data_7059 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 7059 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 'Investigation of PZA-resistance by Mycobacterium Tuberculosis' 'Structure analysis' 'The data from the entries that make up this study were used to determine the structure of Pyrazinamidase.' 7059 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID . 'NMR assignment' 7059 1 . Pyrazinamidase 7059 1 . Pyrazinamide 7059 1 . PZA-resistance 7059 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7059 _Entry.Title ; 1H, 13C, and 15N Resonance Assignments of the Pyrazinamidase from Mycobacterium Tuberculosis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-04-10 _Entry.Accession_date 2006-04-10 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Woo-Sung Son . . . 7059 2 Won-Je Kim . . . 7059 3 Yong-Jin Kim . . . 7059 4 Se-Won Suh . . . 7059 5 Bong-Jin Lee . . . 7059 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7059 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 679 7059 '15N chemical shifts' 178 7059 '1H chemical shifts' 1110 7059 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2007-02-09 2006-04-10 update BMRB 'complete entry citation' 7059 1 . . 2006-10-02 2006-04-10 original author 'original release' 7059 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7059 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17131033 _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N Resonance Assignments of the Pyrazinamidase from Mycobacterium Tuberculosis ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 36 _Citation.Journal_issue 'Suppl. 5' _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 60 _Citation.Page_last 60 _Citation.Year 2006 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Woo-Sung Son . . . 7059 1 2 Won-Je Kim . . . 7059 1 3 Yong-Jin Kim . . . 7059 1 4 Se-Won Suh . . . 7059 1 5 Takahisa Ikegami . . . 7059 1 6 Hideo Akutsu . . . 7059 1 7 Bong-Jin Lee . . . 7059 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Mycobacterium Tuberculosis' 7059 1 NMR 7059 1 PncA 7059 1 Pyrazinamidase 7059 1 PZA-resistance 7059 1 'Resonance assignment' 7059 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7059 _Assembly.ID 1 _Assembly.Name Pyrazinamidase _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 19604.6 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 7059 1 stop_ 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 Pyrazinamidase 1 $Pyrazinamidase_polypeptide . . no native no no . . . 7059 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Pyrazinamidase_polypeptide _Entity.Sf_category entity _Entity.Sf_framecode Pyrazinamidase_polypeptide _Entity.Entry_ID 7059 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Pyrazinamidase _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MRALIIVDVQNDFCEGGSLA VTGGAALARAISDYLAEAAD YHHVVATKDFHIDPGDHFSG TPDYSSSWPPHCVSGTPGAD FHPSLDTSAIEAVFYKGAYT GAYSGFEGVDENGTPLLNWL RQRGVDEVDVVGIATDHCVR QTAEDAVRNGLATRVLVDLT AGVSADTTVAALEEMRTASV ELVCSS ; _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 186 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19604.6 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 3PL1 . "Determination Of The Crystal Structure Of The Pyrazinamidase From M.tuberculosis : A Structure-function Analysis For Prediction" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 2 no DBJ BAH26342 . "pyrazinamidase/nicotinamidase [Mycobacterium bovis BCG str. Tokyo 172]" . . . . . 100.00 186 99.46 99.46 6.26e-130 . . . . 7059 1 3 no DBJ BAL66049 . "pyrazinamidase/nicotinamidas [Mycobacterium tuberculosis str. Erdman = ATCC 35801]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 4 no DBJ BAO48146 . "pyrazinamidase [Mycobacterium tuberculosis]" . . . . . 100.00 186 99.46 99.46 1.05e-129 . . . . 7059 1 5 no DBJ BAQ06101 . "pyrazinamidase/nicotinamidas [Mycobacterium tuberculosis str. Kurono]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 6 no DBJ GAA45748 . "pyrazinamidase/nicotinamidas [Mycobacterium tuberculosis NCGM2209]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 7 no EMBL CAD96922 . "PYRAZINAMIDASE/NICOTINAMIDAS PNCA (PZase) [Mycobacterium bovis AF2122/97]" . . . . . 100.00 186 99.46 99.46 6.26e-130 . . . . 7059 1 8 no EMBL CAL72050 . "Pyrazinamidase/nicotinamidas pncA [Mycobacterium bovis BCG str. Pasteur 1173P2]" . . . . . 100.00 186 99.46 99.46 6.26e-130 . . . . 7059 1 9 no EMBL CCC27128 . "pyrazinamidase/nicotinamidas PNCA (PZase) [Mycobacterium africanum GM041182]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 10 no EMBL CCC44398 . "pyrazinamidase/nicotinamidas PNCA (PZase) [Mycobacterium canettii CIPT 140010059]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 11 no EMBL CCC64640 . "Pyrazinamidase/nicotinamidas pncA [Mycobacterium bovis BCG str. Moreau RDJ]" . . . . . 100.00 186 99.46 99.46 6.26e-130 . . . . 7059 1 12 no GB AAB37768 . "pyrazinamidase/nicotinamidase [Mycobacterium tuberculosis str. Erdman = ATCC 35801]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 13 no GB AAK38743 . "PncA [Mycobacterium bovis]" . . . . . 100.00 186 99.46 99.46 6.26e-130 . . . . 7059 1 14 no GB AAK46382 . "pyrazinamidase/nicotinamidase [Mycobacterium tuberculosis CDC1551]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 15 no GB AAV33179 . "pyrazinamidase [Mycobacterium tuberculosis]" . . . . . 100.00 186 98.92 99.46 5.61e-130 . . . . 7059 1 16 no GB AAV33180 . "truncated pyrazinamidase [Mycobacterium tuberculosis]" . . . . . 54.84 113 98.04 98.04 6.14e-65 . . . . 7059 1 17 no REF NP_216559 . "pyrazinamidase/nicotinamidase PncA [Mycobacterium tuberculosis H37Rv]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 18 no REF NP_336568 . "pyrazinamidase/nicotinamidase [Mycobacterium tuberculosis CDC1551]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 19 no REF NP_855719 . "pyrazinamidase [Mycobacterium bovis AF2122/97]" . . . . . 100.00 186 99.46 99.46 6.26e-130 . . . . 7059 1 20 no REF WP_003410243 . "MULTISPECIES: amidase [Mycobacterium tuberculosis complex]" . . . . . 100.00 186 100.00 100.00 2.23e-131 . . . . 7059 1 21 no REF WP_003906725 . "pyrazinamidase/nicotinamidase [Mycobacterium tuberculosis]" . . . . . 66.13 125 99.19 99.19 9.23e-84 . . . . 7059 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID Pyrazinamidase . 7059 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 . 7059 1 2 . ARG . 7059 1 3 . ALA . 7059 1 4 . LEU . 7059 1 5 . ILE . 7059 1 6 . ILE . 7059 1 7 . VAL . 7059 1 8 . ASP . 7059 1 9 . VAL . 7059 1 10 . GLN . 7059 1 11 . ASN . 7059 1 12 . ASP . 7059 1 13 . PHE . 7059 1 14 . CYS . 7059 1 15 . GLU . 7059 1 16 . GLY . 7059 1 17 . GLY . 7059 1 18 . SER . 7059 1 19 . LEU . 7059 1 20 . ALA . 7059 1 21 . VAL . 7059 1 22 . THR . 7059 1 23 . GLY . 7059 1 24 . GLY . 7059 1 25 . ALA . 7059 1 26 . ALA . 7059 1 27 . LEU . 7059 1 28 . ALA . 7059 1 29 . ARG . 7059 1 30 . ALA . 7059 1 31 . ILE . 7059 1 32 . SER . 7059 1 33 . ASP . 7059 1 34 . TYR . 7059 1 35 . LEU . 7059 1 36 . ALA . 7059 1 37 . GLU . 7059 1 38 . ALA . 7059 1 39 . ALA . 7059 1 40 . ASP . 7059 1 41 . TYR . 7059 1 42 . HIS . 7059 1 43 . HIS . 7059 1 44 . VAL . 7059 1 45 . VAL . 7059 1 46 . ALA . 7059 1 47 . THR . 7059 1 48 . LYS . 7059 1 49 . ASP . 7059 1 50 . PHE . 7059 1 51 . HIS . 7059 1 52 . ILE . 7059 1 53 . ASP . 7059 1 54 . PRO . 7059 1 55 . GLY . 7059 1 56 . ASP . 7059 1 57 . HIS . 7059 1 58 . PHE . 7059 1 59 . SER . 7059 1 60 . GLY . 7059 1 61 . THR . 7059 1 62 . PRO . 7059 1 63 . ASP . 7059 1 64 . TYR . 7059 1 65 . SER . 7059 1 66 . SER . 7059 1 67 . SER . 7059 1 68 . TRP . 7059 1 69 . PRO . 7059 1 70 . PRO . 7059 1 71 . HIS . 7059 1 72 . CYS . 7059 1 73 . VAL . 7059 1 74 . SER . 7059 1 75 . GLY . 7059 1 76 . THR . 7059 1 77 . PRO . 7059 1 78 . GLY . 7059 1 79 . ALA . 7059 1 80 . ASP . 7059 1 81 . PHE . 7059 1 82 . HIS . 7059 1 83 . PRO . 7059 1 84 . SER . 7059 1 85 . LEU . 7059 1 86 . ASP . 7059 1 87 . THR . 7059 1 88 . SER . 7059 1 89 . ALA . 7059 1 90 . ILE . 7059 1 91 . GLU . 7059 1 92 . ALA . 7059 1 93 . VAL . 7059 1 94 . PHE . 7059 1 95 . TYR . 7059 1 96 . LYS . 7059 1 97 . GLY . 7059 1 98 . ALA . 7059 1 99 . TYR . 7059 1 100 . THR . 7059 1 101 . GLY . 7059 1 102 . ALA . 7059 1 103 . TYR . 7059 1 104 . SER . 7059 1 105 . GLY . 7059 1 106 . PHE . 7059 1 107 . GLU . 7059 1 108 . GLY . 7059 1 109 . VAL . 7059 1 110 . ASP . 7059 1 111 . GLU . 7059 1 112 . ASN . 7059 1 113 . GLY . 7059 1 114 . THR . 7059 1 115 . PRO . 7059 1 116 . LEU . 7059 1 117 . LEU . 7059 1 118 . ASN . 7059 1 119 . TRP . 7059 1 120 . LEU . 7059 1 121 . ARG . 7059 1 122 . GLN . 7059 1 123 . ARG . 7059 1 124 . GLY . 7059 1 125 . VAL . 7059 1 126 . ASP . 7059 1 127 . GLU . 7059 1 128 . VAL . 7059 1 129 . ASP . 7059 1 130 . VAL . 7059 1 131 . VAL . 7059 1 132 . GLY . 7059 1 133 . ILE . 7059 1 134 . ALA . 7059 1 135 . THR . 7059 1 136 . ASP . 7059 1 137 . HIS . 7059 1 138 . CYS . 7059 1 139 . VAL . 7059 1 140 . ARG . 7059 1 141 . GLN . 7059 1 142 . THR . 7059 1 143 . ALA . 7059 1 144 . GLU . 7059 1 145 . ASP . 7059 1 146 . ALA . 7059 1 147 . VAL . 7059 1 148 . ARG . 7059 1 149 . ASN . 7059 1 150 . GLY . 7059 1 151 . LEU . 7059 1 152 . ALA . 7059 1 153 . THR . 7059 1 154 . ARG . 7059 1 155 . VAL . 7059 1 156 . LEU . 7059 1 157 . VAL . 7059 1 158 . ASP . 7059 1 159 . LEU . 7059 1 160 . THR . 7059 1 161 . ALA . 7059 1 162 . GLY . 7059 1 163 . VAL . 7059 1 164 . SER . 7059 1 165 . ALA . 7059 1 166 . ASP . 7059 1 167 . THR . 7059 1 168 . THR . 7059 1 169 . VAL . 7059 1 170 . ALA . 7059 1 171 . ALA . 7059 1 172 . LEU . 7059 1 173 . GLU . 7059 1 174 . GLU . 7059 1 175 . MET . 7059 1 176 . ARG . 7059 1 177 . THR . 7059 1 178 . ALA . 7059 1 179 . SER . 7059 1 180 . VAL . 7059 1 181 . GLU . 7059 1 182 . LEU . 7059 1 183 . VAL . 7059 1 184 . CYS . 7059 1 185 . SER . 7059 1 186 . SER . 7059 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 7059 1 . ARG 2 2 7059 1 . ALA 3 3 7059 1 . LEU 4 4 7059 1 . ILE 5 5 7059 1 . ILE 6 6 7059 1 . VAL 7 7 7059 1 . ASP 8 8 7059 1 . VAL 9 9 7059 1 . GLN 10 10 7059 1 . ASN 11 11 7059 1 . ASP 12 12 7059 1 . PHE 13 13 7059 1 . CYS 14 14 7059 1 . GLU 15 15 7059 1 . GLY 16 16 7059 1 . GLY 17 17 7059 1 . SER 18 18 7059 1 . LEU 19 19 7059 1 . ALA 20 20 7059 1 . VAL 21 21 7059 1 . THR 22 22 7059 1 . GLY 23 23 7059 1 . GLY 24 24 7059 1 . ALA 25 25 7059 1 . ALA 26 26 7059 1 . LEU 27 27 7059 1 . ALA 28 28 7059 1 . ARG 29 29 7059 1 . ALA 30 30 7059 1 . ILE 31 31 7059 1 . SER 32 32 7059 1 . ASP 33 33 7059 1 . TYR 34 34 7059 1 . LEU 35 35 7059 1 . ALA 36 36 7059 1 . GLU 37 37 7059 1 . ALA 38 38 7059 1 . ALA 39 39 7059 1 . ASP 40 40 7059 1 . TYR 41 41 7059 1 . HIS 42 42 7059 1 . HIS 43 43 7059 1 . VAL 44 44 7059 1 . VAL 45 45 7059 1 . ALA 46 46 7059 1 . THR 47 47 7059 1 . LYS 48 48 7059 1 . ASP 49 49 7059 1 . PHE 50 50 7059 1 . HIS 51 51 7059 1 . ILE 52 52 7059 1 . ASP 53 53 7059 1 . PRO 54 54 7059 1 . GLY 55 55 7059 1 . ASP 56 56 7059 1 . HIS 57 57 7059 1 . PHE 58 58 7059 1 . SER 59 59 7059 1 . GLY 60 60 7059 1 . THR 61 61 7059 1 . PRO 62 62 7059 1 . ASP 63 63 7059 1 . TYR 64 64 7059 1 . SER 65 65 7059 1 . SER 66 66 7059 1 . SER 67 67 7059 1 . TRP 68 68 7059 1 . PRO 69 69 7059 1 . PRO 70 70 7059 1 . HIS 71 71 7059 1 . CYS 72 72 7059 1 . VAL 73 73 7059 1 . SER 74 74 7059 1 . GLY 75 75 7059 1 . THR 76 76 7059 1 . PRO 77 77 7059 1 . GLY 78 78 7059 1 . ALA 79 79 7059 1 . ASP 80 80 7059 1 . PHE 81 81 7059 1 . HIS 82 82 7059 1 . PRO 83 83 7059 1 . SER 84 84 7059 1 . LEU 85 85 7059 1 . ASP 86 86 7059 1 . THR 87 87 7059 1 . SER 88 88 7059 1 . ALA 89 89 7059 1 . ILE 90 90 7059 1 . GLU 91 91 7059 1 . ALA 92 92 7059 1 . VAL 93 93 7059 1 . PHE 94 94 7059 1 . TYR 95 95 7059 1 . LYS 96 96 7059 1 . GLY 97 97 7059 1 . ALA 98 98 7059 1 . TYR 99 99 7059 1 . THR 100 100 7059 1 . GLY 101 101 7059 1 . ALA 102 102 7059 1 . TYR 103 103 7059 1 . SER 104 104 7059 1 . GLY 105 105 7059 1 . PHE 106 106 7059 1 . GLU 107 107 7059 1 . GLY 108 108 7059 1 . VAL 109 109 7059 1 . ASP 110 110 7059 1 . GLU 111 111 7059 1 . ASN 112 112 7059 1 . GLY 113 113 7059 1 . THR 114 114 7059 1 . PRO 115 115 7059 1 . LEU 116 116 7059 1 . LEU 117 117 7059 1 . ASN 118 118 7059 1 . TRP 119 119 7059 1 . LEU 120 120 7059 1 . ARG 121 121 7059 1 . GLN 122 122 7059 1 . ARG 123 123 7059 1 . GLY 124 124 7059 1 . VAL 125 125 7059 1 . ASP 126 126 7059 1 . GLU 127 127 7059 1 . VAL 128 128 7059 1 . ASP 129 129 7059 1 . VAL 130 130 7059 1 . VAL 131 131 7059 1 . GLY 132 132 7059 1 . ILE 133 133 7059 1 . ALA 134 134 7059 1 . THR 135 135 7059 1 . ASP 136 136 7059 1 . HIS 137 137 7059 1 . CYS 138 138 7059 1 . VAL 139 139 7059 1 . ARG 140 140 7059 1 . GLN 141 141 7059 1 . THR 142 142 7059 1 . ALA 143 143 7059 1 . GLU 144 144 7059 1 . ASP 145 145 7059 1 . ALA 146 146 7059 1 . VAL 147 147 7059 1 . ARG 148 148 7059 1 . ASN 149 149 7059 1 . GLY 150 150 7059 1 . LEU 151 151 7059 1 . ALA 152 152 7059 1 . THR 153 153 7059 1 . ARG 154 154 7059 1 . VAL 155 155 7059 1 . LEU 156 156 7059 1 . VAL 157 157 7059 1 . ASP 158 158 7059 1 . LEU 159 159 7059 1 . THR 160 160 7059 1 . ALA 161 161 7059 1 . GLY 162 162 7059 1 . VAL 163 163 7059 1 . SER 164 164 7059 1 . ALA 165 165 7059 1 . ASP 166 166 7059 1 . THR 167 167 7059 1 . THR 168 168 7059 1 . VAL 169 169 7059 1 . ALA 170 170 7059 1 . ALA 171 171 7059 1 . LEU 172 172 7059 1 . GLU 173 173 7059 1 . GLU 174 174 7059 1 . MET 175 175 7059 1 . ARG 176 176 7059 1 . THR 177 177 7059 1 . ALA 178 178 7059 1 . SER 179 179 7059 1 . VAL 180 180 7059 1 . GLU 181 181 7059 1 . LEU 182 182 7059 1 . VAL 183 183 7059 1 . CYS 184 184 7059 1 . SER 185 185 7059 1 . SER 186 186 7059 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 7059 _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 $Pyrazinamidase_polypeptide . 1773 . no . 'Mycobacterium Tuberculosis' . . Eubacteria . Mycobacterium tuberculosis . . . . . . . . . . . . . . . . . . . . . 7059 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 7059 _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 $Pyrazinamidase_polypeptide . 'recombinant technology' . . . . . . . . . . . . . . . . . . . plasmid . . pET-22b(+) . . . . . . 7059 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7059 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pyrazinamidase '[U-13C; U-15N; 70%-2H]' . . 1 $Pyrazinamidase_polypeptide . protein 0.8 0.5 1.5 mM 0.1 . . . 7059 1 2 DTT . . . . . . . 10 . . mM . . . . 7059 1 3 NaN3 . . . . . . . 1 . . mM . . . . 7059 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 7059 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pyrazinamidase '[U-13C; U-15N]' . . 1 $Pyrazinamidase_polypeptide . protein 0.8 0.5 1.5 mM 0.1 . . . 7059 2 2 DTT . . . . . . . 10 . . mM . . . . 7059 2 3 NaN3 . . . . . . . 1 . . mM . . . . 7059 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 7059 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pyrazinamidase [U-15N] . . 1 $Pyrazinamidase_polypeptide . protein 0.8 0.5 1.5 mM 0.1 . . . 7059 3 2 DTT . . . . . . . 10 . . mM . . . . 7059 3 3 NaN3 . . . . . . . 1 . . mM . . . . 7059 3 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 7059 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.7 0.05 pH 7059 1 temperature 313 0.1 K 7059 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 7059 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'with Cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_800MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_spectrometer _NMR_spectrometer.Entry_ID 7059 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'with Cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 7059 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 7059 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 1H15N_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 2 1H15N_TROSY no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 3 '3D TROSY-HNCA' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 4 '3D TROSY-HN(CO)CA' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 5 '3D TROSY-HNCACB' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 6 '3D TROSY-HN(CO)CACB' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 7 '3D TROSY-HN(CA)CO' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 8 '3D TROSY-HNCO' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 9 '3D CC(CO)NH' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 10 '3D (H)CC(CO)NH' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 11 '3D HNHA' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 12 '3D HBHA(CO)NH' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 13 '3D 15N-edited NOESY-TROSY' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 14 '3D 13C-edited NOESY-HSQC' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 15 '3D 13C-edited TOCSY-HSQC' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 16 '3D HCCH-COSY' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 17 '3D HCCH-TOCSY' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7059 1 stop_ save_ save_1H15N_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_HSQC _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_1H15N_TROSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_TROSY _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '1H15N TROSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_TROSY-HNCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_TROSY-HNCA _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '3D TROSY-HNCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_TROSY-HN(CO)CA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_TROSY-HN(CO)CA _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '3D TROSY-HN(CO)CA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_TROSY-HNCACB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_TROSY-HNCACB _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '3D TROSY-HNCACB' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_TROSY-HN(CO)CACB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_TROSY-HN(CO)CACB _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '3D TROSY-HN(CO)CACB' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_TROSY-HN(CA)CO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_TROSY-HN(CA)CO _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name '3D TROSY-HN(CA)CO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_TROSY-HNCO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_TROSY-HNCO _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name '3D TROSY-HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_CC(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_CC(CO)NH _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '3D CC(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_(H)CC(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_(H)CC(CO)NH _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '3D (H)CC(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HNHA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HNHA _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '3D HNHA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HBHA(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HBHA(CO)NH _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '3D HBHA(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N-edited_NOESY-TROSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-edited_NOESY-TROSY _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name '3D 15N-edited NOESY-TROSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_13C-edited_NOESY-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-edited_NOESY-HSQC _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '3D 13C-edited NOESY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_13C-edited_TOCSY-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-edited_TOCSY-HSQC _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 15 _NMR_spec_expt.Name '3D 13C-edited TOCSY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HCCH-COSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HCCH-COSY _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 16 _NMR_spec_expt.Name '3D HCCH-COSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HCCH-TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HCCH-TOCSY _NMR_spec_expt.Entry_ID 7059 _NMR_spec_expt.ID 17 _NMR_spec_expt.Name '3D HCCH-TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7059 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.251449530 . . . . . . . . . 7059 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 7059 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.101329118 . . . . . . . . . 7059 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7059 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 1H15N_HSQC 3 $sample_3 isotropic 7059 1 2 1H15N_TROSY 1 $sample_1 isotropic 7059 1 3 3D_TROSY-HNCA 1 $sample_1 isotropic 7059 1 4 3D_TROSY-HN(CO)CA 1 $sample_1 isotropic 7059 1 5 3D_TROSY-HNCACB 1 $sample_1 isotropic 7059 1 6 3D_TROSY-HN(CO)CACB 1 $sample_1 isotropic 7059 1 7 3D_TROSY-HN(CA)CO 1 $sample_1 isotropic 7059 1 8 3D_TROSY-HNCO 1 $sample_1 isotropic 7059 1 9 3D_CC(CO)NH 1 $sample_1 isotropic 7059 1 10 3D_(H)CC(CO)NH 1 $sample_1 isotropic 7059 1 11 3D_HNHA 3 $sample_3 isotropic 7059 1 12 3D_HBHA(CO)NH 2 $sample_2 isotropic 7059 1 13 3D_15N-edited_NOESY-TROSY 3 $sample_3 isotropic 7059 1 14 3D_13C-edited_NOESY-HSQC 2 $sample_2 isotropic 7059 1 15 3D_13C-edited_TOCSY-HSQC 2 $sample_2 isotropic 7059 1 16 3D_HCCH-COSY 2 $sample_2 isotropic 7059 1 17 3D_HCCH-TOCSY 2 $sample_2 isotropic 7059 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID . $XWINNMR . . 7059 1 . $NMRPipe . . 7059 1 . $NMRView . . 7059 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 3.906 0.02 . 1 . . . . 1 MET HA . 7059 1 2 . 1 1 1 1 MET HB2 H 1 2.069 0.02 . 1 . . . . 1 MET HB2 . 7059 1 3 . 1 1 1 1 MET HB3 H 1 2.069 0.02 . 1 . . . . 1 MET HB3 . 7059 1 4 . 1 1 1 1 MET C C 13 171.789 0.35 . 1 . . . . 1 MET C . 7059 1 5 . 1 1 1 1 MET CA C 13 55.868 0.35 . 1 . . . . 1 MET CA . 7059 1 6 . 1 1 1 1 MET CB C 13 32.002 0.35 . 1 . . . . 1 MET CB . 7059 1 7 . 1 1 2 2 ARG H H 1 10.550 0.02 . 1 . . . . 2 ARG H . 7059 1 8 . 1 1 2 2 ARG HA H 1 5.777 0.02 . 1 . . . . 2 ARG HA . 7059 1 9 . 1 1 2 2 ARG HB2 H 1 2.058 0.02 . 1 . . . . 2 ARG HB2 . 7059 1 10 . 1 1 2 2 ARG HB3 H 1 2.058 0.02 . 1 . . . . 2 ARG HB3 . 7059 1 11 . 1 1 2 2 ARG HG2 H 1 1.742 0.02 . 2 . . . . 2 ARG HG2 . 7059 1 12 . 1 1 2 2 ARG HG3 H 1 1.616 0.02 . 2 . . . . 2 ARG HG3 . 7059 1 13 . 1 1 2 2 ARG HD2 H 1 3.342 0.02 . 2 . . . . 2 ARG HD2 . 7059 1 14 . 1 1 2 2 ARG HD3 H 1 2.936 0.02 . 2 . . . . 2 ARG HD3 . 7059 1 15 . 1 1 2 2 ARG C C 13 176.114 0.35 . 1 . . . . 2 ARG C . 7059 1 16 . 1 1 2 2 ARG CA C 13 55.386 0.35 . 1 . . . . 2 ARG CA . 7059 1 17 . 1 1 2 2 ARG CB C 13 33.385 0.35 . 1 . . . . 2 ARG CB . 7059 1 18 . 1 1 2 2 ARG CG C 13 26.232 0.35 . 1 . . . . 2 ARG CG . 7059 1 19 . 1 1 2 2 ARG CD C 13 42.595 0.35 . 1 . . . . 2 ARG CD . 7059 1 20 . 1 1 2 2 ARG N N 15 129.488 0.2 . 1 . . . . 2 ARG N . 7059 1 21 . 1 1 3 3 ALA H H 1 8.815 0.02 . 1 . . . . 3 ALA H . 7059 1 22 . 1 1 3 3 ALA HA H 1 6.022 0.02 . 1 . . . . 3 ALA HA . 7059 1 23 . 1 1 3 3 ALA HB1 H 1 1.424 0.02 . 1 . . . . 3 ALA HB . 7059 1 24 . 1 1 3 3 ALA HB2 H 1 1.424 0.02 . 1 . . . . 3 ALA HB . 7059 1 25 . 1 1 3 3 ALA HB3 H 1 1.424 0.02 . 1 . . . . 3 ALA HB . 7059 1 26 . 1 1 3 3 ALA C C 13 174.421 0.35 . 1 . . . . 3 ALA C . 7059 1 27 . 1 1 3 3 ALA CA C 13 49.146 0.35 . 1 . . . . 3 ALA CA . 7059 1 28 . 1 1 3 3 ALA CB C 13 23.592 0.35 . 1 . . . . 3 ALA CB . 7059 1 29 . 1 1 3 3 ALA N N 15 125.427 0.2 . 1 . . . . 3 ALA N . 7059 1 30 . 1 1 4 4 LEU H H 1 7.926 0.02 . 1 . . . . 4 LEU H . 7059 1 31 . 1 1 4 4 LEU HA H 1 4.699 0.02 . 1 . . . . 4 LEU HA . 7059 1 32 . 1 1 4 4 LEU HB2 H 1 1.340 0.02 . 1 . . . . 4 LEU HB2 . 7059 1 33 . 1 1 4 4 LEU HB3 H 1 1.340 0.02 . 1 . . . . 4 LEU HB3 . 7059 1 34 . 1 1 4 4 LEU HG H 1 1.074 0.02 . 1 . . . . 4 LEU HG . 7059 1 35 . 1 1 4 4 LEU HD11 H 1 0.841 0.02 . 2 . . . . 4 LEU HD1 . 7059 1 36 . 1 1 4 4 LEU HD12 H 1 0.841 0.02 . 2 . . . . 4 LEU HD1 . 7059 1 37 . 1 1 4 4 LEU HD13 H 1 0.841 0.02 . 2 . . . . 4 LEU HD1 . 7059 1 38 . 1 1 4 4 LEU HD21 H 1 0.679 0.02 . 2 . . . . 4 LEU HD2 . 7059 1 39 . 1 1 4 4 LEU HD22 H 1 0.679 0.02 . 2 . . . . 4 LEU HD2 . 7059 1 40 . 1 1 4 4 LEU HD23 H 1 0.679 0.02 . 2 . . . . 4 LEU HD2 . 7059 1 41 . 1 1 4 4 LEU C C 13 174.285 0.35 . 1 . . . . 4 LEU C . 7059 1 42 . 1 1 4 4 LEU CA C 13 52.864 0.35 . 1 . . . . 4 LEU CA . 7059 1 43 . 1 1 4 4 LEU CB C 13 42.484 0.35 . 1 . . . . 4 LEU CB . 7059 1 44 . 1 1 4 4 LEU CG C 13 25.973 0.35 . 1 . . . . 4 LEU CG . 7059 1 45 . 1 1 4 4 LEU CD1 C 13 22.722 0.35 . 1 . . . . 4 LEU CD1 . 7059 1 46 . 1 1 4 4 LEU CD2 C 13 22.722 0.35 . 1 . . . . 4 LEU CD2 . 7059 1 47 . 1 1 4 4 LEU N N 15 122.857 0.2 . 1 . . . . 4 LEU N . 7059 1 48 . 1 1 5 5 ILE H H 1 9.087 0.02 . 1 . . . . 5 ILE H . 7059 1 49 . 1 1 5 5 ILE HA H 1 4.180 0.02 . 1 . . . . 5 ILE HA . 7059 1 50 . 1 1 5 5 ILE HB H 1 1.712 0.02 . 1 . . . . 5 ILE HB . 7059 1 51 . 1 1 5 5 ILE HG12 H 1 1.394 0.02 . 2 . . . . 5 ILE HG12 . 7059 1 52 . 1 1 5 5 ILE HG13 H 1 1.166 0.02 . 2 . . . . 5 ILE HG13 . 7059 1 53 . 1 1 5 5 ILE HG21 H 1 0.505 0.02 . 1 . . . . 5 ILE HG2 . 7059 1 54 . 1 1 5 5 ILE HG22 H 1 0.505 0.02 . 1 . . . . 5 ILE HG2 . 7059 1 55 . 1 1 5 5 ILE HG23 H 1 0.505 0.02 . 1 . . . . 5 ILE HG2 . 7059 1 56 . 1 1 5 5 ILE HD11 H 1 0.434 0.02 . 1 . . . . 5 ILE HD1 . 7059 1 57 . 1 1 5 5 ILE HD12 H 1 0.434 0.02 . 1 . . . . 5 ILE HD1 . 7059 1 58 . 1 1 5 5 ILE HD13 H 1 0.434 0.02 . 1 . . . . 5 ILE HD1 . 7059 1 59 . 1 1 5 5 ILE C C 13 174.219 0.35 . 1 . . . . 5 ILE C . 7059 1 60 . 1 1 5 5 ILE CA C 13 59.905 0.35 . 1 . . . . 5 ILE CA . 7059 1 61 . 1 1 5 5 ILE CB C 13 38.606 0.35 . 1 . . . . 5 ILE CB . 7059 1 62 . 1 1 5 5 ILE CG1 C 13 25.207 0.35 . 1 . . . . 5 ILE CG1 . 7059 1 63 . 1 1 5 5 ILE CD1 C 13 12.516 0.35 . 1 . . . . 5 ILE CD1 . 7059 1 64 . 1 1 5 5 ILE N N 15 124.350 0.2 . 1 . . . . 5 ILE N . 7059 1 65 . 1 1 6 6 ILE H H 1 8.756 0.02 . 1 . . . . 6 ILE H . 7059 1 66 . 1 1 6 6 ILE HA H 1 4.063 0.02 . 1 . . . . 6 ILE HA . 7059 1 67 . 1 1 6 6 ILE HB H 1 1.803 0.02 . 1 . . . . 6 ILE HB . 7059 1 68 . 1 1 6 6 ILE HG12 H 1 1.552 0.02 . 2 . . . . 6 ILE HG12 . 7059 1 69 . 1 1 6 6 ILE HG13 H 1 1.162 0.02 . 2 . . . . 6 ILE HG13 . 7059 1 70 . 1 1 6 6 ILE HG21 H 1 0.747 0.02 . 1 . . . . 6 ILE HG2 . 7059 1 71 . 1 1 6 6 ILE HG22 H 1 0.747 0.02 . 1 . . . . 6 ILE HG2 . 7059 1 72 . 1 1 6 6 ILE HG23 H 1 0.747 0.02 . 1 . . . . 6 ILE HG2 . 7059 1 73 . 1 1 6 6 ILE HD11 H 1 0.543 0.02 . 1 . . . . 6 ILE HD1 . 7059 1 74 . 1 1 6 6 ILE HD12 H 1 0.543 0.02 . 1 . . . . 6 ILE HD1 . 7059 1 75 . 1 1 6 6 ILE HD13 H 1 0.543 0.02 . 1 . . . . 6 ILE HD1 . 7059 1 76 . 1 1 6 6 ILE C C 13 176.334 0.35 . 1 . . . . 6 ILE C . 7059 1 77 . 1 1 6 6 ILE CA C 13 60.437 0.35 . 1 . . . . 6 ILE CA . 7059 1 78 . 1 1 6 6 ILE CB C 13 37.656 0.35 . 1 . . . . 6 ILE CB . 7059 1 79 . 1 1 6 6 ILE CG1 C 13 31.873 0.35 . 1 . . . . 6 ILE CG1 . 7059 1 80 . 1 1 6 6 ILE CG2 C 13 24.203 0.35 . 1 . . . . 6 ILE CG2 . 7059 1 81 . 1 1 6 6 ILE CD1 C 13 16.935 0.35 . 1 . . . . 6 ILE CD1 . 7059 1 82 . 1 1 6 6 ILE N N 15 126.032 0.2 . 1 . . . . 6 ILE N . 7059 1 83 . 1 1 7 7 VAL H H 1 9.298 0.02 . 1 . . . . 7 VAL H . 7059 1 84 . 1 1 7 7 VAL HA H 1 4.451 0.02 . 1 . . . . 7 VAL HA . 7059 1 85 . 1 1 7 7 VAL HB H 1 1.976 0.02 . 1 . . . . 7 VAL HB . 7059 1 86 . 1 1 7 7 VAL HG11 H 1 0.996 0.02 . 2 . . . . 7 VAL HG1 . 7059 1 87 . 1 1 7 7 VAL HG12 H 1 0.996 0.02 . 2 . . . . 7 VAL HG1 . 7059 1 88 . 1 1 7 7 VAL HG13 H 1 0.996 0.02 . 2 . . . . 7 VAL HG1 . 7059 1 89 . 1 1 7 7 VAL HG21 H 1 1.210 0.02 . 2 . . . . 7 VAL HG2 . 7059 1 90 . 1 1 7 7 VAL HG22 H 1 1.210 0.02 . 2 . . . . 7 VAL HG2 . 7059 1 91 . 1 1 7 7 VAL HG23 H 1 1.210 0.02 . 2 . . . . 7 VAL HG2 . 7059 1 92 . 1 1 7 7 VAL C C 13 173.677 0.35 . 1 . . . . 7 VAL C . 7059 1 93 . 1 1 7 7 VAL CA C 13 62.565 0.35 . 1 . . . . 7 VAL CA . 7059 1 94 . 1 1 7 7 VAL CB C 13 31.410 0.35 . 1 . . . . 7 VAL CB . 7059 1 95 . 1 1 7 7 VAL CG1 C 13 22.698 0.35 . 1 . . . . 7 VAL CG1 . 7059 1 96 . 1 1 7 7 VAL CG2 C 13 22.698 0.35 . 1 . . . . 7 VAL CG2 . 7059 1 97 . 1 1 7 7 VAL N N 15 133.169 0.2 . 1 . . . . 7 VAL N . 7059 1 98 . 1 1 8 8 ASP H H 1 7.698 0.02 . 1 . . . . 8 ASP H . 7059 1 99 . 1 1 8 8 ASP HA H 1 4.136 0.02 . 1 . . . . 8 ASP HA . 7059 1 100 . 1 1 8 8 ASP HB2 H 1 2.939 0.02 . 1 . . . . 8 ASP HB2 . 7059 1 101 . 1 1 8 8 ASP HB3 H 1 2.939 0.02 . 1 . . . . 8 ASP HB3 . 7059 1 102 . 1 1 8 8 ASP C C 13 175.045 0.35 . 1 . . . . 8 ASP C . 7059 1 103 . 1 1 8 8 ASP CA C 13 55.269 0.35 . 1 . . . . 8 ASP CA . 7059 1 104 . 1 1 8 8 ASP CB C 13 38.717 0.35 . 1 . . . . 8 ASP CB . 7059 1 105 . 1 1 8 8 ASP N N 15 127.372 0.2 . 1 . . . . 8 ASP N . 7059 1 106 . 1 1 9 9 VAL H H 1 8.894 0.02 . 1 . . . . 9 VAL H . 7059 1 107 . 1 1 9 9 VAL HA H 1 4.164 0.02 . 1 . . . . 9 VAL HA . 7059 1 108 . 1 1 9 9 VAL HB H 1 2.110 0.02 . 1 . . . . 9 VAL HB . 7059 1 109 . 1 1 9 9 VAL HG11 H 1 0.431 0.02 . 2 . . . . 9 VAL HG1 . 7059 1 110 . 1 1 9 9 VAL HG12 H 1 0.431 0.02 . 2 . . . . 9 VAL HG1 . 7059 1 111 . 1 1 9 9 VAL HG13 H 1 0.431 0.02 . 2 . . . . 9 VAL HG1 . 7059 1 112 . 1 1 9 9 VAL HG21 H 1 0.951 0.02 . 2 . . . . 9 VAL HG2 . 7059 1 113 . 1 1 9 9 VAL HG22 H 1 0.951 0.02 . 2 . . . . 9 VAL HG2 . 7059 1 114 . 1 1 9 9 VAL HG23 H 1 0.951 0.02 . 2 . . . . 9 VAL HG2 . 7059 1 115 . 1 1 9 9 VAL C C 13 176.304 0.35 . 1 . . . . 9 VAL C . 7059 1 116 . 1 1 9 9 VAL CA C 13 61.403 0.35 . 1 . . . . 9 VAL CA . 7059 1 117 . 1 1 9 9 VAL CB C 13 27.773 0.35 . 1 . . . . 9 VAL CB . 7059 1 118 . 1 1 9 9 VAL CG1 C 13 22.012 0.35 . 1 . . . . 9 VAL CG1 . 7059 1 119 . 1 1 9 9 VAL CG2 C 13 22.012 0.35 . 1 . . . . 9 VAL CG2 . 7059 1 120 . 1 1 9 9 VAL N N 15 120.560 0.2 . 1 . . . . 9 VAL N . 7059 1 121 . 1 1 10 10 GLN H H 1 7.671 0.02 . 1 . . . . 10 GLN H . 7059 1 122 . 1 1 10 10 GLN HA H 1 5.072 0.02 . 1 . . . . 10 GLN HA . 7059 1 123 . 1 1 10 10 GLN HB2 H 1 2.249 0.02 . 2 . . . . 10 GLN HB2 . 7059 1 124 . 1 1 10 10 GLN HB3 H 1 1.616 0.02 . 2 . . . . 10 GLN HB3 . 7059 1 125 . 1 1 10 10 GLN HG2 H 1 2.789 0.02 . 2 . . . . 10 GLN HG2 . 7059 1 126 . 1 1 10 10 GLN HG3 H 1 2.278 0.02 . 2 . . . . 10 GLN HG3 . 7059 1 127 . 1 1 10 10 GLN C C 13 177.651 0.35 . 1 . . . . 10 GLN C . 7059 1 128 . 1 1 10 10 GLN CA C 13 53.353 0.35 . 1 . . . . 10 GLN CA . 7059 1 129 . 1 1 10 10 GLN CB C 13 35.877 0.35 . 1 . . . . 10 GLN CB . 7059 1 130 . 1 1 10 10 GLN CG C 13 32.231 0.35 . 1 . . . . 10 GLN CG . 7059 1 131 . 1 1 10 10 GLN N N 15 119.934 0.2 . 1 . . . . 10 GLN N . 7059 1 132 . 1 1 11 11 ASN H H 1 8.636 0.02 . 1 . . . . 11 ASN H . 7059 1 133 . 1 1 11 11 ASN HA H 1 4.514 0.02 . 1 . . . . 11 ASN HA . 7059 1 134 . 1 1 11 11 ASN HB2 H 1 2.999 0.02 . 2 . . . . 11 ASN HB2 . 7059 1 135 . 1 1 11 11 ASN HB3 H 1 2.704 0.02 . 2 . . . . 11 ASN HB3 . 7059 1 136 . 1 1 11 11 ASN HD21 H 1 7.284 0.02 . 1 . . . . 11 ASN HD21 . 7059 1 137 . 1 1 11 11 ASN HD22 H 1 6.492 0.02 . 1 . . . . 11 ASN HD22 . 7059 1 138 . 1 1 11 11 ASN C C 13 179.974 0.35 . 1 . . . . 11 ASN C . 7059 1 139 . 1 1 11 11 ASN CA C 13 56.776 0.35 . 1 . . . . 11 ASN CA . 7059 1 140 . 1 1 11 11 ASN CB C 13 37.198 0.35 . 1 . . . . 11 ASN CB . 7059 1 141 . 1 1 11 11 ASN N N 15 119.928 0.2 . 1 . . . . 11 ASN N . 7059 1 142 . 1 1 12 12 ASP H H 1 8.868 0.02 . 1 . . . . 12 ASP H . 7059 1 143 . 1 1 12 12 ASP HA H 1 5.002 0.02 . 1 . . . . 12 ASP HA . 7059 1 144 . 1 1 12 12 ASP HB2 H 1 2.420 0.02 . 1 . . . . 12 ASP HB2 . 7059 1 145 . 1 1 12 12 ASP HB3 H 1 2.420 0.02 . 1 . . . . 12 ASP HB3 . 7059 1 146 . 1 1 12 12 ASP C C 13 175.617 0.35 . 1 . . . . 12 ASP C . 7059 1 147 . 1 1 12 12 ASP CA C 13 57.228 0.35 . 1 . . . . 12 ASP CA . 7059 1 148 . 1 1 12 12 ASP CB C 13 40.276 0.35 . 1 . . . . 12 ASP CB . 7059 1 149 . 1 1 12 12 ASP N N 15 116.886 0.2 . 1 . . . . 12 ASP N . 7059 1 150 . 1 1 13 13 PHE H H 1 7.513 0.02 . 1 . . . . 13 PHE H . 7059 1 151 . 1 1 13 13 PHE HA H 1 5.339 0.02 . 1 . . . . 13 PHE HA . 7059 1 152 . 1 1 13 13 PHE HB2 H 1 3.899 0.02 . 2 . . . . 13 PHE HB2 . 7059 1 153 . 1 1 13 13 PHE HB3 H 1 2.744 0.02 . 2 . . . . 13 PHE HB3 . 7059 1 154 . 1 1 13 13 PHE C C 13 175.116 0.35 . 1 . . . . 13 PHE C . 7059 1 155 . 1 1 13 13 PHE CA C 13 55.991 0.35 . 1 . . . . 13 PHE CA . 7059 1 156 . 1 1 13 13 PHE CB C 13 39.882 0.35 . 1 . . . . 13 PHE CB . 7059 1 157 . 1 1 13 13 PHE N N 15 114.620 0.2 . 1 . . . . 13 PHE N . 7059 1 158 . 1 1 14 14 CYS H H 1 7.566 0.02 . 1 . . . . 14 CYS H . 7059 1 159 . 1 1 14 14 CYS HA H 1 5.079 0.02 . 1 . . . . 14 CYS HA . 7059 1 160 . 1 1 14 14 CYS HB2 H 1 3.187 0.02 . 2 . . . . 14 CYS HB2 . 7059 1 161 . 1 1 14 14 CYS HB3 H 1 2.732 0.02 . 2 . . . . 14 CYS HB3 . 7059 1 162 . 1 1 14 14 CYS C C 13 172.562 0.35 . 1 . . . . 14 CYS C . 7059 1 163 . 1 1 14 14 CYS CA C 13 57.252 0.35 . 1 . . . . 14 CYS CA . 7059 1 164 . 1 1 14 14 CYS CB C 13 32.124 0.35 . 1 . . . . 14 CYS CB . 7059 1 165 . 1 1 14 14 CYS N N 15 116.249 0.2 . 1 . . . . 14 CYS N . 7059 1 166 . 1 1 15 15 GLU H H 1 11.002 0.02 . 1 . . . . 15 GLU H . 7059 1 167 . 1 1 15 15 GLU HA H 1 3.945 0.02 . 1 . . . . 15 GLU HA . 7059 1 168 . 1 1 15 15 GLU HB2 H 1 2.080 0.02 . 2 . . . . 15 GLU HB2 . 7059 1 169 . 1 1 15 15 GLU HB3 H 1 1.927 0.02 . 2 . . . . 15 GLU HB3 . 7059 1 170 . 1 1 15 15 GLU HG2 H 1 2.701 0.02 . 2 . . . . 15 GLU HG2 . 7059 1 171 . 1 1 15 15 GLU HG3 H 1 2.419 0.02 . 2 . . . . 15 GLU HG3 . 7059 1 172 . 1 1 15 15 GLU C C 13 178.022 0.35 . 1 . . . . 15 GLU C . 7059 1 173 . 1 1 15 15 GLU CA C 13 61.485 0.35 . 1 . . . . 15 GLU CA . 7059 1 174 . 1 1 15 15 GLU CB C 13 27.851 0.35 . 1 . . . . 15 GLU CB . 7059 1 175 . 1 1 15 15 GLU CG C 13 37.044 0.35 . 1 . . . . 15 GLU CG . 7059 1 176 . 1 1 15 15 GLU N N 15 122.781 0.2 . 1 . . . . 15 GLU N . 7059 1 177 . 1 1 16 16 GLY H H 1 8.826 0.02 . 1 . . . . 16 GLY H . 7059 1 178 . 1 1 16 16 GLY HA2 H 1 3.623 0.02 . 2 . . . . 16 GLY HA2 . 7059 1 179 . 1 1 16 16 GLY HA3 H 1 4.397 0.02 . 2 . . . . 16 GLY HA3 . 7059 1 180 . 1 1 16 16 GLY C C 13 175.371 0.35 . 1 . . . . 16 GLY C . 7059 1 181 . 1 1 16 16 GLY CA C 13 44.675 0.35 . 1 . . . . 16 GLY CA . 7059 1 182 . 1 1 16 16 GLY N N 15 114.539 0.2 . 1 . . . . 16 GLY N . 7059 1 183 . 1 1 17 17 GLY H H 1 9.052 0.02 . 1 . . . . 17 GLY H . 7059 1 184 . 1 1 17 17 GLY HA2 H 1 4.365 0.02 . 2 . . . . 17 GLY HA2 . 7059 1 185 . 1 1 17 17 GLY HA3 H 1 3.184 0.02 . 2 . . . . 17 GLY HA3 . 7059 1 186 . 1 1 17 17 GLY C C 13 174.841 0.35 . 1 . . . . 17 GLY C . 7059 1 187 . 1 1 17 17 GLY CA C 13 44.161 0.35 . 1 . . . . 17 GLY CA . 7059 1 188 . 1 1 17 17 GLY N N 15 109.545 0.2 . 1 . . . . 17 GLY N . 7059 1 189 . 1 1 18 18 SER H H 1 8.531 0.02 . 1 . . . . 18 SER H . 7059 1 190 . 1 1 18 18 SER HA H 1 5.019 0.02 . 1 . . . . 18 SER HA . 7059 1 191 . 1 1 18 18 SER HB2 H 1 3.869 0.02 . 2 . . . . 18 SER HB2 . 7059 1 192 . 1 1 18 18 SER HB3 H 1 4.161 0.02 . 2 . . . . 18 SER HB3 . 7059 1 193 . 1 1 18 18 SER C C 13 175.290 0.35 . 1 . . . . 18 SER C . 7059 1 194 . 1 1 18 18 SER CA C 13 60.702 0.35 . 1 . . . . 18 SER CA . 7059 1 195 . 1 1 18 18 SER CB C 13 63.663 0.35 . 1 . . . . 18 SER CB . 7059 1 196 . 1 1 18 18 SER N N 15 116.069 0.2 . 1 . . . . 18 SER N . 7059 1 197 . 1 1 19 19 LEU H H 1 8.799 0.02 . 1 . . . . 19 LEU H . 7059 1 198 . 1 1 19 19 LEU HA H 1 4.723 0.02 . 1 . . . . 19 LEU HA . 7059 1 199 . 1 1 19 19 LEU HB2 H 1 1.853 0.02 . 2 . . . . 19 LEU HB2 . 7059 1 200 . 1 1 19 19 LEU HB3 H 1 0.936 0.02 . 2 . . . . 19 LEU HB3 . 7059 1 201 . 1 1 19 19 LEU HG H 1 1.236 0.02 . 1 . . . . 19 LEU HG . 7059 1 202 . 1 1 19 19 LEU HD11 H 1 0.844 0.02 . 2 . . . . 19 LEU HD1 . 7059 1 203 . 1 1 19 19 LEU HD12 H 1 0.844 0.02 . 2 . . . . 19 LEU HD1 . 7059 1 204 . 1 1 19 19 LEU HD13 H 1 0.844 0.02 . 2 . . . . 19 LEU HD1 . 7059 1 205 . 1 1 19 19 LEU HD21 H 1 0.673 0.02 . 2 . . . . 19 LEU HD2 . 7059 1 206 . 1 1 19 19 LEU HD22 H 1 0.673 0.02 . 2 . . . . 19 LEU HD2 . 7059 1 207 . 1 1 19 19 LEU HD23 H 1 0.673 0.02 . 2 . . . . 19 LEU HD2 . 7059 1 208 . 1 1 19 19 LEU C C 13 175.415 0.35 . 1 . . . . 19 LEU C . 7059 1 209 . 1 1 19 19 LEU CA C 13 52.490 0.35 . 1 . . . . 19 LEU CA . 7059 1 210 . 1 1 19 19 LEU CB C 13 41.994 0.35 . 1 . . . . 19 LEU CB . 7059 1 211 . 1 1 19 19 LEU CG C 13 26.353 0.35 . 1 . . . . 19 LEU CG . 7059 1 212 . 1 1 19 19 LEU N N 15 126.904 0.2 . 1 . . . . 19 LEU N . 7059 1 213 . 1 1 20 20 ALA H H 1 6.442 0.02 . 1 . . . . 20 ALA H . 7059 1 214 . 1 1 20 20 ALA HA H 1 4.216 0.02 . 1 . . . . 20 ALA HA . 7059 1 215 . 1 1 20 20 ALA HB1 H 1 1.193 0.02 . 1 . . . . 20 ALA HB . 7059 1 216 . 1 1 20 20 ALA HB2 H 1 1.193 0.02 . 1 . . . . 20 ALA HB . 7059 1 217 . 1 1 20 20 ALA HB3 H 1 1.193 0.02 . 1 . . . . 20 ALA HB . 7059 1 218 . 1 1 20 20 ALA C C 13 177.966 0.35 . 1 . . . . 20 ALA C . 7059 1 219 . 1 1 20 20 ALA CA C 13 53.800 0.35 . 1 . . . . 20 ALA CA . 7059 1 220 . 1 1 20 20 ALA CB C 13 20.799 0.35 . 1 . . . . 20 ALA CB . 7059 1 221 . 1 1 20 20 ALA N N 15 118.438 0.2 . 1 . . . . 20 ALA N . 7059 1 222 . 1 1 21 21 VAL H H 1 7.851 0.02 . 1 . . . . 21 VAL H . 7059 1 223 . 1 1 21 21 VAL HA H 1 4.204 0.02 . 1 . . . . 21 VAL HA . 7059 1 224 . 1 1 21 21 VAL HB H 1 2.303 0.02 . 1 . . . . 21 VAL HB . 7059 1 225 . 1 1 21 21 VAL HG11 H 1 0.743 0.02 . 2 . . . . 21 VAL HG1 . 7059 1 226 . 1 1 21 21 VAL HG12 H 1 0.743 0.02 . 2 . . . . 21 VAL HG1 . 7059 1 227 . 1 1 21 21 VAL HG13 H 1 0.743 0.02 . 2 . . . . 21 VAL HG1 . 7059 1 228 . 1 1 21 21 VAL HG21 H 1 0.980 0.02 . 2 . . . . 21 VAL HG2 . 7059 1 229 . 1 1 21 21 VAL HG22 H 1 0.980 0.02 . 2 . . . . 21 VAL HG2 . 7059 1 230 . 1 1 21 21 VAL HG23 H 1 0.980 0.02 . 2 . . . . 21 VAL HG2 . 7059 1 231 . 1 1 21 21 VAL C C 13 176.028 0.35 . 1 . . . . 21 VAL C . 7059 1 232 . 1 1 21 21 VAL CA C 13 60.949 0.35 . 1 . . . . 21 VAL CA . 7059 1 233 . 1 1 21 21 VAL CB C 13 31.980 0.35 . 1 . . . . 21 VAL CB . 7059 1 234 . 1 1 21 21 VAL CG1 C 13 20.849 0.35 . 2 . . . . 21 VAL CG1 . 7059 1 235 . 1 1 21 21 VAL CG2 C 13 22.933 0.35 . 2 . . . . 21 VAL CG2 . 7059 1 236 . 1 1 21 21 VAL N N 15 124.666 0.2 . 1 . . . . 21 VAL N . 7059 1 237 . 1 1 22 22 THR H H 1 8.588 0.02 . 1 . . . . 22 THR H . 7059 1 238 . 1 1 22 22 THR HA H 1 3.780 0.02 . 1 . . . . 22 THR HA . 7059 1 239 . 1 1 22 22 THR HB H 1 4.195 0.02 . 1 . . . . 22 THR HB . 7059 1 240 . 1 1 22 22 THR HG21 H 1 1.241 0.02 . 1 . . . . 22 THR HG2 . 7059 1 241 . 1 1 22 22 THR HG22 H 1 1.241 0.02 . 1 . . . . 22 THR HG2 . 7059 1 242 . 1 1 22 22 THR HG23 H 1 1.241 0.02 . 1 . . . . 22 THR HG2 . 7059 1 243 . 1 1 22 22 THR C C 13 175.290 0.35 . 1 . . . . 22 THR C . 7059 1 244 . 1 1 22 22 THR CA C 13 65.181 0.35 . 1 . . . . 22 THR CA . 7059 1 245 . 1 1 22 22 THR CB C 13 68.159 0.35 . 1 . . . . 22 THR CB . 7059 1 246 . 1 1 22 22 THR CG2 C 13 20.824 0.35 . 1 . . . . 22 THR CG2 . 7059 1 247 . 1 1 22 22 THR N N 15 123.521 0.2 . 1 . . . . 22 THR N . 7059 1 248 . 1 1 23 23 GLY H H 1 9.423 0.02 . 1 . . . . 23 GLY H . 7059 1 249 . 1 1 23 23 GLY HA2 H 1 4.399 0.02 . 2 . . . . 23 GLY HA2 . 7059 1 250 . 1 1 23 23 GLY HA3 H 1 3.792 0.02 . 2 . . . . 23 GLY HA3 . 7059 1 251 . 1 1 23 23 GLY C C 13 176.305 0.35 . 1 . . . . 23 GLY C . 7059 1 252 . 1 1 23 23 GLY CA C 13 44.329 0.35 . 1 . . . . 23 GLY CA . 7059 1 253 . 1 1 23 23 GLY N N 15 116.314 0.2 . 1 . . . . 23 GLY N . 7059 1 254 . 1 1 24 24 GLY H H 1 8.807 0.02 . 1 . . . . 24 GLY H . 7059 1 255 . 1 1 24 24 GLY HA2 H 1 3.998 0.02 . 2 . . . . 24 GLY HA2 . 7059 1 256 . 1 1 24 24 GLY HA3 H 1 3.529 0.02 . 2 . . . . 24 GLY HA3 . 7059 1 257 . 1 1 24 24 GLY C C 13 173.872 0.35 . 1 . . . . 24 GLY C . 7059 1 258 . 1 1 24 24 GLY CA C 13 48.522 0.35 . 1 . . . . 24 GLY CA . 7059 1 259 . 1 1 24 24 GLY N N 15 112.649 0.2 . 1 . . . . 24 GLY N . 7059 1 260 . 1 1 25 25 ALA H H 1 9.820 0.02 . 1 . . . . 25 ALA H . 7059 1 261 . 1 1 25 25 ALA HA H 1 3.144 0.02 . 1 . . . . 25 ALA HA . 7059 1 262 . 1 1 25 25 ALA HB1 H 1 1.363 0.02 . 1 . . . . 25 ALA HB . 7059 1 263 . 1 1 25 25 ALA HB2 H 1 1.363 0.02 . 1 . . . . 25 ALA HB . 7059 1 264 . 1 1 25 25 ALA HB3 H 1 1.363 0.02 . 1 . . . . 25 ALA HB . 7059 1 265 . 1 1 25 25 ALA C C 13 181.441 0.35 . 1 . . . . 25 ALA C . 7059 1 266 . 1 1 25 25 ALA CA C 13 55.047 0.35 . 1 . . . . 25 ALA CA . 7059 1 267 . 1 1 25 25 ALA CB C 13 17.811 0.35 . 1 . . . . 25 ALA CB . 7059 1 268 . 1 1 25 25 ALA N N 15 124.343 0.2 . 1 . . . . 25 ALA N . 7059 1 269 . 1 1 26 26 ALA H H 1 8.628 0.02 . 1 . . . . 26 ALA H . 7059 1 270 . 1 1 26 26 ALA HA H 1 3.992 0.02 . 1 . . . . 26 ALA HA . 7059 1 271 . 1 1 26 26 ALA HB1 H 1 1.353 0.02 . 1 . . . . 26 ALA HB . 7059 1 272 . 1 1 26 26 ALA HB2 H 1 1.353 0.02 . 1 . . . . 26 ALA HB . 7059 1 273 . 1 1 26 26 ALA HB3 H 1 1.353 0.02 . 1 . . . . 26 ALA HB . 7059 1 274 . 1 1 26 26 ALA C C 13 180.754 0.35 . 1 . . . . 26 ALA C . 7059 1 275 . 1 1 26 26 ALA CA C 13 54.126 0.35 . 1 . . . . 26 ALA CA . 7059 1 276 . 1 1 26 26 ALA CB C 13 17.268 0.35 . 1 . . . . 26 ALA CB . 7059 1 277 . 1 1 26 26 ALA N N 15 121.278 0.2 . 1 . . . . 26 ALA N . 7059 1 278 . 1 1 27 27 LEU H H 1 8.183 0.02 . 1 . . . . 27 LEU H . 7059 1 279 . 1 1 27 27 LEU HA H 1 4.123 0.02 . 1 . . . . 27 LEU HA . 7059 1 280 . 1 1 27 27 LEU HB2 H 1 2.044 0.02 . 2 . . . . 27 LEU HB2 . 7059 1 281 . 1 1 27 27 LEU HB3 H 1 1.525 0.02 . 2 . . . . 27 LEU HB3 . 7059 1 282 . 1 1 27 27 LEU HG H 1 1.361 0.02 . 1 . . . . 27 LEU HG . 7059 1 283 . 1 1 27 27 LEU HD11 H 1 0.778 0.02 . 2 . . . . 27 LEU HD1 . 7059 1 284 . 1 1 27 27 LEU HD12 H 1 0.778 0.02 . 2 . . . . 27 LEU HD1 . 7059 1 285 . 1 1 27 27 LEU HD13 H 1 0.778 0.02 . 2 . . . . 27 LEU HD1 . 7059 1 286 . 1 1 27 27 LEU HD21 H 1 0.681 0.02 . 2 . . . . 27 LEU HD2 . 7059 1 287 . 1 1 27 27 LEU HD22 H 1 0.681 0.02 . 2 . . . . 27 LEU HD2 . 7059 1 288 . 1 1 27 27 LEU HD23 H 1 0.681 0.02 . 2 . . . . 27 LEU HD2 . 7059 1 289 . 1 1 27 27 LEU C C 13 178.179 0.35 . 1 . . . . 27 LEU C . 7059 1 290 . 1 1 27 27 LEU CA C 13 56.879 0.35 . 1 . . . . 27 LEU CA . 7059 1 291 . 1 1 27 27 LEU CB C 13 40.358 0.35 . 1 . . . . 27 LEU CB . 7059 1 292 . 1 1 27 27 LEU CG C 13 25.625 0.35 . 1 . . . . 27 LEU CG . 7059 1 293 . 1 1 27 27 LEU N N 15 121.926 0.2 . 1 . . . . 27 LEU N . 7059 1 294 . 1 1 28 28 ALA H H 1 7.896 0.02 . 1 . . . . 28 ALA H . 7059 1 295 . 1 1 28 28 ALA HA H 1 3.617 0.02 . 1 . . . . 28 ALA HA . 7059 1 296 . 1 1 28 28 ALA HB1 H 1 1.093 0.02 . 1 . . . . 28 ALA HB . 7059 1 297 . 1 1 28 28 ALA HB2 H 1 1.093 0.02 . 1 . . . . 28 ALA HB . 7059 1 298 . 1 1 28 28 ALA HB3 H 1 1.093 0.02 . 1 . . . . 28 ALA HB . 7059 1 299 . 1 1 28 28 ALA C C 13 178.704 0.35 . 1 . . . . 28 ALA C . 7059 1 300 . 1 1 28 28 ALA CA C 13 55.768 0.35 . 1 . . . . 28 ALA CA . 7059 1 301 . 1 1 28 28 ALA CB C 13 18.271 0.35 . 1 . . . . 28 ALA CB . 7059 1 302 . 1 1 28 28 ALA N N 15 121.344 0.2 . 1 . . . . 28 ALA N . 7059 1 303 . 1 1 29 29 ARG H H 1 6.809 0.02 . 1 . . . . 29 ARG H . 7059 1 304 . 1 1 29 29 ARG HA H 1 4.164 0.02 . 1 . . . . 29 ARG HA . 7059 1 305 . 1 1 29 29 ARG HB2 H 1 2.110 0.02 . 1 . . . . 29 ARG HB2 . 7059 1 306 . 1 1 29 29 ARG HB3 H 1 2.110 0.02 . 1 . . . . 29 ARG HB3 . 7059 1 307 . 1 1 29 29 ARG HG2 H 1 1.861 0.02 . 2 . . . . 29 ARG HG2 . 7059 1 308 . 1 1 29 29 ARG HG3 H 1 1.611 0.02 . 2 . . . . 29 ARG HG3 . 7059 1 309 . 1 1 29 29 ARG HD2 H 1 3.145 0.02 . 2 . . . . 29 ARG HD2 . 7059 1 310 . 1 1 29 29 ARG HD3 H 1 3.048 0.02 . 2 . . . . 29 ARG HD3 . 7059 1 311 . 1 1 29 29 ARG C C 13 177.247 0.35 . 1 . . . . 29 ARG C . 7059 1 312 . 1 1 29 29 ARG CA C 13 57.833 0.35 . 1 . . . . 29 ARG CA . 7059 1 313 . 1 1 29 29 ARG CB C 13 29.174 0.35 . 1 . . . . 29 ARG CB . 7059 1 314 . 1 1 29 29 ARG CG C 13 25.564 0.35 . 1 . . . . 29 ARG CG . 7059 1 315 . 1 1 29 29 ARG CD C 13 42.339 0.35 . 1 . . . . 29 ARG CD . 7059 1 316 . 1 1 29 29 ARG N N 15 114.721 0.2 . 1 . . . . 29 ARG N . 7059 1 317 . 1 1 30 30 ALA H H 1 8.232 0.02 . 1 . . . . 30 ALA H . 7059 1 318 . 1 1 30 30 ALA HA H 1 4.125 0.02 . 1 . . . . 30 ALA HA . 7059 1 319 . 1 1 30 30 ALA HB1 H 1 1.375 0.02 . 1 . . . . 30 ALA HB . 7059 1 320 . 1 1 30 30 ALA HB2 H 1 1.375 0.02 . 1 . . . . 30 ALA HB . 7059 1 321 . 1 1 30 30 ALA HB3 H 1 1.375 0.02 . 1 . . . . 30 ALA HB . 7059 1 322 . 1 1 30 30 ALA C C 13 181.168 0.35 . 1 . . . . 30 ALA C . 7059 1 323 . 1 1 30 30 ALA CA C 13 55.038 0.35 . 1 . . . . 30 ALA CA . 7059 1 324 . 1 1 30 30 ALA CB C 13 17.819 0.35 . 1 . . . . 30 ALA CB . 7059 1 325 . 1 1 30 30 ALA N N 15 122.862 0.2 . 1 . . . . 30 ALA N . 7059 1 326 . 1 1 31 31 ILE H H 1 9.087 0.02 . 1 . . . . 31 ILE H . 7059 1 327 . 1 1 31 31 ILE HA H 1 3.662 0.02 . 1 . . . . 31 ILE HA . 7059 1 328 . 1 1 31 31 ILE HB H 1 1.772 0.02 . 1 . . . . 31 ILE HB . 7059 1 329 . 1 1 31 31 ILE HG12 H 1 2.063 0.02 . 2 . . . . 31 ILE HG12 . 7059 1 330 . 1 1 31 31 ILE HG13 H 1 0.846 0.02 . 2 . . . . 31 ILE HG13 . 7059 1 331 . 1 1 31 31 ILE HG21 H 1 0.753 0.02 . 1 . . . . 31 ILE HG2 . 7059 1 332 . 1 1 31 31 ILE HG22 H 1 0.753 0.02 . 1 . . . . 31 ILE HG2 . 7059 1 333 . 1 1 31 31 ILE HG23 H 1 0.753 0.02 . 1 . . . . 31 ILE HG2 . 7059 1 334 . 1 1 31 31 ILE HD11 H 1 0.720 0.02 . 1 . . . . 31 ILE HD1 . 7059 1 335 . 1 1 31 31 ILE HD12 H 1 0.720 0.02 . 1 . . . . 31 ILE HD1 . 7059 1 336 . 1 1 31 31 ILE HD13 H 1 0.720 0.02 . 1 . . . . 31 ILE HD1 . 7059 1 337 . 1 1 31 31 ILE C C 13 177.637 0.35 . 1 . . . . 31 ILE C . 7059 1 338 . 1 1 31 31 ILE CA C 13 65.936 0.35 . 1 . . . . 31 ILE CA . 7059 1 339 . 1 1 31 31 ILE CB C 13 37.305 0.35 . 1 . . . . 31 ILE CB . 7059 1 340 . 1 1 31 31 ILE CG1 C 13 30.675 0.35 . 1 . . . . 31 ILE CG1 . 7059 1 341 . 1 1 31 31 ILE CG2 C 13 18.899 0.35 . 1 . . . . 31 ILE CG2 . 7059 1 342 . 1 1 31 31 ILE CD1 C 13 14.168 0.35 . 1 . . . . 31 ILE CD1 . 7059 1 343 . 1 1 31 31 ILE N N 15 119.245 0.2 . 1 . . . . 31 ILE N . 7059 1 344 . 1 1 32 32 SER H H 1 7.776 0.02 . 1 . . . . 32 SER H . 7059 1 345 . 1 1 32 32 SER HA H 1 4.417 0.02 . 1 . . . . 32 SER HA . 7059 1 346 . 1 1 32 32 SER HB2 H 1 4.142 0.02 . 1 . . . . 32 SER HB2 . 7059 1 347 . 1 1 32 32 SER HB3 H 1 4.142 0.02 . 1 . . . . 32 SER HB3 . 7059 1 348 . 1 1 32 32 SER C C 13 176.696 0.35 . 1 . . . . 32 SER C . 7059 1 349 . 1 1 32 32 SER CA C 13 62.767 0.35 . 1 . . . . 32 SER CA . 7059 1 350 . 1 1 32 32 SER CB C 13 61.801 0.35 . 1 . . . . 32 SER CB . 7059 1 351 . 1 1 32 32 SER N N 15 117.292 0.2 . 1 . . . . 32 SER N . 7059 1 352 . 1 1 33 33 ASP H H 1 8.635 0.02 . 1 . . . . 33 ASP H . 7059 1 353 . 1 1 33 33 ASP HA H 1 4.417 0.02 . 1 . . . . 33 ASP HA . 7059 1 354 . 1 1 33 33 ASP HB2 H 1 3.142 0.02 . 2 . . . . 33 ASP HB2 . 7059 1 355 . 1 1 33 33 ASP HB3 H 1 2.961 0.02 . 2 . . . . 33 ASP HB3 . 7059 1 356 . 1 1 33 33 ASP C C 13 178.542 0.35 . 1 . . . . 33 ASP C . 7059 1 357 . 1 1 33 33 ASP CA C 13 57.213 0.35 . 1 . . . . 33 ASP CA . 7059 1 358 . 1 1 33 33 ASP CB C 13 39.553 0.35 . 1 . . . . 33 ASP CB . 7059 1 359 . 1 1 33 33 ASP N N 15 123.299 0.2 . 1 . . . . 33 ASP N . 7059 1 360 . 1 1 34 34 TYR H H 1 8.418 0.02 . 1 . . . . 34 TYR H . 7059 1 361 . 1 1 34 34 TYR HA H 1 4.365 0.02 . 1 . . . . 34 TYR HA . 7059 1 362 . 1 1 34 34 TYR HB2 H 1 3.189 0.02 . 1 . . . . 34 TYR HB2 . 7059 1 363 . 1 1 34 34 TYR HB3 H 1 3.189 0.02 . 1 . . . . 34 TYR HB3 . 7059 1 364 . 1 1 34 34 TYR HD1 H 1 6.946 0.02 . 1 . . . . 34 TYR HD . 7059 1 365 . 1 1 34 34 TYR HD2 H 1 6.946 0.02 . 1 . . . . 34 TYR HD . 7059 1 366 . 1 1 34 34 TYR C C 13 177.917 0.35 . 1 . . . . 34 TYR C . 7059 1 367 . 1 1 34 34 TYR CA C 13 60.263 0.35 . 1 . . . . 34 TYR CA . 7059 1 368 . 1 1 34 34 TYR CB C 13 38.071 0.35 . 1 . . . . 34 TYR CB . 7059 1 369 . 1 1 34 34 TYR N N 15 122.198 0.2 . 1 . . . . 34 TYR N . 7059 1 370 . 1 1 35 35 LEU H H 1 8.628 0.02 . 1 . . . . 35 LEU H . 7059 1 371 . 1 1 35 35 LEU HA H 1 3.717 0.02 . 1 . . . . 35 LEU HA . 7059 1 372 . 1 1 35 35 LEU HB2 H 1 1.966 0.02 . 2 . . . . 35 LEU HB2 . 7059 1 373 . 1 1 35 35 LEU HB3 H 1 1.443 0.02 . 2 . . . . 35 LEU HB3 . 7059 1 374 . 1 1 35 35 LEU HG H 1 1.306 0.02 . 1 . . . . 35 LEU HG . 7059 1 375 . 1 1 35 35 LEU HD11 H 1 0.747 0.02 . 1 . . . . 35 LEU HD1 . 7059 1 376 . 1 1 35 35 LEU HD12 H 1 0.747 0.02 . 1 . . . . 35 LEU HD1 . 7059 1 377 . 1 1 35 35 LEU HD13 H 1 0.747 0.02 . 1 . . . . 35 LEU HD1 . 7059 1 378 . 1 1 35 35 LEU HD21 H 1 0.747 0.02 . 1 . . . . 35 LEU HD2 . 7059 1 379 . 1 1 35 35 LEU HD22 H 1 0.747 0.02 . 1 . . . . 35 LEU HD2 . 7059 1 380 . 1 1 35 35 LEU HD23 H 1 0.747 0.02 . 1 . . . . 35 LEU HD2 . 7059 1 381 . 1 1 35 35 LEU C C 13 178.509 0.35 . 1 . . . . 35 LEU C . 7059 1 382 . 1 1 35 35 LEU CA C 13 56.949 0.35 . 1 . . . . 35 LEU CA . 7059 1 383 . 1 1 35 35 LEU CB C 13 41.226 0.35 . 1 . . . . 35 LEU CB . 7059 1 384 . 1 1 35 35 LEU CG C 13 26.347 0.35 . 1 . . . . 35 LEU CG . 7059 1 385 . 1 1 35 35 LEU CD1 C 13 19.344 0.35 . 1 . . . . 35 LEU CD1 . 7059 1 386 . 1 1 35 35 LEU CD2 C 13 19.344 0.35 . 1 . . . . 35 LEU CD2 . 7059 1 387 . 1 1 35 35 LEU N N 15 118.668 0.2 . 1 . . . . 35 LEU N . 7059 1 388 . 1 1 36 36 ALA H H 1 7.505 0.02 . 1 . . . . 36 ALA H . 7059 1 389 . 1 1 36 36 ALA HA H 1 4.124 0.02 . 1 . . . . 36 ALA HA . 7059 1 390 . 1 1 36 36 ALA HB1 H 1 1.504 0.02 . 1 . . . . 36 ALA HB . 7059 1 391 . 1 1 36 36 ALA HB2 H 1 1.504 0.02 . 1 . . . . 36 ALA HB . 7059 1 392 . 1 1 36 36 ALA HB3 H 1 1.504 0.02 . 1 . . . . 36 ALA HB . 7059 1 393 . 1 1 36 36 ALA C C 13 178.791 0.35 . 1 . . . . 36 ALA C . 7059 1 394 . 1 1 36 36 ALA CA C 13 53.846 0.35 . 1 . . . . 36 ALA CA . 7059 1 395 . 1 1 36 36 ALA CB C 13 18.255 0.35 . 1 . . . . 36 ALA CB . 7059 1 396 . 1 1 36 36 ALA N N 15 118.851 0.2 . 1 . . . . 36 ALA N . 7059 1 397 . 1 1 37 37 GLU H H 1 7.399 0.02 . 1 . . . . 37 GLU H . 7059 1 398 . 1 1 37 37 GLU HA H 1 4.403 0.02 . 1 . . . . 37 GLU HA . 7059 1 399 . 1 1 37 37 GLU HB2 H 1 1.944 0.02 . 1 . . . . 37 GLU HB2 . 7059 1 400 . 1 1 37 37 GLU HB3 H 1 1.944 0.02 . 1 . . . . 37 GLU HB3 . 7059 1 401 . 1 1 37 37 GLU HG2 H 1 2.220 0.02 . 1 . . . . 37 GLU HG2 . 7059 1 402 . 1 1 37 37 GLU HG3 H 1 2.220 0.02 . 1 . . . . 37 GLU HG3 . 7059 1 403 . 1 1 37 37 GLU C C 13 176.379 0.35 . 1 . . . . 37 GLU C . 7059 1 404 . 1 1 37 37 GLU CA C 13 55.955 0.35 . 1 . . . . 37 GLU CA . 7059 1 405 . 1 1 37 37 GLU CB C 13 31.065 0.35 . 1 . . . . 37 GLU CB . 7059 1 406 . 1 1 37 37 GLU CG C 13 34.386 0.35 . 1 . . . . 37 GLU CG . 7059 1 407 . 1 1 37 37 GLU N N 15 114.187 0.2 . 1 . . . . 37 GLU N . 7059 1 408 . 1 1 38 38 ALA H H 1 7.839 0.02 . 1 . . . . 38 ALA H . 7059 1 409 . 1 1 38 38 ALA HA H 1 4.148 0.02 . 1 . . . . 38 ALA HA . 7059 1 410 . 1 1 38 38 ALA HB1 H 1 1.077 0.02 . 1 . . . . 38 ALA HB . 7059 1 411 . 1 1 38 38 ALA HB2 H 1 1.077 0.02 . 1 . . . . 38 ALA HB . 7059 1 412 . 1 1 38 38 ALA HB3 H 1 1.077 0.02 . 1 . . . . 38 ALA HB . 7059 1 413 . 1 1 38 38 ALA C C 13 177.228 0.35 . 1 . . . . 38 ALA C . 7059 1 414 . 1 1 38 38 ALA CA C 13 52.724 0.35 . 1 . . . . 38 ALA CA . 7059 1 415 . 1 1 38 38 ALA CB C 13 18.519 0.35 . 1 . . . . 38 ALA CB . 7059 1 416 . 1 1 38 38 ALA N N 15 123.233 0.2 . 1 . . . . 38 ALA N . 7059 1 417 . 1 1 39 39 ALA H H 1 7.924 0.02 . 1 . . . . 39 ALA H . 7059 1 418 . 1 1 39 39 ALA HA H 1 4.157 0.02 . 1 . . . . 39 ALA HA . 7059 1 419 . 1 1 39 39 ALA HB1 H 1 1.186 0.02 . 1 . . . . 39 ALA HB . 7059 1 420 . 1 1 39 39 ALA HB2 H 1 1.186 0.02 . 1 . . . . 39 ALA HB . 7059 1 421 . 1 1 39 39 ALA HB3 H 1 1.186 0.02 . 1 . . . . 39 ALA HB . 7059 1 422 . 1 1 39 39 ALA C C 13 177.554 0.35 . 1 . . . . 39 ALA C . 7059 1 423 . 1 1 39 39 ALA CA C 13 52.015 0.35 . 1 . . . . 39 ALA CA . 7059 1 424 . 1 1 39 39 ALA CB C 13 19.405 0.35 . 1 . . . . 39 ALA CB . 7059 1 425 . 1 1 39 39 ALA N N 15 123.041 0.2 . 1 . . . . 39 ALA N . 7059 1 426 . 1 1 40 40 ASP H H 1 7.590 0.02 . 1 . . . . 40 ASP H . 7059 1 427 . 1 1 40 40 ASP HA H 1 4.399 0.02 . 1 . . . . 40 ASP HA . 7059 1 428 . 1 1 40 40 ASP HB2 H 1 2.349 0.02 . 2 . . . . 40 ASP HB2 . 7059 1 429 . 1 1 40 40 ASP HB3 H 1 2.090 0.02 . 2 . . . . 40 ASP HB3 . 7059 1 430 . 1 1 40 40 ASP C C 13 175.410 0.35 . 1 . . . . 40 ASP C . 7059 1 431 . 1 1 40 40 ASP CA C 13 53.951 0.35 . 1 . . . . 40 ASP CA . 7059 1 432 . 1 1 40 40 ASP CB C 13 40.419 0.35 . 1 . . . . 40 ASP CB . 7059 1 433 . 1 1 40 40 ASP N N 15 117.147 0.2 . 1 . . . . 40 ASP N . 7059 1 434 . 1 1 41 41 TYR H H 1 7.884 0.02 . 1 . . . . 41 TYR H . 7059 1 435 . 1 1 41 41 TYR HA H 1 4.538 0.02 . 1 . . . . 41 TYR HA . 7059 1 436 . 1 1 41 41 TYR HB2 H 1 3.038 0.02 . 2 . . . . 41 TYR HB2 . 7059 1 437 . 1 1 41 41 TYR HB3 H 1 2.592 0.02 . 2 . . . . 41 TYR HB3 . 7059 1 438 . 1 1 41 41 TYR HD1 H 1 6.778 0.02 . 1 . . . . 41 TYR HD . 7059 1 439 . 1 1 41 41 TYR HD2 H 1 6.778 0.02 . 1 . . . . 41 TYR HD . 7059 1 440 . 1 1 41 41 TYR C C 13 175.889 0.35 . 1 . . . . 41 TYR C . 7059 1 441 . 1 1 41 41 TYR CA C 13 58.102 0.35 . 1 . . . . 41 TYR CA . 7059 1 442 . 1 1 41 41 TYR CB C 13 39.417 0.35 . 1 . . . . 41 TYR CB . 7059 1 443 . 1 1 41 41 TYR N N 15 116.997 0.2 . 1 . . . . 41 TYR N . 7059 1 444 . 1 1 42 42 HIS H H 1 8.735 0.02 . 1 . . . . 42 HIS H . 7059 1 445 . 1 1 42 42 HIS HA H 1 4.254 0.02 . 1 . . . . 42 HIS HA . 7059 1 446 . 1 1 42 42 HIS HB2 H 1 2.957 0.02 . 1 . . . . 42 HIS HB2 . 7059 1 447 . 1 1 42 42 HIS HB3 H 1 2.957 0.02 . 1 . . . . 42 HIS HB3 . 7059 1 448 . 1 1 42 42 HIS C C 13 175.467 0.35 . 1 . . . . 42 HIS C . 7059 1 449 . 1 1 42 42 HIS CA C 13 59.242 0.35 . 1 . . . . 42 HIS CA . 7059 1 450 . 1 1 42 42 HIS CB C 13 31.612 0.35 . 1 . . . . 42 HIS CB . 7059 1 451 . 1 1 42 42 HIS N N 15 121.390 0.2 . 1 . . . . 42 HIS N . 7059 1 452 . 1 1 43 43 HIS H H 1 7.517 0.02 . 1 . . . . 43 HIS H . 7059 1 453 . 1 1 43 43 HIS HA H 1 5.620 0.02 . 1 . . . . 43 HIS HA . 7059 1 454 . 1 1 43 43 HIS HB2 H 1 3.413 0.02 . 2 . . . . 43 HIS HB2 . 7059 1 455 . 1 1 43 43 HIS HB3 H 1 2.606 0.02 . 2 . . . . 43 HIS HB3 . 7059 1 456 . 1 1 43 43 HIS C C 13 173.656 0.35 . 1 . . . . 43 HIS C . 7059 1 457 . 1 1 43 43 HIS CA C 13 54.625 0.35 . 1 . . . . 43 HIS CA . 7059 1 458 . 1 1 43 43 HIS CB C 13 34.220 0.35 . 1 . . . . 43 HIS CB . 7059 1 459 . 1 1 43 43 HIS N N 15 110.161 0.2 . 1 . . . . 43 HIS N . 7059 1 460 . 1 1 44 44 VAL H H 1 8.282 0.02 . 1 . . . . 44 VAL H . 7059 1 461 . 1 1 44 44 VAL HA H 1 4.681 0.02 . 1 . . . . 44 VAL HA . 7059 1 462 . 1 1 44 44 VAL HB H 1 2.345 0.02 . 1 . . . . 44 VAL HB . 7059 1 463 . 1 1 44 44 VAL HG11 H 1 0.743 0.02 . 2 . . . . 44 VAL HG1 . 7059 1 464 . 1 1 44 44 VAL HG12 H 1 0.743 0.02 . 2 . . . . 44 VAL HG1 . 7059 1 465 . 1 1 44 44 VAL HG13 H 1 0.743 0.02 . 2 . . . . 44 VAL HG1 . 7059 1 466 . 1 1 44 44 VAL HG21 H 1 0.851 0.02 . 2 . . . . 44 VAL HG2 . 7059 1 467 . 1 1 44 44 VAL HG22 H 1 0.851 0.02 . 2 . . . . 44 VAL HG2 . 7059 1 468 . 1 1 44 44 VAL HG23 H 1 0.851 0.02 . 2 . . . . 44 VAL HG2 . 7059 1 469 . 1 1 44 44 VAL C C 13 174.537 0.35 . 1 . . . . 44 VAL C . 7059 1 470 . 1 1 44 44 VAL CA C 13 62.148 0.35 . 1 . . . . 44 VAL CA . 7059 1 471 . 1 1 44 44 VAL CB C 13 33.173 0.35 . 1 . . . . 44 VAL CB . 7059 1 472 . 1 1 44 44 VAL CG1 C 13 19.400 0.35 . 2 . . . . 44 VAL CG1 . 7059 1 473 . 1 1 44 44 VAL CG2 C 13 22.411 0.35 . 2 . . . . 44 VAL CG2 . 7059 1 474 . 1 1 44 44 VAL N N 15 122.939 0.2 . 1 . . . . 44 VAL N . 7059 1 475 . 1 1 45 45 VAL H H 1 9.080 0.02 . 1 . . . . 45 VAL H . 7059 1 476 . 1 1 45 45 VAL HA H 1 5.063 0.02 . 1 . . . . 45 VAL HA . 7059 1 477 . 1 1 45 45 VAL HB H 1 2.109 0.02 . 1 . . . . 45 VAL HB . 7059 1 478 . 1 1 45 45 VAL HG11 H 1 0.241 0.02 . 2 . . . . 45 VAL HG1 . 7059 1 479 . 1 1 45 45 VAL HG12 H 1 0.241 0.02 . 2 . . . . 45 VAL HG1 . 7059 1 480 . 1 1 45 45 VAL HG13 H 1 0.241 0.02 . 2 . . . . 45 VAL HG1 . 7059 1 481 . 1 1 45 45 VAL HG21 H 1 0.429 0.02 . 2 . . . . 45 VAL HG2 . 7059 1 482 . 1 1 45 45 VAL HG22 H 1 0.429 0.02 . 2 . . . . 45 VAL HG2 . 7059 1 483 . 1 1 45 45 VAL HG23 H 1 0.429 0.02 . 2 . . . . 45 VAL HG2 . 7059 1 484 . 1 1 45 45 VAL C C 13 173.080 0.35 . 1 . . . . 45 VAL C . 7059 1 485 . 1 1 45 45 VAL CA C 13 58.184 0.35 . 1 . . . . 45 VAL CA . 7059 1 486 . 1 1 45 45 VAL CB C 13 34.933 0.35 . 1 . . . . 45 VAL CB . 7059 1 487 . 1 1 45 45 VAL CG1 C 13 22.268 0.35 . 1 . . . . 45 VAL CG1 . 7059 1 488 . 1 1 45 45 VAL CG2 C 13 22.268 0.35 . 1 . . . . 45 VAL CG2 . 7059 1 489 . 1 1 45 45 VAL N N 15 117.979 0.2 . 1 . . . . 45 VAL N . 7059 1 490 . 1 1 46 46 ALA H H 1 8.159 0.02 . 1 . . . . 46 ALA H . 7059 1 491 . 1 1 46 46 ALA HA H 1 5.600 0.02 . 1 . . . . 46 ALA HA . 7059 1 492 . 1 1 46 46 ALA HB1 H 1 1.514 0.02 . 1 . . . . 46 ALA HB . 7059 1 493 . 1 1 46 46 ALA HB2 H 1 1.514 0.02 . 1 . . . . 46 ALA HB . 7059 1 494 . 1 1 46 46 ALA HB3 H 1 1.514 0.02 . 1 . . . . 46 ALA HB . 7059 1 495 . 1 1 46 46 ALA C C 13 176.316 0.35 . 1 . . . . 46 ALA C . 7059 1 496 . 1 1 46 46 ALA CA C 13 49.645 0.35 . 1 . . . . 46 ALA CA . 7059 1 497 . 1 1 46 46 ALA CB C 13 24.311 0.35 . 1 . . . . 46 ALA CB . 7059 1 498 . 1 1 46 46 ALA N N 15 119.424 0.2 . 1 . . . . 46 ALA N . 7059 1 499 . 1 1 47 47 THR H H 1 8.634 0.02 . 1 . . . . 47 THR H . 7059 1 500 . 1 1 47 47 THR HA H 1 5.301 0.02 . 1 . . . . 47 THR HA . 7059 1 501 . 1 1 47 47 THR HB H 1 4.950 0.02 . 1 . . . . 47 THR HB . 7059 1 502 . 1 1 47 47 THR HG21 H 1 0.704 0.02 . 1 . . . . 47 THR HG2 . 7059 1 503 . 1 1 47 47 THR HG22 H 1 0.704 0.02 . 1 . . . . 47 THR HG2 . 7059 1 504 . 1 1 47 47 THR HG23 H 1 0.704 0.02 . 1 . . . . 47 THR HG2 . 7059 1 505 . 1 1 47 47 THR C C 13 173.465 0.35 . 1 . . . . 47 THR C . 7059 1 506 . 1 1 47 47 THR CA C 13 59.720 0.35 . 1 . . . . 47 THR CA . 7059 1 507 . 1 1 47 47 THR CB C 13 70.383 0.35 . 1 . . . . 47 THR CB . 7059 1 508 . 1 1 47 47 THR CG2 C 13 23.916 0.35 . 1 . . . . 47 THR CG2 . 7059 1 509 . 1 1 47 47 THR N N 15 109.449 0.2 . 1 . . . . 47 THR N . 7059 1 510 . 1 1 48 48 LYS H H 1 8.339 0.02 . 1 . . . . 48 LYS H . 7059 1 511 . 1 1 48 48 LYS HA H 1 4.204 0.02 . 1 . . . . 48 LYS HA . 7059 1 512 . 1 1 48 48 LYS HB2 H 1 1.869 0.02 . 1 . . . . 48 LYS HB2 . 7059 1 513 . 1 1 48 48 LYS HB3 H 1 1.869 0.02 . 1 . . . . 48 LYS HB3 . 7059 1 514 . 1 1 48 48 LYS HG2 H 1 1.597 0.02 . 1 . . . . 48 LYS HG2 . 7059 1 515 . 1 1 48 48 LYS HG3 H 1 1.597 0.02 . 1 . . . . 48 LYS HG3 . 7059 1 516 . 1 1 48 48 LYS HD2 H 1 1.816 0.02 . 1 . . . . 48 LYS HD2 . 7059 1 517 . 1 1 48 48 LYS HD3 H 1 1.816 0.02 . 1 . . . . 48 LYS HD3 . 7059 1 518 . 1 1 48 48 LYS HE2 H 1 3.132 0.02 . 1 . . . . 48 LYS HE2 . 7059 1 519 . 1 1 48 48 LYS HE3 H 1 3.132 0.02 . 1 . . . . 48 LYS HE3 . 7059 1 520 . 1 1 48 48 LYS C C 13 176.608 0.35 . 1 . . . . 48 LYS C . 7059 1 521 . 1 1 48 48 LYS CA C 13 57.695 0.35 . 1 . . . . 48 LYS CA . 7059 1 522 . 1 1 48 48 LYS CB C 13 35.149 0.35 . 1 . . . . 48 LYS CB . 7059 1 523 . 1 1 48 48 LYS CG C 13 25.637 0.35 . 1 . . . . 48 LYS CG . 7059 1 524 . 1 1 48 48 LYS CD C 13 30.869 0.35 . 1 . . . . 48 LYS CD . 7059 1 525 . 1 1 48 48 LYS CE C 13 42.625 0.35 . 1 . . . . 48 LYS CE . 7059 1 526 . 1 1 48 48 LYS N N 15 119.582 0.2 . 1 . . . . 48 LYS N . 7059 1 527 . 1 1 49 49 ASP H H 1 7.576 0.02 . 1 . . . . 49 ASP H . 7059 1 528 . 1 1 49 49 ASP HA H 1 4.550 0.02 . 1 . . . . 49 ASP HA . 7059 1 529 . 1 1 49 49 ASP HB2 H 1 2.581 0.02 . 1 . . . . 49 ASP HB2 . 7059 1 530 . 1 1 49 49 ASP HB3 H 1 2.581 0.02 . 1 . . . . 49 ASP HB3 . 7059 1 531 . 1 1 49 49 ASP C C 13 175.535 0.35 . 1 . . . . 49 ASP C . 7059 1 532 . 1 1 49 49 ASP CA C 13 53.804 0.35 . 1 . . . . 49 ASP CA . 7059 1 533 . 1 1 49 49 ASP CB C 13 40.418 0.35 . 1 . . . . 49 ASP CB . 7059 1 534 . 1 1 49 49 ASP N N 15 117.321 0.2 . 1 . . . . 49 ASP N . 7059 1 535 . 1 1 50 50 PHE H H 1 7.962 0.02 . 1 . . . . 50 PHE H . 7059 1 536 . 1 1 50 50 PHE HA H 1 4.569 0.02 . 1 . . . . 50 PHE HA . 7059 1 537 . 1 1 50 50 PHE HB2 H 1 3.105 0.02 . 1 . . . . 50 PHE HB2 . 7059 1 538 . 1 1 50 50 PHE HB3 H 1 3.105 0.02 . 1 . . . . 50 PHE HB3 . 7059 1 539 . 1 1 50 50 PHE C C 13 176.256 0.35 . 1 . . . . 50 PHE C . 7059 1 540 . 1 1 50 50 PHE CA C 13 54.546 0.35 . 1 . . . . 50 PHE CA . 7059 1 541 . 1 1 50 50 PHE CB C 13 41.751 0.35 . 1 . . . . 50 PHE CB . 7059 1 542 . 1 1 50 50 PHE N N 15 119.928 0.2 . 1 . . . . 50 PHE N . 7059 1 543 . 1 1 51 51 HIS H H 1 8.008 0.02 . 1 . . . . 51 HIS H . 7059 1 544 . 1 1 51 51 HIS HA H 1 4.431 0.02 . 1 . . . . 51 HIS HA . 7059 1 545 . 1 1 51 51 HIS HB2 H 1 1.364 0.02 . 1 . . . . 51 HIS HB2 . 7059 1 546 . 1 1 51 51 HIS HB3 H 1 1.364 0.02 . 1 . . . . 51 HIS HB3 . 7059 1 547 . 1 1 51 51 HIS C C 13 176.551 0.35 . 1 . . . . 51 HIS C . 7059 1 548 . 1 1 51 51 HIS CA C 13 51.929 0.35 . 1 . . . . 51 HIS CA . 7059 1 549 . 1 1 51 51 HIS CB C 13 18.745 0.35 . 1 . . . . 51 HIS CB . 7059 1 550 . 1 1 51 51 HIS N N 15 125.653 0.2 . 1 . . . . 51 HIS N . 7059 1 551 . 1 1 52 52 ILE H H 1 7.075 0.02 . 1 . . . . 52 ILE H . 7059 1 552 . 1 1 52 52 ILE HA H 1 4.703 0.02 . 1 . . . . 52 ILE HA . 7059 1 553 . 1 1 52 52 ILE HB H 1 2.094 0.02 . 1 . . . . 52 ILE HB . 7059 1 554 . 1 1 52 52 ILE HG12 H 1 1.144 0.02 . 2 . . . . 52 ILE HG12 . 7059 1 555 . 1 1 52 52 ILE HG13 H 1 1.086 0.02 . 2 . . . . 52 ILE HG13 . 7059 1 556 . 1 1 52 52 ILE HG21 H 1 0.742 0.02 . 1 . . . . 52 ILE HG2 . 7059 1 557 . 1 1 52 52 ILE HG22 H 1 0.742 0.02 . 1 . . . . 52 ILE HG2 . 7059 1 558 . 1 1 52 52 ILE HG23 H 1 0.742 0.02 . 1 . . . . 52 ILE HG2 . 7059 1 559 . 1 1 52 52 ILE HD11 H 1 0.873 0.02 . 1 . . . . 52 ILE HD1 . 7059 1 560 . 1 1 52 52 ILE HD12 H 1 0.873 0.02 . 1 . . . . 52 ILE HD1 . 7059 1 561 . 1 1 52 52 ILE HD13 H 1 0.873 0.02 . 1 . . . . 52 ILE HD1 . 7059 1 562 . 1 1 52 52 ILE C C 13 177.109 0.35 . 1 . . . . 52 ILE C . 7059 1 563 . 1 1 52 52 ILE CA C 13 63.833 0.35 . 1 . . . . 52 ILE CA . 7059 1 564 . 1 1 52 52 ILE CB C 13 37.224 0.35 . 1 . . . . 52 ILE CB . 7059 1 565 . 1 1 52 52 ILE CG1 C 13 31.787 0.35 . 1 . . . . 52 ILE CG1 . 7059 1 566 . 1 1 52 52 ILE CG2 C 13 27.121 0.35 . 1 . . . . 52 ILE CG2 . 7059 1 567 . 1 1 52 52 ILE CD1 C 13 29.595 0.35 . 1 . . . . 52 ILE CD1 . 7059 1 568 . 1 1 52 52 ILE N N 15 116.814 0.2 . 1 . . . . 52 ILE N . 7059 1 569 . 1 1 53 53 ASP H H 1 7.235 0.02 . 1 . . . . 53 ASP H . 7059 1 570 . 1 1 53 53 ASP HA H 1 4.692 0.02 . 1 . . . . 53 ASP HA . 7059 1 571 . 1 1 53 53 ASP HB2 H 1 3.028 0.02 . 1 . . . . 53 ASP HB2 . 7059 1 572 . 1 1 53 53 ASP HB3 H 1 3.028 0.02 . 1 . . . . 53 ASP HB3 . 7059 1 573 . 1 1 53 53 ASP C C 13 173.569 0.35 . 1 . . . . 53 ASP C . 7059 1 574 . 1 1 53 53 ASP CA C 13 51.543 0.35 . 1 . . . . 53 ASP CA . 7059 1 575 . 1 1 53 53 ASP CB C 13 40.272 0.35 . 1 . . . . 53 ASP CB . 7059 1 576 . 1 1 53 53 ASP N N 15 111.228 0.2 . 1 . . . . 53 ASP N . 7059 1 577 . 1 1 54 54 PRO HA H 1 4.296 0.02 . 1 . . . . 54 PRO HA . 7059 1 578 . 1 1 54 54 PRO HB2 H 1 2.859 0.02 . 2 . . . . 54 PRO HB2 . 7059 1 579 . 1 1 54 54 PRO HB3 H 1 1.714 0.02 . 2 . . . . 54 PRO HB3 . 7059 1 580 . 1 1 54 54 PRO C C 13 175.486 0.35 . 1 . . . . 54 PRO C . 7059 1 581 . 1 1 54 54 PRO CA C 13 61.899 0.35 . 1 . . . . 54 PRO CA . 7059 1 582 . 1 1 54 54 PRO CB C 13 29.395 0.35 . 1 . . . . 54 PRO CB . 7059 1 583 . 1 1 54 54 PRO CG C 13 22.913 0.35 . 1 . . . . 54 PRO CG . 7059 1 584 . 1 1 54 54 PRO CD C 13 47.786 0.35 . 1 . . . . 54 PRO CD . 7059 1 585 . 1 1 55 55 GLY H H 1 7.702 0.02 . 1 . . . . 55 GLY H . 7059 1 586 . 1 1 55 55 GLY HA2 H 1 4.251 0.02 . 2 . . . . 55 GLY HA2 . 7059 1 587 . 1 1 55 55 GLY HA3 H 1 3.853 0.02 . 2 . . . . 55 GLY HA3 . 7059 1 588 . 1 1 55 55 GLY C C 13 176.065 0.35 . 1 . . . . 55 GLY C . 7059 1 589 . 1 1 55 55 GLY CA C 13 47.171 0.35 . 1 . . . . 55 GLY CA . 7059 1 590 . 1 1 55 55 GLY N N 15 111.122 0.2 . 1 . . . . 55 GLY N . 7059 1 591 . 1 1 56 56 ASP H H 1 8.666 0.02 . 1 . . . . 56 ASP H . 7059 1 592 . 1 1 56 56 ASP HA H 1 4.502 0.02 . 1 . . . . 56 ASP HA . 7059 1 593 . 1 1 56 56 ASP HB2 H 1 2.803 0.02 . 1 . . . . 56 ASP HB2 . 7059 1 594 . 1 1 56 56 ASP HB3 H 1 2.803 0.02 . 1 . . . . 56 ASP HB3 . 7059 1 595 . 1 1 56 56 ASP C C 13 176.816 0.35 . 1 . . . . 56 ASP C . 7059 1 596 . 1 1 56 56 ASP CA C 13 56.007 0.35 . 1 . . . . 56 ASP CA . 7059 1 597 . 1 1 56 56 ASP CB C 13 39.473 0.35 . 1 . . . . 56 ASP CB . 7059 1 598 . 1 1 56 56 ASP N N 15 125.606 0.2 . 1 . . . . 56 ASP N . 7059 1 599 . 1 1 57 57 HIS H H 1 7.181 0.02 . 1 . . . . 57 HIS H . 7059 1 600 . 1 1 57 57 HIS HA H 1 4.751 0.02 . 1 . . . . 57 HIS HA . 7059 1 601 . 1 1 57 57 HIS HB2 H 1 1.646 0.02 . 1 . . . . 57 HIS HB2 . 7059 1 602 . 1 1 57 57 HIS HB3 H 1 1.646 0.02 . 1 . . . . 57 HIS HB3 . 7059 1 603 . 1 1 57 57 HIS C C 13 175.328 0.35 . 1 . . . . 57 HIS C . 7059 1 604 . 1 1 57 57 HIS CA C 13 55.706 0.35 . 1 . . . . 57 HIS CA . 7059 1 605 . 1 1 57 57 HIS CB C 13 34.710 0.35 . 1 . . . . 57 HIS CB . 7059 1 606 . 1 1 57 57 HIS N N 15 125.983 0.2 . 1 . . . . 57 HIS N . 7059 1 607 . 1 1 58 58 PHE H H 1 7.714 0.02 . 1 . . . . 58 PHE H . 7059 1 608 . 1 1 58 58 PHE HA H 1 3.851 0.02 . 1 . . . . 58 PHE HA . 7059 1 609 . 1 1 58 58 PHE HB2 H 1 2.483 0.02 . 1 . . . . 58 PHE HB2 . 7059 1 610 . 1 1 58 58 PHE HB3 H 1 2.483 0.02 . 1 . . . . 58 PHE HB3 . 7059 1 611 . 1 1 58 58 PHE C C 13 176.135 0.35 . 1 . . . . 58 PHE C . 7059 1 612 . 1 1 58 58 PHE CA C 13 50.547 0.35 . 1 . . . . 58 PHE CA . 7059 1 613 . 1 1 58 58 PHE CB C 13 39.181 0.35 . 1 . . . . 58 PHE CB . 7059 1 614 . 1 1 58 58 PHE N N 15 112.614 0.2 . 1 . . . . 58 PHE N . 7059 1 615 . 1 1 59 59 SER H H 1 8.074 0.02 . 1 . . . . 59 SER H . 7059 1 616 . 1 1 59 59 SER HA H 1 4.107 0.02 . 1 . . . . 59 SER HA . 7059 1 617 . 1 1 59 59 SER HB2 H 1 3.894 0.02 . 1 . . . . 59 SER HB2 . 7059 1 618 . 1 1 59 59 SER HB3 H 1 3.894 0.02 . 1 . . . . 59 SER HB3 . 7059 1 619 . 1 1 59 59 SER C C 13 174.515 0.35 . 1 . . . . 59 SER C . 7059 1 620 . 1 1 59 59 SER CA C 13 56.370 0.35 . 1 . . . . 59 SER CA . 7059 1 621 . 1 1 59 59 SER CB C 13 65.175 0.35 . 1 . . . . 59 SER CB . 7059 1 622 . 1 1 59 59 SER N N 15 111.209 0.2 . 1 . . . . 59 SER N . 7059 1 623 . 1 1 60 60 GLY H H 1 8.568 0.02 . 1 . . . . 60 GLY H . 7059 1 624 . 1 1 60 60 GLY HA2 H 1 4.210 0.02 . 2 . . . . 60 GLY HA2 . 7059 1 625 . 1 1 60 60 GLY HA3 H 1 3.813 0.02 . 2 . . . . 60 GLY HA3 . 7059 1 626 . 1 1 60 60 GLY C C 13 174.789 0.35 . 1 . . . . 60 GLY C . 7059 1 627 . 1 1 60 60 GLY CA C 13 45.375 0.35 . 1 . . . . 60 GLY CA . 7059 1 628 . 1 1 60 60 GLY N N 15 112.430 0.2 . 1 . . . . 60 GLY N . 7059 1 629 . 1 1 61 61 THR H H 1 8.625 0.02 . 1 . . . . 61 THR H . 7059 1 630 . 1 1 61 61 THR HA H 1 4.453 0.02 . 1 . . . . 61 THR HA . 7059 1 631 . 1 1 61 61 THR HB H 1 4.148 0.02 . 1 . . . . 61 THR HB . 7059 1 632 . 1 1 61 61 THR HG21 H 1 1.043 0.02 . 1 . . . . 61 THR HG2 . 7059 1 633 . 1 1 61 61 THR HG22 H 1 1.043 0.02 . 1 . . . . 61 THR HG2 . 7059 1 634 . 1 1 61 61 THR HG23 H 1 1.043 0.02 . 1 . . . . 61 THR HG2 . 7059 1 635 . 1 1 61 61 THR C C 13 172.337 0.35 . 1 . . . . 61 THR C . 7059 1 636 . 1 1 61 61 THR CA C 13 57.327 0.35 . 1 . . . . 61 THR CA . 7059 1 637 . 1 1 61 61 THR CB C 13 68.899 0.35 . 1 . . . . 61 THR CB . 7059 1 638 . 1 1 61 61 THR N N 15 113.236 0.2 . 1 . . . . 61 THR N . 7059 1 639 . 1 1 62 62 PRO HA H 1 4.382 0.02 . 1 . . . . 62 PRO HA . 7059 1 640 . 1 1 62 62 PRO HB2 H 1 2.730 0.02 . 1 . . . . 62 PRO HB2 . 7059 1 641 . 1 1 62 62 PRO HB3 H 1 2.730 0.02 . 1 . . . . 62 PRO HB3 . 7059 1 642 . 1 1 62 62 PRO HG2 H 1 2.239 0.02 . 2 . . . . 62 PRO HG2 . 7059 1 643 . 1 1 62 62 PRO HG3 H 1 1.922 0.02 . 2 . . . . 62 PRO HG3 . 7059 1 644 . 1 1 62 62 PRO HD2 H 1 3.612 0.02 . 2 . . . . 62 PRO HD2 . 7059 1 645 . 1 1 62 62 PRO HD3 H 1 3.436 0.02 . 2 . . . . 62 PRO HD3 . 7059 1 646 . 1 1 62 62 PRO C C 13 175.982 0.35 . 1 . . . . 62 PRO C . 7059 1 647 . 1 1 62 62 PRO CA C 13 61.681 0.35 . 1 . . . . 62 PRO CA . 7059 1 648 . 1 1 62 62 PRO CB C 13 30.828 0.35 . 1 . . . . 62 PRO CB . 7059 1 649 . 1 1 62 62 PRO CG C 13 25.676 0.35 . 1 . . . . 62 PRO CG . 7059 1 650 . 1 1 62 62 PRO CD C 13 49.322 0.35 . 1 . . . . 62 PRO CD . 7059 1 651 . 1 1 63 63 ASP H H 1 7.551 0.02 . 1 . . . . 63 ASP H . 7059 1 652 . 1 1 63 63 ASP HA H 1 4.606 0.02 . 1 . . . . 63 ASP HA . 7059 1 653 . 1 1 63 63 ASP HB2 H 1 2.205 0.02 . 2 . . . . 63 ASP HB2 . 7059 1 654 . 1 1 63 63 ASP HB3 H 1 2.910 0.02 . 2 . . . . 63 ASP HB3 . 7059 1 655 . 1 1 63 63 ASP C C 13 177.488 0.35 . 1 . . . . 63 ASP C . 7059 1 656 . 1 1 63 63 ASP CA C 13 52.186 0.35 . 1 . . . . 63 ASP CA . 7059 1 657 . 1 1 63 63 ASP CB C 13 40.425 0.35 . 1 . . . . 63 ASP CB . 7059 1 658 . 1 1 63 63 ASP N N 15 117.253 0.2 . 1 . . . . 63 ASP N . 7059 1 659 . 1 1 64 64 TYR H H 1 7.810 0.02 . 1 . . . . 64 TYR H . 7059 1 660 . 1 1 64 64 TYR HA H 1 4.601 0.02 . 1 . . . . 64 TYR HA . 7059 1 661 . 1 1 64 64 TYR HB2 H 1 3.748 0.02 . 1 . . . . 64 TYR HB2 . 7059 1 662 . 1 1 64 64 TYR HB3 H 1 3.748 0.02 . 1 . . . . 64 TYR HB3 . 7059 1 663 . 1 1 64 64 TYR HD1 H 1 6.996 0.02 . 1 . . . . 64 TYR HD . 7059 1 664 . 1 1 64 64 TYR HD2 H 1 6.996 0.02 . 1 . . . . 64 TYR HD . 7059 1 665 . 1 1 64 64 TYR C C 13 173.576 0.35 . 1 . . . . 64 TYR C . 7059 1 666 . 1 1 64 64 TYR CA C 13 59.062 0.35 . 1 . . . . 64 TYR CA . 7059 1 667 . 1 1 64 64 TYR CB C 13 33.361 0.35 . 1 . . . . 64 TYR CB . 7059 1 668 . 1 1 64 64 TYR N N 15 115.150 0.2 . 1 . . . . 64 TYR N . 7059 1 669 . 1 1 65 65 SER H H 1 7.475 0.02 . 1 . . . . 65 SER H . 7059 1 670 . 1 1 65 65 SER HA H 1 5.069 0.02 . 1 . . . . 65 SER HA . 7059 1 671 . 1 1 65 65 SER HB2 H 1 3.572 0.02 . 1 . . . . 65 SER HB2 . 7059 1 672 . 1 1 65 65 SER HB3 H 1 3.572 0.02 . 1 . . . . 65 SER HB3 . 7059 1 673 . 1 1 65 65 SER C C 13 173.958 0.35 . 1 . . . . 65 SER C . 7059 1 674 . 1 1 65 65 SER CA C 13 60.269 0.35 . 1 . . . . 65 SER CA . 7059 1 675 . 1 1 65 65 SER CB C 13 63.526 0.35 . 1 . . . . 65 SER CB . 7059 1 676 . 1 1 65 65 SER N N 15 109.962 0.2 . 1 . . . . 65 SER N . 7059 1 677 . 1 1 66 66 SER H H 1 9.742 0.02 . 1 . . . . 66 SER H . 7059 1 678 . 1 1 66 66 SER HA H 1 4.977 0.02 . 1 . . . . 66 SER HA . 7059 1 679 . 1 1 66 66 SER HB2 H 1 3.906 0.02 . 1 . . . . 66 SER HB2 . 7059 1 680 . 1 1 66 66 SER HB3 H 1 3.906 0.02 . 1 . . . . 66 SER HB3 . 7059 1 681 . 1 1 66 66 SER C C 13 173.656 0.35 . 1 . . . . 66 SER C . 7059 1 682 . 1 1 66 66 SER CA C 13 59.341 0.35 . 1 . . . . 66 SER CA . 7059 1 683 . 1 1 66 66 SER CB C 13 65.206 0.35 . 1 . . . . 66 SER CB . 7059 1 684 . 1 1 66 66 SER N N 15 118.022 0.2 . 1 . . . . 66 SER N . 7059 1 685 . 1 1 67 67 SER H H 1 8.506 0.02 . 1 . . . . 67 SER H . 7059 1 686 . 1 1 67 67 SER HA H 1 4.700 0.02 . 1 . . . . 67 SER HA . 7059 1 687 . 1 1 67 67 SER HB2 H 1 3.414 0.02 . 1 . . . . 67 SER HB2 . 7059 1 688 . 1 1 67 67 SER HB3 H 1 3.414 0.02 . 1 . . . . 67 SER HB3 . 7059 1 689 . 1 1 67 67 SER C C 13 172.594 0.35 . 1 . . . . 67 SER C . 7059 1 690 . 1 1 67 67 SER CA C 13 56.286 0.35 . 1 . . . . 67 SER CA . 7059 1 691 . 1 1 67 67 SER CB C 13 67.093 0.35 . 1 . . . . 67 SER CB . 7059 1 692 . 1 1 67 67 SER N N 15 120.059 0.2 . 1 . . . . 67 SER N . 7059 1 693 . 1 1 68 68 TRP H H 1 10.337 0.02 . 1 . . . . 68 TRP H . 7059 1 694 . 1 1 68 68 TRP HA H 1 4.691 0.02 . 1 . . . . 68 TRP HA . 7059 1 695 . 1 1 68 68 TRP HD1 H 1 7.291 0.02 . 1 . . . . 68 TRP HD1 . 7059 1 696 . 1 1 68 68 TRP HE3 H 1 6.871 0.02 . 1 . . . . 68 TRP HE3 . 7059 1 697 . 1 1 68 68 TRP N N 15 132.112 0.2 . 1 . . . . 68 TRP N . 7059 1 698 . 1 1 70 70 PRO HA H 1 4.141 0.02 . 1 . . . . 70 PRO HA . 7059 1 699 . 1 1 70 70 PRO HB2 H 1 2.082 0.02 . 1 . . . . 70 PRO HB2 . 7059 1 700 . 1 1 70 70 PRO HB3 H 1 2.082 0.02 . 1 . . . . 70 PRO HB3 . 7059 1 701 . 1 1 70 70 PRO HG2 H 1 2.151 0.02 . 1 . . . . 70 PRO HG2 . 7059 1 702 . 1 1 70 70 PRO HG3 H 1 2.151 0.02 . 1 . . . . 70 PRO HG3 . 7059 1 703 . 1 1 70 70 PRO HD2 H 1 3.471 0.02 . 2 . . . . 70 PRO HD2 . 7059 1 704 . 1 1 70 70 PRO HD3 H 1 2.943 0.02 . 2 . . . . 70 PRO HD3 . 7059 1 705 . 1 1 70 70 PRO C C 13 176.226 0.35 . 1 . . . . 70 PRO C . 7059 1 706 . 1 1 70 70 PRO CA C 13 62.492 0.35 . 1 . . . . 70 PRO CA . 7059 1 707 . 1 1 70 70 PRO CB C 13 31.874 0.35 . 1 . . . . 70 PRO CB . 7059 1 708 . 1 1 70 70 PRO CG C 13 25.708 0.35 . 1 . . . . 70 PRO CG . 7059 1 709 . 1 1 70 70 PRO CD C 13 50.513 0.35 . 1 . . . . 70 PRO CD . 7059 1 710 . 1 1 71 71 HIS H H 1 8.091 0.02 . 1 . . . . 71 HIS H . 7059 1 711 . 1 1 71 71 HIS HA H 1 4.613 0.02 . 1 . . . . 71 HIS HA . 7059 1 712 . 1 1 71 71 HIS HB2 H 1 3.127 0.02 . 1 . . . . 71 HIS HB2 . 7059 1 713 . 1 1 71 71 HIS HB3 H 1 3.127 0.02 . 1 . . . . 71 HIS HB3 . 7059 1 714 . 1 1 71 71 HIS C C 13 174.021 0.35 . 1 . . . . 71 HIS C . 7059 1 715 . 1 1 71 71 HIS CA C 13 55.887 0.35 . 1 . . . . 71 HIS CA . 7059 1 716 . 1 1 71 71 HIS CB C 13 29.724 0.35 . 1 . . . . 71 HIS CB . 7059 1 717 . 1 1 71 71 HIS N N 15 122.626 0.2 . 1 . . . . 71 HIS N . 7059 1 718 . 1 1 72 72 CYS H H 1 8.036 0.02 . 1 . . . . 72 CYS H . 7059 1 719 . 1 1 72 72 CYS HA H 1 4.307 0.02 . 1 . . . . 72 CYS HA . 7059 1 720 . 1 1 72 72 CYS HB2 H 1 2.623 0.02 . 1 . . . . 72 CYS HB2 . 7059 1 721 . 1 1 72 72 CYS HB3 H 1 2.623 0.02 . 1 . . . . 72 CYS HB3 . 7059 1 722 . 1 1 72 72 CYS C C 13 179.268 0.35 . 1 . . . . 72 CYS C . 7059 1 723 . 1 1 72 72 CYS CA C 13 57.057 0.35 . 1 . . . . 72 CYS CA . 7059 1 724 . 1 1 72 72 CYS CB C 13 27.752 0.35 . 1 . . . . 72 CYS CB . 7059 1 725 . 1 1 72 72 CYS N N 15 125.147 0.2 . 1 . . . . 72 CYS N . 7059 1 726 . 1 1 73 73 VAL H H 1 8.247 0.02 . 1 . . . . 73 VAL H . 7059 1 727 . 1 1 73 73 VAL HA H 1 4.485 0.02 . 1 . . . . 73 VAL HA . 7059 1 728 . 1 1 73 73 VAL HB H 1 2.066 0.02 . 1 . . . . 73 VAL HB . 7059 1 729 . 1 1 73 73 VAL HG11 H 1 0.657 0.02 . 2 . . . . 73 VAL HG1 . 7059 1 730 . 1 1 73 73 VAL HG12 H 1 0.657 0.02 . 2 . . . . 73 VAL HG1 . 7059 1 731 . 1 1 73 73 VAL HG13 H 1 0.657 0.02 . 2 . . . . 73 VAL HG1 . 7059 1 732 . 1 1 73 73 VAL HG21 H 1 0.808 0.02 . 2 . . . . 73 VAL HG2 . 7059 1 733 . 1 1 73 73 VAL HG22 H 1 0.808 0.02 . 2 . . . . 73 VAL HG2 . 7059 1 734 . 1 1 73 73 VAL HG23 H 1 0.808 0.02 . 2 . . . . 73 VAL HG2 . 7059 1 735 . 1 1 73 73 VAL C C 13 177.668 0.35 . 1 . . . . 73 VAL C . 7059 1 736 . 1 1 73 73 VAL CA C 13 62.410 0.35 . 1 . . . . 73 VAL CA . 7059 1 737 . 1 1 73 73 VAL CB C 13 30.701 0.35 . 1 . . . . 73 VAL CB . 7059 1 738 . 1 1 73 73 VAL CG1 C 13 21.981 0.35 . 1 . . . . 73 VAL CG1 . 7059 1 739 . 1 1 73 73 VAL CG2 C 13 21.981 0.35 . 1 . . . . 73 VAL CG2 . 7059 1 740 . 1 1 73 73 VAL N N 15 118.241 0.2 . 1 . . . . 73 VAL N . 7059 1 741 . 1 1 74 74 SER H H 1 8.226 0.02 . 1 . . . . 74 SER H . 7059 1 742 . 1 1 74 74 SER HA H 1 4.399 0.02 . 1 . . . . 74 SER HA . 7059 1 743 . 1 1 74 74 SER HB2 H 1 3.315 0.02 . 1 . . . . 74 SER HB2 . 7059 1 744 . 1 1 74 74 SER HB3 H 1 3.315 0.02 . 1 . . . . 74 SER HB3 . 7059 1 745 . 1 1 74 74 SER C C 13 175.229 0.35 . 1 . . . . 74 SER C . 7059 1 746 . 1 1 74 74 SER CA C 13 51.796 0.35 . 1 . . . . 74 SER CA . 7059 1 747 . 1 1 74 74 SER CB C 13 62.652 0.35 . 1 . . . . 74 SER CB . 7059 1 748 . 1 1 74 74 SER N N 15 122.095 0.2 . 1 . . . . 74 SER N . 7059 1 749 . 1 1 75 75 GLY H H 1 8.436 0.02 . 1 . . . . 75 GLY H . 7059 1 750 . 1 1 75 75 GLY HA2 H 1 3.668 0.02 . 2 . . . . 75 GLY HA2 . 7059 1 751 . 1 1 75 75 GLY HA3 H 1 3.141 0.02 . 2 . . . . 75 GLY HA3 . 7059 1 752 . 1 1 75 75 GLY C C 13 174.503 0.35 . 1 . . . . 75 GLY C . 7059 1 753 . 1 1 75 75 GLY CA C 13 44.911 0.35 . 1 . . . . 75 GLY CA . 7059 1 754 . 1 1 75 75 GLY N N 15 114.366 0.2 . 1 . . . . 75 GLY N . 7059 1 755 . 1 1 76 76 THR H H 1 8.942 0.02 . 1 . . . . 76 THR H . 7059 1 756 . 1 1 76 76 THR HA H 1 4.608 0.02 . 1 . . . . 76 THR HA . 7059 1 757 . 1 1 76 76 THR HB H 1 4.341 0.02 . 1 . . . . 76 THR HB . 7059 1 758 . 1 1 76 76 THR HG21 H 1 1.567 0.02 . 1 . . . . 76 THR HG2 . 7059 1 759 . 1 1 76 76 THR HG22 H 1 1.567 0.02 . 1 . . . . 76 THR HG2 . 7059 1 760 . 1 1 76 76 THR HG23 H 1 1.567 0.02 . 1 . . . . 76 THR HG2 . 7059 1 761 . 1 1 76 76 THR C C 13 174.586 0.35 . 1 . . . . 76 THR C . 7059 1 762 . 1 1 76 76 THR CA C 13 61.067 0.35 . 1 . . . . 76 THR CA . 7059 1 763 . 1 1 76 76 THR CB C 13 68.751 0.35 . 1 . . . . 76 THR CB . 7059 1 764 . 1 1 76 76 THR N N 15 122.752 0.2 . 1 . . . . 76 THR N . 7059 1 765 . 1 1 77 77 PRO HA H 1 4.537 0.02 . 1 . . . . 77 PRO HA . 7059 1 766 . 1 1 77 77 PRO HB2 H 1 2.403 0.02 . 2 . . . . 77 PRO HB2 . 7059 1 767 . 1 1 77 77 PRO HB3 H 1 1.938 0.02 . 2 . . . . 77 PRO HB3 . 7059 1 768 . 1 1 77 77 PRO HG2 H 1 2.107 0.02 . 2 . . . . 77 PRO HG2 . 7059 1 769 . 1 1 77 77 PRO HG3 H 1 2.028 0.02 . 2 . . . . 77 PRO HG3 . 7059 1 770 . 1 1 77 77 PRO HD2 H 1 3.882 0.02 . 1 . . . . 77 PRO HD2 . 7059 1 771 . 1 1 77 77 PRO HD3 H 1 3.882 0.02 . 1 . . . . 77 PRO HD3 . 7059 1 772 . 1 1 77 77 PRO C C 13 179.677 0.35 . 1 . . . . 77 PRO C . 7059 1 773 . 1 1 77 77 PRO CA C 13 63.772 0.35 . 1 . . . . 77 PRO CA . 7059 1 774 . 1 1 77 77 PRO CB C 13 30.638 0.35 . 1 . . . . 77 PRO CB . 7059 1 775 . 1 1 77 77 PRO CG C 13 26.784 0.35 . 1 . . . . 77 PRO CG . 7059 1 776 . 1 1 77 77 PRO CD C 13 50.124 0.35 . 1 . . . . 77 PRO CD . 7059 1 777 . 1 1 78 78 GLY H H 1 8.137 0.02 . 1 . . . . 78 GLY H . 7059 1 778 . 1 1 78 78 GLY HA2 H 1 3.888 0.02 . 2 . . . . 78 GLY HA2 . 7059 1 779 . 1 1 78 78 GLY HA3 H 1 3.697 0.02 . 2 . . . . 78 GLY HA3 . 7059 1 780 . 1 1 78 78 GLY C C 13 173.929 0.35 . 1 . . . . 78 GLY C . 7059 1 781 . 1 1 78 78 GLY CA C 13 46.322 0.35 . 1 . . . . 78 GLY CA . 7059 1 782 . 1 1 78 78 GLY N N 15 106.211 0.2 . 1 . . . . 78 GLY N . 7059 1 783 . 1 1 79 79 ALA H H 1 6.993 0.02 . 1 . . . . 79 ALA H . 7059 1 784 . 1 1 79 79 ALA HA H 1 4.193 0.02 . 1 . . . . 79 ALA HA . 7059 1 785 . 1 1 79 79 ALA HB1 H 1 1.250 0.02 . 1 . . . . 79 ALA HB . 7059 1 786 . 1 1 79 79 ALA HB2 H 1 1.250 0.02 . 1 . . . . 79 ALA HB . 7059 1 787 . 1 1 79 79 ALA HB3 H 1 1.250 0.02 . 1 . . . . 79 ALA HB . 7059 1 788 . 1 1 79 79 ALA C C 13 178.472 0.35 . 1 . . . . 79 ALA C . 7059 1 789 . 1 1 79 79 ALA CA C 13 51.584 0.35 . 1 . . . . 79 ALA CA . 7059 1 790 . 1 1 79 79 ALA CB C 13 18.590 0.35 . 1 . . . . 79 ALA CB . 7059 1 791 . 1 1 79 79 ALA N N 15 115.993 0.2 . 1 . . . . 79 ALA N . 7059 1 792 . 1 1 80 80 ASP H H 1 7.574 0.02 . 1 . . . . 80 ASP H . 7059 1 793 . 1 1 80 80 ASP HA H 1 4.272 0.02 . 1 . . . . 80 ASP HA . 7059 1 794 . 1 1 80 80 ASP HB2 H 1 2.276 0.02 . 1 . . . . 80 ASP HB2 . 7059 1 795 . 1 1 80 80 ASP HB3 H 1 2.276 0.02 . 1 . . . . 80 ASP HB3 . 7059 1 796 . 1 1 80 80 ASP C C 13 176.619 0.35 . 1 . . . . 80 ASP C . 7059 1 797 . 1 1 80 80 ASP CA C 13 54.576 0.35 . 1 . . . . 80 ASP CA . 7059 1 798 . 1 1 80 80 ASP CB C 13 40.676 0.35 . 1 . . . . 80 ASP CB . 7059 1 799 . 1 1 80 80 ASP N N 15 117.556 0.2 . 1 . . . . 80 ASP N . 7059 1 800 . 1 1 81 81 PHE H H 1 8.037 0.02 . 1 . . . . 81 PHE H . 7059 1 801 . 1 1 81 81 PHE HA H 1 4.967 0.02 . 1 . . . . 81 PHE HA . 7059 1 802 . 1 1 81 81 PHE HB2 H 1 2.765 0.02 . 2 . . . . 81 PHE HB2 . 7059 1 803 . 1 1 81 81 PHE HB3 H 1 3.102 0.02 . 2 . . . . 81 PHE HB3 . 7059 1 804 . 1 1 81 81 PHE HD1 H 1 7.325 0.02 . 1 . . . . 81 PHE HD . 7059 1 805 . 1 1 81 81 PHE HD2 H 1 7.325 0.02 . 1 . . . . 81 PHE HD . 7059 1 806 . 1 1 81 81 PHE C C 13 175.790 0.35 . 1 . . . . 81 PHE C . 7059 1 807 . 1 1 81 81 PHE CA C 13 57.577 0.35 . 1 . . . . 81 PHE CA . 7059 1 808 . 1 1 81 81 PHE CB C 13 39.598 0.35 . 1 . . . . 81 PHE CB . 7059 1 809 . 1 1 81 81 PHE N N 15 116.014 0.2 . 1 . . . . 81 PHE N . 7059 1 810 . 1 1 82 82 HIS H H 1 7.762 0.02 . 1 . . . . 82 HIS H . 7059 1 811 . 1 1 82 82 HIS HA H 1 4.813 0.02 . 1 . . . . 82 HIS HA . 7059 1 812 . 1 1 82 82 HIS HB2 H 1 2.493 0.02 . 1 . . . . 82 HIS HB2 . 7059 1 813 . 1 1 82 82 HIS HB3 H 1 2.493 0.02 . 1 . . . . 82 HIS HB3 . 7059 1 814 . 1 1 82 82 HIS HD1 H 1 8.634 0.02 . 1 . . . . 82 HIS HD1 . 7059 1 815 . 1 1 82 82 HIS C C 13 177.081 0.35 . 1 . . . . 82 HIS C . 7059 1 816 . 1 1 82 82 HIS CA C 13 56.163 0.35 . 1 . . . . 82 HIS CA . 7059 1 817 . 1 1 82 82 HIS CB C 13 31.573 0.35 . 1 . . . . 82 HIS CB . 7059 1 818 . 1 1 82 82 HIS N N 15 122.445 0.2 . 1 . . . . 82 HIS N . 7059 1 819 . 1 1 83 83 PRO HA H 1 4.370 0.02 . 1 . . . . 83 PRO HA . 7059 1 820 . 1 1 83 83 PRO HB2 H 1 2.285 0.02 . 2 . . . . 83 PRO HB2 . 7059 1 821 . 1 1 83 83 PRO HB3 H 1 1.862 0.02 . 2 . . . . 83 PRO HB3 . 7059 1 822 . 1 1 83 83 PRO HG2 H 1 2.011 0.02 . 2 . . . . 83 PRO HG2 . 7059 1 823 . 1 1 83 83 PRO HG3 H 1 1.641 0.02 . 2 . . . . 83 PRO HG3 . 7059 1 824 . 1 1 83 83 PRO HD2 H 1 3.524 0.02 . 2 . . . . 83 PRO HD2 . 7059 1 825 . 1 1 83 83 PRO HD3 H 1 2.978 0.02 . 2 . . . . 83 PRO HD3 . 7059 1 826 . 1 1 83 83 PRO C C 13 178.230 0.35 . 1 . . . . 83 PRO C . 7059 1 827 . 1 1 83 83 PRO CA C 13 64.525 0.35 . 1 . . . . 83 PRO CA . 7059 1 828 . 1 1 83 83 PRO CB C 13 31.334 0.35 . 1 . . . . 83 PRO CB . 7059 1 829 . 1 1 83 83 PRO CG C 13 26.067 0.35 . 1 . . . . 83 PRO CG . 7059 1 830 . 1 1 83 83 PRO CD C 13 50.023 0.35 . 1 . . . . 83 PRO CD . 7059 1 831 . 1 1 84 84 SER H H 1 10.735 0.02 . 1 . . . . 84 SER H . 7059 1 832 . 1 1 84 84 SER HA H 1 4.471 0.02 . 1 . . . . 84 SER HA . 7059 1 833 . 1 1 84 84 SER HB2 H 1 3.863 0.02 . 1 . . . . 84 SER HB2 . 7059 1 834 . 1 1 84 84 SER HB3 H 1 3.863 0.02 . 1 . . . . 84 SER HB3 . 7059 1 835 . 1 1 84 84 SER C C 13 173.936 0.35 . 1 . . . . 84 SER C . 7059 1 836 . 1 1 84 84 SER CA C 13 59.766 0.35 . 1 . . . . 84 SER CA . 7059 1 837 . 1 1 84 84 SER CB C 13 63.099 0.35 . 1 . . . . 84 SER CB . 7059 1 838 . 1 1 84 84 SER N N 15 116.588 0.2 . 1 . . . . 84 SER N . 7059 1 839 . 1 1 85 85 LEU H H 1 8.185 0.02 . 1 . . . . 85 LEU H . 7059 1 840 . 1 1 85 85 LEU HA H 1 4.195 0.02 . 1 . . . . 85 LEU HA . 7059 1 841 . 1 1 85 85 LEU HB2 H 1 2.044 0.02 . 2 . . . . 85 LEU HB2 . 7059 1 842 . 1 1 85 85 LEU HB3 H 1 1.049 0.02 . 2 . . . . 85 LEU HB3 . 7059 1 843 . 1 1 85 85 LEU HG H 1 1.329 0.02 . 1 . . . . 85 LEU HG . 7059 1 844 . 1 1 85 85 LEU HD11 H 1 0.808 0.02 . 2 . . . . 85 LEU HD1 . 7059 1 845 . 1 1 85 85 LEU HD12 H 1 0.808 0.02 . 2 . . . . 85 LEU HD1 . 7059 1 846 . 1 1 85 85 LEU HD13 H 1 0.808 0.02 . 2 . . . . 85 LEU HD1 . 7059 1 847 . 1 1 85 85 LEU HD21 H 1 0.388 0.02 . 2 . . . . 85 LEU HD2 . 7059 1 848 . 1 1 85 85 LEU HD22 H 1 0.388 0.02 . 2 . . . . 85 LEU HD2 . 7059 1 849 . 1 1 85 85 LEU HD23 H 1 0.388 0.02 . 2 . . . . 85 LEU HD2 . 7059 1 850 . 1 1 85 85 LEU C C 13 174.540 0.35 . 1 . . . . 85 LEU C . 7059 1 851 . 1 1 85 85 LEU CA C 13 53.715 0.35 . 1 . . . . 85 LEU CA . 7059 1 852 . 1 1 85 85 LEU CB C 13 41.998 0.35 . 1 . . . . 85 LEU CB . 7059 1 853 . 1 1 85 85 LEU CG C 13 25.619 0.35 . 1 . . . . 85 LEU CG . 7059 1 854 . 1 1 85 85 LEU N N 15 123.491 0.2 . 1 . . . . 85 LEU N . 7059 1 855 . 1 1 86 86 ASP H H 1 8.426 0.02 . 1 . . . . 86 ASP H . 7059 1 856 . 1 1 86 86 ASP HA H 1 4.526 0.02 . 1 . . . . 86 ASP HA . 7059 1 857 . 1 1 86 86 ASP HB2 H 1 2.697 0.02 . 1 . . . . 86 ASP HB2 . 7059 1 858 . 1 1 86 86 ASP HB3 H 1 2.697 0.02 . 1 . . . . 86 ASP HB3 . 7059 1 859 . 1 1 86 86 ASP C C 13 176.598 0.35 . 1 . . . . 86 ASP C . 7059 1 860 . 1 1 86 86 ASP CA C 13 53.422 0.35 . 1 . . . . 86 ASP CA . 7059 1 861 . 1 1 86 86 ASP CB C 13 40.009 0.35 . 1 . . . . 86 ASP CB . 7059 1 862 . 1 1 86 86 ASP N N 15 129.168 0.2 . 1 . . . . 86 ASP N . 7059 1 863 . 1 1 87 87 THR H H 1 8.032 0.02 . 1 . . . . 87 THR H . 7059 1 864 . 1 1 87 87 THR HA H 1 3.875 0.02 . 1 . . . . 87 THR HA . 7059 1 865 . 1 1 87 87 THR HB H 1 4.363 0.02 . 1 . . . . 87 THR HB . 7059 1 866 . 1 1 87 87 THR HG21 H 1 0.769 0.02 . 1 . . . . 87 THR HG2 . 7059 1 867 . 1 1 87 87 THR HG22 H 1 0.769 0.02 . 1 . . . . 87 THR HG2 . 7059 1 868 . 1 1 87 87 THR HG23 H 1 0.769 0.02 . 1 . . . . 87 THR HG2 . 7059 1 869 . 1 1 87 87 THR C C 13 177.284 0.35 . 1 . . . . 87 THR C . 7059 1 870 . 1 1 87 87 THR CA C 13 61.457 0.35 . 1 . . . . 87 THR CA . 7059 1 871 . 1 1 87 87 THR CB C 13 68.275 0.35 . 1 . . . . 87 THR CB . 7059 1 872 . 1 1 87 87 THR CG2 C 13 20.762 0.35 . 1 . . . . 87 THR CG2 . 7059 1 873 . 1 1 87 87 THR N N 15 115.198 0.2 . 1 . . . . 87 THR N . 7059 1 874 . 1 1 88 88 SER H H 1 8.392 0.02 . 1 . . . . 88 SER H . 7059 1 875 . 1 1 88 88 SER HA H 1 4.141 0.02 . 1 . . . . 88 SER HA . 7059 1 876 . 1 1 88 88 SER HB2 H 1 3.917 0.02 . 1 . . . . 88 SER HB2 . 7059 1 877 . 1 1 88 88 SER HB3 H 1 3.917 0.02 . 1 . . . . 88 SER HB3 . 7059 1 878 . 1 1 88 88 SER C C 13 175.380 0.35 . 1 . . . . 88 SER C . 7059 1 879 . 1 1 88 88 SER CA C 13 61.760 0.35 . 1 . . . . 88 SER CA . 7059 1 880 . 1 1 88 88 SER CB C 13 62.544 0.35 . 1 . . . . 88 SER CB . 7059 1 881 . 1 1 88 88 SER N N 15 120.573 0.2 . 1 . . . . 88 SER N . 7059 1 882 . 1 1 89 89 ALA H H 1 8.372 0.02 . 1 . . . . 89 ALA H . 7059 1 883 . 1 1 89 89 ALA HA H 1 4.313 0.02 . 1 . . . . 89 ALA HA . 7059 1 884 . 1 1 89 89 ALA HB1 H 1 1.269 0.02 . 1 . . . . 89 ALA HB . 7059 1 885 . 1 1 89 89 ALA HB2 H 1 1.269 0.02 . 1 . . . . 89 ALA HB . 7059 1 886 . 1 1 89 89 ALA HB3 H 1 1.269 0.02 . 1 . . . . 89 ALA HB . 7059 1 887 . 1 1 89 89 ALA C C 13 177.119 0.35 . 1 . . . . 89 ALA C . 7059 1 888 . 1 1 89 89 ALA CA C 13 51.584 0.35 . 1 . . . . 89 ALA CA . 7059 1 889 . 1 1 89 89 ALA CB C 13 19.240 0.35 . 1 . . . . 89 ALA CB . 7059 1 890 . 1 1 89 89 ALA N N 15 122.285 0.2 . 1 . . . . 89 ALA N . 7059 1 891 . 1 1 90 90 ILE H H 1 7.082 0.02 . 1 . . . . 90 ILE H . 7059 1 892 . 1 1 90 90 ILE HA H 1 3.472 0.02 . 1 . . . . 90 ILE HA . 7059 1 893 . 1 1 90 90 ILE HB H 1 1.670 0.02 . 1 . . . . 90 ILE HB . 7059 1 894 . 1 1 90 90 ILE HG12 H 1 1.378 0.02 . 2 . . . . 90 ILE HG12 . 7059 1 895 . 1 1 90 90 ILE HG13 H 1 0.705 0.02 . 2 . . . . 90 ILE HG13 . 7059 1 896 . 1 1 90 90 ILE HG21 H 1 0.467 0.02 . 1 . . . . 90 ILE HG2 . 7059 1 897 . 1 1 90 90 ILE HG22 H 1 0.467 0.02 . 1 . . . . 90 ILE HG2 . 7059 1 898 . 1 1 90 90 ILE HG23 H 1 0.467 0.02 . 1 . . . . 90 ILE HG2 . 7059 1 899 . 1 1 90 90 ILE HD11 H 1 0.260 0.02 . 1 . . . . 90 ILE HD1 . 7059 1 900 . 1 1 90 90 ILE HD12 H 1 0.260 0.02 . 1 . . . . 90 ILE HD1 . 7059 1 901 . 1 1 90 90 ILE HD13 H 1 0.260 0.02 . 1 . . . . 90 ILE HD1 . 7059 1 902 . 1 1 90 90 ILE C C 13 176.511 0.35 . 1 . . . . 90 ILE C . 7059 1 903 . 1 1 90 90 ILE CA C 13 62.268 0.35 . 1 . . . . 90 ILE CA . 7059 1 904 . 1 1 90 90 ILE CB C 13 37.143 0.35 . 1 . . . . 90 ILE CB . 7059 1 905 . 1 1 90 90 ILE CG1 C 13 26.502 0.35 . 1 . . . . 90 ILE CG1 . 7059 1 906 . 1 1 90 90 ILE CG2 C 13 22.268 0.35 . 1 . . . . 90 ILE CG2 . 7059 1 907 . 1 1 90 90 ILE CD1 C 13 17.250 0.35 . 1 . . . . 90 ILE CD1 . 7059 1 908 . 1 1 90 90 ILE N N 15 116.812 0.2 . 1 . . . . 90 ILE N . 7059 1 909 . 1 1 91 91 GLU H H 1 8.879 0.02 . 1 . . . . 91 GLU H . 7059 1 910 . 1 1 91 91 GLU HA H 1 4.252 0.02 . 1 . . . . 91 GLU HA . 7059 1 911 . 1 1 91 91 GLU HB2 H 1 2.365 0.02 . 1 . . . . 91 GLU HB2 . 7059 1 912 . 1 1 91 91 GLU HB3 H 1 2.365 0.02 . 1 . . . . 91 GLU HB3 . 7059 1 913 . 1 1 91 91 GLU HG2 H 1 2.621 0.02 . 1 . . . . 91 GLU HG2 . 7059 1 914 . 1 1 91 91 GLU HG3 H 1 2.621 0.02 . 1 . . . . 91 GLU HG3 . 7059 1 915 . 1 1 91 91 GLU C C 13 176.254 0.35 . 1 . . . . 91 GLU C . 7059 1 916 . 1 1 91 91 GLU CA C 13 57.735 0.35 . 1 . . . . 91 GLU CA . 7059 1 917 . 1 1 91 91 GLU CB C 13 31.751 0.35 . 1 . . . . 91 GLU CB . 7059 1 918 . 1 1 91 91 GLU CG C 13 36.436 0.35 . 1 . . . . 91 GLU CG . 7059 1 919 . 1 1 91 91 GLU N N 15 128.522 0.2 . 1 . . . . 91 GLU N . 7059 1 920 . 1 1 92 92 ALA H H 1 7.085 0.02 . 1 . . . . 92 ALA H . 7059 1 921 . 1 1 92 92 ALA HA H 1 4.480 0.02 . 1 . . . . 92 ALA HA . 7059 1 922 . 1 1 92 92 ALA HB1 H 1 0.761 0.02 . 1 . . . . 92 ALA HB . 7059 1 923 . 1 1 92 92 ALA HB2 H 1 0.761 0.02 . 1 . . . . 92 ALA HB . 7059 1 924 . 1 1 92 92 ALA HB3 H 1 0.761 0.02 . 1 . . . . 92 ALA HB . 7059 1 925 . 1 1 92 92 ALA C C 13 173.849 0.35 . 1 . . . . 92 ALA C . 7059 1 926 . 1 1 92 92 ALA CA C 13 51.519 0.35 . 1 . . . . 92 ALA CA . 7059 1 927 . 1 1 92 92 ALA CB C 13 22.029 0.35 . 1 . . . . 92 ALA CB . 7059 1 928 . 1 1 92 92 ALA N N 15 118.050 0.2 . 1 . . . . 92 ALA N . 7059 1 929 . 1 1 93 93 VAL H H 1 7.302 0.02 . 1 . . . . 93 VAL H . 7059 1 930 . 1 1 93 93 VAL HA H 1 4.476 0.02 . 1 . . . . 93 VAL HA . 7059 1 931 . 1 1 93 93 VAL HB H 1 2.883 0.02 . 1 . . . . 93 VAL HB . 7059 1 932 . 1 1 93 93 VAL HG11 H 1 0.818 0.02 . 2 . . . . 93 VAL HG1 . 7059 1 933 . 1 1 93 93 VAL HG12 H 1 0.818 0.02 . 2 . . . . 93 VAL HG1 . 7059 1 934 . 1 1 93 93 VAL HG13 H 1 0.818 0.02 . 2 . . . . 93 VAL HG1 . 7059 1 935 . 1 1 93 93 VAL HG21 H 1 1.374 0.02 . 2 . . . . 93 VAL HG2 . 7059 1 936 . 1 1 93 93 VAL HG22 H 1 1.374 0.02 . 2 . . . . 93 VAL HG2 . 7059 1 937 . 1 1 93 93 VAL HG23 H 1 1.374 0.02 . 2 . . . . 93 VAL HG2 . 7059 1 938 . 1 1 93 93 VAL C C 13 173.001 0.35 . 1 . . . . 93 VAL C . 7059 1 939 . 1 1 93 93 VAL CA C 13 59.997 0.35 . 1 . . . . 93 VAL CA . 7059 1 940 . 1 1 93 93 VAL CB C 13 33.124 0.35 . 1 . . . . 93 VAL CB . 7059 1 941 . 1 1 93 93 VAL CG1 C 13 19.954 0.35 . 1 . . . . 93 VAL CG1 . 7059 1 942 . 1 1 93 93 VAL CG2 C 13 19.954 0.35 . 1 . . . . 93 VAL CG2 . 7059 1 943 . 1 1 93 93 VAL N N 15 119.793 0.2 . 1 . . . . 93 VAL N . 7059 1 944 . 1 1 94 94 PHE H H 1 8.408 0.02 . 1 . . . . 94 PHE H . 7059 1 945 . 1 1 94 94 PHE HA H 1 3.849 0.02 . 1 . . . . 94 PHE HA . 7059 1 946 . 1 1 94 94 PHE HB2 H 1 2.352 0.02 . 2 . . . . 94 PHE HB2 . 7059 1 947 . 1 1 94 94 PHE HB3 H 1 2.141 0.02 . 2 . . . . 94 PHE HB3 . 7059 1 948 . 1 1 94 94 PHE HD1 H 1 6.774 0.02 . 1 . . . . 94 PHE HD . 7059 1 949 . 1 1 94 94 PHE HD2 H 1 6.774 0.02 . 1 . . . . 94 PHE HD . 7059 1 950 . 1 1 94 94 PHE HE1 H 1 5.296 0.02 . 1 . . . . 94 PHE HE . 7059 1 951 . 1 1 94 94 PHE HE2 H 1 5.296 0.02 . 1 . . . . 94 PHE HE . 7059 1 952 . 1 1 94 94 PHE C C 13 174.048 0.35 . 1 . . . . 94 PHE C . 7059 1 953 . 1 1 94 94 PHE CA C 13 56.648 0.35 . 1 . . . . 94 PHE CA . 7059 1 954 . 1 1 94 94 PHE CB C 13 39.165 0.35 . 1 . . . . 94 PHE CB . 7059 1 955 . 1 1 94 94 PHE N N 15 123.615 0.2 . 1 . . . . 94 PHE N . 7059 1 956 . 1 1 95 95 TYR H H 1 8.986 0.02 . 1 . . . . 95 TYR H . 7059 1 957 . 1 1 95 95 TYR HA H 1 4.555 0.02 . 1 . . . . 95 TYR HA . 7059 1 958 . 1 1 95 95 TYR HB2 H 1 2.833 0.02 . 1 . . . . 95 TYR HB2 . 7059 1 959 . 1 1 95 95 TYR HB3 H 1 2.833 0.02 . 1 . . . . 95 TYR HB3 . 7059 1 960 . 1 1 95 95 TYR HD1 H 1 6.508 0.02 . 1 . . . . 95 TYR HD . 7059 1 961 . 1 1 95 95 TYR HD2 H 1 6.508 0.02 . 1 . . . . 95 TYR HD . 7059 1 962 . 1 1 95 95 TYR C C 13 175.947 0.35 . 1 . . . . 95 TYR C . 7059 1 963 . 1 1 95 95 TYR CA C 13 57.579 0.35 . 1 . . . . 95 TYR CA . 7059 1 964 . 1 1 95 95 TYR CB C 13 38.695 0.35 . 1 . . . . 95 TYR CB . 7059 1 965 . 1 1 95 95 TYR N N 15 125.180 0.2 . 1 . . . . 95 TYR N . 7059 1 966 . 1 1 96 96 LYS H H 1 8.125 0.02 . 1 . . . . 96 LYS H . 7059 1 967 . 1 1 96 96 LYS HA H 1 4.818 0.02 . 1 . . . . 96 LYS HA . 7059 1 968 . 1 1 96 96 LYS HB2 H 1 2.161 0.02 . 1 . . . . 96 LYS HB2 . 7059 1 969 . 1 1 96 96 LYS HB3 H 1 2.161 0.02 . 1 . . . . 96 LYS HB3 . 7059 1 970 . 1 1 96 96 LYS HG2 H 1 1.185 0.02 . 1 . . . . 96 LYS HG2 . 7059 1 971 . 1 1 96 96 LYS HG3 H 1 1.185 0.02 . 1 . . . . 96 LYS HG3 . 7059 1 972 . 1 1 96 96 LYS HD2 H 1 1.658 0.02 . 1 . . . . 96 LYS HD2 . 7059 1 973 . 1 1 96 96 LYS HD3 H 1 1.658 0.02 . 1 . . . . 96 LYS HD3 . 7059 1 974 . 1 1 96 96 LYS HE2 H 1 3.053 0.02 . 1 . . . . 96 LYS HE2 . 7059 1 975 . 1 1 96 96 LYS HE3 H 1 3.053 0.02 . 1 . . . . 96 LYS HE3 . 7059 1 976 . 1 1 96 96 LYS C C 13 176.062 0.35 . 1 . . . . 96 LYS C . 7059 1 977 . 1 1 96 96 LYS CA C 13 56.742 0.35 . 1 . . . . 96 LYS CA . 7059 1 978 . 1 1 96 96 LYS CB C 13 31.543 0.35 . 1 . . . . 96 LYS CB . 7059 1 979 . 1 1 96 96 LYS CG C 13 22.792 0.35 . 1 . . . . 96 LYS CG . 7059 1 980 . 1 1 96 96 LYS CD C 13 29.363 0.35 . 1 . . . . 96 LYS CD . 7059 1 981 . 1 1 96 96 LYS CE C 13 40.188 0.35 . 1 . . . . 96 LYS CE . 7059 1 982 . 1 1 96 96 LYS N N 15 122.569 0.2 . 1 . . . . 96 LYS N . 7059 1 983 . 1 1 97 97 GLY H H 1 8.700 0.02 . 1 . . . . 97 GLY H . 7059 1 984 . 1 1 97 97 GLY HA2 H 1 4.678 0.02 . 2 . . . . 97 GLY HA2 . 7059 1 985 . 1 1 97 97 GLY HA3 H 1 4.153 0.02 . 2 . . . . 97 GLY HA3 . 7059 1 986 . 1 1 97 97 GLY C C 13 179.246 0.35 . 1 . . . . 97 GLY C . 7059 1 987 . 1 1 97 97 GLY CA C 13 43.944 0.35 . 1 . . . . 97 GLY CA . 7059 1 988 . 1 1 97 97 GLY N N 15 121.464 0.2 . 1 . . . . 97 GLY N . 7059 1 989 . 1 1 98 98 ALA H H 1 8.269 0.02 . 1 . . . . 98 ALA H . 7059 1 990 . 1 1 98 98 ALA HA H 1 4.357 0.02 . 1 . . . . 98 ALA HA . 7059 1 991 . 1 1 98 98 ALA HB1 H 1 1.839 0.02 . 1 . . . . 98 ALA HB . 7059 1 992 . 1 1 98 98 ALA HB2 H 1 1.839 0.02 . 1 . . . . 98 ALA HB . 7059 1 993 . 1 1 98 98 ALA HB3 H 1 1.839 0.02 . 1 . . . . 98 ALA HB . 7059 1 994 . 1 1 98 98 ALA C C 13 178.934 0.35 . 1 . . . . 98 ALA C . 7059 1 995 . 1 1 98 98 ALA CA C 13 57.585 0.35 . 1 . . . . 98 ALA CA . 7059 1 996 . 1 1 98 98 ALA CB C 13 24.750 0.35 . 1 . . . . 98 ALA CB . 7059 1 997 . 1 1 98 98 ALA N N 15 128.322 0.2 . 1 . . . . 98 ALA N . 7059 1 998 . 1 1 99 99 TYR H H 1 8.673 0.02 . 1 . . . . 99 TYR H . 7059 1 999 . 1 1 99 99 TYR HA H 1 4.851 0.02 . 1 . . . . 99 TYR HA . 7059 1 1000 . 1 1 99 99 TYR HB2 H 1 2.428 0.02 . 1 . . . . 99 TYR HB2 . 7059 1 1001 . 1 1 99 99 TYR HB3 H 1 2.428 0.02 . 1 . . . . 99 TYR HB3 . 7059 1 1002 . 1 1 99 99 TYR HD1 H 1 7.242 0.02 . 1 . . . . 99 TYR HD . 7059 1 1003 . 1 1 99 99 TYR HD2 H 1 7.242 0.02 . 1 . . . . 99 TYR HD . 7059 1 1004 . 1 1 99 99 TYR C C 13 175.018 0.35 . 1 . . . . 99 TYR C . 7059 1 1005 . 1 1 99 99 TYR CA C 13 56.528 0.35 . 1 . . . . 99 TYR CA . 7059 1 1006 . 1 1 99 99 TYR CB C 13 38.792 0.35 . 1 . . . . 99 TYR CB . 7059 1 1007 . 1 1 99 99 TYR N N 15 110.832 0.2 . 1 . . . . 99 TYR N . 7059 1 1008 . 1 1 100 100 THR H H 1 7.796 0.02 . 1 . . . . 100 THR H . 7059 1 1009 . 1 1 100 100 THR HA H 1 4.147 0.02 . 1 . . . . 100 THR HA . 7059 1 1010 . 1 1 100 100 THR HB H 1 4.507 0.02 . 1 . . . . 100 THR HB . 7059 1 1011 . 1 1 100 100 THR HG21 H 1 1.354 0.02 . 1 . . . . 100 THR HG2 . 7059 1 1012 . 1 1 100 100 THR HG22 H 1 1.354 0.02 . 1 . . . . 100 THR HG2 . 7059 1 1013 . 1 1 100 100 THR HG23 H 1 1.354 0.02 . 1 . . . . 100 THR HG2 . 7059 1 1014 . 1 1 100 100 THR C C 13 178.023 0.35 . 1 . . . . 100 THR C . 7059 1 1015 . 1 1 100 100 THR CA C 13 64.011 0.35 . 1 . . . . 100 THR CA . 7059 1 1016 . 1 1 100 100 THR CB C 13 67.049 0.35 . 1 . . . . 100 THR CB . 7059 1 1017 . 1 1 100 100 THR CG2 C 13 23.558 0.35 . 1 . . . . 100 THR CG2 . 7059 1 1018 . 1 1 100 100 THR N N 15 111.364 0.2 . 1 . . . . 100 THR N . 7059 1 1019 . 1 1 101 101 GLY H H 1 8.707 0.02 . 1 . . . . 101 GLY H . 7059 1 1020 . 1 1 101 101 GLY HA2 H 1 4.426 0.02 . 2 . . . . 101 GLY HA2 . 7059 1 1021 . 1 1 101 101 GLY HA3 H 1 3.977 0.02 . 2 . . . . 101 GLY HA3 . 7059 1 1022 . 1 1 101 101 GLY C C 13 176.706 0.35 . 1 . . . . 101 GLY C . 7059 1 1023 . 1 1 101 101 GLY CA C 13 44.925 0.35 . 1 . . . . 101 GLY CA . 7059 1 1024 . 1 1 101 101 GLY N N 15 116.316 0.2 . 1 . . . . 101 GLY N . 7059 1 1025 . 1 1 102 102 ALA H H 1 7.990 0.02 . 1 . . . . 102 ALA H . 7059 1 1026 . 1 1 102 102 ALA HA H 1 4.072 0.02 . 1 . . . . 102 ALA HA . 7059 1 1027 . 1 1 102 102 ALA HB1 H 1 3.115 0.02 . 1 . . . . 102 ALA HB . 7059 1 1028 . 1 1 102 102 ALA HB2 H 1 3.115 0.02 . 1 . . . . 102 ALA HB . 7059 1 1029 . 1 1 102 102 ALA HB3 H 1 3.115 0.02 . 1 . . . . 102 ALA HB . 7059 1 1030 . 1 1 102 102 ALA C C 13 178.600 0.35 . 1 . . . . 102 ALA C . 7059 1 1031 . 1 1 102 102 ALA CA C 13 53.409 0.35 . 1 . . . . 102 ALA CA . 7059 1 1032 . 1 1 102 102 ALA CB C 13 18.538 0.35 . 1 . . . . 102 ALA CB . 7059 1 1033 . 1 1 102 102 ALA N N 15 123.024 0.2 . 1 . . . . 102 ALA N . 7059 1 1034 . 1 1 103 103 TYR H H 1 8.344 0.02 . 1 . . . . 103 TYR H . 7059 1 1035 . 1 1 103 103 TYR HA H 1 3.993 0.02 . 1 . . . . 103 TYR HA . 7059 1 1036 . 1 1 103 103 TYR HB2 H 1 3.270 0.02 . 2 . . . . 103 TYR HB2 . 7059 1 1037 . 1 1 103 103 TYR HB3 H 1 2.933 0.02 . 2 . . . . 103 TYR HB3 . 7059 1 1038 . 1 1 103 103 TYR C C 13 174.441 0.35 . 1 . . . . 103 TYR C . 7059 1 1039 . 1 1 103 103 TYR CA C 13 59.324 0.35 . 1 . . . . 103 TYR CA . 7059 1 1040 . 1 1 103 103 TYR CB C 13 40.811 0.35 . 1 . . . . 103 TYR CB . 7059 1 1041 . 1 1 103 103 TYR N N 15 119.440 0.2 . 1 . . . . 103 TYR N . 7059 1 1042 . 1 1 104 104 SER H H 1 8.247 0.02 . 1 . . . . 104 SER H . 7059 1 1043 . 1 1 104 104 SER HA H 1 4.154 0.02 . 1 . . . . 104 SER HA . 7059 1 1044 . 1 1 104 104 SER HB2 H 1 3.752 0.02 . 1 . . . . 104 SER HB2 . 7059 1 1045 . 1 1 104 104 SER HB3 H 1 3.752 0.02 . 1 . . . . 104 SER HB3 . 7059 1 1046 . 1 1 104 104 SER C C 13 176.426 0.35 . 1 . . . . 104 SER C . 7059 1 1047 . 1 1 104 104 SER CA C 13 55.025 0.35 . 1 . . . . 104 SER CA . 7059 1 1048 . 1 1 104 104 SER CB C 13 65.690 0.35 . 1 . . . . 104 SER CB . 7059 1 1049 . 1 1 104 104 SER N N 15 111.463 0.2 . 1 . . . . 104 SER N . 7059 1 1050 . 1 1 105 105 GLY H H 1 9.444 0.02 . 1 . . . . 105 GLY H . 7059 1 1051 . 1 1 105 105 GLY HA2 H 1 3.465 0.02 . 2 . . . . 105 GLY HA2 . 7059 1 1052 . 1 1 105 105 GLY HA3 H 1 3.160 0.02 . 2 . . . . 105 GLY HA3 . 7059 1 1053 . 1 1 105 105 GLY C C 13 173.993 0.35 . 1 . . . . 105 GLY C . 7059 1 1054 . 1 1 105 105 GLY CA C 13 46.677 0.35 . 1 . . . . 105 GLY CA . 7059 1 1055 . 1 1 105 105 GLY N N 15 115.902 0.2 . 1 . . . . 105 GLY N . 7059 1 1056 . 1 1 106 106 PHE H H 1 8.315 0.02 . 1 . . . . 106 PHE H . 7059 1 1057 . 1 1 106 106 PHE HA H 1 4.042 0.02 . 1 . . . . 106 PHE HA . 7059 1 1058 . 1 1 106 106 PHE HB2 H 1 3.427 0.02 . 2 . . . . 106 PHE HB2 . 7059 1 1059 . 1 1 106 106 PHE HB3 H 1 2.923 0.02 . 2 . . . . 106 PHE HB3 . 7059 1 1060 . 1 1 106 106 PHE HD1 H 1 7.416 0.02 . 1 . . . . 106 PHE HD . 7059 1 1061 . 1 1 106 106 PHE HD2 H 1 7.416 0.02 . 1 . . . . 106 PHE HD . 7059 1 1062 . 1 1 106 106 PHE C C 13 176.532 0.35 . 1 . . . . 106 PHE C . 7059 1 1063 . 1 1 106 106 PHE CA C 13 61.109 0.35 . 1 . . . . 106 PHE CA . 7059 1 1064 . 1 1 106 106 PHE CB C 13 37.490 0.35 . 1 . . . . 106 PHE CB . 7059 1 1065 . 1 1 106 106 PHE N N 15 114.600 0.2 . 1 . . . . 106 PHE N . 7059 1 1066 . 1 1 107 107 GLU H H 1 7.740 0.02 . 1 . . . . 107 GLU H . 7059 1 1067 . 1 1 107 107 GLU HA H 1 4.353 0.02 . 1 . . . . 107 GLU HA . 7059 1 1068 . 1 1 107 107 GLU HB2 H 1 2.335 0.02 . 2 . . . . 107 GLU HB2 . 7059 1 1069 . 1 1 107 107 GLU HB3 H 1 2.076 0.02 . 2 . . . . 107 GLU HB3 . 7059 1 1070 . 1 1 107 107 GLU HG2 H 1 2.756 0.02 . 1 . . . . 107 GLU HG2 . 7059 1 1071 . 1 1 107 107 GLU HG3 H 1 2.756 0.02 . 1 . . . . 107 GLU HG3 . 7059 1 1072 . 1 1 107 107 GLU C C 13 176.607 0.35 . 1 . . . . 107 GLU C . 7059 1 1073 . 1 1 107 107 GLU CA C 13 57.289 0.35 . 1 . . . . 107 GLU CA . 7059 1 1074 . 1 1 107 107 GLU CB C 13 30.064 0.35 . 1 . . . . 107 GLU CB . 7059 1 1075 . 1 1 107 107 GLU CG C 13 37.966 0.35 . 1 . . . . 107 GLU CG . 7059 1 1076 . 1 1 107 107 GLU N N 15 118.278 0.2 . 1 . . . . 107 GLU N . 7059 1 1077 . 1 1 108 108 GLY H H 1 7.899 0.02 . 1 . . . . 108 GLY H . 7059 1 1078 . 1 1 108 108 GLY HA2 H 1 4.418 0.02 . 2 . . . . 108 GLY HA2 . 7059 1 1079 . 1 1 108 108 GLY HA3 H 1 4.009 0.02 . 2 . . . . 108 GLY HA3 . 7059 1 1080 . 1 1 108 108 GLY C C 13 172.237 0.35 . 1 . . . . 108 GLY C . 7059 1 1081 . 1 1 108 108 GLY CA C 13 44.941 0.35 . 1 . . . . 108 GLY CA . 7059 1 1082 . 1 1 108 108 GLY N N 15 106.570 0.2 . 1 . . . . 108 GLY N . 7059 1 1083 . 1 1 109 109 VAL H H 1 8.476 0.02 . 1 . . . . 109 VAL H . 7059 1 1084 . 1 1 109 109 VAL HA H 1 5.326 0.02 . 1 . . . . 109 VAL HA . 7059 1 1085 . 1 1 109 109 VAL HB H 1 1.865 0.02 . 1 . . . . 109 VAL HB . 7059 1 1086 . 1 1 109 109 VAL HG11 H 1 0.933 0.02 . 2 . . . . 109 VAL HG1 . 7059 1 1087 . 1 1 109 109 VAL HG12 H 1 0.933 0.02 . 2 . . . . 109 VAL HG1 . 7059 1 1088 . 1 1 109 109 VAL HG13 H 1 0.933 0.02 . 2 . . . . 109 VAL HG1 . 7059 1 1089 . 1 1 109 109 VAL HG21 H 1 1.089 0.02 . 2 . . . . 109 VAL HG2 . 7059 1 1090 . 1 1 109 109 VAL HG22 H 1 1.089 0.02 . 2 . . . . 109 VAL HG2 . 7059 1 1091 . 1 1 109 109 VAL HG23 H 1 1.089 0.02 . 2 . . . . 109 VAL HG2 . 7059 1 1092 . 1 1 109 109 VAL C C 13 176.149 0.35 . 1 . . . . 109 VAL C . 7059 1 1093 . 1 1 109 109 VAL CA C 13 58.969 0.35 . 1 . . . . 109 VAL CA . 7059 1 1094 . 1 1 109 109 VAL CB C 13 35.133 0.35 . 1 . . . . 109 VAL CB . 7059 1 1095 . 1 1 109 109 VAL CG1 C 13 19.544 0.35 . 1 . . . . 109 VAL CG1 . 7059 1 1096 . 1 1 109 109 VAL CG2 C 13 19.544 0.35 . 1 . . . . 109 VAL CG2 . 7059 1 1097 . 1 1 109 109 VAL N N 15 116.344 0.2 . 1 . . . . 109 VAL N . 7059 1 1098 . 1 1 110 110 ASP H H 1 8.401 0.02 . 1 . . . . 110 ASP H . 7059 1 1099 . 1 1 110 110 ASP HA H 1 5.032 0.02 . 1 . . . . 110 ASP HA . 7059 1 1100 . 1 1 110 110 ASP HB2 H 1 2.776 0.02 . 2 . . . . 110 ASP HB2 . 7059 1 1101 . 1 1 110 110 ASP HB3 H 1 1.832 0.02 . 2 . . . . 110 ASP HB3 . 7059 1 1102 . 1 1 110 110 ASP C C 13 179.043 0.35 . 1 . . . . 110 ASP C . 7059 1 1103 . 1 1 110 110 ASP CA C 13 52.522 0.35 . 1 . . . . 110 ASP CA . 7059 1 1104 . 1 1 110 110 ASP CB C 13 39.515 0.35 . 1 . . . . 110 ASP CB . 7059 1 1105 . 1 1 110 110 ASP N N 15 125.250 0.2 . 1 . . . . 110 ASP N . 7059 1 1106 . 1 1 111 111 GLU H H 1 8.977 0.02 . 1 . . . . 111 GLU H . 7059 1 1107 . 1 1 111 111 GLU HA H 1 4.064 0.02 . 1 . . . . 111 GLU HA . 7059 1 1108 . 1 1 111 111 GLU HB2 H 1 2.083 0.02 . 1 . . . . 111 GLU HB2 . 7059 1 1109 . 1 1 111 111 GLU HB3 H 1 2.083 0.02 . 1 . . . . 111 GLU HB3 . 7059 1 1110 . 1 1 111 111 GLU HG2 H 1 2.362 0.02 . 1 . . . . 111 GLU HG2 . 7059 1 1111 . 1 1 111 111 GLU HG3 H 1 2.362 0.02 . 1 . . . . 111 GLU HG3 . 7059 1 1112 . 1 1 111 111 GLU C C 13 176.719 0.35 . 1 . . . . 111 GLU C . 7059 1 1113 . 1 1 111 111 GLU CA C 13 58.280 0.35 . 1 . . . . 111 GLU CA . 7059 1 1114 . 1 1 111 111 GLU CB C 13 28.257 0.35 . 1 . . . . 111 GLU CB . 7059 1 1115 . 1 1 111 111 GLU CG C 13 34.262 0.35 . 1 . . . . 111 GLU CG . 7059 1 1116 . 1 1 111 111 GLU N N 15 116.219 0.2 . 1 . . . . 111 GLU N . 7059 1 1117 . 1 1 112 112 ASN H H 1 8.130 0.02 . 1 . . . . 112 ASN H . 7059 1 1118 . 1 1 112 112 ASN HA H 1 4.904 0.02 . 1 . . . . 112 ASN HA . 7059 1 1119 . 1 1 112 112 ASN HB2 H 1 2.974 0.02 . 1 . . . . 112 ASN HB2 . 7059 1 1120 . 1 1 112 112 ASN HB3 H 1 2.974 0.02 . 1 . . . . 112 ASN HB3 . 7059 1 1121 . 1 1 112 112 ASN C C 13 175.770 0.35 . 1 . . . . 112 ASN C . 7059 1 1122 . 1 1 112 112 ASN CA C 13 52.791 0.35 . 1 . . . . 112 ASN CA . 7059 1 1123 . 1 1 112 112 ASN CB C 13 39.372 0.35 . 1 . . . . 112 ASN CB . 7059 1 1124 . 1 1 112 112 ASN N N 15 116.595 0.2 . 1 . . . . 112 ASN N . 7059 1 1125 . 1 1 113 113 GLY H H 1 8.342 0.02 . 1 . . . . 113 GLY H . 7059 1 1126 . 1 1 113 113 GLY HA2 H 1 4.315 0.02 . 2 . . . . 113 GLY HA2 . 7059 1 1127 . 1 1 113 113 GLY HA3 H 1 3.563 0.02 . 2 . . . . 113 GLY HA3 . 7059 1 1128 . 1 1 113 113 GLY C C 13 174.571 0.35 . 1 . . . . 113 GLY C . 7059 1 1129 . 1 1 113 113 GLY CA C 13 45.075 0.35 . 1 . . . . 113 GLY CA . 7059 1 1130 . 1 1 113 113 GLY N N 15 109.234 0.2 . 1 . . . . 113 GLY N . 7059 1 1131 . 1 1 114 114 THR H H 1 8.011 0.02 . 1 . . . . 114 THR H . 7059 1 1132 . 1 1 114 114 THR HA H 1 5.011 0.02 . 1 . . . . 114 THR HA . 7059 1 1133 . 1 1 114 114 THR HB H 1 4.472 0.02 . 1 . . . . 114 THR HB . 7059 1 1134 . 1 1 114 114 THR HG21 H 1 1.031 0.02 . 1 . . . . 114 THR HG2 . 7059 1 1135 . 1 1 114 114 THR HG22 H 1 1.031 0.02 . 1 . . . . 114 THR HG2 . 7059 1 1136 . 1 1 114 114 THR HG23 H 1 1.031 0.02 . 1 . . . . 114 THR HG2 . 7059 1 1137 . 1 1 114 114 THR C C 13 174.557 0.35 . 1 . . . . 114 THR C . 7059 1 1138 . 1 1 114 114 THR CA C 13 58.859 0.35 . 1 . . . . 114 THR CA . 7059 1 1139 . 1 1 114 114 THR CB C 13 69.693 0.35 . 1 . . . . 114 THR CB . 7059 1 1140 . 1 1 114 114 THR N N 15 110.718 0.2 . 1 . . . . 114 THR N . 7059 1 1141 . 1 1 115 115 PRO HA H 1 5.208 0.02 . 1 . . . . 115 PRO HA . 7059 1 1142 . 1 1 115 115 PRO HB2 H 1 2.809 0.02 . 2 . . . . 115 PRO HB2 . 7059 1 1143 . 1 1 115 115 PRO HB3 H 1 2.163 0.02 . 2 . . . . 115 PRO HB3 . 7059 1 1144 . 1 1 115 115 PRO HG2 H 1 2.137 0.02 . 2 . . . . 115 PRO HG2 . 7059 1 1145 . 1 1 115 115 PRO HG3 H 1 2.032 0.02 . 2 . . . . 115 PRO HG3 . 7059 1 1146 . 1 1 115 115 PRO HD2 H 1 3.928 0.02 . 2 . . . . 115 PRO HD2 . 7059 1 1147 . 1 1 115 115 PRO HD3 H 1 3.726 0.02 . 2 . . . . 115 PRO HD3 . 7059 1 1148 . 1 1 115 115 PRO C C 13 177.467 0.35 . 1 . . . . 115 PRO C . 7059 1 1149 . 1 1 115 115 PRO CA C 13 62.309 0.35 . 1 . . . . 115 PRO CA . 7059 1 1150 . 1 1 115 115 PRO CB C 13 32.787 0.35 . 1 . . . . 115 PRO CB . 7059 1 1151 . 1 1 115 115 PRO CG C 13 27.285 0.35 . 1 . . . . 115 PRO CG . 7059 1 1152 . 1 1 115 115 PRO CD C 13 51.310 0.35 . 1 . . . . 115 PRO CD . 7059 1 1153 . 1 1 116 116 LEU H H 1 7.206 0.02 . 1 . . . . 116 LEU H . 7059 1 1154 . 1 1 116 116 LEU HA H 1 3.155 0.02 . 1 . . . . 116 LEU HA . 7059 1 1155 . 1 1 116 116 LEU HB2 H 1 0.943 0.02 . 2 . . . . 116 LEU HB2 . 7059 1 1156 . 1 1 116 116 LEU HB3 H 1 0.304 0.02 . 2 . . . . 116 LEU HB3 . 7059 1 1157 . 1 1 116 116 LEU HG H 1 0.493 0.02 . 1 . . . . 116 LEU HG . 7059 1 1158 . 1 1 116 116 LEU HD11 H 1 -0.516 0.02 . 2 . . . . 116 LEU HD1 . 7059 1 1159 . 1 1 116 116 LEU HD12 H 1 -0.516 0.02 . 2 . . . . 116 LEU HD1 . 7059 1 1160 . 1 1 116 116 LEU HD13 H 1 -0.516 0.02 . 2 . . . . 116 LEU HD1 . 7059 1 1161 . 1 1 116 116 LEU HD21 H 1 -0.817 0.02 . 2 . . . . 116 LEU HD2 . 7059 1 1162 . 1 1 116 116 LEU HD22 H 1 -0.817 0.02 . 2 . . . . 116 LEU HD2 . 7059 1 1163 . 1 1 116 116 LEU HD23 H 1 -0.817 0.02 . 2 . . . . 116 LEU HD2 . 7059 1 1164 . 1 1 116 116 LEU C C 13 177.417 0.35 . 1 . . . . 116 LEU C . 7059 1 1165 . 1 1 116 116 LEU CA C 13 58.203 0.35 . 1 . . . . 116 LEU CA . 7059 1 1166 . 1 1 116 116 LEU CB C 13 40.337 0.35 . 1 . . . . 116 LEU CB . 7059 1 1167 . 1 1 116 116 LEU CG C 13 25.278 0.35 . 1 . . . . 116 LEU CG . 7059 1 1168 . 1 1 116 116 LEU N N 15 122.225 0.2 . 1 . . . . 116 LEU N . 7059 1 1169 . 1 1 117 117 LEU H H 1 9.637 0.02 . 1 . . . . 117 LEU H . 7059 1 1170 . 1 1 117 117 LEU HA H 1 4.093 0.02 . 1 . . . . 117 LEU HA . 7059 1 1171 . 1 1 117 117 LEU HB2 H 1 1.822 0.02 . 2 . . . . 117 LEU HB2 . 7059 1 1172 . 1 1 117 117 LEU HB3 H 1 1.761 0.02 . 2 . . . . 117 LEU HB3 . 7059 1 1173 . 1 1 117 117 LEU HG H 1 1.579 0.02 . 1 . . . . 117 LEU HG . 7059 1 1174 . 1 1 117 117 LEU HD11 H 1 0.940 0.02 . 1 . . . . 117 LEU HD1 . 7059 1 1175 . 1 1 117 117 LEU HD12 H 1 0.940 0.02 . 1 . . . . 117 LEU HD1 . 7059 1 1176 . 1 1 117 117 LEU HD13 H 1 0.940 0.02 . 1 . . . . 117 LEU HD1 . 7059 1 1177 . 1 1 117 117 LEU HD21 H 1 0.940 0.02 . 1 . . . . 117 LEU HD2 . 7059 1 1178 . 1 1 117 117 LEU HD22 H 1 0.940 0.02 . 1 . . . . 117 LEU HD2 . 7059 1 1179 . 1 1 117 117 LEU HD23 H 1 0.940 0.02 . 1 . . . . 117 LEU HD2 . 7059 1 1180 . 1 1 117 117 LEU C C 13 177.885 0.35 . 1 . . . . 117 LEU C . 7059 1 1181 . 1 1 117 117 LEU CA C 13 58.475 0.35 . 1 . . . . 117 LEU CA . 7059 1 1182 . 1 1 117 117 LEU CB C 13 41.056 0.35 . 1 . . . . 117 LEU CB . 7059 1 1183 . 1 1 117 117 LEU CG C 13 26.121 0.35 . 1 . . . . 117 LEU CG . 7059 1 1184 . 1 1 117 117 LEU CD1 C 13 24.414 0.35 . 2 . . . . 117 LEU CD1 . 7059 1 1185 . 1 1 117 117 LEU CD2 C 13 21.821 0.35 . 2 . . . . 117 LEU CD2 . 7059 1 1186 . 1 1 117 117 LEU N N 15 116.555 0.2 . 1 . . . . 117 LEU N . 7059 1 1187 . 1 1 118 118 ASN H H 1 7.058 0.02 . 1 . . . . 118 ASN H . 7059 1 1188 . 1 1 118 118 ASN HA H 1 4.273 0.02 . 1 . . . . 118 ASN HA . 7059 1 1189 . 1 1 118 118 ASN HB2 H 1 2.673 0.02 . 1 . . . . 118 ASN HB2 . 7059 1 1190 . 1 1 118 118 ASN HB3 H 1 2.673 0.02 . 1 . . . . 118 ASN HB3 . 7059 1 1191 . 1 1 118 118 ASN C C 13 176.826 0.35 . 1 . . . . 118 ASN C . 7059 1 1192 . 1 1 118 118 ASN CA C 13 56.197 0.35 . 1 . . . . 118 ASN CA . 7059 1 1193 . 1 1 118 118 ASN CB C 13 36.952 0.35 . 1 . . . . 118 ASN CB . 7059 1 1194 . 1 1 118 118 ASN N N 15 114.584 0.2 . 1 . . . . 118 ASN N . 7059 1 1195 . 1 1 119 119 TRP H H 1 8.417 0.02 . 1 . . . . 119 TRP H . 7059 1 1196 . 1 1 119 119 TRP HA H 1 3.813 0.02 . 1 . . . . 119 TRP HA . 7059 1 1197 . 1 1 119 119 TRP HB2 H 1 3.504 0.02 . 2 . . . . 119 TRP HB2 . 7059 1 1198 . 1 1 119 119 TRP HB3 H 1 3.182 0.02 . 2 . . . . 119 TRP HB3 . 7059 1 1199 . 1 1 119 119 TRP C C 13 179.494 0.35 . 1 . . . . 119 TRP C . 7059 1 1200 . 1 1 119 119 TRP CA C 13 61.882 0.35 . 1 . . . . 119 TRP CA . 7059 1 1201 . 1 1 119 119 TRP CB C 13 30.924 0.35 . 1 . . . . 119 TRP CB . 7059 1 1202 . 1 1 119 119 TRP N N 15 122.004 0.2 . 1 . . . . 119 TRP N . 7059 1 1203 . 1 1 120 120 LEU H H 1 8.241 0.02 . 1 . . . . 120 LEU H . 7059 1 1204 . 1 1 120 120 LEU HA H 1 3.917 0.02 . 1 . . . . 120 LEU HA . 7059 1 1205 . 1 1 120 120 LEU HB2 H 1 1.328 0.02 . 2 . . . . 120 LEU HB2 . 7059 1 1206 . 1 1 120 120 LEU HB3 H 1 2.204 0.02 . 2 . . . . 120 LEU HB3 . 7059 1 1207 . 1 1 120 120 LEU HG H 1 1.407 0.02 . 1 . . . . 120 LEU HG . 7059 1 1208 . 1 1 120 120 LEU HD11 H 1 0.815 0.02 . 2 . . . . 120 LEU HD1 . 7059 1 1209 . 1 1 120 120 LEU HD12 H 1 0.815 0.02 . 2 . . . . 120 LEU HD1 . 7059 1 1210 . 1 1 120 120 LEU HD13 H 1 0.815 0.02 . 2 . . . . 120 LEU HD1 . 7059 1 1211 . 1 1 120 120 LEU HD21 H 1 0.712 0.02 . 2 . . . . 120 LEU HD2 . 7059 1 1212 . 1 1 120 120 LEU HD22 H 1 0.712 0.02 . 2 . . . . 120 LEU HD2 . 7059 1 1213 . 1 1 120 120 LEU HD23 H 1 0.712 0.02 . 2 . . . . 120 LEU HD2 . 7059 1 1214 . 1 1 120 120 LEU C C 13 179.661 0.35 . 1 . . . . 120 LEU C . 7059 1 1215 . 1 1 120 120 LEU CA C 13 57.868 0.35 . 1 . . . . 120 LEU CA . 7059 1 1216 . 1 1 120 120 LEU CB C 13 40.719 0.35 . 1 . . . . 120 LEU CB . 7059 1 1217 . 1 1 120 120 LEU CG C 13 24.936 0.35 . 1 . . . . 120 LEU CG . 7059 1 1218 . 1 1 120 120 LEU N N 15 116.214 0.2 . 1 . . . . 120 LEU N . 7059 1 1219 . 1 1 121 121 ARG H H 1 8.785 0.02 . 1 . . . . 121 ARG H . 7059 1 1220 . 1 1 121 121 ARG HA H 1 3.976 0.02 . 1 . . . . 121 ARG HA . 7059 1 1221 . 1 1 121 121 ARG HB2 H 1 2.113 0.02 . 1 . . . . 121 ARG HB2 . 7059 1 1222 . 1 1 121 121 ARG HB3 H 1 2.113 0.02 . 1 . . . . 121 ARG HB3 . 7059 1 1223 . 1 1 121 121 ARG HG2 H 1 1.928 0.02 . 2 . . . . 121 ARG HG2 . 7059 1 1224 . 1 1 121 121 ARG HG3 H 1 1.653 0.02 . 2 . . . . 121 ARG HG3 . 7059 1 1225 . 1 1 121 121 ARG HD2 H 1 3.222 0.02 . 1 . . . . 121 ARG HD2 . 7059 1 1226 . 1 1 121 121 ARG HD3 H 1 3.222 0.02 . 1 . . . . 121 ARG HD3 . 7059 1 1227 . 1 1 121 121 ARG C C 13 181.121 0.35 . 1 . . . . 121 ARG C . 7059 1 1228 . 1 1 121 121 ARG CA C 13 59.186 0.35 . 1 . . . . 121 ARG CA . 7059 1 1229 . 1 1 121 121 ARG CB C 13 29.183 0.35 . 1 . . . . 121 ARG CB . 7059 1 1230 . 1 1 121 121 ARG CG C 13 26.353 0.35 . 1 . . . . 121 ARG CG . 7059 1 1231 . 1 1 121 121 ARG CD C 13 42.552 0.35 . 1 . . . . 121 ARG CD . 7059 1 1232 . 1 1 121 121 ARG N N 15 119.373 0.2 . 1 . . . . 121 ARG N . 7059 1 1233 . 1 1 122 122 GLN H H 1 8.345 0.02 . 1 . . . . 122 GLN H . 7059 1 1234 . 1 1 122 122 GLN HA H 1 4.009 0.02 . 1 . . . . 122 GLN HA . 7059 1 1235 . 1 1 122 122 GLN HB2 H 1 2.009 0.02 . 2 . . . . 122 GLN HB2 . 7059 1 1236 . 1 1 122 122 GLN HB3 H 1 1.862 0.02 . 2 . . . . 122 GLN HB3 . 7059 1 1237 . 1 1 122 122 GLN HG2 H 1 2.832 0.02 . 2 . . . . 122 GLN HG2 . 7059 1 1238 . 1 1 122 122 GLN HG3 H 1 2.371 0.02 . 2 . . . . 122 GLN HG3 . 7059 1 1239 . 1 1 122 122 GLN C C 13 177.277 0.35 . 1 . . . . 122 GLN C . 7059 1 1240 . 1 1 122 122 GLN CA C 13 57.984 0.35 . 1 . . . . 122 GLN CA . 7059 1 1241 . 1 1 122 122 GLN CB C 13 27.715 0.35 . 1 . . . . 122 GLN CB . 7059 1 1242 . 1 1 122 122 GLN CG C 13 32.902 0.35 . 1 . . . . 122 GLN CG . 7059 1 1243 . 1 1 122 122 GLN N N 15 119.339 0.2 . 1 . . . . 122 GLN N . 7059 1 1244 . 1 1 123 123 ARG H H 1 6.719 0.02 . 1 . . . . 123 ARG H . 7059 1 1245 . 1 1 123 123 ARG HA H 1 3.988 0.02 . 1 . . . . 123 ARG HA . 7059 1 1246 . 1 1 123 123 ARG HB2 H 1 1.792 0.02 . 2 . . . . 123 ARG HB2 . 7059 1 1247 . 1 1 123 123 ARG HB3 H 1 0.816 0.02 . 2 . . . . 123 ARG HB3 . 7059 1 1248 . 1 1 123 123 ARG HG2 H 1 1.807 0.02 . 2 . . . . 123 ARG HG2 . 7059 1 1249 . 1 1 123 123 ARG HG3 H 1 1.443 0.02 . 2 . . . . 123 ARG HG3 . 7059 1 1250 . 1 1 123 123 ARG HD2 H 1 3.242 0.02 . 2 . . . . 123 ARG HD2 . 7059 1 1251 . 1 1 123 123 ARG HD3 H 1 3.123 0.02 . 2 . . . . 123 ARG HD3 . 7059 1 1252 . 1 1 123 123 ARG C C 13 175.810 0.35 . 1 . . . . 123 ARG C . 7059 1 1253 . 1 1 123 123 ARG CA C 13 55.481 0.35 . 1 . . . . 123 ARG CA . 7059 1 1254 . 1 1 123 123 ARG CB C 13 29.367 0.35 . 1 . . . . 123 ARG CB . 7059 1 1255 . 1 1 123 123 ARG CG C 13 26.579 0.35 . 1 . . . . 123 ARG CG . 7059 1 1256 . 1 1 123 123 ARG CD C 13 40.510 0.35 . 1 . . . . 123 ARG CD . 7059 1 1257 . 1 1 123 123 ARG N N 15 116.300 0.2 . 1 . . . . 123 ARG N . 7059 1 1258 . 1 1 124 124 GLY H H 1 7.627 0.02 . 1 . . . . 124 GLY H . 7059 1 1259 . 1 1 124 124 GLY HA2 H 1 3.992 0.02 . 2 . . . . 124 GLY HA2 . 7059 1 1260 . 1 1 124 124 GLY HA3 H 1 3.708 0.02 . 2 . . . . 124 GLY HA3 . 7059 1 1261 . 1 1 124 124 GLY C C 13 174.744 0.35 . 1 . . . . 124 GLY C . 7059 1 1262 . 1 1 124 124 GLY CA C 13 45.629 0.35 . 1 . . . . 124 GLY CA . 7059 1 1263 . 1 1 124 124 GLY N N 15 106.990 0.2 . 1 . . . . 124 GLY N . 7059 1 1264 . 1 1 125 125 VAL H H 1 7.643 0.02 . 1 . . . . 125 VAL H . 7059 1 1265 . 1 1 125 125 VAL HA H 1 3.692 0.02 . 1 . . . . 125 VAL HA . 7059 1 1266 . 1 1 125 125 VAL HB H 1 1.849 0.02 . 1 . . . . 125 VAL HB . 7059 1 1267 . 1 1 125 125 VAL HG11 H 1 0.885 0.02 . 2 . . . . 125 VAL HG1 . 7059 1 1268 . 1 1 125 125 VAL HG12 H 1 0.885 0.02 . 2 . . . . 125 VAL HG1 . 7059 1 1269 . 1 1 125 125 VAL HG13 H 1 0.885 0.02 . 2 . . . . 125 VAL HG1 . 7059 1 1270 . 1 1 125 125 VAL HG21 H 1 1.133 0.02 . 2 . . . . 125 VAL HG2 . 7059 1 1271 . 1 1 125 125 VAL HG22 H 1 1.133 0.02 . 2 . . . . 125 VAL HG2 . 7059 1 1272 . 1 1 125 125 VAL HG23 H 1 1.133 0.02 . 2 . . . . 125 VAL HG2 . 7059 1 1273 . 1 1 125 125 VAL C C 13 174.521 0.35 . 1 . . . . 125 VAL C . 7059 1 1274 . 1 1 125 125 VAL CA C 13 63.411 0.35 . 1 . . . . 125 VAL CA . 7059 1 1275 . 1 1 125 125 VAL CB C 13 30.775 0.35 . 1 . . . . 125 VAL CB . 7059 1 1276 . 1 1 125 125 VAL CG1 C 13 21.771 0.35 . 1 . . . . 125 VAL CG1 . 7059 1 1277 . 1 1 125 125 VAL CG2 C 13 21.771 0.35 . 1 . . . . 125 VAL CG2 . 7059 1 1278 . 1 1 125 125 VAL N N 15 120.034 0.2 . 1 . . . . 125 VAL N . 7059 1 1279 . 1 1 126 126 ASP H H 1 8.948 0.02 . 1 . . . . 126 ASP H . 7059 1 1280 . 1 1 126 126 ASP HA H 1 4.733 0.02 . 1 . . . . 126 ASP HA . 7059 1 1281 . 1 1 126 126 ASP HB2 H 1 3.084 0.02 . 1 . . . . 126 ASP HB2 . 7059 1 1282 . 1 1 126 126 ASP HB3 H 1 3.084 0.02 . 1 . . . . 126 ASP HB3 . 7059 1 1283 . 1 1 126 126 ASP C C 13 175.633 0.35 . 1 . . . . 126 ASP C . 7059 1 1284 . 1 1 126 126 ASP CA C 13 52.768 0.35 . 1 . . . . 126 ASP CA . 7059 1 1285 . 1 1 126 126 ASP CB C 13 40.789 0.35 . 1 . . . . 126 ASP CB . 7059 1 1286 . 1 1 126 126 ASP N N 15 124.210 0.2 . 1 . . . . 126 ASP N . 7059 1 1287 . 1 1 127 127 GLU H H 1 8.014 0.02 . 1 . . . . 127 GLU H . 7059 1 1288 . 1 1 127 127 GLU HA H 1 5.507 0.02 . 1 . . . . 127 GLU HA . 7059 1 1289 . 1 1 127 127 GLU HB2 H 1 2.206 0.02 . 2 . . . . 127 GLU HB2 . 7059 1 1290 . 1 1 127 127 GLU HB3 H 1 1.976 0.02 . 2 . . . . 127 GLU HB3 . 7059 1 1291 . 1 1 127 127 GLU HG2 H 1 2.365 0.02 . 2 . . . . 127 GLU HG2 . 7059 1 1292 . 1 1 127 127 GLU HG3 H 1 2.190 0.02 . 2 . . . . 127 GLU HG3 . 7059 1 1293 . 1 1 127 127 GLU C C 13 175.414 0.35 . 1 . . . . 127 GLU C . 7059 1 1294 . 1 1 127 127 GLU CA C 13 54.542 0.35 . 1 . . . . 127 GLU CA . 7059 1 1295 . 1 1 127 127 GLU CB C 13 32.550 0.35 . 1 . . . . 127 GLU CB . 7059 1 1296 . 1 1 127 127 GLU CG C 13 34.194 0.35 . 1 . . . . 127 GLU CG . 7059 1 1297 . 1 1 127 127 GLU N N 15 122.035 0.2 . 1 . . . . 127 GLU N . 7059 1 1298 . 1 1 128 128 VAL H H 1 9.166 0.02 . 1 . . . . 128 VAL H . 7059 1 1299 . 1 1 128 128 VAL HA H 1 5.773 0.02 . 1 . . . . 128 VAL HA . 7059 1 1300 . 1 1 128 128 VAL HB H 1 1.990 0.02 . 1 . . . . 128 VAL HB . 7059 1 1301 . 1 1 128 128 VAL HG11 H 1 0.844 0.02 . 2 . . . . 128 VAL HG1 . 7059 1 1302 . 1 1 128 128 VAL HG12 H 1 0.844 0.02 . 2 . . . . 128 VAL HG1 . 7059 1 1303 . 1 1 128 128 VAL HG13 H 1 0.844 0.02 . 2 . . . . 128 VAL HG1 . 7059 1 1304 . 1 1 128 128 VAL HG21 H 1 0.916 0.02 . 2 . . . . 128 VAL HG2 . 7059 1 1305 . 1 1 128 128 VAL HG22 H 1 0.916 0.02 . 2 . . . . 128 VAL HG2 . 7059 1 1306 . 1 1 128 128 VAL HG23 H 1 0.916 0.02 . 2 . . . . 128 VAL HG2 . 7059 1 1307 . 1 1 128 128 VAL C C 13 173.574 0.35 . 1 . . . . 128 VAL C . 7059 1 1308 . 1 1 128 128 VAL CA C 13 58.087 0.35 . 1 . . . . 128 VAL CA . 7059 1 1309 . 1 1 128 128 VAL CB C 13 35.360 0.35 . 1 . . . . 128 VAL CB . 7059 1 1310 . 1 1 128 128 VAL CG1 C 13 22.925 0.35 . 2 . . . . 128 VAL CG1 . 7059 1 1311 . 1 1 128 128 VAL CG2 C 13 19.428 0.35 . 2 . . . . 128 VAL CG2 . 7059 1 1312 . 1 1 128 128 VAL N N 15 113.727 0.2 . 1 . . . . 128 VAL N . 7059 1 1313 . 1 1 129 129 ASP H H 1 8.753 0.02 . 1 . . . . 129 ASP H . 7059 1 1314 . 1 1 129 129 ASP HA H 1 5.959 0.02 . 1 . . . . 129 ASP HA . 7059 1 1315 . 1 1 129 129 ASP HB2 H 1 2.427 0.02 . 2 . . . . 129 ASP HB2 . 7059 1 1316 . 1 1 129 129 ASP HB3 H 1 2.706 0.02 . 2 . . . . 129 ASP HB3 . 7059 1 1317 . 1 1 129 129 ASP C C 13 175.070 0.35 . 1 . . . . 129 ASP C . 7059 1 1318 . 1 1 129 129 ASP CA C 13 51.408 0.35 . 1 . . . . 129 ASP CA . 7059 1 1319 . 1 1 129 129 ASP CB C 13 42.382 0.35 . 1 . . . . 129 ASP CB . 7059 1 1320 . 1 1 129 129 ASP N N 15 122.512 0.2 . 1 . . . . 129 ASP N . 7059 1 1321 . 1 1 130 130 VAL H H 1 8.986 0.02 . 1 . . . . 130 VAL H . 7059 1 1322 . 1 1 130 130 VAL HA H 1 4.819 0.02 . 1 . . . . 130 VAL HA . 7059 1 1323 . 1 1 130 130 VAL HB H 1 1.893 0.02 . 1 . . . . 130 VAL HB . 7059 1 1324 . 1 1 130 130 VAL HG11 H 1 0.689 0.02 . 2 . . . . 130 VAL HG1 . 7059 1 1325 . 1 1 130 130 VAL HG12 H 1 0.689 0.02 . 2 . . . . 130 VAL HG1 . 7059 1 1326 . 1 1 130 130 VAL HG13 H 1 0.689 0.02 . 2 . . . . 130 VAL HG1 . 7059 1 1327 . 1 1 130 130 VAL HG21 H 1 0.956 0.02 . 2 . . . . 130 VAL HG2 . 7059 1 1328 . 1 1 130 130 VAL HG22 H 1 0.956 0.02 . 2 . . . . 130 VAL HG2 . 7059 1 1329 . 1 1 130 130 VAL HG23 H 1 0.956 0.02 . 2 . . . . 130 VAL HG2 . 7059 1 1330 . 1 1 130 130 VAL C C 13 174.436 0.35 . 1 . . . . 130 VAL C . 7059 1 1331 . 1 1 130 130 VAL CA C 13 61.553 0.35 . 1 . . . . 130 VAL CA . 7059 1 1332 . 1 1 130 130 VAL CB C 13 33.444 0.35 . 1 . . . . 130 VAL CB . 7059 1 1333 . 1 1 130 130 VAL CG1 C 13 20.541 0.35 . 2 . . . . 130 VAL CG1 . 7059 1 1334 . 1 1 130 130 VAL CG2 C 13 22.431 0.35 . 2 . . . . 130 VAL CG2 . 7059 1 1335 . 1 1 130 130 VAL N N 15 122.238 0.2 . 1 . . . . 130 VAL N . 7059 1 1336 . 1 1 131 131 VAL H H 1 8.278 0.02 . 1 . . . . 131 VAL H . 7059 1 1337 . 1 1 131 131 VAL HA H 1 4.516 0.02 . 1 . . . . 131 VAL HA . 7059 1 1338 . 1 1 131 131 VAL HB H 1 2.950 0.02 . 1 . . . . 131 VAL HB . 7059 1 1339 . 1 1 131 131 VAL HG11 H 1 0.769 0.02 . 2 . . . . 131 VAL HG1 . 7059 1 1340 . 1 1 131 131 VAL HG12 H 1 0.769 0.02 . 2 . . . . 131 VAL HG1 . 7059 1 1341 . 1 1 131 131 VAL HG13 H 1 0.769 0.02 . 2 . . . . 131 VAL HG1 . 7059 1 1342 . 1 1 131 131 VAL HG21 H 1 0.974 0.02 . 2 . . . . 131 VAL HG2 . 7059 1 1343 . 1 1 131 131 VAL HG22 H 1 0.974 0.02 . 2 . . . . 131 VAL HG2 . 7059 1 1344 . 1 1 131 131 VAL HG23 H 1 0.974 0.02 . 2 . . . . 131 VAL HG2 . 7059 1 1345 . 1 1 131 131 VAL C C 13 174.336 0.35 . 1 . . . . 131 VAL C . 7059 1 1346 . 1 1 131 131 VAL CA C 13 58.126 0.35 . 1 . . . . 131 VAL CA . 7059 1 1347 . 1 1 131 131 VAL CB C 13 34.141 0.35 . 1 . . . . 131 VAL CB . 7059 1 1348 . 1 1 131 131 VAL CG1 C 13 18.752 0.35 . 2 . . . . 131 VAL CG1 . 7059 1 1349 . 1 1 131 131 VAL CG2 C 13 24.485 0.35 . 2 . . . . 131 VAL CG2 . 7059 1 1350 . 1 1 131 131 VAL N N 15 116.149 0.2 . 1 . . . . 131 VAL N . 7059 1 1351 . 1 1 132 132 GLY H H 1 8.737 0.02 . 1 . . . . 132 GLY H . 7059 1 1352 . 1 1 132 132 GLY HA2 H 1 5.199 0.02 . 2 . . . . 132 GLY HA2 . 7059 1 1353 . 1 1 132 132 GLY HA3 H 1 4.475 0.02 . 2 . . . . 132 GLY HA3 . 7059 1 1354 . 1 1 132 132 GLY C C 13 171.281 0.35 . 1 . . . . 132 GLY C . 7059 1 1355 . 1 1 132 132 GLY CA C 13 43.991 0.35 . 1 . . . . 132 GLY CA . 7059 1 1356 . 1 1 132 132 GLY N N 15 105.587 0.2 . 1 . . . . 132 GLY N . 7059 1 1357 . 1 1 133 133 ILE H H 1 8.711 0.02 . 1 . . . . 133 ILE H . 7059 1 1358 . 1 1 133 133 ILE HA H 1 4.737 0.02 . 1 . . . . 133 ILE HA . 7059 1 1359 . 1 1 133 133 ILE HB H 1 1.776 0.02 . 1 . . . . 133 ILE HB . 7059 1 1360 . 1 1 133 133 ILE HG12 H 1 1.498 0.02 . 2 . . . . 133 ILE HG12 . 7059 1 1361 . 1 1 133 133 ILE HG13 H 1 1.017 0.02 . 2 . . . . 133 ILE HG13 . 7059 1 1362 . 1 1 133 133 ILE HG21 H 1 0.936 0.02 . 1 . . . . 133 ILE HG2 . 7059 1 1363 . 1 1 133 133 ILE HG22 H 1 0.936 0.02 . 1 . . . . 133 ILE HG2 . 7059 1 1364 . 1 1 133 133 ILE HG23 H 1 0.936 0.02 . 1 . . . . 133 ILE HG2 . 7059 1 1365 . 1 1 133 133 ILE HD11 H 1 0.763 0.02 . 1 . . . . 133 ILE HD1 . 7059 1 1366 . 1 1 133 133 ILE HD12 H 1 0.763 0.02 . 1 . . . . 133 ILE HD1 . 7059 1 1367 . 1 1 133 133 ILE HD13 H 1 0.763 0.02 . 1 . . . . 133 ILE HD1 . 7059 1 1368 . 1 1 133 133 ILE C C 13 174.552 0.35 . 1 . . . . 133 ILE C . 7059 1 1369 . 1 1 133 133 ILE CA C 13 55.349 0.35 . 1 . . . . 133 ILE CA . 7059 1 1370 . 1 1 133 133 ILE CB C 13 41.110 0.35 . 1 . . . . 133 ILE CB . 7059 1 1371 . 1 1 133 133 ILE CG1 C 13 33.859 0.35 . 1 . . . . 133 ILE CG1 . 7059 1 1372 . 1 1 133 133 ILE CG2 C 13 27.270 0.35 . 1 . . . . 133 ILE CG2 . 7059 1 1373 . 1 1 133 133 ILE CD1 C 13 24.992 0.35 . 1 . . . . 133 ILE CD1 . 7059 1 1374 . 1 1 133 133 ILE N N 15 121.274 0.2 . 1 . . . . 133 ILE N . 7059 1 1375 . 1 1 134 134 ALA H H 1 7.059 0.02 . 1 . . . . 134 ALA H . 7059 1 1376 . 1 1 134 134 ALA HA H 1 4.351 0.02 . 1 . . . . 134 ALA HA . 7059 1 1377 . 1 1 134 134 ALA HB1 H 1 1.808 0.02 . 1 . . . . 134 ALA HB . 7059 1 1378 . 1 1 134 134 ALA HB2 H 1 1.808 0.02 . 1 . . . . 134 ALA HB . 7059 1 1379 . 1 1 134 134 ALA HB3 H 1 1.808 0.02 . 1 . . . . 134 ALA HB . 7059 1 1380 . 1 1 134 134 ALA C C 13 181.156 0.35 . 1 . . . . 134 ALA C . 7059 1 1381 . 1 1 134 134 ALA CA C 13 52.216 0.35 . 1 . . . . 134 ALA CA . 7059 1 1382 . 1 1 134 134 ALA CB C 13 23.067 0.35 . 1 . . . . 134 ALA CB . 7059 1 1383 . 1 1 134 134 ALA N N 15 122.722 0.2 . 1 . . . . 134 ALA N . 7059 1 1384 . 1 1 135 135 THR H H 1 8.887 0.02 . 1 . . . . 135 THR H . 7059 1 1385 . 1 1 135 135 THR HA H 1 4.942 0.02 . 1 . . . . 135 THR HA . 7059 1 1386 . 1 1 135 135 THR HB H 1 3.655 0.02 . 1 . . . . 135 THR HB . 7059 1 1387 . 1 1 135 135 THR HG21 H 1 0.999 0.02 . 1 . . . . 135 THR HG2 . 7059 1 1388 . 1 1 135 135 THR HG22 H 1 0.999 0.02 . 1 . . . . 135 THR HG2 . 7059 1 1389 . 1 1 135 135 THR HG23 H 1 0.999 0.02 . 1 . . . . 135 THR HG2 . 7059 1 1390 . 1 1 135 135 THR C C 13 171.725 0.35 . 1 . . . . 135 THR C . 7059 1 1391 . 1 1 135 135 THR CA C 13 67.791 0.35 . 1 . . . . 135 THR CA . 7059 1 1392 . 1 1 135 135 THR CB C 13 69.428 0.35 . 1 . . . . 135 THR CB . 7059 1 1393 . 1 1 135 135 THR CG2 C 13 17.785 0.35 . 1 . . . . 135 THR CG2 . 7059 1 1394 . 1 1 135 135 THR N N 15 120.279 0.2 . 1 . . . . 135 THR N . 7059 1 1395 . 1 1 136 136 ASP H H 1 10.235 0.02 . 1 . . . . 136 ASP H . 7059 1 1396 . 1 1 136 136 ASP HA H 1 4.121 0.02 . 1 . . . . 136 ASP HA . 7059 1 1397 . 1 1 136 136 ASP HB2 H 1 2.675 0.02 . 1 . . . . 136 ASP HB2 . 7059 1 1398 . 1 1 136 136 ASP HB3 H 1 2.675 0.02 . 1 . . . . 136 ASP HB3 . 7059 1 1399 . 1 1 136 136 ASP C C 13 176.304 0.35 . 1 . . . . 136 ASP C . 7059 1 1400 . 1 1 136 136 ASP CA C 13 51.476 0.35 . 1 . . . . 136 ASP CA . 7059 1 1401 . 1 1 136 136 ASP CB C 13 37.878 0.35 . 1 . . . . 136 ASP CB . 7059 1 1402 . 1 1 136 136 ASP N N 15 106.486 0.2 . 1 . . . . 136 ASP N . 7059 1 1403 . 1 1 137 137 HIS H H 1 7.861 0.02 . 1 . . . . 137 HIS H . 7059 1 1404 . 1 1 137 137 HIS HA H 1 5.181 0.02 . 1 . . . . 137 HIS HA . 7059 1 1405 . 1 1 137 137 HIS HB2 H 1 3.893 0.02 . 1 . . . . 137 HIS HB2 . 7059 1 1406 . 1 1 137 137 HIS HB3 H 1 3.893 0.02 . 1 . . . . 137 HIS HB3 . 7059 1 1407 . 1 1 137 137 HIS C C 13 174.841 0.35 . 1 . . . . 137 HIS C . 7059 1 1408 . 1 1 137 137 HIS CA C 13 56.471 0.35 . 1 . . . . 137 HIS CA . 7059 1 1409 . 1 1 137 137 HIS CB C 13 31.812 0.35 . 1 . . . . 137 HIS CB . 7059 1 1410 . 1 1 137 137 HIS N N 15 120.538 0.2 . 1 . . . . 137 HIS N . 7059 1 1411 . 1 1 138 138 CYS H H 1 7.569 0.02 . 1 . . . . 138 CYS H . 7059 1 1412 . 1 1 138 138 CYS HA H 1 4.226 0.02 . 1 . . . . 138 CYS HA . 7059 1 1413 . 1 1 138 138 CYS HB2 H 1 1.996 0.02 . 1 . . . . 138 CYS HB2 . 7059 1 1414 . 1 1 138 138 CYS HB3 H 1 1.996 0.02 . 1 . . . . 138 CYS HB3 . 7059 1 1415 . 1 1 138 138 CYS C C 13 179.195 0.35 . 1 . . . . 138 CYS C . 7059 1 1416 . 1 1 138 138 CYS CA C 13 62.860 0.35 . 1 . . . . 138 CYS CA . 7059 1 1417 . 1 1 138 138 CYS CB C 13 27.418 0.35 . 1 . . . . 138 CYS CB . 7059 1 1418 . 1 1 138 138 CYS N N 15 115.925 0.2 . 1 . . . . 138 CYS N . 7059 1 1419 . 1 1 139 139 VAL H H 1 8.180 0.02 . 1 . . . . 139 VAL H . 7059 1 1420 . 1 1 139 139 VAL HA H 1 4.740 0.02 . 1 . . . . 139 VAL HA . 7059 1 1421 . 1 1 139 139 VAL HB H 1 2.158 0.02 . 1 . . . . 139 VAL HB . 7059 1 1422 . 1 1 139 139 VAL HG11 H 1 0.783 0.02 . 2 . . . . 139 VAL HG1 . 7059 1 1423 . 1 1 139 139 VAL HG12 H 1 0.783 0.02 . 2 . . . . 139 VAL HG1 . 7059 1 1424 . 1 1 139 139 VAL HG13 H 1 0.783 0.02 . 2 . . . . 139 VAL HG1 . 7059 1 1425 . 1 1 139 139 VAL HG21 H 1 0.862 0.02 . 2 . . . . 139 VAL HG2 . 7059 1 1426 . 1 1 139 139 VAL HG22 H 1 0.862 0.02 . 2 . . . . 139 VAL HG2 . 7059 1 1427 . 1 1 139 139 VAL HG23 H 1 0.862 0.02 . 2 . . . . 139 VAL HG2 . 7059 1 1428 . 1 1 139 139 VAL C C 13 175.283 0.35 . 1 . . . . 139 VAL C . 7059 1 1429 . 1 1 139 139 VAL CA C 13 68.127 0.35 . 1 . . . . 139 VAL CA . 7059 1 1430 . 1 1 139 139 VAL CB C 13 29.298 0.35 . 1 . . . . 139 VAL CB . 7059 1 1431 . 1 1 139 139 VAL CG1 C 13 18.937 0.35 . 2 . . . . 139 VAL CG1 . 7059 1 1432 . 1 1 139 139 VAL CG2 C 13 20.650 0.35 . 2 . . . . 139 VAL CG2 . 7059 1 1433 . 1 1 139 139 VAL N N 15 120.384 0.2 . 1 . . . . 139 VAL N . 7059 1 1434 . 1 1 140 140 ARG H H 1 6.031 0.02 . 1 . . . . 140 ARG H . 7059 1 1435 . 1 1 140 140 ARG HA H 1 3.960 0.02 . 1 . . . . 140 ARG HA . 7059 1 1436 . 1 1 140 140 ARG HB2 H 1 2.279 0.02 . 2 . . . . 140 ARG HB2 . 7059 1 1437 . 1 1 140 140 ARG HB3 H 1 2.001 0.02 . 2 . . . . 140 ARG HB3 . 7059 1 1438 . 1 1 140 140 ARG HG2 H 1 1.864 0.02 . 2 . . . . 140 ARG HG2 . 7059 1 1439 . 1 1 140 140 ARG HG3 H 1 1.423 0.02 . 2 . . . . 140 ARG HG3 . 7059 1 1440 . 1 1 140 140 ARG HD2 H 1 3.319 0.02 . 2 . . . . 140 ARG HD2 . 7059 1 1441 . 1 1 140 140 ARG HD3 H 1 2.935 0.02 . 2 . . . . 140 ARG HD3 . 7059 1 1442 . 1 1 140 140 ARG C C 13 177.823 0.35 . 1 . . . . 140 ARG C . 7059 1 1443 . 1 1 140 140 ARG CA C 13 58.696 0.35 . 1 . . . . 140 ARG CA . 7059 1 1444 . 1 1 140 140 ARG CB C 13 28.843 0.35 . 1 . . . . 140 ARG CB . 7059 1 1445 . 1 1 140 140 ARG CG C 13 27.337 0.35 . 1 . . . . 140 ARG CG . 7059 1 1446 . 1 1 140 140 ARG CD C 13 42.674 0.35 . 1 . . . . 140 ARG CD . 7059 1 1447 . 1 1 140 140 ARG N N 15 118.832 0.2 . 1 . . . . 140 ARG N . 7059 1 1448 . 1 1 141 141 GLN H H 1 8.116 0.02 . 1 . . . . 141 GLN H . 7059 1 1449 . 1 1 141 141 GLN HA H 1 3.961 0.02 . 1 . . . . 141 GLN HA . 7059 1 1450 . 1 1 141 141 GLN HB2 H 1 2.306 0.02 . 2 . . . . 141 GLN HB2 . 7059 1 1451 . 1 1 141 141 GLN HB3 H 1 2.278 0.02 . 2 . . . . 141 GLN HB3 . 7059 1 1452 . 1 1 141 141 GLN HG2 H 1 2.983 0.02 . 2 . . . . 141 GLN HG2 . 7059 1 1453 . 1 1 141 141 GLN HG3 H 1 2.942 0.02 . 2 . . . . 141 GLN HG3 . 7059 1 1454 . 1 1 141 141 GLN C C 13 178.494 0.35 . 1 . . . . 141 GLN C . 7059 1 1455 . 1 1 141 141 GLN CA C 13 58.552 0.35 . 1 . . . . 141 GLN CA . 7059 1 1456 . 1 1 141 141 GLN CB C 13 28.116 0.35 . 1 . . . . 141 GLN CB . 7059 1 1457 . 1 1 141 141 GLN CG C 13 33.607 0.35 . 1 . . . . 141 GLN CG . 7059 1 1458 . 1 1 141 141 GLN N N 15 115.778 0.2 . 1 . . . . 141 GLN N . 7059 1 1459 . 1 1 142 142 THR H H 1 8.678 0.02 . 1 . . . . 142 THR H . 7059 1 1460 . 1 1 142 142 THR HA H 1 4.330 0.02 . 1 . . . . 142 THR HA . 7059 1 1461 . 1 1 142 142 THR HB H 1 4.041 0.02 . 1 . . . . 142 THR HB . 7059 1 1462 . 1 1 142 142 THR HG21 H 1 0.978 0.02 . 1 . . . . 142 THR HG2 . 7059 1 1463 . 1 1 142 142 THR HG22 H 1 0.978 0.02 . 1 . . . . 142 THR HG2 . 7059 1 1464 . 1 1 142 142 THR HG23 H 1 0.978 0.02 . 1 . . . . 142 THR HG2 . 7059 1 1465 . 1 1 142 142 THR C C 13 175.830 0.35 . 1 . . . . 142 THR C . 7059 1 1466 . 1 1 142 142 THR CA C 13 67.460 0.35 . 1 . . . . 142 THR CA . 7059 1 1467 . 1 1 142 142 THR CB C 13 68.097 0.35 . 1 . . . . 142 THR CB . 7059 1 1468 . 1 1 142 142 THR CG2 C 13 16.402 0.35 . 1 . . . . 142 THR CG2 . 7059 1 1469 . 1 1 142 142 THR N N 15 115.552 0.2 . 1 . . . . 142 THR N . 7059 1 1470 . 1 1 143 143 ALA H H 1 8.626 0.02 . 1 . . . . 143 ALA H . 7059 1 1471 . 1 1 143 143 ALA HA H 1 3.967 0.02 . 1 . . . . 143 ALA HA . 7059 1 1472 . 1 1 143 143 ALA HB1 H 1 1.370 0.02 . 1 . . . . 143 ALA HB . 7059 1 1473 . 1 1 143 143 ALA HB2 H 1 1.370 0.02 . 1 . . . . 143 ALA HB . 7059 1 1474 . 1 1 143 143 ALA HB3 H 1 1.370 0.02 . 1 . . . . 143 ALA HB . 7059 1 1475 . 1 1 143 143 ALA C C 13 178.655 0.35 . 1 . . . . 143 ALA C . 7059 1 1476 . 1 1 143 143 ALA CA C 13 56.451 0.35 . 1 . . . . 143 ALA CA . 7059 1 1477 . 1 1 143 143 ALA CB C 13 18.212 0.35 . 1 . . . . 143 ALA CB . 7059 1 1478 . 1 1 143 143 ALA N N 15 122.484 0.2 . 1 . . . . 143 ALA N . 7059 1 1479 . 1 1 144 144 GLU H H 1 8.090 0.02 . 1 . . . . 144 GLU H . 7059 1 1480 . 1 1 144 144 GLU HA H 1 4.330 0.02 . 1 . . . . 144 GLU HA . 7059 1 1481 . 1 1 144 144 GLU HB2 H 1 2.017 0.02 . 1 . . . . 144 GLU HB2 . 7059 1 1482 . 1 1 144 144 GLU HB3 H 1 2.017 0.02 . 1 . . . . 144 GLU HB3 . 7059 1 1483 . 1 1 144 144 GLU HG2 H 1 1.645 0.02 . 1 . . . . 144 GLU HG2 . 7059 1 1484 . 1 1 144 144 GLU HG3 H 1 1.645 0.02 . 1 . . . . 144 GLU HG3 . 7059 1 1485 . 1 1 144 144 GLU C C 13 179.313 0.35 . 1 . . . . 144 GLU C . 7059 1 1486 . 1 1 144 144 GLU CA C 13 59.355 0.35 . 1 . . . . 144 GLU CA . 7059 1 1487 . 1 1 144 144 GLU CB C 13 27.301 0.35 . 1 . . . . 144 GLU CB . 7059 1 1488 . 1 1 144 144 GLU CG C 13 34.989 0.35 . 1 . . . . 144 GLU CG . 7059 1 1489 . 1 1 144 144 GLU N N 15 114.792 0.2 . 1 . . . . 144 GLU N . 7059 1 1490 . 1 1 145 145 ASP H H 1 8.474 0.02 . 1 . . . . 145 ASP H . 7059 1 1491 . 1 1 145 145 ASP HA H 1 4.282 0.02 . 1 . . . . 145 ASP HA . 7059 1 1492 . 1 1 145 145 ASP HB2 H 1 1.969 0.02 . 1 . . . . 145 ASP HB2 . 7059 1 1493 . 1 1 145 145 ASP HB3 H 1 1.969 0.02 . 1 . . . . 145 ASP HB3 . 7059 1 1494 . 1 1 145 145 ASP C C 13 178.330 0.35 . 1 . . . . 145 ASP C . 7059 1 1495 . 1 1 145 145 ASP CA C 13 56.567 0.35 . 1 . . . . 145 ASP CA . 7059 1 1496 . 1 1 145 145 ASP CB C 13 40.262 0.35 . 1 . . . . 145 ASP CB . 7059 1 1497 . 1 1 145 145 ASP N N 15 120.359 0.2 . 1 . . . . 145 ASP N . 7059 1 1498 . 1 1 146 146 ALA H H 1 8.076 0.02 . 1 . . . . 146 ALA H . 7059 1 1499 . 1 1 146 146 ALA HA H 1 3.329 0.02 . 1 . . . . 146 ALA HA . 7059 1 1500 . 1 1 146 146 ALA HB1 H 1 1.606 0.02 . 1 . . . . 146 ALA HB . 7059 1 1501 . 1 1 146 146 ALA HB2 H 1 1.606 0.02 . 1 . . . . 146 ALA HB . 7059 1 1502 . 1 1 146 146 ALA HB3 H 1 1.606 0.02 . 1 . . . . 146 ALA HB . 7059 1 1503 . 1 1 146 146 ALA C C 13 179.323 0.35 . 1 . . . . 146 ALA C . 7059 1 1504 . 1 1 146 146 ALA CA C 13 55.984 0.35 . 1 . . . . 146 ALA CA . 7059 1 1505 . 1 1 146 146 ALA CB C 13 17.555 0.35 . 1 . . . . 146 ALA CB . 7059 1 1506 . 1 1 146 146 ALA N N 15 124.668 0.2 . 1 . . . . 146 ALA N . 7059 1 1507 . 1 1 147 147 VAL H H 1 7.469 0.02 . 1 . . . . 147 VAL H . 7059 1 1508 . 1 1 147 147 VAL HA H 1 4.025 0.02 . 1 . . . . 147 VAL HA . 7059 1 1509 . 1 1 147 147 VAL HB H 1 2.014 0.02 . 1 . . . . 147 VAL HB . 7059 1 1510 . 1 1 147 147 VAL HG11 H 1 1.082 0.02 . 2 . . . . 147 VAL HG1 . 7059 1 1511 . 1 1 147 147 VAL HG12 H 1 1.082 0.02 . 2 . . . . 147 VAL HG1 . 7059 1 1512 . 1 1 147 147 VAL HG13 H 1 1.082 0.02 . 2 . . . . 147 VAL HG1 . 7059 1 1513 . 1 1 147 147 VAL HG21 H 1 1.145 0.02 . 2 . . . . 147 VAL HG2 . 7059 1 1514 . 1 1 147 147 VAL HG22 H 1 1.145 0.02 . 2 . . . . 147 VAL HG2 . 7059 1 1515 . 1 1 147 147 VAL HG23 H 1 1.145 0.02 . 2 . . . . 147 VAL HG2 . 7059 1 1516 . 1 1 147 147 VAL C C 13 181.625 0.35 . 1 . . . . 147 VAL C . 7059 1 1517 . 1 1 147 147 VAL CA C 13 65.596 0.35 . 1 . . . . 147 VAL CA . 7059 1 1518 . 1 1 147 147 VAL CB C 13 31.443 0.35 . 1 . . . . 147 VAL CB . 7059 1 1519 . 1 1 147 147 VAL CG1 C 13 19.902 0.35 . 2 . . . . 147 VAL CG1 . 7059 1 1520 . 1 1 147 147 VAL CG2 C 13 22.115 0.35 . 2 . . . . 147 VAL CG2 . 7059 1 1521 . 1 1 147 147 VAL N N 15 118.561 0.2 . 1 . . . . 147 VAL N . 7059 1 1522 . 1 1 148 148 ARG H H 1 7.997 0.02 . 1 . . . . 148 ARG H . 7059 1 1523 . 1 1 148 148 ARG HA H 1 4.068 0.02 . 1 . . . . 148 ARG HA . 7059 1 1524 . 1 1 148 148 ARG HB2 H 1 1.894 0.02 . 1 . . . . 148 ARG HB2 . 7059 1 1525 . 1 1 148 148 ARG HB3 H 1 1.894 0.02 . 1 . . . . 148 ARG HB3 . 7059 1 1526 . 1 1 148 148 ARG HG2 H 1 1.611 0.02 . 2 . . . . 148 ARG HG2 . 7059 1 1527 . 1 1 148 148 ARG HG3 H 1 1.175 0.02 . 2 . . . . 148 ARG HG3 . 7059 1 1528 . 1 1 148 148 ARG HD2 H 1 3.258 0.02 . 2 . . . . 148 ARG HD2 . 7059 1 1529 . 1 1 148 148 ARG HD3 H 1 3.157 0.02 . 2 . . . . 148 ARG HD3 . 7059 1 1530 . 1 1 148 148 ARG C C 13 177.689 0.35 . 1 . . . . 148 ARG C . 7059 1 1531 . 1 1 148 148 ARG CA C 13 58.830 0.35 . 1 . . . . 148 ARG CA . 7059 1 1532 . 1 1 148 148 ARG CB C 13 29.223 0.35 . 1 . . . . 148 ARG CB . 7059 1 1533 . 1 1 148 148 ARG CG C 13 27.086 0.35 . 1 . . . . 148 ARG CG . 7059 1 1534 . 1 1 148 148 ARG CD C 13 42.566 0.35 . 1 . . . . 148 ARG CD . 7059 1 1535 . 1 1 148 148 ARG N N 15 122.214 0.2 . 1 . . . . 148 ARG N . 7059 1 1536 . 1 1 149 149 ASN H H 1 7.479 0.02 . 1 . . . . 149 ASN H . 7059 1 1537 . 1 1 149 149 ASN HA H 1 4.663 0.02 . 1 . . . . 149 ASN HA . 7059 1 1538 . 1 1 149 149 ASN HB2 H 1 2.833 0.02 . 2 . . . . 149 ASN HB2 . 7059 1 1539 . 1 1 149 149 ASN HB3 H 1 2.294 0.02 . 2 . . . . 149 ASN HB3 . 7059 1 1540 . 1 1 149 149 ASN HD21 H 1 5.811 0.02 . 1 . . . . 149 ASN HD21 . 7059 1 1541 . 1 1 149 149 ASN C C 13 174.465 0.35 . 1 . . . . 149 ASN C . 7059 1 1542 . 1 1 149 149 ASN CA C 13 53.377 0.35 . 1 . . . . 149 ASN CA . 7059 1 1543 . 1 1 149 149 ASN CB C 13 39.373 0.35 . 1 . . . . 149 ASN CB . 7059 1 1544 . 1 1 149 149 ASN N N 15 115.230 0.2 . 1 . . . . 149 ASN N . 7059 1 1545 . 1 1 150 150 GLY H H 1 7.941 0.02 . 1 . . . . 150 GLY H . 7059 1 1546 . 1 1 150 150 GLY HA2 H 1 4.107 0.02 . 2 . . . . 150 GLY HA2 . 7059 1 1547 . 1 1 150 150 GLY HA3 H 1 3.824 0.02 . 2 . . . . 150 GLY HA3 . 7059 1 1548 . 1 1 150 150 GLY C C 13 174.352 0.35 . 1 . . . . 150 GLY C . 7059 1 1549 . 1 1 150 150 GLY CA C 13 45.856 0.35 . 1 . . . . 150 GLY CA . 7059 1 1550 . 1 1 150 150 GLY N N 15 106.808 0.2 . 1 . . . . 150 GLY N . 7059 1 1551 . 1 1 151 151 LEU H H 1 7.932 0.02 . 1 . . . . 151 LEU H . 7059 1 1552 . 1 1 151 151 LEU HA H 1 4.422 0.02 . 1 . . . . 151 LEU HA . 7059 1 1553 . 1 1 151 151 LEU HB2 H 1 0.933 0.02 . 1 . . . . 151 LEU HB2 . 7059 1 1554 . 1 1 151 151 LEU HB3 H 1 0.933 0.02 . 1 . . . . 151 LEU HB3 . 7059 1 1555 . 1 1 151 151 LEU HG H 1 1.444 0.02 . 1 . . . . 151 LEU HG . 7059 1 1556 . 1 1 151 151 LEU HD11 H 1 0.769 0.02 . 2 . . . . 151 LEU HD1 . 7059 1 1557 . 1 1 151 151 LEU HD12 H 1 0.769 0.02 . 2 . . . . 151 LEU HD1 . 7059 1 1558 . 1 1 151 151 LEU HD13 H 1 0.769 0.02 . 2 . . . . 151 LEU HD1 . 7059 1 1559 . 1 1 151 151 LEU HD21 H 1 0.715 0.02 . 2 . . . . 151 LEU HD2 . 7059 1 1560 . 1 1 151 151 LEU HD22 H 1 0.715 0.02 . 2 . . . . 151 LEU HD2 . 7059 1 1561 . 1 1 151 151 LEU HD23 H 1 0.715 0.02 . 2 . . . . 151 LEU HD2 . 7059 1 1562 . 1 1 151 151 LEU C C 13 177.626 0.35 . 1 . . . . 151 LEU C . 7059 1 1563 . 1 1 151 151 LEU CA C 13 53.424 0.35 . 1 . . . . 151 LEU CA . 7059 1 1564 . 1 1 151 151 LEU CB C 13 40.790 0.35 . 1 . . . . 151 LEU CB . 7059 1 1565 . 1 1 151 151 LEU CG C 13 26.453 0.35 . 1 . . . . 151 LEU CG . 7059 1 1566 . 1 1 151 151 LEU CD1 C 13 20.045 0.35 . 1 . . . . 151 LEU CD1 . 7059 1 1567 . 1 1 151 151 LEU CD2 C 13 20.045 0.35 . 1 . . . . 151 LEU CD2 . 7059 1 1568 . 1 1 151 151 LEU N N 15 120.462 0.2 . 1 . . . . 151 LEU N . 7059 1 1569 . 1 1 152 152 ALA H H 1 8.170 0.02 . 1 . . . . 152 ALA H . 7059 1 1570 . 1 1 152 152 ALA HA H 1 4.408 0.02 . 1 . . . . 152 ALA HA . 7059 1 1571 . 1 1 152 152 ALA HB1 H 1 1.601 0.02 . 1 . . . . 152 ALA HB . 7059 1 1572 . 1 1 152 152 ALA HB2 H 1 1.601 0.02 . 1 . . . . 152 ALA HB . 7059 1 1573 . 1 1 152 152 ALA HB3 H 1 1.601 0.02 . 1 . . . . 152 ALA HB . 7059 1 1574 . 1 1 152 152 ALA C C 13 177.656 0.35 . 1 . . . . 152 ALA C . 7059 1 1575 . 1 1 152 152 ALA CA C 13 53.184 0.35 . 1 . . . . 152 ALA CA . 7059 1 1576 . 1 1 152 152 ALA CB C 13 17.703 0.35 . 1 . . . . 152 ALA CB . 7059 1 1577 . 1 1 152 152 ALA N N 15 130.167 0.2 . 1 . . . . 152 ALA N . 7059 1 1578 . 1 1 153 153 THR H H 1 8.732 0.02 . 1 . . . . 153 THR H . 7059 1 1579 . 1 1 153 153 THR HA H 1 5.402 0.02 . 1 . . . . 153 THR HA . 7059 1 1580 . 1 1 153 153 THR HB H 1 3.693 0.02 . 1 . . . . 153 THR HB . 7059 1 1581 . 1 1 153 153 THR HG21 H 1 1.142 0.02 . 1 . . . . 153 THR HG2 . 7059 1 1582 . 1 1 153 153 THR HG22 H 1 1.142 0.02 . 1 . . . . 153 THR HG2 . 7059 1 1583 . 1 1 153 153 THR HG23 H 1 1.142 0.02 . 1 . . . . 153 THR HG2 . 7059 1 1584 . 1 1 153 153 THR C C 13 173.850 0.35 . 1 . . . . 153 THR C . 7059 1 1585 . 1 1 153 153 THR CA C 13 63.352 0.35 . 1 . . . . 153 THR CA . 7059 1 1586 . 1 1 153 153 THR CB C 13 70.505 0.35 . 1 . . . . 153 THR CB . 7059 1 1587 . 1 1 153 153 THR CG2 C 13 23.776 0.35 . 1 . . . . 153 THR CG2 . 7059 1 1588 . 1 1 153 153 THR N N 15 124.053 0.2 . 1 . . . . 153 THR N . 7059 1 1589 . 1 1 154 154 ARG H H 1 9.032 0.02 . 1 . . . . 154 ARG H . 7059 1 1590 . 1 1 154 154 ARG HA H 1 5.661 0.02 . 1 . . . . 154 ARG HA . 7059 1 1591 . 1 1 154 154 ARG HB2 H 1 2.161 0.02 . 2 . . . . 154 ARG HB2 . 7059 1 1592 . 1 1 154 154 ARG HB3 H 1 1.494 0.02 . 2 . . . . 154 ARG HB3 . 7059 1 1593 . 1 1 154 154 ARG HG2 H 1 1.922 0.02 . 2 . . . . 154 ARG HG2 . 7059 1 1594 . 1 1 154 154 ARG HG3 H 1 1.545 0.02 . 2 . . . . 154 ARG HG3 . 7059 1 1595 . 1 1 154 154 ARG HD2 H 1 2.867 0.02 . 2 . . . . 154 ARG HD2 . 7059 1 1596 . 1 1 154 154 ARG HD3 H 1 3.347 0.02 . 2 . . . . 154 ARG HD3 . 7059 1 1597 . 1 1 154 154 ARG C C 13 175.818 0.35 . 1 . . . . 154 ARG C . 7059 1 1598 . 1 1 154 154 ARG CA C 13 53.092 0.35 . 1 . . . . 154 ARG CA . 7059 1 1599 . 1 1 154 154 ARG CB C 13 32.119 0.35 . 1 . . . . 154 ARG CB . 7059 1 1600 . 1 1 154 154 ARG CG C 13 24.433 0.35 . 1 . . . . 154 ARG CG . 7059 1 1601 . 1 1 154 154 ARG CD C 13 43.225 0.35 . 1 . . . . 154 ARG CD . 7059 1 1602 . 1 1 154 154 ARG N N 15 124.985 0.2 . 1 . . . . 154 ARG N . 7059 1 1603 . 1 1 155 155 VAL H H 1 8.655 0.02 . 1 . . . . 155 VAL H . 7059 1 1604 . 1 1 155 155 VAL HA H 1 4.584 0.02 . 1 . . . . 155 VAL HA . 7059 1 1605 . 1 1 155 155 VAL HB H 1 1.690 0.02 . 1 . . . . 155 VAL HB . 7059 1 1606 . 1 1 155 155 VAL HG11 H 1 0.578 0.02 . 2 . . . . 155 VAL HG1 . 7059 1 1607 . 1 1 155 155 VAL HG12 H 1 0.578 0.02 . 2 . . . . 155 VAL HG1 . 7059 1 1608 . 1 1 155 155 VAL HG13 H 1 0.578 0.02 . 2 . . . . 155 VAL HG1 . 7059 1 1609 . 1 1 155 155 VAL HG21 H 1 0.743 0.02 . 2 . . . . 155 VAL HG2 . 7059 1 1610 . 1 1 155 155 VAL HG22 H 1 0.743 0.02 . 2 . . . . 155 VAL HG2 . 7059 1 1611 . 1 1 155 155 VAL HG23 H 1 0.743 0.02 . 2 . . . . 155 VAL HG2 . 7059 1 1612 . 1 1 155 155 VAL C C 13 174.901 0.35 . 1 . . . . 155 VAL C . 7059 1 1613 . 1 1 155 155 VAL CA C 13 60.493 0.35 . 1 . . . . 155 VAL CA . 7059 1 1614 . 1 1 155 155 VAL CB C 13 33.197 0.35 . 1 . . . . 155 VAL CB . 7059 1 1615 . 1 1 155 155 VAL CG1 C 13 20.404 0.35 . 2 . . . . 155 VAL CG1 . 7059 1 1616 . 1 1 155 155 VAL CG2 C 13 22.324 0.35 . 2 . . . . 155 VAL CG2 . 7059 1 1617 . 1 1 155 155 VAL N N 15 121.499 0.2 . 1 . . . . 155 VAL N . 7059 1 1618 . 1 1 156 156 LEU H H 1 6.924 0.02 . 1 . . . . 156 LEU H . 7059 1 1619 . 1 1 156 156 LEU HA H 1 4.985 0.02 . 1 . . . . 156 LEU HA . 7059 1 1620 . 1 1 156 156 LEU HB2 H 1 1.115 0.02 . 1 . . . . 156 LEU HB2 . 7059 1 1621 . 1 1 156 156 LEU HB3 H 1 1.115 0.02 . 1 . . . . 156 LEU HB3 . 7059 1 1622 . 1 1 156 156 LEU HG H 1 1.295 0.02 . 1 . . . . 156 LEU HG . 7059 1 1623 . 1 1 156 156 LEU HD11 H 1 0.678 0.02 . 2 . . . . 156 LEU HD1 . 7059 1 1624 . 1 1 156 156 LEU HD12 H 1 0.678 0.02 . 2 . . . . 156 LEU HD1 . 7059 1 1625 . 1 1 156 156 LEU HD13 H 1 0.678 0.02 . 2 . . . . 156 LEU HD1 . 7059 1 1626 . 1 1 156 156 LEU HD21 H 1 0.519 0.02 . 2 . . . . 156 LEU HD2 . 7059 1 1627 . 1 1 156 156 LEU HD22 H 1 0.519 0.02 . 2 . . . . 156 LEU HD2 . 7059 1 1628 . 1 1 156 156 LEU HD23 H 1 0.519 0.02 . 2 . . . . 156 LEU HD2 . 7059 1 1629 . 1 1 156 156 LEU C C 13 177.137 0.35 . 1 . . . . 156 LEU C . 7059 1 1630 . 1 1 156 156 LEU CA C 13 52.286 0.35 . 1 . . . . 156 LEU CA . 7059 1 1631 . 1 1 156 156 LEU CB C 13 37.057 0.35 . 1 . . . . 156 LEU CB . 7059 1 1632 . 1 1 156 156 LEU CG C 13 27.148 0.35 . 1 . . . . 156 LEU CG . 7059 1 1633 . 1 1 156 156 LEU N N 15 126.602 0.2 . 1 . . . . 156 LEU N . 7059 1 1634 . 1 1 157 157 VAL H H 1 8.324 0.02 . 1 . . . . 157 VAL H . 7059 1 1635 . 1 1 157 157 VAL HA H 1 3.354 0.02 . 1 . . . . 157 VAL HA . 7059 1 1636 . 1 1 157 157 VAL HB H 1 1.993 0.02 . 1 . . . . 157 VAL HB . 7059 1 1637 . 1 1 157 157 VAL HG11 H 1 0.881 0.02 . 2 . . . . 157 VAL HG1 . 7059 1 1638 . 1 1 157 157 VAL HG12 H 1 0.881 0.02 . 2 . . . . 157 VAL HG1 . 7059 1 1639 . 1 1 157 157 VAL HG13 H 1 0.881 0.02 . 2 . . . . 157 VAL HG1 . 7059 1 1640 . 1 1 157 157 VAL HG21 H 1 0.934 0.02 . 2 . . . . 157 VAL HG2 . 7059 1 1641 . 1 1 157 157 VAL HG22 H 1 0.934 0.02 . 2 . . . . 157 VAL HG2 . 7059 1 1642 . 1 1 157 157 VAL HG23 H 1 0.934 0.02 . 2 . . . . 157 VAL HG2 . 7059 1 1643 . 1 1 157 157 VAL C C 13 177.716 0.35 . 1 . . . . 157 VAL C . 7059 1 1644 . 1 1 157 157 VAL CA C 13 65.887 0.35 . 1 . . . . 157 VAL CA . 7059 1 1645 . 1 1 157 157 VAL CB C 13 31.589 0.35 . 1 . . . . 157 VAL CB . 7059 1 1646 . 1 1 157 157 VAL CG1 C 13 21.258 0.35 . 1 . . . . 157 VAL CG1 . 7059 1 1647 . 1 1 157 157 VAL CG2 C 13 21.258 0.35 . 1 . . . . 157 VAL CG2 . 7059 1 1648 . 1 1 157 157 VAL N N 15 121.556 0.2 . 1 . . . . 157 VAL N . 7059 1 1649 . 1 1 158 158 ASP H H 1 9.527 0.02 . 1 . . . . 158 ASP H . 7059 1 1650 . 1 1 158 158 ASP HA H 1 4.474 0.02 . 1 . . . . 158 ASP HA . 7059 1 1651 . 1 1 158 158 ASP HB2 H 1 2.747 0.02 . 1 . . . . 158 ASP HB2 . 7059 1 1652 . 1 1 158 158 ASP HB3 H 1 2.747 0.02 . 1 . . . . 158 ASP HB3 . 7059 1 1653 . 1 1 158 158 ASP C C 13 175.961 0.35 . 1 . . . . 158 ASP C . 7059 1 1654 . 1 1 158 158 ASP CA C 13 55.020 0.35 . 1 . . . . 158 ASP CA . 7059 1 1655 . 1 1 158 158 ASP CB C 13 38.024 0.35 . 1 . . . . 158 ASP CB . 7059 1 1656 . 1 1 158 158 ASP N N 15 116.870 0.2 . 1 . . . . 158 ASP N . 7059 1 1657 . 1 1 159 159 LEU H H 1 7.842 0.02 . 1 . . . . 159 LEU H . 7059 1 1658 . 1 1 159 159 LEU HA H 1 4.581 0.02 . 1 . . . . 159 LEU HA . 7059 1 1659 . 1 1 159 159 LEU HB2 H 1 1.615 0.02 . 1 . . . . 159 LEU HB2 . 7059 1 1660 . 1 1 159 159 LEU HB3 H 1 1.615 0.02 . 1 . . . . 159 LEU HB3 . 7059 1 1661 . 1 1 159 159 LEU HG H 1 1.256 0.02 . 1 . . . . 159 LEU HG . 7059 1 1662 . 1 1 159 159 LEU HD11 H 1 0.584 0.02 . 2 . . . . 159 LEU HD1 . 7059 1 1663 . 1 1 159 159 LEU HD12 H 1 0.584 0.02 . 2 . . . . 159 LEU HD1 . 7059 1 1664 . 1 1 159 159 LEU HD13 H 1 0.584 0.02 . 2 . . . . 159 LEU HD1 . 7059 1 1665 . 1 1 159 159 LEU HD21 H 1 0.326 0.02 . 2 . . . . 159 LEU HD2 . 7059 1 1666 . 1 1 159 159 LEU HD22 H 1 0.326 0.02 . 2 . . . . 159 LEU HD2 . 7059 1 1667 . 1 1 159 159 LEU HD23 H 1 0.326 0.02 . 2 . . . . 159 LEU HD2 . 7059 1 1668 . 1 1 159 159 LEU C C 13 174.676 0.35 . 1 . . . . 159 LEU C . 7059 1 1669 . 1 1 159 159 LEU CA C 13 53.038 0.35 . 1 . . . . 159 LEU CA . 7059 1 1670 . 1 1 159 159 LEU CB C 13 39.508 0.35 . 1 . . . . 159 LEU CB . 7059 1 1671 . 1 1 159 159 LEU CG C 13 24.863 0.35 . 1 . . . . 159 LEU CG . 7059 1 1672 . 1 1 159 159 LEU CD1 C 13 22.273 0.35 . 1 . . . . 159 LEU CD1 . 7059 1 1673 . 1 1 159 159 LEU CD2 C 13 22.273 0.35 . 1 . . . . 159 LEU CD2 . 7059 1 1674 . 1 1 159 159 LEU N N 15 121.365 0.2 . 1 . . . . 159 LEU N . 7059 1 1675 . 1 1 160 160 THR H H 1 7.134 0.02 . 1 . . . . 160 THR H . 7059 1 1676 . 1 1 160 160 THR HA H 1 5.656 0.02 . 1 . . . . 160 THR HA . 7059 1 1677 . 1 1 160 160 THR HB H 1 4.184 0.02 . 1 . . . . 160 THR HB . 7059 1 1678 . 1 1 160 160 THR HG21 H 1 1.114 0.02 . 1 . . . . 160 THR HG2 . 7059 1 1679 . 1 1 160 160 THR HG22 H 1 1.114 0.02 . 1 . . . . 160 THR HG2 . 7059 1 1680 . 1 1 160 160 THR HG23 H 1 1.114 0.02 . 1 . . . . 160 THR HG2 . 7059 1 1681 . 1 1 160 160 THR C C 13 172.602 0.35 . 1 . . . . 160 THR C . 7059 1 1682 . 1 1 160 160 THR CA C 13 59.193 0.35 . 1 . . . . 160 THR CA . 7059 1 1683 . 1 1 160 160 THR CB C 13 72.207 0.35 . 1 . . . . 160 THR CB . 7059 1 1684 . 1 1 160 160 THR CG2 C 13 21.622 0.35 . 1 . . . . 160 THR CG2 . 7059 1 1685 . 1 1 160 160 THR N N 15 108.099 0.2 . 1 . . . . 160 THR N . 7059 1 1686 . 1 1 161 161 ALA H H 1 7.198 0.02 . 1 . . . . 161 ALA H . 7059 1 1687 . 1 1 161 161 ALA HA H 1 4.695 0.02 . 1 . . . . 161 ALA HA . 7059 1 1688 . 1 1 161 161 ALA HB1 H 1 1.280 0.02 . 1 . . . . 161 ALA HB . 7059 1 1689 . 1 1 161 161 ALA HB2 H 1 1.280 0.02 . 1 . . . . 161 ALA HB . 7059 1 1690 . 1 1 161 161 ALA HB3 H 1 1.280 0.02 . 1 . . . . 161 ALA HB . 7059 1 1691 . 1 1 161 161 ALA C C 13 177.088 0.35 . 1 . . . . 161 ALA C . 7059 1 1692 . 1 1 161 161 ALA CA C 13 51.543 0.35 . 1 . . . . 161 ALA CA . 7059 1 1693 . 1 1 161 161 ALA CB C 13 21.289 0.35 . 1 . . . . 161 ALA CB . 7059 1 1694 . 1 1 161 161 ALA N N 15 121.331 0.2 . 1 . . . . 161 ALA N . 7059 1 1695 . 1 1 162 162 GLY H H 1 8.553 0.02 . 1 . . . . 162 GLY H . 7059 1 1696 . 1 1 162 162 GLY HA2 H 1 4.765 0.02 . 2 . . . . 162 GLY HA2 . 7059 1 1697 . 1 1 162 162 GLY HA3 H 1 4.048 0.02 . 2 . . . . 162 GLY HA3 . 7059 1 1698 . 1 1 162 162 GLY C C 13 173.493 0.35 . 1 . . . . 162 GLY C . 7059 1 1699 . 1 1 162 162 GLY CA C 13 43.252 0.35 . 1 . . . . 162 GLY CA . 7059 1 1700 . 1 1 162 162 GLY N N 15 110.274 0.2 . 1 . . . . 162 GLY N . 7059 1 1701 . 1 1 163 163 VAL H H 1 10.892 0.02 . 1 . . . . 163 VAL H . 7059 1 1702 . 1 1 163 163 VAL HA H 1 3.832 0.02 . 1 . . . . 163 VAL HA . 7059 1 1703 . 1 1 163 163 VAL HB H 1 2.498 0.02 . 1 . . . . 163 VAL HB . 7059 1 1704 . 1 1 163 163 VAL HG11 H 1 0.783 0.02 . 2 . . . . 163 VAL HG1 . 7059 1 1705 . 1 1 163 163 VAL HG12 H 1 0.783 0.02 . 2 . . . . 163 VAL HG1 . 7059 1 1706 . 1 1 163 163 VAL HG13 H 1 0.783 0.02 . 2 . . . . 163 VAL HG1 . 7059 1 1707 . 1 1 163 163 VAL HG21 H 1 1.002 0.02 . 2 . . . . 163 VAL HG2 . 7059 1 1708 . 1 1 163 163 VAL HG22 H 1 1.002 0.02 . 2 . . . . 163 VAL HG2 . 7059 1 1709 . 1 1 163 163 VAL HG23 H 1 1.002 0.02 . 2 . . . . 163 VAL HG2 . 7059 1 1710 . 1 1 163 163 VAL C C 13 177.604 0.35 . 1 . . . . 163 VAL C . 7059 1 1711 . 1 1 163 163 VAL CA C 13 66.405 0.35 . 1 . . . . 163 VAL CA . 7059 1 1712 . 1 1 163 163 VAL CB C 13 30.897 0.35 . 1 . . . . 163 VAL CB . 7059 1 1713 . 1 1 163 163 VAL CG1 C 13 20.571 0.35 . 1 . . . . 163 VAL CG1 . 7059 1 1714 . 1 1 163 163 VAL CG2 C 13 20.571 0.35 . 1 . . . . 163 VAL CG2 . 7059 1 1715 . 1 1 163 163 VAL N N 15 124.700 0.2 . 1 . . . . 163 VAL N . 7059 1 1716 . 1 1 164 164 SER H H 1 8.145 0.02 . 1 . . . . 164 SER H . 7059 1 1717 . 1 1 164 164 SER HA H 1 4.250 0.02 . 1 . . . . 164 SER HA . 7059 1 1718 . 1 1 164 164 SER HB2 H 1 3.928 0.02 . 1 . . . . 164 SER HB2 . 7059 1 1719 . 1 1 164 164 SER HB3 H 1 3.928 0.02 . 1 . . . . 164 SER HB3 . 7059 1 1720 . 1 1 164 164 SER C C 13 175.380 0.35 . 1 . . . . 164 SER C . 7059 1 1721 . 1 1 164 164 SER CA C 13 56.372 0.35 . 1 . . . . 164 SER CA . 7059 1 1722 . 1 1 164 164 SER CB C 13 65.620 0.35 . 1 . . . . 164 SER CB . 7059 1 1723 . 1 1 164 164 SER N N 15 111.289 0.2 . 1 . . . . 164 SER N . 7059 1 1724 . 1 1 165 165 ALA H H 1 8.076 0.02 . 1 . . . . 165 ALA H . 7059 1 1725 . 1 1 165 165 ALA HA H 1 4.089 0.02 . 1 . . . . 165 ALA HA . 7059 1 1726 . 1 1 165 165 ALA HB1 H 1 1.551 0.02 . 1 . . . . 165 ALA HB . 7059 1 1727 . 1 1 165 165 ALA HB2 H 1 1.551 0.02 . 1 . . . . 165 ALA HB . 7059 1 1728 . 1 1 165 165 ALA HB3 H 1 1.551 0.02 . 1 . . . . 165 ALA HB . 7059 1 1729 . 1 1 165 165 ALA C C 13 179.887 0.35 . 1 . . . . 165 ALA C . 7059 1 1730 . 1 1 165 165 ALA CA C 13 55.967 0.35 . 1 . . . . 165 ALA CA . 7059 1 1731 . 1 1 165 165 ALA CB C 13 17.633 0.35 . 1 . . . . 165 ALA CB . 7059 1 1732 . 1 1 165 165 ALA N N 15 124.557 0.2 . 1 . . . . 165 ALA N . 7059 1 1733 . 1 1 166 166 ASP H H 1 8.708 0.02 . 1 . . . . 166 ASP H . 7059 1 1734 . 1 1 166 166 ASP HA H 1 4.408 0.02 . 1 . . . . 166 ASP HA . 7059 1 1735 . 1 1 166 166 ASP HB2 H 1 2.757 0.02 . 1 . . . . 166 ASP HB2 . 7059 1 1736 . 1 1 166 166 ASP HB3 H 1 2.757 0.02 . 1 . . . . 166 ASP HB3 . 7059 1 1737 . 1 1 166 166 ASP C C 13 179.860 0.35 . 1 . . . . 166 ASP C . 7059 1 1738 . 1 1 166 166 ASP CA C 13 56.932 0.35 . 1 . . . . 166 ASP CA . 7059 1 1739 . 1 1 166 166 ASP CB C 13 38.948 0.35 . 1 . . . . 166 ASP CB . 7059 1 1740 . 1 1 166 166 ASP N N 15 116.346 0.2 . 1 . . . . 166 ASP N . 7059 1 1741 . 1 1 167 167 THR H H 1 7.887 0.02 . 1 . . . . 167 THR H . 7059 1 1742 . 1 1 167 167 THR HA H 1 4.185 0.02 . 1 . . . . 167 THR HA . 7059 1 1743 . 1 1 167 167 THR HB H 1 4.646 0.02 . 1 . . . . 167 THR HB . 7059 1 1744 . 1 1 167 167 THR HG21 H 1 0.824 0.02 . 1 . . . . 167 THR HG2 . 7059 1 1745 . 1 1 167 167 THR HG22 H 1 0.824 0.02 . 1 . . . . 167 THR HG2 . 7059 1 1746 . 1 1 167 167 THR HG23 H 1 0.824 0.02 . 1 . . . . 167 THR HG2 . 7059 1 1747 . 1 1 167 167 THR C C 13 178.844 0.35 . 1 . . . . 167 THR C . 7059 1 1748 . 1 1 167 167 THR CA C 13 64.217 0.35 . 1 . . . . 167 THR CA . 7059 1 1749 . 1 1 167 167 THR CB C 13 67.067 0.35 . 1 . . . . 167 THR CB . 7059 1 1750 . 1 1 167 167 THR CG2 C 13 18.684 0.35 . 1 . . . . 167 THR CG2 . 7059 1 1751 . 1 1 167 167 THR N N 15 111.338 0.2 . 1 . . . . 167 THR N . 7059 1 1752 . 1 1 168 168 THR H H 1 8.385 0.02 . 1 . . . . 168 THR H . 7059 1 1753 . 1 1 168 168 THR HA H 1 4.339 0.02 . 1 . . . . 168 THR HA . 7059 1 1754 . 1 1 168 168 THR HB H 1 3.743 0.02 . 1 . . . . 168 THR HB . 7059 1 1755 . 1 1 168 168 THR HG21 H 1 1.077 0.02 . 1 . . . . 168 THR HG2 . 7059 1 1756 . 1 1 168 168 THR HG22 H 1 1.077 0.02 . 1 . . . . 168 THR HG2 . 7059 1 1757 . 1 1 168 168 THR HG23 H 1 1.077 0.02 . 1 . . . . 168 THR HG2 . 7059 1 1758 . 1 1 168 168 THR C C 13 174.915 0.35 . 1 . . . . 168 THR C . 7059 1 1759 . 1 1 168 168 THR CA C 13 69.474 0.35 . 1 . . . . 168 THR CA . 7059 1 1760 . 1 1 168 168 THR CB C 13 67.502 0.35 . 1 . . . . 168 THR CB . 7059 1 1761 . 1 1 168 168 THR CG2 C 13 19.428 0.35 . 1 . . . . 168 THR CG2 . 7059 1 1762 . 1 1 168 168 THR N N 15 123.826 0.2 . 1 . . . . 168 THR N . 7059 1 1763 . 1 1 169 169 VAL H H 1 7.969 0.02 . 1 . . . . 169 VAL H . 7059 1 1764 . 1 1 169 169 VAL HA H 1 3.614 0.02 . 1 . . . . 169 VAL HA . 7059 1 1765 . 1 1 169 169 VAL HB H 1 2.111 0.02 . 1 . . . . 169 VAL HB . 7059 1 1766 . 1 1 169 169 VAL HG11 H 1 0.997 0.02 . 2 . . . . 169 VAL HG1 . 7059 1 1767 . 1 1 169 169 VAL HG12 H 1 0.997 0.02 . 2 . . . . 169 VAL HG1 . 7059 1 1768 . 1 1 169 169 VAL HG13 H 1 0.997 0.02 . 2 . . . . 169 VAL HG1 . 7059 1 1769 . 1 1 169 169 VAL HG21 H 1 1.137 0.02 . 2 . . . . 169 VAL HG2 . 7059 1 1770 . 1 1 169 169 VAL HG22 H 1 1.137 0.02 . 2 . . . . 169 VAL HG2 . 7059 1 1771 . 1 1 169 169 VAL HG23 H 1 1.137 0.02 . 2 . . . . 169 VAL HG2 . 7059 1 1772 . 1 1 169 169 VAL C C 13 178.992 0.35 . 1 . . . . 169 VAL C . 7059 1 1773 . 1 1 169 169 VAL CA C 13 67.072 0.35 . 1 . . . . 169 VAL CA . 7059 1 1774 . 1 1 169 169 VAL CB C 13 31.074 0.35 . 1 . . . . 169 VAL CB . 7059 1 1775 . 1 1 169 169 VAL CG1 C 13 19.885 0.35 . 2 . . . . 169 VAL CG1 . 7059 1 1776 . 1 1 169 169 VAL CG2 C 13 21.766 0.35 . 2 . . . . 169 VAL CG2 . 7059 1 1777 . 1 1 169 169 VAL N N 15 121.595 0.2 . 1 . . . . 169 VAL N . 7059 1 1778 . 1 1 170 170 ALA H H 1 7.325 0.02 . 1 . . . . 170 ALA H . 7059 1 1779 . 1 1 170 170 ALA HA H 1 4.172 0.02 . 1 . . . . 170 ALA HA . 7059 1 1780 . 1 1 170 170 ALA HB1 H 1 1.439 0.02 . 1 . . . . 170 ALA HB . 7059 1 1781 . 1 1 170 170 ALA HB2 H 1 1.439 0.02 . 1 . . . . 170 ALA HB . 7059 1 1782 . 1 1 170 170 ALA HB3 H 1 1.439 0.02 . 1 . . . . 170 ALA HB . 7059 1 1783 . 1 1 170 170 ALA C C 13 180.153 0.35 . 1 . . . . 170 ALA C . 7059 1 1784 . 1 1 170 170 ALA CA C 13 54.613 0.35 . 1 . . . . 170 ALA CA . 7059 1 1785 . 1 1 170 170 ALA CB C 13 17.784 0.35 . 1 . . . . 170 ALA CB . 7059 1 1786 . 1 1 170 170 ALA N N 15 120.395 0.2 . 1 . . . . 170 ALA N . 7059 1 1787 . 1 1 171 171 ALA H H 1 8.212 0.02 . 1 . . . . 171 ALA H . 7059 1 1788 . 1 1 171 171 ALA HA H 1 4.025 0.02 . 1 . . . . 171 ALA HA . 7059 1 1789 . 1 1 171 171 ALA HB1 H 1 1.400 0.02 . 1 . . . . 171 ALA HB . 7059 1 1790 . 1 1 171 171 ALA HB2 H 1 1.400 0.02 . 1 . . . . 171 ALA HB . 7059 1 1791 . 1 1 171 171 ALA HB3 H 1 1.400 0.02 . 1 . . . . 171 ALA HB . 7059 1 1792 . 1 1 171 171 ALA C C 13 178.775 0.35 . 1 . . . . 171 ALA C . 7059 1 1793 . 1 1 171 171 ALA CA C 13 53.759 0.35 . 1 . . . . 171 ALA CA . 7059 1 1794 . 1 1 171 171 ALA CB C 13 18.795 0.35 . 1 . . . . 171 ALA CB . 7059 1 1795 . 1 1 171 171 ALA N N 15 121.252 0.2 . 1 . . . . 171 ALA N . 7059 1 1796 . 1 1 172 172 LEU H H 1 8.252 0.02 . 1 . . . . 172 LEU H . 7059 1 1797 . 1 1 172 172 LEU HA H 1 3.961 0.02 . 1 . . . . 172 LEU HA . 7059 1 1798 . 1 1 172 172 LEU HB2 H 1 1.358 0.02 . 2 . . . . 172 LEU HB2 . 7059 1 1799 . 1 1 172 172 LEU HB3 H 1 2.147 0.02 . 2 . . . . 172 LEU HB3 . 7059 1 1800 . 1 1 172 172 LEU HG H 1 0.747 0.02 . 1 . . . . 172 LEU HG . 7059 1 1801 . 1 1 172 172 LEU C C 13 178.059 0.35 . 1 . . . . 172 LEU C . 7059 1 1802 . 1 1 172 172 LEU CA C 13 56.622 0.35 . 1 . . . . 172 LEU CA . 7059 1 1803 . 1 1 172 172 LEU CB C 13 40.799 0.35 . 1 . . . . 172 LEU CB . 7059 1 1804 . 1 1 172 172 LEU CG C 13 26.014 0.35 . 1 . . . . 172 LEU CG . 7059 1 1805 . 1 1 172 172 LEU CD1 C 13 22.286 0.35 . 1 . . . . 172 LEU CD1 . 7059 1 1806 . 1 1 172 172 LEU CD2 C 13 22.286 0.35 . 1 . . . . 172 LEU CD2 . 7059 1 1807 . 1 1 172 172 LEU N N 15 118.823 0.2 . 1 . . . . 172 LEU N . 7059 1 1808 . 1 1 173 173 GLU H H 1 7.521 0.02 . 1 . . . . 173 GLU H . 7059 1 1809 . 1 1 173 173 GLU HA H 1 4.169 0.02 . 1 . . . . 173 GLU HA . 7059 1 1810 . 1 1 173 173 GLU HB2 H 1 2.116 0.02 . 1 . . . . 173 GLU HB2 . 7059 1 1811 . 1 1 173 173 GLU HB3 H 1 2.116 0.02 . 1 . . . . 173 GLU HB3 . 7059 1 1812 . 1 1 173 173 GLU HG2 H 1 2.252 0.02 . 1 . . . . 173 GLU HG2 . 7059 1 1813 . 1 1 173 173 GLU HG3 H 1 2.252 0.02 . 1 . . . . 173 GLU HG3 . 7059 1 1814 . 1 1 173 173 GLU C C 13 177.323 0.35 . 1 . . . . 173 GLU C . 7059 1 1815 . 1 1 173 173 GLU CA C 13 57.370 0.35 . 1 . . . . 173 GLU CA . 7059 1 1816 . 1 1 173 173 GLU CB C 13 29.126 0.35 . 1 . . . . 173 GLU CB . 7059 1 1817 . 1 1 173 173 GLU CG C 13 34.571 0.35 . 1 . . . . 173 GLU CG . 7059 1 1818 . 1 1 173 173 GLU N N 15 118.117 0.2 . 1 . . . . 173 GLU N . 7059 1 1819 . 1 1 174 174 GLU H H 1 8.297 0.02 . 1 . . . . 174 GLU H . 7059 1 1820 . 1 1 174 174 GLU HA H 1 3.996 0.02 . 1 . . . . 174 GLU HA . 7059 1 1821 . 1 1 174 174 GLU HB2 H 1 2.072 0.02 . 1 . . . . 174 GLU HB2 . 7059 1 1822 . 1 1 174 174 GLU HB3 H 1 2.072 0.02 . 1 . . . . 174 GLU HB3 . 7059 1 1823 . 1 1 174 174 GLU HG2 H 1 2.411 0.02 . 1 . . . . 174 GLU HG2 . 7059 1 1824 . 1 1 174 174 GLU HG3 H 1 2.411 0.02 . 1 . . . . 174 GLU HG3 . 7059 1 1825 . 1 1 174 174 GLU C C 13 180.336 0.35 . 1 . . . . 174 GLU C . 7059 1 1826 . 1 1 174 174 GLU CA C 13 58.672 0.35 . 1 . . . . 174 GLU CA . 7059 1 1827 . 1 1 174 174 GLU CB C 13 30.038 0.35 . 1 . . . . 174 GLU CB . 7059 1 1828 . 1 1 174 174 GLU CG C 13 35.486 0.35 . 1 . . . . 174 GLU CG . 7059 1 1829 . 1 1 174 174 GLU N N 15 120.927 0.2 . 1 . . . . 174 GLU N . 7059 1 1830 . 1 1 175 175 MET H H 1 8.698 0.02 . 1 . . . . 175 MET H . 7059 1 1831 . 1 1 175 175 MET HA H 1 3.913 0.02 . 1 . . . . 175 MET HA . 7059 1 1832 . 1 1 175 175 MET HB2 H 1 2.885 0.02 . 1 . . . . 175 MET HB2 . 7059 1 1833 . 1 1 175 175 MET HB3 H 1 2.885 0.02 . 1 . . . . 175 MET HB3 . 7059 1 1834 . 1 1 175 175 MET HG2 H 1 3.404 0.02 . 1 . . . . 175 MET HG2 . 7059 1 1835 . 1 1 175 175 MET HG3 H 1 3.404 0.02 . 1 . . . . 175 MET HG3 . 7059 1 1836 . 1 1 175 175 MET C C 13 177.818 0.35 . 1 . . . . 175 MET C . 7059 1 1837 . 1 1 175 175 MET CA C 13 60.501 0.35 . 1 . . . . 175 MET CA . 7059 1 1838 . 1 1 175 175 MET CB C 13 34.208 0.35 . 1 . . . . 175 MET CB . 7059 1 1839 . 1 1 175 175 MET CG C 13 33.788 0.35 . 1 . . . . 175 MET CG . 7059 1 1840 . 1 1 175 175 MET CE C 13 23.331 0.35 . 1 . . . . 175 MET CE . 7059 1 1841 . 1 1 175 175 MET N N 15 118.555 0.2 . 1 . . . . 175 MET N . 7059 1 1842 . 1 1 176 176 ARG H H 1 8.226 0.02 . 1 . . . . 176 ARG H . 7059 1 1843 . 1 1 176 176 ARG HA H 1 4.377 0.02 . 1 . . . . 176 ARG HA . 7059 1 1844 . 1 1 176 176 ARG HB2 H 1 2.039 0.02 . 1 . . . . 176 ARG HB2 . 7059 1 1845 . 1 1 176 176 ARG HB3 H 1 2.039 0.02 . 1 . . . . 176 ARG HB3 . 7059 1 1846 . 1 1 176 176 ARG HG2 H 1 1.886 0.02 . 2 . . . . 176 ARG HG2 . 7059 1 1847 . 1 1 176 176 ARG HG3 H 1 1.642 0.02 . 2 . . . . 176 ARG HG3 . 7059 1 1848 . 1 1 176 176 ARG HD2 H 1 3.248 0.02 . 2 . . . . 176 ARG HD2 . 7059 1 1849 . 1 1 176 176 ARG HD3 H 1 3.071 0.02 . 2 . . . . 176 ARG HD3 . 7059 1 1850 . 1 1 176 176 ARG C C 13 181.473 0.35 . 1 . . . . 176 ARG C . 7059 1 1851 . 1 1 176 176 ARG CA C 13 59.275 0.35 . 1 . . . . 176 ARG CA . 7059 1 1852 . 1 1 176 176 ARG CB C 13 29.199 0.35 . 1 . . . . 176 ARG CB . 7059 1 1853 . 1 1 176 176 ARG CG C 13 26.205 0.35 . 1 . . . . 176 ARG CG . 7059 1 1854 . 1 1 176 176 ARG CD C 13 42.646 0.35 . 1 . . . . 176 ARG CD . 7059 1 1855 . 1 1 176 176 ARG N N 15 120.195 0.2 . 1 . . . . 176 ARG N . 7059 1 1856 . 1 1 177 177 THR H H 1 8.099 0.02 . 1 . . . . 177 THR H . 7059 1 1857 . 1 1 177 177 THR HA H 1 4.077 0.02 . 1 . . . . 177 THR HA . 7059 1 1858 . 1 1 177 177 THR HB H 1 4.387 0.02 . 1 . . . . 177 THR HB . 7059 1 1859 . 1 1 177 177 THR HG21 H 1 0.819 0.02 . 1 . . . . 177 THR HG2 . 7059 1 1860 . 1 1 177 177 THR HG22 H 1 0.819 0.02 . 1 . . . . 177 THR HG2 . 7059 1 1861 . 1 1 177 177 THR HG23 H 1 0.819 0.02 . 1 . . . . 177 THR HG2 . 7059 1 1862 . 1 1 177 177 THR C C 13 174.760 0.35 . 1 . . . . 177 THR C . 7059 1 1863 . 1 1 177 177 THR CA C 13 65.277 0.35 . 1 . . . . 177 THR CA . 7059 1 1864 . 1 1 177 177 THR CB C 13 68.485 0.35 . 1 . . . . 177 THR CB . 7059 1 1865 . 1 1 177 177 THR CG2 C 13 20.263 0.35 . 1 . . . . 177 THR CG2 . 7059 1 1866 . 1 1 177 177 THR N N 15 115.706 0.2 . 1 . . . . 177 THR N . 7059 1 1867 . 1 1 178 178 ALA H H 1 7.634 0.02 . 1 . . . . 178 ALA H . 7059 1 1868 . 1 1 178 178 ALA HA H 1 4.487 0.02 . 1 . . . . 178 ALA HA . 7059 1 1869 . 1 1 178 178 ALA HB1 H 1 1.554 0.02 . 1 . . . . 178 ALA HB . 7059 1 1870 . 1 1 178 178 ALA HB2 H 1 1.554 0.02 . 1 . . . . 178 ALA HB . 7059 1 1871 . 1 1 178 178 ALA HB3 H 1 1.554 0.02 . 1 . . . . 178 ALA HB . 7059 1 1872 . 1 1 178 178 ALA C C 13 176.199 0.35 . 1 . . . . 178 ALA C . 7059 1 1873 . 1 1 178 178 ALA CA C 13 51.894 0.35 . 1 . . . . 178 ALA CA . 7059 1 1874 . 1 1 178 178 ALA CB C 13 17.863 0.35 . 1 . . . . 178 ALA CB . 7059 1 1875 . 1 1 178 178 ALA N N 15 124.309 0.2 . 1 . . . . 178 ALA N . 7059 1 1876 . 1 1 179 179 SER H H 1 7.653 0.02 . 1 . . . . 179 SER H . 7059 1 1877 . 1 1 179 179 SER HA H 1 3.977 0.02 . 1 . . . . 179 SER HA . 7059 1 1878 . 1 1 179 179 SER HB2 H 1 4.400 0.02 . 1 . . . . 179 SER HB2 . 7059 1 1879 . 1 1 179 179 SER HB3 H 1 4.400 0.02 . 1 . . . . 179 SER HB3 . 7059 1 1880 . 1 1 179 179 SER C C 13 174.310 0.35 . 1 . . . . 179 SER C . 7059 1 1881 . 1 1 179 179 SER CA C 13 60.384 0.35 . 1 . . . . 179 SER CA . 7059 1 1882 . 1 1 179 179 SER CB C 13 61.389 0.35 . 1 . . . . 179 SER CB . 7059 1 1883 . 1 1 179 179 SER N N 15 107.362 0.2 . 1 . . . . 179 SER N . 7059 1 1884 . 1 1 180 180 VAL H H 1 7.859 0.02 . 1 . . . . 180 VAL H . 7059 1 1885 . 1 1 180 180 VAL HA H 1 3.707 0.02 . 1 . . . . 180 VAL HA . 7059 1 1886 . 1 1 180 180 VAL HB H 1 1.678 0.02 . 1 . . . . 180 VAL HB . 7059 1 1887 . 1 1 180 180 VAL HG11 H 1 0.672 0.02 . 2 . . . . 180 VAL HG1 . 7059 1 1888 . 1 1 180 180 VAL HG12 H 1 0.672 0.02 . 2 . . . . 180 VAL HG1 . 7059 1 1889 . 1 1 180 180 VAL HG13 H 1 0.672 0.02 . 2 . . . . 180 VAL HG1 . 7059 1 1890 . 1 1 180 180 VAL HG21 H 1 0.764 0.02 . 2 . . . . 180 VAL HG2 . 7059 1 1891 . 1 1 180 180 VAL HG22 H 1 0.764 0.02 . 2 . . . . 180 VAL HG2 . 7059 1 1892 . 1 1 180 180 VAL HG23 H 1 0.764 0.02 . 2 . . . . 180 VAL HG2 . 7059 1 1893 . 1 1 180 180 VAL C C 13 175.776 0.35 . 1 . . . . 180 VAL C . 7059 1 1894 . 1 1 180 180 VAL CA C 13 62.329 0.35 . 1 . . . . 180 VAL CA . 7059 1 1895 . 1 1 180 180 VAL CB C 13 31.752 0.35 . 1 . . . . 180 VAL CB . 7059 1 1896 . 1 1 180 180 VAL CG1 C 13 21.026 0.35 . 1 . . . . 180 VAL CG1 . 7059 1 1897 . 1 1 180 180 VAL CG2 C 13 21.026 0.35 . 1 . . . . 180 VAL CG2 . 7059 1 1898 . 1 1 180 180 VAL N N 15 121.650 0.2 . 1 . . . . 180 VAL N . 7059 1 1899 . 1 1 181 181 GLU H H 1 8.391 0.02 . 1 . . . . 181 GLU H . 7059 1 1900 . 1 1 181 181 GLU HA H 1 4.335 0.02 . 1 . . . . 181 GLU HA . 7059 1 1901 . 1 1 181 181 GLU HB2 H 1 2.038 0.02 . 1 . . . . 181 GLU HB2 . 7059 1 1902 . 1 1 181 181 GLU HB3 H 1 2.038 0.02 . 1 . . . . 181 GLU HB3 . 7059 1 1903 . 1 1 181 181 GLU HG2 H 1 2.719 0.02 . 1 . . . . 181 GLU HG2 . 7059 1 1904 . 1 1 181 181 GLU HG3 H 1 2.719 0.02 . 1 . . . . 181 GLU HG3 . 7059 1 1905 . 1 1 181 181 GLU C C 13 174.992 0.35 . 1 . . . . 181 GLU C . 7059 1 1906 . 1 1 181 181 GLU CA C 13 56.049 0.35 . 1 . . . . 181 GLU CA . 7059 1 1907 . 1 1 181 181 GLU CB C 13 30.099 0.35 . 1 . . . . 181 GLU CB . 7059 1 1908 . 1 1 181 181 GLU CG C 13 34.747 0.35 . 1 . . . . 181 GLU CG . 7059 1 1909 . 1 1 181 181 GLU N N 15 128.477 0.2 . 1 . . . . 181 GLU N . 7059 1 1910 . 1 1 182 182 LEU H H 1 8.477 0.02 . 1 . . . . 182 LEU H . 7059 1 1911 . 1 1 182 182 LEU HA H 1 4.948 0.02 . 1 . . . . 182 LEU HA . 7059 1 1912 . 1 1 182 182 LEU HB2 H 1 1.915 0.02 . 2 . . . . 182 LEU HB2 . 7059 1 1913 . 1 1 182 182 LEU HB3 H 1 1.222 0.02 . 2 . . . . 182 LEU HB3 . 7059 1 1914 . 1 1 182 182 LEU HG H 1 1.682 0.02 . 1 . . . . 182 LEU HG . 7059 1 1915 . 1 1 182 182 LEU HD11 H 1 0.996 0.02 . 2 . . . . 182 LEU HD1 . 7059 1 1916 . 1 1 182 182 LEU HD12 H 1 0.996 0.02 . 2 . . . . 182 LEU HD1 . 7059 1 1917 . 1 1 182 182 LEU HD13 H 1 0.996 0.02 . 2 . . . . 182 LEU HD1 . 7059 1 1918 . 1 1 182 182 LEU HD21 H 1 0.772 0.02 . 2 . . . . 182 LEU HD2 . 7059 1 1919 . 1 1 182 182 LEU HD22 H 1 0.772 0.02 . 2 . . . . 182 LEU HD2 . 7059 1 1920 . 1 1 182 182 LEU HD23 H 1 0.772 0.02 . 2 . . . . 182 LEU HD2 . 7059 1 1921 . 1 1 182 182 LEU C C 13 176.349 0.35 . 1 . . . . 182 LEU C . 7059 1 1922 . 1 1 182 182 LEU CA C 13 53.496 0.35 . 1 . . . . 182 LEU CA . 7059 1 1923 . 1 1 182 182 LEU CB C 13 40.508 0.35 . 1 . . . . 182 LEU CB . 7059 1 1924 . 1 1 182 182 LEU CG C 13 25.736 0.35 . 1 . . . . 182 LEU CG . 7059 1 1925 . 1 1 182 182 LEU CD1 C 13 22.124 0.35 . 2 . . . . 182 LEU CD1 . 7059 1 1926 . 1 1 182 182 LEU CD2 C 13 19.998 0.35 . 2 . . . . 182 LEU CD2 . 7059 1 1927 . 1 1 182 182 LEU N N 15 127.113 0.2 . 1 . . . . 182 LEU N . 7059 1 1928 . 1 1 183 183 VAL H H 1 8.383 0.02 . 1 . . . . 183 VAL H . 7059 1 1929 . 1 1 183 183 VAL HA H 1 4.684 0.02 . 1 . . . . 183 VAL HA . 7059 1 1930 . 1 1 183 183 VAL HB H 1 2.124 0.02 . 1 . . . . 183 VAL HB . 7059 1 1931 . 1 1 183 183 VAL HG11 H 1 0.710 0.02 . 2 . . . . 183 VAL HG1 . 7059 1 1932 . 1 1 183 183 VAL HG12 H 1 0.710 0.02 . 2 . . . . 183 VAL HG1 . 7059 1 1933 . 1 1 183 183 VAL HG13 H 1 0.710 0.02 . 2 . . . . 183 VAL HG1 . 7059 1 1934 . 1 1 183 183 VAL HG21 H 1 0.854 0.02 . 2 . . . . 183 VAL HG2 . 7059 1 1935 . 1 1 183 183 VAL HG22 H 1 0.854 0.02 . 2 . . . . 183 VAL HG2 . 7059 1 1936 . 1 1 183 183 VAL HG23 H 1 0.854 0.02 . 2 . . . . 183 VAL HG2 . 7059 1 1937 . 1 1 183 183 VAL C C 13 174.478 0.35 . 1 . . . . 183 VAL C . 7059 1 1938 . 1 1 183 183 VAL CA C 13 59.394 0.35 . 1 . . . . 183 VAL CA . 7059 1 1939 . 1 1 183 183 VAL CB C 13 34.829 0.35 . 1 . . . . 183 VAL CB . 7059 1 1940 . 1 1 183 183 VAL CG1 C 13 25.416 0.35 . 1 . . . . 183 VAL CG1 . 7059 1 1941 . 1 1 183 183 VAL CG2 C 13 25.416 0.35 . 1 . . . . 183 VAL CG2 . 7059 1 1942 . 1 1 183 183 VAL N N 15 120.118 0.2 . 1 . . . . 183 VAL N . 7059 1 1943 . 1 1 184 184 CYS H H 1 8.318 0.02 . 1 . . . . 184 CYS H . 7059 1 1944 . 1 1 184 184 CYS HA H 1 4.848 0.02 . 1 . . . . 184 CYS HA . 7059 1 1945 . 1 1 184 184 CYS HB2 H 1 2.793 0.02 . 1 . . . . 184 CYS HB2 . 7059 1 1946 . 1 1 184 184 CYS HB3 H 1 2.793 0.02 . 1 . . . . 184 CYS HB3 . 7059 1 1947 . 1 1 184 184 CYS HG H 1 3.881 0.02 . 1 . . . . 184 CYS HG . 7059 1 1948 . 1 1 184 184 CYS C C 13 175.436 0.35 . 1 . . . . 184 CYS C . 7059 1 1949 . 1 1 184 184 CYS CA C 13 57.611 0.35 . 1 . . . . 184 CYS CA . 7059 1 1950 . 1 1 184 184 CYS CB C 13 28.799 0.35 . 1 . . . . 184 CYS CB . 7059 1 1951 . 1 1 184 184 CYS N N 15 119.859 0.2 . 1 . . . . 184 CYS N . 7059 1 1952 . 1 1 185 185 SER H H 1 10.398 0.02 . 1 . . . . 185 SER H . 7059 1 1953 . 1 1 185 185 SER HA H 1 4.124 0.02 . 1 . . . . 185 SER HA . 7059 1 1954 . 1 1 185 185 SER HB2 H 1 3.544 0.02 . 1 . . . . 185 SER HB2 . 7059 1 1955 . 1 1 185 185 SER HB3 H 1 3.544 0.02 . 1 . . . . 185 SER HB3 . 7059 1 1956 . 1 1 185 185 SER C C 13 174.893 0.35 . 1 . . . . 185 SER C . 7059 1 1957 . 1 1 185 185 SER CA C 13 59.751 0.35 . 1 . . . . 185 SER CA . 7059 1 1958 . 1 1 185 185 SER CB C 13 63.423 0.35 . 1 . . . . 185 SER CB . 7059 1 1959 . 1 1 185 185 SER N N 15 123.036 0.2 . 1 . . . . 185 SER N . 7059 1 1960 . 1 1 186 186 SER H H 1 8.109 0.02 . 1 . . . . 186 SER H . 7059 1 1961 . 1 1 186 186 SER HA H 1 4.534 0.02 . 1 . . . . 186 SER HA . 7059 1 1962 . 1 1 186 186 SER HB2 H 1 4.282 0.02 . 2 . . . . 186 SER HB2 . 7059 1 1963 . 1 1 186 186 SER HB3 H 1 3.509 0.02 . 2 . . . . 186 SER HB3 . 7059 1 1964 . 1 1 186 186 SER C C 13 175.102 0.35 . 1 . . . . 186 SER C . 7059 1 1965 . 1 1 186 186 SER CA C 13 58.881 0.35 . 1 . . . . 186 SER CA . 7059 1 1966 . 1 1 186 186 SER CB C 13 63.248 0.35 . 1 . . . . 186 SER CB . 7059 1 1967 . 1 1 186 186 SER N N 15 115.014 0.2 . 1 . . . . 186 SER N . 7059 1 stop_ save_