data_18934 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18934 _Entry.Title ; Binary complex of African Swine Fever Virus Pol X with MgdGTP ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-01-03 _Entry.Accession_date 2013-01-03 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _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 Wen-Jin Wu . . . 18934 2 Mei-I Su . . . 18934 3 Ming-Daw Tsai . . . 18934 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' . 18934 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DNA polymerase' . 18934 NMR . 18934 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18934 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 796 18934 '15N chemical shifts' 180 18934 '1H chemical shifts' 1381 18934 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2014-05-05 2013-01-03 update BMRB 'update entry citation' 18934 1 . . 2014-03-31 2013-01-03 original author 'original release' 18934 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 18933 'African Swine Fever Virus Pol X (free form)' 18934 BMRB 18935 'Ternary complex of African Swine Fever Virus Pol X with MgdGTP and DNA' 18934 PDB 2M2T 'African Swine Fever Virus Pol X (free form)' 18934 PDB 2M2U 'Binary complex of African Swine Fever Virus Pol X with MgdGTP' 18934 PDB 2M2V 'Ternary complex of African Swine Fever Virus Pol X with DNA and MgdGTP; substrates-bound protein-only structure' 18934 PDB 2M2W 'Ternary complex of African Swine Fever Virus Pol X with DNA and MgdGTP; coordinates of substrates and protein' 18934 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18934 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24617852 _Citation.Full_citation . _Citation.Title 'How a low-fidelity DNA polymerase chooses non-watson-crick from watson-crick incorporation.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full 'Journal of the American Chemical Society' _Citation.Journal_volume 136 _Citation.Journal_issue 13 _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 4927 _Citation.Page_last 4937 _Citation.Year 2014 _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 Wen-Jin Wu . . . 18934 1 2 Mei-I Su . . . 18934 1 3 Jian-Li Wu . . . 18934 1 4 Sandeep Kumar . . . 18934 1 5 Liang-Hin Lim . . . 18934 1 6 'Chun-Wei Eric' Wang . . . 18934 1 7 Frank Nelissen . H.T. . 18934 1 8 'Ming-Chuan Chad' Chen . . . 18934 1 9 Jurgen Doreleijers . F. . 18934 1 10 Sybren Wijmenga . S. . 18934 1 11 Ming-Daw Tsai . . . 18934 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18934 _Assembly.ID 1 _Assembly.Name 'Binary complex of African Swine Fever Virus Pol X with MgdGTP' _Assembly.BMRB_code . _Assembly.Number_of_components 4 _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 'African Swine Fever Virus Pol X' 1 $entity_1 A . yes native no no . . . 18934 1 2 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE 3 $entity_DGT B . no native no no . . . 18934 1 3 MG2_1 2 $entity_MG C . no native no no . . . 18934 1 4 MG2_2 2 $entity_MG D . no native no no . . . 18934 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 18934 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; MLTLIQGKKIVNHLRSRLAF EYNGQLIKILSKNIVAVGSL RREEKMLNDVDLLIIVPEKK LLKHVLPNIRIKGLSFSVKV CGERKCVLFIEWEKKTYQLD LFTALAEEKPYAIFHFTGPV SYLIRIRAALKKKNYKLNQY GLFKNQTLVPLKITTEKELI KELGFTYRIPKKRL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 174 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20351.670 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 18933 . entity . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 2 no BMRB 18935 . entity . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 3 no PDB 1JAJ . "Solution Structure Of Dna Polymerase X From The African Swine Fever Virus" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 4 no PDB 1JQR . "Nmr Structure Of The African Swine Fever Virus Dna Polymerase X" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 5 no PDB 2M2T . "Asfv Pol X Structure" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 6 no PDB 2M2U . "Binary Complex Of African Swine Fever Virus Pol X With Mgdgtp" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 7 no PDB 2M2V . "African Swine Fever Virus Pol X In The Ternary Complex With Mgdgtp And Dna" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 8 no PDB 2M2W . "Ternary Complex Of Asfv Pol X With Dna And Mgdgtp" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 9 no EMBL CAN10196 . "DNA polymerase beta-like protein [African swine fever virus Benin 97/1]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 10 no EMBL CAN10446 . "DNA polymerase beta-like protein [African swine fever virus OURT 88/3]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 11 no EMBL CBH29197 . "BA71V-O174L [African swine fever virus E75]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 12 no GB AAA65326 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 13 no GB AIY22288 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 14 no GB AIY22446 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 15 no GB AKO62778 . "pO174L [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 16 no PRF 2113434DC . "DNA polymerase beta-like protein" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 17 no REF NP_042790 . "DNA polymerase beta-like protein [African swine fever virus]" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 1 18 no SP P0C984 . "RecName: Full=Repair DNA polymerase X; Short=Pol X [African swine fever virus Malawi LIL 20/1]" . . . . . 100.00 174 98.85 99.43 1.25e-117 . . . . 18934 1 19 no SP P42494 . "RecName: Full=Repair DNA polymerase X; Short=Pol X" . . . . . 100.00 174 100.00 100.00 1.99e-119 . . . . 18934 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 . MET . 18934 1 2 . LEU . 18934 1 3 . THR . 18934 1 4 . LEU . 18934 1 5 . ILE . 18934 1 6 . GLN . 18934 1 7 . GLY . 18934 1 8 . LYS . 18934 1 9 . LYS . 18934 1 10 . ILE . 18934 1 11 . VAL . 18934 1 12 . ASN . 18934 1 13 . HIS . 18934 1 14 . LEU . 18934 1 15 . ARG . 18934 1 16 . SER . 18934 1 17 . ARG . 18934 1 18 . LEU . 18934 1 19 . ALA . 18934 1 20 . PHE . 18934 1 21 . GLU . 18934 1 22 . TYR . 18934 1 23 . ASN . 18934 1 24 . GLY . 18934 1 25 . GLN . 18934 1 26 . LEU . 18934 1 27 . ILE . 18934 1 28 . LYS . 18934 1 29 . ILE . 18934 1 30 . LEU . 18934 1 31 . SER . 18934 1 32 . LYS . 18934 1 33 . ASN . 18934 1 34 . ILE . 18934 1 35 . VAL . 18934 1 36 . ALA . 18934 1 37 . VAL . 18934 1 38 . GLY . 18934 1 39 . SER . 18934 1 40 . LEU . 18934 1 41 . ARG . 18934 1 42 . ARG . 18934 1 43 . GLU . 18934 1 44 . GLU . 18934 1 45 . LYS . 18934 1 46 . MET . 18934 1 47 . LEU . 18934 1 48 . ASN . 18934 1 49 . ASP . 18934 1 50 . VAL . 18934 1 51 . ASP . 18934 1 52 . LEU . 18934 1 53 . LEU . 18934 1 54 . ILE . 18934 1 55 . ILE . 18934 1 56 . VAL . 18934 1 57 . PRO . 18934 1 58 . GLU . 18934 1 59 . LYS . 18934 1 60 . LYS . 18934 1 61 . LEU . 18934 1 62 . LEU . 18934 1 63 . LYS . 18934 1 64 . HIS . 18934 1 65 . VAL . 18934 1 66 . LEU . 18934 1 67 . PRO . 18934 1 68 . ASN . 18934 1 69 . ILE . 18934 1 70 . ARG . 18934 1 71 . ILE . 18934 1 72 . LYS . 18934 1 73 . GLY . 18934 1 74 . LEU . 18934 1 75 . SER . 18934 1 76 . PHE . 18934 1 77 . SER . 18934 1 78 . VAL . 18934 1 79 . LYS . 18934 1 80 . VAL . 18934 1 81 . CYS . 18934 1 82 . GLY . 18934 1 83 . GLU . 18934 1 84 . ARG . 18934 1 85 . LYS . 18934 1 86 . CYS . 18934 1 87 . VAL . 18934 1 88 . LEU . 18934 1 89 . PHE . 18934 1 90 . ILE . 18934 1 91 . GLU . 18934 1 92 . TRP . 18934 1 93 . GLU . 18934 1 94 . LYS . 18934 1 95 . LYS . 18934 1 96 . THR . 18934 1 97 . TYR . 18934 1 98 . GLN . 18934 1 99 . LEU . 18934 1 100 . ASP . 18934 1 101 . LEU . 18934 1 102 . PHE . 18934 1 103 . THR . 18934 1 104 . ALA . 18934 1 105 . LEU . 18934 1 106 . ALA . 18934 1 107 . GLU . 18934 1 108 . GLU . 18934 1 109 . LYS . 18934 1 110 . PRO . 18934 1 111 . TYR . 18934 1 112 . ALA . 18934 1 113 . ILE . 18934 1 114 . PHE . 18934 1 115 . HIS . 18934 1 116 . PHE . 18934 1 117 . THR . 18934 1 118 . GLY . 18934 1 119 . PRO . 18934 1 120 . VAL . 18934 1 121 . SER . 18934 1 122 . TYR . 18934 1 123 . LEU . 18934 1 124 . ILE . 18934 1 125 . ARG . 18934 1 126 . ILE . 18934 1 127 . ARG . 18934 1 128 . ALA . 18934 1 129 . ALA . 18934 1 130 . LEU . 18934 1 131 . LYS . 18934 1 132 . LYS . 18934 1 133 . LYS . 18934 1 134 . ASN . 18934 1 135 . TYR . 18934 1 136 . LYS . 18934 1 137 . LEU . 18934 1 138 . ASN . 18934 1 139 . GLN . 18934 1 140 . TYR . 18934 1 141 . GLY . 18934 1 142 . LEU . 18934 1 143 . PHE . 18934 1 144 . LYS . 18934 1 145 . ASN . 18934 1 146 . GLN . 18934 1 147 . THR . 18934 1 148 . LEU . 18934 1 149 . VAL . 18934 1 150 . PRO . 18934 1 151 . LEU . 18934 1 152 . LYS . 18934 1 153 . ILE . 18934 1 154 . THR . 18934 1 155 . THR . 18934 1 156 . GLU . 18934 1 157 . LYS . 18934 1 158 . GLU . 18934 1 159 . LEU . 18934 1 160 . ILE . 18934 1 161 . LYS . 18934 1 162 . GLU . 18934 1 163 . LEU . 18934 1 164 . GLY . 18934 1 165 . PHE . 18934 1 166 . THR . 18934 1 167 . TYR . 18934 1 168 . ARG . 18934 1 169 . ILE . 18934 1 170 . PRO . 18934 1 171 . LYS . 18934 1 172 . LYS . 18934 1 173 . ARG . 18934 1 174 . LEU . 18934 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 18934 1 . LEU 2 2 18934 1 . THR 3 3 18934 1 . LEU 4 4 18934 1 . ILE 5 5 18934 1 . GLN 6 6 18934 1 . GLY 7 7 18934 1 . LYS 8 8 18934 1 . LYS 9 9 18934 1 . ILE 10 10 18934 1 . VAL 11 11 18934 1 . ASN 12 12 18934 1 . HIS 13 13 18934 1 . LEU 14 14 18934 1 . ARG 15 15 18934 1 . SER 16 16 18934 1 . ARG 17 17 18934 1 . LEU 18 18 18934 1 . ALA 19 19 18934 1 . PHE 20 20 18934 1 . GLU 21 21 18934 1 . TYR 22 22 18934 1 . ASN 23 23 18934 1 . GLY 24 24 18934 1 . GLN 25 25 18934 1 . LEU 26 26 18934 1 . ILE 27 27 18934 1 . LYS 28 28 18934 1 . ILE 29 29 18934 1 . LEU 30 30 18934 1 . SER 31 31 18934 1 . LYS 32 32 18934 1 . ASN 33 33 18934 1 . ILE 34 34 18934 1 . VAL 35 35 18934 1 . ALA 36 36 18934 1 . VAL 37 37 18934 1 . GLY 38 38 18934 1 . SER 39 39 18934 1 . LEU 40 40 18934 1 . ARG 41 41 18934 1 . ARG 42 42 18934 1 . GLU 43 43 18934 1 . GLU 44 44 18934 1 . LYS 45 45 18934 1 . MET 46 46 18934 1 . LEU 47 47 18934 1 . ASN 48 48 18934 1 . ASP 49 49 18934 1 . VAL 50 50 18934 1 . ASP 51 51 18934 1 . LEU 52 52 18934 1 . LEU 53 53 18934 1 . ILE 54 54 18934 1 . ILE 55 55 18934 1 . VAL 56 56 18934 1 . PRO 57 57 18934 1 . GLU 58 58 18934 1 . LYS 59 59 18934 1 . LYS 60 60 18934 1 . LEU 61 61 18934 1 . LEU 62 62 18934 1 . LYS 63 63 18934 1 . HIS 64 64 18934 1 . VAL 65 65 18934 1 . LEU 66 66 18934 1 . PRO 67 67 18934 1 . ASN 68 68 18934 1 . ILE 69 69 18934 1 . ARG 70 70 18934 1 . ILE 71 71 18934 1 . LYS 72 72 18934 1 . GLY 73 73 18934 1 . LEU 74 74 18934 1 . SER 75 75 18934 1 . PHE 76 76 18934 1 . SER 77 77 18934 1 . VAL 78 78 18934 1 . LYS 79 79 18934 1 . VAL 80 80 18934 1 . CYS 81 81 18934 1 . GLY 82 82 18934 1 . GLU 83 83 18934 1 . ARG 84 84 18934 1 . LYS 85 85 18934 1 . CYS 86 86 18934 1 . VAL 87 87 18934 1 . LEU 88 88 18934 1 . PHE 89 89 18934 1 . ILE 90 90 18934 1 . GLU 91 91 18934 1 . TRP 92 92 18934 1 . GLU 93 93 18934 1 . LYS 94 94 18934 1 . LYS 95 95 18934 1 . THR 96 96 18934 1 . TYR 97 97 18934 1 . GLN 98 98 18934 1 . LEU 99 99 18934 1 . ASP 100 100 18934 1 . LEU 101 101 18934 1 . PHE 102 102 18934 1 . THR 103 103 18934 1 . ALA 104 104 18934 1 . LEU 105 105 18934 1 . ALA 106 106 18934 1 . GLU 107 107 18934 1 . GLU 108 108 18934 1 . LYS 109 109 18934 1 . PRO 110 110 18934 1 . TYR 111 111 18934 1 . ALA 112 112 18934 1 . ILE 113 113 18934 1 . PHE 114 114 18934 1 . HIS 115 115 18934 1 . PHE 116 116 18934 1 . THR 117 117 18934 1 . GLY 118 118 18934 1 . PRO 119 119 18934 1 . VAL 120 120 18934 1 . SER 121 121 18934 1 . TYR 122 122 18934 1 . LEU 123 123 18934 1 . ILE 124 124 18934 1 . ARG 125 125 18934 1 . ILE 126 126 18934 1 . ARG 127 127 18934 1 . ALA 128 128 18934 1 . ALA 129 129 18934 1 . LEU 130 130 18934 1 . LYS 131 131 18934 1 . LYS 132 132 18934 1 . LYS 133 133 18934 1 . ASN 134 134 18934 1 . TYR 135 135 18934 1 . LYS 136 136 18934 1 . LEU 137 137 18934 1 . ASN 138 138 18934 1 . GLN 139 139 18934 1 . TYR 140 140 18934 1 . GLY 141 141 18934 1 . LEU 142 142 18934 1 . PHE 143 143 18934 1 . LYS 144 144 18934 1 . ASN 145 145 18934 1 . GLN 146 146 18934 1 . THR 147 147 18934 1 . LEU 148 148 18934 1 . VAL 149 149 18934 1 . PRO 150 150 18934 1 . LEU 151 151 18934 1 . LYS 152 152 18934 1 . ILE 153 153 18934 1 . THR 154 154 18934 1 . THR 155 155 18934 1 . GLU 156 156 18934 1 . LYS 157 157 18934 1 . GLU 158 158 18934 1 . LEU 159 159 18934 1 . ILE 160 160 18934 1 . LYS 161 161 18934 1 . GLU 162 162 18934 1 . LEU 163 163 18934 1 . GLY 164 164 18934 1 . PHE 165 165 18934 1 . THR 166 166 18934 1 . TYR 167 167 18934 1 . ARG 168 168 18934 1 . ILE 169 169 18934 1 . PRO 170 170 18934 1 . LYS 171 171 18934 1 . LYS 172 172 18934 1 . ARG 173 173 18934 1 . LEU 174 174 18934 1 stop_ save_ save_entity_MG _Entity.Sf_category entity _Entity.Sf_framecode entity_MG _Entity.Entry_ID 18934 _Entity.ID 2 _Entity.BMRB_code MG _Entity.Name entity_MG _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID MG _Entity.Nonpolymer_comp_label $chem_comp_MG _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 24.305 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'MAGNESIUM ION' BMRB 18934 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'MAGNESIUM ION' BMRB 18934 2 MG 'Three letter code' 18934 2 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 1 MG $chem_comp_MG 18934 2 stop_ loop_ _Entity_atom_list.ID _Entity_atom_list.Comp_index_ID _Entity_atom_list.Comp_ID _Entity_atom_list.Atom_ID _Entity_atom_list.Entry_ID _Entity_atom_list.Entity_ID 1 1 MG MG 18934 2 stop_ save_ save_entity_DGT _Entity.Sf_category entity _Entity.Sf_framecode entity_DGT _Entity.Entry_ID 18934 _Entity.ID 3 _Entity.BMRB_code DGT _Entity.Name entity_DGT _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID DGT _Entity.Nonpolymer_comp_label $chem_comp_DGT _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 507.181 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE BMRB 18934 3 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE BMRB 18934 3 DGT 'Three letter code' 18934 3 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 1 DGT $chem_comp_DGT 18934 3 stop_ loop_ _Entity_atom_list.ID _Entity_atom_list.Comp_index_ID _Entity_atom_list.Comp_ID _Entity_atom_list.Atom_ID _Entity_atom_list.Entry_ID _Entity_atom_list.Entity_ID 1 1 DGT C1' 18934 3 2 1 DGT C2 18934 3 3 1 DGT C2' 18934 3 4 1 DGT C3' 18934 3 5 1 DGT C4 18934 3 6 1 DGT C4' 18934 3 7 1 DGT C5 18934 3 8 1 DGT C5' 18934 3 9 1 DGT C6 18934 3 10 1 DGT C8 18934 3 11 1 DGT H1' 18934 3 12 1 DGT H16 18934 3 13 1 DGT H2' 18934 3 14 1 DGT H2'A 18934 3 15 1 DGT H3' 18934 3 16 1 DGT H4' 18934 3 17 1 DGT H5' 18934 3 18 1 DGT H5'A 18934 3 19 1 DGT H8 18934 3 20 1 DGT HN2 18934 3 21 1 DGT HN2A 18934 3 22 1 DGT HO1A 18934 3 23 1 DGT HO1B 18934 3 24 1 DGT HO1G 18934 3 25 1 DGT HO2G 18934 3 26 1 DGT HO3' 18934 3 27 1 DGT N1 18934 3 28 1 DGT N2 18934 3 29 1 DGT N3 18934 3 30 1 DGT N7 18934 3 31 1 DGT N9 18934 3 32 1 DGT O1A 18934 3 33 1 DGT O1B 18934 3 34 1 DGT O1G 18934 3 35 1 DGT O2A 18934 3 36 1 DGT O2B 18934 3 37 1 DGT O2G 18934 3 38 1 DGT O3' 18934 3 39 1 DGT O3A 18934 3 40 1 DGT O3B 18934 3 41 1 DGT O3G 18934 3 42 1 DGT O4' 18934 3 43 1 DGT O5' 18934 3 44 1 DGT O6 18934 3 45 1 DGT PA 18934 3 46 1 DGT PB 18934 3 47 1 DGT PG 18934 3 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 18934 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10497 organism . 'African Swine Fever Virus' 'African Swine Fever Virus' . . Viruses . Asfivirus 'African Swine Fever Virus' . . . . . . . . . . . . . . . . . . . . . 18934 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 18934 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET-17b . . . . . . 18934 1 2 2 $entity_MG . 'obtained from a vendor' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18934 1 3 3 $entity_DGT . 'obtained from a vendor' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18934 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_MG _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_MG _Chem_comp.Entry_ID 18934 _Chem_comp.ID MG _Chem_comp.Provenance PDB _Chem_comp.Name 'MAGNESIUM ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code MG _Chem_comp.PDB_code MG _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code MG _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Mg/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Mg _Chem_comp.Formula_weight 24.305 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site PDBJ _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Mg/q+2 InChI InChI 1.03 18934 MG JLVVSXFLKOJNIY-UHFFFAOYSA-N InChIKey InChI 1.03 18934 MG [Mg++] SMILES CACTVS 3.341 18934 MG [Mg++] SMILES_CANONICAL CACTVS 3.341 18934 MG [Mg+2] SMILES ACDLabs 10.04 18934 MG [Mg+2] SMILES 'OpenEye OEToolkits' 1.5.0 18934 MG [Mg+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 18934 MG stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID magnesium 'SYSTEMATIC NAME' ACDLabs 10.04 18934 MG 'magnesium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 18934 MG stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID MG MG MG MG . MG . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 18934 MG stop_ save_ save_chem_comp_DGT _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_DGT _Chem_comp.Entry_ID 18934 _Chem_comp.ID DGT _Chem_comp.Provenance PDB _Chem_comp.Name 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code DGT _Chem_comp.PDB_code DGT _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code DGT _Chem_comp.Number_atoms_all 47 _Chem_comp.Number_atoms_nh 31 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/C10H16N5O13P3/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(26-6)2-25-30(21,22)28-31(23,24)27-29(18,19)20/h3-6,16H,1-2H2,(H,21,22)(H,23,24)(H2,18,19,20)(H3,11,13,14,17)/t4-,5+,6+/m0/s1 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic yes _Chem_comp.Formula 'C10 H16 N5 O13 P3' _Chem_comp.Formula_weight 507.181 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details Corina _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 1HK8 _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID c1nc2c(n1C3CC(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)N=C(NC2=O)N SMILES 'OpenEye OEToolkits' 1.5.0 18934 DGT c1nc2c(n1[C@H]3C[C@@H]([C@H](O3)CO[P@@](=O)(O)O[P@@](=O)(O)OP(=O)(O)O)O)N=C(NC2=O)N SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 18934 DGT HAAZLUGHYHWQIW-KVQBGUIXSA-N InChIKey InChI 1.03 18934 DGT InChI=1S/C10H16N5O13P3/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(26-6)2-25-30(21,22)28-31(23,24)27-29(18,19)20/h3-6,16H,1-2H2,(H,21,22)(H,23,24)(H2,18,19,20)(H3,11,13,14,17)/t4-,5+,6+/m0/s1 InChI InChI 1.03 18934 DGT NC1=Nc2n(cnc2C(=O)N1)[C@H]3C[C@H](O)[C@@H](CO[P@](O)(=O)O[P@](O)(=O)O[P](O)(O)=O)O3 SMILES_CANONICAL CACTVS 3.341 18934 DGT NC1=Nc2n(cnc2C(=O)N1)[CH]3C[CH](O)[CH](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)O3 SMILES CACTVS 3.341 18934 DGT O=P(O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c2N=C(N)NC1=O)CC3O SMILES ACDLabs 10.04 18934 DGT stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID '2'-deoxyguanosine 5'-(tetrahydrogen triphosphate)' 'SYSTEMATIC NAME' ACDLabs 10.04 18934 DGT '[[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 18934 DGT stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID PG PG PG PG . P . . N 0 . . . 1 no no . . . . 32.266 . 78.871 . 76.218 . -6.722 1.739 -0.798 1 . 18934 DGT O1G O1G O1G O1G . O . . N 0 . . . 1 no no . . . . 31.153 . 79.985 . 76.366 . -7.321 0.703 -1.876 2 . 18934 DGT O2G O2G O2G O2G . O . . N 0 . . . 1 no no . . . . 33.145 . 78.551 . 77.503 . -6.586 3.195 -1.471 3 . 18934 DGT O3G O3G O3G O3G . O . . N 0 . . . 1 no no . . . . 31.600 . 77.506 . 75.758 . -7.629 1.817 0.368 4 . 18934 DGT O3B O3B O3B O3B . O . . N 0 . . . 1 no no . . . . 33.211 . 79.424 . 75.063 . -5.271 1.232 -0.317 5 . 18934 DGT PB PB PB PB . P . . S 0 . . . 1 no no . . . . 34.610 . 78.768 . 74.667 . -4.764 0.060 0.662 6 . 18934 DGT O1B O1B O1B O1B . O . . N 0 . . . 1 no no . . . . 34.597 . 77.173 . 74.731 . -5.022 0.489 2.192 7 . 18934 DGT O2B O2B O2B O2B . O . . N 0 . . . 1 no no . . . . 34.904 . 79.361 . 73.231 . -5.508 -1.185 0.368 8 . 18934 DGT O3A O3A O3A O3A . O . . N 0 . . . 1 no no . . . . 35.682 . 79.283 . 75.741 . -3.190 -0.189 0.432 9 . 18934 DGT PA PA PA PA . P . . R 0 . . . 1 no no . . . . 36.293 . 80.771 . 75.717 . -2.192 -1.411 0.751 10 . 18934 DGT O1A O1A O1A O1A . O . . N 0 . . . 1 no no . . . . 36.826 . 81.090 . 77.182 . -1.875 -1.448 2.329 11 . 18934 DGT O2A O2A O2A O2A . O . . N 0 . . . 1 no no . . . . 37.451 . 80.843 . 74.624 . -2.828 -2.685 0.346 12 . 18934 DGT O5' O5' O5' O5' . O . . N 0 . . . 1 no no . . . . 35.068 . 81.728 . 75.281 . -0.821 -1.212 -0.068 13 . 18934 DGT C5' C5' C5' C5' . C . . N 0 . . . 1 no no . . . . 34.201 . 82.274 . 76.270 . 0.228 -2.183 -0.079 14 . 18934 DGT C4' C4' C4' C4' . C . . R 0 . . . 1 no no . . . . 33.306 . 83.380 . 75.714 . 1.380 -1.680 -0.950 15 . 18934 DGT O4' O4' O4' O4' . O . . N 0 . . . 1 no no . . . . 34.029 . 84.594 . 75.478 . 2.030 -0.550 -0.330 16 . 18934 DGT C3' C3' C3' C3' . C . . S 0 . . . 1 no no . . . . 32.567 . 83.020 . 74.433 . 2.503 -2.744 -1.038 17 . 18934 DGT O3' O3' O3' O3' . O . . N 0 . . . 1 no no . . . . 31.175 . 82.994 . 74.711 . 2.243 -3.674 -2.091 18 . 18934 DGT C2' C2' C2' C2' . C . . N 0 . . . 1 no no . . . . 32.894 . 84.114 . 73.428 . 3.746 -1.879 -1.358 19 . 18934 DGT C1' C1' C1' C1' . C . . R 0 . . . 1 no no . . . . 33.803 . 85.105 . 74.157 . 3.348 -0.460 -0.898 20 . 18934 DGT N9 N9 N9 N9 . N . . N 0 . . . 1 yes no . . . . 35.124 . 85.396 . 73.513 . 4.294 0.020 0.112 21 . 18934 DGT C8 C8 C8 C8 . C . . N 0 . . . 1 yes no . . . . 35.944 . 84.585 . 72.778 . 4.145 -0.070 1.466 22 . 18934 DGT N7 N7 N7 N7 . N . . N 0 . . . 1 yes no . . . . 37.088 . 85.251 . 72.377 . 5.176 0.458 2.059 23 . 18934 DGT C5 C5 C5 C5 . C . . N 0 . . . 1 yes no . . . . 37.028 . 86.519 . 72.862 . 6.045 0.916 1.125 24 . 18934 DGT C6 C6 C6 C6 . C . . N 0 . . . 1 no no . . . . 37.806 . 87.806 . 72.885 . 7.301 1.565 1.183 25 . 18934 DGT O6 O6 O6 O6 . O . . N 0 . . . 1 no no . . . . 38.913 . 87.924 . 72.312 . 7.822 1.824 2.254 26 . 18934 DGT N1 N1 N1 N1 . N . . N 0 . . . 1 no no . . . . 37.324 . 88.886 . 73.533 . 7.908 1.891 0.021 27 . 18934 DGT C2 C2 C2 C2 . C . . N 0 . . . 1 no no . . . . 36.144 . 88.892 . 74.184 . 7.317 1.597 -1.172 28 . 18934 DGT N2 N2 N2 N2 . N . . N 0 . . . 1 no no . . . . 35.763 . 90.040 . 74.793 . 7.957 1.939 -2.336 29 . 18934 DGT N3 N3 N3 N3 . N . . N 0 . . . 1 no no . . . . 35.343 . 87.792 . 74.245 . 6.151 0.994 -1.238 30 . 18934 DGT C4 C4 C4 C4 . C . . N 0 . . . 1 yes no . . . . 35.765 . 86.571 . 73.584 . 5.492 0.636 -0.130 31 . 18934 DGT HO1G HO1G HO1G HO1G . H . . N 0 . . . 0 no no . . . . 30.930 . 80.090 . 77.283 . -6.777 0.602 -2.669 32 . 18934 DGT HO2G HO2G HO2G HO2G . H . . N 0 . . . 0 no no . . . . 34.060 . 78.487 . 77.254 . -7.424 3.563 -1.785 33 . 18934 DGT HO1B HO1B HO1B HO1B . H . . N 0 . . . 0 no no . . . . 34.594 . 76.820 . 73.849 . -4.564 1.299 2.456 34 . 18934 DGT HO1A HO1A HO1A HO1A . H . . N 0 . . . 0 no no . . . . 37.774 . 81.154 . 77.168 . -1.457 -0.644 2.665 35 . 18934 DGT H5' H5' H5' H5' . H . . N 0 . . . 1 no no . . . . 33.560 . 81.468 . 76.656 . 0.585 -2.344 0.939 36 . 18934 DGT H5'A H5'A H5'A H5'A . H . . N 0 . . . 0 no no . . . . 34.827 . 82.713 . 77.061 . -0.151 -3.122 -0.483 37 . 18934 DGT H4' H4' H4' H4' . H . . N 0 . . . 1 no no . . . . 32.558 . 83.520 . 76.508 . 1.021 -1.418 -1.945 38 . 18934 DGT H3' H3' H3' H3' . H . . N 0 . . . 1 no no . . . . 32.861 . 82.036 . 74.038 . 2.624 -3.262 -0.086 39 . 18934 DGT HO3' HO3' HO3' HO3' . H . . N 0 . . . 0 no no . . . . 31.039 . 82.988 . 75.651 . 2.918 -4.360 -2.186 40 . 18934 DGT H2' H2' H2' H2' . H . . N 0 . . . 1 no no . . . . 33.406 . 83.692 . 72.551 . 4.613 -2.234 -0.800 41 . 18934 DGT H2'A H2'A H2'A H2'A . H . . N 0 . . . 0 no no . . . . 31.981 . 84.605 . 73.061 . 3.951 -1.888 -2.429 42 . 18934 DGT H1' H1' H1' H1' . H . . N 0 . . . 1 no no . . . . 33.273 . 86.069 . 74.140 . 3.338 0.218 -1.752 43 . 18934 DGT H8 H8 H8 H8 . H . . N 0 . . . 1 no no . . . . 35.726 . 83.554 . 72.541 . 3.298 -0.513 1.969 44 . 18934 DGT HN2 HN2 HN2 HN2 . H . . N 0 . . . 1 no no . . . . 36.453 . 90.751 . 74.659 . 8.818 2.385 -2.303 45 . 18934 DGT HN2A HN2A HN2A HN2A . H . . N 0 . . . 0 no no . . . . 34.912 . 90.160 . 75.304 . 7.549 1.737 -3.192 46 . 18934 DGT H16 H16 H16 H16 . H . . N 0 . . . 1 no no . . . . 37.869 . 89.724 . 73.530 . 8.770 2.336 0.035 47 . 18934 DGT stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING PG O1G no N 1 . 18934 DGT 2 . SING PG O2G no N 2 . 18934 DGT 3 . SING O1G HO1G no N 3 . 18934 DGT 4 . SING O2G HO2G no N 4 . 18934 DGT 5 . DOUB O3G PG no N 5 . 18934 DGT 6 . SING O3B PG no N 6 . 18934 DGT 7 . SING PB O3B no N 7 . 18934 DGT 8 . SING PB O1B no N 8 . 18934 DGT 9 . SING PB O3A no N 9 . 18934 DGT 10 . SING O1B HO1B no N 10 . 18934 DGT 11 . DOUB O2B PB no N 11 . 18934 DGT 12 . SING PA O3A no N 12 . 18934 DGT 13 . SING PA O1A no N 13 . 18934 DGT 14 . SING O1A HO1A no N 14 . 18934 DGT 15 . DOUB O2A PA no N 15 . 18934 DGT 16 . SING O5' PA no N 16 . 18934 DGT 17 . SING O5' C5' no N 17 . 18934 DGT 18 . SING C5' H5' no N 18 . 18934 DGT 19 . SING C5' H5'A no N 19 . 18934 DGT 20 . SING C4' C5' no N 20 . 18934 DGT 21 . SING C4' H4' no N 21 . 18934 DGT 22 . SING O4' C4' no N 22 . 18934 DGT 23 . SING C3' C4' no N 23 . 18934 DGT 24 . SING C3' O3' no N 24 . 18934 DGT 25 . SING C3' H3' no N 25 . 18934 DGT 26 . SING O3' HO3' no N 26 . 18934 DGT 27 . SING C2' C3' no N 27 . 18934 DGT 28 . SING C2' C1' no N 28 . 18934 DGT 29 . SING C2' H2' no N 29 . 18934 DGT 30 . SING C2' H2'A no N 30 . 18934 DGT 31 . SING C1' O4' no N 31 . 18934 DGT 32 . SING C1' H1' no N 32 . 18934 DGT 33 . SING N9 C1' no N 33 . 18934 DGT 34 . SING N9 C4 yes N 34 . 18934 DGT 35 . SING C8 N9 yes N 35 . 18934 DGT 36 . SING C8 H8 no N 36 . 18934 DGT 37 . DOUB N7 C8 yes N 37 . 18934 DGT 38 . SING N7 C5 yes N 38 . 18934 DGT 39 . SING C5 C6 no N 39 . 18934 DGT 40 . DOUB C5 C4 yes N 40 . 18934 DGT 41 . SING C6 N1 no N 41 . 18934 DGT 42 . DOUB O6 C6 no N 42 . 18934 DGT 43 . SING N1 C2 no N 43 . 18934 DGT 44 . DOUB C2 N3 no N 44 . 18934 DGT 45 . SING C2 N2 no N 45 . 18934 DGT 46 . SING N2 HN2 no N 46 . 18934 DGT 47 . SING N2 HN2A no N 47 . 18934 DGT 48 . SING C4 N3 no N 48 . 18934 DGT 49 . SING N1 H16 no N 49 . 18934 DGT stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18934 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 'African Swine Fever Virus Pol X' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 0.5 . . mM . . . . 18934 1 2 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE '[U-100% 13C; U-100% 15N]' . . 3 $entity_DGT . . 5 . . mM . . . . 18934 1 3 MG2 'natural abundance' . . 2 $entity_MG . . 10 . . mM . . . . 18934 1 4 DTT '[U-100% 2H]' . . . . . . 10 . . mM . . . . 18934 1 5 Borate 'natural abundance' . . . . . . 50 . . mM . . . . 18934 1 6 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 18934 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18934 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 'African Swine Fever Virus Pol X' '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 0.5 . . mM . . . . 18934 2 2 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE 'natural abundance' . . 3 $entity_DGT . . 5 . . mM . . . . 18934 2 3 MG2 'natural abundance' . . 2 $entity_MG . . 10 . . mM . . . . 18934 2 4 DTT '[U-100% 2H]' . . . . . . 10 . . mM . . . . 18934 2 5 Borate 'natural abundance' . . . . . . 50 . . mM . . . . 18934 2 6 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 18934 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 18934 _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' 100 . mM 18934 1 pH 6.5 . pH 18934 1 pressure 1 . atm 18934 1 temperature 293 . K 18934 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 18934 _Software.ID 1 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 18934 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18934 1 stop_ save_ save_Haddock _Software.Sf_category software _Software.Sf_framecode Haddock _Software.Entry_ID 18934 _Software.ID 2 _Software.Name HADDOCK _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Dr. Alexandre Bonvin' . . 18934 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 18934 2 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 18934 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18934 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 18934 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 18934 _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 . 800 . . . 18934 1 2 spectrometer_2 Bruker Avance . 850 . . . 18934 1 3 spectrometer_3 Bruker Avance . 600 . . . 18934 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 18934 _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 . . . . . . . . . . . . . . . . . . . . . 18934 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 1 3 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 1 4 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 1 5 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 1 8 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 1 9 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 18934 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 18934 _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 . . . . . . . . . 18934 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18934 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18934 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 18934 _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' . . . 18934 1 2 '2D 1H-13C HSQC' . . . 18934 1 3 '3D HNCO' . . . 18934 1 4 '3D HNCA' . . . 18934 1 5 '3D HNCACB' . . . 18934 1 6 '3D HCCH-TOCSY' . . . 18934 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 1 1 MET HA H 1 4.460 0.020 . 1 . . . A 1 MET HA . 18934 1 2 . 1 1 1 1 MET HB2 H 1 1.984 0.020 . 2 . . . A 1 MET HB2 . 18934 1 3 . 1 1 1 1 MET HB3 H 1 2.138 0.020 . 2 . . . A 1 MET HB3 . 18934 1 4 . 1 1 1 1 MET HG2 H 1 2.690 0.020 . 2 . . . A 1 MET HG2 . 18934 1 5 . 1 1 1 1 MET HG3 H 1 2.545 0.020 . 2 . . . A 1 MET HG3 . 18934 1 6 . 1 1 1 1 MET CA C 13 52.626 0.3 . 1 . . . A 1 MET CA . 18934 1 7 . 1 1 1 1 MET CB C 13 32.017 0.3 . 1 . . . A 1 MET CB . 18934 1 8 . 1 1 1 1 MET CG C 13 28.950 0.3 . 1 . . . A 1 MET CG . 18934 1 9 . 1 1 2 2 LEU H H 1 9.067 0.020 . 1 . . . A 2 LEU H . 18934 1 10 . 1 1 2 2 LEU HA H 1 4.872 0.020 . 1 . . . A 2 LEU HA . 18934 1 11 . 1 1 2 2 LEU HB2 H 1 1.659 0.020 . 2 . . . A 2 LEU HB2 . 18934 1 12 . 1 1 2 2 LEU HB3 H 1 1.533 0.020 . 2 . . . A 2 LEU HB3 . 18934 1 13 . 1 1 2 2 LEU HG H 1 1.383 0.020 . 1 . . . A 2 LEU HG . 18934 1 14 . 1 1 2 2 LEU HD11 H 1 0.320 0.020 . 1 . . . A 2 LEU HD11 . 18934 1 15 . 1 1 2 2 LEU HD12 H 1 0.320 0.020 . 1 . . . A 2 LEU HD12 . 18934 1 16 . 1 1 2 2 LEU HD13 H 1 0.320 0.020 . 1 . . . A 2 LEU HD13 . 18934 1 17 . 1 1 2 2 LEU HD21 H 1 0.360 0.020 . 1 . . . A 2 LEU HD21 . 18934 1 18 . 1 1 2 2 LEU HD22 H 1 0.360 0.020 . 1 . . . A 2 LEU HD22 . 18934 1 19 . 1 1 2 2 LEU HD23 H 1 0.360 0.020 . 1 . . . A 2 LEU HD23 . 18934 1 20 . 1 1 2 2 LEU C C 13 171.175 0.3 . 1 . . . A 2 LEU C . 18934 1 21 . 1 1 2 2 LEU CA C 13 51.936 0.3 . 1 . . . A 2 LEU CA . 18934 1 22 . 1 1 2 2 LEU CB C 13 40.888 0.3 . 1 . . . A 2 LEU CB . 18934 1 23 . 1 1 2 2 LEU CG C 13 24.151 0.3 . 1 . . . A 2 LEU CG . 18934 1 24 . 1 1 2 2 LEU CD1 C 13 23.769 0.3 . 1 . . . A 2 LEU CD1 . 18934 1 25 . 1 1 2 2 LEU CD2 C 13 22.786 0.3 . 1 . . . A 2 LEU CD2 . 18934 1 26 . 1 1 2 2 LEU N N 15 121.190 0.3 . 1 . . . A 2 LEU N . 18934 1 27 . 1 1 3 3 THR H H 1 8.542 0.020 . 1 . . . A 3 THR H . 18934 1 28 . 1 1 3 3 THR HA H 1 4.942 0.020 . 1 . . . A 3 THR HA . 18934 1 29 . 1 1 3 3 THR HB H 1 4.686 0.020 . 1 . . . A 3 THR HB . 18934 1 30 . 1 1 3 3 THR HG21 H 1 1.358 0.020 . 1 . . . A 3 THR HG21 . 18934 1 31 . 1 1 3 3 THR HG22 H 1 1.358 0.020 . 1 . . . A 3 THR HG22 . 18934 1 32 . 1 1 3 3 THR HG23 H 1 1.358 0.020 . 1 . . . A 3 THR HG23 . 18934 1 33 . 1 1 3 3 THR C C 13 172.982 0.3 . 1 . . . A 3 THR C . 18934 1 34 . 1 1 3 3 THR CA C 13 58.402 0.3 . 1 . . . A 3 THR CA . 18934 1 35 . 1 1 3 3 THR CB C 13 68.621 0.3 . 1 . . . A 3 THR CB . 18934 1 36 . 1 1 3 3 THR CG2 C 13 19.533 0.3 . 1 . . . A 3 THR CG2 . 18934 1 37 . 1 1 3 3 THR N N 15 112.138 0.3 . 1 . . . A 3 THR N . 18934 1 38 . 1 1 4 4 LEU H H 1 7.674 0.020 . 1 . . . A 4 LEU H . 18934 1 39 . 1 1 4 4 LEU HA H 1 3.981 0.020 . 1 . . . A 4 LEU HA . 18934 1 40 . 1 1 4 4 LEU HB2 H 1 2.405 0.020 . 2 . . . A 4 LEU HB2 . 18934 1 41 . 1 1 4 4 LEU HB3 H 1 1.659 0.020 . 2 . . . A 4 LEU HB3 . 18934 1 42 . 1 1 4 4 LEU HG H 1 1.365 0.020 . 1 . . . A 4 LEU HG . 18934 1 43 . 1 1 4 4 LEU HD11 H 1 1.143 0.020 . 1 . . . A 4 LEU HD11 . 18934 1 44 . 1 1 4 4 LEU HD12 H 1 1.143 0.020 . 1 . . . A 4 LEU HD12 . 18934 1 45 . 1 1 4 4 LEU HD13 H 1 1.143 0.020 . 1 . . . A 4 LEU HD13 . 18934 1 46 . 1 1 4 4 LEU HD21 H 1 0.775 0.020 . 1 . . . A 4 LEU HD21 . 18934 1 47 . 1 1 4 4 LEU HD22 H 1 0.775 0.020 . 1 . . . A 4 LEU HD22 . 18934 1 48 . 1 1 4 4 LEU HD23 H 1 0.775 0.020 . 1 . . . A 4 LEU HD23 . 18934 1 49 . 1 1 4 4 LEU C C 13 175.540 0.3 . 1 . . . A 4 LEU C . 18934 1 50 . 1 1 4 4 LEU CA C 13 55.906 0.3 . 1 . . . A 4 LEU CA . 18934 1 51 . 1 1 4 4 LEU CB C 13 37.757 0.3 . 1 . . . A 4 LEU CB . 18934 1 52 . 1 1 4 4 LEU CG C 13 24.565 0.3 . 1 . . . A 4 LEU CG . 18934 1 53 . 1 1 4 4 LEU CD1 C 13 21.164 0.3 . 1 . . . A 4 LEU CD1 . 18934 1 54 . 1 1 4 4 LEU CD2 C 13 22.840 0.3 . 1 . . . A 4 LEU CD2 . 18934 1 55 . 1 1 4 4 LEU N N 15 121.822 0.3 . 1 . . . A 4 LEU N . 18934 1 56 . 1 1 5 5 ILE H H 1 7.698 0.020 . 1 . . . A 5 ILE H . 18934 1 57 . 1 1 5 5 ILE HA H 1 3.699 0.020 . 1 . . . A 5 ILE HA . 18934 1 58 . 1 1 5 5 ILE HB H 1 1.778 0.020 . 1 . . . A 5 ILE HB . 18934 1 59 . 1 1 5 5 ILE HG12 H 1 1.550 0.020 . 2 . . . A 5 ILE HG12 . 18934 1 60 . 1 1 5 5 ILE HG13 H 1 1.285 0.020 . 2 . . . A 5 ILE HG13 . 18934 1 61 . 1 1 5 5 ILE HG21 H 1 0.912 0.020 . 1 . . . A 5 ILE HG21 . 18934 1 62 . 1 1 5 5 ILE HG22 H 1 0.912 0.020 . 1 . . . A 5 ILE HG22 . 18934 1 63 . 1 1 5 5 ILE HG23 H 1 0.912 0.020 . 1 . . . A 5 ILE HG23 . 18934 1 64 . 1 1 5 5 ILE HD11 H 1 0.891 0.020 . 1 . . . A 5 ILE HD11 . 18934 1 65 . 1 1 5 5 ILE HD12 H 1 0.891 0.020 . 1 . . . A 5 ILE HD12 . 18934 1 66 . 1 1 5 5 ILE HD13 H 1 0.891 0.020 . 1 . . . A 5 ILE HD13 . 18934 1 67 . 1 1 5 5 ILE C C 13 175.606 0.3 . 1 . . . A 5 ILE C . 18934 1 68 . 1 1 5 5 ILE CA C 13 61.459 0.3 . 1 . . . A 5 ILE CA . 18934 1 69 . 1 1 5 5 ILE CB C 13 35.073 0.3 . 1 . . . A 5 ILE CB . 18934 1 70 . 1 1 5 5 ILE CG1 C 13 26.562 0.3 . 1 . . . A 5 ILE CG1 . 18934 1 71 . 1 1 5 5 ILE CG2 C 13 14.919 0.3 . 1 . . . A 5 ILE CG2 . 18934 1 72 . 1 1 5 5 ILE CD1 C 13 10.284 0.3 . 1 . . . A 5 ILE CD1 . 18934 1 73 . 1 1 5 5 ILE N N 15 114.871 0.3 . 1 . . . A 5 ILE N . 18934 1 74 . 1 1 6 6 GLN H H 1 7.724 0.020 . 1 . . . A 6 GLN H . 18934 1 75 . 1 1 6 6 GLN HA H 1 4.026 0.020 . 1 . . . A 6 GLN HA . 18934 1 76 . 1 1 6 6 GLN HB2 H 1 2.249 0.020 . 2 . . . A 6 GLN HB2 . 18934 1 77 . 1 1 6 6 GLN HB3 H 1 1.793 0.020 . 2 . . . A 6 GLN HB3 . 18934 1 78 . 1 1 6 6 GLN HG2 H 1 2.378 0.020 . 1 . . . A 6 GLN HG2 . 18934 1 79 . 1 1 6 6 GLN HG3 H 1 2.378 0.020 . 1 . . . A 6 GLN HG3 . 18934 1 80 . 1 1 6 6 GLN HE21 H 1 6.876 0.020 . 1 . . . A 6 GLN HE21 . 18934 1 81 . 1 1 6 6 GLN HE22 H 1 7.209 0.020 . 1 . . . A 6 GLN HE22 . 18934 1 82 . 1 1 6 6 GLN C C 13 175.895 0.3 . 1 . . . A 6 GLN C . 18934 1 83 . 1 1 6 6 GLN CA C 13 56.026 0.3 . 1 . . . A 6 GLN CA . 18934 1 84 . 1 1 6 6 GLN CB C 13 26.426 0.3 . 1 . . . A 6 GLN CB . 18934 1 85 . 1 1 6 6 GLN CG C 13 31.240 0.3 . 1 . . . A 6 GLN CG . 18934 1 86 . 1 1 6 6 GLN N N 15 121.263 0.3 . 1 . . . A 6 GLN N . 18934 1 87 . 1 1 6 6 GLN NE2 N 15 110.629 0.3 . 1 . . . A 6 GLN NE2 . 18934 1 88 . 1 1 7 7 GLY H H 1 8.613 0.020 . 1 . . . A 7 GLY H . 18934 1 89 . 1 1 7 7 GLY HA2 H 1 3.323 0.020 . 2 . . . A 7 GLY HA2 . 18934 1 90 . 1 1 7 7 GLY HA3 H 1 3.226 0.020 . 2 . . . A 7 GLY HA3 . 18934 1 91 . 1 1 7 7 GLY C C 13 172.052 0.3 . 1 . . . A 7 GLY C . 18934 1 92 . 1 1 7 7 GLY CA C 13 44.696 0.3 . 1 . . . A 7 GLY CA . 18934 1 93 . 1 1 7 7 GLY N N 15 106.718 0.3 . 1 . . . A 7 GLY N . 18934 1 94 . 1 1 8 8 LYS H H 1 8.402 0.020 . 1 . . . A 8 LYS H . 18934 1 95 . 1 1 8 8 LYS HA H 1 3.764 0.020 . 1 . . . A 8 LYS HA . 18934 1 96 . 1 1 8 8 LYS HB2 H 1 1.870 0.020 . 2 . . . A 8 LYS HB2 . 18934 1 97 . 1 1 8 8 LYS HB3 H 1 1.778 0.020 . 2 . . . A 8 LYS HB3 . 18934 1 98 . 1 1 8 8 LYS HG2 H 1 1.622 0.020 . 1 . . . A 8 LYS HG2 . 18934 1 99 . 1 1 8 8 LYS HG3 H 1 1.622 0.020 . 1 . . . A 8 LYS HG3 . 18934 1 100 . 1 1 8 8 LYS HD2 H 1 3.140 0.020 . 1 . . . A 8 LYS HD2 . 18934 1 101 . 1 1 8 8 LYS HD3 H 1 3.140 0.020 . 1 . . . A 8 LYS HD3 . 18934 1 102 . 1 1 8 8 LYS C C 13 176.772 0.3 . 1 . . . A 8 LYS C . 18934 1 103 . 1 1 8 8 LYS CA C 13 57.835 0.3 . 1 . . . A 8 LYS CA . 18934 1 104 . 1 1 8 8 LYS CB C 13 29.780 0.3 . 1 . . . A 8 LYS CB . 18934 1 105 . 1 1 8 8 LYS CG C 13 24.356 0.3 . 1 . . . A 8 LYS CG . 18934 1 106 . 1 1 8 8 LYS CD C 13 40.584 0.3 . 1 . . . A 8 LYS CD . 18934 1 107 . 1 1 8 8 LYS N N 15 120.263 0.3 . 1 . . . A 8 LYS N . 18934 1 108 . 1 1 9 9 LYS H H 1 7.853 0.020 . 1 . . . A 9 LYS H . 18934 1 109 . 1 1 9 9 LYS HA H 1 4.004 0.020 . 1 . . . A 9 LYS HA . 18934 1 110 . 1 1 9 9 LYS HB2 H 1 2.026 0.020 . 2 . . . A 9 LYS HB2 . 18934 1 111 . 1 1 9 9 LYS HB3 H 1 1.950 0.020 . 2 . . . A 9 LYS HB3 . 18934 1 112 . 1 1 9 9 LYS HG2 H 1 1.503 0.020 . 2 . . . A 9 LYS HG2 . 18934 1 113 . 1 1 9 9 LYS HG3 H 1 1.735 0.020 . 2 . . . A 9 LYS HG3 . 18934 1 114 . 1 1 9 9 LYS HD2 H 1 1.768 0.020 . 2 . . . A 9 LYS HD2 . 18934 1 115 . 1 1 9 9 LYS HD3 H 1 1.810 0.020 . 2 . . . A 9 LYS HD3 . 18934 1 116 . 1 1 9 9 LYS HE2 H 1 2.984 0.020 . 1 . . . A 9 LYS HE2 . 18934 1 117 . 1 1 9 9 LYS HE3 H 1 2.984 0.020 . 1 . . . A 9 LYS HE3 . 18934 1 118 . 1 1 9 9 LYS C C 13 177.064 0.3 . 1 . . . A 9 LYS C . 18934 1 119 . 1 1 9 9 LYS CA C 13 57.266 0.3 . 1 . . . A 9 LYS CA . 18934 1 120 . 1 1 9 9 LYS CB C 13 29.788 0.3 . 1 . . . A 9 LYS CB . 18934 1 121 . 1 1 9 9 LYS CG C 13 23.137 0.3 . 1 . . . A 9 LYS CG . 18934 1 122 . 1 1 9 9 LYS CD C 13 27.061 0.3 . 1 . . . A 9 LYS CD . 18934 1 123 . 1 1 9 9 LYS CE C 13 39.463 0.3 . 1 . . . A 9 LYS CE . 18934 1 124 . 1 1 9 9 LYS N N 15 120.310 0.3 . 1 . . . A 9 LYS N . 18934 1 125 . 1 1 10 10 ILE H H 1 7.932 0.020 . 1 . . . A 10 ILE H . 18934 1 126 . 1 1 10 10 ILE HA H 1 2.761 0.020 . 1 . . . A 10 ILE HA . 18934 1 127 . 1 1 10 10 ILE HB H 1 1.423 0.020 . 1 . . . A 10 ILE HB . 18934 1 128 . 1 1 10 10 ILE HG12 H 1 0.597 0.020 . 2 . . . A 10 ILE HG12 . 18934 1 129 . 1 1 10 10 ILE HG13 H 1 -0.865 0.020 . 2 . . . A 10 ILE HG13 . 18934 1 130 . 1 1 10 10 ILE HG21 H 1 0.323 0.020 . 1 . . . A 10 ILE HG21 . 18934 1 131 . 1 1 10 10 ILE HG22 H 1 0.323 0.020 . 1 . . . A 10 ILE HG22 . 18934 1 132 . 1 1 10 10 ILE HG23 H 1 0.323 0.020 . 1 . . . A 10 ILE HG23 . 18934 1 133 . 1 1 10 10 ILE HD11 H 1 -0.218 0.020 . 1 . . . A 10 ILE HD11 . 18934 1 134 . 1 1 10 10 ILE HD12 H 1 -0.218 0.020 . 1 . . . A 10 ILE HD12 . 18934 1 135 . 1 1 10 10 ILE HD13 H 1 -0.218 0.020 . 1 . . . A 10 ILE HD13 . 18934 1 136 . 1 1 10 10 ILE C C 13 175.080 0.3 . 1 . . . A 10 ILE C . 18934 1 137 . 1 1 10 10 ILE CA C 13 62.706 0.3 . 1 . . . A 10 ILE CA . 18934 1 138 . 1 1 10 10 ILE CB C 13 34.328 0.3 . 1 . . . A 10 ILE CB . 18934 1 139 . 1 1 10 10 ILE CG1 C 13 25.544 0.3 . 1 . . . A 10 ILE CG1 . 18934 1 140 . 1 1 10 10 ILE CG2 C 13 13.880 0.3 . 1 . . . A 10 ILE CG2 . 18934 1 141 . 1 1 10 10 ILE CD1 C 13 10.757 0.3 . 1 . . . A 10 ILE CD1 . 18934 1 142 . 1 1 10 10 ILE N N 15 121.456 0.3 . 1 . . . A 10 ILE N . 18934 1 143 . 1 1 11 11 VAL H H 1 8.082 0.020 . 1 . . . A 11 VAL H . 18934 1 144 . 1 1 11 11 VAL HA H 1 3.172 0.020 . 1 . . . A 11 VAL HA . 18934 1 145 . 1 1 11 11 VAL HB H 1 1.972 0.020 . 1 . . . A 11 VAL HB . 18934 1 146 . 1 1 11 11 VAL HG11 H 1 0.809 0.020 . 1 . . . A 11 VAL HG11 . 18934 1 147 . 1 1 11 11 VAL HG12 H 1 0.809 0.020 . 1 . . . A 11 VAL HG12 . 18934 1 148 . 1 1 11 11 VAL HG13 H 1 0.809 0.020 . 1 . . . A 11 VAL HG13 . 18934 1 149 . 1 1 11 11 VAL HG21 H 1 0.885 0.020 . 1 . . . A 11 VAL HG21 . 18934 1 150 . 1 1 11 11 VAL HG22 H 1 0.885 0.020 . 1 . . . A 11 VAL HG22 . 18934 1 151 . 1 1 11 11 VAL HG23 H 1 0.885 0.020 . 1 . . . A 11 VAL HG23 . 18934 1 152 . 1 1 11 11 VAL C C 13 174.412 0.3 . 1 . . . A 11 VAL C . 18934 1 153 . 1 1 11 11 VAL CA C 13 65.427 0.3 . 1 . . . A 11 VAL CA . 18934 1 154 . 1 1 11 11 VAL CB C 13 28.364 0.3 . 1 . . . A 11 VAL CB . 18934 1 155 . 1 1 11 11 VAL CG1 C 13 18.712 0.3 . 1 . . . A 11 VAL CG1 . 18934 1 156 . 1 1 11 11 VAL CG2 C 13 22.978 0.3 . 1 . . . A 11 VAL CG2 . 18934 1 157 . 1 1 11 11 VAL N N 15 119.577 0.3 . 1 . . . A 11 VAL N . 18934 1 158 . 1 1 12 12 ASN H H 1 7.879 0.020 . 1 . . . A 12 ASN H . 18934 1 159 . 1 1 12 12 ASN HA H 1 4.289 0.020 . 1 . . . A 12 ASN HA . 18934 1 160 . 1 1 12 12 ASN HB2 H 1 2.822 0.020 . 1 . . . A 12 ASN HB2 . 18934 1 161 . 1 1 12 12 ASN HB3 H 1 2.822 0.020 . 1 . . . A 12 ASN HB3 . 18934 1 162 . 1 1 12 12 ASN CA C 13 53.756 0.3 . 1 . . . A 12 ASN CA . 18934 1 163 . 1 1 12 12 ASN CB C 13 35.670 0.3 . 1 . . . A 12 ASN CB . 18934 1 164 . 1 1 12 12 ASN N N 15 115.867 0.3 . 1 . . . A 12 ASN N . 18934 1 165 . 1 1 13 13 HIS H H 1 7.838 0.020 . 1 . . . A 13 HIS H . 18934 1 166 . 1 1 13 13 HIS HA H 1 4.228 0.020 . 1 . . . A 13 HIS HA . 18934 1 167 . 1 1 13 13 HIS HB2 H 1 3.127 0.020 . 1 . . . A 13 HIS HB2 . 18934 1 168 . 1 1 13 13 HIS HB3 H 1 3.127 0.020 . 1 . . . A 13 HIS HB3 . 18934 1 169 . 1 1 13 13 HIS HD2 H 1 7.027 0.020 . 1 . . . A 13 HIS HD2 . 18934 1 170 . 1 1 13 13 HIS C C 13 175.080 0.3 . 1 . . . A 13 HIS C . 18934 1 171 . 1 1 13 13 HIS CA C 13 56.816 0.3 . 1 . . . A 13 HIS CA . 18934 1 172 . 1 1 13 13 HIS CB C 13 29.333 0.3 . 1 . . . A 13 HIS CB . 18934 1 173 . 1 1 13 13 HIS CD2 C 13 117.603 0.3 . 1 . . . A 13 HIS CD2 . 18934 1 174 . 1 1 13 13 HIS N N 15 119.426 0.3 . 1 . . . A 13 HIS N . 18934 1 175 . 1 1 14 14 LEU H H 1 8.381 0.020 . 1 . . . A 14 LEU H . 18934 1 176 . 1 1 14 14 LEU HA H 1 3.794 0.020 . 1 . . . A 14 LEU HA . 18934 1 177 . 1 1 14 14 LEU HB2 H 1 1.728 0.020 . 2 . . . A 14 LEU HB2 . 18934 1 178 . 1 1 14 14 LEU HB3 H 1 1.158 0.020 . 2 . . . A 14 LEU HB3 . 18934 1 179 . 1 1 14 14 LEU HG H 1 1.870 0.020 . 1 . . . A 14 LEU HG . 18934 1 180 . 1 1 14 14 LEU HD11 H 1 0.587 0.020 . 1 . . . A 14 LEU HD11 . 18934 1 181 . 1 1 14 14 LEU HD12 H 1 0.587 0.020 . 1 . . . A 14 LEU HD12 . 18934 1 182 . 1 1 14 14 LEU HD13 H 1 0.587 0.020 . 1 . . . A 14 LEU HD13 . 18934 1 183 . 1 1 14 14 LEU HD21 H 1 0.664 0.020 . 1 . . . A 14 LEU HD21 . 18934 1 184 . 1 1 14 14 LEU HD22 H 1 0.664 0.020 . 1 . . . A 14 LEU HD22 . 18934 1 185 . 1 1 14 14 LEU HD23 H 1 0.664 0.020 . 1 . . . A 14 LEU HD23 . 18934 1 186 . 1 1 14 14 LEU C C 13 176.396 0.3 . 1 . . . A 14 LEU C . 18934 1 187 . 1 1 14 14 LEU CA C 13 54.433 0.3 . 1 . . . A 14 LEU CA . 18934 1 188 . 1 1 14 14 LEU CB C 13 39.472 0.3 . 1 . . . A 14 LEU CB . 18934 1 189 . 1 1 14 14 LEU CG C 13 23.586 0.3 . 1 . . . A 14 LEU CG . 18934 1 190 . 1 1 14 14 LEU CD1 C 13 24.922 0.3 . 1 . . . A 14 LEU CD1 . 18934 1 191 . 1 1 14 14 LEU CD2 C 13 20.756 0.3 . 1 . . . A 14 LEU CD2 . 18934 1 192 . 1 1 14 14 LEU N N 15 115.777 0.3 . 1 . . . A 14 LEU N . 18934 1 193 . 1 1 15 15 ARG H H 1 7.946 0.020 . 1 . . . A 15 ARG H . 18934 1 194 . 1 1 15 15 ARG HA H 1 3.842 0.020 . 1 . . . A 15 ARG HA . 18934 1 195 . 1 1 15 15 ARG HB2 H 1 1.935 0.020 . 2 . . . A 15 ARG HB2 . 18934 1 196 . 1 1 15 15 ARG HB3 H 1 1.804 0.020 . 2 . . . A 15 ARG HB3 . 18934 1 197 . 1 1 15 15 ARG HG2 H 1 1.486 0.020 . 2 . . . A 15 ARG HG2 . 18934 1 198 . 1 1 15 15 ARG HG3 H 1 1.431 0.020 . 2 . . . A 15 ARG HG3 . 18934 1 199 . 1 1 15 15 ARG HD2 H 1 2.951 0.020 . 1 . . . A 15 ARG HD2 . 18934 1 200 . 1 1 15 15 ARG HD3 H 1 2.951 0.020 . 1 . . . A 15 ARG HD3 . 18934 1 201 . 1 1 15 15 ARG C C 13 173.493 0.3 . 1 . . . A 15 ARG C . 18934 1 202 . 1 1 15 15 ARG CA C 13 57.495 0.3 . 1 . . . A 15 ARG CA . 18934 1 203 . 1 1 15 15 ARG CB C 13 27.320 0.3 . 1 . . . A 15 ARG CB . 18934 1 204 . 1 1 15 15 ARG CG C 13 21.947 0.3 . 1 . . . A 15 ARG CG . 18934 1 205 . 1 1 15 15 ARG CD C 13 39.168 0.3 . 1 . . . A 15 ARG CD . 18934 1 206 . 1 1 15 15 ARG N N 15 115.213 0.3 . 1 . . . A 15 ARG N . 18934 1 207 . 1 1 16 16 SER H H 1 7.020 0.020 . 1 . . . A 16 SER H . 18934 1 208 . 1 1 16 16 SER HA H 1 4.808 0.020 . 1 . . . A 16 SER HA . 18934 1 209 . 1 1 16 16 SER HB2 H 1 4.064 0.020 . 2 . . . A 16 SER HB2 . 18934 1 210 . 1 1 16 16 SER HB3 H 1 3.753 0.020 . 2 . . . A 16 SER HB3 . 18934 1 211 . 1 1 16 16 SER C C 13 173.431 0.3 . 1 . . . A 16 SER C . 18934 1 212 . 1 1 16 16 SER CA C 13 54.776 0.3 . 1 . . . A 16 SER CA . 18934 1 213 . 1 1 16 16 SER CB C 13 61.538 0.3 . 1 . . . A 16 SER CB . 18934 1 214 . 1 1 16 16 SER N N 15 108.680 0.3 . 1 . . . A 16 SER N . 18934 1 215 . 1 1 17 17 ARG H H 1 7.806 0.020 . 1 . . . A 17 ARG H . 18934 1 216 . 1 1 17 17 ARG HA H 1 4.490 0.020 . 1 . . . A 17 ARG HA . 18934 1 217 . 1 1 17 17 ARG HB2 H 1 2.339 0.020 . 1 . . . A 17 ARG HB2 . 18934 1 218 . 1 1 17 17 ARG HB3 H 1 2.339 0.020 . 1 . . . A 17 ARG HB3 . 18934 1 219 . 1 1 17 17 ARG HG2 H 1 2.054 0.020 . 1 . . . A 17 ARG HG2 . 18934 1 220 . 1 1 17 17 ARG HG3 H 1 2.054 0.020 . 1 . . . A 17 ARG HG3 . 18934 1 221 . 1 1 17 17 ARG HD2 H 1 4.299 0.020 . 1 . . . A 17 ARG HD2 . 18934 1 222 . 1 1 17 17 ARG HD3 H 1 4.299 0.020 . 1 . . . A 17 ARG HD3 . 18934 1 223 . 1 1 17 17 ARG HE H 1 7.679 0.020 . 1 . . . A 17 ARG HE . 18934 1 224 . 1 1 17 17 ARG C C 13 175.623 0.3 . 1 . . . A 17 ARG C . 18934 1 225 . 1 1 17 17 ARG CA C 13 54.094 0.3 . 1 . . . A 17 ARG CA . 18934 1 226 . 1 1 17 17 ARG CB C 13 30.153 0.3 . 1 . . . A 17 ARG CB . 18934 1 227 . 1 1 17 17 ARG CG C 13 26.329 0.3 . 1 . . . A 17 ARG CG . 18934 1 228 . 1 1 17 17 ARG N N 15 122.175 0.3 . 1 . . . A 17 ARG N . 18934 1 229 . 1 1 17 17 ARG NE N 15 78.476 0.3 . 1 . . . A 17 ARG NE . 18934 1 230 . 1 1 18 18 LEU H H 1 8.806 0.020 . 1 . . . A 18 LEU H . 18934 1 231 . 1 1 18 18 LEU HA H 1 4.951 0.020 . 1 . . . A 18 LEU HA . 18934 1 232 . 1 1 18 18 LEU HB2 H 1 1.870 0.020 . 2 . . . A 18 LEU HB2 . 18934 1 233 . 1 1 18 18 LEU HB3 H 1 1.239 0.020 . 2 . . . A 18 LEU HB3 . 18934 1 234 . 1 1 18 18 LEU HG H 1 1.790 0.020 . 1 . . . A 18 LEU HG . 18934 1 235 . 1 1 18 18 LEU HD11 H 1 0.644 0.020 . 1 . . . A 18 LEU HD11 . 18934 1 236 . 1 1 18 18 LEU HD12 H 1 0.644 0.020 . 1 . . . A 18 LEU HD12 . 18934 1 237 . 1 1 18 18 LEU HD13 H 1 0.644 0.020 . 1 . . . A 18 LEU HD13 . 18934 1 238 . 1 1 18 18 LEU HD21 H 1 0.700 0.020 . 1 . . . A 18 LEU HD21 . 18934 1 239 . 1 1 18 18 LEU HD22 H 1 0.700 0.020 . 1 . . . A 18 LEU HD22 . 18934 1 240 . 1 1 18 18 LEU HD23 H 1 0.700 0.020 . 1 . . . A 18 LEU HD23 . 18934 1 241 . 1 1 18 18 LEU C C 13 173.577 0.3 . 1 . . . A 18 LEU C . 18934 1 242 . 1 1 18 18 LEU CA C 13 52.393 0.3 . 1 . . . A 18 LEU CA . 18934 1 243 . 1 1 18 18 LEU CB C 13 41.783 0.3 . 1 . . . A 18 LEU CB . 18934 1 244 . 1 1 18 18 LEU CG C 13 24.130 0.3 . 1 . . . A 18 LEU CG . 18934 1 245 . 1 1 18 18 LEU CD1 C 13 23.013 0.3 . 1 . . . A 18 LEU CD1 . 18934 1 246 . 1 1 18 18 LEU CD2 C 13 22.212 0.3 . 1 . . . A 18 LEU CD2 . 18934 1 247 . 1 1 18 18 LEU N N 15 121.998 0.3 . 1 . . . A 18 LEU N . 18934 1 248 . 1 1 19 19 ALA H H 1 8.684 0.020 . 1 . . . A 19 ALA H . 18934 1 249 . 1 1 19 19 ALA HA H 1 5.036 0.020 . 1 . . . A 19 ALA HA . 18934 1 250 . 1 1 19 19 ALA HB1 H 1 1.167 0.020 . 1 . . . A 19 ALA HB1 . 18934 1 251 . 1 1 19 19 ALA HB2 H 1 1.167 0.020 . 1 . . . A 19 ALA HB2 . 18934 1 252 . 1 1 19 19 ALA HB3 H 1 1.167 0.020 . 1 . . . A 19 ALA HB3 . 18934 1 253 . 1 1 19 19 ALA C C 13 171.092 0.3 . 1 . . . A 19 ALA C . 18934 1 254 . 1 1 19 19 ALA CA C 13 48.551 0.3 . 1 . . . A 19 ALA CA . 18934 1 255 . 1 1 19 19 ALA CB C 13 21.215 0.3 . 1 . . . A 19 ALA CB . 18934 1 256 . 1 1 19 19 ALA N N 15 125.776 0.3 . 1 . . . A 19 ALA N . 18934 1 257 . 1 1 20 20 PHE H H 1 8.827 0.020 . 1 . . . A 20 PHE H . 18934 1 258 . 1 1 20 20 PHE HA H 1 5.479 0.020 . 1 . . . A 20 PHE HA . 18934 1 259 . 1 1 20 20 PHE HB2 H 1 3.115 0.020 . 2 . . . A 20 PHE HB2 . 18934 1 260 . 1 1 20 20 PHE HB3 H 1 2.954 0.020 . 2 . . . A 20 PHE HB3 . 18934 1 261 . 1 1 20 20 PHE HD1 H 1 6.971 0.020 . 1 . . . A 20 PHE HD1 . 18934 1 262 . 1 1 20 20 PHE HD2 H 1 6.971 0.020 . 1 . . . A 20 PHE HD2 . 18934 1 263 . 1 1 20 20 PHE HE1 H 1 7.064 0.020 . 1 . . . A 20 PHE HE1 . 18934 1 264 . 1 1 20 20 PHE HE2 H 1 7.064 0.020 . 1 . . . A 20 PHE HE2 . 18934 1 265 . 1 1 20 20 PHE HZ H 1 6.858 0.020 . 1 . . . A 20 PHE HZ . 18934 1 266 . 1 1 20 20 PHE C C 13 169.797 0.3 . 1 . . . A 20 PHE C . 18934 1 267 . 1 1 20 20 PHE CA C 13 53.416 0.3 . 1 . . . A 20 PHE CA . 18934 1 268 . 1 1 20 20 PHE CB C 13 39.770 0.3 . 1 . . . A 20 PHE CB . 18934 1 269 . 1 1 20 20 PHE CD2 C 13 127.909 0.3 . 1 . . . A 20 PHE CD2 . 18934 1 270 . 1 1 20 20 PHE CE2 C 13 128.990 0.3 . 1 . . . A 20 PHE CE2 . 18934 1 271 . 1 1 20 20 PHE CZ C 13 126.806 0.3 . 1 . . . A 20 PHE CZ . 18934 1 272 . 1 1 20 20 PHE N N 15 113.856 0.3 . 1 . . . A 20 PHE N . 18934 1 273 . 1 1 21 21 GLU H H 1 7.853 0.020 . 1 . . . A 21 GLU H . 18934 1 274 . 1 1 21 21 GLU HA H 1 4.908 0.020 . 1 . . . A 21 GLU HA . 18934 1 275 . 1 1 21 21 GLU HB2 H 1 2.015 0.020 . 2 . . . A 21 GLU HB2 . 18934 1 276 . 1 1 21 21 GLU HB3 H 1 1.731 0.020 . 2 . . . A 21 GLU HB3 . 18934 1 277 . 1 1 21 21 GLU C C 13 172.052 0.3 . 1 . . . A 21 GLU C . 18934 1 278 . 1 1 21 21 GLU CA C 13 52.621 0.3 . 1 . . . A 21 GLU CA . 18934 1 279 . 1 1 21 21 GLU CB C 13 28.960 0.3 . 1 . . . A 21 GLU CB . 18934 1 280 . 1 1 21 21 GLU CG C 13 33.703 0.3 . 1 . . . A 21 GLU CG . 18934 1 281 . 1 1 21 21 GLU N N 15 122.295 0.3 . 1 . . . A 21 GLU N . 18934 1 282 . 1 1 22 22 TYR H H 1 8.847 0.020 . 1 . . . A 22 TYR H . 18934 1 283 . 1 1 22 22 TYR HA H 1 4.738 0.020 . 1 . . . A 22 TYR HA . 18934 1 284 . 1 1 22 22 TYR HB2 H 1 2.890 0.020 . 2 . . . A 22 TYR HB2 . 18934 1 285 . 1 1 22 22 TYR HB3 H 1 2.565 0.020 . 2 . . . A 22 TYR HB3 . 18934 1 286 . 1 1 22 22 TYR HD1 H 1 6.612 0.020 . 1 . . . A 22 TYR HD1 . 18934 1 287 . 1 1 22 22 TYR HD2 H 1 6.612 0.020 . 1 . . . A 22 TYR HD2 . 18934 1 288 . 1 1 22 22 TYR HE1 H 1 6.312 0.020 . 1 . . . A 22 TYR HE1 . 18934 1 289 . 1 1 22 22 TYR HE2 H 1 6.312 0.020 . 1 . . . A 22 TYR HE2 . 18934 1 290 . 1 1 22 22 TYR C C 13 172.070 0.3 . 1 . . . A 22 TYR C . 18934 1 291 . 1 1 22 22 TYR CA C 13 53.301 0.3 . 1 . . . A 22 TYR CA . 18934 1 292 . 1 1 22 22 TYR CB C 13 38.353 0.3 . 1 . . . A 22 TYR CB . 18934 1 293 . 1 1 22 22 TYR CD1 C 13 130.025 0.3 . 1 . . . A 22 TYR CD1 . 18934 1 294 . 1 1 22 22 TYR CE1 C 13 115.511 0.3 . 1 . . . A 22 TYR CE1 . 18934 1 295 . 1 1 22 22 TYR N N 15 125.594 0.3 . 1 . . . A 22 TYR N . 18934 1 296 . 1 1 23 23 ASN H H 1 8.991 0.020 . 1 . . . A 23 ASN H . 18934 1 297 . 1 1 23 23 ASN HA H 1 4.039 0.020 . 1 . . . A 23 ASN HA . 18934 1 298 . 1 1 23 23 ASN HB2 H 1 2.706 0.020 . 2 . . . A 23 ASN HB2 . 18934 1 299 . 1 1 23 23 ASN HB3 H 1 1.777 0.020 . 2 . . . A 23 ASN HB3 . 18934 1 300 . 1 1 23 23 ASN HD21 H 1 6.371 0.020 . 1 . . . A 23 ASN HD21 . 18934 1 301 . 1 1 23 23 ASN HD22 H 1 6.816 0.020 . 1 . . . A 23 ASN HD22 . 18934 1 302 . 1 1 23 23 ASN C C 13 172.679 0.3 . 1 . . . A 23 ASN C . 18934 1 303 . 1 1 23 23 ASN CA C 13 50.694 0.3 . 1 . . . A 23 ASN CA . 18934 1 304 . 1 1 23 23 ASN CB C 13 34.179 0.3 . 1 . . . A 23 ASN CB . 18934 1 305 . 1 1 23 23 ASN N N 15 127.898 0.3 . 1 . . . A 23 ASN N . 18934 1 306 . 1 1 23 23 ASN ND2 N 15 110.597 0.3 . 1 . . . A 23 ASN ND2 . 18934 1 307 . 1 1 24 24 GLY H H 1 8.586 0.020 . 1 . . . A 24 GLY H . 18934 1 308 . 1 1 24 24 GLY HA2 H 1 4.026 0.020 . 2 . . . A 24 GLY HA2 . 18934 1 309 . 1 1 24 24 GLY HA3 H 1 3.571 0.020 . 2 . . . A 24 GLY HA3 . 18934 1 310 . 1 1 24 24 GLY C C 13 170.925 0.3 . 1 . . . A 24 GLY C . 18934 1 311 . 1 1 24 24 GLY CA C 13 42.653 0.3 . 1 . . . A 24 GLY CA . 18934 1 312 . 1 1 24 24 GLY N N 15 103.320 0.3 . 1 . . . A 24 GLY N . 18934 1 313 . 1 1 25 25 GLN H H 1 7.625 0.020 . 1 . . . A 25 GLN H . 18934 1 314 . 1 1 25 25 GLN HA H 1 4.505 0.020 . 1 . . . A 25 GLN HA . 18934 1 315 . 1 1 25 25 GLN HB2 H 1 1.966 0.020 . 2 . . . A 25 GLN HB2 . 18934 1 316 . 1 1 25 25 GLN HB3 H 1 1.908 0.020 . 2 . . . A 25 GLN HB3 . 18934 1 317 . 1 1 25 25 GLN HG2 H 1 2.205 0.020 . 1 . . . A 25 GLN HG2 . 18934 1 318 . 1 1 25 25 GLN HG3 H 1 2.205 0.020 . 1 . . . A 25 GLN HG3 . 18934 1 319 . 1 1 25 25 GLN HE21 H 1 6.475 0.020 . 1 . . . A 25 GLN HE21 . 18934 1 320 . 1 1 25 25 GLN HE22 H 1 8.025 0.020 . 1 . . . A 25 GLN HE22 . 18934 1 321 . 1 1 25 25 GLN C C 13 170.942 0.3 . 1 . . . A 25 GLN C . 18934 1 322 . 1 1 25 25 GLN CA C 13 50.922 0.3 . 1 . . . A 25 GLN CA . 18934 1 323 . 1 1 25 25 GLN CB C 13 28.886 0.3 . 1 . . . A 25 GLN CB . 18934 1 324 . 1 1 25 25 GLN CG C 13 30.708 0.3 . 1 . . . A 25 GLN CG . 18934 1 325 . 1 1 25 25 GLN N N 15 119.296 0.3 . 1 . . . A 25 GLN N . 18934 1 326 . 1 1 25 25 GLN NE2 N 15 117.408 0.3 . 1 . . . A 25 GLN NE2 . 18934 1 327 . 1 1 26 26 LEU H H 1 8.450 0.020 . 1 . . . A 26 LEU H . 18934 1 328 . 1 1 26 26 LEU HA H 1 4.391 0.020 . 1 . . . A 26 LEU HA . 18934 1 329 . 1 1 26 26 LEU HB2 H 1 1.410 0.020 . 1 . . . A 26 LEU HB2 . 18934 1 330 . 1 1 26 26 LEU HB3 H 1 1.410 0.020 . 1 . . . A 26 LEU HB3 . 18934 1 331 . 1 1 26 26 LEU HG H 1 1.243 0.020 . 1 . . . A 26 LEU HG . 18934 1 332 . 1 1 26 26 LEU HD11 H 1 0.683 0.020 . 1 . . . A 26 LEU HD11 . 18934 1 333 . 1 1 26 26 LEU HD12 H 1 0.683 0.020 . 1 . . . A 26 LEU HD12 . 18934 1 334 . 1 1 26 26 LEU HD13 H 1 0.683 0.020 . 1 . . . A 26 LEU HD13 . 18934 1 335 . 1 1 26 26 LEU HD21 H 1 0.694 0.020 . 1 . . . A 26 LEU HD21 . 18934 1 336 . 1 1 26 26 LEU HD22 H 1 0.694 0.020 . 1 . . . A 26 LEU HD22 . 18934 1 337 . 1 1 26 26 LEU HD23 H 1 0.694 0.020 . 1 . . . A 26 LEU HD23 . 18934 1 338 . 1 1 26 26 LEU C C 13 173.159 0.3 . 1 . . . A 26 LEU C . 18934 1 339 . 1 1 26 26 LEU CA C 13 51.717 0.3 . 1 . . . A 26 LEU CA . 18934 1 340 . 1 1 26 26 LEU CB C 13 39.248 0.3 . 1 . . . A 26 LEU CB . 18934 1 341 . 1 1 26 26 LEU CG C 13 24.456 0.3 . 1 . . . A 26 LEU CG . 18934 1 342 . 1 1 26 26 LEU CD1 C 13 21.705 0.3 . 1 . . . A 26 LEU CD1 . 18934 1 343 . 1 1 26 26 LEU CD2 C 13 22.128 0.3 . 1 . . . A 26 LEU CD2 . 18934 1 344 . 1 1 26 26 LEU N N 15 124.194 0.3 . 1 . . . A 26 LEU N . 18934 1 345 . 1 1 27 27 ILE H H 1 8.914 0.020 . 1 . . . A 27 ILE H . 18934 1 346 . 1 1 27 27 ILE HA H 1 3.932 0.020 . 1 . . . A 27 ILE HA . 18934 1 347 . 1 1 27 27 ILE HB H 1 0.616 0.020 . 1 . . . A 27 ILE HB . 18934 1 348 . 1 1 27 27 ILE HG12 H 1 1.052 0.020 . 2 . . . A 27 ILE HG12 . 18934 1 349 . 1 1 27 27 ILE HG13 H 1 0.898 0.020 . 2 . . . A 27 ILE HG13 . 18934 1 350 . 1 1 27 27 ILE HG21 H 1 0.642 0.020 . 1 . . . A 27 ILE HG21 . 18934 1 351 . 1 1 27 27 ILE HG22 H 1 0.642 0.020 . 1 . . . A 27 ILE HG22 . 18934 1 352 . 1 1 27 27 ILE HG23 H 1 0.642 0.020 . 1 . . . A 27 ILE HG23 . 18934 1 353 . 1 1 27 27 ILE HD11 H 1 0.600 0.020 . 1 . . . A 27 ILE HD11 . 18934 1 354 . 1 1 27 27 ILE HD12 H 1 0.600 0.020 . 1 . . . A 27 ILE HD12 . 18934 1 355 . 1 1 27 27 ILE HD13 H 1 0.600 0.020 . 1 . . . A 27 ILE HD13 . 18934 1 356 . 1 1 27 27 ILE C C 13 172.407 0.3 . 1 . . . A 27 ILE C . 18934 1 357 . 1 1 27 27 ILE CA C 13 57.041 0.3 . 1 . . . A 27 ILE CA . 18934 1 358 . 1 1 27 27 ILE CB C 13 33.955 0.3 . 1 . . . A 27 ILE CB . 18934 1 359 . 1 1 27 27 ILE CG1 C 13 24.486 0.3 . 1 . . . A 27 ILE CG1 . 18934 1 360 . 1 1 27 27 ILE CG2 C 13 14.860 0.3 . 1 . . . A 27 ILE CG2 . 18934 1 361 . 1 1 27 27 ILE CD1 C 13 9.473 0.3 . 1 . . . A 27 ILE CD1 . 18934 1 362 . 1 1 27 27 ILE N N 15 130.251 0.3 . 1 . . . A 27 ILE N . 18934 1 363 . 1 1 28 28 LYS H H 1 8.231 0.020 . 1 . . . A 28 LYS H . 18934 1 364 . 1 1 28 28 LYS HA H 1 4.057 0.020 . 1 . . . A 28 LYS HA . 18934 1 365 . 1 1 28 28 LYS HB2 H 1 1.724 0.020 . 2 . . . A 28 LYS HB2 . 18934 1 366 . 1 1 28 28 LYS HB3 H 1 1.636 0.020 . 2 . . . A 28 LYS HB3 . 18934 1 367 . 1 1 28 28 LYS HG2 H 1 1.281 0.020 . 1 . . . A 28 LYS HG2 . 18934 1 368 . 1 1 28 28 LYS HG3 H 1 1.281 0.020 . 1 . . . A 28 LYS HG3 . 18934 1 369 . 1 1 28 28 LYS HD2 H 1 1.469 0.020 . 1 . . . A 28 LYS HD2 . 18934 1 370 . 1 1 28 28 LYS HD3 H 1 1.469 0.020 . 1 . . . A 28 LYS HD3 . 18934 1 371 . 1 1 28 28 LYS HE2 H 1 2.927 0.020 . 1 . . . A 28 LYS HE2 . 18934 1 372 . 1 1 28 28 LYS HE3 H 1 2.927 0.020 . 1 . . . A 28 LYS HE3 . 18934 1 373 . 1 1 28 28 LYS C C 13 173.952 0.3 . 1 . . . A 28 LYS C . 18934 1 374 . 1 1 28 28 LYS CA C 13 54.553 0.3 . 1 . . . A 28 LYS CA . 18934 1 375 . 1 1 28 28 LYS CB C 13 30.004 0.3 . 1 . . . A 28 LYS CB . 18934 1 376 . 1 1 28 28 LYS CG C 13 22.555 0.3 . 1 . . . A 28 LYS CG . 18934 1 377 . 1 1 28 28 LYS CD C 13 24.286 0.3 . 1 . . . A 28 LYS CD . 18934 1 378 . 1 1 28 28 LYS CE C 13 39.463 0.3 . 1 . . . A 28 LYS CE . 18934 1 379 . 1 1 28 28 LYS N N 15 125.650 0.3 . 1 . . . A 28 LYS N . 18934 1 380 . 1 1 29 29 ILE H H 1 8.082 0.020 . 1 . . . A 29 ILE H . 18934 1 381 . 1 1 29 29 ILE HA H 1 4.176 0.020 . 1 . . . A 29 ILE HA . 18934 1 382 . 1 1 29 29 ILE HB H 1 1.530 0.020 . 1 . . . A 29 ILE HB . 18934 1 383 . 1 1 29 29 ILE HG12 H 1 1.685 0.020 . 2 . . . A 29 ILE HG12 . 18934 1 384 . 1 1 29 29 ILE HG13 H 1 1.119 0.020 . 2 . . . A 29 ILE HG13 . 18934 1 385 . 1 1 29 29 ILE HG21 H 1 0.920 0.020 . 1 . . . A 29 ILE HG21 . 18934 1 386 . 1 1 29 29 ILE HG22 H 1 0.920 0.020 . 1 . . . A 29 ILE HG22 . 18934 1 387 . 1 1 29 29 ILE HG23 H 1 0.920 0.020 . 1 . . . A 29 ILE HG23 . 18934 1 388 . 1 1 29 29 ILE HD11 H 1 0.745 0.020 . 1 . . . A 29 ILE HD11 . 18934 1 389 . 1 1 29 29 ILE HD12 H 1 0.745 0.020 . 1 . . . A 29 ILE HD12 . 18934 1 390 . 1 1 29 29 ILE HD13 H 1 0.745 0.020 . 1 . . . A 29 ILE HD13 . 18934 1 391 . 1 1 29 29 ILE C C 13 173.075 0.3 . 1 . . . A 29 ILE C . 18934 1 392 . 1 1 29 29 ILE CA C 13 57.949 0.3 . 1 . . . A 29 ILE CA . 18934 1 393 . 1 1 29 29 ILE CB C 13 35.222 0.3 . 1 . . . A 29 ILE CB . 18934 1 394 . 1 1 29 29 ILE CG1 C 13 26.564 0.3 . 1 . . . A 29 ILE CG1 . 18934 1 395 . 1 1 29 29 ILE CG2 C 13 14.827 0.3 . 1 . . . A 29 ILE CG2 . 18934 1 396 . 1 1 29 29 ILE CD1 C 13 10.904 0.3 . 1 . . . A 29 ILE CD1 . 18934 1 397 . 1 1 29 29 ILE N N 15 125.802 0.3 . 1 . . . A 29 ILE N . 18934 1 398 . 1 1 30 30 LEU H H 1 8.980 0.020 . 1 . . . A 30 LEU H . 18934 1 399 . 1 1 30 30 LEU HA H 1 4.259 0.020 . 1 . . . A 30 LEU HA . 18934 1 400 . 1 1 30 30 LEU HB2 H 1 1.687 0.020 . 1 . . . A 30 LEU HB2 . 18934 1 401 . 1 1 30 30 LEU HB3 H 1 1.687 0.020 . 1 . . . A 30 LEU HB3 . 18934 1 402 . 1 1 30 30 LEU HG H 1 1.780 0.020 . 1 . . . A 30 LEU HG . 18934 1 403 . 1 1 30 30 LEU HD11 H 1 0.930 0.020 . 1 . . . A 30 LEU HD11 . 18934 1 404 . 1 1 30 30 LEU HD12 H 1 0.930 0.020 . 1 . . . A 30 LEU HD12 . 18934 1 405 . 1 1 30 30 LEU HD13 H 1 0.930 0.020 . 1 . . . A 30 LEU HD13 . 18934 1 406 . 1 1 30 30 LEU HD21 H 1 0.860 0.020 . 1 . . . A 30 LEU HD21 . 18934 1 407 . 1 1 30 30 LEU HD22 H 1 0.860 0.020 . 1 . . . A 30 LEU HD22 . 18934 1 408 . 1 1 30 30 LEU HD23 H 1 0.860 0.020 . 1 . . . A 30 LEU HD23 . 18934 1 409 . 1 1 30 30 LEU CA C 13 52.280 0.3 . 1 . . . A 30 LEU CA . 18934 1 410 . 1 1 30 30 LEU CB C 13 39.323 0.3 . 1 . . . A 30 LEU CB . 18934 1 411 . 1 1 30 30 LEU CG C 13 24.376 0.3 . 1 . . . A 30 LEU CG . 18934 1 412 . 1 1 30 30 LEU CD1 C 13 22.826 0.3 . 1 . . . A 30 LEU CD1 . 18934 1 413 . 1 1 30 30 LEU CD2 C 13 19.665 0.3 . 1 . . . A 30 LEU CD2 . 18934 1 414 . 1 1 30 30 LEU N N 15 128.750 0.3 . 1 . . . A 30 LEU N . 18934 1 415 . 1 1 31 31 SER H H 1 8.651 0.020 . 1 . . . A 31 SER H . 18934 1 416 . 1 1 31 31 SER HA H 1 4.139 0.020 . 1 . . . A 31 SER HA . 18934 1 417 . 1 1 31 31 SER HB2 H 1 3.912 0.020 . 1 . . . A 31 SER HB2 . 18934 1 418 . 1 1 31 31 SER HB3 H 1 3.912 0.020 . 1 . . . A 31 SER HB3 . 18934 1 419 . 1 1 31 31 SER CA C 13 58.966 0.3 . 1 . . . A 31 SER CA . 18934 1 420 . 1 1 31 31 SER CB C 13 60.122 0.3 . 1 . . . A 31 SER CB . 18934 1 421 . 1 1 31 31 SER N N 15 117.327 0.3 . 1 . . . A 31 SER N . 18934 1 422 . 1 1 32 32 LYS H H 1 8.055 0.020 . 1 . . . A 32 LYS H . 18934 1 423 . 1 1 32 32 LYS HA H 1 4.219 0.020 . 1 . . . A 32 LYS HA . 18934 1 424 . 1 1 32 32 LYS HB2 H 1 1.871 0.020 . 2 . . . A 32 LYS HB2 . 18934 1 425 . 1 1 32 32 LYS HB3 H 1 1.756 0.020 . 2 . . . A 32 LYS HB3 . 18934 1 426 . 1 1 32 32 LYS HG2 H 1 1.113 0.020 . 2 . . . A 32 LYS HG2 . 18934 1 427 . 1 1 32 32 LYS HG3 H 1 1.353 0.020 . 2 . . . A 32 LYS HG3 . 18934 1 428 . 1 1 32 32 LYS HD2 H 1 1.626 0.020 . 1 . . . A 32 LYS HD2 . 18934 1 429 . 1 1 32 32 LYS HD3 H 1 1.626 0.020 . 1 . . . A 32 LYS HD3 . 18934 1 430 . 1 1 32 32 LYS HE2 H 1 2.933 0.020 . 1 . . . A 32 LYS HE2 . 18934 1 431 . 1 1 32 32 LYS HE3 H 1 2.933 0.020 . 1 . . . A 32 LYS HE3 . 18934 1 432 . 1 1 32 32 LYS C C 13 173.389 0.3 . 1 . . . A 32 LYS C . 18934 1 433 . 1 1 32 32 LYS CA C 13 55.003 0.3 . 1 . . . A 32 LYS CA . 18934 1 434 . 1 1 32 32 LYS CB C 13 28.513 0.3 . 1 . . . A 32 LYS CB . 18934 1 435 . 1 1 32 32 LYS CG C 13 22.081 0.3 . 1 . . . A 32 LYS CG . 18934 1 436 . 1 1 32 32 LYS CD C 13 26.522 0.3 . 1 . . . A 32 LYS CD . 18934 1 437 . 1 1 32 32 LYS CE C 13 39.355 0.3 . 1 . . . A 32 LYS CE . 18934 1 438 . 1 1 32 32 LYS N N 15 115.443 0.3 . 1 . . . A 32 LYS N . 18934 1 439 . 1 1 33 33 ASN H H 1 7.952 0.020 . 1 . . . A 33 ASN H . 18934 1 440 . 1 1 33 33 ASN HA H 1 4.907 0.020 . 1 . . . A 33 ASN HA . 18934 1 441 . 1 1 33 33 ASN HB2 H 1 3.918 0.020 . 2 . . . A 33 ASN HB2 . 18934 1 442 . 1 1 33 33 ASN HB3 H 1 2.800 0.020 . 2 . . . A 33 ASN HB3 . 18934 1 443 . 1 1 33 33 ASN HD21 H 1 6.936 0.020 . 1 . . . A 33 ASN HD21 . 18934 1 444 . 1 1 33 33 ASN HD22 H 1 7.689 0.020 . 1 . . . A 33 ASN HD22 . 18934 1 445 . 1 1 33 33 ASN C C 13 173.322 0.3 . 1 . . . A 33 ASN C . 18934 1 446 . 1 1 33 33 ASN CA C 13 49.679 0.3 . 1 . . . A 33 ASN CA . 18934 1 447 . 1 1 33 33 ASN CB C 13 36.117 0.3 . 1 . . . A 33 ASN CB . 18934 1 448 . 1 1 33 33 ASN N N 15 118.614 0.3 . 1 . . . A 33 ASN N . 18934 1 449 . 1 1 33 33 ASN ND2 N 15 113.194 0.3 . 1 . . . A 33 ASN ND2 . 18934 1 450 . 1 1 34 34 ILE H H 1 7.425 0.020 . 1 . . . A 34 ILE H . 18934 1 451 . 1 1 34 34 ILE HA H 1 4.789 0.020 . 1 . . . A 34 ILE HA . 18934 1 452 . 1 1 34 34 ILE HB H 1 1.800 0.020 . 1 . . . A 34 ILE HB . 18934 1 453 . 1 1 34 34 ILE HG12 H 1 1.695 0.020 . 1 . . . A 34 ILE HG12 . 18934 1 454 . 1 1 34 34 ILE HG13 H 1 1.695 0.020 . 1 . . . A 34 ILE HG13 . 18934 1 455 . 1 1 34 34 ILE HG21 H 1 0.624 0.020 . 1 . . . A 34 ILE HG21 . 18934 1 456 . 1 1 34 34 ILE HG22 H 1 0.624 0.020 . 1 . . . A 34 ILE HG22 . 18934 1 457 . 1 1 34 34 ILE HG23 H 1 0.624 0.020 . 1 . . . A 34 ILE HG23 . 18934 1 458 . 1 1 34 34 ILE HD11 H 1 0.805 0.020 . 1 . . . A 34 ILE HD11 . 18934 1 459 . 1 1 34 34 ILE HD12 H 1 0.805 0.020 . 1 . . . A 34 ILE HD12 . 18934 1 460 . 1 1 34 34 ILE HD13 H 1 0.805 0.020 . 1 . . . A 34 ILE HD13 . 18934 1 461 . 1 1 34 34 ILE C C 13 172.867 0.3 . 1 . . . A 34 ILE C . 18934 1 462 . 1 1 34 34 ILE CA C 13 58.169 0.3 . 1 . . . A 34 ILE CA . 18934 1 463 . 1 1 34 34 ILE CB C 13 37.310 0.3 . 1 . . . A 34 ILE CB . 18934 1 464 . 1 1 34 34 ILE CG1 C 13 24.456 0.3 . 1 . . . A 34 ILE CG1 . 18934 1 465 . 1 1 34 34 ILE CG2 C 13 15.293 0.3 . 1 . . . A 34 ILE CG2 . 18934 1 466 . 1 1 34 34 ILE CD1 C 13 13.267 0.3 . 1 . . . A 34 ILE CD1 . 18934 1 467 . 1 1 34 34 ILE N N 15 119.203 0.3 . 1 . . . A 34 ILE N . 18934 1 468 . 1 1 35 35 VAL H H 1 9.546 0.020 . 1 . . . A 35 VAL H . 18934 1 469 . 1 1 35 35 VAL HA H 1 4.346 0.020 . 1 . . . A 35 VAL HA . 18934 1 470 . 1 1 35 35 VAL HB H 1 1.897 0.020 . 1 . . . A 35 VAL HB . 18934 1 471 . 1 1 35 35 VAL HG11 H 1 0.859 0.020 . 1 . . . A 35 VAL HG11 . 18934 1 472 . 1 1 35 35 VAL HG12 H 1 0.859 0.020 . 1 . . . A 35 VAL HG12 . 18934 1 473 . 1 1 35 35 VAL HG13 H 1 0.859 0.020 . 1 . . . A 35 VAL HG13 . 18934 1 474 . 1 1 35 35 VAL HG21 H 1 0.784 0.020 . 1 . . . A 35 VAL HG21 . 18934 1 475 . 1 1 35 35 VAL HG22 H 1 0.784 0.020 . 1 . . . A 35 VAL HG22 . 18934 1 476 . 1 1 35 35 VAL HG23 H 1 0.784 0.020 . 1 . . . A 35 VAL HG23 . 18934 1 477 . 1 1 35 35 VAL C C 13 172.386 0.3 . 1 . . . A 35 VAL C . 18934 1 478 . 1 1 35 35 VAL CA C 13 57.727 0.3 . 1 . . . A 35 VAL CA . 18934 1 479 . 1 1 35 35 VAL CB C 13 32.986 0.3 . 1 . . . A 35 VAL CB . 18934 1 480 . 1 1 35 35 VAL CG1 C 13 17.761 0.3 . 1 . . . A 35 VAL CG1 . 18934 1 481 . 1 1 35 35 VAL CG2 C 13 17.530 0.3 . 1 . . . A 35 VAL CG2 . 18934 1 482 . 1 1 35 35 VAL N N 15 128.698 0.3 . 1 . . . A 35 VAL N . 18934 1 483 . 1 1 36 36 ALA H H 1 8.742 0.020 . 1 . . . A 36 ALA H . 18934 1 484 . 1 1 36 36 ALA HA H 1 4.573 0.020 . 1 . . . A 36 ALA HA . 18934 1 485 . 1 1 36 36 ALA HB1 H 1 1.327 0.020 . 1 . . . A 36 ALA HB1 . 18934 1 486 . 1 1 36 36 ALA HB2 H 1 1.327 0.020 . 1 . . . A 36 ALA HB2 . 18934 1 487 . 1 1 36 36 ALA HB3 H 1 1.327 0.020 . 1 . . . A 36 ALA HB3 . 18934 1 488 . 1 1 36 36 ALA C C 13 174.036 0.3 . 1 . . . A 36 ALA C . 18934 1 489 . 1 1 36 36 ALA CA C 13 50.355 0.3 . 1 . . . A 36 ALA CA . 18934 1 490 . 1 1 36 36 ALA CB C 13 16.239 0.3 . 1 . . . A 36 ALA CB . 18934 1 491 . 1 1 36 36 ALA N N 15 129.945 0.3 . 1 . . . A 36 ALA N . 18934 1 492 . 1 1 37 37 VAL H H 1 8.395 0.020 . 1 . . . A 37 VAL H . 18934 1 493 . 1 1 37 37 VAL HA H 1 4.558 0.020 . 1 . . . A 37 VAL HA . 18934 1 494 . 1 1 37 37 VAL HB H 1 1.884 0.020 . 1 . . . A 37 VAL HB . 18934 1 495 . 1 1 37 37 VAL HG11 H 1 0.800 0.020 . 1 . . . A 37 VAL HG11 . 18934 1 496 . 1 1 37 37 VAL HG12 H 1 0.800 0.020 . 1 . . . A 37 VAL HG12 . 18934 1 497 . 1 1 37 37 VAL HG13 H 1 0.800 0.020 . 1 . . . A 37 VAL HG13 . 18934 1 498 . 1 1 37 37 VAL HG21 H 1 0.380 0.020 . 1 . . . A 37 VAL HG21 . 18934 1 499 . 1 1 37 37 VAL HG22 H 1 0.380 0.020 . 1 . . . A 37 VAL HG22 . 18934 1 500 . 1 1 37 37 VAL HG23 H 1 0.380 0.020 . 1 . . . A 37 VAL HG23 . 18934 1 501 . 1 1 37 37 VAL C C 13 172.240 0.3 . 1 . . . A 37 VAL C . 18934 1 502 . 1 1 37 37 VAL CA C 13 57.153 0.3 . 1 . . . A 37 VAL CA . 18934 1 503 . 1 1 37 37 VAL CB C 13 30.302 0.3 . 1 . . . A 37 VAL CB . 18934 1 504 . 1 1 37 37 VAL CG1 C 13 20.298 0.3 . 1 . . . A 37 VAL CG1 . 18934 1 505 . 1 1 37 37 VAL CG2 C 13 15.154 0.3 . 1 . . . A 37 VAL CG2 . 18934 1 506 . 1 1 37 37 VAL N N 15 116.124 0.3 . 1 . . . A 37 VAL N . 18934 1 507 . 1 1 38 38 GLY H H 1 8.191 0.020 . 1 . . . A 38 GLY H . 18934 1 508 . 1 1 38 38 GLY HA2 H 1 4.798 0.020 . 2 . . . A 38 GLY HA2 . 18934 1 509 . 1 1 38 38 GLY HA3 H 1 4.425 0.020 . 2 . . . A 38 GLY HA3 . 18934 1 510 . 1 1 38 38 GLY C C 13 171.906 0.3 . 1 . . . A 38 GLY C . 18934 1 511 . 1 1 38 38 GLY CA C 13 43.561 0.3 . 1 . . . A 38 GLY CA . 18934 1 512 . 1 1 38 38 GLY N N 15 108.362 0.3 . 1 . . . A 38 GLY N . 18934 1 513 . 1 1 39 39 SER H H 1 8.284 0.020 . 1 . . . A 39 SER H . 18934 1 514 . 1 1 39 39 SER HA H 1 4.274 0.020 . 1 . . . A 39 SER HA . 18934 1 515 . 1 1 39 39 SER HB2 H 1 3.787 0.020 . 1 . . . A 39 SER HB2 . 18934 1 516 . 1 1 39 39 SER HB3 H 1 3.787 0.020 . 1 . . . A 39 SER HB3 . 18934 1 517 . 1 1 39 39 SER CA C 13 58.288 0.3 . 1 . . . A 39 SER CA . 18934 1 518 . 1 1 39 39 SER CB C 13 60.047 0.3 . 1 . . . A 39 SER CB . 18934 1 519 . 1 1 39 39 SER N N 15 116.236 0.3 . 1 . . . A 39 SER N . 18934 1 520 . 1 1 40 40 LEU H H 1 8.456 0.020 . 1 . . . A 40 LEU H . 18934 1 521 . 1 1 40 40 LEU HA H 1 4.074 0.020 . 1 . . . A 40 LEU HA . 18934 1 522 . 1 1 40 40 LEU HB2 H 1 1.967 0.020 . 1 . . . A 40 LEU HB2 . 18934 1 523 . 1 1 40 40 LEU HB3 H 1 1.967 0.020 . 1 . . . A 40 LEU HB3 . 18934 1 524 . 1 1 40 40 LEU HG H 1 1.548 0.020 . 1 . . . A 40 LEU HG . 18934 1 525 . 1 1 40 40 LEU HD11 H 1 0.792 0.020 . 1 . . . A 40 LEU HD11 . 18934 1 526 . 1 1 40 40 LEU HD12 H 1 0.792 0.020 . 1 . . . A 40 LEU HD12 . 18934 1 527 . 1 1 40 40 LEU HD13 H 1 0.792 0.020 . 1 . . . A 40 LEU HD13 . 18934 1 528 . 1 1 40 40 LEU HD21 H 1 0.743 0.020 . 1 . . . A 40 LEU HD21 . 18934 1 529 . 1 1 40 40 LEU HD22 H 1 0.743 0.020 . 1 . . . A 40 LEU HD22 . 18934 1 530 . 1 1 40 40 LEU HD23 H 1 0.743 0.020 . 1 . . . A 40 LEU HD23 . 18934 1 531 . 1 1 40 40 LEU C C 13 178.212 0.3 . 1 . . . A 40 LEU C . 18934 1 532 . 1 1 40 40 LEU CA C 13 56.705 0.3 . 1 . . . A 40 LEU CA . 18934 1 533 . 1 1 40 40 LEU CB C 13 39.994 0.3 . 1 . . . A 40 LEU CB . 18934 1 534 . 1 1 40 40 LEU CG C 13 25.435 0.3 . 1 . . . A 40 LEU CG . 18934 1 535 . 1 1 40 40 LEU CD1 C 13 23.957 0.3 . 1 . . . A 40 LEU CD1 . 18934 1 536 . 1 1 40 40 LEU CD2 C 13 23.639 0.3 . 1 . . . A 40 LEU CD2 . 18934 1 537 . 1 1 40 40 LEU N N 15 122.630 0.3 . 1 . . . A 40 LEU N . 18934 1 538 . 1 1 41 41 ARG H H 1 6.917 0.020 . 1 . . . A 41 ARG H . 18934 1 539 . 1 1 41 41 ARG HA H 1 3.951 0.020 . 1 . . . A 41 ARG HA . 18934 1 540 . 1 1 41 41 ARG HB2 H 1 1.777 0.020 . 1 . . . A 41 ARG HB2 . 18934 1 541 . 1 1 41 41 ARG HB3 H 1 1.777 0.020 . 1 . . . A 41 ARG HB3 . 18934 1 542 . 1 1 41 41 ARG HG2 H 1 1.555 0.020 . 1 . . . A 41 ARG HG2 . 18934 1 543 . 1 1 41 41 ARG HG3 H 1 1.555 0.020 . 1 . . . A 41 ARG HG3 . 18934 1 544 . 1 1 41 41 ARG HD2 H 1 2.904 0.020 . 1 . . . A 41 ARG HD2 . 18934 1 545 . 1 1 41 41 ARG HD3 H 1 2.904 0.020 . 1 . . . A 41 ARG HD3 . 18934 1 546 . 1 1 41 41 ARG C C 13 174.245 0.3 . 1 . . . A 41 ARG C . 18934 1 547 . 1 1 41 41 ARG CA C 13 56.250 0.3 . 1 . . . A 41 ARG CA . 18934 1 548 . 1 1 41 41 ARG CB C 13 26.649 0.3 . 1 . . . A 41 ARG CB . 18934 1 549 . 1 1 41 41 ARG CG C 13 26.458 0.3 . 1 . . . A 41 ARG CG . 18934 1 550 . 1 1 41 41 ARG N N 15 121.383 0.3 . 1 . . . A 41 ARG N . 18934 1 551 . 1 1 42 42 ARG H H 1 6.954 0.020 . 1 . . . A 42 ARG H . 18934 1 552 . 1 1 42 42 ARG HA H 1 3.627 0.020 . 1 . . . A 42 ARG HA . 18934 1 553 . 1 1 42 42 ARG HB2 H 1 1.916 0.020 . 2 . . . A 42 ARG HB2 . 18934 1 554 . 1 1 42 42 ARG HB3 H 1 1.779 0.020 . 2 . . . A 42 ARG HB3 . 18934 1 555 . 1 1 42 42 ARG HG2 H 1 2.100 0.020 . 1 . . . A 42 ARG HG2 . 18934 1 556 . 1 1 42 42 ARG HG3 H 1 2.100 0.020 . 1 . . . A 42 ARG HG3 . 18934 1 557 . 1 1 42 42 ARG HD2 H 1 2.195 0.020 . 1 . . . A 42 ARG HD2 . 18934 1 558 . 1 1 42 42 ARG HD3 H 1 2.195 0.020 . 1 . . . A 42 ARG HD3 . 18934 1 559 . 1 1 42 42 ARG HE H 1 7.935 0.020 . 1 . . . A 42 ARG HE . 18934 1 560 . 1 1 42 42 ARG C C 13 170.006 0.3 . 1 . . . A 42 ARG C . 18934 1 561 . 1 1 42 42 ARG CA C 13 54.777 0.3 . 1 . . . A 42 ARG CA . 18934 1 562 . 1 1 42 42 ARG CB C 13 27.544 0.3 . 1 . . . A 42 ARG CB . 18934 1 563 . 1 1 42 42 ARG CG C 13 33.885 0.3 . 1 . . . A 42 ARG CG . 18934 1 564 . 1 1 42 42 ARG CD C 13 34.131 0.3 . 1 . . . A 42 ARG CD . 18934 1 565 . 1 1 42 42 ARG N N 15 112.879 0.3 . 1 . . . A 42 ARG N . 18934 1 566 . 1 1 42 42 ARG NE N 15 83.330 0.3 . 1 . . . A 42 ARG NE . 18934 1 567 . 1 1 43 43 GLU H H 1 7.721 0.020 . 1 . . . A 43 GLU H . 18934 1 568 . 1 1 43 43 GLU HA H 1 3.642 0.020 . 1 . . . A 43 GLU HA . 18934 1 569 . 1 1 43 43 GLU HB2 H 1 2.112 0.020 . 1 . . . A 43 GLU HB2 . 18934 1 570 . 1 1 43 43 GLU HB3 H 1 2.112 0.020 . 1 . . . A 43 GLU HB3 . 18934 1 571 . 1 1 43 43 GLU HG2 H 1 2.075 0.020 . 1 . . . A 43 GLU HG2 . 18934 1 572 . 1 1 43 43 GLU HG3 H 1 2.075 0.020 . 1 . . . A 43 GLU HG3 . 18934 1 573 . 1 1 43 43 GLU C C 13 173.159 0.3 . 1 . . . A 43 GLU C . 18934 1 574 . 1 1 43 43 GLU CA C 13 54.323 0.3 . 1 . . . A 43 GLU CA . 18934 1 575 . 1 1 43 43 GLU CB C 13 23.369 0.3 . 1 . . . A 43 GLU CB . 18934 1 576 . 1 1 43 43 GLU CG C 13 34.062 0.3 . 1 . . . A 43 GLU CG . 18934 1 577 . 1 1 43 43 GLU N N 15 112.553 0.3 . 1 . . . A 43 GLU N . 18934 1 578 . 1 1 44 44 GLU H H 1 7.264 0.020 . 1 . . . A 44 GLU H . 18934 1 579 . 1 1 44 44 GLU HA H 1 4.121 0.020 . 1 . . . A 44 GLU HA . 18934 1 580 . 1 1 44 44 GLU HB2 H 1 2.210 0.020 . 1 . . . A 44 GLU HB2 . 18934 1 581 . 1 1 44 44 GLU HB3 H 1 2.210 0.020 . 1 . . . A 44 GLU HB3 . 18934 1 582 . 1 1 44 44 GLU HG2 H 1 2.350 0.020 . 1 . . . A 44 GLU HG2 . 18934 1 583 . 1 1 44 44 GLU HG3 H 1 2.350 0.020 . 1 . . . A 44 GLU HG3 . 18934 1 584 . 1 1 44 44 GLU C C 13 172.115 0.3 . 1 . . . A 44 GLU C . 18934 1 585 . 1 1 44 44 GLU CA C 13 54.889 0.3 . 1 . . . A 44 GLU CA . 18934 1 586 . 1 1 44 44 GLU CB C 13 26.202 0.3 . 1 . . . A 44 GLU CB . 18934 1 587 . 1 1 44 44 GLU CG C 13 35.031 0.3 . 1 . . . A 44 GLU CG . 18934 1 588 . 1 1 44 44 GLU N N 15 119.124 0.3 . 1 . . . A 44 GLU N . 18934 1 589 . 1 1 45 45 LYS H H 1 7.949 0.020 . 1 . . . A 45 LYS H . 18934 1 590 . 1 1 45 45 LYS HA H 1 3.839 0.020 . 1 . . . A 45 LYS HA . 18934 1 591 . 1 1 45 45 LYS HB2 H 1 1.838 0.020 . 1 . . . A 45 LYS HB2 . 18934 1 592 . 1 1 45 45 LYS HB3 H 1 1.838 0.020 . 1 . . . A 45 LYS HB3 . 18934 1 593 . 1 1 45 45 LYS HG2 H 1 1.487 0.020 . 2 . . . A 45 LYS HG2 . 18934 1 594 . 1 1 45 45 LYS HG3 H 1 1.595 0.020 . 2 . . . A 45 LYS HG3 . 18934 1 595 . 1 1 45 45 LYS HD2 H 1 1.721 0.020 . 1 . . . A 45 LYS HD2 . 18934 1 596 . 1 1 45 45 LYS HD3 H 1 1.721 0.020 . 1 . . . A 45 LYS HD3 . 18934 1 597 . 1 1 45 45 LYS HE2 H 1 3.025 0.020 . 1 . . . A 45 LYS HE2 . 18934 1 598 . 1 1 45 45 LYS HE3 H 1 3.025 0.020 . 1 . . . A 45 LYS HE3 . 18934 1 599 . 1 1 45 45 LYS C C 13 174.871 0.3 . 1 . . . A 45 LYS C . 18934 1 600 . 1 1 45 45 LYS CA C 13 57.154 0.3 . 1 . . . A 45 LYS CA . 18934 1 601 . 1 1 45 45 LYS CB C 13 30.451 0.3 . 1 . . . A 45 LYS CB . 18934 1 602 . 1 1 45 45 LYS CG C 13 22.866 0.3 . 1 . . . A 45 LYS CG . 18934 1 603 . 1 1 45 45 LYS CD C 13 26.522 0.3 . 1 . . . A 45 LYS CD . 18934 1 604 . 1 1 45 45 LYS CE C 13 39.463 0.3 . 1 . . . A 45 LYS CE . 18934 1 605 . 1 1 45 45 LYS N N 15 115.473 0.3 . 1 . . . A 45 LYS N . 18934 1 606 . 1 1 46 46 MET H H 1 7.650 0.020 . 1 . . . A 46 MET H . 18934 1 607 . 1 1 46 46 MET HA H 1 5.105 0.020 . 1 . . . A 46 MET HA . 18934 1 608 . 1 1 46 46 MET HB2 H 1 1.837 0.020 . 1 . . . A 46 MET HB2 . 18934 1 609 . 1 1 46 46 MET HB3 H 1 1.837 0.020 . 1 . . . A 46 MET HB3 . 18934 1 610 . 1 1 46 46 MET HG2 H 1 2.616 0.020 . 2 . . . A 46 MET HG2 . 18934 1 611 . 1 1 46 46 MET HG3 H 1 2.342 0.020 . 2 . . . A 46 MET HG3 . 18934 1 612 . 1 1 46 46 MET C C 13 171.363 0.3 . 1 . . . A 46 MET C . 18934 1 613 . 1 1 46 46 MET CA C 13 49.675 0.3 . 1 . . . A 46 MET CA . 18934 1 614 . 1 1 46 46 MET CB C 13 31.569 0.3 . 1 . . . A 46 MET CB . 18934 1 615 . 1 1 46 46 MET CG C 13 29.284 0.3 . 1 . . . A 46 MET CG . 18934 1 616 . 1 1 46 46 MET N N 15 115.233 0.3 . 1 . . . A 46 MET N . 18934 1 617 . 1 1 47 47 LEU H H 1 9.479 0.020 . 1 . . . A 47 LEU H . 18934 1 618 . 1 1 47 47 LEU HA H 1 4.759 0.020 . 1 . . . A 47 LEU HA . 18934 1 619 . 1 1 47 47 LEU HB2 H 1 1.529 0.020 . 1 . . . A 47 LEU HB2 . 18934 1 620 . 1 1 47 47 LEU HB3 H 1 1.529 0.020 . 1 . . . A 47 LEU HB3 . 18934 1 621 . 1 1 47 47 LEU HG H 1 1.376 0.020 . 1 . . . A 47 LEU HG . 18934 1 622 . 1 1 47 47 LEU HD11 H 1 0.800 0.020 . 1 . . . A 47 LEU HD11 . 18934 1 623 . 1 1 47 47 LEU HD12 H 1 0.800 0.020 . 1 . . . A 47 LEU HD12 . 18934 1 624 . 1 1 47 47 LEU HD13 H 1 0.800 0.020 . 1 . . . A 47 LEU HD13 . 18934 1 625 . 1 1 47 47 LEU HD21 H 1 0.725 0.020 . 1 . . . A 47 LEU HD21 . 18934 1 626 . 1 1 47 47 LEU HD22 H 1 0.725 0.020 . 1 . . . A 47 LEU HD22 . 18934 1 627 . 1 1 47 47 LEU HD23 H 1 0.725 0.020 . 1 . . . A 47 LEU HD23 . 18934 1 628 . 1 1 47 47 LEU C C 13 171.364 0.3 . 1 . . . A 47 LEU C . 18934 1 629 . 1 1 47 47 LEU CA C 13 49.498 0.3 . 1 . . . A 47 LEU CA . 18934 1 630 . 1 1 47 47 LEU CB C 13 41.335 0.3 . 1 . . . A 47 LEU CB . 18934 1 631 . 1 1 47 47 LEU CG C 13 24.900 0.3 . 1 . . . A 47 LEU CG . 18934 1 632 . 1 1 47 47 LEU CD1 C 13 24.919 0.3 . 1 . . . A 47 LEU CD1 . 18934 1 633 . 1 1 47 47 LEU CD2 C 13 20.376 0.3 . 1 . . . A 47 LEU CD2 . 18934 1 634 . 1 1 47 47 LEU N N 15 120.733 0.3 . 1 . . . A 47 LEU N . 18934 1 635 . 1 1 48 48 ASN H H 1 10.097 0.020 . 1 . . . A 48 ASN H . 18934 1 636 . 1 1 48 48 ASN HA H 1 4.530 0.020 . 1 . . . A 48 ASN HA . 18934 1 637 . 1 1 48 48 ASN HB2 H 1 2.800 0.020 . 1 . . . A 48 ASN HB2 . 18934 1 638 . 1 1 48 48 ASN HB3 H 1 2.800 0.020 . 1 . . . A 48 ASN HB3 . 18934 1 639 . 1 1 48 48 ASN C C 13 171.112 0.3 . 1 . . . A 48 ASN C . 18934 1 640 . 1 1 48 48 ASN CA C 13 53.078 0.3 . 1 . . . A 48 ASN CA . 18934 1 641 . 1 1 48 48 ASN CB C 13 35.744 0.3 . 1 . . . A 48 ASN CB . 18934 1 642 . 1 1 48 48 ASN N N 15 123.092 0.3 . 1 . . . A 48 ASN N . 18934 1 643 . 1 1 49 49 ASP H H 1 7.760 0.020 . 1 . . . A 49 ASP H . 18934 1 644 . 1 1 49 49 ASP HA H 1 4.250 0.020 . 1 . . . A 49 ASP HA . 18934 1 645 . 1 1 49 49 ASP HB2 H 1 2.730 0.020 . 1 . . . A 49 ASP HB2 . 18934 1 646 . 1 1 49 49 ASP HB3 H 1 2.730 0.020 . 1 . . . A 49 ASP HB3 . 18934 1 647 . 1 1 49 49 ASP CA C 13 48.890 0.3 . 1 . . . A 49 ASP CA . 18934 1 648 . 1 1 49 49 ASP CB C 13 38.801 0.3 . 1 . . . A 49 ASP CB . 18934 1 649 . 1 1 49 49 ASP N N 15 119.467 0.3 . 1 . . . A 49 ASP N . 18934 1 650 . 1 1 50 50 VAL H H 1 7.772 0.020 . 1 . . . A 50 VAL H . 18934 1 651 . 1 1 50 50 VAL HA H 1 4.072 0.020 . 1 . . . A 50 VAL HA . 18934 1 652 . 1 1 50 50 VAL HB H 1 1.760 0.020 . 1 . . . A 50 VAL HB . 18934 1 653 . 1 1 50 50 VAL HG11 H 1 0.538 0.020 . 1 . . . A 50 VAL HG11 . 18934 1 654 . 1 1 50 50 VAL HG12 H 1 0.538 0.020 . 1 . . . A 50 VAL HG12 . 18934 1 655 . 1 1 50 50 VAL HG13 H 1 0.538 0.020 . 1 . . . A 50 VAL HG13 . 18934 1 656 . 1 1 50 50 VAL HG21 H 1 0.664 0.020 . 1 . . . A 50 VAL HG21 . 18934 1 657 . 1 1 50 50 VAL HG22 H 1 0.664 0.020 . 1 . . . A 50 VAL HG22 . 18934 1 658 . 1 1 50 50 VAL HG23 H 1 0.664 0.020 . 1 . . . A 50 VAL HG23 . 18934 1 659 . 1 1 50 50 VAL C C 13 170.089 0.3 . 1 . . . A 50 VAL C . 18934 1 660 . 1 1 50 50 VAL CA C 13 59.990 0.3 . 1 . . . A 50 VAL CA . 18934 1 661 . 1 1 50 50 VAL CB C 13 30.451 0.3 . 1 . . . A 50 VAL CB . 18934 1 662 . 1 1 50 50 VAL CG1 C 13 18.997 0.3 . 1 . . . A 50 VAL CG1 . 18934 1 663 . 1 1 50 50 VAL CG2 C 13 18.714 0.3 . 1 . . . A 50 VAL CG2 . 18934 1 664 . 1 1 50 50 VAL N N 15 117.395 0.3 . 1 . . . A 50 VAL N . 18934 1 665 . 1 1 51 51 ASP H H 1 8.604 0.020 . 1 . . . A 51 ASP H . 18934 1 666 . 1 1 51 51 ASP HA H 1 5.450 0.020 . 1 . . . A 51 ASP HA . 18934 1 667 . 1 1 51 51 ASP HB2 H 1 2.375 0.020 . 2 . . . A 51 ASP HB2 . 18934 1 668 . 1 1 51 51 ASP HB3 H 1 2.420 0.020 . 2 . . . A 51 ASP HB3 . 18934 1 669 . 1 1 51 51 ASP CA C 13 50.585 0.3 . 1 . . . A 51 ASP CA . 18934 1 670 . 1 1 51 51 ASP CB C 13 40.739 0.3 . 1 . . . A 51 ASP CB . 18934 1 671 . 1 1 51 51 ASP N N 15 126.344 0.3 . 1 . . . A 51 ASP N . 18934 1 672 . 1 1 52 52 LEU H H 1 9.454 0.020 . 1 . . . A 52 LEU H . 18934 1 673 . 1 1 52 52 LEU HA H 1 4.793 0.020 . 1 . . . A 52 LEU HA . 18934 1 674 . 1 1 52 52 LEU HB2 H 1 1.442 0.020 . 2 . . . A 52 LEU HB2 . 18934 1 675 . 1 1 52 52 LEU HB3 H 1 1.355 0.020 . 2 . . . A 52 LEU HB3 . 18934 1 676 . 1 1 52 52 LEU HG H 1 1.335 0.020 . 1 . . . A 52 LEU HG . 18934 1 677 . 1 1 52 52 LEU HD11 H 1 0.579 0.020 . 1 . . . A 52 LEU HD11 . 18934 1 678 . 1 1 52 52 LEU HD12 H 1 0.579 0.020 . 1 . . . A 52 LEU HD12 . 18934 1 679 . 1 1 52 52 LEU HD13 H 1 0.579 0.020 . 1 . . . A 52 LEU HD13 . 18934 1 680 . 1 1 52 52 LEU HD21 H 1 0.637 0.020 . 1 . . . A 52 LEU HD21 . 18934 1 681 . 1 1 52 52 LEU HD22 H 1 0.637 0.020 . 1 . . . A 52 LEU HD22 . 18934 1 682 . 1 1 52 52 LEU HD23 H 1 0.637 0.020 . 1 . . . A 52 LEU HD23 . 18934 1 683 . 1 1 52 52 LEU C C 13 170.298 0.3 . 1 . . . A 52 LEU C . 18934 1 684 . 1 1 52 52 LEU CA C 13 50.698 0.3 . 1 . . . A 52 LEU CA . 18934 1 685 . 1 1 52 52 LEU CB C 13 43.572 0.3 . 1 . . . A 52 LEU CB . 18934 1 686 . 1 1 52 52 LEU CG C 13 23.369 0.3 . 1 . . . A 52 LEU CG . 18934 1 687 . 1 1 52 52 LEU CD1 C 13 22.472 0.3 . 1 . . . A 52 LEU CD1 . 18934 1 688 . 1 1 52 52 LEU CD2 C 13 21.708 0.3 . 1 . . . A 52 LEU CD2 . 18934 1 689 . 1 1 52 52 LEU N N 15 123.955 0.3 . 1 . . . A 52 LEU N . 18934 1 690 . 1 1 53 53 LEU H H 1 9.083 0.020 . 1 . . . A 53 LEU H . 18934 1 691 . 1 1 53 53 LEU HA H 1 4.799 0.020 . 1 . . . A 53 LEU HA . 18934 1 692 . 1 1 53 53 LEU HB2 H 1 2.013 0.020 . 1 . . . A 53 LEU HB2 . 18934 1 693 . 1 1 53 53 LEU HB3 H 1 2.013 0.020 . 1 . . . A 53 LEU HB3 . 18934 1 694 . 1 1 53 53 LEU HG H 1 1.267 0.020 . 1 . . . A 53 LEU HG . 18934 1 695 . 1 1 53 53 LEU HD11 H 1 0.640 0.020 . 1 . . . A 53 LEU HD11 . 18934 1 696 . 1 1 53 53 LEU HD12 H 1 0.640 0.020 . 1 . . . A 53 LEU HD12 . 18934 1 697 . 1 1 53 53 LEU HD13 H 1 0.640 0.020 . 1 . . . A 53 LEU HD13 . 18934 1 698 . 1 1 53 53 LEU HD21 H 1 0.663 0.020 . 1 . . . A 53 LEU HD21 . 18934 1 699 . 1 1 53 53 LEU HD22 H 1 0.663 0.020 . 1 . . . A 53 LEU HD22 . 18934 1 700 . 1 1 53 53 LEU HD23 H 1 0.663 0.020 . 1 . . . A 53 LEU HD23 . 18934 1 701 . 1 1 53 53 LEU CA C 13 50.591 0.3 . 1 . . . A 53 LEU CA . 18934 1 702 . 1 1 53 53 LEU CB C 13 42.901 0.3 . 1 . . . A 53 LEU CB . 18934 1 703 . 1 1 53 53 LEU CG C 13 24.021 0.3 . 1 . . . A 53 LEU CG . 18934 1 704 . 1 1 53 53 LEU CD1 C 13 21.183 0.3 . 1 . . . A 53 LEU CD1 . 18934 1 705 . 1 1 53 53 LEU CD2 C 13 25.026 0.3 . 1 . . . A 53 LEU CD2 . 18934 1 706 . 1 1 53 53 LEU N N 15 125.210 0.3 . 1 . . . A 53 LEU N . 18934 1 707 . 1 1 54 54 ILE H H 1 9.297 0.020 . 1 . . . A 54 ILE H . 18934 1 708 . 1 1 54 54 ILE HA H 1 4.813 0.020 . 1 . . . A 54 ILE HA . 18934 1 709 . 1 1 54 54 ILE HB H 1 1.690 0.020 . 1 . . . A 54 ILE HB . 18934 1 710 . 1 1 54 54 ILE HG12 H 1 1.387 0.020 . 2 . . . A 54 ILE HG12 . 18934 1 711 . 1 1 54 54 ILE HG13 H 1 0.950 0.020 . 2 . . . A 54 ILE HG13 . 18934 1 712 . 1 1 54 54 ILE HG21 H 1 0.665 0.020 . 1 . . . A 54 ILE HG21 . 18934 1 713 . 1 1 54 54 ILE HG22 H 1 0.665 0.020 . 1 . . . A 54 ILE HG22 . 18934 1 714 . 1 1 54 54 ILE HG23 H 1 0.665 0.020 . 1 . . . A 54 ILE HG23 . 18934 1 715 . 1 1 54 54 ILE HD11 H 1 0.623 0.020 . 1 . . . A 54 ILE HD11 . 18934 1 716 . 1 1 54 54 ILE HD12 H 1 0.623 0.020 . 1 . . . A 54 ILE HD12 . 18934 1 717 . 1 1 54 54 ILE HD13 H 1 0.623 0.020 . 1 . . . A 54 ILE HD13 . 18934 1 718 . 1 1 54 54 ILE C C 13 172.261 0.3 . 1 . . . A 54 ILE C . 18934 1 719 . 1 1 54 54 ILE CA C 13 56.475 0.3 . 1 . . . A 54 ILE CA . 18934 1 720 . 1 1 54 54 ILE CB C 13 37.012 0.3 . 1 . . . A 54 ILE CB . 18934 1 721 . 1 1 54 54 ILE CG1 C 13 24.782 0.3 . 1 . . . A 54 ILE CG1 . 18934 1 722 . 1 1 54 54 ILE CG2 C 13 14.910 0.3 . 1 . . . A 54 ILE CG2 . 18934 1 723 . 1 1 54 54 ILE CD1 C 13 11.461 0.3 . 1 . . . A 54 ILE CD1 . 18934 1 724 . 1 1 54 54 ILE N N 15 127.066 0.3 . 1 . . . A 54 ILE N . 18934 1 725 . 1 1 55 55 ILE H H 1 9.243 0.020 . 1 . . . A 55 ILE H . 18934 1 726 . 1 1 55 55 ILE HA H 1 4.679 0.020 . 1 . . . A 55 ILE HA . 18934 1 727 . 1 1 55 55 ILE HB H 1 1.948 0.020 . 1 . . . A 55 ILE HB . 18934 1 728 . 1 1 55 55 ILE HG12 H 1 1.457 0.020 . 2 . . . A 55 ILE HG12 . 18934 1 729 . 1 1 55 55 ILE HG13 H 1 1.242 0.020 . 2 . . . A 55 ILE HG13 . 18934 1 730 . 1 1 55 55 ILE HG21 H 1 0.688 0.020 . 1 . . . A 55 ILE HG21 . 18934 1 731 . 1 1 55 55 ILE HG22 H 1 0.688 0.020 . 1 . . . A 55 ILE HG22 . 18934 1 732 . 1 1 55 55 ILE HG23 H 1 0.688 0.020 . 1 . . . A 55 ILE HG23 . 18934 1 733 . 1 1 55 55 ILE HD11 H 1 0.614 0.020 . 1 . . . A 55 ILE HD11 . 18934 1 734 . 1 1 55 55 ILE HD12 H 1 0.614 0.020 . 1 . . . A 55 ILE HD12 . 18934 1 735 . 1 1 55 55 ILE HD13 H 1 0.614 0.020 . 1 . . . A 55 ILE HD13 . 18934 1 736 . 1 1 55 55 ILE C C 13 172.867 0.3 . 1 . . . A 55 ILE C . 18934 1 737 . 1 1 55 55 ILE CA C 13 55.457 0.3 . 1 . . . A 55 ILE CA . 18934 1 738 . 1 1 55 55 ILE CB C 13 32.864 0.3 . 1 . . . A 55 ILE CB . 18934 1 739 . 1 1 55 55 ILE CG1 C 13 24.486 0.3 . 1 . . . A 55 ILE CG1 . 18934 1 740 . 1 1 55 55 ILE CG2 C 13 14.964 0.3 . 1 . . . A 55 ILE CG2 . 18934 1 741 . 1 1 55 55 ILE CD1 C 13 8.226 0.3 . 1 . . . A 55 ILE CD1 . 18934 1 742 . 1 1 55 55 ILE N N 15 127.251 0.3 . 1 . . . A 55 ILE N . 18934 1 743 . 1 1 56 56 VAL H H 1 9.175 0.020 . 1 . . . A 56 VAL H . 18934 1 744 . 1 1 56 56 VAL HA H 1 4.294 0.020 . 1 . . . A 56 VAL HA . 18934 1 745 . 1 1 56 56 VAL HB H 1 1.860 0.020 . 1 . . . A 56 VAL HB . 18934 1 746 . 1 1 56 56 VAL HG11 H 1 0.786 0.020 . 1 . . . A 56 VAL HG11 . 18934 1 747 . 1 1 56 56 VAL HG12 H 1 0.786 0.020 . 1 . . . A 56 VAL HG12 . 18934 1 748 . 1 1 56 56 VAL HG13 H 1 0.786 0.020 . 1 . . . A 56 VAL HG13 . 18934 1 749 . 1 1 56 56 VAL HG21 H 1 0.790 0.020 . 1 . . . A 56 VAL HG21 . 18934 1 750 . 1 1 56 56 VAL HG22 H 1 0.790 0.020 . 1 . . . A 56 VAL HG22 . 18934 1 751 . 1 1 56 56 VAL HG23 H 1 0.790 0.020 . 1 . . . A 56 VAL HG23 . 18934 1 752 . 1 1 56 56 VAL CA C 13 56.583 0.3 . 1 . . . A 56 VAL CA . 18934 1 753 . 1 1 56 56 VAL CB C 13 30.675 0.3 . 1 . . . A 56 VAL CB . 18934 1 754 . 1 1 56 56 VAL CG1 C 13 18.586 0.3 . 1 . . . A 56 VAL CG1 . 18934 1 755 . 1 1 56 56 VAL CG2 C 13 19.214 0.3 . 1 . . . A 56 VAL CG2 . 18934 1 756 . 1 1 56 56 VAL N N 15 129.261 0.3 . 1 . . . A 56 VAL N . 18934 1 757 . 1 1 57 57 PRO HA H 1 4.345 0.020 . 1 . . . A 57 PRO HA . 18934 1 758 . 1 1 57 57 PRO HB2 H 1 2.377 0.020 . 2 . . . A 57 PRO HB2 . 18934 1 759 . 1 1 57 57 PRO HB3 H 1 2.060 0.020 . 2 . . . A 57 PRO HB3 . 18934 1 760 . 1 1 57 57 PRO HG2 H 1 1.768 0.020 . 1 . . . A 57 PRO HG2 . 18934 1 761 . 1 1 57 57 PRO HG3 H 1 1.768 0.020 . 1 . . . A 57 PRO HG3 . 18934 1 762 . 1 1 57 57 PRO HD2 H 1 3.848 0.020 . 1 . . . A 57 PRO HD2 . 18934 1 763 . 1 1 57 57 PRO HD3 H 1 3.848 0.020 . 1 . . . A 57 PRO HD3 . 18934 1 764 . 1 1 57 57 PRO C C 13 173.728 0.3 . 1 . . . A 57 PRO C . 18934 1 765 . 1 1 57 57 PRO CA C 13 62.249 0.3 . 1 . . . A 57 PRO CA . 18934 1 766 . 1 1 57 57 PRO CB C 13 30.015 0.3 . 1 . . . A 57 PRO CB . 18934 1 767 . 1 1 58 58 GLU H H 1 6.736 0.020 . 1 . . . A 58 GLU H . 18934 1 768 . 1 1 58 58 GLU HA H 1 4.729 0.020 . 1 . . . A 58 GLU HA . 18934 1 769 . 1 1 58 58 GLU HB2 H 1 2.067 0.020 . 2 . . . A 58 GLU HB2 . 18934 1 770 . 1 1 58 58 GLU HB3 H 1 1.873 0.020 . 2 . . . A 58 GLU HB3 . 18934 1 771 . 1 1 58 58 GLU HG2 H 1 2.246 0.020 . 1 . . . A 58 GLU HG2 . 18934 1 772 . 1 1 58 58 GLU HG3 H 1 2.246 0.020 . 1 . . . A 58 GLU HG3 . 18934 1 773 . 1 1 58 58 GLU C C 13 173.180 0.3 . 1 . . . A 58 GLU C . 18934 1 774 . 1 1 58 58 GLU CA C 13 51.987 0.3 . 1 . . . A 58 GLU CA . 18934 1 775 . 1 1 58 58 GLU CB C 13 29.787 0.3 . 1 . . . A 58 GLU CB . 18934 1 776 . 1 1 58 58 GLU CG C 13 33.281 0.3 . 1 . . . A 58 GLU CG . 18934 1 777 . 1 1 58 58 GLU N N 15 113.921 0.3 . 1 . . . A 58 GLU N . 18934 1 778 . 1 1 59 59 LYS H H 1 8.921 0.020 . 1 . . . A 59 LYS H . 18934 1 779 . 1 1 59 59 LYS HA H 1 3.840 0.020 . 1 . . . A 59 LYS HA . 18934 1 780 . 1 1 59 59 LYS HB2 H 1 1.880 0.020 . 1 . . . A 59 LYS HB2 . 18934 1 781 . 1 1 59 59 LYS HB3 H 1 1.880 0.020 . 1 . . . A 59 LYS HB3 . 18934 1 782 . 1 1 59 59 LYS C C 13 176.304 0.3 . 1 . . . A 59 LYS C . 18934 1 783 . 1 1 59 59 LYS CA C 13 57.420 0.3 . 1 . . . A 59 LYS CA . 18934 1 784 . 1 1 59 59 LYS CB C 13 29.558 0.3 . 1 . . . A 59 LYS CB . 18934 1 785 . 1 1 59 59 LYS N N 15 126.244 0.3 . 1 . . . A 59 LYS N . 18934 1 786 . 1 1 60 60 LYS H H 1 8.956 0.020 . 1 . . . A 60 LYS H . 18934 1 787 . 1 1 60 60 LYS HA H 1 4.180 0.020 . 1 . . . A 60 LYS HA . 18934 1 788 . 1 1 60 60 LYS HB2 H 1 1.964 0.020 . 2 . . . A 60 LYS HB2 . 18934 1 789 . 1 1 60 60 LYS HB3 H 1 1.835 0.020 . 2 . . . A 60 LYS HB3 . 18934 1 790 . 1 1 60 60 LYS HG2 H 1 1.221 0.020 . 1 . . . A 60 LYS HG2 . 18934 1 791 . 1 1 60 60 LYS HG3 H 1 1.221 0.020 . 1 . . . A 60 LYS HG3 . 18934 1 792 . 1 1 60 60 LYS HD2 H 1 1.672 0.020 . 1 . . . A 60 LYS HD2 . 18934 1 793 . 1 1 60 60 LYS HD3 H 1 1.672 0.020 . 1 . . . A 60 LYS HD3 . 18934 1 794 . 1 1 60 60 LYS HE2 H 1 2.913 0.020 . 1 . . . A 60 LYS HE2 . 18934 1 795 . 1 1 60 60 LYS HE3 H 1 2.913 0.020 . 1 . . . A 60 LYS HE3 . 18934 1 796 . 1 1 60 60 LYS C C 13 174.224 0.3 . 1 . . . A 60 LYS C . 18934 1 797 . 1 1 60 60 LYS CA C 13 55.838 0.3 . 1 . . . A 60 LYS CA . 18934 1 798 . 1 1 60 60 LYS CB C 13 28.886 0.3 . 1 . . . A 60 LYS CB . 18934 1 799 . 1 1 60 60 LYS CG C 13 22.062 0.3 . 1 . . . A 60 LYS CG . 18934 1 800 . 1 1 60 60 LYS CD C 13 26.740 0.3 . 1 . . . A 60 LYS CD . 18934 1 801 . 1 1 60 60 LYS CE C 13 39.246 0.3 . 1 . . . A 60 LYS CE . 18934 1 802 . 1 1 60 60 LYS N N 15 117.478 0.3 . 1 . . . A 60 LYS N . 18934 1 803 . 1 1 61 61 LEU H H 1 7.313 0.020 . 1 . . . A 61 LEU H . 18934 1 804 . 1 1 61 61 LEU HA H 1 4.181 0.020 . 1 . . . A 61 LEU HA . 18934 1 805 . 1 1 61 61 LEU HB2 H 1 1.611 0.020 . 2 . . . A 61 LEU HB2 . 18934 1 806 . 1 1 61 61 LEU HB3 H 1 1.274 0.020 . 2 . . . A 61 LEU HB3 . 18934 1 807 . 1 1 61 61 LEU HG H 1 1.380 0.020 . 1 . . . A 61 LEU HG . 18934 1 808 . 1 1 61 61 LEU HD11 H 1 0.887 0.020 . 1 . . . A 61 LEU HD11 . 18934 1 809 . 1 1 61 61 LEU HD12 H 1 0.887 0.020 . 1 . . . A 61 LEU HD12 . 18934 1 810 . 1 1 61 61 LEU HD13 H 1 0.887 0.020 . 1 . . . A 61 LEU HD13 . 18934 1 811 . 1 1 61 61 LEU HD21 H 1 0.353 0.020 . 1 . . . A 61 LEU HD21 . 18934 1 812 . 1 1 61 61 LEU HD22 H 1 0.353 0.020 . 1 . . . A 61 LEU HD22 . 18934 1 813 . 1 1 61 61 LEU HD23 H 1 0.353 0.020 . 1 . . . A 61 LEU HD23 . 18934 1 814 . 1 1 61 61 LEU C C 13 175.686 0.3 . 1 . . . A 61 LEU C . 18934 1 815 . 1 1 61 61 LEU CA C 13 52.429 0.3 . 1 . . . A 61 LEU CA . 18934 1 816 . 1 1 61 61 LEU CB C 13 39.397 0.3 . 1 . . . A 61 LEU CB . 18934 1 817 . 1 1 61 61 LEU CG C 13 24.130 0.3 . 1 . . . A 61 LEU CG . 18934 1 818 . 1 1 61 61 LEU CD1 C 13 23.074 0.3 . 1 . . . A 61 LEU CD1 . 18934 1 819 . 1 1 61 61 LEU CD2 C 13 19.010 0.3 . 1 . . . A 61 LEU CD2 . 18934 1 820 . 1 1 61 61 LEU N N 15 115.179 0.3 . 1 . . . A 61 LEU N . 18934 1 821 . 1 1 62 62 LEU H H 1 7.326 0.020 . 1 . . . A 62 LEU H . 18934 1 822 . 1 1 62 62 LEU HA H 1 3.760 0.020 . 1 . . . A 62 LEU HA . 18934 1 823 . 1 1 62 62 LEU HB2 H 1 1.796 0.020 . 2 . . . A 62 LEU HB2 . 18934 1 824 . 1 1 62 62 LEU HB3 H 1 1.542 0.020 . 2 . . . A 62 LEU HB3 . 18934 1 825 . 1 1 62 62 LEU HG H 1 0.838 0.020 . 1 . . . A 62 LEU HG . 18934 1 826 . 1 1 62 62 LEU HD11 H 1 0.796 0.020 . 1 . . . A 62 LEU HD11 . 18934 1 827 . 1 1 62 62 LEU HD12 H 1 0.796 0.020 . 1 . . . A 62 LEU HD12 . 18934 1 828 . 1 1 62 62 LEU HD13 H 1 0.796 0.020 . 1 . . . A 62 LEU HD13 . 18934 1 829 . 1 1 62 62 LEU HD21 H 1 0.785 0.020 . 1 . . . A 62 LEU HD21 . 18934 1 830 . 1 1 62 62 LEU HD22 H 1 0.785 0.020 . 1 . . . A 62 LEU HD22 . 18934 1 831 . 1 1 62 62 LEU HD23 H 1 0.785 0.020 . 1 . . . A 62 LEU HD23 . 18934 1 832 . 1 1 62 62 LEU CA C 13 56.715 0.3 . 1 . . . A 62 LEU CA . 18934 1 833 . 1 1 62 62 LEU CB C 13 39.077 0.3 . 1 . . . A 62 LEU CB . 18934 1 834 . 1 1 62 62 LEU CG C 13 24.130 0.3 . 1 . . . A 62 LEU CG . 18934 1 835 . 1 1 62 62 LEU CD1 C 13 20.989 0.3 . 1 . . . A 62 LEU CD1 . 18934 1 836 . 1 1 62 62 LEU CD2 C 13 21.887 0.3 . 1 . . . A 62 LEU CD2 . 18934 1 837 . 1 1 62 62 LEU N N 15 119.327 0.3 . 1 . . . A 62 LEU N . 18934 1 838 . 1 1 63 63 LYS H H 1 8.123 0.020 . 1 . . . A 63 LYS H . 18934 1 839 . 1 1 63 63 LYS HA H 1 3.924 0.020 . 1 . . . A 63 LYS HA . 18934 1 840 . 1 1 63 63 LYS HB2 H 1 1.528 0.020 . 2 . . . A 63 LYS HB2 . 18934 1 841 . 1 1 63 63 LYS HB3 H 1 1.433 0.020 . 2 . . . A 63 LYS HB3 . 18934 1 842 . 1 1 63 63 LYS HG2 H 1 1.112 0.020 . 2 . . . A 63 LYS HG2 . 18934 1 843 . 1 1 63 63 LYS HG3 H 1 0.669 0.020 . 2 . . . A 63 LYS HG3 . 18934 1 844 . 1 1 63 63 LYS HD2 H 1 1.252 0.020 . 1 . . . A 63 LYS HD2 . 18934 1 845 . 1 1 63 63 LYS HD3 H 1 1.252 0.020 . 1 . . . A 63 LYS HD3 . 18934 1 846 . 1 1 63 63 LYS HE2 H 1 2.902 0.020 . 1 . . . A 63 LYS HE2 . 18934 1 847 . 1 1 63 63 LYS HE3 H 1 2.902 0.020 . 1 . . . A 63 LYS HE3 . 18934 1 848 . 1 1 63 63 LYS C C 13 172.679 0.3 . 1 . . . A 63 LYS C . 18934 1 849 . 1 1 63 63 LYS CA C 13 55.159 0.3 . 1 . . . A 63 LYS CA . 18934 1 850 . 1 1 63 63 LYS CB C 13 28.886 0.3 . 1 . . . A 63 LYS CB . 18934 1 851 . 1 1 63 63 LYS CG C 13 20.711 0.3 . 1 . . . A 63 LYS CG . 18934 1 852 . 1 1 63 63 LYS CD C 13 24.362 0.3 . 1 . . . A 63 LYS CD . 18934 1 853 . 1 1 63 63 LYS CE C 13 38.923 0.3 . 1 . . . A 63 LYS CE . 18934 1 854 . 1 1 63 63 LYS N N 15 114.038 0.3 . 1 . . . A 63 LYS N . 18934 1 855 . 1 1 64 64 HIS H H 1 7.601 0.020 . 1 . . . A 64 HIS H . 18934 1 856 . 1 1 64 64 HIS HA H 1 4.466 0.020 . 1 . . . A 64 HIS HA . 18934 1 857 . 1 1 64 64 HIS HB2 H 1 3.391 0.020 . 2 . . . A 64 HIS HB2 . 18934 1 858 . 1 1 64 64 HIS HB3 H 1 2.846 0.020 . 2 . . . A 64 HIS HB3 . 18934 1 859 . 1 1 64 64 HIS HD2 H 1 7.003 0.020 . 1 . . . A 64 HIS HD2 . 18934 1 860 . 1 1 64 64 HIS C C 13 173.618 0.3 . 1 . . . A 64 HIS C . 18934 1 861 . 1 1 64 64 HIS CA C 13 53.573 0.3 . 1 . . . A 64 HIS CA . 18934 1 862 . 1 1 64 64 HIS CB C 13 30.461 0.3 . 1 . . . A 64 HIS CB . 18934 1 863 . 1 1 64 64 HIS CD2 C 13 117.616 0.3 . 1 . . . A 64 HIS CD2 . 18934 1 864 . 1 1 64 64 HIS N N 15 114.797 0.3 . 1 . . . A 64 HIS N . 18934 1 865 . 1 1 65 65 VAL H H 1 6.850 0.020 . 1 . . . A 65 VAL H . 18934 1 866 . 1 1 65 65 VAL HA H 1 2.901 0.020 . 1 . . . A 65 VAL HA . 18934 1 867 . 1 1 65 65 VAL HB H 1 1.658 0.020 . 1 . . . A 65 VAL HB . 18934 1 868 . 1 1 65 65 VAL HG11 H 1 0.298 0.020 . 1 . . . A 65 VAL HG11 . 18934 1 869 . 1 1 65 65 VAL HG12 H 1 0.298 0.020 . 1 . . . A 65 VAL HG12 . 18934 1 870 . 1 1 65 65 VAL HG13 H 1 0.298 0.020 . 1 . . . A 65 VAL HG13 . 18934 1 871 . 1 1 65 65 VAL HG21 H 1 -0.085 0.020 . 1 . . . A 65 VAL HG21 . 18934 1 872 . 1 1 65 65 VAL HG22 H 1 -0.085 0.020 . 1 . . . A 65 VAL HG22 . 18934 1 873 . 1 1 65 65 VAL HG23 H 1 -0.085 0.020 . 1 . . . A 65 VAL HG23 . 18934 1 874 . 1 1 65 65 VAL C C 13 173.605 0.3 . 1 . . . A 65 VAL C . 18934 1 875 . 1 1 65 65 VAL CA C 13 63.760 0.3 . 1 . . . A 65 VAL CA . 18934 1 876 . 1 1 65 65 VAL CB C 13 28.195 0.3 . 1 . . . A 65 VAL CB . 18934 1 877 . 1 1 65 65 VAL CG1 C 13 17.680 0.3 . 1 . . . A 65 VAL CG1 . 18934 1 878 . 1 1 65 65 VAL CG2 C 13 18.157 0.3 . 1 . . . A 65 VAL CG2 . 18934 1 879 . 1 1 65 65 VAL N N 15 118.174 0.3 . 1 . . . A 65 VAL N . 18934 1 880 . 1 1 66 66 LEU H H 1 8.703 0.020 . 1 . . . A 66 LEU H . 18934 1 881 . 1 1 66 66 LEU HA H 1 4.141 0.020 . 1 . . . A 66 LEU HA . 18934 1 882 . 1 1 66 66 LEU HB2 H 1 2.047 0.020 . 2 . . . A 66 LEU HB2 . 18934 1 883 . 1 1 66 66 LEU HB3 H 1 1.158 0.020 . 2 . . . A 66 LEU HB3 . 18934 1 884 . 1 1 66 66 LEU HG H 1 1.550 0.020 . 1 . . . A 66 LEU HG . 18934 1 885 . 1 1 66 66 LEU HD11 H 1 0.545 0.020 . 1 . . . A 66 LEU HD11 . 18934 1 886 . 1 1 66 66 LEU HD12 H 1 0.545 0.020 . 1 . . . A 66 LEU HD12 . 18934 1 887 . 1 1 66 66 LEU HD13 H 1 0.545 0.020 . 1 . . . A 66 LEU HD13 . 18934 1 888 . 1 1 66 66 LEU HD21 H 1 0.502 0.020 . 1 . . . A 66 LEU HD21 . 18934 1 889 . 1 1 66 66 LEU HD22 H 1 0.502 0.020 . 1 . . . A 66 LEU HD22 . 18934 1 890 . 1 1 66 66 LEU HD23 H 1 0.502 0.020 . 1 . . . A 66 LEU HD23 . 18934 1 891 . 1 1 66 66 LEU C C 13 175.101 0.3 . 1 . . . A 66 LEU C . 18934 1 892 . 1 1 66 66 LEU CA C 13 55.851 0.3 . 1 . . . A 66 LEU CA . 18934 1 893 . 1 1 66 66 LEU CB C 13 34.775 0.3 . 1 . . . A 66 LEU CB . 18934 1 894 . 1 1 66 66 LEU CG C 13 21.846 0.3 . 1 . . . A 66 LEU CG . 18934 1 895 . 1 1 66 66 LEU CD1 C 13 22.514 0.3 . 1 . . . A 66 LEU CD1 . 18934 1 896 . 1 1 66 66 LEU CD2 C 13 19.963 0.3 . 1 . . . A 66 LEU CD2 . 18934 1 897 . 1 1 66 66 LEU N N 15 114.018 0.3 . 1 . . . A 66 LEU N . 18934 1 898 . 1 1 67 67 PRO HA H 1 4.439 0.020 . 1 . . . A 67 PRO HA . 18934 1 899 . 1 1 67 67 PRO HB2 H 1 2.360 0.020 . 2 . . . A 67 PRO HB2 . 18934 1 900 . 1 1 67 67 PRO HB3 H 1 1.620 0.020 . 2 . . . A 67 PRO HB3 . 18934 1 901 . 1 1 67 67 PRO HG2 H 1 2.020 0.020 . 1 . . . A 67 PRO HG2 . 18934 1 902 . 1 1 67 67 PRO HG3 H 1 2.020 0.020 . 1 . . . A 67 PRO HG3 . 18934 1 903 . 1 1 67 67 PRO HD2 H 1 3.150 0.020 . 1 . . . A 67 PRO HD2 . 18934 1 904 . 1 1 67 67 PRO HD3 H 1 3.150 0.020 . 1 . . . A 67 PRO HD3 . 18934 1 905 . 1 1 67 67 PRO C C 13 173.863 0.3 . 1 . . . A 67 PRO C . 18934 1 906 . 1 1 67 67 PRO CA C 13 62.646 0.3 . 1 . . . A 67 PRO CA . 18934 1 907 . 1 1 67 67 PRO CB C 13 28.880 0.3 . 1 . . . A 67 PRO CB . 18934 1 908 . 1 1 67 67 PRO CG C 13 25.135 0.3 . 1 . . . A 67 PRO CG . 18934 1 909 . 1 1 67 67 PRO CD C 13 48.042 0.3 . 1 . . . A 67 PRO CD . 18934 1 910 . 1 1 68 68 ASN H H 1 7.011 0.020 . 1 . . . A 68 ASN H . 18934 1 911 . 1 1 68 68 ASN HA H 1 5.252 0.020 . 1 . . . A 68 ASN HA . 18934 1 912 . 1 1 68 68 ASN HB2 H 1 3.361 0.020 . 1 . . . A 68 ASN HB2 . 18934 1 913 . 1 1 68 68 ASN HB3 H 1 3.361 0.020 . 1 . . . A 68 ASN HB3 . 18934 1 914 . 1 1 68 68 ASN CA C 13 48.600 0.3 . 1 . . . A 68 ASN CA . 18934 1 915 . 1 1 68 68 ASN CB C 13 38.353 0.3 . 1 . . . A 68 ASN CB . 18934 1 916 . 1 1 68 68 ASN N N 15 111.480 0.3 . 1 . . . A 68 ASN N . 18934 1 917 . 1 1 69 69 ILE H H 1 7.151 0.020 . 1 . . . A 69 ILE H . 18934 1 918 . 1 1 69 69 ILE HA H 1 4.544 0.020 . 1 . . . A 69 ILE HA . 18934 1 919 . 1 1 69 69 ILE HB H 1 2.199 0.020 . 1 . . . A 69 ILE HB . 18934 1 920 . 1 1 69 69 ILE HG12 H 1 1.357 0.020 . 2 . . . A 69 ILE HG12 . 18934 1 921 . 1 1 69 69 ILE HG13 H 1 1.083 0.020 . 2 . . . A 69 ILE HG13 . 18934 1 922 . 1 1 69 69 ILE HG21 H 1 0.775 0.020 . 1 . . . A 69 ILE HG21 . 18934 1 923 . 1 1 69 69 ILE HG22 H 1 0.775 0.020 . 1 . . . A 69 ILE HG22 . 18934 1 924 . 1 1 69 69 ILE HG23 H 1 0.775 0.020 . 1 . . . A 69 ILE HG23 . 18934 1 925 . 1 1 69 69 ILE HD11 H 1 0.745 0.020 . 1 . . . A 69 ILE HD11 . 18934 1 926 . 1 1 69 69 ILE HD12 H 1 0.745 0.020 . 1 . . . A 69 ILE HD12 . 18934 1 927 . 1 1 69 69 ILE HD13 H 1 0.745 0.020 . 1 . . . A 69 ILE HD13 . 18934 1 928 . 1 1 69 69 ILE C C 13 171.509 0.3 . 1 . . . A 69 ILE C . 18934 1 929 . 1 1 69 69 ILE CA C 13 57.205 0.3 . 1 . . . A 69 ILE CA . 18934 1 930 . 1 1 69 69 ILE CB C 13 36.580 0.3 . 1 . . . A 69 ILE CB . 18934 1 931 . 1 1 69 69 ILE CG1 C 13 25.979 0.3 . 1 . . . A 69 ILE CG1 . 18934 1 932 . 1 1 69 69 ILE CG2 C 13 16.405 0.3 . 1 . . . A 69 ILE CG2 . 18934 1 933 . 1 1 69 69 ILE CD1 C 13 11.028 0.3 . 1 . . . A 69 ILE CD1 . 18934 1 934 . 1 1 69 69 ILE N N 15 122.641 0.3 . 1 . . . A 69 ILE N . 18934 1 935 . 1 1 70 70 ARG H H 1 8.945 0.020 . 1 . . . A 70 ARG H . 18934 1 936 . 1 1 70 70 ARG HA H 1 4.755 0.020 . 1 . . . A 70 ARG HA . 18934 1 937 . 1 1 70 70 ARG HB2 H 1 1.445 0.020 . 1 . . . A 70 ARG HB2 . 18934 1 938 . 1 1 70 70 ARG HB3 H 1 1.445 0.020 . 1 . . . A 70 ARG HB3 . 18934 1 939 . 1 1 70 70 ARG HG2 H 1 1.125 0.020 . 1 . . . A 70 ARG HG2 . 18934 1 940 . 1 1 70 70 ARG HG3 H 1 1.125 0.020 . 1 . . . A 70 ARG HG3 . 18934 1 941 . 1 1 70 70 ARG HD2 H 1 1.766 0.020 . 1 . . . A 70 ARG HD2 . 18934 1 942 . 1 1 70 70 ARG HD3 H 1 1.766 0.020 . 1 . . . A 70 ARG HD3 . 18934 1 943 . 1 1 70 70 ARG C C 13 171.802 0.3 . 1 . . . A 70 ARG C . 18934 1 944 . 1 1 70 70 ARG CA C 13 50.857 0.3 . 1 . . . A 70 ARG CA . 18934 1 945 . 1 1 70 70 ARG CB C 13 30.675 0.3 . 1 . . . A 70 ARG CB . 18934 1 946 . 1 1 70 70 ARG N N 15 126.375 0.3 . 1 . . . A 70 ARG N . 18934 1 947 . 1 1 71 71 ILE H H 1 7.580 0.020 . 1 . . . A 71 ILE H . 18934 1 948 . 1 1 71 71 ILE HA H 1 4.634 0.020 . 1 . . . A 71 ILE HA . 18934 1 949 . 1 1 71 71 ILE HB H 1 1.714 0.020 . 1 . . . A 71 ILE HB . 18934 1 950 . 1 1 71 71 ILE HG12 H 1 0.886 0.020 . 2 . . . A 71 ILE HG12 . 18934 1 951 . 1 1 71 71 ILE HG13 H 1 0.570 0.020 . 2 . . . A 71 ILE HG13 . 18934 1 952 . 1 1 71 71 ILE HG21 H 1 0.652 0.020 . 1 . . . A 71 ILE HG21 . 18934 1 953 . 1 1 71 71 ILE HG22 H 1 0.652 0.020 . 1 . . . A 71 ILE HG22 . 18934 1 954 . 1 1 71 71 ILE HG23 H 1 0.652 0.020 . 1 . . . A 71 ILE HG23 . 18934 1 955 . 1 1 71 71 ILE HD11 H 1 0.080 0.020 . 1 . . . A 71 ILE HD11 . 18934 1 956 . 1 1 71 71 ILE HD12 H 1 0.080 0.020 . 1 . . . A 71 ILE HD12 . 18934 1 957 . 1 1 71 71 ILE HD13 H 1 0.080 0.020 . 1 . . . A 71 ILE HD13 . 18934 1 958 . 1 1 71 71 ILE C C 13 172.804 0.3 . 1 . . . A 71 ILE C . 18934 1 959 . 1 1 71 71 ILE CA C 13 57.418 0.3 . 1 . . . A 71 ILE CA . 18934 1 960 . 1 1 71 71 ILE CB C 13 36.346 0.3 . 1 . . . A 71 ILE CB . 18934 1 961 . 1 1 71 71 ILE CG1 C 13 23.260 0.3 . 1 . . . A 71 ILE CG1 . 18934 1 962 . 1 1 71 71 ILE CG2 C 13 16.275 0.3 . 1 . . . A 71 ILE CG2 . 18934 1 963 . 1 1 71 71 ILE CD1 C 13 10.115 0.3 . 1 . . . A 71 ILE CD1 . 18934 1 964 . 1 1 71 71 ILE N N 15 119.088 0.3 . 1 . . . A 71 ILE N . 18934 1 965 . 1 1 72 72 LYS H H 1 8.617 0.020 . 1 . . . A 72 LYS H . 18934 1 966 . 1 1 72 72 LYS HA H 1 4.207 0.020 . 1 . . . A 72 LYS HA . 18934 1 967 . 1 1 72 72 LYS HB2 H 1 1.795 0.020 . 2 . . . A 72 LYS HB2 . 18934 1 968 . 1 1 72 72 LYS HB3 H 1 1.710 0.020 . 2 . . . A 72 LYS HB3 . 18934 1 969 . 1 1 72 72 LYS HG2 H 1 1.321 0.020 . 2 . . . A 72 LYS HG2 . 18934 1 970 . 1 1 72 72 LYS HG3 H 1 1.401 0.020 . 2 . . . A 72 LYS HG3 . 18934 1 971 . 1 1 72 72 LYS HD2 H 1 1.647 0.020 . 1 . . . A 72 LYS HD2 . 18934 1 972 . 1 1 72 72 LYS HD3 H 1 1.647 0.020 . 1 . . . A 72 LYS HD3 . 18934 1 973 . 1 1 72 72 LYS HE2 H 1 2.933 0.020 . 1 . . . A 72 LYS HE2 . 18934 1 974 . 1 1 72 72 LYS HE3 H 1 2.933 0.020 . 1 . . . A 72 LYS HE3 . 18934 1 975 . 1 1 72 72 LYS C C 13 174.871 0.3 . 1 . . . A 72 LYS C . 18934 1 976 . 1 1 72 72 LYS CA C 13 54.932 0.3 . 1 . . . A 72 LYS CA . 18934 1 977 . 1 1 72 72 LYS CB C 13 29.777 0.3 . 1 . . . A 72 LYS CB . 18934 1 978 . 1 1 72 72 LYS CG C 13 21.857 0.3 . 1 . . . A 72 LYS CG . 18934 1 979 . 1 1 72 72 LYS CD C 13 26.522 0.3 . 1 . . . A 72 LYS CD . 18934 1 980 . 1 1 72 72 LYS CE C 13 39.463 0.3 . 1 . . . A 72 LYS CE . 18934 1 981 . 1 1 72 72 LYS N N 15 128.132 0.3 . 1 . . . A 72 LYS N . 18934 1 982 . 1 1 73 73 GLY H H 1 8.858 0.020 . 1 . . . A 73 GLY H . 18934 1 983 . 1 1 73 73 GLY HA2 H 1 4.142 0.020 . 2 . . . A 73 GLY HA2 . 18934 1 984 . 1 1 73 73 GLY HA3 H 1 3.803 0.020 . 2 . . . A 73 GLY HA3 . 18934 1 985 . 1 1 73 73 GLY C C 13 171.071 0.3 . 1 . . . A 73 GLY C . 18934 1 986 . 1 1 73 73 GLY CA C 13 43.606 0.3 . 1 . . . A 73 GLY CA . 18934 1 987 . 1 1 73 73 GLY N N 15 113.270 0.3 . 1 . . . A 73 GLY N . 18934 1 988 . 1 1 74 74 LEU H H 1 7.421 0.020 . 1 . . . A 74 LEU H . 18934 1 989 . 1 1 74 74 LEU HA H 1 4.930 0.020 . 1 . . . A 74 LEU HA . 18934 1 990 . 1 1 74 74 LEU HB2 H 1 1.852 0.020 . 2 . . . A 74 LEU HB2 . 18934 1 991 . 1 1 74 74 LEU HB3 H 1 1.531 0.020 . 2 . . . A 74 LEU HB3 . 18934 1 992 . 1 1 74 74 LEU HG H 1 1.876 0.020 . 1 . . . A 74 LEU HG . 18934 1 993 . 1 1 74 74 LEU HD11 H 1 1.080 0.020 . 1 . . . A 74 LEU HD11 . 18934 1 994 . 1 1 74 74 LEU HD12 H 1 1.080 0.020 . 1 . . . A 74 LEU HD12 . 18934 1 995 . 1 1 74 74 LEU HD13 H 1 1.080 0.020 . 1 . . . A 74 LEU HD13 . 18934 1 996 . 1 1 74 74 LEU HD21 H 1 1.075 0.020 . 1 . . . A 74 LEU HD21 . 18934 1 997 . 1 1 74 74 LEU HD22 H 1 1.075 0.020 . 1 . . . A 74 LEU HD22 . 18934 1 998 . 1 1 74 74 LEU HD23 H 1 1.075 0.020 . 1 . . . A 74 LEU HD23 . 18934 1 999 . 1 1 74 74 LEU C C 13 173.034 0.3 . 1 . . . A 74 LEU C . 18934 1 1000 . 1 1 74 74 LEU CA C 13 51.310 0.3 . 1 . . . A 74 LEU CA . 18934 1 1001 . 1 1 74 74 LEU CB C 13 42.454 0.3 . 1 . . . A 74 LEU CB . 18934 1 1002 . 1 1 74 74 LEU CG C 13 24.565 0.3 . 1 . . . A 74 LEU CG . 18934 1 1003 . 1 1 74 74 LEU CD1 C 13 22.870 0.3 . 1 . . . A 74 LEU CD1 . 18934 1 1004 . 1 1 74 74 LEU CD2 C 13 23.012 0.3 . 1 . . . A 74 LEU CD2 . 18934 1 1005 . 1 1 74 74 LEU N N 15 119.818 0.3 . 1 . . . A 74 LEU N . 18934 1 1006 . 1 1 75 75 SER H H 1 8.965 0.020 . 1 . . . A 75 SER H . 18934 1 1007 . 1 1 75 75 SER HA H 1 4.681 0.020 . 1 . . . A 75 SER HA . 18934 1 1008 . 1 1 75 75 SER HB2 H 1 3.880 0.020 . 2 . . . A 75 SER HB2 . 18934 1 1009 . 1 1 75 75 SER HB3 H 1 3.808 0.020 . 2 . . . A 75 SER HB3 . 18934 1 1010 . 1 1 75 75 SER C C 13 170.361 0.3 . 1 . . . A 75 SER C . 18934 1 1011 . 1 1 75 75 SER CA C 13 55.617 0.3 . 1 . . . A 75 SER CA . 18934 1 1012 . 1 1 75 75 SER CB C 13 61.050 0.3 . 1 . . . A 75 SER CB . 18934 1 1013 . 1 1 75 75 SER N N 15 119.707 0.3 . 1 . . . A 75 SER N . 18934 1 1014 . 1 1 76 76 PHE H H 1 8.069 0.020 . 1 . . . A 76 PHE H . 18934 1 1015 . 1 1 76 76 PHE HA H 1 5.705 0.020 . 1 . . . A 76 PHE HA . 18934 1 1016 . 1 1 76 76 PHE HB2 H 1 3.036 0.020 . 2 . . . A 76 PHE HB2 . 18934 1 1017 . 1 1 76 76 PHE HB3 H 1 2.940 0.020 . 2 . . . A 76 PHE HB3 . 18934 1 1018 . 1 1 76 76 PHE HD1 H 1 7.052 0.020 . 1 . . . A 76 PHE HD1 . 18934 1 1019 . 1 1 76 76 PHE HD2 H 1 7.052 0.020 . 1 . . . A 76 PHE HD2 . 18934 1 1020 . 1 1 76 76 PHE HE1 H 1 7.418 0.020 . 1 . . . A 76 PHE HE1 . 18934 1 1021 . 1 1 76 76 PHE HE2 H 1 7.418 0.020 . 1 . . . A 76 PHE HE2 . 18934 1 1022 . 1 1 76 76 PHE HZ H 1 7.440 0.020 . 1 . . . A 76 PHE HZ . 18934 1 1023 . 1 1 76 76 PHE C C 13 170.716 0.3 . 1 . . . A 76 PHE C . 18934 1 1024 . 1 1 76 76 PHE CA C 13 53.118 0.3 . 1 . . . A 76 PHE CA . 18934 1 1025 . 1 1 76 76 PHE CB C 13 40.217 0.3 . 1 . . . A 76 PHE CB . 18934 1 1026 . 1 1 76 76 PHE CD2 C 13 130.268 0.3 . 1 . . . A 76 PHE CD2 . 18934 1 1027 . 1 1 76 76 PHE CE2 C 13 128.938 0.3 . 1 . . . A 76 PHE CE2 . 18934 1 1028 . 1 1 76 76 PHE CZ C 13 127.763 0.3 . 1 . . . A 76 PHE CZ . 18934 1 1029 . 1 1 76 76 PHE N N 15 118.818 0.3 . 1 . . . A 76 PHE N . 18934 1 1030 . 1 1 77 77 SER H H 1 8.976 0.020 . 1 . . . A 77 SER H . 18934 1 1031 . 1 1 77 77 SER HA H 1 4.735 0.020 . 1 . . . A 77 SER HA . 18934 1 1032 . 1 1 77 77 SER HB2 H 1 3.792 0.020 . 1 . . . A 77 SER HB2 . 18934 1 1033 . 1 1 77 77 SER HB3 H 1 3.792 0.020 . 1 . . . A 77 SER HB3 . 18934 1 1034 . 1 1 77 77 SER CA C 13 53.572 0.3 . 1 . . . A 77 SER CA . 18934 1 1035 . 1 1 77 77 SER CB C 13 63.312 0.3 . 1 . . . A 77 SER CB . 18934 1 1036 . 1 1 77 77 SER N N 15 114.348 0.3 . 1 . . . A 77 SER N . 18934 1 1037 . 1 1 78 78 VAL H H 1 8.941 0.020 . 1 . . . A 78 VAL H . 18934 1 1038 . 1 1 78 78 VAL HA H 1 4.235 0.020 . 1 . . . A 78 VAL HA . 18934 1 1039 . 1 1 78 78 VAL HB H 1 2.058 0.020 . 1 . . . A 78 VAL HB . 18934 1 1040 . 1 1 78 78 VAL HG11 H 1 0.772 0.020 . 1 . . . A 78 VAL HG11 . 18934 1 1041 . 1 1 78 78 VAL HG12 H 1 0.772 0.020 . 1 . . . A 78 VAL HG12 . 18934 1 1042 . 1 1 78 78 VAL HG13 H 1 0.772 0.020 . 1 . . . A 78 VAL HG13 . 18934 1 1043 . 1 1 78 78 VAL HG21 H 1 1.058 0.020 . 1 . . . A 78 VAL HG21 . 18934 1 1044 . 1 1 78 78 VAL HG22 H 1 1.058 0.020 . 1 . . . A 78 VAL HG22 . 18934 1 1045 . 1 1 78 78 VAL HG23 H 1 1.058 0.020 . 1 . . . A 78 VAL HG23 . 18934 1 1046 . 1 1 78 78 VAL C C 13 173.326 0.3 . 1 . . . A 78 VAL C . 18934 1 1047 . 1 1 78 78 VAL CA C 13 59.921 0.3 . 1 . . . A 78 VAL CA . 18934 1 1048 . 1 1 78 78 VAL CB C 13 30.004 0.3 . 1 . . . A 78 VAL CB . 18934 1 1049 . 1 1 78 78 VAL CG1 C 13 18.599 0.3 . 1 . . . A 78 VAL CG1 . 18934 1 1050 . 1 1 78 78 VAL CG2 C 13 18.380 0.3 . 1 . . . A 78 VAL CG2 . 18934 1 1051 . 1 1 78 78 VAL N N 15 124.421 0.3 . 1 . . . A 78 VAL N . 18934 1 1052 . 1 1 79 79 LYS H H 1 9.177 0.020 . 1 . . . A 79 LYS H . 18934 1 1053 . 1 1 79 79 LYS HA H 1 4.398 0.020 . 1 . . . A 79 LYS HA . 18934 1 1054 . 1 1 79 79 LYS HB2 H 1 1.635 0.020 . 1 . . . A 79 LYS HB2 . 18934 1 1055 . 1 1 79 79 LYS HB3 H 1 1.635 0.020 . 1 . . . A 79 LYS HB3 . 18934 1 1056 . 1 1 79 79 LYS HG2 H 1 1.135 0.020 . 2 . . . A 79 LYS HG2 . 18934 1 1057 . 1 1 79 79 LYS HG3 H 1 1.195 0.020 . 2 . . . A 79 LYS HG3 . 18934 1 1058 . 1 1 79 79 LYS HD2 H 1 1.355 0.020 . 2 . . . A 79 LYS HD2 . 18934 1 1059 . 1 1 79 79 LYS HD3 H 1 1.475 0.020 . 2 . . . A 79 LYS HD3 . 18934 1 1060 . 1 1 79 79 LYS HE2 H 1 2.701 0.020 . 1 . . . A 79 LYS HE2 . 18934 1 1061 . 1 1 79 79 LYS HE3 H 1 2.701 0.020 . 1 . . . A 79 LYS HE3 . 18934 1 1062 . 1 1 79 79 LYS C C 13 173.702 0.3 . 1 . . . A 79 LYS C . 18934 1 1063 . 1 1 79 79 LYS CA C 13 54.028 0.3 . 1 . . . A 79 LYS CA . 18934 1 1064 . 1 1 79 79 LYS CB C 13 30.010 0.3 . 1 . . . A 79 LYS CB . 18934 1 1065 . 1 1 79 79 LYS CG C 13 21.520 0.3 . 1 . . . A 79 LYS CG . 18934 1 1066 . 1 1 79 79 LYS CD C 13 25.552 0.3 . 1 . . . A 79 LYS CD . 18934 1 1067 . 1 1 79 79 LYS CE C 13 39.246 0.3 . 1 . . . A 79 LYS CE . 18934 1 1068 . 1 1 79 79 LYS N N 15 129.422 0.3 . 1 . . . A 79 LYS N . 18934 1 1069 . 1 1 80 80 VAL H H 1 7.542 0.020 . 1 . . . A 80 VAL H . 18934 1 1070 . 1 1 80 80 VAL HA H 1 4.261 0.020 . 1 . . . A 80 VAL HA . 18934 1 1071 . 1 1 80 80 VAL HB H 1 1.921 0.020 . 1 . . . A 80 VAL HB . 18934 1 1072 . 1 1 80 80 VAL HG11 H 1 0.782 0.020 . 1 . . . A 80 VAL HG11 . 18934 1 1073 . 1 1 80 80 VAL HG12 H 1 0.782 0.020 . 1 . . . A 80 VAL HG12 . 18934 1 1074 . 1 1 80 80 VAL HG13 H 1 0.782 0.020 . 1 . . . A 80 VAL HG13 . 18934 1 1075 . 1 1 80 80 VAL HG21 H 1 0.870 0.020 . 1 . . . A 80 VAL HG21 . 18934 1 1076 . 1 1 80 80 VAL HG22 H 1 0.870 0.020 . 1 . . . A 80 VAL HG22 . 18934 1 1077 . 1 1 80 80 VAL HG23 H 1 0.870 0.020 . 1 . . . A 80 VAL HG23 . 18934 1 1078 . 1 1 80 80 VAL CA C 13 58.560 0.3 . 1 . . . A 80 VAL CA . 18934 1 1079 . 1 1 80 80 VAL CB C 13 32.060 0.3 . 1 . . . A 80 VAL CB . 18934 1 1080 . 1 1 80 80 VAL CG1 C 13 17.570 0.3 . 1 . . . A 80 VAL CG1 . 18934 1 1081 . 1 1 80 80 VAL CG2 C 13 18.083 0.3 . 1 . . . A 80 VAL CG2 . 18934 1 1082 . 1 1 80 80 VAL N N 15 116.181 0.3 . 1 . . . A 80 VAL N . 18934 1 1083 . 1 1 81 81 CYS H H 1 8.934 0.020 . 1 . . . A 81 CYS H . 18934 1 1084 . 1 1 81 81 CYS HA H 1 4.683 0.020 . 1 . . . A 81 CYS HA . 18934 1 1085 . 1 1 81 81 CYS HB2 H 1 2.885 0.020 . 2 . . . A 81 CYS HB2 . 18934 1 1086 . 1 1 81 81 CYS HB3 H 1 2.510 0.020 . 2 . . . A 81 CYS HB3 . 18934 1 1087 . 1 1 81 81 CYS C C 13 169.797 0.3 . 1 . . . A 81 CYS C . 18934 1 1088 . 1 1 81 81 CYS CA C 13 56.513 0.3 . 1 . . . A 81 CYS CA . 18934 1 1089 . 1 1 81 81 CYS CB C 13 25.931 0.3 . 1 . . . A 81 CYS CB . 18934 1 1090 . 1 1 81 81 CYS N N 15 126.647 0.3 . 1 . . . A 81 CYS N . 18934 1 1091 . 1 1 82 82 GLY H H 1 8.044 0.020 . 1 . . . A 82 GLY H . 18934 1 1092 . 1 1 82 82 GLY HA2 H 1 4.413 0.020 . 2 . . . A 82 GLY HA2 . 18934 1 1093 . 1 1 82 82 GLY HA3 H 1 3.906 0.020 . 2 . . . A 82 GLY HA3 . 18934 1 1094 . 1 1 82 82 GLY C C 13 168.878 0.3 . 1 . . . A 82 GLY C . 18934 1 1095 . 1 1 82 82 GLY CA C 13 41.560 0.3 . 1 . . . A 82 GLY CA . 18934 1 1096 . 1 1 82 82 GLY N N 15 117.876 0.3 . 1 . . . A 82 GLY N . 18934 1 1097 . 1 1 83 83 GLU H H 1 8.286 0.020 . 1 . . . A 83 GLU H . 18934 1 1098 . 1 1 83 83 GLU HA H 1 3.968 0.020 . 1 . . . A 83 GLU HA . 18934 1 1099 . 1 1 83 83 GLU HB2 H 1 1.973 0.020 . 2 . . . A 83 GLU HB2 . 18934 1 1100 . 1 1 83 83 GLU HB3 H 1 1.899 0.020 . 2 . . . A 83 GLU HB3 . 18934 1 1101 . 1 1 83 83 GLU HG2 H 1 2.203 0.020 . 2 . . . A 83 GLU HG2 . 18934 1 1102 . 1 1 83 83 GLU HG3 H 1 2.089 0.020 . 2 . . . A 83 GLU HG3 . 18934 1 1103 . 1 1 83 83 GLU C C 13 175.936 0.3 . 1 . . . A 83 GLU C . 18934 1 1104 . 1 1 83 83 GLU CA C 13 56.749 0.3 . 1 . . . A 83 GLU CA . 18934 1 1105 . 1 1 83 83 GLU CB C 13 28.196 0.3 . 1 . . . A 83 GLU CB . 18934 1 1106 . 1 1 83 83 GLU CG C 13 34.352 0.3 . 1 . . . A 83 GLU CG . 18934 1 1107 . 1 1 83 83 GLU N N 15 116.633 0.3 . 1 . . . A 83 GLU N . 18934 1 1108 . 1 1 84 84 ARG H H 1 8.366 0.020 . 1 . . . A 84 ARG H . 18934 1 1109 . 1 1 84 84 ARG HA H 1 4.848 0.020 . 1 . . . A 84 ARG HA . 18934 1 1110 . 1 1 84 84 ARG HB2 H 1 2.325 0.020 . 2 . . . A 84 ARG HB2 . 18934 1 1111 . 1 1 84 84 ARG HB3 H 1 1.855 0.020 . 2 . . . A 84 ARG HB3 . 18934 1 1112 . 1 1 84 84 ARG HG2 H 1 1.628 0.020 . 1 . . . A 84 ARG HG2 . 18934 1 1113 . 1 1 84 84 ARG HG3 H 1 1.628 0.020 . 1 . . . A 84 ARG HG3 . 18934 1 1114 . 1 1 84 84 ARG HD2 H 1 3.149 0.020 . 1 . . . A 84 ARG HD2 . 18934 1 1115 . 1 1 84 84 ARG HD3 H 1 3.149 0.020 . 1 . . . A 84 ARG HD3 . 18934 1 1116 . 1 1 84 84 ARG HE H 1 7.415 0.020 . 1 . . . A 84 ARG HE . 18934 1 1117 . 1 1 84 84 ARG C C 13 173.430 0.3 . 1 . . . A 84 ARG C . 18934 1 1118 . 1 1 84 84 ARG CA C 13 51.314 0.3 . 1 . . . A 84 ARG CA . 18934 1 1119 . 1 1 84 84 ARG CB C 13 29.334 0.3 . 1 . . . A 84 ARG CB . 18934 1 1120 . 1 1 84 84 ARG CG C 13 24.298 0.3 . 1 . . . A 84 ARG CG . 18934 1 1121 . 1 1 84 84 ARG CD C 13 40.460 0.3 . 1 . . . A 84 ARG CD . 18934 1 1122 . 1 1 84 84 ARG N N 15 113.342 0.3 . 1 . . . A 84 ARG N . 18934 1 1123 . 1 1 84 84 ARG NE N 15 86.144 0.3 . 1 . . . A 84 ARG NE . 18934 1 1124 . 1 1 85 85 LYS H H 1 6.794 0.020 . 1 . . . A 85 LYS H . 18934 1 1125 . 1 1 85 85 LYS HA H 1 5.200 0.020 . 1 . . . A 85 LYS HA . 18934 1 1126 . 1 1 85 85 LYS HB2 H 1 1.574 0.020 . 2 . . . A 85 LYS HB2 . 18934 1 1127 . 1 1 85 85 LYS HB3 H 1 1.305 0.020 . 2 . . . A 85 LYS HB3 . 18934 1 1128 . 1 1 85 85 LYS HE2 H 1 1.990 0.020 . 1 . . . A 85 LYS HE2 . 18934 1 1129 . 1 1 85 85 LYS HE3 H 1 1.990 0.020 . 1 . . . A 85 LYS HE3 . 18934 1 1130 . 1 1 85 85 LYS C C 13 172.031 0.3 . 1 . . . A 85 LYS C . 18934 1 1131 . 1 1 85 85 LYS CA C 13 52.900 0.3 . 1 . . . A 85 LYS CA . 18934 1 1132 . 1 1 85 85 LYS CB C 13 32.729 0.3 . 1 . . . A 85 LYS CB . 18934 1 1133 . 1 1 85 85 LYS CG C 13 23.185 0.3 . 1 . . . A 85 LYS CG . 18934 1 1134 . 1 1 85 85 LYS N N 15 119.067 0.3 . 1 . . . A 85 LYS N . 18934 1 1135 . 1 1 86 86 CYS H H 1 9.257 0.020 . 1 . . . A 86 CYS H . 18934 1 1136 . 1 1 86 86 CYS HA H 1 4.926 0.020 . 1 . . . A 86 CYS HA . 18934 1 1137 . 1 1 86 86 CYS HB2 H 1 3.146 0.020 . 2 . . . A 86 CYS HB2 . 18934 1 1138 . 1 1 86 86 CYS HB3 H 1 2.683 0.020 . 2 . . . A 86 CYS HB3 . 18934 1 1139 . 1 1 86 86 CYS C C 13 168.043 0.3 . 1 . . . A 86 CYS C . 18934 1 1140 . 1 1 86 86 CYS CA C 13 53.124 0.3 . 1 . . . A 86 CYS CA . 18934 1 1141 . 1 1 86 86 CYS CB C 13 28.422 0.3 . 1 . . . A 86 CYS CB . 18934 1 1142 . 1 1 86 86 CYS N N 15 127.355 0.3 . 1 . . . A 86 CYS N . 18934 1 1143 . 1 1 87 87 VAL H H 1 8.627 0.020 . 1 . . . A 87 VAL H . 18934 1 1144 . 1 1 87 87 VAL HA H 1 4.705 0.020 . 1 . . . A 87 VAL HA . 18934 1 1145 . 1 1 87 87 VAL HB H 1 1.777 0.020 . 1 . . . A 87 VAL HB . 18934 1 1146 . 1 1 87 87 VAL HG11 H 1 0.807 0.020 . 1 . . . A 87 VAL HG11 . 18934 1 1147 . 1 1 87 87 VAL HG12 H 1 0.807 0.020 . 1 . . . A 87 VAL HG12 . 18934 1 1148 . 1 1 87 87 VAL HG13 H 1 0.807 0.020 . 1 . . . A 87 VAL HG13 . 18934 1 1149 . 1 1 87 87 VAL HG21 H 1 0.776 0.020 . 1 . . . A 87 VAL HG21 . 18934 1 1150 . 1 1 87 87 VAL HG22 H 1 0.776 0.020 . 1 . . . A 87 VAL HG22 . 18934 1 1151 . 1 1 87 87 VAL HG23 H 1 0.776 0.020 . 1 . . . A 87 VAL HG23 . 18934 1 1152 . 1 1 87 87 VAL C C 13 171.864 0.3 . 1 . . . A 87 VAL C . 18934 1 1153 . 1 1 87 87 VAL CA C 13 59.016 0.3 . 1 . . . A 87 VAL CA . 18934 1 1154 . 1 1 87 87 VAL CB C 13 31.144 0.3 . 1 . . . A 87 VAL CB . 18934 1 1155 . 1 1 87 87 VAL CG1 C 13 17.441 0.3 . 1 . . . A 87 VAL CG1 . 18934 1 1156 . 1 1 87 87 VAL CG2 C 13 16.858 0.3 . 1 . . . A 87 VAL CG2 . 18934 1 1157 . 1 1 87 87 VAL N N 15 125.351 0.3 . 1 . . . A 87 VAL N . 18934 1 1158 . 1 1 88 88 LEU H H 1 9.566 0.020 . 1 . . . A 88 LEU H . 18934 1 1159 . 1 1 88 88 LEU HA H 1 5.324 0.020 . 1 . . . A 88 LEU HA . 18934 1 1160 . 1 1 88 88 LEU HB2 H 1 1.794 0.020 . 2 . . . A 88 LEU HB2 . 18934 1 1161 . 1 1 88 88 LEU HB3 H 1 1.440 0.020 . 2 . . . A 88 LEU HB3 . 18934 1 1162 . 1 1 88 88 LEU HG H 1 1.682 0.020 . 1 . . . A 88 LEU HG . 18934 1 1163 . 1 1 88 88 LEU HD11 H 1 0.470 0.020 . 1 . . . A 88 LEU HD11 . 18934 1 1164 . 1 1 88 88 LEU HD12 H 1 0.470 0.020 . 1 . . . A 88 LEU HD12 . 18934 1 1165 . 1 1 88 88 LEU HD13 H 1 0.470 0.020 . 1 . . . A 88 LEU HD13 . 18934 1 1166 . 1 1 88 88 LEU HD21 H 1 0.745 0.020 . 1 . . . A 88 LEU HD21 . 18934 1 1167 . 1 1 88 88 LEU HD22 H 1 0.745 0.020 . 1 . . . A 88 LEU HD22 . 18934 1 1168 . 1 1 88 88 LEU HD23 H 1 0.745 0.020 . 1 . . . A 88 LEU HD23 . 18934 1 1169 . 1 1 88 88 LEU C C 13 172.992 0.3 . 1 . . . A 88 LEU C . 18934 1 1170 . 1 1 88 88 LEU CA C 13 50.172 0.3 . 1 . . . A 88 LEU CA . 18934 1 1171 . 1 1 88 88 LEU CB C 13 42.700 0.3 . 1 . . . A 88 LEU CB . 18934 1 1172 . 1 1 88 88 LEU CG C 13 24.814 0.3 . 1 . . . A 88 LEU CG . 18934 1 1173 . 1 1 88 88 LEU CD1 C 13 23.503 0.3 . 1 . . . A 88 LEU CD1 . 18934 1 1174 . 1 1 88 88 LEU CD2 C 13 23.862 0.3 . 1 . . . A 88 LEU CD2 . 18934 1 1175 . 1 1 88 88 LEU N N 15 127.342 0.3 . 1 . . . A 88 LEU N . 18934 1 1176 . 1 1 89 89 PHE H H 1 8.928 0.020 . 1 . . . A 89 PHE H . 18934 1 1177 . 1 1 89 89 PHE HA H 1 5.605 0.020 . 1 . . . A 89 PHE HA . 18934 1 1178 . 1 1 89 89 PHE HB2 H 1 2.968 0.020 . 2 . . . A 89 PHE HB2 . 18934 1 1179 . 1 1 89 89 PHE HB3 H 1 2.807 0.020 . 2 . . . A 89 PHE HB3 . 18934 1 1180 . 1 1 89 89 PHE HD1 H 1 7.123 0.020 . 1 . . . A 89 PHE HD1 . 18934 1 1181 . 1 1 89 89 PHE HD2 H 1 7.123 0.020 . 1 . . . A 89 PHE HD2 . 18934 1 1182 . 1 1 89 89 PHE HE1 H 1 7.313 0.020 . 1 . . . A 89 PHE HE1 . 18934 1 1183 . 1 1 89 89 PHE HE2 H 1 7.313 0.020 . 1 . . . A 89 PHE HE2 . 18934 1 1184 . 1 1 89 89 PHE HZ H 1 7.232 0.020 . 1 . . . A 89 PHE HZ . 18934 1 1185 . 1 1 89 89 PHE C C 13 174.224 0.3 . 1 . . . A 89 PHE C . 18934 1 1186 . 1 1 89 89 PHE CA C 13 53.119 0.3 . 1 . . . A 89 PHE CA . 18934 1 1187 . 1 1 89 89 PHE CB C 13 37.031 0.3 . 1 . . . A 89 PHE CB . 18934 1 1188 . 1 1 89 89 PHE CD1 C 13 128.242 0.3 . 1 . . . A 89 PHE CD1 . 18934 1 1189 . 1 1 89 89 PHE CE1 C 13 128.852 0.3 . 1 . . . A 89 PHE CE1 . 18934 1 1190 . 1 1 89 89 PHE CZ C 13 127.241 0.3 . 1 . . . A 89 PHE CZ . 18934 1 1191 . 1 1 89 89 PHE N N 15 119.585 0.3 . 1 . . . A 89 PHE N . 18934 1 1192 . 1 1 90 90 ILE H H 1 9.351 0.020 . 1 . . . A 90 ILE H . 18934 1 1193 . 1 1 90 90 ILE HA H 1 5.129 0.020 . 1 . . . A 90 ILE HA . 18934 1 1194 . 1 1 90 90 ILE HB H 1 1.856 0.020 . 1 . . . A 90 ILE HB . 18934 1 1195 . 1 1 90 90 ILE HG12 H 1 1.754 0.020 . 2 . . . A 90 ILE HG12 . 18934 1 1196 . 1 1 90 90 ILE HG13 H 1 1.073 0.020 . 2 . . . A 90 ILE HG13 . 18934 1 1197 . 1 1 90 90 ILE HG21 H 1 0.861 0.020 . 1 . . . A 90 ILE HG21 . 18934 1 1198 . 1 1 90 90 ILE HG22 H 1 0.861 0.020 . 1 . . . A 90 ILE HG22 . 18934 1 1199 . 1 1 90 90 ILE HG23 H 1 0.861 0.020 . 1 . . . A 90 ILE HG23 . 18934 1 1200 . 1 1 90 90 ILE HD11 H 1 0.736 0.020 . 1 . . . A 90 ILE HD11 . 18934 1 1201 . 1 1 90 90 ILE HD12 H 1 0.736 0.020 . 1 . . . A 90 ILE HD12 . 18934 1 1202 . 1 1 90 90 ILE HD13 H 1 0.736 0.020 . 1 . . . A 90 ILE HD13 . 18934 1 1203 . 1 1 90 90 ILE C C 13 170.904 0.3 . 1 . . . A 90 ILE C . 18934 1 1204 . 1 1 90 90 ILE CA C 13 56.296 0.3 . 1 . . . A 90 ILE CA . 18934 1 1205 . 1 1 90 90 ILE CB C 13 38.617 0.3 . 1 . . . A 90 ILE CB . 18934 1 1206 . 1 1 90 90 ILE CG1 C 13 23.478 0.3 . 1 . . . A 90 ILE CG1 . 18934 1 1207 . 1 1 90 90 ILE CG2 C 13 15.924 0.3 . 1 . . . A 90 ILE CG2 . 18934 1 1208 . 1 1 90 90 ILE CD1 C 13 11.551 0.3 . 1 . . . A 90 ILE CD1 . 18934 1 1209 . 1 1 90 90 ILE N N 15 118.580 0.3 . 1 . . . A 90 ILE N . 18934 1 1210 . 1 1 91 91 GLU H H 1 8.149 0.020 . 1 . . . A 91 GLU H . 18934 1 1211 . 1 1 91 91 GLU HA H 1 5.160 0.020 . 1 . . . A 91 GLU HA . 18934 1 1212 . 1 1 91 91 GLU HB2 H 1 2.027 0.020 . 2 . . . A 91 GLU HB2 . 18934 1 1213 . 1 1 91 91 GLU HB3 H 1 1.900 0.020 . 2 . . . A 91 GLU HB3 . 18934 1 1214 . 1 1 91 91 GLU HG2 H 1 1.996 0.020 . 1 . . . A 91 GLU HG2 . 18934 1 1215 . 1 1 91 91 GLU HG3 H 1 1.996 0.020 . 1 . . . A 91 GLU HG3 . 18934 1 1216 . 1 1 91 91 GLU C C 13 172.867 0.3 . 1 . . . A 91 GLU C . 18934 1 1217 . 1 1 91 91 GLU CA C 13 52.217 0.3 . 1 . . . A 91 GLU CA . 18934 1 1218 . 1 1 91 91 GLU CB C 13 27.975 0.3 . 1 . . . A 91 GLU CB . 18934 1 1219 . 1 1 91 91 GLU CG C 13 33.700 0.3 . 1 . . . A 91 GLU CG . 18934 1 1220 . 1 1 91 91 GLU N N 15 122.976 0.3 . 1 . . . A 91 GLU N . 18934 1 1221 . 1 1 92 92 TRP H H 1 9.313 0.020 . 1 . . . A 92 TRP H . 18934 1 1222 . 1 1 92 92 TRP HA H 1 4.850 0.020 . 1 . . . A 92 TRP HA . 18934 1 1223 . 1 1 92 92 TRP HB2 H 1 3.277 0.020 . 2 . . . A 92 TRP HB2 . 18934 1 1224 . 1 1 92 92 TRP HB3 H 1 2.874 0.020 . 2 . . . A 92 TRP HB3 . 18934 1 1225 . 1 1 92 92 TRP HD1 H 1 6.981 0.020 . 1 . . . A 92 TRP HD1 . 18934 1 1226 . 1 1 92 92 TRP HE1 H 1 9.677 0.020 . 1 . . . A 92 TRP HE1 . 18934 1 1227 . 1 1 92 92 TRP HE3 H 1 7.381 0.020 . 1 . . . A 92 TRP HE3 . 18934 1 1228 . 1 1 92 92 TRP HZ2 H 1 7.073 0.020 . 1 . . . A 92 TRP HZ2 . 18934 1 1229 . 1 1 92 92 TRP HZ3 H 1 6.376 0.020 . 1 . . . A 92 TRP HZ3 . 18934 1 1230 . 1 1 92 92 TRP HH2 H 1 6.678 0.020 . 1 . . . A 92 TRP HH2 . 18934 1 1231 . 1 1 92 92 TRP C C 13 172.240 0.3 . 1 . . . A 92 TRP C . 18934 1 1232 . 1 1 92 92 TRP CA C 13 53.806 0.3 . 1 . . . A 92 TRP CA . 18934 1 1233 . 1 1 92 92 TRP CB C 13 28.662 0.3 . 1 . . . A 92 TRP CB . 18934 1 1234 . 1 1 92 92 TRP CD1 C 13 123.949 0.3 . 1 . . . A 92 TRP CD1 . 18934 1 1235 . 1 1 92 92 TRP CE3 C 13 117.614 0.3 . 1 . . . A 92 TRP CE3 . 18934 1 1236 . 1 1 92 92 TRP CZ2 C 13 111.759 0.3 . 1 . . . A 92 TRP CZ2 . 18934 1 1237 . 1 1 92 92 TRP CZ3 C 13 118.072 0.3 . 1 . . . A 92 TRP CZ3 . 18934 1 1238 . 1 1 92 92 TRP CH2 C 13 121.366 0.3 . 1 . . . A 92 TRP CH2 . 18934 1 1239 . 1 1 92 92 TRP N N 15 126.743 0.3 . 1 . . . A 92 TRP N . 18934 1 1240 . 1 1 92 92 TRP NE1 N 15 128.478 0.3 . 1 . . . A 92 TRP NE1 . 18934 1 1241 . 1 1 93 93 GLU H H 1 8.797 0.020 . 1 . . . A 93 GLU H . 18934 1 1242 . 1 1 93 93 GLU HA H 1 3.474 0.020 . 1 . . . A 93 GLU HA . 18934 1 1243 . 1 1 93 93 GLU HB2 H 1 1.776 0.020 . 2 . . . A 93 GLU HB2 . 18934 1 1244 . 1 1 93 93 GLU HB3 H 1 1.627 0.020 . 2 . . . A 93 GLU HB3 . 18934 1 1245 . 1 1 93 93 GLU HG2 H 1 1.391 0.020 . 2 . . . A 93 GLU HG2 . 18934 1 1246 . 1 1 93 93 GLU HG3 H 1 1.005 0.020 . 2 . . . A 93 GLU HG3 . 18934 1 1247 . 1 1 93 93 GLU C C 13 172.908 0.3 . 1 . . . A 93 GLU C . 18934 1 1248 . 1 1 93 93 GLU CA C 13 54.477 0.3 . 1 . . . A 93 GLU CA . 18934 1 1249 . 1 1 93 93 GLU CB C 13 24.124 0.3 . 1 . . . A 93 GLU CB . 18934 1 1250 . 1 1 93 93 GLU CG C 13 32.633 0.3 . 1 . . . A 93 GLU CG . 18934 1 1251 . 1 1 93 93 GLU N N 15 126.797 0.3 . 1 . . . A 93 GLU N . 18934 1 1252 . 1 1 94 94 LYS H H 1 8.537 0.020 . 1 . . . A 94 LYS H . 18934 1 1253 . 1 1 94 94 LYS HA H 1 3.698 0.020 . 1 . . . A 94 LYS HA . 18934 1 1254 . 1 1 94 94 LYS HB2 H 1 2.092 0.020 . 2 . . . A 94 LYS HB2 . 18934 1 1255 . 1 1 94 94 LYS HB3 H 1 1.953 0.020 . 2 . . . A 94 LYS HB3 . 18934 1 1256 . 1 1 94 94 LYS HG2 H 1 1.283 0.020 . 2 . . . A 94 LYS HG2 . 18934 1 1257 . 1 1 94 94 LYS HG3 H 1 1.252 0.020 . 2 . . . A 94 LYS HG3 . 18934 1 1258 . 1 1 94 94 LYS HD2 H 1 1.558 0.020 . 2 . . . A 94 LYS HD2 . 18934 1 1259 . 1 1 94 94 LYS HD3 H 1 1.620 0.020 . 2 . . . A 94 LYS HD3 . 18934 1 1260 . 1 1 94 94 LYS HE2 H 1 2.892 0.020 . 1 . . . A 94 LYS HE2 . 18934 1 1261 . 1 1 94 94 LYS HE3 H 1 2.892 0.020 . 1 . . . A 94 LYS HE3 . 18934 1 1262 . 1 1 94 94 LYS C C 13 172.637 0.3 . 1 . . . A 94 LYS C . 18934 1 1263 . 1 1 94 94 LYS CA C 13 55.159 0.3 . 1 . . . A 94 LYS CA . 18934 1 1264 . 1 1 94 94 LYS CB C 13 26.840 0.3 . 1 . . . A 94 LYS CB . 18934 1 1265 . 1 1 94 94 LYS CG C 13 22.671 0.3 . 1 . . . A 94 LYS CG . 18934 1 1266 . 1 1 94 94 LYS CD C 13 26.087 0.3 . 1 . . . A 94 LYS CD . 18934 1 1267 . 1 1 94 94 LYS CE C 13 39.463 0.3 . 1 . . . A 94 LYS CE . 18934 1 1268 . 1 1 94 94 LYS N N 15 108.122 0.3 . 1 . . . A 94 LYS N . 18934 1 1269 . 1 1 95 95 LYS H H 1 7.820 0.020 . 1 . . . A 95 LYS H . 18934 1 1270 . 1 1 95 95 LYS HA H 1 4.560 0.020 . 1 . . . A 95 LYS HA . 18934 1 1271 . 1 1 95 95 LYS HB2 H 1 1.719 0.020 . 2 . . . A 95 LYS HB2 . 18934 1 1272 . 1 1 95 95 LYS HB3 H 1 1.448 0.020 . 2 . . . A 95 LYS HB3 . 18934 1 1273 . 1 1 95 95 LYS HG2 H 1 1.334 0.020 . 2 . . . A 95 LYS HG2 . 18934 1 1274 . 1 1 95 95 LYS HG3 H 1 1.470 0.020 . 2 . . . A 95 LYS HG3 . 18934 1 1275 . 1 1 95 95 LYS HD2 H 1 1.722 0.020 . 1 . . . A 95 LYS HD2 . 18934 1 1276 . 1 1 95 95 LYS HD3 H 1 1.722 0.020 . 1 . . . A 95 LYS HD3 . 18934 1 1277 . 1 1 95 95 LYS HE2 H 1 3.015 0.020 . 1 . . . A 95 LYS HE2 . 18934 1 1278 . 1 1 95 95 LYS HE3 H 1 3.015 0.020 . 1 . . . A 95 LYS HE3 . 18934 1 1279 . 1 1 95 95 LYS C C 13 171.572 0.3 . 1 . . . A 95 LYS C . 18934 1 1280 . 1 1 95 95 LYS CA C 13 51.985 0.3 . 1 . . . A 95 LYS CA . 18934 1 1281 . 1 1 95 95 LYS CB C 13 32.730 0.3 . 1 . . . A 95 LYS CB . 18934 1 1282 . 1 1 95 95 LYS CG C 13 22.623 0.3 . 1 . . . A 95 LYS CG . 18934 1 1283 . 1 1 95 95 LYS CD C 13 25.980 0.3 . 1 . . . A 95 LYS CD . 18934 1 1284 . 1 1 95 95 LYS CE C 13 39.681 0.3 . 1 . . . A 95 LYS CE . 18934 1 1285 . 1 1 95 95 LYS N N 15 120.999 0.3 . 1 . . . A 95 LYS N . 18934 1 1286 . 1 1 96 96 THR H H 1 7.781 0.020 . 1 . . . A 96 THR H . 18934 1 1287 . 1 1 96 96 THR HA H 1 5.254 0.020 . 1 . . . A 96 THR HA . 18934 1 1288 . 1 1 96 96 THR HB H 1 3.666 0.020 . 1 . . . A 96 THR HB . 18934 1 1289 . 1 1 96 96 THR HG21 H 1 1.026 0.020 . 1 . . . A 96 THR HG21 . 18934 1 1290 . 1 1 96 96 THR HG22 H 1 1.026 0.020 . 1 . . . A 96 THR HG22 . 18934 1 1291 . 1 1 96 96 THR HG23 H 1 1.026 0.020 . 1 . . . A 96 THR HG23 . 18934 1 1292 . 1 1 96 96 THR C C 13 171.518 0.3 . 1 . . . A 96 THR C . 18934 1 1293 . 1 1 96 96 THR CA C 13 58.781 0.3 . 1 . . . A 96 THR CA . 18934 1 1294 . 1 1 96 96 THR CB C 13 67.391 0.3 . 1 . . . A 96 THR CB . 18934 1 1295 . 1 1 96 96 THR CG2 C 13 19.456 0.3 . 1 . . . A 96 THR CG2 . 18934 1 1296 . 1 1 96 96 THR N N 15 115.342 0.3 . 1 . . . A 96 THR N . 18934 1 1297 . 1 1 97 97 TYR H H 1 9.020 0.020 . 1 . . . A 97 TYR H . 18934 1 1298 . 1 1 97 97 TYR HA H 1 4.760 0.020 . 1 . . . A 97 TYR HA . 18934 1 1299 . 1 1 97 97 TYR HB2 H 1 2.919 0.020 . 2 . . . A 97 TYR HB2 . 18934 1 1300 . 1 1 97 97 TYR HB3 H 1 2.297 0.020 . 2 . . . A 97 TYR HB3 . 18934 1 1301 . 1 1 97 97 TYR HD1 H 1 6.979 0.020 . 1 . . . A 97 TYR HD1 . 18934 1 1302 . 1 1 97 97 TYR HD2 H 1 6.979 0.020 . 1 . . . A 97 TYR HD2 . 18934 1 1303 . 1 1 97 97 TYR HE1 H 1 6.762 0.020 . 1 . . . A 97 TYR HE1 . 18934 1 1304 . 1 1 97 97 TYR HE2 H 1 6.762 0.020 . 1 . . . A 97 TYR HE2 . 18934 1 1305 . 1 1 97 97 TYR C C 13 170.444 0.3 . 1 . . . A 97 TYR C . 18934 1 1306 . 1 1 97 97 TYR CA C 13 53.354 0.3 . 1 . . . A 97 TYR CA . 18934 1 1307 . 1 1 97 97 TYR CB C 13 39.756 0.3 . 1 . . . A 97 TYR CB . 18934 1 1308 . 1 1 97 97 TYR CD1 C 13 130.278 0.3 . 1 . . . A 97 TYR CD1 . 18934 1 1309 . 1 1 97 97 TYR CE1 C 13 115.451 0.3 . 1 . . . A 97 TYR CE1 . 18934 1 1310 . 1 1 97 97 TYR N N 15 123.430 0.3 . 1 . . . A 97 TYR N . 18934 1 1311 . 1 1 98 98 GLN H H 1 8.695 0.020 . 1 . . . A 98 GLN H . 18934 1 1312 . 1 1 98 98 GLN HA H 1 4.656 0.020 . 1 . . . A 98 GLN HA . 18934 1 1313 . 1 1 98 98 GLN HB2 H 1 2.020 0.020 . 2 . . . A 98 GLN HB2 . 18934 1 1314 . 1 1 98 98 GLN HB3 H 1 1.890 0.020 . 2 . . . A 98 GLN HB3 . 18934 1 1315 . 1 1 98 98 GLN HG2 H 1 2.205 0.020 . 1 . . . A 98 GLN HG2 . 18934 1 1316 . 1 1 98 98 GLN HG3 H 1 2.205 0.020 . 1 . . . A 98 GLN HG3 . 18934 1 1317 . 1 1 98 98 GLN C C 13 169.901 0.3 . 1 . . . A 98 GLN C . 18934 1 1318 . 1 1 98 98 GLN CA C 13 52.894 0.3 . 1 . . . A 98 GLN CA . 18934 1 1319 . 1 1 98 98 GLN CB C 13 27.974 0.3 . 1 . . . A 98 GLN CB . 18934 1 1320 . 1 1 98 98 GLN CG C 13 33.518 0.3 . 1 . . . A 98 GLN CG . 18934 1 1321 . 1 1 98 98 GLN N N 15 122.635 0.3 . 1 . . . A 98 GLN N . 18934 1 1322 . 1 1 99 99 LEU H H 1 9.206 0.020 . 1 . . . A 99 LEU H . 18934 1 1323 . 1 1 99 99 LEU HA H 1 4.959 0.020 . 1 . . . A 99 LEU HA . 18934 1 1324 . 1 1 99 99 LEU HB2 H 1 1.679 0.020 . 1 . . . A 99 LEU HB2 . 18934 1 1325 . 1 1 99 99 LEU HB3 H 1 1.679 0.020 . 1 . . . A 99 LEU HB3 . 18934 1 1326 . 1 1 99 99 LEU HG H 1 1.219 0.020 . 1 . . . A 99 LEU HG . 18934 1 1327 . 1 1 99 99 LEU HD11 H 1 0.640 0.020 . 1 . . . A 99 LEU HD11 . 18934 1 1328 . 1 1 99 99 LEU HD12 H 1 0.640 0.020 . 1 . . . A 99 LEU HD12 . 18934 1 1329 . 1 1 99 99 LEU HD13 H 1 0.640 0.020 . 1 . . . A 99 LEU HD13 . 18934 1 1330 . 1 1 99 99 LEU HD21 H 1 0.575 0.020 . 1 . . . A 99 LEU HD21 . 18934 1 1331 . 1 1 99 99 LEU HD22 H 1 0.575 0.020 . 1 . . . A 99 LEU HD22 . 18934 1 1332 . 1 1 99 99 LEU HD23 H 1 0.575 0.020 . 1 . . . A 99 LEU HD23 . 18934 1 1333 . 1 1 99 99 LEU C C 13 169.895 0.3 . 1 . . . A 99 LEU C . 18934 1 1334 . 1 1 99 99 LEU CA C 13 50.180 0.3 . 1 . . . A 99 LEU CA . 18934 1 1335 . 1 1 99 99 LEU CB C 13 43.146 0.3 . 1 . . . A 99 LEU CB . 18934 1 1336 . 1 1 99 99 LEU CG C 13 24.934 0.3 . 1 . . . A 99 LEU CG . 18934 1 1337 . 1 1 99 99 LEU CD1 C 13 21.184 0.3 . 1 . . . A 99 LEU CD1 . 18934 1 1338 . 1 1 99 99 LEU CD2 C 13 24.309 0.3 . 1 . . . A 99 LEU CD2 . 18934 1 1339 . 1 1 99 99 LEU N N 15 130.510 0.3 . 1 . . . A 99 LEU N . 18934 1 1340 . 1 1 100 100 ASP H H 1 9.060 0.020 . 1 . . . A 100 ASP H . 18934 1 1341 . 1 1 100 100 ASP HA H 1 5.105 0.020 . 1 . . . A 100 ASP HA . 18934 1 1342 . 1 1 100 100 ASP HB2 H 1 3.089 0.020 . 2 . . . A 100 ASP HB2 . 18934 1 1343 . 1 1 100 100 ASP HB3 H 1 2.024 0.020 . 2 . . . A 100 ASP HB3 . 18934 1 1344 . 1 1 100 100 ASP CA C 13 49.501 0.3 . 1 . . . A 100 ASP CA . 18934 1 1345 . 1 1 100 100 ASP CB C 13 39.994 0.3 . 1 . . . A 100 ASP CB . 18934 1 1346 . 1 1 100 100 ASP N N 15 129.093 0.3 . 1 . . . A 100 ASP N . 18934 1 1347 . 1 1 101 101 LEU H H 1 8.536 0.020 . 1 . . . A 101 LEU H . 18934 1 1348 . 1 1 101 101 LEU HA H 1 5.192 0.020 . 1 . . . A 101 LEU HA . 18934 1 1349 . 1 1 101 101 LEU HB2 H 1 1.729 0.020 . 2 . . . A 101 LEU HB2 . 18934 1 1350 . 1 1 101 101 LEU HB3 H 1 0.934 0.020 . 2 . . . A 101 LEU HB3 . 18934 1 1351 . 1 1 101 101 LEU HG H 1 0.682 0.020 . 1 . . . A 101 LEU HG . 18934 1 1352 . 1 1 101 101 LEU HD11 H 1 0.585 0.020 . 1 . . . A 101 LEU HD11 . 18934 1 1353 . 1 1 101 101 LEU HD12 H 1 0.585 0.020 . 1 . . . A 101 LEU HD12 . 18934 1 1354 . 1 1 101 101 LEU HD13 H 1 0.585 0.020 . 1 . . . A 101 LEU HD13 . 18934 1 1355 . 1 1 101 101 LEU HD21 H 1 0.650 0.020 . 1 . . . A 101 LEU HD21 . 18934 1 1356 . 1 1 101 101 LEU HD22 H 1 0.650 0.020 . 1 . . . A 101 LEU HD22 . 18934 1 1357 . 1 1 101 101 LEU HD23 H 1 0.650 0.020 . 1 . . . A 101 LEU HD23 . 18934 1 1358 . 1 1 101 101 LEU C C 13 171.718 0.3 . 1 . . . A 101 LEU C . 18934 1 1359 . 1 1 101 101 LEU CA C 13 49.501 0.3 . 1 . . . A 101 LEU CA . 18934 1 1360 . 1 1 101 101 LEU CB C 13 42.006 0.3 . 1 . . . A 101 LEU CB . 18934 1 1361 . 1 1 101 101 LEU CG C 13 23.695 0.3 . 1 . . . A 101 LEU CG . 18934 1 1362 . 1 1 101 101 LEU CD1 C 13 24.113 0.3 . 1 . . . A 101 LEU CD1 . 18934 1 1363 . 1 1 101 101 LEU CD2 C 13 21.184 0.3 . 1 . . . A 101 LEU CD2 . 18934 1 1364 . 1 1 101 101 LEU N N 15 119.756 0.3 . 1 . . . A 101 LEU N . 18934 1 1365 . 1 1 102 102 PHE H H 1 8.733 0.020 . 1 . . . A 102 PHE H . 18934 1 1366 . 1 1 102 102 PHE HA H 1 5.324 0.020 . 1 . . . A 102 PHE HA . 18934 1 1367 . 1 1 102 102 PHE HB2 H 1 2.424 0.020 . 2 . . . A 102 PHE HB2 . 18934 1 1368 . 1 1 102 102 PHE HB3 H 1 2.171 0.020 . 2 . . . A 102 PHE HB3 . 18934 1 1369 . 1 1 102 102 PHE HD1 H 1 6.758 0.020 . 1 . . . A 102 PHE HD1 . 18934 1 1370 . 1 1 102 102 PHE HD2 H 1 6.758 0.020 . 1 . . . A 102 PHE HD2 . 18934 1 1371 . 1 1 102 102 PHE HE1 H 1 7.130 0.020 . 1 . . . A 102 PHE HE1 . 18934 1 1372 . 1 1 102 102 PHE HE2 H 1 7.130 0.020 . 1 . . . A 102 PHE HE2 . 18934 1 1373 . 1 1 102 102 PHE HZ H 1 7.323 0.020 . 1 . . . A 102 PHE HZ . 18934 1 1374 . 1 1 102 102 PHE CA C 13 52.215 0.3 . 1 . . . A 102 PHE CA . 18934 1 1375 . 1 1 102 102 PHE CB C 13 39.528 0.3 . 1 . . . A 102 PHE CB . 18934 1 1376 . 1 1 102 102 PHE CD1 C 13 130.012 0.3 . 1 . . . A 102 PHE CD1 . 18934 1 1377 . 1 1 102 102 PHE CE1 C 13 127.981 0.3 . 1 . . . A 102 PHE CE1 . 18934 1 1378 . 1 1 102 102 PHE CZ C 13 125.893 0.3 . 1 . . . A 102 PHE CZ . 18934 1 1379 . 1 1 102 102 PHE N N 15 119.803 0.3 . 1 . . . A 102 PHE N . 18934 1 1380 . 1 1 103 103 THR H H 1 7.940 0.020 . 1 . . . A 103 THR H . 18934 1 1381 . 1 1 103 103 THR HA H 1 5.646 0.020 . 1 . . . A 103 THR HA . 18934 1 1382 . 1 1 103 103 THR HB H 1 3.867 0.020 . 1 . . . A 103 THR HB . 18934 1 1383 . 1 1 103 103 THR HG21 H 1 0.976 0.020 . 1 . . . A 103 THR HG21 . 18934 1 1384 . 1 1 103 103 THR HG22 H 1 0.976 0.020 . 1 . . . A 103 THR HG22 . 18934 1 1385 . 1 1 103 103 THR HG23 H 1 0.976 0.020 . 1 . . . A 103 THR HG23 . 18934 1 1386 . 1 1 103 103 THR C C 13 172.052 0.3 . 1 . . . A 103 THR C . 18934 1 1387 . 1 1 103 103 THR CA C 13 55.611 0.3 . 1 . . . A 103 THR CA . 18934 1 1388 . 1 1 103 103 THR CB C 13 69.217 0.3 . 1 . . . A 103 THR CB . 18934 1 1389 . 1 1 103 103 THR CG2 C 13 20.592 0.3 . 1 . . . A 103 THR CG2 . 18934 1 1390 . 1 1 103 103 THR N N 15 107.681 0.3 . 1 . . . A 103 THR N . 18934 1 1391 . 1 1 104 104 ALA H H 1 8.651 0.020 . 1 . . . A 104 ALA H . 18934 1 1392 . 1 1 104 104 ALA HA H 1 4.573 0.020 . 1 . . . A 104 ALA HA . 18934 1 1393 . 1 1 104 104 ALA HB1 H 1 1.368 0.020 . 1 . . . A 104 ALA HB1 . 18934 1 1394 . 1 1 104 104 ALA HB2 H 1 1.368 0.020 . 1 . . . A 104 ALA HB2 . 18934 1 1395 . 1 1 104 104 ALA HB3 H 1 1.368 0.020 . 1 . . . A 104 ALA HB3 . 18934 1 1396 . 1 1 104 104 ALA C C 13 172.992 0.3 . 1 . . . A 104 ALA C . 18934 1 1397 . 1 1 104 104 ALA CA C 13 47.683 0.3 . 1 . . . A 104 ALA CA . 18934 1 1398 . 1 1 104 104 ALA CB C 13 20.951 0.3 . 1 . . . A 104 ALA CB . 18934 1 1399 . 1 1 104 104 ALA N N 15 121.958 0.3 . 1 . . . A 104 ALA N . 18934 1 1400 . 1 1 105 105 LEU H H 1 8.351 0.020 . 1 . . . A 105 LEU H . 18934 1 1401 . 1 1 105 105 LEU HA H 1 4.934 0.020 . 1 . . . A 105 LEU HA . 18934 1 1402 . 1 1 105 105 LEU HB2 H 1 1.964 0.020 . 2 . . . A 105 LEU HB2 . 18934 1 1403 . 1 1 105 105 LEU HB3 H 1 1.387 0.020 . 2 . . . A 105 LEU HB3 . 18934 1 1404 . 1 1 105 105 LEU HG H 1 1.701 0.020 . 1 . . . A 105 LEU HG . 18934 1 1405 . 1 1 105 105 LEU HD11 H 1 0.959 0.020 . 1 . . . A 105 LEU HD11 . 18934 1 1406 . 1 1 105 105 LEU HD12 H 1 0.959 0.020 . 1 . . . A 105 LEU HD12 . 18934 1 1407 . 1 1 105 105 LEU HD13 H 1 0.959 0.020 . 1 . . . A 105 LEU HD13 . 18934 1 1408 . 1 1 105 105 LEU HD21 H 1 0.865 0.020 . 1 . . . A 105 LEU HD21 . 18934 1 1409 . 1 1 105 105 LEU HD22 H 1 0.865 0.020 . 1 . . . A 105 LEU HD22 . 18934 1 1410 . 1 1 105 105 LEU HD23 H 1 0.865 0.020 . 1 . . . A 105 LEU HD23 . 18934 1 1411 . 1 1 105 105 LEU C C 13 172.031 0.3 . 1 . . . A 105 LEU C . 18934 1 1412 . 1 1 105 105 LEU CA C 13 50.859 0.3 . 1 . . . A 105 LEU CA . 18934 1 1413 . 1 1 105 105 LEU CB C 13 40.201 0.3 . 1 . . . A 105 LEU CB . 18934 1 1414 . 1 1 105 105 LEU CG C 13 24.674 0.3 . 1 . . . A 105 LEU CG . 18934 1 1415 . 1 1 105 105 LEU CD1 C 13 22.953 0.3 . 1 . . . A 105 LEU CD1 . 18934 1 1416 . 1 1 105 105 LEU CD2 C 13 20.729 0.3 . 1 . . . A 105 LEU CD2 . 18934 1 1417 . 1 1 105 105 LEU N N 15 120.296 0.3 . 1 . . . A 105 LEU N . 18934 1 1418 . 1 1 106 106 ALA H H 1 8.068 0.020 . 1 . . . A 106 ALA H . 18934 1 1419 . 1 1 106 106 ALA HA H 1 3.827 0.020 . 1 . . . A 106 ALA HA . 18934 1 1420 . 1 1 106 106 ALA HB1 H 1 1.453 0.020 . 1 . . . A 106 ALA HB1 . 18934 1 1421 . 1 1 106 106 ALA HB2 H 1 1.453 0.020 . 1 . . . A 106 ALA HB2 . 18934 1 1422 . 1 1 106 106 ALA HB3 H 1 1.453 0.020 . 1 . . . A 106 ALA HB3 . 18934 1 1423 . 1 1 106 106 ALA C C 13 178.338 0.3 . 1 . . . A 106 ALA C . 18934 1 1424 . 1 1 106 106 ALA CA C 13 54.032 0.3 . 1 . . . A 106 ALA CA . 18934 1 1425 . 1 1 106 106 ALA CB C 13 15.507 0.3 . 1 . . . A 106 ALA CB . 18934 1 1426 . 1 1 106 106 ALA N N 15 124.152 0.3 . 1 . . . A 106 ALA N . 18934 1 1427 . 1 1 107 107 GLU H H 1 9.664 0.020 . 1 . . . A 107 GLU H . 18934 1 1428 . 1 1 107 107 GLU HA H 1 4.261 0.020 . 1 . . . A 107 GLU HA . 18934 1 1429 . 1 1 107 107 GLU HB2 H 1 2.182 0.020 . 1 . . . A 107 GLU HB2 . 18934 1 1430 . 1 1 107 107 GLU HB3 H 1 2.182 0.020 . 1 . . . A 107 GLU HB3 . 18934 1 1431 . 1 1 107 107 GLU HG2 H 1 2.376 0.020 . 1 . . . A 107 GLU HG2 . 18934 1 1432 . 1 1 107 107 GLU HG3 H 1 2.376 0.020 . 1 . . . A 107 GLU HG3 . 18934 1 1433 . 1 1 107 107 GLU C C 13 174.892 0.3 . 1 . . . A 107 GLU C . 18934 1 1434 . 1 1 107 107 GLU CA C 13 56.292 0.3 . 1 . . . A 107 GLU CA . 18934 1 1435 . 1 1 107 107 GLU CB C 13 26.159 0.3 . 1 . . . A 107 GLU CB . 18934 1 1436 . 1 1 107 107 GLU CG C 13 33.690 0.3 . 1 . . . A 107 GLU CG . 18934 1 1437 . 1 1 107 107 GLU N N 15 115.897 0.3 . 1 . . . A 107 GLU N . 18934 1 1438 . 1 1 108 108 GLU H H 1 7.632 0.020 . 1 . . . A 108 GLU H . 18934 1 1439 . 1 1 108 108 GLU HA H 1 4.512 0.020 . 1 . . . A 108 GLU HA . 18934 1 1440 . 1 1 108 108 GLU HB2 H 1 2.707 0.020 . 1 . . . A 108 GLU HB2 . 18934 1 1441 . 1 1 108 108 GLU HB3 H 1 2.707 0.020 . 1 . . . A 108 GLU HB3 . 18934 1 1442 . 1 1 108 108 GLU HG2 H 1 2.760 0.020 . 1 . . . A 108 GLU HG2 . 18934 1 1443 . 1 1 108 108 GLU HG3 H 1 2.760 0.020 . 1 . . . A 108 GLU HG3 . 18934 1 1444 . 1 1 108 108 GLU CA C 13 52.671 0.3 . 1 . . . A 108 GLU CA . 18934 1 1445 . 1 1 108 108 GLU CB C 13 27.747 0.3 . 1 . . . A 108 GLU CB . 18934 1 1446 . 1 1 108 108 GLU CG C 13 32.954 0.3 . 1 . . . A 108 GLU CG . 18934 1 1447 . 1 1 108 108 GLU N N 15 115.684 0.3 . 1 . . . A 108 GLU N . 18934 1 1448 . 1 1 109 109 LYS H H 1 7.552 0.020 . 1 . . . A 109 LYS H . 18934 1 1449 . 1 1 109 109 LYS HA H 1 3.843 0.020 . 1 . . . A 109 LYS HA . 18934 1 1450 . 1 1 109 109 LYS HB2 H 1 2.175 0.020 . 1 . . . A 109 LYS HB2 . 18934 1 1451 . 1 1 109 109 LYS HB3 H 1 2.175 0.020 . 1 . . . A 109 LYS HB3 . 18934 1 1452 . 1 1 109 109 LYS HG2 H 1 1.908 0.020 . 1 . . . A 109 LYS HG2 . 18934 1 1453 . 1 1 109 109 LYS HG3 H 1 1.908 0.020 . 1 . . . A 109 LYS HG3 . 18934 1 1454 . 1 1 109 109 LYS C C 13 169.839 0.3 . 1 . . . A 109 LYS C . 18934 1 1455 . 1 1 109 109 LYS CA C 13 60.592 0.3 . 1 . . . A 109 LYS CA . 18934 1 1456 . 1 1 109 109 LYS CB C 13 28.655 0.3 . 1 . . . A 109 LYS CB . 18934 1 1457 . 1 1 109 109 LYS N N 15 119.324 0.3 . 1 . . . A 109 LYS N . 18934 1 1458 . 1 1 110 110 PRO HA H 1 3.925 0.020 . 1 . . . A 110 PRO HA . 18934 1 1459 . 1 1 110 110 PRO HB2 H 1 1.495 0.020 . 2 . . . A 110 PRO HB2 . 18934 1 1460 . 1 1 110 110 PRO HB3 H 1 0.900 0.020 . 2 . . . A 110 PRO HB3 . 18934 1 1461 . 1 1 110 110 PRO HG2 H 1 1.345 0.020 . 1 . . . A 110 PRO HG2 . 18934 1 1462 . 1 1 110 110 PRO HG3 H 1 1.345 0.020 . 1 . . . A 110 PRO HG3 . 18934 1 1463 . 1 1 110 110 PRO C C 13 174.285 0.3 . 1 . . . A 110 PRO C . 18934 1 1464 . 1 1 110 110 PRO CA C 13 63.998 0.3 . 1 . . . A 110 PRO CA . 18934 1 1465 . 1 1 110 110 PRO CB C 13 27.747 0.3 . 1 . . . A 110 PRO CB . 18934 1 1466 . 1 1 111 111 TYR H H 1 6.388 0.020 . 1 . . . A 111 TYR H . 18934 1 1467 . 1 1 111 111 TYR HA H 1 3.830 0.020 . 1 . . . A 111 TYR HA . 18934 1 1468 . 1 1 111 111 TYR HB2 H 1 3.436 0.020 . 2 . . . A 111 TYR HB2 . 18934 1 1469 . 1 1 111 111 TYR HB3 H 1 2.846 0.020 . 2 . . . A 111 TYR HB3 . 18934 1 1470 . 1 1 111 111 TYR HD1 H 1 6.924 0.020 . 1 . . . A 111 TYR HD1 . 18934 1 1471 . 1 1 111 111 TYR HD2 H 1 6.924 0.020 . 1 . . . A 111 TYR HD2 . 18934 1 1472 . 1 1 111 111 TYR HE1 H 1 6.735 0.020 . 1 . . . A 111 TYR HE1 . 18934 1 1473 . 1 1 111 111 TYR HE2 H 1 6.735 0.020 . 1 . . . A 111 TYR HE2 . 18934 1 1474 . 1 1 111 111 TYR C C 13 176.584 0.3 . 1 . . . A 111 TYR C . 18934 1 1475 . 1 1 111 111 TYR CA C 13 56.745 0.3 . 1 . . . A 111 TYR CA . 18934 1 1476 . 1 1 111 111 TYR CB C 13 33.638 0.3 . 1 . . . A 111 TYR CB . 18934 1 1477 . 1 1 111 111 TYR CD1 C 13 130.057 0.3 . 1 . . . A 111 TYR CD1 . 18934 1 1478 . 1 1 111 111 TYR CE1 C 13 116.928 0.3 . 1 . . . A 111 TYR CE1 . 18934 1 1479 . 1 1 111 111 TYR N N 15 114.378 0.3 . 1 . . . A 111 TYR N . 18934 1 1480 . 1 1 112 112 ALA H H 1 8.620 0.020 . 1 . . . A 112 ALA H . 18934 1 1481 . 1 1 112 112 ALA HA H 1 3.899 0.020 . 1 . . . A 112 ALA HA . 18934 1 1482 . 1 1 112 112 ALA HB1 H 1 1.605 0.020 . 1 . . . A 112 ALA HB1 . 18934 1 1483 . 1 1 112 112 ALA HB2 H 1 1.605 0.020 . 1 . . . A 112 ALA HB2 . 18934 1 1484 . 1 1 112 112 ALA HB3 H 1 1.605 0.020 . 1 . . . A 112 ALA HB3 . 18934 1 1485 . 1 1 112 112 ALA C C 13 176.208 0.3 . 1 . . . A 112 ALA C . 18934 1 1486 . 1 1 112 112 ALA CA C 13 52.667 0.3 . 1 . . . A 112 ALA CA . 18934 1 1487 . 1 1 112 112 ALA CB C 13 16.420 0.3 . 1 . . . A 112 ALA CB . 18934 1 1488 . 1 1 112 112 ALA N N 15 124.190 0.3 . 1 . . . A 112 ALA N . 18934 1 1489 . 1 1 113 113 ILE H H 1 8.640 0.020 . 1 . . . A 113 ILE H . 18934 1 1490 . 1 1 113 113 ILE HA H 1 3.326 0.020 . 1 . . . A 113 ILE HA . 18934 1 1491 . 1 1 113 113 ILE HB H 1 1.655 0.020 . 1 . . . A 113 ILE HB . 18934 1 1492 . 1 1 113 113 ILE HG12 H 1 1.814 0.020 . 2 . . . A 113 ILE HG12 . 18934 1 1493 . 1 1 113 113 ILE HG13 H 1 0.620 0.020 . 2 . . . A 113 ILE HG13 . 18934 1 1494 . 1 1 113 113 ILE HG21 H 1 0.791 0.020 . 1 . . . A 113 ILE HG21 . 18934 1 1495 . 1 1 113 113 ILE HG22 H 1 0.791 0.020 . 1 . . . A 113 ILE HG22 . 18934 1 1496 . 1 1 113 113 ILE HG23 H 1 0.791 0.020 . 1 . . . A 113 ILE HG23 . 18934 1 1497 . 1 1 113 113 ILE HD11 H 1 0.836 0.020 . 1 . . . A 113 ILE HD11 . 18934 1 1498 . 1 1 113 113 ILE HD12 H 1 0.836 0.020 . 1 . . . A 113 ILE HD12 . 18934 1 1499 . 1 1 113 113 ILE HD13 H 1 0.836 0.020 . 1 . . . A 113 ILE HD13 . 18934 1 1500 . 1 1 113 113 ILE C C 13 175.477 0.3 . 1 . . . A 113 ILE C . 18934 1 1501 . 1 1 113 113 ILE CA C 13 64.221 0.3 . 1 . . . A 113 ILE CA . 18934 1 1502 . 1 1 113 113 ILE CB C 13 35.664 0.3 . 1 . . . A 113 ILE CB . 18934 1 1503 . 1 1 113 113 ILE CG1 C 13 27.827 0.3 . 1 . . . A 113 ILE CG1 . 18934 1 1504 . 1 1 113 113 ILE CG2 C 13 13.777 0.3 . 1 . . . A 113 ILE CG2 . 18934 1 1505 . 1 1 113 113 ILE CD1 C 13 12.215 0.3 . 1 . . . A 113 ILE CD1 . 18934 1 1506 . 1 1 113 113 ILE N N 15 118.663 0.3 . 1 . . . A 113 ILE N . 18934 1 1507 . 1 1 114 114 PHE H H 1 7.777 0.020 . 1 . . . A 114 PHE H . 18934 1 1508 . 1 1 114 114 PHE HA H 1 4.550 0.020 . 1 . . . A 114 PHE HA . 18934 1 1509 . 1 1 114 114 PHE HB2 H 1 3.297 0.020 . 2 . . . A 114 PHE HB2 . 18934 1 1510 . 1 1 114 114 PHE HB3 H 1 2.940 0.020 . 2 . . . A 114 PHE HB3 . 18934 1 1511 . 1 1 114 114 PHE HD1 H 1 7.264 0.020 . 1 . . . A 114 PHE HD1 . 18934 1 1512 . 1 1 114 114 PHE HD2 H 1 7.264 0.020 . 1 . . . A 114 PHE HD2 . 18934 1 1513 . 1 1 114 114 PHE HE1 H 1 7.122 0.020 . 1 . . . A 114 PHE HE1 . 18934 1 1514 . 1 1 114 114 PHE HE2 H 1 7.122 0.020 . 1 . . . A 114 PHE HE2 . 18934 1 1515 . 1 1 114 114 PHE HZ H 1 7.096 0.020 . 1 . . . A 114 PHE HZ . 18934 1 1516 . 1 1 114 114 PHE C C 13 175.372 0.3 . 1 . . . A 114 PHE C . 18934 1 1517 . 1 1 114 114 PHE CA C 13 59.451 0.3 . 1 . . . A 114 PHE CA . 18934 1 1518 . 1 1 114 114 PHE CB C 13 37.723 0.3 . 1 . . . A 114 PHE CB . 18934 1 1519 . 1 1 114 114 PHE CD1 C 13 128.921 0.3 . 1 . . . A 114 PHE CD1 . 18934 1 1520 . 1 1 114 114 PHE CE1 C 13 128.547 0.3 . 1 . . . A 114 PHE CE1 . 18934 1 1521 . 1 1 114 114 PHE CZ C 13 126.548 0.3 . 1 . . . A 114 PHE CZ . 18934 1 1522 . 1 1 114 114 PHE N N 15 121.946 0.3 . 1 . . . A 114 PHE N . 18934 1 1523 . 1 1 115 115 HIS H H 1 8.276 0.020 . 1 . . . A 115 HIS H . 18934 1 1524 . 1 1 115 115 HIS HA H 1 3.920 0.020 . 1 . . . A 115 HIS HA . 18934 1 1525 . 1 1 115 115 HIS HB2 H 1 2.850 0.020 . 1 . . . A 115 HIS HB2 . 18934 1 1526 . 1 1 115 115 HIS HB3 H 1 2.850 0.020 . 1 . . . A 115 HIS HB3 . 18934 1 1527 . 1 1 115 115 HIS HD2 H 1 7.020 0.020 . 1 . . . A 115 HIS HD2 . 18934 1 1528 . 1 1 115 115 HIS HE1 H 1 7.581 0.020 . 1 . . . A 115 HIS HE1 . 18934 1 1529 . 1 1 115 115 HIS C C 13 174.328 0.3 . 1 . . . A 115 HIS C . 18934 1 1530 . 1 1 115 115 HIS CA C 13 57.425 0.3 . 1 . . . A 115 HIS CA . 18934 1 1531 . 1 1 115 115 HIS CB C 13 30.010 0.3 . 1 . . . A 115 HIS CB . 18934 1 1532 . 1 1 115 115 HIS CD2 C 13 117.852 0.3 . 1 . . . A 115 HIS CD2 . 18934 1 1533 . 1 1 115 115 HIS CE1 C 13 136.134 0.3 . 1 . . . A 115 HIS CE1 . 18934 1 1534 . 1 1 115 115 HIS N N 15 118.270 0.3 . 1 . . . A 115 HIS N . 18934 1 1535 . 1 1 116 116 PHE H H 1 8.614 0.020 . 1 . . . A 116 PHE H . 18934 1 1536 . 1 1 116 116 PHE HA H 1 4.440 0.020 . 1 . . . A 116 PHE HA . 18934 1 1537 . 1 1 116 116 PHE HB2 H 1 2.857 0.020 . 2 . . . A 116 PHE HB2 . 18934 1 1538 . 1 1 116 116 PHE HB3 H 1 2.545 0.020 . 2 . . . A 116 PHE HB3 . 18934 1 1539 . 1 1 116 116 PHE HD1 H 1 6.978 0.020 . 1 . . . A 116 PHE HD1 . 18934 1 1540 . 1 1 116 116 PHE HD2 H 1 6.978 0.020 . 1 . . . A 116 PHE HD2 . 18934 1 1541 . 1 1 116 116 PHE HE1 H 1 6.967 0.020 . 1 . . . A 116 PHE HE1 . 18934 1 1542 . 1 1 116 116 PHE HE2 H 1 6.967 0.020 . 1 . . . A 116 PHE HE2 . 18934 1 1543 . 1 1 116 116 PHE HZ H 1 7.034 0.020 . 1 . . . A 116 PHE HZ . 18934 1 1544 . 1 1 116 116 PHE C C 13 174.850 0.3 . 1 . . . A 116 PHE C . 18934 1 1545 . 1 1 116 116 PHE CA C 13 57.199 0.3 . 1 . . . A 116 PHE CA . 18934 1 1546 . 1 1 116 116 PHE CB C 13 34.997 0.3 . 1 . . . A 116 PHE CB . 18934 1 1547 . 1 1 116 116 PHE CD1 C 13 130.765 0.3 . 1 . . . A 116 PHE CD1 . 18934 1 1548 . 1 1 116 116 PHE CE1 C 13 127.992 0.3 . 1 . . . A 116 PHE CE1 . 18934 1 1549 . 1 1 116 116 PHE CZ C 13 126.850 0.3 . 1 . . . A 116 PHE CZ . 18934 1 1550 . 1 1 116 116 PHE N N 15 109.884 0.3 . 1 . . . A 116 PHE N . 18934 1 1551 . 1 1 117 117 THR H H 1 7.623 0.020 . 1 . . . A 117 THR H . 18934 1 1552 . 1 1 117 117 THR HA H 1 4.309 0.020 . 1 . . . A 117 THR HA . 18934 1 1553 . 1 1 117 117 THR HB H 1 3.979 0.020 . 1 . . . A 117 THR HB . 18934 1 1554 . 1 1 117 117 THR HG21 H 1 1.044 0.020 . 1 . . . A 117 THR HG21 . 18934 1 1555 . 1 1 117 117 THR HG22 H 1 1.044 0.020 . 1 . . . A 117 THR HG22 . 18934 1 1556 . 1 1 117 117 THR HG23 H 1 1.044 0.020 . 1 . . . A 117 THR HG23 . 18934 1 1557 . 1 1 117 117 THR CA C 13 64.224 0.3 . 1 . . . A 117 THR CA . 18934 1 1558 . 1 1 117 117 THR CB C 13 65.341 0.3 . 1 . . . A 117 THR CB . 18934 1 1559 . 1 1 117 117 THR CG2 C 13 18.286 0.3 . 1 . . . A 117 THR CG2 . 18934 1 1560 . 1 1 117 117 THR N N 15 116.995 0.3 . 1 . . . A 117 THR N . 18934 1 1561 . 1 1 118 118 GLY H H 1 6.897 0.020 . 1 . . . A 118 GLY H . 18934 1 1562 . 1 1 118 118 GLY HA2 H 1 3.026 0.020 . 2 . . . A 118 GLY HA2 . 18934 1 1563 . 1 1 118 118 GLY HA3 H 1 3.351 0.020 . 2 . . . A 118 GLY HA3 . 18934 1 1564 . 1 1 118 118 GLY C C 13 167.625 0.3 . 1 . . . A 118 GLY C . 18934 1 1565 . 1 1 118 118 GLY CA C 13 41.569 0.3 . 1 . . . A 118 GLY CA . 18934 1 1566 . 1 1 118 118 GLY N N 15 106.807 0.3 . 1 . . . A 118 GLY N . 18934 1 1567 . 1 1 119 119 PRO HA H 1 4.668 0.020 . 1 . . . A 119 PRO HA . 18934 1 1568 . 1 1 119 119 PRO HB2 H 1 2.390 0.020 . 2 . . . A 119 PRO HB2 . 18934 1 1569 . 1 1 119 119 PRO HB3 H 1 2.130 0.020 . 2 . . . A 119 PRO HB3 . 18934 1 1570 . 1 1 119 119 PRO HG2 H 1 1.900 0.020 . 1 . . . A 119 PRO HG2 . 18934 1 1571 . 1 1 119 119 PRO HG3 H 1 1.900 0.020 . 1 . . . A 119 PRO HG3 . 18934 1 1572 . 1 1 119 119 PRO HD2 H 1 4.284 0.020 . 1 . . . A 119 PRO HD2 . 18934 1 1573 . 1 1 119 119 PRO HD3 H 1 4.284 0.020 . 1 . . . A 119 PRO HD3 . 18934 1 1574 . 1 1 119 119 PRO C C 13 174.690 0.3 . 1 . . . A 119 PRO C . 18934 1 1575 . 1 1 119 119 PRO CA C 13 60.373 0.3 . 1 . . . A 119 PRO CA . 18934 1 1576 . 1 1 119 119 PRO CB C 13 32.051 0.3 . 1 . . . A 119 PRO CB . 18934 1 1577 . 1 1 119 119 PRO CG C 13 26.353 0.3 . 1 . . . A 119 PRO CG . 18934 1 1578 . 1 1 119 119 PRO CD C 13 53.341 0.3 . 1 . . . A 119 PRO CD . 18934 1 1579 . 1 1 120 120 VAL H H 1 9.418 0.020 . 1 . . . A 120 VAL H . 18934 1 1580 . 1 1 120 120 VAL HA H 1 3.025 0.020 . 1 . . . A 120 VAL HA . 18934 1 1581 . 1 1 120 120 VAL HB H 1 1.615 0.020 . 1 . . . A 120 VAL HB . 18934 1 1582 . 1 1 120 120 VAL HG11 H 1 0.714 0.020 . 1 . . . A 120 VAL HG11 . 18934 1 1583 . 1 1 120 120 VAL HG12 H 1 0.714 0.020 . 1 . . . A 120 VAL HG12 . 18934 1 1584 . 1 1 120 120 VAL HG13 H 1 0.714 0.020 . 1 . . . A 120 VAL HG13 . 18934 1 1585 . 1 1 120 120 VAL HG21 H 1 0.408 0.020 . 1 . . . A 120 VAL HG21 . 18934 1 1586 . 1 1 120 120 VAL HG22 H 1 0.408 0.020 . 1 . . . A 120 VAL HG22 . 18934 1 1587 . 1 1 120 120 VAL HG23 H 1 0.408 0.020 . 1 . . . A 120 VAL HG23 . 18934 1 1588 . 1 1 120 120 VAL C C 13 174.670 0.3 . 1 . . . A 120 VAL C . 18934 1 1589 . 1 1 120 120 VAL CA C 13 64.901 0.3 . 1 . . . A 120 VAL CA . 18934 1 1590 . 1 1 120 120 VAL CB C 13 28.422 0.3 . 1 . . . A 120 VAL CB . 18934 1 1591 . 1 1 120 120 VAL CG1 C 13 17.805 0.3 . 1 . . . A 120 VAL CG1 . 18934 1 1592 . 1 1 120 120 VAL CG2 C 13 19.281 0.3 . 1 . . . A 120 VAL CG2 . 18934 1 1593 . 1 1 120 120 VAL N N 15 122.263 0.3 . 1 . . . A 120 VAL N . 18934 1 1594 . 1 1 121 121 SER H H 1 8.380 0.020 . 1 . . . A 121 SER H . 18934 1 1595 . 1 1 121 121 SER HA H 1 3.815 0.020 . 1 . . . A 121 SER HA . 18934 1 1596 . 1 1 121 121 SER HB2 H 1 3.784 0.020 . 1 . . . A 121 SER HB2 . 18934 1 1597 . 1 1 121 121 SER HB3 H 1 3.784 0.020 . 1 . . . A 121 SER HB3 . 18934 1 1598 . 1 1 121 121 SER CA C 13 58.791 0.3 . 1 . . . A 121 SER CA . 18934 1 1599 . 1 1 121 121 SER CB C 13 58.548 0.3 . 1 . . . A 121 SER CB . 18934 1 1600 . 1 1 121 121 SER N N 15 113.164 0.3 . 1 . . . A 121 SER N . 18934 1 1601 . 1 1 122 122 TYR H H 1 6.441 0.020 . 1 . . . A 122 TYR H . 18934 1 1602 . 1 1 122 122 TYR HA H 1 4.177 0.020 . 1 . . . A 122 TYR HA . 18934 1 1603 . 1 1 122 122 TYR HB2 H 1 2.595 0.020 . 2 . . . A 122 TYR HB2 . 18934 1 1604 . 1 1 122 122 TYR HB3 H 1 2.473 0.020 . 2 . . . A 122 TYR HB3 . 18934 1 1605 . 1 1 122 122 TYR HD1 H 1 6.771 0.020 . 1 . . . A 122 TYR HD1 . 18934 1 1606 . 1 1 122 122 TYR HD2 H 1 6.771 0.020 . 1 . . . A 122 TYR HD2 . 18934 1 1607 . 1 1 122 122 TYR HE1 H 1 6.709 0.020 . 1 . . . A 122 TYR HE1 . 18934 1 1608 . 1 1 122 122 TYR HE2 H 1 6.709 0.020 . 1 . . . A 122 TYR HE2 . 18934 1 1609 . 1 1 122 122 TYR C C 13 173.262 0.3 . 1 . . . A 122 TYR C . 18934 1 1610 . 1 1 122 122 TYR CA C 13 56.524 0.3 . 1 . . . A 122 TYR CA . 18934 1 1611 . 1 1 122 122 TYR CB C 13 36.811 0.3 . 1 . . . A 122 TYR CB . 18934 1 1612 . 1 1 122 122 TYR CD2 C 13 130.469 0.3 . 1 . . . A 122 TYR CD2 . 18934 1 1613 . 1 1 122 122 TYR CE2 C 13 115.739 0.3 . 1 . . . A 122 TYR CE2 . 18934 1 1614 . 1 1 122 122 TYR N N 15 124.525 0.3 . 1 . . . A 122 TYR N . 18934 1 1615 . 1 1 123 123 LEU H H 1 7.416 0.020 . 1 . . . A 123 LEU H . 18934 1 1616 . 1 1 123 123 LEU HA H 1 3.506 0.020 . 1 . . . A 123 LEU HA . 18934 1 1617 . 1 1 123 123 LEU HB2 H 1 1.649 0.020 . 1 . . . A 123 LEU HB2 . 18934 1 1618 . 1 1 123 123 LEU HB3 H 1 1.649 0.020 . 1 . . . A 123 LEU HB3 . 18934 1 1619 . 1 1 123 123 LEU HG H 1 1.309 0.020 . 1 . . . A 123 LEU HG . 18934 1 1620 . 1 1 123 123 LEU HD11 H 1 0.455 0.020 . 1 . . . A 123 LEU HD11 . 18934 1 1621 . 1 1 123 123 LEU HD12 H 1 0.455 0.020 . 1 . . . A 123 LEU HD12 . 18934 1 1622 . 1 1 123 123 LEU HD13 H 1 0.455 0.020 . 1 . . . A 123 LEU HD13 . 18934 1 1623 . 1 1 123 123 LEU HD21 H 1 0.354 0.020 . 1 . . . A 123 LEU HD21 . 18934 1 1624 . 1 1 123 123 LEU HD22 H 1 0.354 0.020 . 1 . . . A 123 LEU HD22 . 18934 1 1625 . 1 1 123 123 LEU HD23 H 1 0.354 0.020 . 1 . . . A 123 LEU HD23 . 18934 1 1626 . 1 1 123 123 LEU C C 13 176.772 0.3 . 1 . . . A 123 LEU C . 18934 1 1627 . 1 1 123 123 LEU CA C 13 54.702 0.3 . 1 . . . A 123 LEU CA . 18934 1 1628 . 1 1 123 123 LEU CB C 13 37.952 0.3 . 1 . . . A 123 LEU CB . 18934 1 1629 . 1 1 123 123 LEU CG C 13 23.180 0.3 . 1 . . . A 123 LEU CG . 18934 1 1630 . 1 1 123 123 LEU CD1 C 13 23.183 0.3 . 1 . . . A 123 LEU CD1 . 18934 1 1631 . 1 1 123 123 LEU CD2 C 13 18.549 0.3 . 1 . . . A 123 LEU CD2 . 18934 1 1632 . 1 1 123 123 LEU N N 15 117.017 0.3 . 1 . . . A 123 LEU N . 18934 1 1633 . 1 1 124 124 ILE H H 1 8.440 0.020 . 1 . . . A 124 ILE H . 18934 1 1634 . 1 1 124 124 ILE HA H 1 3.502 0.020 . 1 . . . A 124 ILE HA . 18934 1 1635 . 1 1 124 124 ILE HB H 1 1.731 0.020 . 1 . . . A 124 ILE HB . 18934 1 1636 . 1 1 124 124 ILE HG12 H 1 1.587 0.020 . 2 . . . A 124 ILE HG12 . 18934 1 1637 . 1 1 124 124 ILE HG13 H 1 1.032 0.020 . 2 . . . A 124 ILE HG13 . 18934 1 1638 . 1 1 124 124 ILE HG21 H 1 0.830 0.020 . 1 . . . A 124 ILE HG21 . 18934 1 1639 . 1 1 124 124 ILE HG22 H 1 0.830 0.020 . 1 . . . A 124 ILE HG22 . 18934 1 1640 . 1 1 124 124 ILE HG23 H 1 0.830 0.020 . 1 . . . A 124 ILE HG23 . 18934 1 1641 . 1 1 124 124 ILE HD11 H 1 0.709 0.020 . 1 . . . A 124 ILE HD11 . 18934 1 1642 . 1 1 124 124 ILE HD12 H 1 0.709 0.020 . 1 . . . A 124 ILE HD12 . 18934 1 1643 . 1 1 124 124 ILE HD13 H 1 0.709 0.020 . 1 . . . A 124 ILE HD13 . 18934 1 1644 . 1 1 124 124 ILE C C 13 175.957 0.3 . 1 . . . A 124 ILE C . 18934 1 1645 . 1 1 124 124 ILE CA C 13 62.871 0.3 . 1 . . . A 124 ILE CA . 18934 1 1646 . 1 1 124 124 ILE CB C 13 35.225 0.3 . 1 . . . A 124 ILE CB . 18934 1 1647 . 1 1 124 124 ILE CG1 C 13 26.522 0.3 . 1 . . . A 124 ILE CG1 . 18934 1 1648 . 1 1 124 124 ILE CG2 C 13 14.153 0.3 . 1 . . . A 124 ILE CG2 . 18934 1 1649 . 1 1 124 124 ILE CD1 C 13 10.744 0.3 . 1 . . . A 124 ILE CD1 . 18934 1 1650 . 1 1 124 124 ILE N N 15 117.820 0.3 . 1 . . . A 124 ILE N . 18934 1 1651 . 1 1 125 125 ARG H H 1 7.086 0.020 . 1 . . . A 125 ARG H . 18934 1 1652 . 1 1 125 125 ARG HA H 1 4.103 0.020 . 1 . . . A 125 ARG HA . 18934 1 1653 . 1 1 125 125 ARG HB2 H 1 1.861 0.020 . 1 . . . A 125 ARG HB2 . 18934 1 1654 . 1 1 125 125 ARG HB3 H 1 1.861 0.020 . 1 . . . A 125 ARG HB3 . 18934 1 1655 . 1 1 125 125 ARG HG2 H 1 1.555 0.020 . 2 . . . A 125 ARG HG2 . 18934 1 1656 . 1 1 125 125 ARG HG3 H 1 1.737 0.020 . 2 . . . A 125 ARG HG3 . 18934 1 1657 . 1 1 125 125 ARG HD2 H 1 3.215 0.020 . 1 . . . A 125 ARG HD2 . 18934 1 1658 . 1 1 125 125 ARG HD3 H 1 3.215 0.020 . 1 . . . A 125 ARG HD3 . 18934 1 1659 . 1 1 125 125 ARG HE H 1 7.441 0.020 . 1 . . . A 125 ARG HE . 18934 1 1660 . 1 1 125 125 ARG C C 13 176.813 0.3 . 1 . . . A 125 ARG C . 18934 1 1661 . 1 1 125 125 ARG CA C 13 56.973 0.3 . 1 . . . A 125 ARG CA . 18934 1 1662 . 1 1 125 125 ARG CB C 13 27.288 0.3 . 1 . . . A 125 ARG CB . 18934 1 1663 . 1 1 125 125 ARG CG C 13 24.990 0.3 . 1 . . . A 125 ARG CG . 18934 1 1664 . 1 1 125 125 ARG CD C 13 40.768 0.3 . 1 . . . A 125 ARG CD . 18934 1 1665 . 1 1 125 125 ARG N N 15 120.740 0.3 . 1 . . . A 125 ARG N . 18934 1 1666 . 1 1 125 125 ARG NE N 15 84.714 0.3 . 1 . . . A 125 ARG NE . 18934 1 1667 . 1 1 126 126 ILE H H 1 7.811 0.020 . 1 . . . A 126 ILE H . 18934 1 1668 . 1 1 126 126 ILE HA H 1 3.413 0.020 . 1 . . . A 126 ILE HA . 18934 1 1669 . 1 1 126 126 ILE HB H 1 1.691 0.020 . 1 . . . A 126 ILE HB . 18934 1 1670 . 1 1 126 126 ILE HG12 H 1 0.425 0.020 . 2 . . . A 126 ILE HG12 . 18934 1 1671 . 1 1 126 126 ILE HG13 H 1 0.480 0.020 . 2 . . . A 126 ILE HG13 . 18934 1 1672 . 1 1 126 126 ILE HG21 H 1 0.492 0.020 . 1 . . . A 126 ILE HG21 . 18934 1 1673 . 1 1 126 126 ILE HG22 H 1 0.492 0.020 . 1 . . . A 126 ILE HG22 . 18934 1 1674 . 1 1 126 126 ILE HG23 H 1 0.492 0.020 . 1 . . . A 126 ILE HG23 . 18934 1 1675 . 1 1 126 126 ILE HD11 H 1 -0.253 0.020 . 1 . . . A 126 ILE HD11 . 18934 1 1676 . 1 1 126 126 ILE HD12 H 1 -0.253 0.020 . 1 . . . A 126 ILE HD12 . 18934 1 1677 . 1 1 126 126 ILE HD13 H 1 -0.253 0.020 . 1 . . . A 126 ILE HD13 . 18934 1 1678 . 1 1 126 126 ILE C C 13 171.718 0.3 . 1 . . . A 126 ILE C . 18934 1 1679 . 1 1 126 126 ILE CA C 13 59.917 0.3 . 1 . . . A 126 ILE CA . 18934 1 1680 . 1 1 126 126 ILE CB C 13 33.627 0.3 . 1 . . . A 126 ILE CB . 18934 1 1681 . 1 1 126 126 ILE CG1 C 13 24.130 0.3 . 1 . . . A 126 ILE CG1 . 18934 1 1682 . 1 1 126 126 ILE CG2 C 13 14.635 0.3 . 1 . . . A 126 ILE CG2 . 18934 1 1683 . 1 1 126 126 ILE CD1 C 13 6.624 0.3 . 1 . . . A 126 ILE CD1 . 18934 1 1684 . 1 1 126 126 ILE N N 15 122.126 0.3 . 1 . . . A 126 ILE N . 18934 1 1685 . 1 1 127 127 ARG H H 1 8.807 0.020 . 1 . . . A 127 ARG H . 18934 1 1686 . 1 1 127 127 ARG HA H 1 3.913 0.020 . 1 . . . A 127 ARG HA . 18934 1 1687 . 1 1 127 127 ARG HB2 H 1 1.908 0.020 . 1 . . . A 127 ARG HB2 . 18934 1 1688 . 1 1 127 127 ARG HB3 H 1 1.908 0.020 . 1 . . . A 127 ARG HB3 . 18934 1 1689 . 1 1 127 127 ARG HG2 H 1 1.733 0.020 . 1 . . . A 127 ARG HG2 . 18934 1 1690 . 1 1 127 127 ARG HG3 H 1 1.733 0.020 . 1 . . . A 127 ARG HG3 . 18934 1 1691 . 1 1 127 127 ARG HD2 H 1 1.779 0.020 . 1 . . . A 127 ARG HD2 . 18934 1 1692 . 1 1 127 127 ARG HD3 H 1 1.779 0.020 . 1 . . . A 127 ARG HD3 . 18934 1 1693 . 1 1 127 127 ARG C C 13 177.001 0.3 . 1 . . . A 127 ARG C . 18934 1 1694 . 1 1 127 127 ARG CA C 13 57.659 0.3 . 1 . . . A 127 ARG CA . 18934 1 1695 . 1 1 127 127 ARG CB C 13 27.521 0.3 . 1 . . . A 127 ARG CB . 18934 1 1696 . 1 1 127 127 ARG CG C 13 26.496 0.3 . 1 . . . A 127 ARG CG . 18934 1 1697 . 1 1 127 127 ARG N N 15 119.063 0.3 . 1 . . . A 127 ARG N . 18934 1 1698 . 1 1 128 128 ALA H H 1 7.987 0.020 . 1 . . . A 128 ALA H . 18934 1 1699 . 1 1 128 128 ALA HA H 1 4.182 0.020 . 1 . . . A 128 ALA HA . 18934 1 1700 . 1 1 128 128 ALA HB1 H 1 1.521 0.020 . 1 . . . A 128 ALA HB1 . 18934 1 1701 . 1 1 128 128 ALA HB2 H 1 1.521 0.020 . 1 . . . A 128 ALA HB2 . 18934 1 1702 . 1 1 128 128 ALA HB3 H 1 1.521 0.020 . 1 . . . A 128 ALA HB3 . 18934 1 1703 . 1 1 128 128 ALA C C 13 177.502 0.3 . 1 . . . A 128 ALA C . 18934 1 1704 . 1 1 128 128 ALA CA C 13 52.443 0.3 . 1 . . . A 128 ALA CA . 18934 1 1705 . 1 1 128 128 ALA CB C 13 15.059 0.3 . 1 . . . A 128 ALA CB . 18934 1 1706 . 1 1 128 128 ALA N N 15 122.268 0.3 . 1 . . . A 128 ALA N . 18934 1 1707 . 1 1 129 129 ALA H H 1 7.528 0.020 . 1 . . . A 129 ALA H . 18934 1 1708 . 1 1 129 129 ALA HA H 1 4.265 0.020 . 1 . . . A 129 ALA HA . 18934 1 1709 . 1 1 129 129 ALA HB1 H 1 1.736 0.020 . 1 . . . A 129 ALA HB1 . 18934 1 1710 . 1 1 129 129 ALA HB2 H 1 1.736 0.020 . 1 . . . A 129 ALA HB2 . 18934 1 1711 . 1 1 129 129 ALA HB3 H 1 1.736 0.020 . 1 . . . A 129 ALA HB3 . 18934 1 1712 . 1 1 129 129 ALA C C 13 178.735 0.3 . 1 . . . A 129 ALA C . 18934 1 1713 . 1 1 129 129 ALA CA C 13 52.226 0.3 . 1 . . . A 129 ALA CA . 18934 1 1714 . 1 1 129 129 ALA CB C 13 15.512 0.3 . 1 . . . A 129 ALA CB . 18934 1 1715 . 1 1 129 129 ALA N N 15 121.273 0.3 . 1 . . . A 129 ALA N . 18934 1 1716 . 1 1 130 130 LEU H H 1 8.388 0.020 . 1 . . . A 130 LEU H . 18934 1 1717 . 1 1 130 130 LEU HA H 1 4.205 0.020 . 1 . . . A 130 LEU HA . 18934 1 1718 . 1 1 130 130 LEU HB2 H 1 1.650 0.020 . 1 . . . A 130 LEU HB2 . 18934 1 1719 . 1 1 130 130 LEU HB3 H 1 1.650 0.020 . 1 . . . A 130 LEU HB3 . 18934 1 1720 . 1 1 130 130 LEU HG H 1 1.955 0.020 . 1 . . . A 130 LEU HG . 18934 1 1721 . 1 1 130 130 LEU HD11 H 1 0.905 0.020 . 1 . . . A 130 LEU HD11 . 18934 1 1722 . 1 1 130 130 LEU HD12 H 1 0.905 0.020 . 1 . . . A 130 LEU HD12 . 18934 1 1723 . 1 1 130 130 LEU HD13 H 1 0.905 0.020 . 1 . . . A 130 LEU HD13 . 18934 1 1724 . 1 1 130 130 LEU HD21 H 1 0.978 0.020 . 1 . . . A 130 LEU HD21 . 18934 1 1725 . 1 1 130 130 LEU HD22 H 1 0.978 0.020 . 1 . . . A 130 LEU HD22 . 18934 1 1726 . 1 1 130 130 LEU HD23 H 1 0.978 0.020 . 1 . . . A 130 LEU HD23 . 18934 1 1727 . 1 1 130 130 LEU C C 13 177.106 0.3 . 1 . . . A 130 LEU C . 18934 1 1728 . 1 1 130 130 LEU CA C 13 54.709 0.3 . 1 . . . A 130 LEU CA . 18934 1 1729 . 1 1 130 130 LEU CB C 13 38.618 0.3 . 1 . . . A 130 LEU CB . 18934 1 1730 . 1 1 130 130 LEU CG C 13 24.565 0.3 . 1 . . . A 130 LEU CG . 18934 1 1731 . 1 1 130 130 LEU CD1 C 13 25.423 0.3 . 1 . . . A 130 LEU CD1 . 18934 1 1732 . 1 1 130 130 LEU CD2 C 13 20.444 0.3 . 1 . . . A 130 LEU CD2 . 18934 1 1733 . 1 1 130 130 LEU N N 15 118.557 0.3 . 1 . . . A 130 LEU N . 18934 1 1734 . 1 1 131 131 LYS H H 1 8.325 0.020 . 1 . . . A 131 LYS H . 18934 1 1735 . 1 1 131 131 LYS HA H 1 4.271 0.020 . 1 . . . A 131 LYS HA . 18934 1 1736 . 1 1 131 131 LYS HB2 H 1 2.104 0.020 . 2 . . . A 131 LYS HB2 . 18934 1 1737 . 1 1 131 131 LYS HB3 H 1 2.002 0.020 . 2 . . . A 131 LYS HB3 . 18934 1 1738 . 1 1 131 131 LYS HG2 H 1 1.602 0.020 . 2 . . . A 131 LYS HG2 . 18934 1 1739 . 1 1 131 131 LYS HG3 H 1 1.544 0.020 . 2 . . . A 131 LYS HG3 . 18934 1 1740 . 1 1 131 131 LYS HD2 H 1 1.728 0.020 . 2 . . . A 131 LYS HD2 . 18934 1 1741 . 1 1 131 131 LYS HD3 H 1 1.776 0.020 . 2 . . . A 131 LYS HD3 . 18934 1 1742 . 1 1 131 131 LYS HE2 H 1 2.994 0.020 . 1 . . . A 131 LYS HE2 . 18934 1 1743 . 1 1 131 131 LYS HE3 H 1 2.994 0.020 . 1 . . . A 131 LYS HE3 . 18934 1 1744 . 1 1 131 131 LYS C C 13 177.440 0.3 . 1 . . . A 131 LYS C . 18934 1 1745 . 1 1 131 131 LYS CA C 13 56.753 0.3 . 1 . . . A 131 LYS CA . 18934 1 1746 . 1 1 131 131 LYS CB C 13 29.557 0.3 . 1 . . . A 131 LYS CB . 18934 1 1747 . 1 1 131 131 LYS CG C 13 22.403 0.3 . 1 . . . A 131 LYS CG . 18934 1 1748 . 1 1 131 131 LYS CD C 13 26.740 0.3 . 1 . . . A 131 LYS CD . 18934 1 1749 . 1 1 131 131 LYS CE C 13 39.572 0.3 . 1 . . . A 131 LYS CE . 18934 1 1750 . 1 1 131 131 LYS N N 15 121.673 0.3 . 1 . . . A 131 LYS N . 18934 1 1751 . 1 1 132 132 LYS H H 1 7.342 0.020 . 1 . . . A 132 LYS H . 18934 1 1752 . 1 1 132 132 LYS HA H 1 4.158 0.020 . 1 . . . A 132 LYS HA . 18934 1 1753 . 1 1 132 132 LYS HB2 H 1 1.982 0.020 . 1 . . . A 132 LYS HB2 . 18934 1 1754 . 1 1 132 132 LYS HB3 H 1 1.982 0.020 . 1 . . . A 132 LYS HB3 . 18934 1 1755 . 1 1 132 132 LYS HG2 H 1 1.563 0.020 . 2 . . . A 132 LYS HG2 . 18934 1 1756 . 1 1 132 132 LYS HG3 H 1 1.720 0.020 . 2 . . . A 132 LYS HG3 . 18934 1 1757 . 1 1 132 132 LYS HD2 H 1 1.770 0.020 . 1 . . . A 132 LYS HD2 . 18934 1 1758 . 1 1 132 132 LYS HD3 H 1 1.770 0.020 . 1 . . . A 132 LYS HD3 . 18934 1 1759 . 1 1 132 132 LYS HE2 H 1 3.025 0.020 . 1 . . . A 132 LYS HE2 . 18934 1 1760 . 1 1 132 132 LYS HE3 H 1 3.025 0.020 . 1 . . . A 132 LYS HE3 . 18934 1 1761 . 1 1 132 132 LYS C C 13 174.642 0.3 . 1 . . . A 132 LYS C . 18934 1 1762 . 1 1 132 132 LYS CA C 13 56.065 0.3 . 1 . . . A 132 LYS CA . 18934 1 1763 . 1 1 132 132 LYS CB C 13 29.557 0.3 . 1 . . . A 132 LYS CB . 18934 1 1764 . 1 1 132 132 LYS CG C 13 22.716 0.3 . 1 . . . A 132 LYS CG . 18934 1 1765 . 1 1 132 132 LYS CD C 13 26.522 0.3 . 1 . . . A 132 LYS CD . 18934 1 1766 . 1 1 132 132 LYS CE C 13 39.463 0.3 . 1 . . . A 132 LYS CE . 18934 1 1767 . 1 1 132 132 LYS N N 15 117.933 0.3 . 1 . . . A 132 LYS N . 18934 1 1768 . 1 1 133 133 LYS H H 1 7.373 0.020 . 1 . . . A 133 LYS H . 18934 1 1769 . 1 1 133 133 LYS HA H 1 4.417 0.020 . 1 . . . A 133 LYS HA . 18934 1 1770 . 1 1 133 133 LYS HB2 H 1 1.685 0.020 . 1 . . . A 133 LYS HB2 . 18934 1 1771 . 1 1 133 133 LYS HB3 H 1 1.685 0.020 . 1 . . . A 133 LYS HB3 . 18934 1 1772 . 1 1 133 133 LYS HG2 H 1 1.386 0.020 . 2 . . . A 133 LYS HG2 . 18934 1 1773 . 1 1 133 133 LYS HG3 H 1 1.456 0.020 . 2 . . . A 133 LYS HG3 . 18934 1 1774 . 1 1 133 133 LYS HD2 H 1 1.689 0.020 . 1 . . . A 133 LYS HD2 . 18934 1 1775 . 1 1 133 133 LYS HD3 H 1 1.689 0.020 . 1 . . . A 133 LYS HD3 . 18934 1 1776 . 1 1 133 133 LYS HE2 H 1 2.933 0.020 . 1 . . . A 133 LYS HE2 . 18934 1 1777 . 1 1 133 133 LYS HE3 H 1 2.933 0.020 . 1 . . . A 133 LYS HE3 . 18934 1 1778 . 1 1 133 133 LYS C C 13 171.781 0.3 . 1 . . . A 133 LYS C . 18934 1 1779 . 1 1 133 133 LYS CA C 13 52.443 0.3 . 1 . . . A 133 LYS CA . 18934 1 1780 . 1 1 133 133 LYS CB C 13 30.465 0.3 . 1 . . . A 133 LYS CB . 18934 1 1781 . 1 1 133 133 LYS CG C 13 22.611 0.3 . 1 . . . A 133 LYS CG . 18934 1 1782 . 1 1 133 133 LYS CD C 13 26.849 0.3 . 1 . . . A 133 LYS CD . 18934 1 1783 . 1 1 133 133 LYS CE C 13 39.463 0.3 . 1 . . . A 133 LYS CE . 18934 1 1784 . 1 1 133 133 LYS N N 15 116.405 0.3 . 1 . . . A 133 LYS N . 18934 1 1785 . 1 1 134 134 ASN H H 1 7.969 0.020 . 1 . . . A 134 ASN H . 18934 1 1786 . 1 1 134 134 ASN HA H 1 4.339 0.020 . 1 . . . A 134 ASN HA . 18934 1 1787 . 1 1 134 134 ASN HB2 H 1 3.110 0.020 . 2 . . . A 134 ASN HB2 . 18934 1 1788 . 1 1 134 134 ASN HB3 H 1 2.750 0.020 . 2 . . . A 134 ASN HB3 . 18934 1 1789 . 1 1 134 134 ASN HD21 H 1 6.825 0.020 . 1 . . . A 134 ASN HD21 . 18934 1 1790 . 1 1 134 134 ASN HD22 H 1 7.437 0.020 . 1 . . . A 134 ASN HD22 . 18934 1 1791 . 1 1 134 134 ASN C C 13 171.133 0.3 . 1 . . . A 134 ASN C . 18934 1 1792 . 1 1 134 134 ASN CA C 13 51.993 0.3 . 1 . . . A 134 ASN CA . 18934 1 1793 . 1 1 134 134 ASN CB C 13 34.091 0.3 . 1 . . . A 134 ASN CB . 18934 1 1794 . 1 1 134 134 ASN N N 15 112.355 0.3 . 1 . . . A 134 ASN N . 18934 1 1795 . 1 1 134 134 ASN ND2 N 15 112.072 0.3 . 1 . . . A 134 ASN ND2 . 18934 1 1796 . 1 1 135 135 TYR H H 1 7.748 0.020 . 1 . . . A 135 TYR H . 18934 1 1797 . 1 1 135 135 TYR HA H 1 5.705 0.020 . 1 . . . A 135 TYR HA . 18934 1 1798 . 1 1 135 135 TYR HB2 H 1 2.879 0.020 . 1 . . . A 135 TYR HB2 . 18934 1 1799 . 1 1 135 135 TYR HB3 H 1 2.879 0.020 . 1 . . . A 135 TYR HB3 . 18934 1 1800 . 1 1 135 135 TYR HD1 H 1 6.970 0.020 . 1 . . . A 135 TYR HD1 . 18934 1 1801 . 1 1 135 135 TYR HD2 H 1 6.970 0.020 . 1 . . . A 135 TYR HD2 . 18934 1 1802 . 1 1 135 135 TYR HE1 H 1 6.551 0.020 . 1 . . . A 135 TYR HE1 . 18934 1 1803 . 1 1 135 135 TYR HE2 H 1 6.551 0.020 . 1 . . . A 135 TYR HE2 . 18934 1 1804 . 1 1 135 135 TYR C C 13 173.556 0.3 . 1 . . . A 135 TYR C . 18934 1 1805 . 1 1 135 135 TYR CA C 13 53.351 0.3 . 1 . . . A 135 TYR CA . 18934 1 1806 . 1 1 135 135 TYR CB C 13 39.756 0.3 . 1 . . . A 135 TYR CB . 18934 1 1807 . 1 1 135 135 TYR CD1 C 13 130.653 0.3 . 1 . . . A 135 TYR CD1 . 18934 1 1808 . 1 1 135 135 TYR CE1 C 13 116.196 0.3 . 1 . . . A 135 TYR CE1 . 18934 1 1809 . 1 1 135 135 TYR N N 15 114.995 0.3 . 1 . . . A 135 TYR N . 18934 1 1810 . 1 1 136 136 LYS H H 1 9.319 0.020 . 1 . . . A 136 LYS H . 18934 1 1811 . 1 1 136 136 LYS HA H 1 4.636 0.020 . 1 . . . A 136 LYS HA . 18934 1 1812 . 1 1 136 136 LYS HB2 H 1 1.765 0.020 . 2 . . . A 136 LYS HB2 . 18934 1 1813 . 1 1 136 136 LYS HB3 H 1 1.705 0.020 . 2 . . . A 136 LYS HB3 . 18934 1 1814 . 1 1 136 136 LYS HG2 H 1 1.475 0.020 . 2 . . . A 136 LYS HG2 . 18934 1 1815 . 1 1 136 136 LYS HG3 H 1 1.210 0.020 . 2 . . . A 136 LYS HG3 . 18934 1 1816 . 1 1 136 136 LYS HD2 H 1 1.560 0.020 . 1 . . . A 136 LYS HD2 . 18934 1 1817 . 1 1 136 136 LYS HD3 H 1 1.560 0.020 . 1 . . . A 136 LYS HD3 . 18934 1 1818 . 1 1 136 136 LYS HE2 H 1 2.785 0.020 . 2 . . . A 136 LYS HE2 . 18934 1 1819 . 1 1 136 136 LYS HE3 H 1 2.720 0.020 . 2 . . . A 136 LYS HE3 . 18934 1 1820 . 1 1 136 136 LYS C C 13 170.632 0.3 . 1 . . . A 136 LYS C . 18934 1 1821 . 1 1 136 136 LYS CA C 13 52.452 0.3 . 1 . . . A 136 LYS CA . 18934 1 1822 . 1 1 136 136 LYS CB C 13 33.182 0.3 . 1 . . . A 136 LYS CB . 18934 1 1823 . 1 1 136 136 LYS CG C 13 22.408 0.3 . 1 . . . A 136 LYS CG . 18934 1 1824 . 1 1 136 136 LYS CD C 13 26.522 0.3 . 1 . . . A 136 LYS CD . 18934 1 1825 . 1 1 136 136 LYS CE C 13 39.246 0.3 . 1 . . . A 136 LYS CE . 18934 1 1826 . 1 1 136 136 LYS N N 15 121.899 0.3 . 1 . . . A 136 LYS N . 18934 1 1827 . 1 1 137 137 LEU H H 1 8.856 0.020 . 1 . . . A 137 LEU H . 18934 1 1828 . 1 1 137 137 LEU HA H 1 5.372 0.020 . 1 . . . A 137 LEU HA . 18934 1 1829 . 1 1 137 137 LEU HB2 H 1 1.712 0.020 . 2 . . . A 137 LEU HB2 . 18934 1 1830 . 1 1 137 137 LEU HB3 H 1 1.238 0.020 . 2 . . . A 137 LEU HB3 . 18934 1 1831 . 1 1 137 137 LEU HG H 1 1.643 0.020 . 1 . . . A 137 LEU HG . 18934 1 1832 . 1 1 137 137 LEU HD11 H 1 1.165 0.020 . 1 . . . A 137 LEU HD11 . 18934 1 1833 . 1 1 137 137 LEU HD12 H 1 1.165 0.020 . 1 . . . A 137 LEU HD12 . 18934 1 1834 . 1 1 137 137 LEU HD13 H 1 1.165 0.020 . 1 . . . A 137 LEU HD13 . 18934 1 1835 . 1 1 137 137 LEU HD21 H 1 0.842 0.020 . 1 . . . A 137 LEU HD21 . 18934 1 1836 . 1 1 137 137 LEU HD22 H 1 0.842 0.020 . 1 . . . A 137 LEU HD22 . 18934 1 1837 . 1 1 137 137 LEU HD23 H 1 0.842 0.020 . 1 . . . A 137 LEU HD23 . 18934 1 1838 . 1 1 137 137 LEU C C 13 172.679 0.3 . 1 . . . A 137 LEU C . 18934 1 1839 . 1 1 137 137 LEU CA C 13 50.631 0.3 . 1 . . . A 137 LEU CA . 18934 1 1840 . 1 1 137 137 LEU CB C 13 44.069 0.3 . 1 . . . A 137 LEU CB . 18934 1 1841 . 1 1 137 137 LEU CG C 13 24.490 0.3 . 1 . . . A 137 LEU CG . 18934 1 1842 . 1 1 137 137 LEU CD1 C 13 21.138 0.3 . 1 . . . A 137 LEU CD1 . 18934 1 1843 . 1 1 137 137 LEU CD2 C 13 24.488 0.3 . 1 . . . A 137 LEU CD2 . 18934 1 1844 . 1 1 137 137 LEU N N 15 126.698 0.3 . 1 . . . A 137 LEU N . 18934 1 1845 . 1 1 138 138 ASN H H 1 8.856 0.020 . 1 . . . A 138 ASN H . 18934 1 1846 . 1 1 138 138 ASN HA H 1 4.750 0.020 . 1 . . . A 138 ASN HA . 18934 1 1847 . 1 1 138 138 ASN HB2 H 1 2.995 0.020 . 2 . . . A 138 ASN HB2 . 18934 1 1848 . 1 1 138 138 ASN HB3 H 1 2.899 0.020 . 2 . . . A 138 ASN HB3 . 18934 1 1849 . 1 1 138 138 ASN HD21 H 1 6.919 0.020 . 1 . . . A 138 ASN HD21 . 18934 1 1850 . 1 1 138 138 ASN HD22 H 1 7.620 0.020 . 1 . . . A 138 ASN HD22 . 18934 1 1851 . 1 1 138 138 ASN C C 13 172.198 0.3 . 1 . . . A 138 ASN C . 18934 1 1852 . 1 1 138 138 ASN CA C 13 49.727 0.3 . 1 . . . A 138 ASN CA . 18934 1 1853 . 1 1 138 138 ASN CB C 13 35.446 0.3 . 1 . . . A 138 ASN CB . 18934 1 1854 . 1 1 138 138 ASN N N 15 125.299 0.3 . 1 . . . A 138 ASN N . 18934 1 1855 . 1 1 138 138 ASN ND2 N 15 112.978 0.3 . 1 . . . A 138 ASN ND2 . 18934 1 1856 . 1 1 139 139 GLN H H 1 9.317 0.020 . 1 . . . A 139 GLN H . 18934 1 1857 . 1 1 139 139 GLN HA H 1 3.538 0.020 . 1 . . . A 139 GLN HA . 18934 1 1858 . 1 1 139 139 GLN HB2 H 1 1.440 0.020 . 1 . . . A 139 GLN HB2 . 18934 1 1859 . 1 1 139 139 GLN HB3 H 1 1.440 0.020 . 1 . . . A 139 GLN HB3 . 18934 1 1860 . 1 1 139 139 GLN HG2 H 1 1.957 0.020 . 1 . . . A 139 GLN HG2 . 18934 1 1861 . 1 1 139 139 GLN HG3 H 1 1.957 0.020 . 1 . . . A 139 GLN HG3 . 18934 1 1862 . 1 1 139 139 GLN C C 13 171.363 0.3 . 1 . . . A 139 GLN C . 18934 1 1863 . 1 1 139 139 GLN CA C 13 54.480 0.3 . 1 . . . A 139 GLN CA . 18934 1 1864 . 1 1 139 139 GLN CB C 13 23.668 0.3 . 1 . . . A 139 GLN CB . 18934 1 1865 . 1 1 139 139 GLN CG C 13 33.020 0.3 . 1 . . . A 139 GLN CG . 18934 1 1866 . 1 1 139 139 GLN N N 15 116.462 0.3 . 1 . . . A 139 GLN N . 18934 1 1867 . 1 1 140 140 TYR H H 1 8.590 0.020 . 1 . . . A 140 TYR H . 18934 1 1868 . 1 1 140 140 TYR HA H 1 4.507 0.020 . 1 . . . A 140 TYR HA . 18934 1 1869 . 1 1 140 140 TYR HB2 H 1 3.300 0.020 . 2 . . . A 140 TYR HB2 . 18934 1 1870 . 1 1 140 140 TYR HB3 H 1 2.901 0.020 . 2 . . . A 140 TYR HB3 . 18934 1 1871 . 1 1 140 140 TYR HD1 H 1 6.945 0.020 . 1 . . . A 140 TYR HD1 . 18934 1 1872 . 1 1 140 140 TYR HD2 H 1 6.945 0.020 . 1 . . . A 140 TYR HD2 . 18934 1 1873 . 1 1 140 140 TYR HE1 H 1 6.549 0.020 . 1 . . . A 140 TYR HE1 . 18934 1 1874 . 1 1 140 140 TYR HE2 H 1 6.549 0.020 . 1 . . . A 140 TYR HE2 . 18934 1 1875 . 1 1 140 140 TYR CA C 13 54.480 0.3 . 1 . . . A 140 TYR CA . 18934 1 1876 . 1 1 140 140 TYR CB C 13 35.452 0.3 . 1 . . . A 140 TYR CB . 18934 1 1877 . 1 1 140 140 TYR CD1 C 13 130.744 0.3 . 1 . . . A 140 TYR CD1 . 18934 1 1878 . 1 1 140 140 TYR CE1 C 13 115.510 0.3 . 1 . . . A 140 TYR CE1 . 18934 1 1879 . 1 1 140 140 TYR N N 15 120.138 0.3 . 1 . . . A 140 TYR N . 18934 1 1880 . 1 1 141 141 GLY H H 1 7.236 0.020 . 1 . . . A 141 GLY H . 18934 1 1881 . 1 1 141 141 GLY HA2 H 1 3.111 0.020 . 2 . . . A 141 GLY HA2 . 18934 1 1882 . 1 1 141 141 GLY HA3 H 1 1.495 0.020 . 2 . . . A 141 GLY HA3 . 18934 1 1883 . 1 1 141 141 GLY C C 13 165.370 0.3 . 1 . . . A 141 GLY C . 18934 1 1884 . 1 1 141 141 GLY CA C 13 41.566 0.3 . 1 . . . A 141 GLY CA . 18934 1 1885 . 1 1 141 141 GLY N N 15 105.529 0.3 . 1 . . . A 141 GLY N . 18934 1 1886 . 1 1 142 142 LEU H H 1 7.516 0.020 . 1 . . . A 142 LEU H . 18934 1 1887 . 1 1 142 142 LEU HA H 1 4.947 0.020 . 1 . . . A 142 LEU HA . 18934 1 1888 . 1 1 142 142 LEU HB2 H 1 1.852 0.020 . 2 . . . A 142 LEU HB2 . 18934 1 1889 . 1 1 142 142 LEU HB3 H 1 1.028 0.020 . 2 . . . A 142 LEU HB3 . 18934 1 1890 . 1 1 142 142 LEU HG H 1 1.243 0.020 . 1 . . . A 142 LEU HG . 18934 1 1891 . 1 1 142 142 LEU HD11 H 1 0.830 0.020 . 1 . . . A 142 LEU HD11 . 18934 1 1892 . 1 1 142 142 LEU HD12 H 1 0.830 0.020 . 1 . . . A 142 LEU HD12 . 18934 1 1893 . 1 1 142 142 LEU HD13 H 1 0.830 0.020 . 1 . . . A 142 LEU HD13 . 18934 1 1894 . 1 1 142 142 LEU HD21 H 1 0.505 0.020 . 1 . . . A 142 LEU HD21 . 18934 1 1895 . 1 1 142 142 LEU HD22 H 1 0.505 0.020 . 1 . . . A 142 LEU HD22 . 18934 1 1896 . 1 1 142 142 LEU HD23 H 1 0.505 0.020 . 1 . . . A 142 LEU HD23 . 18934 1 1897 . 1 1 142 142 LEU C C 13 169.860 0.3 . 1 . . . A 142 LEU C . 18934 1 1898 . 1 1 142 142 LEU CA C 13 50.180 0.3 . 1 . . . A 142 LEU CA . 18934 1 1899 . 1 1 142 142 LEU CB C 13 42.700 0.3 . 1 . . . A 142 LEU CB . 18934 1 1900 . 1 1 142 142 LEU CG C 13 24.782 0.3 . 1 . . . A 142 LEU CG . 18934 1 1901 . 1 1 142 142 LEU CD1 C 13 21.614 0.3 . 1 . . . A 142 LEU CD1 . 18934 1 1902 . 1 1 142 142 LEU CD2 C 13 23.612 0.3 . 1 . . . A 142 LEU CD2 . 18934 1 1903 . 1 1 142 142 LEU N N 15 119.237 0.3 . 1 . . . A 142 LEU N . 18934 1 1904 . 1 1 143 143 PHE H H 1 9.403 0.020 . 1 . . . A 143 PHE H . 18934 1 1905 . 1 1 143 143 PHE HA H 1 5.096 0.020 . 1 . . . A 143 PHE HA . 18934 1 1906 . 1 1 143 143 PHE HB2 H 1 2.722 0.020 . 2 . . . A 143 PHE HB2 . 18934 1 1907 . 1 1 143 143 PHE HB3 H 1 2.508 0.020 . 2 . . . A 143 PHE HB3 . 18934 1 1908 . 1 1 143 143 PHE HD1 H 1 6.736 0.020 . 1 . . . A 143 PHE HD1 . 18934 1 1909 . 1 1 143 143 PHE HD2 H 1 6.736 0.020 . 1 . . . A 143 PHE HD2 . 18934 1 1910 . 1 1 143 143 PHE HE1 H 1 7.158 0.020 . 1 . . . A 143 PHE HE1 . 18934 1 1911 . 1 1 143 143 PHE HE2 H 1 7.158 0.020 . 1 . . . A 143 PHE HE2 . 18934 1 1912 . 1 1 143 143 PHE HZ H 1 7.220 0.020 . 1 . . . A 143 PHE HZ . 18934 1 1913 . 1 1 143 143 PHE C C 13 172.470 0.3 . 1 . . . A 143 PHE C . 18934 1 1914 . 1 1 143 143 PHE CA C 13 53.571 0.3 . 1 . . . A 143 PHE CA . 18934 1 1915 . 1 1 143 143 PHE CB C 13 40.430 0.3 . 1 . . . A 143 PHE CB . 18934 1 1916 . 1 1 143 143 PHE CD1 C 13 129.344 0.3 . 1 . . . A 143 PHE CD1 . 18934 1 1917 . 1 1 143 143 PHE CE1 C 13 128.808 0.3 . 1 . . . A 143 PHE CE1 . 18934 1 1918 . 1 1 143 143 PHE CZ C 13 127.028 0.3 . 1 . . . A 143 PHE CZ . 18934 1 1919 . 1 1 143 143 PHE N N 15 122.506 0.3 . 1 . . . A 143 PHE N . 18934 1 1920 . 1 1 144 144 LYS H H 1 8.931 0.020 . 1 . . . A 144 LYS H . 18934 1 1921 . 1 1 144 144 LYS HA H 1 4.683 0.020 . 1 . . . A 144 LYS HA . 18934 1 1922 . 1 1 144 144 LYS HB2 H 1 1.440 0.020 . 1 . . . A 144 LYS HB2 . 18934 1 1923 . 1 1 144 144 LYS HB3 H 1 1.440 0.020 . 1 . . . A 144 LYS HB3 . 18934 1 1924 . 1 1 144 144 LYS HG2 H 1 1.135 0.020 . 2 . . . A 144 LYS HG2 . 18934 1 1925 . 1 1 144 144 LYS HG3 H 1 1.160 0.020 . 2 . . . A 144 LYS HG3 . 18934 1 1926 . 1 1 144 144 LYS HD2 H 1 1.440 0.020 . 1 . . . A 144 LYS HD2 . 18934 1 1927 . 1 1 144 144 LYS HD3 H 1 1.440 0.020 . 1 . . . A 144 LYS HD3 . 18934 1 1928 . 1 1 144 144 LYS HE2 H 1 2.781 0.020 . 1 . . . A 144 LYS HE2 . 18934 1 1929 . 1 1 144 144 LYS HE3 H 1 2.781 0.020 . 1 . . . A 144 LYS HE3 . 18934 1 1930 . 1 1 144 144 LYS C C 13 174.224 0.3 . 1 . . . A 144 LYS C . 18934 1 1931 . 1 1 144 144 LYS CA C 13 52.670 0.3 . 1 . . . A 144 LYS CA . 18934 1 1932 . 1 1 144 144 LYS CB C 13 31.598 0.3 . 1 . . . A 144 LYS CB . 18934 1 1933 . 1 1 144 144 LYS CG C 13 21.969 0.3 . 1 . . . A 144 LYS CG . 18934 1 1934 . 1 1 144 144 LYS CD C 13 26.522 0.3 . 1 . . . A 144 LYS CD . 18934 1 1935 . 1 1 144 144 LYS CE C 13 39.463 0.3 . 1 . . . A 144 LYS CE . 18934 1 1936 . 1 1 144 144 LYS N N 15 122.899 0.3 . 1 . . . A 144 LYS N . 18934 1 1937 . 1 1 145 145 ASN H H 1 9.225 0.020 . 1 . . . A 145 ASN H . 18934 1 1938 . 1 1 145 145 ASN HA H 1 4.250 0.020 . 1 . . . A 145 ASN HA . 18934 1 1939 . 1 1 145 145 ASN CA C 13 53.223 0.3 . 1 . . . A 145 ASN CA . 18934 1 1940 . 1 1 145 145 ASN CB C 13 34.577 0.3 . 1 . . . A 145 ASN CB . 18934 1 1941 . 1 1 145 145 ASN N N 15 126.562 0.3 . 1 . . . A 145 ASN N . 18934 1 1942 . 1 1 146 146 GLN H H 1 8.869 0.020 . 1 . . . A 146 GLN H . 18934 1 1943 . 1 1 146 146 GLN HA H 1 3.990 0.020 . 1 . . . A 146 GLN HA . 18934 1 1944 . 1 1 146 146 GLN HB2 H 1 2.272 0.020 . 2 . . . A 146 GLN HB2 . 18934 1 1945 . 1 1 146 146 GLN HB3 H 1 2.190 0.020 . 2 . . . A 146 GLN HB3 . 18934 1 1946 . 1 1 146 146 GLN HG2 H 1 2.190 0.020 . 2 . . . A 146 GLN HG2 . 18934 1 1947 . 1 1 146 146 GLN HG3 H 1 2.240 0.020 . 2 . . . A 146 GLN HG3 . 18934 1 1948 . 1 1 146 146 GLN HE21 H 1 6.778 0.020 . 1 . . . A 146 GLN HE21 . 18934 1 1949 . 1 1 146 146 GLN HE22 H 1 7.390 0.020 . 1 . . . A 146 GLN HE22 . 18934 1 1950 . 1 1 146 146 GLN CA C 13 54.316 0.3 . 1 . . . A 146 GLN CA . 18934 1 1951 . 1 1 146 146 GLN CB C 13 25.019 0.3 . 1 . . . A 146 GLN CB . 18934 1 1952 . 1 1 146 146 GLN CG C 13 31.776 0.3 . 1 . . . A 146 GLN CG . 18934 1 1953 . 1 1 146 146 GLN N N 15 112.109 0.3 . 1 . . . A 146 GLN N . 18934 1 1954 . 1 1 146 146 GLN NE2 N 15 111.732 0.3 . 1 . . . A 146 GLN NE2 . 18934 1 1955 . 1 1 147 147 THR H H 1 8.018 0.020 . 1 . . . A 147 THR H . 18934 1 1956 . 1 1 147 147 THR HA H 1 4.560 0.020 . 1 . . . A 147 THR HA . 18934 1 1957 . 1 1 147 147 THR HB H 1 4.163 0.020 . 1 . . . A 147 THR HB . 18934 1 1958 . 1 1 147 147 THR HG21 H 1 1.290 0.020 . 1 . . . A 147 THR HG21 . 18934 1 1959 . 1 1 147 147 THR HG22 H 1 1.290 0.020 . 1 . . . A 147 THR HG22 . 18934 1 1960 . 1 1 147 147 THR HG23 H 1 1.290 0.020 . 1 . . . A 147 THR HG23 . 18934 1 1961 . 1 1 147 147 THR C C 13 170.444 0.3 . 1 . . . A 147 THR C . 18934 1 1962 . 1 1 147 147 THR CA C 13 59.235 0.3 . 1 . . . A 147 THR CA . 18934 1 1963 . 1 1 147 147 THR CB C 13 68.081 0.3 . 1 . . . A 147 THR CB . 18934 1 1964 . 1 1 147 147 THR CG2 C 13 18.807 0.3 . 1 . . . A 147 THR CG2 . 18934 1 1965 . 1 1 147 147 THR N N 15 116.974 0.3 . 1 . . . A 147 THR N . 18934 1 1966 . 1 1 148 148 LEU H H 1 8.717 0.020 . 1 . . . A 148 LEU H . 18934 1 1967 . 1 1 148 148 LEU HA H 1 3.652 0.020 . 1 . . . A 148 LEU HA . 18934 1 1968 . 1 1 148 148 LEU HB2 H 1 1.437 0.020 . 2 . . . A 148 LEU HB2 . 18934 1 1969 . 1 1 148 148 LEU HB3 H 1 1.321 0.020 . 2 . . . A 148 LEU HB3 . 18934 1 1970 . 1 1 148 148 LEU HG H 1 1.062 0.020 . 1 . . . A 148 LEU HG . 18934 1 1971 . 1 1 148 148 LEU HD11 H 1 0.371 0.020 . 1 . . . A 148 LEU HD11 . 18934 1 1972 . 1 1 148 148 LEU HD12 H 1 0.371 0.020 . 1 . . . A 148 LEU HD12 . 18934 1 1973 . 1 1 148 148 LEU HD13 H 1 0.371 0.020 . 1 . . . A 148 LEU HD13 . 18934 1 1974 . 1 1 148 148 LEU HD21 H 1 0.569 0.020 . 1 . . . A 148 LEU HD21 . 18934 1 1975 . 1 1 148 148 LEU HD22 H 1 0.569 0.020 . 1 . . . A 148 LEU HD22 . 18934 1 1976 . 1 1 148 148 LEU HD23 H 1 0.569 0.020 . 1 . . . A 148 LEU HD23 . 18934 1 1977 . 1 1 148 148 LEU C C 13 173.952 0.3 . 1 . . . A 148 LEU C . 18934 1 1978 . 1 1 148 148 LEU CA C 13 53.120 0.3 . 1 . . . A 148 LEU CA . 18934 1 1979 . 1 1 148 148 LEU CB C 13 39.982 0.3 . 1 . . . A 148 LEU CB . 18934 1 1980 . 1 1 148 148 LEU CG C 13 23.953 0.3 . 1 . . . A 148 LEU CG . 18934 1 1981 . 1 1 148 148 LEU CD1 C 13 21.348 0.3 . 1 . . . A 148 LEU CD1 . 18934 1 1982 . 1 1 148 148 LEU CD2 C 13 22.908 0.3 . 1 . . . A 148 LEU CD2 . 18934 1 1983 . 1 1 148 148 LEU N N 15 130.060 0.3 . 1 . . . A 148 LEU N . 18934 1 1984 . 1 1 149 149 VAL H H 1 9.015 0.020 . 1 . . . A 149 VAL H . 18934 1 1985 . 1 1 149 149 VAL HA H 1 4.222 0.020 . 1 . . . A 149 VAL HA . 18934 1 1986 . 1 1 149 149 VAL HB H 1 1.790 0.020 . 1 . . . A 149 VAL HB . 18934 1 1987 . 1 1 149 149 VAL HG11 H 1 0.819 0.020 . 1 . . . A 149 VAL HG11 . 18934 1 1988 . 1 1 149 149 VAL HG12 H 1 0.819 0.020 . 1 . . . A 149 VAL HG12 . 18934 1 1989 . 1 1 149 149 VAL HG13 H 1 0.819 0.020 . 1 . . . A 149 VAL HG13 . 18934 1 1990 . 1 1 149 149 VAL HG21 H 1 0.903 0.020 . 1 . . . A 149 VAL HG21 . 18934 1 1991 . 1 1 149 149 VAL HG22 H 1 0.903 0.020 . 1 . . . A 149 VAL HG22 . 18934 1 1992 . 1 1 149 149 VAL HG23 H 1 0.903 0.020 . 1 . . . A 149 VAL HG23 . 18934 1 1993 . 1 1 149 149 VAL C C 13 172.094 0.3 . 1 . . . A 149 VAL C . 18934 1 1994 . 1 1 149 149 VAL CA C 13 56.970 0.3 . 1 . . . A 149 VAL CA . 18934 1 1995 . 1 1 149 149 VAL CB C 13 29.780 0.3 . 1 . . . A 149 VAL CB . 18934 1 1996 . 1 1 149 149 VAL CG1 C 13 18.052 0.3 . 1 . . . A 149 VAL CG1 . 18934 1 1997 . 1 1 149 149 VAL CG2 C 13 19.145 0.3 . 1 . . . A 149 VAL CG2 . 18934 1 1998 . 1 1 149 149 VAL N N 15 130.244 0.3 . 1 . . . A 149 VAL N . 18934 1 1999 . 1 1 150 150 PRO HA H 1 4.534 0.020 . 1 . . . A 150 PRO HA . 18934 1 2000 . 1 1 150 150 PRO HB2 H 1 2.070 0.020 . 2 . . . A 150 PRO HB2 . 18934 1 2001 . 1 1 150 150 PRO HB3 H 1 1.947 0.020 . 2 . . . A 150 PRO HB3 . 18934 1 2002 . 1 1 150 150 PRO HG2 H 1 1.259 0.020 . 1 . . . A 150 PRO HG2 . 18934 1 2003 . 1 1 150 150 PRO HG3 H 1 1.259 0.020 . 1 . . . A 150 PRO HG3 . 18934 1 2004 . 1 1 150 150 PRO HD2 H 1 3.695 0.020 . 1 . . . A 150 PRO HD2 . 18934 1 2005 . 1 1 150 150 PRO HD3 H 1 3.695 0.020 . 1 . . . A 150 PRO HD3 . 18934 1 2006 . 1 1 150 150 PRO C C 13 173.323 0.3 . 1 . . . A 150 PRO C . 18934 1 2007 . 1 1 150 150 PRO CA C 13 59.697 0.3 . 1 . . . A 150 PRO CA . 18934 1 2008 . 1 1 150 150 PRO CB C 13 27.064 0.3 . 1 . . . A 150 PRO CB . 18934 1 2009 . 1 1 150 150 PRO CG C 13 22.073 0.3 . 1 . . . A 150 PRO CG . 18934 1 2010 . 1 1 150 150 PRO CD C 13 54.973 0.3 . 1 . . . A 150 PRO CD . 18934 1 2011 . 1 1 151 151 LEU H H 1 7.941 0.020 . 1 . . . A 151 LEU H . 18934 1 2012 . 1 1 151 151 LEU HA H 1 4.395 0.020 . 1 . . . A 151 LEU HA . 18934 1 2013 . 1 1 151 151 LEU HB2 H 1 1.729 0.020 . 1 . . . A 151 LEU HB2 . 18934 1 2014 . 1 1 151 151 LEU HB3 H 1 1.729 0.020 . 1 . . . A 151 LEU HB3 . 18934 1 2015 . 1 1 151 151 LEU HG H 1 1.574 0.020 . 1 . . . A 151 LEU HG . 18934 1 2016 . 1 1 151 151 LEU HD11 H 1 0.826 0.020 . 1 . . . A 151 LEU HD11 . 18934 1 2017 . 1 1 151 151 LEU HD12 H 1 0.826 0.020 . 1 . . . A 151 LEU HD12 . 18934 1 2018 . 1 1 151 151 LEU HD13 H 1 0.826 0.020 . 1 . . . A 151 LEU HD13 . 18934 1 2019 . 1 1 151 151 LEU HD21 H 1 0.728 0.020 . 1 . . . A 151 LEU HD21 . 18934 1 2020 . 1 1 151 151 LEU HD22 H 1 0.728 0.020 . 1 . . . A 151 LEU HD22 . 18934 1 2021 . 1 1 151 151 LEU HD23 H 1 0.728 0.020 . 1 . . . A 151 LEU HD23 . 18934 1 2022 . 1 1 151 151 LEU C C 13 174.892 0.3 . 1 . . . A 151 LEU C . 18934 1 2023 . 1 1 151 151 LEU CA C 13 51.545 0.3 . 1 . . . A 151 LEU CA . 18934 1 2024 . 1 1 151 151 LEU CB C 13 42.476 0.3 . 1 . . . A 151 LEU CB . 18934 1 2025 . 1 1 151 151 LEU CG C 13 23.913 0.3 . 1 . . . A 151 LEU CG . 18934 1 2026 . 1 1 151 151 LEU CD1 C 13 22.934 0.3 . 1 . . . A 151 LEU CD1 . 18934 1 2027 . 1 1 151 151 LEU CD2 C 13 20.261 0.3 . 1 . . . A 151 LEU CD2 . 18934 1 2028 . 1 1 151 151 LEU N N 15 123.695 0.3 . 1 . . . A 151 LEU N . 18934 1 2029 . 1 1 152 152 LYS H H 1 9.306 0.020 . 1 . . . A 152 LYS H . 18934 1 2030 . 1 1 152 152 LYS HA H 1 4.505 0.020 . 1 . . . A 152 LYS HA . 18934 1 2031 . 1 1 152 152 LYS HB2 H 1 1.810 0.020 . 2 . . . A 152 LYS HB2 . 18934 1 2032 . 1 1 152 152 LYS HB3 H 1 1.650 0.020 . 2 . . . A 152 LYS HB3 . 18934 1 2033 . 1 1 152 152 LYS HG2 H 1 1.315 0.020 . 2 . . . A 152 LYS HG2 . 18934 1 2034 . 1 1 152 152 LYS HG3 H 1 1.395 0.020 . 2 . . . A 152 LYS HG3 . 18934 1 2035 . 1 1 152 152 LYS HD2 H 1 1.635 0.020 . 1 . . . A 152 LYS HD2 . 18934 1 2036 . 1 1 152 152 LYS HD3 H 1 1.635 0.020 . 1 . . . A 152 LYS HD3 . 18934 1 2037 . 1 1 152 152 LYS HE2 H 1 2.925 0.020 . 1 . . . A 152 LYS HE2 . 18934 1 2038 . 1 1 152 152 LYS HE3 H 1 2.925 0.020 . 1 . . . A 152 LYS HE3 . 18934 1 2039 . 1 1 152 152 LYS C C 13 172.261 0.3 . 1 . . . A 152 LYS C . 18934 1 2040 . 1 1 152 152 LYS CA C 13 52.335 0.3 . 1 . . . A 152 LYS CA . 18934 1 2041 . 1 1 152 152 LYS CB C 13 27.594 0.3 . 1 . . . A 152 LYS CB . 18934 1 2042 . 1 1 152 152 LYS CG C 13 21.797 0.3 . 1 . . . A 152 LYS CG . 18934 1 2043 . 1 1 152 152 LYS CD C 13 26.305 0.3 . 1 . . . A 152 LYS CD . 18934 1 2044 . 1 1 152 152 LYS CE C 13 39.463 0.3 . 1 . . . A 152 LYS CE . 18934 1 2045 . 1 1 152 152 LYS N N 15 126.881 0.3 . 1 . . . A 152 LYS N . 18934 1 2046 . 1 1 153 153 ILE H H 1 7.154 0.020 . 1 . . . A 153 ILE H . 18934 1 2047 . 1 1 153 153 ILE HA H 1 4.584 0.020 . 1 . . . A 153 ILE HA . 18934 1 2048 . 1 1 153 153 ILE HB H 1 1.803 0.020 . 1 . . . A 153 ILE HB . 18934 1 2049 . 1 1 153 153 ILE HG12 H 1 1.167 0.020 . 2 . . . A 153 ILE HG12 . 18934 1 2050 . 1 1 153 153 ILE HG13 H 1 0.826 0.020 . 2 . . . A 153 ILE HG13 . 18934 1 2051 . 1 1 153 153 ILE HG21 H 1 0.704 0.020 . 1 . . . A 153 ILE HG21 . 18934 1 2052 . 1 1 153 153 ILE HG22 H 1 0.704 0.020 . 1 . . . A 153 ILE HG22 . 18934 1 2053 . 1 1 153 153 ILE HG23 H 1 0.704 0.020 . 1 . . . A 153 ILE HG23 . 18934 1 2054 . 1 1 153 153 ILE HD11 H 1 0.439 0.020 . 1 . . . A 153 ILE HD11 . 18934 1 2055 . 1 1 153 153 ILE HD12 H 1 0.439 0.020 . 1 . . . A 153 ILE HD12 . 18934 1 2056 . 1 1 153 153 ILE HD13 H 1 0.439 0.020 . 1 . . . A 153 ILE HD13 . 18934 1 2057 . 1 1 153 153 ILE C C 13 173.075 0.3 . 1 . . . A 153 ILE C . 18934 1 2058 . 1 1 153 153 ILE CA C 13 56.304 0.3 . 1 . . . A 153 ILE CA . 18934 1 2059 . 1 1 153 153 ILE CB C 13 39.979 0.3 . 1 . . . A 153 ILE CB . 18934 1 2060 . 1 1 153 153 ILE CG1 C 13 23.043 0.3 . 1 . . . A 153 ILE CG1 . 18934 1 2061 . 1 1 153 153 ILE CG2 C 13 17.446 0.3 . 1 . . . A 153 ILE CG2 . 18934 1 2062 . 1 1 153 153 ILE CD1 C 13 12.550 0.3 . 1 . . . A 153 ILE CD1 . 18934 1 2063 . 1 1 153 153 ILE N N 15 114.198 0.3 . 1 . . . A 153 ILE N . 18934 1 2064 . 1 1 154 154 THR H H 1 9.370 0.020 . 1 . . . A 154 THR H . 18934 1 2065 . 1 1 154 154 THR HA H 1 4.539 0.020 . 1 . . . A 154 THR HA . 18934 1 2066 . 1 1 154 154 THR HB H 1 4.279 0.020 . 1 . . . A 154 THR HB . 18934 1 2067 . 1 1 154 154 THR HG21 H 1 1.150 0.020 . 1 . . . A 154 THR HG21 . 18934 1 2068 . 1 1 154 154 THR HG22 H 1 1.150 0.020 . 1 . . . A 154 THR HG22 . 18934 1 2069 . 1 1 154 154 THR HG23 H 1 1.150 0.020 . 1 . . . A 154 THR HG23 . 18934 1 2070 . 1 1 154 154 THR CA C 13 59.704 0.3 . 1 . . . A 154 THR CA . 18934 1 2071 . 1 1 154 154 THR CB C 13 68.529 0.3 . 1 . . . A 154 THR CB . 18934 1 2072 . 1 1 154 154 THR CG2 C 13 19.140 0.3 . 1 . . . A 154 THR CG2 . 18934 1 2073 . 1 1 154 154 THR N N 15 111.055 0.3 . 1 . . . A 154 THR N . 18934 1 2074 . 1 1 155 155 THR H H 1 7.692 0.020 . 1 . . . A 155 THR H . 18934 1 2075 . 1 1 155 155 THR HA H 1 4.899 0.020 . 1 . . . A 155 THR HA . 18934 1 2076 . 1 1 155 155 THR HB H 1 4.695 0.020 . 1 . . . A 155 THR HB . 18934 1 2077 . 1 1 155 155 THR HG21 H 1 1.150 0.020 . 1 . . . A 155 THR HG21 . 18934 1 2078 . 1 1 155 155 THR HG22 H 1 1.150 0.020 . 1 . . . A 155 THR HG22 . 18934 1 2079 . 1 1 155 155 THR HG23 H 1 1.150 0.020 . 1 . . . A 155 THR HG23 . 18934 1 2080 . 1 1 155 155 THR C C 13 172.081 0.3 . 1 . . . A 155 THR C . 18934 1 2081 . 1 1 155 155 THR CA C 13 56.519 0.3 . 1 . . . A 155 THR CA . 18934 1 2082 . 1 1 155 155 THR CB C 13 70.667 0.3 . 1 . . . A 155 THR CB . 18934 1 2083 . 1 1 155 155 THR CG2 C 13 18.858 0.3 . 1 . . . A 155 THR CG2 . 18934 1 2084 . 1 1 155 155 THR N N 15 111.163 0.3 . 1 . . . A 155 THR N . 18934 1 2085 . 1 1 156 156 GLU H H 1 9.411 0.020 . 1 . . . A 156 GLU H . 18934 1 2086 . 1 1 156 156 GLU HA H 1 3.758 0.020 . 1 . . . A 156 GLU HA . 18934 1 2087 . 1 1 156 156 GLU HB2 H 1 2.161 0.020 . 2 . . . A 156 GLU HB2 . 18934 1 2088 . 1 1 156 156 GLU HB3 H 1 2.297 0.020 . 2 . . . A 156 GLU HB3 . 18934 1 2089 . 1 1 156 156 GLU HG2 H 1 2.420 0.020 . 2 . . . A 156 GLU HG2 . 18934 1 2090 . 1 1 156 156 GLU HG3 H 1 2.509 0.020 . 2 . . . A 156 GLU HG3 . 18934 1 2091 . 1 1 156 156 GLU CA C 13 56.758 0.3 . 1 . . . A 156 GLU CA . 18934 1 2092 . 1 1 156 156 GLU CB C 13 26.873 0.3 . 1 . . . A 156 GLU CB . 18934 1 2093 . 1 1 156 156 GLU CG C 13 33.674 0.3 . 1 . . . A 156 GLU CG . 18934 1 2094 . 1 1 156 156 GLU N N 15 123.371 0.3 . 1 . . . A 156 GLU N . 18934 1 2095 . 1 1 157 157 LYS H H 1 8.238 0.020 . 1 . . . A 157 LYS H . 18934 1 2096 . 1 1 157 157 LYS HA H 1 3.791 0.020 . 1 . . . A 157 LYS HA . 18934 1 2097 . 1 1 157 157 LYS HB2 H 1 1.529 0.020 . 2 . . . A 157 LYS HB2 . 18934 1 2098 . 1 1 157 157 LYS HB3 H 1 1.421 0.020 . 2 . . . A 157 LYS HB3 . 18934 1 2099 . 1 1 157 157 LYS HG2 H 1 1.459 0.020 . 1 . . . A 157 LYS HG2 . 18934 1 2100 . 1 1 157 157 LYS HG3 H 1 1.459 0.020 . 1 . . . A 157 LYS HG3 . 18934 1 2101 . 1 1 157 157 LYS HD2 H 1 1.715 0.020 . 1 . . . A 157 LYS HD2 . 18934 1 2102 . 1 1 157 157 LYS HD3 H 1 1.715 0.020 . 1 . . . A 157 LYS HD3 . 18934 1 2103 . 1 1 157 157 LYS HE2 H 1 2.947 0.020 . 1 . . . A 157 LYS HE2 . 18934 1 2104 . 1 1 157 157 LYS HE3 H 1 2.947 0.020 . 1 . . . A 157 LYS HE3 . 18934 1 2105 . 1 1 157 157 LYS C C 13 175.957 0.3 . 1 . . . A 157 LYS C . 18934 1 2106 . 1 1 157 157 LYS CA C 13 57.879 0.3 . 1 . . . A 157 LYS CA . 18934 1 2107 . 1 1 157 157 LYS CB C 13 29.768 0.3 . 1 . . . A 157 LYS CB . 18934 1 2108 . 1 1 157 157 LYS CG C 13 22.414 0.3 . 1 . . . A 157 LYS CG . 18934 1 2109 . 1 1 157 157 LYS N N 15 119.344 0.3 . 1 . . . A 157 LYS N . 18934 1 2110 . 1 1 158 158 GLU H H 1 7.581 0.020 . 1 . . . A 158 GLU H . 18934 1 2111 . 1 1 158 158 GLU HA H 1 3.849 0.020 . 1 . . . A 158 GLU HA . 18934 1 2112 . 1 1 158 158 GLU HB2 H 1 2.246 0.020 . 2 . . . A 158 GLU HB2 . 18934 1 2113 . 1 1 158 158 GLU HB3 H 1 2.014 0.020 . 2 . . . A 158 GLU HB3 . 18934 1 2114 . 1 1 158 158 GLU HG2 H 1 2.223 0.020 . 1 . . . A 158 GLU HG2 . 18934 1 2115 . 1 1 158 158 GLU HG3 H 1 2.223 0.020 . 1 . . . A 158 GLU HG3 . 18934 1 2116 . 1 1 158 158 GLU C C 13 176.131 0.3 . 1 . . . A 158 GLU C . 18934 1 2117 . 1 1 158 158 GLU CA C 13 56.296 0.3 . 1 . . . A 158 GLU CA . 18934 1 2118 . 1 1 158 158 GLU CB C 13 27.519 0.3 . 1 . . . A 158 GLU CB . 18934 1 2119 . 1 1 158 158 GLU CG C 13 34.368 0.3 . 1 . . . A 158 GLU CG . 18934 1 2120 . 1 1 158 158 GLU N N 15 117.820 0.3 . 1 . . . A 158 GLU N . 18934 1 2121 . 1 1 159 159 LEU H H 1 7.576 0.020 . 1 . . . A 159 LEU H . 18934 1 2122 . 1 1 159 159 LEU HA H 1 3.637 0.020 . 1 . . . A 159 LEU HA . 18934 1 2123 . 1 1 159 159 LEU HB2 H 1 1.992 0.020 . 1 . . . A 159 LEU HB2 . 18934 1 2124 . 1 1 159 159 LEU HB3 H 1 1.992 0.020 . 1 . . . A 159 LEU HB3 . 18934 1 2125 . 1 1 159 159 LEU HG H 1 0.910 0.020 . 1 . . . A 159 LEU HG . 18934 1 2126 . 1 1 159 159 LEU HD11 H 1 0.578 0.020 . 1 . . . A 159 LEU HD11 . 18934 1 2127 . 1 1 159 159 LEU HD12 H 1 0.578 0.020 . 1 . . . A 159 LEU HD12 . 18934 1 2128 . 1 1 159 159 LEU HD13 H 1 0.578 0.020 . 1 . . . A 159 LEU HD13 . 18934 1 2129 . 1 1 159 159 LEU HD21 H 1 0.303 0.020 . 1 . . . A 159 LEU HD21 . 18934 1 2130 . 1 1 159 159 LEU HD22 H 1 0.303 0.020 . 1 . . . A 159 LEU HD22 . 18934 1 2131 . 1 1 159 159 LEU HD23 H 1 0.303 0.020 . 1 . . . A 159 LEU HD23 . 18934 1 2132 . 1 1 159 159 LEU C C 13 173.681 0.3 . 1 . . . A 159 LEU C . 18934 1 2133 . 1 1 159 159 LEU CA C 13 55.843 0.3 . 1 . . . A 159 LEU CA . 18934 1 2134 . 1 1 159 159 LEU CB C 13 38.381 0.3 . 1 . . . A 159 LEU CB . 18934 1 2135 . 1 1 159 159 LEU CG C 13 24.456 0.3 . 1 . . . A 159 LEU CG . 18934 1 2136 . 1 1 159 159 LEU CD1 C 13 20.358 0.3 . 1 . . . A 159 LEU CD1 . 18934 1 2137 . 1 1 159 159 LEU CD2 C 13 23.468 0.3 . 1 . . . A 159 LEU CD2 . 18934 1 2138 . 1 1 159 159 LEU N N 15 120.044 0.3 . 1 . . . A 159 LEU N . 18934 1 2139 . 1 1 160 160 ILE H H 1 7.823 0.020 . 1 . . . A 160 ILE H . 18934 1 2140 . 1 1 160 160 ILE HA H 1 3.182 0.020 . 1 . . . A 160 ILE HA . 18934 1 2141 . 1 1 160 160 ILE HB H 1 1.806 0.020 . 1 . . . A 160 ILE HB . 18934 1 2142 . 1 1 160 160 ILE HG12 H 1 1.470 0.020 . 2 . . . A 160 ILE HG12 . 18934 1 2143 . 1 1 160 160 ILE HG13 H 1 1.383 0.020 . 2 . . . A 160 ILE HG13 . 18934 1 2144 . 1 1 160 160 ILE HG21 H 1 0.895 0.020 . 1 . . . A 160 ILE HG21 . 18934 1 2145 . 1 1 160 160 ILE HG22 H 1 0.895 0.020 . 1 . . . A 160 ILE HG22 . 18934 1 2146 . 1 1 160 160 ILE HG23 H 1 0.895 0.020 . 1 . . . A 160 ILE HG23 . 18934 1 2147 . 1 1 160 160 ILE HD11 H 1 0.999 0.020 . 1 . . . A 160 ILE HD11 . 18934 1 2148 . 1 1 160 160 ILE HD12 H 1 0.999 0.020 . 1 . . . A 160 ILE HD12 . 18934 1 2149 . 1 1 160 160 ILE HD13 H 1 0.999 0.020 . 1 . . . A 160 ILE HD13 . 18934 1 2150 . 1 1 160 160 ILE C C 13 174.328 0.3 . 1 . . . A 160 ILE C . 18934 1 2151 . 1 1 160 160 ILE CA C 13 62.868 0.3 . 1 . . . A 160 ILE CA . 18934 1 2152 . 1 1 160 160 ILE CB C 13 35.893 0.3 . 1 . . . A 160 ILE CB . 18934 1 2153 . 1 1 160 160 ILE CG1 C 13 24.480 0.3 . 1 . . . A 160 ILE CG1 . 18934 1 2154 . 1 1 160 160 ILE CG2 C 13 15.237 0.3 . 1 . . . A 160 ILE CG2 . 18934 1 2155 . 1 1 160 160 ILE CD1 C 13 11.724 0.3 . 1 . . . A 160 ILE CD1 . 18934 1 2156 . 1 1 160 160 ILE N N 15 117.708 0.3 . 1 . . . A 160 ILE N . 18934 1 2157 . 1 1 161 161 LYS H H 1 7.435 0.020 . 1 . . . A 161 LYS H . 18934 1 2158 . 1 1 161 161 LYS HA H 1 4.214 0.020 . 1 . . . A 161 LYS HA . 18934 1 2159 . 1 1 161 161 LYS HB2 H 1 1.882 0.020 . 1 . . . A 161 LYS HB2 . 18934 1 2160 . 1 1 161 161 LYS HB3 H 1 1.882 0.020 . 1 . . . A 161 LYS HB3 . 18934 1 2161 . 1 1 161 161 LYS HG2 H 1 1.359 0.020 . 2 . . . A 161 LYS HG2 . 18934 1 2162 . 1 1 161 161 LYS HG3 H 1 1.485 0.020 . 2 . . . A 161 LYS HG3 . 18934 1 2163 . 1 1 161 161 LYS HD2 H 1 1.622 0.020 . 1 . . . A 161 LYS HD2 . 18934 1 2164 . 1 1 161 161 LYS HD3 H 1 1.622 0.020 . 1 . . . A 161 LYS HD3 . 18934 1 2165 . 1 1 161 161 LYS HE2 H 1 2.896 0.020 . 1 . . . A 161 LYS HE2 . 18934 1 2166 . 1 1 161 161 LYS HE3 H 1 2.896 0.020 . 1 . . . A 161 LYS HE3 . 18934 1 2167 . 1 1 161 161 LYS C C 13 178.212 0.3 . 1 . . . A 161 LYS C . 18934 1 2168 . 1 1 161 161 LYS CA C 13 56.516 0.3 . 1 . . . A 161 LYS CA . 18934 1 2169 . 1 1 161 161 LYS CB C 13 29.333 0.3 . 1 . . . A 161 LYS CB . 18934 1 2170 . 1 1 161 161 LYS CG C 13 21.997 0.3 . 1 . . . A 161 LYS CG . 18934 1 2171 . 1 1 161 161 LYS CD C 13 26.414 0.3 . 1 . . . A 161 LYS CD . 18934 1 2172 . 1 1 161 161 LYS CE C 13 39.355 0.3 . 1 . . . A 161 LYS CE . 18934 1 2173 . 1 1 161 161 LYS N N 15 117.822 0.3 . 1 . . . A 161 LYS N . 18934 1 2174 . 1 1 162 162 GLU H H 1 8.255 0.020 . 1 . . . A 162 GLU H . 18934 1 2175 . 1 1 162 162 GLU HA H 1 3.960 0.020 . 1 . . . A 162 GLU HA . 18934 1 2176 . 1 1 162 162 GLU HB2 H 1 2.011 0.020 . 2 . . . A 162 GLU HB2 . 18934 1 2177 . 1 1 162 162 GLU HB3 H 1 1.946 0.020 . 2 . . . A 162 GLU HB3 . 18934 1 2178 . 1 1 162 162 GLU HG2 H 1 2.305 0.020 . 1 . . . A 162 GLU HG2 . 18934 1 2179 . 1 1 162 162 GLU HG3 H 1 2.305 0.020 . 1 . . . A 162 GLU HG3 . 18934 1 2180 . 1 1 162 162 GLU C C 13 175.978 0.3 . 1 . . . A 162 GLU C . 18934 1 2181 . 1 1 162 162 GLU CA C 13 55.832 0.3 . 1 . . . A 162 GLU CA . 18934 1 2182 . 1 1 162 162 GLU CB C 13 26.156 0.3 . 1 . . . A 162 GLU CB . 18934 1 2183 . 1 1 162 162 GLU CG C 13 32.721 0.3 . 1 . . . A 162 GLU CG . 18934 1 2184 . 1 1 162 162 GLU N N 15 121.391 0.3 . 1 . . . A 162 GLU N . 18934 1 2185 . 1 1 163 163 LEU H H 1 7.833 0.020 . 1 . . . A 163 LEU H . 18934 1 2186 . 1 1 163 163 LEU HA H 1 3.949 0.020 . 1 . . . A 163 LEU HA . 18934 1 2187 . 1 1 163 163 LEU HB2 H 1 1.823 0.020 . 2 . . . A 163 LEU HB2 . 18934 1 2188 . 1 1 163 163 LEU HB3 H 1 1.428 0.020 . 2 . . . A 163 LEU HB3 . 18934 1 2189 . 1 1 163 163 LEU HG H 1 1.893 0.020 . 1 . . . A 163 LEU HG . 18934 1 2190 . 1 1 163 163 LEU HD11 H 1 0.563 0.020 . 1 . . . A 163 LEU HD11 . 18934 1 2191 . 1 1 163 163 LEU HD12 H 1 0.563 0.020 . 1 . . . A 163 LEU HD12 . 18934 1 2192 . 1 1 163 163 LEU HD13 H 1 0.563 0.020 . 1 . . . A 163 LEU HD13 . 18934 1 2193 . 1 1 163 163 LEU HD21 H 1 0.678 0.020 . 1 . . . A 163 LEU HD21 . 18934 1 2194 . 1 1 163 163 LEU HD22 H 1 0.678 0.020 . 1 . . . A 163 LEU HD22 . 18934 1 2195 . 1 1 163 163 LEU HD23 H 1 0.678 0.020 . 1 . . . A 163 LEU HD23 . 18934 1 2196 . 1 1 163 163 LEU CA C 13 52.671 0.3 . 1 . . . A 163 LEU CA . 18934 1 2197 . 1 1 163 163 LEU CB C 13 39.530 0.3 . 1 . . . A 163 LEU CB . 18934 1 2198 . 1 1 163 163 LEU CG C 13 22.825 0.3 . 1 . . . A 163 LEU CG . 18934 1 2199 . 1 1 163 163 LEU CD1 C 13 23.571 0.3 . 1 . . . A 163 LEU CD1 . 18934 1 2200 . 1 1 163 163 LEU CD2 C 13 19.835 0.3 . 1 . . . A 163 LEU CD2 . 18934 1 2201 . 1 1 163 163 LEU N N 15 116.062 0.3 . 1 . . . A 163 LEU N . 18934 1 2202 . 1 1 164 164 GLY H H 1 7.620 0.020 . 1 . . . A 164 GLY H . 18934 1 2203 . 1 1 164 164 GLY HA2 H 1 3.842 0.020 . 2 . . . A 164 GLY HA2 . 18934 1 2204 . 1 1 164 164 GLY HA3 H 1 3.590 0.020 . 2 . . . A 164 GLY HA3 . 18934 1 2205 . 1 1 164 164 GLY C C 13 171.697 0.3 . 1 . . . A 164 GLY C . 18934 1 2206 . 1 1 164 164 GLY CA C 13 42.242 0.3 . 1 . . . A 164 GLY CA . 18934 1 2207 . 1 1 164 164 GLY N N 15 104.226 0.3 . 1 . . . A 164 GLY N . 18934 1 2208 . 1 1 165 165 PHE H H 1 7.333 0.020 . 1 . . . A 165 PHE H . 18934 1 2209 . 1 1 165 165 PHE HA H 1 4.862 0.020 . 1 . . . A 165 PHE HA . 18934 1 2210 . 1 1 165 165 PHE HB2 H 1 3.407 0.020 . 2 . . . A 165 PHE HB2 . 18934 1 2211 . 1 1 165 165 PHE HB3 H 1 2.602 0.020 . 2 . . . A 165 PHE HB3 . 18934 1 2212 . 1 1 165 165 PHE HD1 H 1 7.130 0.020 . 1 . . . A 165 PHE HD1 . 18934 1 2213 . 1 1 165 165 PHE HD2 H 1 7.130 0.020 . 1 . . . A 165 PHE HD2 . 18934 1 2214 . 1 1 165 165 PHE HE1 H 1 7.125 0.020 . 1 . . . A 165 PHE HE1 . 18934 1 2215 . 1 1 165 165 PHE HE2 H 1 7.125 0.020 . 1 . . . A 165 PHE HE2 . 18934 1 2216 . 1 1 165 165 PHE HZ H 1 7.257 0.020 . 1 . . . A 165 PHE HZ . 18934 1 2217 . 1 1 165 165 PHE C C 13 171.843 0.3 . 1 . . . A 165 PHE C . 18934 1 2218 . 1 1 165 165 PHE CA C 13 53.361 0.3 . 1 . . . A 165 PHE CA . 18934 1 2219 . 1 1 165 165 PHE CB C 13 38.621 0.3 . 1 . . . A 165 PHE CB . 18934 1 2220 . 1 1 165 165 PHE CD1 C 13 129.294 0.3 . 1 . . . A 165 PHE CD1 . 18934 1 2221 . 1 1 165 165 PHE CE1 C 13 128.763 0.3 . 1 . . . A 165 PHE CE1 . 18934 1 2222 . 1 1 165 165 PHE CZ C 13 127.208 0.3 . 1 . . . A 165 PHE CZ . 18934 1 2223 . 1 1 165 165 PHE N N 15 118.516 0.3 . 1 . . . A 165 PHE N . 18934 1 2224 . 1 1 166 166 THR H H 1 8.514 0.020 . 1 . . . A 166 THR H . 18934 1 2225 . 1 1 166 166 THR HA H 1 4.138 0.020 . 1 . . . A 166 THR HA . 18934 1 2226 . 1 1 166 166 THR HB H 1 3.984 0.020 . 1 . . . A 166 THR HB . 18934 1 2227 . 1 1 166 166 THR HG21 H 1 1.195 0.020 . 1 . . . A 166 THR HG21 . 18934 1 2228 . 1 1 166 166 THR HG22 H 1 1.195 0.020 . 1 . . . A 166 THR HG22 . 18934 1 2229 . 1 1 166 166 THR HG23 H 1 1.195 0.020 . 1 . . . A 166 THR HG23 . 18934 1 2230 . 1 1 166 166 THR C C 13 171.739 0.3 . 1 . . . A 166 THR C . 18934 1 2231 . 1 1 166 166 THR CA C 13 60.154 0.3 . 1 . . . A 166 THR CA . 18934 1 2232 . 1 1 166 166 THR CB C 13 67.148 0.3 . 1 . . . A 166 THR CB . 18934 1 2233 . 1 1 166 166 THR CG2 C 13 19.029 0.3 . 1 . . . A 166 THR CG2 . 18934 1 2234 . 1 1 166 166 THR N N 15 116.657 0.3 . 1 . . . A 166 THR N . 18934 1 2235 . 1 1 167 167 TYR H H 1 8.995 0.020 . 1 . . . A 167 TYR H . 18934 1 2236 . 1 1 167 167 TYR HA H 1 4.040 0.020 . 1 . . . A 167 TYR HA . 18934 1 2237 . 1 1 167 167 TYR HB2 H 1 3.076 0.020 . 2 . . . A 167 TYR HB2 . 18934 1 2238 . 1 1 167 167 TYR HB3 H 1 2.815 0.020 . 2 . . . A 167 TYR HB3 . 18934 1 2239 . 1 1 167 167 TYR HD1 H 1 6.930 0.020 . 1 . . . A 167 TYR HD1 . 18934 1 2240 . 1 1 167 167 TYR HD2 H 1 6.930 0.020 . 1 . . . A 167 TYR HD2 . 18934 1 2241 . 1 1 167 167 TYR HE1 H 1 6.967 0.020 . 1 . . . A 167 TYR HE1 . 18934 1 2242 . 1 1 167 167 TYR HE2 H 1 6.967 0.020 . 1 . . . A 167 TYR HE2 . 18934 1 2243 . 1 1 167 167 TYR CA C 13 58.110 0.3 . 1 . . . A 167 TYR CA . 18934 1 2244 . 1 1 167 167 TYR CB C 13 35.312 0.3 . 1 . . . A 167 TYR CB . 18934 1 2245 . 1 1 167 167 TYR CD2 C 13 130.942 0.3 . 1 . . . A 167 TYR CD2 . 18934 1 2246 . 1 1 167 167 TYR CE2 C 13 115.491 0.3 . 1 . . . A 167 TYR CE2 . 18934 1 2247 . 1 1 167 167 TYR N N 15 127.611 0.3 . 1 . . . A 167 TYR N . 18934 1 2248 . 1 1 168 168 ARG H H 1 7.205 0.020 . 1 . . . A 168 ARG H . 18934 1 2249 . 1 1 168 168 ARG HA H 1 4.472 0.020 . 1 . . . A 168 ARG HA . 18934 1 2250 . 1 1 168 168 ARG HB2 H 1 1.252 0.020 . 1 . . . A 168 ARG HB2 . 18934 1 2251 . 1 1 168 168 ARG HB3 H 1 1.252 0.020 . 1 . . . A 168 ARG HB3 . 18934 1 2252 . 1 1 168 168 ARG HG2 H 1 1.460 0.020 . 1 . . . A 168 ARG HG2 . 18934 1 2253 . 1 1 168 168 ARG HG3 H 1 1.460 0.020 . 1 . . . A 168 ARG HG3 . 18934 1 2254 . 1 1 168 168 ARG HD2 H 1 1.720 0.020 . 1 . . . A 168 ARG HD2 . 18934 1 2255 . 1 1 168 168 ARG HD3 H 1 1.720 0.020 . 1 . . . A 168 ARG HD3 . 18934 1 2256 . 1 1 168 168 ARG C C 13 172.971 0.3 . 1 . . . A 168 ARG C . 18934 1 2257 . 1 1 168 168 ARG CA C 13 49.948 0.3 . 1 . . . A 168 ARG CA . 18934 1 2258 . 1 1 168 168 ARG CB C 13 30.236 0.3 . 1 . . . A 168 ARG CB . 18934 1 2259 . 1 1 168 168 ARG CG C 13 32.578 0.3 . 1 . . . A 168 ARG CG . 18934 1 2260 . 1 1 168 168 ARG CD C 13 33.069 0.3 . 1 . . . A 168 ARG CD . 18934 1 2261 . 1 1 168 168 ARG N N 15 126.847 0.3 . 1 . . . A 168 ARG N . 18934 1 2262 . 1 1 169 169 ILE H H 1 8.351 0.020 . 1 . . . A 169 ILE H . 18934 1 2263 . 1 1 169 169 ILE HA H 1 4.126 0.020 . 1 . . . A 169 ILE HA . 18934 1 2264 . 1 1 169 169 ILE HB H 1 2.140 0.020 . 1 . . . A 169 ILE HB . 18934 1 2265 . 1 1 169 169 ILE HG12 H 1 1.262 0.020 . 1 . . . A 169 ILE HG12 . 18934 1 2266 . 1 1 169 169 ILE HG13 H 1 1.262 0.020 . 1 . . . A 169 ILE HG13 . 18934 1 2267 . 1 1 169 169 ILE HG21 H 1 1.148 0.020 . 1 . . . A 169 ILE HG21 . 18934 1 2268 . 1 1 169 169 ILE HG22 H 1 1.148 0.020 . 1 . . . A 169 ILE HG22 . 18934 1 2269 . 1 1 169 169 ILE HG23 H 1 1.148 0.020 . 1 . . . A 169 ILE HG23 . 18934 1 2270 . 1 1 169 169 ILE HD11 H 1 0.877 0.020 . 1 . . . A 169 ILE HD11 . 18934 1 2271 . 1 1 169 169 ILE HD12 H 1 0.877 0.020 . 1 . . . A 169 ILE HD12 . 18934 1 2272 . 1 1 169 169 ILE HD13 H 1 0.877 0.020 . 1 . . . A 169 ILE HD13 . 18934 1 2273 . 1 1 169 169 ILE C C 13 172.031 0.3 . 1 . . . A 169 ILE C . 18934 1 2274 . 1 1 169 169 ILE CA C 13 58.334 0.3 . 1 . . . A 169 ILE CA . 18934 1 2275 . 1 1 169 169 ILE CB C 13 32.957 0.3 . 1 . . . A 169 ILE CB . 18934 1 2276 . 1 1 169 169 ILE CG1 C 13 22.716 0.3 . 1 . . . A 169 ILE CG1 . 18934 1 2277 . 1 1 169 169 ILE CG2 C 13 15.209 0.3 . 1 . . . A 169 ILE CG2 . 18934 1 2278 . 1 1 169 169 ILE CD1 C 13 11.488 0.3 . 1 . . . A 169 ILE CD1 . 18934 1 2279 . 1 1 169 169 ILE N N 15 120.147 0.3 . 1 . . . A 169 ILE N . 18934 1 2280 . 1 1 170 170 PRO HA H 1 3.361 0.020 . 1 . . . A 170 PRO HA . 18934 1 2281 . 1 1 170 170 PRO HB2 H 1 2.010 0.020 . 2 . . . A 170 PRO HB2 . 18934 1 2282 . 1 1 170 170 PRO HB3 H 1 1.730 0.020 . 2 . . . A 170 PRO HB3 . 18934 1 2283 . 1 1 170 170 PRO HG2 H 1 1.542 0.020 . 1 . . . A 170 PRO HG2 . 18934 1 2284 . 1 1 170 170 PRO HG3 H 1 1.542 0.020 . 1 . . . A 170 PRO HG3 . 18934 1 2285 . 1 1 170 170 PRO HD2 H 1 3.023 0.020 . 1 . . . A 170 PRO HD2 . 18934 1 2286 . 1 1 170 170 PRO HD3 H 1 3.023 0.020 . 1 . . . A 170 PRO HD3 . 18934 1 2287 . 1 1 170 170 PRO C C 13 174.623 0.3 . 1 . . . A 170 PRO C . 18934 1 2288 . 1 1 170 170 PRO CA C 13 64.454 0.3 . 1 . . . A 170 PRO CA . 18934 1 2289 . 1 1 170 170 PRO CB C 13 29.329 0.3 . 1 . . . A 170 PRO CB . 18934 1 2290 . 1 1 170 170 PRO CG C 13 22.366 0.3 . 1 . . . A 170 PRO CG . 18934 1 2291 . 1 1 170 170 PRO CD C 13 41.641 0.3 . 1 . . . A 170 PRO CD . 18934 1 2292 . 1 1 171 171 LYS H H 1 8.334 0.020 . 1 . . . A 171 LYS H . 18934 1 2293 . 1 1 171 171 LYS HA H 1 4.295 0.020 . 1 . . . A 171 LYS HA . 18934 1 2294 . 1 1 171 171 LYS HB2 H 1 1.955 0.020 . 2 . . . A 171 LYS HB2 . 18934 1 2295 . 1 1 171 171 LYS HB3 H 1 1.413 0.020 . 2 . . . A 171 LYS HB3 . 18934 1 2296 . 1 1 171 171 LYS HG2 H 1 1.156 0.020 . 2 . . . A 171 LYS HG2 . 18934 1 2297 . 1 1 171 171 LYS HG3 H 1 1.298 0.020 . 2 . . . A 171 LYS HG3 . 18934 1 2298 . 1 1 171 171 LYS HD2 H 1 1.598 0.020 . 1 . . . A 171 LYS HD2 . 18934 1 2299 . 1 1 171 171 LYS HD3 H 1 1.598 0.020 . 1 . . . A 171 LYS HD3 . 18934 1 2300 . 1 1 171 171 LYS HE2 H 1 2.892 0.020 . 1 . . . A 171 LYS HE2 . 18934 1 2301 . 1 1 171 171 LYS HE3 H 1 2.892 0.020 . 1 . . . A 171 LYS HE3 . 18934 1 2302 . 1 1 171 171 LYS C C 13 173.347 0.3 . 1 . . . A 171 LYS C . 18934 1 2303 . 1 1 171 171 LYS CA C 13 55.167 0.3 . 1 . . . A 171 LYS CA . 18934 1 2304 . 1 1 171 171 LYS CB C 13 30.010 0.3 . 1 . . . A 171 LYS CB . 18934 1 2305 . 1 1 171 171 LYS CG C 13 21.509 0.3 . 1 . . . A 171 LYS CG . 18934 1 2306 . 1 1 171 171 LYS CD C 13 27.035 0.3 . 1 . . . A 171 LYS CD . 18934 1 2307 . 1 1 171 171 LYS CE C 13 39.355 0.3 . 1 . . . A 171 LYS CE . 18934 1 2308 . 1 1 171 171 LYS N N 15 113.088 0.3 . 1 . . . A 171 LYS N . 18934 1 2309 . 1 1 172 172 LYS H H 1 7.806 0.020 . 1 . . . A 172 LYS H . 18934 1 2310 . 1 1 172 172 LYS HA H 1 4.320 0.020 . 1 . . . A 172 LYS HA . 18934 1 2311 . 1 1 172 172 LYS HB2 H 1 2.015 0.020 . 2 . . . A 172 LYS HB2 . 18934 1 2312 . 1 1 172 172 LYS HB3 H 1 1.437 0.020 . 2 . . . A 172 LYS HB3 . 18934 1 2313 . 1 1 172 172 LYS HG2 H 1 1.109 0.020 . 2 . . . A 172 LYS HG2 . 18934 1 2314 . 1 1 172 172 LYS HG3 H 1 1.269 0.020 . 2 . . . A 172 LYS HG3 . 18934 1 2315 . 1 1 172 172 LYS HD2 H 1 1.583 0.020 . 2 . . . A 172 LYS HD2 . 18934 1 2316 . 1 1 172 172 LYS HD3 H 1 1.628 0.020 . 2 . . . A 172 LYS HD3 . 18934 1 2317 . 1 1 172 172 LYS HE2 H 1 2.893 0.020 . 1 . . . A 172 LYS HE2 . 18934 1 2318 . 1 1 172 172 LYS HE3 H 1 2.893 0.020 . 1 . . . A 172 LYS HE3 . 18934 1 2319 . 1 1 172 172 LYS C C 13 172.867 0.3 . 1 . . . A 172 LYS C . 18934 1 2320 . 1 1 172 172 LYS CA C 13 51.763 0.3 . 1 . . . A 172 LYS CA . 18934 1 2321 . 1 1 172 172 LYS CB C 13 30.010 0.3 . 1 . . . A 172 LYS CB . 18934 1 2322 . 1 1 172 172 LYS CG C 13 22.771 0.3 . 1 . . . A 172 LYS CG . 18934 1 2323 . 1 1 172 172 LYS CD C 13 25.769 0.3 . 1 . . . A 172 LYS CD . 18934 1 2324 . 1 1 172 172 LYS CE C 13 39.355 0.3 . 1 . . . A 172 LYS CE . 18934 1 2325 . 1 1 172 172 LYS N N 15 116.602 0.3 . 1 . . . A 172 LYS N . 18934 1 2326 . 1 1 173 173 ARG H H 1 6.852 0.020 . 1 . . . A 173 ARG H . 18934 1 2327 . 1 1 173 173 ARG HA H 1 3.404 0.020 . 1 . . . A 173 ARG HA . 18934 1 2328 . 1 1 173 173 ARG HB2 H 1 1.288 0.020 . 1 . . . A 173 ARG HB2 . 18934 1 2329 . 1 1 173 173 ARG HB3 H 1 1.288 0.020 . 1 . . . A 173 ARG HB3 . 18934 1 2330 . 1 1 173 173 ARG HG2 H 1 0.897 0.020 . 1 . . . A 173 ARG HG2 . 18934 1 2331 . 1 1 173 173 ARG HG3 H 1 0.897 0.020 . 1 . . . A 173 ARG HG3 . 18934 1 2332 . 1 1 173 173 ARG HD2 H 1 1.775 0.020 . 2 . . . A 173 ARG HD2 . 18934 1 2333 . 1 1 173 173 ARG HD3 H 1 1.550 0.020 . 2 . . . A 173 ARG HD3 . 18934 1 2334 . 1 1 173 173 ARG HE H 1 5.840 0.020 . 1 . . . A 173 ARG HE . 18934 1 2335 . 1 1 173 173 ARG C C 13 170.089 0.3 . 1 . . . A 173 ARG C . 18934 1 2336 . 1 1 173 173 ARG CA C 13 54.713 0.3 . 1 . . . A 173 ARG CA . 18934 1 2337 . 1 1 173 173 ARG CB C 13 26.837 0.3 . 1 . . . A 173 ARG CB . 18934 1 2338 . 1 1 173 173 ARG N N 15 121.494 0.3 . 1 . . . A 173 ARG N . 18934 1 2339 . 1 1 173 173 ARG NE N 15 82.494 0.3 . 1 . . . A 173 ARG NE . 18934 1 2340 . 1 1 174 174 LEU H H 1 7.193 0.020 . 1 . . . A 174 LEU H . 18934 1 2341 . 1 1 174 174 LEU HA H 1 3.988 0.020 . 1 . . . A 174 LEU HA . 18934 1 2342 . 1 1 174 174 LEU HB2 H 1 1.503 0.020 . 2 . . . A 174 LEU HB2 . 18934 1 2343 . 1 1 174 174 LEU HB3 H 1 1.379 0.020 . 2 . . . A 174 LEU HB3 . 18934 1 2344 . 1 1 174 174 LEU HG H 1 1.389 0.020 . 1 . . . A 174 LEU HG . 18934 1 2345 . 1 1 174 174 LEU HD11 H 1 0.784 0.020 . 1 . . . A 174 LEU HD11 . 18934 1 2346 . 1 1 174 174 LEU HD12 H 1 0.784 0.020 . 1 . . . A 174 LEU HD12 . 18934 1 2347 . 1 1 174 174 LEU HD13 H 1 0.784 0.020 . 1 . . . A 174 LEU HD13 . 18934 1 2348 . 1 1 174 174 LEU HD21 H 1 0.783 0.020 . 1 . . . A 174 LEU HD21 . 18934 1 2349 . 1 1 174 174 LEU HD22 H 1 0.783 0.020 . 1 . . . A 174 LEU HD22 . 18934 1 2350 . 1 1 174 174 LEU HD23 H 1 0.783 0.020 . 1 . . . A 174 LEU HD23 . 18934 1 2351 . 1 1 174 174 LEU C C 13 178.233 0.3 . 1 . . . A 174 LEU C . 18934 1 2352 . 1 1 174 174 LEU CA C 13 54.482 0.3 . 1 . . . A 174 LEU CA . 18934 1 2353 . 1 1 174 174 LEU CB C 13 42.702 0.3 . 1 . . . A 174 LEU CB . 18934 1 2354 . 1 1 174 174 LEU CG C 13 24.456 0.3 . 1 . . . A 174 LEU CG . 18934 1 2355 . 1 1 174 174 LEU CD1 C 13 22.156 0.3 . 1 . . . A 174 LEU CD1 . 18934 1 2356 . 1 1 174 174 LEU CD2 C 13 22.047 0.3 . 1 . . . A 174 LEU CD2 . 18934 1 2357 . 1 1 174 174 LEU N N 15 128.188 0.3 . 1 . . . A 174 LEU N . 18934 1 stop_ save_