data_5686 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5686 _Entry.Title ; Backbone 1H, 13C and 15N resonance assignments of the 50kD response regulator HP1043 from Helicobactor pylori ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2003-02-04 _Entry.Accession_date 2003-02-04 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _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 Eunmi Hong . . . 5686 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5686 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 1522 5686 '13C chemical shifts' 872 5686 '15N chemical shifts' 208 5686 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2005-08-16 . update author 'chemical shift table update' 5686 2 . . 2004-01-11 . original author 'Original release' 5686 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5686 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 14739642 _Citation.Full_citation . _Citation.Title ; Letter to the Editor: Backbone 1H, 13C and 15N resonance assignments of the response regulator HP1043 from Helicobactor pylori ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 28 _Citation.Journal_issue 1 _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 85 _Citation.Page_last 86 _Citation.Year 2004 _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 Eunmi Hong . . . 5686 1 2 Jin-Won Jung . . . 5686 1 3 Joon Shin . . . 5686 1 4 Jin-Hwan Kim . . . 5686 1 5 Young-Ho Jeon . . . 5686 1 6 Toshio Yamazaki . . . 5686 1 7 Weontae Lee . . . 5686 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Helicobactor pylori' 5686 1 'response regulator' 5686 1 'sequence-specific assignments' 5686 1 TROSY 5686 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_HP1043 _Assembly.Sf_category assembly _Assembly.Sf_framecode system_HP1043 _Assembly.Entry_ID 5686 _Assembly.ID 1 _Assembly.Name HP1043 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not reported' _Assembly.Molecular_mass . _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 dimer 5686 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 'HP1043 subunit 1' 1 $HP1043 . . . native . . 1 . . 5686 1 2 'HP1043 subunit 2' 1 $HP1043 . . . native . . 1 . . 5686 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID HP1043 system 5686 1 HP1043 abbreviation 5686 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HP1043 _Entity.Sf_category entity _Entity.Sf_framecode HP1043 _Entity.Entry_ID 5686 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Helicobactor pylori 1043' _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 ; MRVLLIEKNSVLGGEIEKGL NVKGFMADVTESLEDGEYLM DIRNYDLVMVSDKNALSFVS RIKEKHSSIVVLVSSDNPTS EEEVHAFEQGADDYIAKPYR SIKALVARIEARLRFWGSNV IEIGDLTISPDEEKIIYKGR EVEVKGKPFEVLTHLARHRD QIVSKEQLLDAIWEEPEMVT PNVIEVAINQIRQKMDKPLG ISTVETVRRRGYRFCYPKPA CEE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 223 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not reported' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 25468.2 _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 2HQO . "Structure Of A Atypical Orphan Response Regulator Protein Revealed A New Phosphorylation-Independent Regulatory Mechanism" . . . . . 54.26 123 98.35 100.00 6.20e-78 . . . . 5686 1 2 no PDB 2HQR . "Structure Of A Atypical Orphan Response Regulator Protein Revealed A New Phosphorylation-Independent Regulatory Mechanism" . . . . . 100.00 223 100.00 100.00 3.78e-160 . . . . 5686 1 3 no PDB 2PLN . "Crystal Structure Analysis Of Hp1043, An Orphan Resonse Regulator Of H. Pylori" . . . . . 52.91 137 97.46 97.46 3.80e-73 . . . . 5686 1 4 no DBJ BAJ55005 . "putative transcriptional regulator [Helicobacter pylori F16]" . . . . . 100.00 223 100.00 100.00 3.78e-160 . . . . 5686 1 5 no DBJ BAJ56990 . "putative transcriptional regulator [Helicobacter pylori F30]" . . . . . 100.00 223 98.21 99.55 1.70e-158 . . . . 5686 1 6 no DBJ BAJ58486 . "putative transcriptional regulator [Helicobacter pylori F32]" . . . . . 100.00 223 99.10 100.00 1.22e-159 . . . . 5686 1 7 no DBJ BAJ59530 . "putative transcriptional regulator [Helicobacter pylori F57]" . . . . . 100.00 223 100.00 100.00 3.78e-160 . . . . 5686 1 8 no DBJ BAM96319 . "putative transcriptional regulator [Helicobacter pylori OK113]" . . . . . 100.00 223 99.55 100.00 5.92e-160 . . . . 5686 1 9 no EMBL CAX28949 . "Putative two-component response regulator [Helicobacter pylori B38]" . . . . . 100.00 223 99.55 99.55 1.85e-159 . . . . 5686 1 10 no EMBL CBI66718 . "two-component system, OmpR family, response regulator [Helicobacter pylori B8]" . . . . . 100.00 223 99.55 100.00 5.92e-160 . . . . 5686 1 11 no GB AAD05966 . "putative TRANSCRIPTIONAL REGULATOR [Helicobacter pylori J99]" . . . . . 100.00 223 100.00 100.00 3.78e-160 . . . . 5686 1 12 no GB AAD08088 . "response regulator [Helicobacter pylori 26695]" . . . . . 100.00 223 99.55 99.55 2.51e-159 . . . . 5686 1 13 no GB ABF84471 . "putative transcriptional regulator [Helicobacter pylori HPAG1]" . . . . . 100.00 223 100.00 100.00 3.78e-160 . . . . 5686 1 14 no GB ACD47870 . "putative transcriptional regulator [Helicobacter pylori Shi470]" . . . . . 100.00 223 99.10 99.10 1.25e-158 . . . . 5686 1 15 no GB ACI27150 . "putative transcriptional regulator [Helicobacter pylori G27]" . . . . . 100.00 223 100.00 100.00 3.78e-160 . . . . 5686 1 16 no REF NP_207833 . "response regulator [Helicobacter pylori 26695]" . . . . . 100.00 223 99.55 99.55 2.51e-159 . . . . 5686 1 17 no REF NP_223100 . "transcriptional regulator [Helicobacter pylori J99]" . . . . . 100.00 223 100.00 100.00 3.78e-160 . . . . 5686 1 18 no REF WP_001221517 . "chemotaxis protein CheY [Helicobacter pylori]" . . . . . 100.00 223 98.65 99.55 8.83e-159 . . . . 5686 1 19 no REF WP_001221518 . "chemotaxis protein CheY [Helicobacter pylori]" . . . . . 100.00 223 98.21 99.55 1.70e-158 . . . . 5686 1 20 no REF WP_001221519 . "chemotaxis protein CheY [Helicobacter pylori]" . . . . . 100.00 223 99.10 100.00 1.02e-159 . . . . 5686 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Helicobactor pylori 1043' common 5686 1 HP1043 abbreviation 5686 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 . 5686 1 2 . ARG . 5686 1 3 . VAL . 5686 1 4 . LEU . 5686 1 5 . LEU . 5686 1 6 . ILE . 5686 1 7 . GLU . 5686 1 8 . LYS . 5686 1 9 . ASN . 5686 1 10 . SER . 5686 1 11 . VAL . 5686 1 12 . LEU . 5686 1 13 . GLY . 5686 1 14 . GLY . 5686 1 15 . GLU . 5686 1 16 . ILE . 5686 1 17 . GLU . 5686 1 18 . LYS . 5686 1 19 . GLY . 5686 1 20 . LEU . 5686 1 21 . ASN . 5686 1 22 . VAL . 5686 1 23 . LYS . 5686 1 24 . GLY . 5686 1 25 . PHE . 5686 1 26 . MET . 5686 1 27 . ALA . 5686 1 28 . ASP . 5686 1 29 . VAL . 5686 1 30 . THR . 5686 1 31 . GLU . 5686 1 32 . SER . 5686 1 33 . LEU . 5686 1 34 . GLU . 5686 1 35 . ASP . 5686 1 36 . GLY . 5686 1 37 . GLU . 5686 1 38 . TYR . 5686 1 39 . LEU . 5686 1 40 . MET . 5686 1 41 . ASP . 5686 1 42 . ILE . 5686 1 43 . ARG . 5686 1 44 . ASN . 5686 1 45 . TYR . 5686 1 46 . ASP . 5686 1 47 . LEU . 5686 1 48 . VAL . 5686 1 49 . MET . 5686 1 50 . VAL . 5686 1 51 . SER . 5686 1 52 . ASP . 5686 1 53 . LYS . 5686 1 54 . ASN . 5686 1 55 . ALA . 5686 1 56 . LEU . 5686 1 57 . SER . 5686 1 58 . PHE . 5686 1 59 . VAL . 5686 1 60 . SER . 5686 1 61 . ARG . 5686 1 62 . ILE . 5686 1 63 . LYS . 5686 1 64 . GLU . 5686 1 65 . LYS . 5686 1 66 . HIS . 5686 1 67 . SER . 5686 1 68 . SER . 5686 1 69 . ILE . 5686 1 70 . VAL . 5686 1 71 . VAL . 5686 1 72 . LEU . 5686 1 73 . VAL . 5686 1 74 . SER . 5686 1 75 . SER . 5686 1 76 . ASP . 5686 1 77 . ASN . 5686 1 78 . PRO . 5686 1 79 . THR . 5686 1 80 . SER . 5686 1 81 . GLU . 5686 1 82 . GLU . 5686 1 83 . GLU . 5686 1 84 . VAL . 5686 1 85 . HIS . 5686 1 86 . ALA . 5686 1 87 . PHE . 5686 1 88 . GLU . 5686 1 89 . GLN . 5686 1 90 . GLY . 5686 1 91 . ALA . 5686 1 92 . ASP . 5686 1 93 . ASP . 5686 1 94 . TYR . 5686 1 95 . ILE . 5686 1 96 . ALA . 5686 1 97 . LYS . 5686 1 98 . PRO . 5686 1 99 . TYR . 5686 1 100 . ARG . 5686 1 101 . SER . 5686 1 102 . ILE . 5686 1 103 . LYS . 5686 1 104 . ALA . 5686 1 105 . LEU . 5686 1 106 . VAL . 5686 1 107 . ALA . 5686 1 108 . ARG . 5686 1 109 . ILE . 5686 1 110 . GLU . 5686 1 111 . ALA . 5686 1 112 . ARG . 5686 1 113 . LEU . 5686 1 114 . ARG . 5686 1 115 . PHE . 5686 1 116 . TRP . 5686 1 117 . GLY . 5686 1 118 . SER . 5686 1 119 . ASN . 5686 1 120 . VAL . 5686 1 121 . ILE . 5686 1 122 . GLU . 5686 1 123 . ILE . 5686 1 124 . GLY . 5686 1 125 . ASP . 5686 1 126 . LEU . 5686 1 127 . THR . 5686 1 128 . ILE . 5686 1 129 . SER . 5686 1 130 . PRO . 5686 1 131 . ASP . 5686 1 132 . GLU . 5686 1 133 . GLU . 5686 1 134 . LYS . 5686 1 135 . ILE . 5686 1 136 . ILE . 5686 1 137 . TYR . 5686 1 138 . LYS . 5686 1 139 . GLY . 5686 1 140 . ARG . 5686 1 141 . GLU . 5686 1 142 . VAL . 5686 1 143 . GLU . 5686 1 144 . VAL . 5686 1 145 . LYS . 5686 1 146 . GLY . 5686 1 147 . LYS . 5686 1 148 . PRO . 5686 1 149 . PHE . 5686 1 150 . GLU . 5686 1 151 . VAL . 5686 1 152 . LEU . 5686 1 153 . THR . 5686 1 154 . HIS . 5686 1 155 . LEU . 5686 1 156 . ALA . 5686 1 157 . ARG . 5686 1 158 . HIS . 5686 1 159 . ARG . 5686 1 160 . ASP . 5686 1 161 . GLN . 5686 1 162 . ILE . 5686 1 163 . VAL . 5686 1 164 . SER . 5686 1 165 . LYS . 5686 1 166 . GLU . 5686 1 167 . GLN . 5686 1 168 . LEU . 5686 1 169 . LEU . 5686 1 170 . ASP . 5686 1 171 . ALA . 5686 1 172 . ILE . 5686 1 173 . TRP . 5686 1 174 . GLU . 5686 1 175 . GLU . 5686 1 176 . PRO . 5686 1 177 . GLU . 5686 1 178 . MET . 5686 1 179 . VAL . 5686 1 180 . THR . 5686 1 181 . PRO . 5686 1 182 . ASN . 5686 1 183 . VAL . 5686 1 184 . ILE . 5686 1 185 . GLU . 5686 1 186 . VAL . 5686 1 187 . ALA . 5686 1 188 . ILE . 5686 1 189 . ASN . 5686 1 190 . GLN . 5686 1 191 . ILE . 5686 1 192 . ARG . 5686 1 193 . GLN . 5686 1 194 . LYS . 5686 1 195 . MET . 5686 1 196 . ASP . 5686 1 197 . LYS . 5686 1 198 . PRO . 5686 1 199 . LEU . 5686 1 200 . GLY . 5686 1 201 . ILE . 5686 1 202 . SER . 5686 1 203 . THR . 5686 1 204 . VAL . 5686 1 205 . GLU . 5686 1 206 . THR . 5686 1 207 . VAL . 5686 1 208 . ARG . 5686 1 209 . ARG . 5686 1 210 . ARG . 5686 1 211 . GLY . 5686 1 212 . TYR . 5686 1 213 . ARG . 5686 1 214 . PHE . 5686 1 215 . CYS . 5686 1 216 . TYR . 5686 1 217 . PRO . 5686 1 218 . LYS . 5686 1 219 . PRO . 5686 1 220 . ALA . 5686 1 221 . CYS . 5686 1 222 . GLU . 5686 1 223 . GLU . 5686 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 5686 1 . ARG 2 2 5686 1 . VAL 3 3 5686 1 . LEU 4 4 5686 1 . LEU 5 5 5686 1 . ILE 6 6 5686 1 . GLU 7 7 5686 1 . LYS 8 8 5686 1 . ASN 9 9 5686 1 . SER 10 10 5686 1 . VAL 11 11 5686 1 . LEU 12 12 5686 1 . GLY 13 13 5686 1 . GLY 14 14 5686 1 . GLU 15 15 5686 1 . ILE 16 16 5686 1 . GLU 17 17 5686 1 . LYS 18 18 5686 1 . GLY 19 19 5686 1 . LEU 20 20 5686 1 . ASN 21 21 5686 1 . VAL 22 22 5686 1 . LYS 23 23 5686 1 . GLY 24 24 5686 1 . PHE 25 25 5686 1 . MET 26 26 5686 1 . ALA 27 27 5686 1 . ASP 28 28 5686 1 . VAL 29 29 5686 1 . THR 30 30 5686 1 . GLU 31 31 5686 1 . SER 32 32 5686 1 . LEU 33 33 5686 1 . GLU 34 34 5686 1 . ASP 35 35 5686 1 . GLY 36 36 5686 1 . GLU 37 37 5686 1 . TYR 38 38 5686 1 . LEU 39 39 5686 1 . MET 40 40 5686 1 . ASP 41 41 5686 1 . ILE 42 42 5686 1 . ARG 43 43 5686 1 . ASN 44 44 5686 1 . TYR 45 45 5686 1 . ASP 46 46 5686 1 . LEU 47 47 5686 1 . VAL 48 48 5686 1 . MET 49 49 5686 1 . VAL 50 50 5686 1 . SER 51 51 5686 1 . ASP 52 52 5686 1 . LYS 53 53 5686 1 . ASN 54 54 5686 1 . ALA 55 55 5686 1 . LEU 56 56 5686 1 . SER 57 57 5686 1 . PHE 58 58 5686 1 . VAL 59 59 5686 1 . SER 60 60 5686 1 . ARG 61 61 5686 1 . ILE 62 62 5686 1 . LYS 63 63 5686 1 . GLU 64 64 5686 1 . LYS 65 65 5686 1 . HIS 66 66 5686 1 . SER 67 67 5686 1 . SER 68 68 5686 1 . ILE 69 69 5686 1 . VAL 70 70 5686 1 . VAL 71 71 5686 1 . LEU 72 72 5686 1 . VAL 73 73 5686 1 . SER 74 74 5686 1 . SER 75 75 5686 1 . ASP 76 76 5686 1 . ASN 77 77 5686 1 . PRO 78 78 5686 1 . THR 79 79 5686 1 . SER 80 80 5686 1 . GLU 81 81 5686 1 . GLU 82 82 5686 1 . GLU 83 83 5686 1 . VAL 84 84 5686 1 . HIS 85 85 5686 1 . ALA 86 86 5686 1 . PHE 87 87 5686 1 . GLU 88 88 5686 1 . GLN 89 89 5686 1 . GLY 90 90 5686 1 . ALA 91 91 5686 1 . ASP 92 92 5686 1 . ASP 93 93 5686 1 . TYR 94 94 5686 1 . ILE 95 95 5686 1 . ALA 96 96 5686 1 . LYS 97 97 5686 1 . PRO 98 98 5686 1 . TYR 99 99 5686 1 . ARG 100 100 5686 1 . SER 101 101 5686 1 . ILE 102 102 5686 1 . LYS 103 103 5686 1 . ALA 104 104 5686 1 . LEU 105 105 5686 1 . VAL 106 106 5686 1 . ALA 107 107 5686 1 . ARG 108 108 5686 1 . ILE 109 109 5686 1 . GLU 110 110 5686 1 . ALA 111 111 5686 1 . ARG 112 112 5686 1 . LEU 113 113 5686 1 . ARG 114 114 5686 1 . PHE 115 115 5686 1 . TRP 116 116 5686 1 . GLY 117 117 5686 1 . SER 118 118 5686 1 . ASN 119 119 5686 1 . VAL 120 120 5686 1 . ILE 121 121 5686 1 . GLU 122 122 5686 1 . ILE 123 123 5686 1 . GLY 124 124 5686 1 . ASP 125 125 5686 1 . LEU 126 126 5686 1 . THR 127 127 5686 1 . ILE 128 128 5686 1 . SER 129 129 5686 1 . PRO 130 130 5686 1 . ASP 131 131 5686 1 . GLU 132 132 5686 1 . GLU 133 133 5686 1 . LYS 134 134 5686 1 . ILE 135 135 5686 1 . ILE 136 136 5686 1 . TYR 137 137 5686 1 . LYS 138 138 5686 1 . GLY 139 139 5686 1 . ARG 140 140 5686 1 . GLU 141 141 5686 1 . VAL 142 142 5686 1 . GLU 143 143 5686 1 . VAL 144 144 5686 1 . LYS 145 145 5686 1 . GLY 146 146 5686 1 . LYS 147 147 5686 1 . PRO 148 148 5686 1 . PHE 149 149 5686 1 . GLU 150 150 5686 1 . VAL 151 151 5686 1 . LEU 152 152 5686 1 . THR 153 153 5686 1 . HIS 154 154 5686 1 . LEU 155 155 5686 1 . ALA 156 156 5686 1 . ARG 157 157 5686 1 . HIS 158 158 5686 1 . ARG 159 159 5686 1 . ASP 160 160 5686 1 . GLN 161 161 5686 1 . ILE 162 162 5686 1 . VAL 163 163 5686 1 . SER 164 164 5686 1 . LYS 165 165 5686 1 . GLU 166 166 5686 1 . GLN 167 167 5686 1 . LEU 168 168 5686 1 . LEU 169 169 5686 1 . ASP 170 170 5686 1 . ALA 171 171 5686 1 . ILE 172 172 5686 1 . TRP 173 173 5686 1 . GLU 174 174 5686 1 . GLU 175 175 5686 1 . PRO 176 176 5686 1 . GLU 177 177 5686 1 . MET 178 178 5686 1 . VAL 179 179 5686 1 . THR 180 180 5686 1 . PRO 181 181 5686 1 . ASN 182 182 5686 1 . VAL 183 183 5686 1 . ILE 184 184 5686 1 . GLU 185 185 5686 1 . VAL 186 186 5686 1 . ALA 187 187 5686 1 . ILE 188 188 5686 1 . ASN 189 189 5686 1 . GLN 190 190 5686 1 . ILE 191 191 5686 1 . ARG 192 192 5686 1 . GLN 193 193 5686 1 . LYS 194 194 5686 1 . MET 195 195 5686 1 . ASP 196 196 5686 1 . LYS 197 197 5686 1 . PRO 198 198 5686 1 . LEU 199 199 5686 1 . GLY 200 200 5686 1 . ILE 201 201 5686 1 . SER 202 202 5686 1 . THR 203 203 5686 1 . VAL 204 204 5686 1 . GLU 205 205 5686 1 . THR 206 206 5686 1 . VAL 207 207 5686 1 . ARG 208 208 5686 1 . ARG 209 209 5686 1 . ARG 210 210 5686 1 . GLY 211 211 5686 1 . TYR 212 212 5686 1 . ARG 213 213 5686 1 . PHE 214 214 5686 1 . CYS 215 215 5686 1 . TYR 216 216 5686 1 . PRO 217 217 5686 1 . LYS 218 218 5686 1 . PRO 219 219 5686 1 . ALA 220 220 5686 1 . CYS 221 221 5686 1 . GLU 222 222 5686 1 . GLU 223 223 5686 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 5686 _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 $HP1043 . 85962 . . 'Helicobactor pylori' 'Helicobactor pylori' . . Eubacteria . Helicobactor pylori 'strain 26695' . . . . . . . . . . . . . . . . . . . . 5686 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 5686 _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 $HP1043 . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5686 _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 'Helicobactor pylori 1043' . . . 1 $HP1043 . . 0.8 . . mM . . . . 5686 1 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 5686 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.23 0.1 pH 5686 1 temperature 303 1 K 5686 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 5686 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 5686 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 5686 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5686 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker DRX . 500 . . . 5686 1 2 NMR_spectrometer_2 Bruker DRX . 600 . . . 5686 1 3 NMR_spectrometer_3 Bruker DRX . 800 . . . 5686 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 5686 _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 '1H-15N HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 2 HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 3 HN(CO)CA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 4 HNCACB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 5 HN(CO)CACB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 6 HNCO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 7 '1H-15N NOESY-HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 8 HCCH-TOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 9 HCCH-COSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 10 '13C-edited NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5686 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H-15N 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_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name 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_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name 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_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name 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_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name 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_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name 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_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name '1H-15N 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_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name 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_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name 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_NMR_spec_expt__0_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_11 _NMR_spec_expt.Entry_ID 5686 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '13C-edited NOESY' _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_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5686 _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct . . 1.000000000 . . . . . . . 5686 1 C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect . . 0.251449530 . . . . . . . 5686 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect . . 0.101329118 . . . . . . . 5686 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_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 5686 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 '1H-15N HSQC' 1 $sample_1 . 5686 1 2 HNCA 1 $sample_1 . 5686 1 3 HN(CO)CA 1 $sample_1 . 5686 1 4 HNCACB 1 $sample_1 . 5686 1 5 HN(CO)CACB 1 $sample_1 . 5686 1 6 HNCO 1 $sample_1 . 5686 1 7 '1H-15N NOESY-HSQC' 1 $sample_1 . 5686 1 8 HCCH-TOCSY 1 $sample_1 . 5686 1 9 HCCH-COSY 1 $sample_1 . 5686 1 10 '13C-edited NOESY' 1 $sample_1 . 5686 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4 0.02 . 1 . . . . . . . . 5686 1 2 . 1 1 1 1 MET HB2 H 1 1.854 0.02 . 2 . . . . . . . . 5686 1 3 . 1 1 1 1 MET HB3 H 1 1.753 0.02 . 2 . . . . . . . . 5686 1 4 . 1 1 1 1 MET HG2 H 1 2.436 0.02 . 2 . . . . . . . . 5686 1 5 . 1 1 1 1 MET HG3 H 1 2.357 0.02 . 2 . . . . . . . . 5686 1 6 . 1 1 1 1 MET HE1 H 1 1.922 0.02 . 1 . . . . . . . . 5686 1 7 . 1 1 1 1 MET HE2 H 1 1.922 0.02 . 1 . . . . . . . . 5686 1 8 . 1 1 1 1 MET HE3 H 1 1.922 0.02 . 1 . . . . . . . . 5686 1 9 . 1 1 1 1 MET C C 13 173.4 0.2 . 1 . . . . . . . . 5686 1 10 . 1 1 1 1 MET CA C 13 54.38 0.1 . 1 . . . . . . . . 5686 1 11 . 1 1 1 1 MET CB C 13 34.54 0.1 . 1 . . . . . . . . 5686 1 12 . 1 1 1 1 MET CG C 13 31.55 0.1 . 1 . . . . . . . . 5686 1 13 . 1 1 1 1 MET CE C 13 17.05 0.1 . 1 . . . . . . . . 5686 1 14 . 1 1 2 2 ARG H H 1 8.291 0.02 . 1 . . . . . . . . 5686 1 15 . 1 1 2 2 ARG HA H 1 5.227 0.02 . 1 . . . . . . . . 5686 1 16 . 1 1 2 2 ARG HB2 H 1 1.764 0.02 . 2 . . . . . . . . 5686 1 17 . 1 1 2 2 ARG HB3 H 1 1.585 0.02 . 2 . . . . . . . . 5686 1 18 . 1 1 2 2 ARG HG2 H 1 1.531 0.02 . 2 . . . . . . . . 5686 1 19 . 1 1 2 2 ARG HG3 H 1 1.356 0.02 . 2 . . . . . . . . 5686 1 20 . 1 1 2 2 ARG HD2 H 1 2.68 0.02 . 2 . . . . . . . . 5686 1 21 . 1 1 2 2 ARG HD3 H 1 2.562 0.02 . 2 . . . . . . . . 5686 1 22 . 1 1 2 2 ARG C C 13 174.5 0.2 . 1 . . . . . . . . 5686 1 23 . 1 1 2 2 ARG CA C 13 54.35 0.1 . 1 . . . . . . . . 5686 1 24 . 1 1 2 2 ARG CB C 13 33.02 0.1 . 1 . . . . . . . . 5686 1 25 . 1 1 2 2 ARG CD C 13 41.78 0.1 . 1 . . . . . . . . 5686 1 26 . 1 1 2 2 ARG N N 15 122.4 0.2 . 1 . . . . . . . . 5686 1 27 . 1 1 3 3 VAL H H 1 8.917 0.02 . 1 . . . . . . . . 5686 1 28 . 1 1 3 3 VAL HA H 1 5.015 0.02 . 1 . . . . . . . . 5686 1 29 . 1 1 3 3 VAL HB H 1 1.852 0.02 . 1 . . . . . . . . 5686 1 30 . 1 1 3 3 VAL HG11 H 1 0.729 0.02 . 2 . . . . . . . . 5686 1 31 . 1 1 3 3 VAL HG12 H 1 0.729 0.02 . 2 . . . . . . . . 5686 1 32 . 1 1 3 3 VAL HG13 H 1 0.729 0.02 . 2 . . . . . . . . 5686 1 33 . 1 1 3 3 VAL HG21 H 1 0.6376 0.02 . 2 . . . . . . . . 5686 1 34 . 1 1 3 3 VAL HG22 H 1 0.6376 0.02 . 2 . . . . . . . . 5686 1 35 . 1 1 3 3 VAL HG23 H 1 0.6376 0.02 . 2 . . . . . . . . 5686 1 36 . 1 1 3 3 VAL C C 13 172.6 0.2 . 1 . . . . . . . . 5686 1 37 . 1 1 3 3 VAL CA C 13 59.52 0.1 . 1 . . . . . . . . 5686 1 38 . 1 1 3 3 VAL CB C 13 34.32 0.1 . 1 . . . . . . . . 5686 1 39 . 1 1 3 3 VAL CG1 C 13 20.57 0.1 . 2 . . . . . . . . 5686 1 40 . 1 1 3 3 VAL CG2 C 13 20.52 0.1 . 2 . . . . . . . . 5686 1 41 . 1 1 3 3 VAL N N 15 126.9 0.2 . 1 . . . . . . . . 5686 1 42 . 1 1 4 4 LEU H H 1 8.562 0.02 . 1 . . . . . . . . 5686 1 43 . 1 1 4 4 LEU HA H 1 4.732 0.02 . 1 . . . . . . . . 5686 1 44 . 1 1 4 4 LEU HB2 H 1 1.124 0.02 . 1 . . . . . . . . 5686 1 45 . 1 1 4 4 LEU HB3 H 1 1.124 0.02 . 1 . . . . . . . . 5686 1 46 . 1 1 4 4 LEU HG H 1 0.9103 0.02 . 1 . . . . . . . . 5686 1 47 . 1 1 4 4 LEU HD11 H 1 0.4405 0.02 . 2 . . . . . . . . 5686 1 48 . 1 1 4 4 LEU HD12 H 1 0.4405 0.02 . 2 . . . . . . . . 5686 1 49 . 1 1 4 4 LEU HD13 H 1 0.4405 0.02 . 2 . . . . . . . . 5686 1 50 . 1 1 4 4 LEU HD21 H 1 0.5172 0.02 . 2 . . . . . . . . 5686 1 51 . 1 1 4 4 LEU HD22 H 1 0.5172 0.02 . 2 . . . . . . . . 5686 1 52 . 1 1 4 4 LEU HD23 H 1 0.5172 0.02 . 2 . . . . . . . . 5686 1 53 . 1 1 4 4 LEU C C 13 173.3 0.2 . 1 . . . . . . . . 5686 1 54 . 1 1 4 4 LEU CA C 13 52.26 0.1 . 1 . . . . . . . . 5686 1 55 . 1 1 4 4 LEU CB C 13 41.27 0.1 . 1 . . . . . . . . 5686 1 56 . 1 1 4 4 LEU CD1 C 13 25.93 0.1 . 2 . . . . . . . . 5686 1 57 . 1 1 4 4 LEU CD2 C 13 21.47 0.1 . 2 . . . . . . . . 5686 1 58 . 1 1 4 4 LEU N N 15 128.1 0.2 . 1 . . . . . . . . 5686 1 59 . 1 1 5 5 LEU H H 1 9.028 0.02 . 1 . . . . . . . . 5686 1 60 . 1 1 5 5 LEU HA H 1 4.846 0.02 . 1 . . . . . . . . 5686 1 61 . 1 1 5 5 LEU HB2 H 1 1.704 0.02 . 2 . . . . . . . . 5686 1 62 . 1 1 5 5 LEU HB3 H 1 1.246 0.02 . 2 . . . . . . . . 5686 1 63 . 1 1 5 5 LEU HG H 1 1.444 0.02 . 1 . . . . . . . . 5686 1 64 . 1 1 5 5 LEU HD11 H 1 0.663 0.02 . 2 . . . . . . . . 5686 1 65 . 1 1 5 5 LEU HD12 H 1 0.663 0.02 . 2 . . . . . . . . 5686 1 66 . 1 1 5 5 LEU HD13 H 1 0.663 0.02 . 2 . . . . . . . . 5686 1 67 . 1 1 5 5 LEU HD21 H 1 0.429 0.02 . 2 . . . . . . . . 5686 1 68 . 1 1 5 5 LEU HD22 H 1 0.429 0.02 . 2 . . . . . . . . 5686 1 69 . 1 1 5 5 LEU HD23 H 1 0.429 0.02 . 2 . . . . . . . . 5686 1 70 . 1 1 5 5 LEU C C 13 173.9 0.2 . 1 . . . . . . . . 5686 1 71 . 1 1 5 5 LEU CA C 13 52.17 0.1 . 1 . . . . . . . . 5686 1 72 . 1 1 5 5 LEU CB C 13 42.7 0.1 . 1 . . . . . . . . 5686 1 73 . 1 1 5 5 LEU CD1 C 13 24.72 0.1 . 2 . . . . . . . . 5686 1 74 . 1 1 5 5 LEU N N 15 127.3 0.2 . 1 . . . . . . . . 5686 1 75 . 1 1 6 6 ILE H H 1 7.653 0.02 . 1 . . . . . . . . 5686 1 76 . 1 1 6 6 ILE HA H 1 4.613 0.02 . 1 . . . . . . . . 5686 1 77 . 1 1 6 6 ILE HB H 1 1.545 0.02 . 1 . . . . . . . . 5686 1 78 . 1 1 6 6 ILE HG12 H 1 1.163 0.02 . 2 . . . . . . . . 5686 1 79 . 1 1 6 6 ILE HG13 H 1 0.6162 0.02 . 2 . . . . . . . . 5686 1 80 . 1 1 6 6 ILE HG21 H 1 0.4173 0.02 . 1 . . . . . . . . 5686 1 81 . 1 1 6 6 ILE HG22 H 1 0.4173 0.02 . 1 . . . . . . . . 5686 1 82 . 1 1 6 6 ILE HG23 H 1 0.4173 0.02 . 1 . . . . . . . . 5686 1 83 . 1 1 6 6 ILE HD11 H 1 0.429 0.02 . 1 . . . . . . . . 5686 1 84 . 1 1 6 6 ILE HD12 H 1 0.429 0.02 . 1 . . . . . . . . 5686 1 85 . 1 1 6 6 ILE HD13 H 1 0.429 0.02 . 1 . . . . . . . . 5686 1 86 . 1 1 6 6 ILE C C 13 174.5 0.2 . 1 . . . . . . . . 5686 1 87 . 1 1 6 6 ILE CA C 13 59.39 0.1 . 1 . . . . . . . . 5686 1 88 . 1 1 6 6 ILE CB C 13 36.79 0.1 . 1 . . . . . . . . 5686 1 89 . 1 1 6 6 ILE CG1 C 13 25.63 0.1 . 1 . . . . . . . . 5686 1 90 . 1 1 6 6 ILE CG2 C 13 15.67 0.1 . 1 . . . . . . . . 5686 1 91 . 1 1 6 6 ILE CD1 C 13 14.3 0.1 . 1 . . . . . . . . 5686 1 92 . 1 1 6 6 ILE N N 15 120.3 0.2 . 1 . . . . . . . . 5686 1 93 . 1 1 7 7 GLU H H 1 8.329 0.02 . 1 . . . . . . . . 5686 1 94 . 1 1 7 7 GLU HA H 1 4.38 0.02 . 1 . . . . . . . . 5686 1 95 . 1 1 7 7 GLU HB2 H 1 1.961 0.02 . 2 . . . . . . . . 5686 1 96 . 1 1 7 7 GLU HB3 H 1 1.362 0.02 . 2 . . . . . . . . 5686 1 97 . 1 1 7 7 GLU HG2 H 1 2.214 0.02 . 2 . . . . . . . . 5686 1 98 . 1 1 7 7 GLU HG3 H 1 1.853 0.02 . 2 . . . . . . . . 5686 1 99 . 1 1 7 7 GLU C C 13 172.5 0.2 . 1 . . . . . . . . 5686 1 100 . 1 1 7 7 GLU CA C 13 53.53 0.1 . 1 . . . . . . . . 5686 1 101 . 1 1 7 7 GLU CB C 13 30.75 0.1 . 1 . . . . . . . . 5686 1 102 . 1 1 7 7 GLU CG C 13 35.42 0.1 . 1 . . . . . . . . 5686 1 103 . 1 1 7 7 GLU N N 15 129.6 0.2 . 1 . . . . . . . . 5686 1 104 . 1 1 8 8 LYS H H 1 8.591 0.02 . 1 . . . . . . . . 5686 1 105 . 1 1 8 8 LYS HA H 1 4.037 0.02 . 1 . . . . . . . . 5686 1 106 . 1 1 8 8 LYS HB2 H 1 1.815 0.02 . 1 . . . . . . . . 5686 1 107 . 1 1 8 8 LYS HB3 H 1 1.815 0.02 . 1 . . . . . . . . 5686 1 108 . 1 1 8 8 LYS HG2 H 1 1.555 0.02 . 2 . . . . . . . . 5686 1 109 . 1 1 8 8 LYS HG3 H 1 1.456 0.02 . 2 . . . . . . . . 5686 1 110 . 1 1 8 8 LYS HD2 H 1 1.687 0.02 . 1 . . . . . . . . 5686 1 111 . 1 1 8 8 LYS HD3 H 1 1.687 0.02 . 1 . . . . . . . . 5686 1 112 . 1 1 8 8 LYS HE2 H 1 3.014 0.02 . 1 . . . . . . . . 5686 1 113 . 1 1 8 8 LYS HE3 H 1 3.014 0.02 . 1 . . . . . . . . 5686 1 114 . 1 1 8 8 LYS C C 13 176.1 0.2 . 1 . . . . . . . . 5686 1 115 . 1 1 8 8 LYS CA C 13 57.26 0.1 . 1 . . . . . . . . 5686 1 116 . 1 1 8 8 LYS CB C 13 31.73 0.1 . 1 . . . . . . . . 5686 1 117 . 1 1 8 8 LYS CG C 13 24.04 0.1 . 1 . . . . . . . . 5686 1 118 . 1 1 8 8 LYS CD C 13 28.05 0.1 . 1 . . . . . . . . 5686 1 119 . 1 1 8 8 LYS CE C 13 41.04 0.1 . 1 . . . . . . . . 5686 1 120 . 1 1 8 8 LYS N N 15 127.2 0.2 . 1 . . . . . . . . 5686 1 121 . 1 1 9 9 ASN H H 1 9.753 0.02 . 1 . . . . . . . . 5686 1 122 . 1 1 9 9 ASN HA H 1 4.71 0.02 . 1 . . . . . . . . 5686 1 123 . 1 1 9 9 ASN HB2 H 1 3.131 0.02 . 2 . . . . . . . . 5686 1 124 . 1 1 9 9 ASN HB3 H 1 2.622 0.02 . 2 . . . . . . . . 5686 1 125 . 1 1 9 9 ASN C C 13 175 0.2 . 1 . . . . . . . . 5686 1 126 . 1 1 9 9 ASN CA C 13 51.37 0.1 . 1 . . . . . . . . 5686 1 127 . 1 1 9 9 ASN CB C 13 36.67 0.1 . 1 . . . . . . . . 5686 1 128 . 1 1 9 9 ASN N N 15 119 0.2 . 1 . . . . . . . . 5686 1 129 . 1 1 10 10 SER H H 1 8.441 0.02 . 1 . . . . . . . . 5686 1 130 . 1 1 10 10 SER HA H 1 4.097 0.02 . 1 . . . . . . . . 5686 1 131 . 1 1 10 10 SER HB2 H 1 3.936 0.02 . 1 . . . . . . . . 5686 1 132 . 1 1 10 10 SER HB3 H 1 3.936 0.02 . 1 . . . . . . . . 5686 1 133 . 1 1 10 10 SER C C 13 176.8 0.2 . 1 . . . . . . . . 5686 1 134 . 1 1 10 10 SER CA C 13 60.35 0.1 . 1 . . . . . . . . 5686 1 135 . 1 1 10 10 SER CB C 13 62.07 0.1 . 1 . . . . . . . . 5686 1 136 . 1 1 10 10 SER N N 15 123.4 0.2 . 1 . . . . . . . . 5686 1 137 . 1 1 11 11 VAL H H 1 7.852 0.02 . 1 . . . . . . . . 5686 1 138 . 1 1 11 11 VAL HA H 1 3.692 0.02 . 1 . . . . . . . . 5686 1 139 . 1 1 11 11 VAL HB H 1 2.11 0.02 . 1 . . . . . . . . 5686 1 140 . 1 1 11 11 VAL HG11 H 1 0.9923 0.02 . 2 . . . . . . . . 5686 1 141 . 1 1 11 11 VAL HG12 H 1 0.9923 0.02 . 2 . . . . . . . . 5686 1 142 . 1 1 11 11 VAL HG13 H 1 0.9923 0.02 . 2 . . . . . . . . 5686 1 143 . 1 1 11 11 VAL HG21 H 1 0.8966 0.02 . 2 . . . . . . . . 5686 1 144 . 1 1 11 11 VAL HG22 H 1 0.8966 0.02 . 2 . . . . . . . . 5686 1 145 . 1 1 11 11 VAL HG23 H 1 0.8966 0.02 . 2 . . . . . . . . 5686 1 146 . 1 1 11 11 VAL C C 13 178.1 0.2 . 1 . . . . . . . . 5686 1 147 . 1 1 11 11 VAL CA C 13 65.03 0.1 . 1 . . . . . . . . 5686 1 148 . 1 1 11 11 VAL CB C 13 30.65 0.1 . 1 . . . . . . . . 5686 1 149 . 1 1 11 11 VAL CG1 C 13 21.38 0.1 . 2 . . . . . . . . 5686 1 150 . 1 1 11 11 VAL CG2 C 13 19.81 0.1 . 2 . . . . . . . . 5686 1 151 . 1 1 11 11 VAL N N 15 124.7 0.2 . 1 . . . . . . . . 5686 1 152 . 1 1 12 12 LEU H H 1 7.28 0.02 . 1 . . . . . . . . 5686 1 153 . 1 1 12 12 LEU HA H 1 4.198 0.02 . 1 . . . . . . . . 5686 1 154 . 1 1 12 12 LEU HB2 H 1 1.551 0.02 . 2 . . . . . . . . 5686 1 155 . 1 1 12 12 LEU HB3 H 1 1.46 0.02 . 2 . . . . . . . . 5686 1 156 . 1 1 12 12 LEU HD11 H 1 0.8915 0.02 . 2 . . . . . . . . 5686 1 157 . 1 1 12 12 LEU HD12 H 1 0.8915 0.02 . 2 . . . . . . . . 5686 1 158 . 1 1 12 12 LEU HD13 H 1 0.8915 0.02 . 2 . . . . . . . . 5686 1 159 . 1 1 12 12 LEU HD21 H 1 1.003 0.02 . 2 . . . . . . . . 5686 1 160 . 1 1 12 12 LEU HD22 H 1 1.003 0.02 . 2 . . . . . . . . 5686 1 161 . 1 1 12 12 LEU HD23 H 1 1.003 0.02 . 2 . . . . . . . . 5686 1 162 . 1 1 12 12 LEU C C 13 178.6 0.2 . 1 . . . . . . . . 5686 1 163 . 1 1 12 12 LEU CA C 13 56.31 0.1 . 1 . . . . . . . . 5686 1 164 . 1 1 12 12 LEU CB C 13 41.08 0.1 . 1 . . . . . . . . 5686 1 165 . 1 1 12 12 LEU CD1 C 13 24.94 0.1 . 2 . . . . . . . . 5686 1 166 . 1 1 12 12 LEU CD2 C 13 22.02 0.1 . 2 . . . . . . . . 5686 1 167 . 1 1 12 12 LEU N N 15 122.9 0.2 . 1 . . . . . . . . 5686 1 168 . 1 1 13 13 GLY H H 1 8.695 0.02 . 1 . . . . . . . . 5686 1 169 . 1 1 13 13 GLY HA2 H 1 3.558 0.02 . 2 . . . . . . . . 5686 1 170 . 1 1 13 13 GLY HA3 H 1 3.385 0.02 . 2 . . . . . . . . 5686 1 171 . 1 1 13 13 GLY C C 13 174.3 0.2 . 1 . . . . . . . . 5686 1 172 . 1 1 13 13 GLY CA C 13 46.36 0.1 . 1 . . . . . . . . 5686 1 173 . 1 1 13 13 GLY N N 15 104.1 0.2 . 1 . . . . . . . . 5686 1 174 . 1 1 14 14 GLY H H 1 7.953 0.02 . 1 . . . . . . . . 5686 1 175 . 1 1 14 14 GLY HA2 H 1 4.033 0.02 . 2 . . . . . . . . 5686 1 176 . 1 1 14 14 GLY HA3 H 1 3.856 0.02 . 2 . . . . . . . . 5686 1 177 . 1 1 14 14 GLY C C 13 176.1 0.2 . 1 . . . . . . . . 5686 1 178 . 1 1 14 14 GLY CA C 13 45.83 0.1 . 1 . . . . . . . . 5686 1 179 . 1 1 14 14 GLY N N 15 107.1 0.2 . 1 . . . . . . . . 5686 1 180 . 1 1 15 15 GLU H H 1 7.894 0.02 . 1 . . . . . . . . 5686 1 181 . 1 1 15 15 GLU HA H 1 4.019 0.02 . 1 . . . . . . . . 5686 1 182 . 1 1 15 15 GLU HB2 H 1 2.276 0.02 . 2 . . . . . . . . 5686 1 183 . 1 1 15 15 GLU HB3 H 1 2.023 0.02 . 2 . . . . . . . . 5686 1 184 . 1 1 15 15 GLU HG2 H 1 2.427 0.02 . 2 . . . . . . . . 5686 1 185 . 1 1 15 15 GLU HG3 H 1 2.194 0.02 . 2 . . . . . . . . 5686 1 186 . 1 1 15 15 GLU C C 13 179.7 0.2 . 1 . . . . . . . . 5686 1 187 . 1 1 15 15 GLU CA C 13 58.48 0.1 . 1 . . . . . . . . 5686 1 188 . 1 1 15 15 GLU CB C 13 28.69 0.1 . 1 . . . . . . . . 5686 1 189 . 1 1 15 15 GLU CG C 13 35.83 0.1 . 1 . . . . . . . . 5686 1 190 . 1 1 15 15 GLU N N 15 122.9 0.2 . 1 . . . . . . . . 5686 1 191 . 1 1 16 16 ILE H H 1 8.22 0.02 . 1 . . . . . . . . 5686 1 192 . 1 1 16 16 ILE HA H 1 3.347 0.02 . 1 . . . . . . . . 5686 1 193 . 1 1 16 16 ILE HB H 1 1.676 0.02 . 1 . . . . . . . . 5686 1 194 . 1 1 16 16 ILE HG21 H 1 0.5299 0.02 . 1 . . . . . . . . 5686 1 195 . 1 1 16 16 ILE HG22 H 1 0.5299 0.02 . 1 . . . . . . . . 5686 1 196 . 1 1 16 16 ILE HG23 H 1 0.5299 0.02 . 1 . . . . . . . . 5686 1 197 . 1 1 16 16 ILE HD11 H 1 0.6619 0.02 . 1 . . . . . . . . 5686 1 198 . 1 1 16 16 ILE HD12 H 1 0.6619 0.02 . 1 . . . . . . . . 5686 1 199 . 1 1 16 16 ILE HD13 H 1 0.6619 0.02 . 1 . . . . . . . . 5686 1 200 . 1 1 16 16 ILE C C 13 176.7 0.2 . 1 . . . . . . . . 5686 1 201 . 1 1 16 16 ILE CA C 13 64.88 0.1 . 1 . . . . . . . . 5686 1 202 . 1 1 16 16 ILE CB C 13 36.68 0.1 . 1 . . . . . . . . 5686 1 203 . 1 1 16 16 ILE CG2 C 13 17.22 0.1 . 1 . . . . . . . . 5686 1 204 . 1 1 16 16 ILE CD1 C 13 14.37 0.1 . 1 . . . . . . . . 5686 1 205 . 1 1 16 16 ILE N N 15 121.7 0.2 . 1 . . . . . . . . 5686 1 206 . 1 1 17 17 GLU H H 1 8.386 0.02 . 1 . . . . . . . . 5686 1 207 . 1 1 17 17 GLU HA H 1 3.447 0.02 . 1 . . . . . . . . 5686 1 208 . 1 1 17 17 GLU HB2 H 1 2.266 0.02 . 2 . . . . . . . . 5686 1 209 . 1 1 17 17 GLU HB3 H 1 1.816 0.02 . 2 . . . . . . . . 5686 1 210 . 1 1 17 17 GLU HG2 H 1 2.228 0.02 . 2 . . . . . . . . 5686 1 211 . 1 1 17 17 GLU HG3 H 1 2.037 0.02 . 2 . . . . . . . . 5686 1 212 . 1 1 17 17 GLU C C 13 177.4 0.2 . 1 . . . . . . . . 5686 1 213 . 1 1 17 17 GLU CA C 13 59.57 0.1 . 1 . . . . . . . . 5686 1 214 . 1 1 17 17 GLU CB C 13 28.27 0.1 . 1 . . . . . . . . 5686 1 215 . 1 1 17 17 GLU CG C 13 33.96 0.1 . 1 . . . . . . . . 5686 1 216 . 1 1 17 17 GLU N N 15 121.1 0.2 . 1 . . . . . . . . 5686 1 217 . 1 1 18 18 LYS H H 1 7.903 0.02 . 1 . . . . . . . . 5686 1 218 . 1 1 18 18 LYS HA H 1 3.957 0.02 . 1 . . . . . . . . 5686 1 219 . 1 1 18 18 LYS HB2 H 1 1.808 0.02 . 1 . . . . . . . . 5686 1 220 . 1 1 18 18 LYS HB3 H 1 1.808 0.02 . 1 . . . . . . . . 5686 1 221 . 1 1 18 18 LYS HG2 H 1 1.574 0.02 . 2 . . . . . . . . 5686 1 222 . 1 1 18 18 LYS HG3 H 1 1.456 0.02 . 2 . . . . . . . . 5686 1 223 . 1 1 18 18 LYS HD2 H 1 1.624 0.02 . 1 . . . . . . . . 5686 1 224 . 1 1 18 18 LYS HD3 H 1 1.624 0.02 . 1 . . . . . . . . 5686 1 225 . 1 1 18 18 LYS HE2 H 1 2.882 0.02 . 1 . . . . . . . . 5686 1 226 . 1 1 18 18 LYS HE3 H 1 2.882 0.02 . 1 . . . . . . . . 5686 1 227 . 1 1 18 18 LYS C C 13 179 0.2 . 1 . . . . . . . . 5686 1 228 . 1 1 18 18 LYS CA C 13 58.52 0.1 . 1 . . . . . . . . 5686 1 229 . 1 1 18 18 LYS CB C 13 31.23 0.1 . 1 . . . . . . . . 5686 1 230 . 1 1 18 18 LYS CG C 13 24.3 0.1 . 1 . . . . . . . . 5686 1 231 . 1 1 18 18 LYS CD C 13 28.24 0.1 . 1 . . . . . . . . 5686 1 232 . 1 1 18 18 LYS CE C 13 40.98 0.1 . 1 . . . . . . . . 5686 1 233 . 1 1 18 18 LYS N N 15 117.6 0.2 . 1 . . . . . . . . 5686 1 234 . 1 1 19 19 GLY H H 1 7.818 0.02 . 1 . . . . . . . . 5686 1 235 . 1 1 19 19 GLY HA2 H 1 3.797 0.02 . 2 . . . . . . . . 5686 1 236 . 1 1 19 19 GLY HA3 H 1 3.307 0.02 . 2 . . . . . . . . 5686 1 237 . 1 1 19 19 GLY C C 13 175.7 0.2 . 1 . . . . . . . . 5686 1 238 . 1 1 19 19 GLY CA C 13 46.07 0.1 . 1 . . . . . . . . 5686 1 239 . 1 1 19 19 GLY N N 15 106.5 0.2 . 1 . . . . . . . . 5686 1 240 . 1 1 20 20 LEU H H 1 8.509 0.02 . 1 . . . . . . . . 5686 1 241 . 1 1 20 20 LEU HA H 1 3.995 0.02 . 1 . . . . . . . . 5686 1 242 . 1 1 20 20 LEU HB2 H 1 1.913 0.02 . 2 . . . . . . . . 5686 1 243 . 1 1 20 20 LEU HB3 H 1 1.251 0.02 . 2 . . . . . . . . 5686 1 244 . 1 1 20 20 LEU HG H 1 1.626 0.02 . 1 . . . . . . . . 5686 1 245 . 1 1 20 20 LEU HD11 H 1 0.5537 0.02 . 2 . . . . . . . . 5686 1 246 . 1 1 20 20 LEU HD12 H 1 0.5537 0.02 . 2 . . . . . . . . 5686 1 247 . 1 1 20 20 LEU HD13 H 1 0.5537 0.02 . 2 . . . . . . . . 5686 1 248 . 1 1 20 20 LEU HD21 H 1 0.5452 0.02 . 2 . . . . . . . . 5686 1 249 . 1 1 20 20 LEU HD22 H 1 0.5452 0.02 . 2 . . . . . . . . 5686 1 250 . 1 1 20 20 LEU HD23 H 1 0.5452 0.02 . 2 . . . . . . . . 5686 1 251 . 1 1 20 20 LEU C C 13 179 0.2 . 1 . . . . . . . . 5686 1 252 . 1 1 20 20 LEU CA C 13 56.6 0.1 . 1 . . . . . . . . 5686 1 253 . 1 1 20 20 LEU CB C 13 39.73 0.1 . 1 . . . . . . . . 5686 1 254 . 1 1 20 20 LEU CD1 C 13 26.45 0.1 . 2 . . . . . . . . 5686 1 255 . 1 1 20 20 LEU CD2 C 13 22.53 0.1 . 2 . . . . . . . . 5686 1 256 . 1 1 20 20 LEU N N 15 121.8 0.2 . 1 . . . . . . . . 5686 1 257 . 1 1 21 21 ASN H H 1 8.73 0.02 . 1 . . . . . . . . 5686 1 258 . 1 1 21 21 ASN HA H 1 4.691 0.02 . 1 . . . . . . . . 5686 1 259 . 1 1 21 21 ASN HB2 H 1 3.002 0.02 . 2 . . . . . . . . 5686 1 260 . 1 1 21 21 ASN HB3 H 1 2.826 0.02 . 2 . . . . . . . . 5686 1 261 . 1 1 21 21 ASN C C 13 179.2 0.2 . 1 . . . . . . . . 5686 1 262 . 1 1 21 21 ASN CA C 13 55.33 0.1 . 1 . . . . . . . . 5686 1 263 . 1 1 21 21 ASN CB C 13 37.84 0.1 . 1 . . . . . . . . 5686 1 264 . 1 1 21 21 ASN N N 15 120.3 0.2 . 1 . . . . . . . . 5686 1 265 . 1 1 22 22 VAL H H 1 7.843 0.02 . 1 . . . . . . . . 5686 1 266 . 1 1 22 22 VAL HA H 1 3.796 0.02 . 1 . . . . . . . . 5686 1 267 . 1 1 22 22 VAL HB H 1 2.201 0.02 . 1 . . . . . . . . 5686 1 268 . 1 1 22 22 VAL HG11 H 1 1.088 0.02 . 2 . . . . . . . . 5686 1 269 . 1 1 22 22 VAL HG12 H 1 1.088 0.02 . 2 . . . . . . . . 5686 1 270 . 1 1 22 22 VAL HG13 H 1 1.088 0.02 . 2 . . . . . . . . 5686 1 271 . 1 1 22 22 VAL HG21 H 1 0.9437 0.02 . 2 . . . . . . . . 5686 1 272 . 1 1 22 22 VAL HG22 H 1 0.9437 0.02 . 2 . . . . . . . . 5686 1 273 . 1 1 22 22 VAL HG23 H 1 0.9437 0.02 . 2 . . . . . . . . 5686 1 274 . 1 1 22 22 VAL C C 13 176.8 0.2 . 1 . . . . . . . . 5686 1 275 . 1 1 22 22 VAL CA C 13 64.68 0.1 . 1 . . . . . . . . 5686 1 276 . 1 1 22 22 VAL CB C 13 30.83 0.1 . 1 . . . . . . . . 5686 1 277 . 1 1 22 22 VAL CG1 C 13 21.33 0.1 . 2 . . . . . . . . 5686 1 278 . 1 1 22 22 VAL CG2 C 13 20.21 0.1 . 2 . . . . . . . . 5686 1 279 . 1 1 22 22 VAL N N 15 119.4 0.2 . 1 . . . . . . . . 5686 1 280 . 1 1 23 23 LYS H H 1 6.931 0.02 . 1 . . . . . . . . 5686 1 281 . 1 1 23 23 LYS HA H 1 4.254 0.02 . 1 . . . . . . . . 5686 1 282 . 1 1 23 23 LYS HB2 H 1 1.937 0.02 . 2 . . . . . . . . 5686 1 283 . 1 1 23 23 LYS HB3 H 1 1.62 0.02 . 2 . . . . . . . . 5686 1 284 . 1 1 23 23 LYS HG2 H 1 1.358 0.02 . 1 . . . . . . . . 5686 1 285 . 1 1 23 23 LYS HG3 H 1 1.358 0.02 . 1 . . . . . . . . 5686 1 286 . 1 1 23 23 LYS HD2 H 1 1.572 0.02 . 2 . . . . . . . . 5686 1 287 . 1 1 23 23 LYS HD3 H 1 1.501 0.02 . 2 . . . . . . . . 5686 1 288 . 1 1 23 23 LYS HE2 H 1 2.862 0.02 . 1 . . . . . . . . 5686 1 289 . 1 1 23 23 LYS HE3 H 1 2.862 0.02 . 1 . . . . . . . . 5686 1 290 . 1 1 23 23 LYS C C 13 175.2 0.2 . 1 . . . . . . . . 5686 1 291 . 1 1 23 23 LYS CA C 13 53.59 0.1 . 1 . . . . . . . . 5686 1 292 . 1 1 23 23 LYS CB C 13 31.4 0.1 . 1 . . . . . . . . 5686 1 293 . 1 1 23 23 LYS CG C 13 23.61 0.1 . 1 . . . . . . . . 5686 1 294 . 1 1 23 23 LYS CD C 13 26.97 0.1 . 1 . . . . . . . . 5686 1 295 . 1 1 23 23 LYS N N 15 117.3 0.2 . 1 . . . . . . . . 5686 1 296 . 1 1 24 24 GLY H H 1 7.714 0.02 . 1 . . . . . . . . 5686 1 297 . 1 1 24 24 GLY HA2 H 1 3.99 0.02 . 2 . . . . . . . . 5686 1 298 . 1 1 24 24 GLY HA3 H 1 3.605 0.02 . 2 . . . . . . . . 5686 1 299 . 1 1 24 24 GLY C C 13 174 0.2 . 1 . . . . . . . . 5686 1 300 . 1 1 24 24 GLY CA C 13 44.17 0.1 . 1 . . . . . . . . 5686 1 301 . 1 1 24 24 GLY N N 15 105.8 0.2 . 1 . . . . . . . . 5686 1 302 . 1 1 25 25 PHE H H 1 7.657 0.02 . 1 . . . . . . . . 5686 1 303 . 1 1 25 25 PHE HA H 1 4.694 0.02 . 1 . . . . . . . . 5686 1 304 . 1 1 25 25 PHE HB2 H 1 2.752 0.02 . 2 . . . . . . . . 5686 1 305 . 1 1 25 25 PHE HB3 H 1 2.682 0.02 . 2 . . . . . . . . 5686 1 306 . 1 1 25 25 PHE HD1 H 1 6.958 0.02 . 1 . . . . . . . . 5686 1 307 . 1 1 25 25 PHE HD2 H 1 6.958 0.02 . 1 . . . . . . . . 5686 1 308 . 1 1 25 25 PHE HE1 H 1 7.089 0.02 . 1 . . . . . . . . 5686 1 309 . 1 1 25 25 PHE HE2 H 1 7.089 0.02 . 1 . . . . . . . . 5686 1 310 . 1 1 25 25 PHE C C 13 174.9 0.2 . 1 . . . . . . . . 5686 1 311 . 1 1 25 25 PHE CA C 13 55.4 0.1 . 1 . . . . . . . . 5686 1 312 . 1 1 25 25 PHE CB C 13 38.9 0.1 . 1 . . . . . . . . 5686 1 313 . 1 1 25 25 PHE N N 15 118.6 0.2 . 1 . . . . . . . . 5686 1 314 . 1 1 26 26 MET H H 1 8.38 0.02 . 1 . . . . . . . . 5686 1 315 . 1 1 26 26 MET HA H 1 4.515 0.02 . 1 . . . . . . . . 5686 1 316 . 1 1 26 26 MET HB2 H 1 2.026 0.02 . 2 . . . . . . . . 5686 1 317 . 1 1 26 26 MET HB3 H 1 1.958 0.02 . 2 . . . . . . . . 5686 1 318 . 1 1 26 26 MET HG2 H 1 2.626 0.02 . 2 . . . . . . . . 5686 1 319 . 1 1 26 26 MET HG3 H 1 2.541 0.02 . 2 . . . . . . . . 5686 1 320 . 1 1 26 26 MET HE1 H 1 2.022 0.02 . 1 . . . . . . . . 5686 1 321 . 1 1 26 26 MET HE2 H 1 2.022 0.02 . 1 . . . . . . . . 5686 1 322 . 1 1 26 26 MET HE3 H 1 2.022 0.02 . 1 . . . . . . . . 5686 1 323 . 1 1 26 26 MET C C 13 174.3 0.2 . 1 . . . . . . . . 5686 1 324 . 1 1 26 26 MET CA C 13 53.99 0.1 . 1 . . . . . . . . 5686 1 325 . 1 1 26 26 MET CB C 13 33.44 0.1 . 1 . . . . . . . . 5686 1 326 . 1 1 26 26 MET CG C 13 31.69 0.1 . 1 . . . . . . . . 5686 1 327 . 1 1 26 26 MET CE C 13 16.61 0.1 . 1 . . . . . . . . 5686 1 328 . 1 1 26 26 MET N N 15 120.7 0.2 . 1 . . . . . . . . 5686 1 329 . 1 1 27 27 ALA H H 1 8.662 0.02 . 1 . . . . . . . . 5686 1 330 . 1 1 27 27 ALA HA H 1 5.756 0.02 . 1 . . . . . . . . 5686 1 331 . 1 1 27 27 ALA HB1 H 1 1.065 0.02 . 1 . . . . . . . . 5686 1 332 . 1 1 27 27 ALA HB2 H 1 1.065 0.02 . 1 . . . . . . . . 5686 1 333 . 1 1 27 27 ALA HB3 H 1 1.065 0.02 . 1 . . . . . . . . 5686 1 334 . 1 1 27 27 ALA C C 13 174.3 0.2 . 1 . . . . . . . . 5686 1 335 . 1 1 27 27 ALA CA C 13 49.75 0.1 . 1 . . . . . . . . 5686 1 336 . 1 1 27 27 ALA CB C 13 21.6 0.1 . 1 . . . . . . . . 5686 1 337 . 1 1 27 27 ALA N N 15 124.6 0.2 . 1 . . . . . . . . 5686 1 338 . 1 1 28 28 ASP H H 1 8.54 0.02 . 1 . . . . . . . . 5686 1 339 . 1 1 28 28 ASP HA H 1 5.095 0.02 . 1 . . . . . . . . 5686 1 340 . 1 1 28 28 ASP HB2 H 1 2.559 0.02 . 2 . . . . . . . . 5686 1 341 . 1 1 28 28 ASP HB3 H 1 2.468 0.02 . 2 . . . . . . . . 5686 1 342 . 1 1 28 28 ASP C C 13 173.2 0.2 . 1 . . . . . . . . 5686 1 343 . 1 1 28 28 ASP CA C 13 52.06 0.1 . 1 . . . . . . . . 5686 1 344 . 1 1 28 28 ASP CB C 13 43.14 0.1 . 1 . . . . . . . . 5686 1 345 . 1 1 28 28 ASP N N 15 119.1 0.2 . 1 . . . . . . . . 5686 1 346 . 1 1 29 29 VAL H H 1 8.591 0.02 . 1 . . . . . . . . 5686 1 347 . 1 1 29 29 VAL HA H 1 4.96 0.02 . 1 . . . . . . . . 5686 1 348 . 1 1 29 29 VAL HB H 1 1.847 0.02 . 1 . . . . . . . . 5686 1 349 . 1 1 29 29 VAL HG11 H 1 0.7967 0.02 . 2 . . . . . . . . 5686 1 350 . 1 1 29 29 VAL HG12 H 1 0.7967 0.02 . 2 . . . . . . . . 5686 1 351 . 1 1 29 29 VAL HG13 H 1 0.7967 0.02 . 2 . . . . . . . . 5686 1 352 . 1 1 29 29 VAL HG21 H 1 0.721 0.02 . 2 . . . . . . . . 5686 1 353 . 1 1 29 29 VAL HG22 H 1 0.721 0.02 . 2 . . . . . . . . 5686 1 354 . 1 1 29 29 VAL HG23 H 1 0.721 0.02 . 2 . . . . . . . . 5686 1 355 . 1 1 29 29 VAL C C 13 175.4 0.2 . 1 . . . . . . . . 5686 1 356 . 1 1 29 29 VAL CA C 13 59.7 0.1 . 1 . . . . . . . . 5686 1 357 . 1 1 29 29 VAL CB C 13 32.54 0.1 . 1 . . . . . . . . 5686 1 358 . 1 1 29 29 VAL CG1 C 13 21.12 0.1 . 2 . . . . . . . . 5686 1 359 . 1 1 29 29 VAL CG2 C 13 20.61 0.1 . 2 . . . . . . . . 5686 1 360 . 1 1 29 29 VAL N N 15 121.3 0.2 . 1 . . . . . . . . 5686 1 361 . 1 1 30 30 THR H H 1 8.952 0.02 . 1 . . . . . . . . 5686 1 362 . 1 1 30 30 THR HA H 1 4.709 0.02 . 1 . . . . . . . . 5686 1 363 . 1 1 30 30 THR HB H 1 3.859 0.02 . 1 . . . . . . . . 5686 1 364 . 1 1 30 30 THR HG21 H 1 0.893 0.02 . 1 . . . . . . . . 5686 1 365 . 1 1 30 30 THR HG22 H 1 0.893 0.02 . 1 . . . . . . . . 5686 1 366 . 1 1 30 30 THR HG23 H 1 0.893 0.02 . 1 . . . . . . . . 5686 1 367 . 1 1 30 30 THR C C 13 171.4 0.2 . 1 . . . . . . . . 5686 1 368 . 1 1 30 30 THR CA C 13 58.83 0.1 . 1 . . . . . . . . 5686 1 369 . 1 1 30 30 THR CB C 13 68.75 0.1 . 1 . . . . . . . . 5686 1 370 . 1 1 30 30 THR CG2 C 13 20.38 0.1 . 1 . . . . . . . . 5686 1 371 . 1 1 30 30 THR N N 15 121.4 0.2 . 1 . . . . . . . . 5686 1 372 . 1 1 31 31 GLU H H 1 8.26 0.02 . 1 . . . . . . . . 5686 1 373 . 1 1 31 31 GLU HA H 1 4.25 0.02 . 1 . . . . . . . . 5686 1 374 . 1 1 31 31 GLU HB2 H 1 2.084 0.02 . 2 . . . . . . . . 5686 1 375 . 1 1 31 31 GLU HB3 H 1 2.008 0.02 . 2 . . . . . . . . 5686 1 376 . 1 1 31 31 GLU HG2 H 1 2.342 0.02 . 2 . . . . . . . . 5686 1 377 . 1 1 31 31 GLU HG3 H 1 2.171 0.02 . 2 . . . . . . . . 5686 1 378 . 1 1 31 31 GLU C C 13 175.4 0.2 . 1 . . . . . . . . 5686 1 379 . 1 1 31 31 GLU CA C 13 55.55 0.1 . 1 . . . . . . . . 5686 1 380 . 1 1 31 31 GLU CB C 13 30.18 0.1 . 1 . . . . . . . . 5686 1 381 . 1 1 31 31 GLU CG C 13 35.02 0.1 . 1 . . . . . . . . 5686 1 382 . 1 1 31 31 GLU N N 15 120.3 0.2 . 1 . . . . . . . . 5686 1 383 . 1 1 32 32 SER H H 1 7.596 0.02 . 1 . . . . . . . . 5686 1 384 . 1 1 32 32 SER HA H 1 4.815 0.02 . 1 . . . . . . . . 5686 1 385 . 1 1 32 32 SER HB2 H 1 4.075 0.02 . 2 . . . . . . . . 5686 1 386 . 1 1 32 32 SER HB3 H 1 3.738 0.02 . 2 . . . . . . . . 5686 1 387 . 1 1 32 32 SER C C 13 173.9 0.2 . 1 . . . . . . . . 5686 1 388 . 1 1 32 32 SER CA C 13 54.6 0.1 . 1 . . . . . . . . 5686 1 389 . 1 1 32 32 SER CB C 13 65.78 0.1 . 1 . . . . . . . . 5686 1 390 . 1 1 32 32 SER N N 15 111.9 0.2 . 1 . . . . . . . . 5686 1 391 . 1 1 33 33 LEU H H 1 8.874 0.02 . 1 . . . . . . . . 5686 1 392 . 1 1 33 33 LEU HA H 1 3.533 0.02 . 1 . . . . . . . . 5686 1 393 . 1 1 33 33 LEU HB2 H 1 1.415 0.02 . 2 . . . . . . . . 5686 1 394 . 1 1 33 33 LEU HB3 H 1 1.234 0.02 . 2 . . . . . . . . 5686 1 395 . 1 1 33 33 LEU HG H 1 1.356 0.02 . 1 . . . . . . . . 5686 1 396 . 1 1 33 33 LEU HD11 H 1 0.4509 0.02 . 2 . . . . . . . . 5686 1 397 . 1 1 33 33 LEU HD12 H 1 0.4509 0.02 . 2 . . . . . . . . 5686 1 398 . 1 1 33 33 LEU HD13 H 1 0.4509 0.02 . 2 . . . . . . . . 5686 1 399 . 1 1 33 33 LEU HD21 H 1 0.1759 0.02 . 2 . . . . . . . . 5686 1 400 . 1 1 33 33 LEU HD22 H 1 0.1759 0.02 . 2 . . . . . . . . 5686 1 401 . 1 1 33 33 LEU HD23 H 1 0.1759 0.02 . 2 . . . . . . . . 5686 1 402 . 1 1 33 33 LEU C C 13 178.1 0.2 . 1 . . . . . . . . 5686 1 403 . 1 1 33 33 LEU CA C 13 56.9 0.1 . 1 . . . . . . . . 5686 1 404 . 1 1 33 33 LEU CB C 13 40.27 0.1 . 1 . . . . . . . . 5686 1 405 . 1 1 33 33 LEU CG C 13 25.25 0.1 . 1 . . . . . . . . 5686 1 406 . 1 1 33 33 LEU CD1 C 13 24.94 0.1 . 2 . . . . . . . . 5686 1 407 . 1 1 33 33 LEU CD2 C 13 22.64 0.1 . 2 . . . . . . . . 5686 1 408 . 1 1 33 33 LEU N N 15 124.4 0.2 . 1 . . . . . . . . 5686 1 409 . 1 1 34 34 GLU H H 1 8.677 0.02 . 1 . . . . . . . . 5686 1 410 . 1 1 34 34 GLU HA H 1 3.992 0.02 . 1 . . . . . . . . 5686 1 411 . 1 1 34 34 GLU HB2 H 1 1.943 0.02 . 2 . . . . . . . . 5686 1 412 . 1 1 34 34 GLU HB3 H 1 1.846 0.02 . 2 . . . . . . . . 5686 1 413 . 1 1 34 34 GLU HG2 H 1 2.343 0.02 . 2 . . . . . . . . 5686 1 414 . 1 1 34 34 GLU HG3 H 1 2.195 0.02 . 2 . . . . . . . . 5686 1 415 . 1 1 34 34 GLU C C 13 179.1 0.2 . 1 . . . . . . . . 5686 1 416 . 1 1 34 34 GLU CA C 13 59.41 0.1 . 1 . . . . . . . . 5686 1 417 . 1 1 34 34 GLU CB C 13 27.91 0.1 . 1 . . . . . . . . 5686 1 418 . 1 1 34 34 GLU CG C 13 35.74 0.1 . 1 . . . . . . . . 5686 1 419 . 1 1 34 34 GLU N N 15 118.4 0.2 . 1 . . . . . . . . 5686 1 420 . 1 1 35 35 ASP H H 1 7.788 0.02 . 1 . . . . . . . . 5686 1 421 . 1 1 35 35 ASP HA H 1 4.543 0.02 . 1 . . . . . . . . 5686 1 422 . 1 1 35 35 ASP HB2 H 1 2.704 0.02 . 2 . . . . . . . . 5686 1 423 . 1 1 35 35 ASP HB3 H 1 2.642 0.02 . 2 . . . . . . . . 5686 1 424 . 1 1 35 35 ASP C C 13 178.2 0.2 . 1 . . . . . . . . 5686 1 425 . 1 1 35 35 ASP CA C 13 56.05 0.1 . 1 . . . . . . . . 5686 1 426 . 1 1 35 35 ASP CB C 13 39.68 0.1 . 1 . . . . . . . . 5686 1 427 . 1 1 35 35 ASP N N 15 120.6 0.2 . 1 . . . . . . . . 5686 1 428 . 1 1 36 36 GLY H H 1 8.26 0.02 . 1 . . . . . . . . 5686 1 429 . 1 1 36 36 GLY HA2 H 1 3.69 0.02 . 2 . . . . . . . . 5686 1 430 . 1 1 36 36 GLY HA3 H 1 3.35 0.02 . 2 . . . . . . . . 5686 1 431 . 1 1 36 36 GLY C C 13 173.4 0.2 . 1 . . . . . . . . 5686 1 432 . 1 1 36 36 GLY CA C 13 46.76 0.1 . 1 . . . . . . . . 5686 1 433 . 1 1 36 36 GLY N N 15 107.6 0.2 . 1 . . . . . . . . 5686 1 434 . 1 1 37 37 GLU H H 1 8.708 0.02 . 1 . . . . . . . . 5686 1 435 . 1 1 37 37 GLU HA H 1 3.85 0.02 . 1 . . . . . . . . 5686 1 436 . 1 1 37 37 GLU HB2 H 1 2.18 0.02 . 2 . . . . . . . . 5686 1 437 . 1 1 37 37 GLU HB3 H 1 2.08 0.02 . 2 . . . . . . . . 5686 1 438 . 1 1 37 37 GLU HG2 H 1 2.375 0.02 . 2 . . . . . . . . 5686 1 439 . 1 1 37 37 GLU HG3 H 1 2.21 0.02 . 2 . . . . . . . . 5686 1 440 . 1 1 37 37 GLU C C 13 177.9 0.2 . 1 . . . . . . . . 5686 1 441 . 1 1 37 37 GLU CA C 13 59.76 0.1 . 1 . . . . . . . . 5686 1 442 . 1 1 37 37 GLU CB C 13 28.76 0.1 . 1 . . . . . . . . 5686 1 443 . 1 1 37 37 GLU CG C 13 36.42 0.1 . 1 . . . . . . . . 5686 1 444 . 1 1 37 37 GLU N N 15 121.2 0.2 . 1 . . . . . . . . 5686 1 445 . 1 1 38 38 TYR H H 1 7.497 0.02 . 1 . . . . . . . . 5686 1 446 . 1 1 38 38 TYR HA H 1 4.367 0.02 . 1 . . . . . . . . 5686 1 447 . 1 1 38 38 TYR HB2 H 1 3.213 0.02 . 1 . . . . . . . . 5686 1 448 . 1 1 38 38 TYR HB3 H 1 3.213 0.02 . 1 . . . . . . . . 5686 1 449 . 1 1 38 38 TYR HD1 H 1 7.166 0.02 . 1 . . . . . . . . 5686 1 450 . 1 1 38 38 TYR HD2 H 1 7.166 0.02 . 1 . . . . . . . . 5686 1 451 . 1 1 38 38 TYR HE1 H 1 6.737 0.02 . 1 . . . . . . . . 5686 1 452 . 1 1 38 38 TYR HE2 H 1 6.737 0.02 . 1 . . . . . . . . 5686 1 453 . 1 1 38 38 TYR C C 13 177.6 0.2 . 1 . . . . . . . . 5686 1 454 . 1 1 38 38 TYR CA C 13 59.94 0.1 . 1 . . . . . . . . 5686 1 455 . 1 1 38 38 TYR CB C 13 36.91 0.1 . 1 . . . . . . . . 5686 1 456 . 1 1 38 38 TYR N N 15 119.4 0.2 . 1 . . . . . . . . 5686 1 457 . 1 1 39 39 LEU H H 1 8.299 0.02 . 1 . . . . . . . . 5686 1 458 . 1 1 39 39 LEU HA H 1 3.832 0.02 . 1 . . . . . . . . 5686 1 459 . 1 1 39 39 LEU HB2 H 1 1.944 0.02 . 2 . . . . . . . . 5686 1 460 . 1 1 39 39 LEU HB3 H 1 1.749 0.02 . 2 . . . . . . . . 5686 1 461 . 1 1 39 39 LEU HG H 1 1.534 0.02 . 1 . . . . . . . . 5686 1 462 . 1 1 39 39 LEU HD11 H 1 0.8168 0.02 . 2 . . . . . . . . 5686 1 463 . 1 1 39 39 LEU HD12 H 1 0.8168 0.02 . 2 . . . . . . . . 5686 1 464 . 1 1 39 39 LEU HD13 H 1 0.8168 0.02 . 2 . . . . . . . . 5686 1 465 . 1 1 39 39 LEU HD21 H 1 0.7678 0.02 . 2 . . . . . . . . 5686 1 466 . 1 1 39 39 LEU HD22 H 1 0.7678 0.02 . 2 . . . . . . . . 5686 1 467 . 1 1 39 39 LEU HD23 H 1 0.7678 0.02 . 2 . . . . . . . . 5686 1 468 . 1 1 39 39 LEU C C 13 179.2 0.2 . 1 . . . . . . . . 5686 1 469 . 1 1 39 39 LEU CA C 13 56.98 0.1 . 1 . . . . . . . . 5686 1 470 . 1 1 39 39 LEU CB C 13 39.96 0.1 . 1 . . . . . . . . 5686 1 471 . 1 1 39 39 LEU CD2 C 13 24.39 0.1 . 2 . . . . . . . . 5686 1 472 . 1 1 39 39 LEU N N 15 119.5 0.2 . 1 . . . . . . . . 5686 1 473 . 1 1 40 40 MET H H 1 7.918 0.02 . 1 . . . . . . . . 5686 1 474 . 1 1 40 40 MET HA H 1 4.343 0.02 . 1 . . . . . . . . 5686 1 475 . 1 1 40 40 MET HB2 H 1 2.05 0.02 . 2 . . . . . . . . 5686 1 476 . 1 1 40 40 MET HB3 H 1 1.868 0.02 . 2 . . . . . . . . 5686 1 477 . 1 1 40 40 MET HG2 H 1 2.667 0.02 . 2 . . . . . . . . 5686 1 478 . 1 1 40 40 MET HG3 H 1 2.193 0.02 . 2 . . . . . . . . 5686 1 479 . 1 1 40 40 MET HE1 H 1 1.735 0.02 . 1 . . . . . . . . 5686 1 480 . 1 1 40 40 MET HE2 H 1 1.735 0.02 . 1 . . . . . . . . 5686 1 481 . 1 1 40 40 MET HE3 H 1 1.735 0.02 . 1 . . . . . . . . 5686 1 482 . 1 1 40 40 MET C C 13 175.9 0.2 . 1 . . . . . . . . 5686 1 483 . 1 1 40 40 MET CA C 13 57.43 0.1 . 1 . . . . . . . . 5686 1 484 . 1 1 40 40 MET CB C 13 32.76 0.1 . 1 . . . . . . . . 5686 1 485 . 1 1 40 40 MET CG C 13 32.54 0.1 . 1 . . . . . . . . 5686 1 486 . 1 1 40 40 MET CE C 13 16.46 0.1 . 1 . . . . . . . . 5686 1 487 . 1 1 40 40 MET N N 15 115.4 0.2 . 1 . . . . . . . . 5686 1 488 . 1 1 41 41 ASP H H 1 7.54 0.02 . 1 . . . . . . . . 5686 1 489 . 1 1 41 41 ASP HA H 1 4.771 0.02 . 1 . . . . . . . . 5686 1 490 . 1 1 41 41 ASP HB2 H 1 2.849 0.02 . 2 . . . . . . . . 5686 1 491 . 1 1 41 41 ASP HB3 H 1 2.661 0.02 . 2 . . . . . . . . 5686 1 492 . 1 1 41 41 ASP C C 13 177.3 0.2 . 1 . . . . . . . . 5686 1 493 . 1 1 41 41 ASP CA C 13 54.62 0.1 . 1 . . . . . . . . 5686 1 494 . 1 1 41 41 ASP CB C 13 40.46 0.1 . 1 . . . . . . . . 5686 1 495 . 1 1 41 41 ASP N N 15 116.8 0.2 . 1 . . . . . . . . 5686 1 496 . 1 1 42 42 ILE H H 1 8.034 0.02 . 1 . . . . . . . . 5686 1 497 . 1 1 42 42 ILE HA H 1 4.276 0.02 . 1 . . . . . . . . 5686 1 498 . 1 1 42 42 ILE HB H 1 1.872 0.02 . 1 . . . . . . . . 5686 1 499 . 1 1 42 42 ILE HG12 H 1 1.233 0.02 . 2 . . . . . . . . 5686 1 500 . 1 1 42 42 ILE HG13 H 1 1.006 0.02 . 2 . . . . . . . . 5686 1 501 . 1 1 42 42 ILE HG21 H 1 0.6914 0.02 . 1 . . . . . . . . 5686 1 502 . 1 1 42 42 ILE HG22 H 1 0.6914 0.02 . 1 . . . . . . . . 5686 1 503 . 1 1 42 42 ILE HG23 H 1 0.6914 0.02 . 1 . . . . . . . . 5686 1 504 . 1 1 42 42 ILE HD11 H 1 0.6516 0.02 . 1 . . . . . . . . 5686 1 505 . 1 1 42 42 ILE HD12 H 1 0.6516 0.02 . 1 . . . . . . . . 5686 1 506 . 1 1 42 42 ILE HD13 H 1 0.6516 0.02 . 1 . . . . . . . . 5686 1 507 . 1 1 42 42 ILE C C 13 175.3 0.2 . 1 . . . . . . . . 5686 1 508 . 1 1 42 42 ILE CA C 13 60.81 0.1 . 1 . . . . . . . . 5686 1 509 . 1 1 42 42 ILE CB C 13 38.87 0.1 . 1 . . . . . . . . 5686 1 510 . 1 1 42 42 ILE CG1 C 13 25.68 0.1 . 1 . . . . . . . . 5686 1 511 . 1 1 42 42 ILE CG2 C 13 16.83 0.1 . 1 . . . . . . . . 5686 1 512 . 1 1 42 42 ILE CD1 C 13 12.7 0.1 . 1 . . . . . . . . 5686 1 513 . 1 1 42 42 ILE N N 15 119.8 0.2 . 1 . . . . . . . . 5686 1 514 . 1 1 43 43 ARG H H 1 8.163 0.02 . 1 . . . . . . . . 5686 1 515 . 1 1 43 43 ARG HA H 1 4.33 0.02 . 1 . . . . . . . . 5686 1 516 . 1 1 43 43 ARG HB2 H 1 1.466 0.02 . 2 . . . . . . . . 5686 1 517 . 1 1 43 43 ARG HB3 H 1 1.213 0.02 . 2 . . . . . . . . 5686 1 518 . 1 1 43 43 ARG HG2 H 1 1.345 0.02 . 2 . . . . . . . . 5686 1 519 . 1 1 43 43 ARG HG3 H 1 1.239 0.02 . 2 . . . . . . . . 5686 1 520 . 1 1 43 43 ARG HD2 H 1 3.006 0.02 . 2 . . . . . . . . 5686 1 521 . 1 1 43 43 ARG HD3 H 1 2.75 0.02 . 2 . . . . . . . . 5686 1 522 . 1 1 43 43 ARG C C 13 172.4 0.2 . 1 . . . . . . . . 5686 1 523 . 1 1 43 43 ARG CA C 13 53.64 0.1 . 1 . . . . . . . . 5686 1 524 . 1 1 43 43 ARG CB C 13 31.96 0.1 . 1 . . . . . . . . 5686 1 525 . 1 1 43 43 ARG CG C 13 26.33 0.1 . 1 . . . . . . . . 5686 1 526 . 1 1 43 43 ARG N N 15 122.4 0.2 . 1 . . . . . . . . 5686 1 527 . 1 1 44 44 ASN H H 1 7.872 0.02 . 1 . . . . . . . . 5686 1 528 . 1 1 44 44 ASN HA H 1 4.678 0.02 . 1 . . . . . . . . 5686 1 529 . 1 1 44 44 ASN HB2 H 1 2.515 0.02 . 2 . . . . . . . . 5686 1 530 . 1 1 44 44 ASN HB3 H 1 2.403 0.02 . 2 . . . . . . . . 5686 1 531 . 1 1 44 44 ASN C C 13 173.8 0.2 . 1 . . . . . . . . 5686 1 532 . 1 1 44 44 ASN CA C 13 51.83 0.1 . 1 . . . . . . . . 5686 1 533 . 1 1 44 44 ASN CB C 13 38.18 0.1 . 1 . . . . . . . . 5686 1 534 . 1 1 44 44 ASN N N 15 117 0.2 . 1 . . . . . . . . 5686 1 535 . 1 1 45 45 TYR H H 1 8.369 0.02 . 1 . . . . . . . . 5686 1 536 . 1 1 45 45 TYR HA H 1 4.268 0.02 . 1 . . . . . . . . 5686 1 537 . 1 1 45 45 TYR HB2 H 1 2.781 0.02 . 2 . . . . . . . . 5686 1 538 . 1 1 45 45 TYR HB3 H 1 2.393 0.02 . 2 . . . . . . . . 5686 1 539 . 1 1 45 45 TYR HD1 H 1 6.735 0.02 . 1 . . . . . . . . 5686 1 540 . 1 1 45 45 TYR HD2 H 1 6.735 0.02 . 1 . . . . . . . . 5686 1 541 . 1 1 45 45 TYR HE1 H 1 6.466 0.02 . 1 . . . . . . . . 5686 1 542 . 1 1 45 45 TYR HE2 H 1 6.466 0.02 . 1 . . . . . . . . 5686 1 543 . 1 1 45 45 TYR C C 13 173.7 0.2 . 1 . . . . . . . . 5686 1 544 . 1 1 45 45 TYR CA C 13 57.63 0.1 . 1 . . . . . . . . 5686 1 545 . 1 1 45 45 TYR CB C 13 39.83 0.1 . 1 . . . . . . . . 5686 1 546 . 1 1 45 45 TYR N N 15 121.5 0.2 . 1 . . . . . . . . 5686 1 547 . 1 1 46 46 ASP H H 1 9.048 0.02 . 1 . . . . . . . . 5686 1 548 . 1 1 46 46 ASP HA H 1 4.708 0.02 . 1 . . . . . . . . 5686 1 549 . 1 1 46 46 ASP HB2 H 1 2.643 0.02 . 2 . . . . . . . . 5686 1 550 . 1 1 46 46 ASP HB3 H 1 2.198 0.02 . 2 . . . . . . . . 5686 1 551 . 1 1 46 46 ASP C C 13 175.5 0.2 . 1 . . . . . . . . 5686 1 552 . 1 1 46 46 ASP CA C 13 54.76 0.1 . 1 . . . . . . . . 5686 1 553 . 1 1 46 46 ASP CB C 13 43.51 0.1 . 1 . . . . . . . . 5686 1 554 . 1 1 46 46 ASP N N 15 118.4 0.2 . 1 . . . . . . . . 5686 1 555 . 1 1 47 47 LEU H H 1 7.541 0.02 . 1 . . . . . . . . 5686 1 556 . 1 1 47 47 LEU HA H 1 5.316 0.02 . 1 . . . . . . . . 5686 1 557 . 1 1 47 47 LEU HB2 H 1 1.708 0.02 . 2 . . . . . . . . 5686 1 558 . 1 1 47 47 LEU HB3 H 1 1.163 0.02 . 2 . . . . . . . . 5686 1 559 . 1 1 47 47 LEU HG H 1 1.554 0.02 . 1 . . . . . . . . 5686 1 560 . 1 1 47 47 LEU HD11 H 1 0.6752 0.02 . 2 . . . . . . . . 5686 1 561 . 1 1 47 47 LEU HD12 H 1 0.6752 0.02 . 2 . . . . . . . . 5686 1 562 . 1 1 47 47 LEU HD13 H 1 0.6752 0.02 . 2 . . . . . . . . 5686 1 563 . 1 1 47 47 LEU HD21 H 1 0.5411 0.02 . 2 . . . . . . . . 5686 1 564 . 1 1 47 47 LEU HD22 H 1 0.5411 0.02 . 2 . . . . . . . . 5686 1 565 . 1 1 47 47 LEU HD23 H 1 0.5411 0.02 . 2 . . . . . . . . 5686 1 566 . 1 1 47 47 LEU C C 13 173 0.2 . 1 . . . . . . . . 5686 1 567 . 1 1 47 47 LEU CA C 13 53.36 0.1 . 1 . . . . . . . . 5686 1 568 . 1 1 47 47 LEU CB C 13 45.01 0.1 . 1 . . . . . . . . 5686 1 569 . 1 1 47 47 LEU CD1 C 13 27.58 0.1 . 2 . . . . . . . . 5686 1 570 . 1 1 47 47 LEU CD2 C 13 25.06 0.1 . 2 . . . . . . . . 5686 1 571 . 1 1 47 47 LEU N N 15 119.4 0.2 . 1 . . . . . . . . 5686 1 572 . 1 1 48 48 VAL H H 1 9.233 0.02 . 1 . . . . . . . . 5686 1 573 . 1 1 48 48 VAL HA H 1 5.345 0.02 . 1 . . . . . . . . 5686 1 574 . 1 1 48 48 VAL HB H 1 1.835 0.02 . 1 . . . . . . . . 5686 1 575 . 1 1 48 48 VAL HG11 H 1 0.815 0.02 . 2 . . . . . . . . 5686 1 576 . 1 1 48 48 VAL HG12 H 1 0.815 0.02 . 2 . . . . . . . . 5686 1 577 . 1 1 48 48 VAL HG13 H 1 0.815 0.02 . 2 . . . . . . . . 5686 1 578 . 1 1 48 48 VAL HG21 H 1 0.918 0.02 . 2 . . . . . . . . 5686 1 579 . 1 1 48 48 VAL HG22 H 1 0.918 0.02 . 2 . . . . . . . . 5686 1 580 . 1 1 48 48 VAL HG23 H 1 0.918 0.02 . 2 . . . . . . . . 5686 1 581 . 1 1 48 48 VAL C C 13 172.3 0.2 . 1 . . . . . . . . 5686 1 582 . 1 1 48 48 VAL CA C 13 57.78 0.1 . 1 . . . . . . . . 5686 1 583 . 1 1 48 48 VAL CB C 13 34.35 0.1 . 1 . . . . . . . . 5686 1 584 . 1 1 48 48 VAL CG1 C 13 20.72 0.1 . 2 . . . . . . . . 5686 1 585 . 1 1 48 48 VAL CG2 C 13 19.87 0.1 . 2 . . . . . . . . 5686 1 586 . 1 1 48 48 VAL N N 15 124.6 0.2 . 1 . . . . . . . . 5686 1 587 . 1 1 49 49 MET H H 1 9.02 0.02 . 1 . . . . . . . . 5686 1 588 . 1 1 49 49 MET HA H 1 5.426 0.02 . 1 . . . . . . . . 5686 1 589 . 1 1 49 49 MET HB2 H 1 2.058 0.02 . 2 . . . . . . . . 5686 1 590 . 1 1 49 49 MET HB3 H 1 1.308 0.02 . 2 . . . . . . . . 5686 1 591 . 1 1 49 49 MET HG2 H 1 2.202 0.02 . 2 . . . . . . . . 5686 1 592 . 1 1 49 49 MET HG3 H 1 1.976 0.02 . 2 . . . . . . . . 5686 1 593 . 1 1 49 49 MET HE1 H 1 1.774 0.02 . 1 . . . . . . . . 5686 1 594 . 1 1 49 49 MET HE2 H 1 1.774 0.02 . 1 . . . . . . . . 5686 1 595 . 1 1 49 49 MET HE3 H 1 1.774 0.02 . 1 . . . . . . . . 5686 1 596 . 1 1 49 49 MET C C 13 173.5 0.2 . 1 . . . . . . . . 5686 1 597 . 1 1 49 49 MET CA C 13 52.85 0.1 . 1 . . . . . . . . 5686 1 598 . 1 1 49 49 MET CB C 13 34.93 0.1 . 1 . . . . . . . . 5686 1 599 . 1 1 49 49 MET CG C 13 30.75 0.1 . 1 . . . . . . . . 5686 1 600 . 1 1 49 49 MET CE C 13 17.16 0.1 . 1 . . . . . . . . 5686 1 601 . 1 1 49 49 MET N N 15 128.2 0.2 . 1 . . . . . . . . 5686 1 602 . 1 1 50 50 VAL H H 1 8.88 0.02 . 1 . . . . . . . . 5686 1 603 . 1 1 50 50 VAL HA H 1 4.691 0.02 . 1 . . . . . . . . 5686 1 604 . 1 1 50 50 VAL HB H 1 1.738 0.02 . 1 . . . . . . . . 5686 1 605 . 1 1 50 50 VAL HG11 H 1 0.6274 0.02 . 2 . . . . . . . . 5686 1 606 . 1 1 50 50 VAL HG12 H 1 0.6274 0.02 . 2 . . . . . . . . 5686 1 607 . 1 1 50 50 VAL HG13 H 1 0.6274 0.02 . 2 . . . . . . . . 5686 1 608 . 1 1 50 50 VAL HG21 H 1 1.002 0.02 . 2 . . . . . . . . 5686 1 609 . 1 1 50 50 VAL HG22 H 1 1.002 0.02 . 2 . . . . . . . . 5686 1 610 . 1 1 50 50 VAL HG23 H 1 1.002 0.02 . 2 . . . . . . . . 5686 1 611 . 1 1 50 50 VAL C C 13 171.9 0.2 . 1 . . . . . . . . 5686 1 612 . 1 1 50 50 VAL CA C 13 58.16 0.1 . 1 . . . . . . . . 5686 1 613 . 1 1 50 50 VAL CB C 13 34.12 0.1 . 1 . . . . . . . . 5686 1 614 . 1 1 50 50 VAL CG1 C 13 21.39 0.1 . 2 . . . . . . . . 5686 1 615 . 1 1 50 50 VAL CG2 C 13 18.13 0.1 . 2 . . . . . . . . 5686 1 616 . 1 1 50 50 VAL N N 15 124.9 0.2 . 1 . . . . . . . . 5686 1 617 . 1 1 51 51 SER H H 1 7.526 0.02 . 1 . . . . . . . . 5686 1 618 . 1 1 51 51 SER HA H 1 5.197 0.02 . 1 . . . . . . . . 5686 1 619 . 1 1 51 51 SER HB2 H 1 3.749 0.02 . 2 . . . . . . . . 5686 1 620 . 1 1 51 51 SER HB3 H 1 3.689 0.02 . 2 . . . . . . . . 5686 1 621 . 1 1 51 51 SER C C 13 172.9 0.2 . 1 . . . . . . . . 5686 1 622 . 1 1 51 51 SER CA C 13 55.04 0.1 . 1 . . . . . . . . 5686 1 623 . 1 1 51 51 SER CB C 13 63.22 0.1 . 1 . . . . . . . . 5686 1 624 . 1 1 51 51 SER N N 15 121.2 0.2 . 1 . . . . . . . . 5686 1 625 . 1 1 52 52 ASP H H 1 8.212 0.02 . 1 . . . . . . . . 5686 1 626 . 1 1 52 52 ASP HA H 1 4.49 0.02 . 1 . . . . . . . . 5686 1 627 . 1 1 52 52 ASP HB2 H 1 2.593 0.02 . 2 . . . . . . . . 5686 1 628 . 1 1 52 52 ASP HB3 H 1 1.834 0.02 . 2 . . . . . . . . 5686 1 629 . 1 1 52 52 ASP CA C 13 54.2 0.1 . 1 . . . . . . . . 5686 1 630 . 1 1 52 52 ASP CB C 13 45.01 0.1 . 1 . . . . . . . . 5686 1 631 . 1 1 52 52 ASP N N 15 123.1 0.2 . 1 . . . . . . . . 5686 1 632 . 1 1 53 53 LYS HA H 1 4.197 0.02 . 1 . . . . . . . . 5686 1 633 . 1 1 53 53 LYS HB2 H 1 1.885 0.02 . 2 . . . . . . . . 5686 1 634 . 1 1 53 53 LYS HB3 H 1 1.75 0.02 . 2 . . . . . . . . 5686 1 635 . 1 1 53 53 LYS HG2 H 1 1.442 0.02 . 2 . . . . . . . . 5686 1 636 . 1 1 53 53 LYS HG3 H 1 1.381 0.02 . 2 . . . . . . . . 5686 1 637 . 1 1 53 53 LYS HD2 H 1 1.676 0.02 . 1 . . . . . . . . 5686 1 638 . 1 1 53 53 LYS HD3 H 1 1.676 0.02 . 1 . . . . . . . . 5686 1 639 . 1 1 53 53 LYS HE2 H 1 2.974 0.02 . 1 . . . . . . . . 5686 1 640 . 1 1 53 53 LYS HE3 H 1 2.974 0.02 . 1 . . . . . . . . 5686 1 641 . 1 1 53 53 LYS C C 13 177.1 0.2 . 1 . . . . . . . . 5686 1 642 . 1 1 53 53 LYS CA C 13 58.19 0.1 . 1 . . . . . . . . 5686 1 643 . 1 1 53 53 LYS CB C 13 31.25 0.1 . 1 . . . . . . . . 5686 1 644 . 1 1 53 53 LYS CG C 13 23.38 0.1 . 1 . . . . . . . . 5686 1 645 . 1 1 53 53 LYS CD C 13 28.11 0.1 . 1 . . . . . . . . 5686 1 646 . 1 1 54 54 ASN H H 1 9.734 0.02 . 1 . . . . . . . . 5686 1 647 . 1 1 54 54 ASN HA H 1 5.209 0.02 . 1 . . . . . . . . 5686 1 648 . 1 1 54 54 ASN HB2 H 1 2.993 0.02 . 2 . . . . . . . . 5686 1 649 . 1 1 54 54 ASN HB3 H 1 2.542 0.02 . 2 . . . . . . . . 5686 1 650 . 1 1 54 54 ASN C C 13 175 0.2 . 1 . . . . . . . . 5686 1 651 . 1 1 54 54 ASN CA C 13 51.74 0.1 . 1 . . . . . . . . 5686 1 652 . 1 1 54 54 ASN CB C 13 37.23 0.1 . 1 . . . . . . . . 5686 1 653 . 1 1 54 54 ASN N N 15 119.4 0.2 . 1 . . . . . . . . 5686 1 654 . 1 1 55 55 ALA H H 1 7.733 0.02 . 1 . . . . . . . . 5686 1 655 . 1 1 55 55 ALA HA H 1 3.8 0.02 . 1 . . . . . . . . 5686 1 656 . 1 1 55 55 ALA HB1 H 1 1.529 0.02 . 1 . . . . . . . . 5686 1 657 . 1 1 55 55 ALA HB2 H 1 1.529 0.02 . 1 . . . . . . . . 5686 1 658 . 1 1 55 55 ALA HB3 H 1 1.529 0.02 . 1 . . . . . . . . 5686 1 659 . 1 1 55 55 ALA C C 13 178.4 0.2 . 1 . . . . . . . . 5686 1 660 . 1 1 55 55 ALA CA C 13 54.71 0.1 . 1 . . . . . . . . 5686 1 661 . 1 1 55 55 ALA CB C 13 19.43 0.1 . 1 . . . . . . . . 5686 1 662 . 1 1 55 55 ALA N N 15 120.1 0.2 . 1 . . . . . . . . 5686 1 663 . 1 1 56 56 LEU H H 1 8.665 0.02 . 1 . . . . . . . . 5686 1 664 . 1 1 56 56 LEU HA H 1 3.939 0.02 . 1 . . . . . . . . 5686 1 665 . 1 1 56 56 LEU HB2 H 1 1.872 0.02 . 2 . . . . . . . . 5686 1 666 . 1 1 56 56 LEU HB3 H 1 1.426 0.02 . 2 . . . . . . . . 5686 1 667 . 1 1 56 56 LEU HG H 1 1.831 0.02 . 1 . . . . . . . . 5686 1 668 . 1 1 56 56 LEU HD11 H 1 0.8956 0.02 . 2 . . . . . . . . 5686 1 669 . 1 1 56 56 LEU HD12 H 1 0.8956 0.02 . 2 . . . . . . . . 5686 1 670 . 1 1 56 56 LEU HD13 H 1 0.8956 0.02 . 2 . . . . . . . . 5686 1 671 . 1 1 56 56 LEU HD21 H 1 0.8178 0.02 . 2 . . . . . . . . 5686 1 672 . 1 1 56 56 LEU HD22 H 1 0.8178 0.02 . 2 . . . . . . . . 5686 1 673 . 1 1 56 56 LEU HD23 H 1 0.8178 0.02 . 2 . . . . . . . . 5686 1 674 . 1 1 56 56 LEU C C 13 177.1 0.2 . 1 . . . . . . . . 5686 1 675 . 1 1 56 56 LEU CA C 13 57.9 0.1 . 1 . . . . . . . . 5686 1 676 . 1 1 56 56 LEU CB C 13 38.68 0.1 . 1 . . . . . . . . 5686 1 677 . 1 1 56 56 LEU CG C 13 27.09 0.1 . 1 . . . . . . . . 5686 1 678 . 1 1 56 56 LEU CD1 C 13 24.38 0.1 . 2 . . . . . . . . 5686 1 679 . 1 1 56 56 LEU CD2 C 13 22.27 0.1 . 2 . . . . . . . . 5686 1 680 . 1 1 56 56 LEU N N 15 115.7 0.2 . 1 . . . . . . . . 5686 1 681 . 1 1 57 57 SER H H 1 7.902 0.02 . 1 . . . . . . . . 5686 1 682 . 1 1 57 57 SER HA H 1 4.26 0.02 . 1 . . . . . . . . 5686 1 683 . 1 1 57 57 SER HB2 H 1 3.901 0.02 . 1 . . . . . . . . 5686 1 684 . 1 1 57 57 SER HB3 H 1 3.901 0.02 . 1 . . . . . . . . 5686 1 685 . 1 1 57 57 SER C C 13 175.6 0.2 . 1 . . . . . . . . 5686 1 686 . 1 1 57 57 SER CA C 13 59.77 0.1 . 1 . . . . . . . . 5686 1 687 . 1 1 57 57 SER CB C 13 61.63 0.1 . 1 . . . . . . . . 5686 1 688 . 1 1 57 57 SER N N 15 114.5 0.2 . 1 . . . . . . . . 5686 1 689 . 1 1 58 58 PHE H H 1 7.408 0.02 . 1 . . . . . . . . 5686 1 690 . 1 1 58 58 PHE HA H 1 4.28 0.02 . 1 . . . . . . . . 5686 1 691 . 1 1 58 58 PHE HB2 H 1 3.297 0.02 . 2 . . . . . . . . 5686 1 692 . 1 1 58 58 PHE HB3 H 1 3.083 0.02 . 2 . . . . . . . . 5686 1 693 . 1 1 58 58 PHE HD1 H 1 6.979 0.02 . 1 . . . . . . . . 5686 1 694 . 1 1 58 58 PHE HD2 H 1 6.979 0.02 . 1 . . . . . . . . 5686 1 695 . 1 1 58 58 PHE HE1 H 1 7.089 0.02 . 1 . . . . . . . . 5686 1 696 . 1 1 58 58 PHE HE2 H 1 7.089 0.02 . 1 . . . . . . . . 5686 1 697 . 1 1 58 58 PHE C C 13 175.5 0.2 . 1 . . . . . . . . 5686 1 698 . 1 1 58 58 PHE CA C 13 59.33 0.1 . 1 . . . . . . . . 5686 1 699 . 1 1 58 58 PHE CB C 13 38.89 0.1 . 1 . . . . . . . . 5686 1 700 . 1 1 58 58 PHE N N 15 122.9 0.2 . 1 . . . . . . . . 5686 1 701 . 1 1 59 59 VAL H H 1 8.239 0.02 . 1 . . . . . . . . 5686 1 702 . 1 1 59 59 VAL HA H 1 3.143 0.02 . 1 . . . . . . . . 5686 1 703 . 1 1 59 59 VAL HB H 1 2.174 0.02 . 1 . . . . . . . . 5686 1 704 . 1 1 59 59 VAL HG11 H 1 0.9925 0.02 . 2 . . . . . . . . 5686 1 705 . 1 1 59 59 VAL HG12 H 1 0.9925 0.02 . 2 . . . . . . . . 5686 1 706 . 1 1 59 59 VAL HG13 H 1 0.9925 0.02 . 2 . . . . . . . . 5686 1 707 . 1 1 59 59 VAL HG21 H 1 0.6975 0.02 . 2 . . . . . . . . 5686 1 708 . 1 1 59 59 VAL HG22 H 1 0.6975 0.02 . 2 . . . . . . . . 5686 1 709 . 1 1 59 59 VAL HG23 H 1 0.6975 0.02 . 2 . . . . . . . . 5686 1 710 . 1 1 59 59 VAL C C 13 176.1 0.2 . 1 . . . . . . . . 5686 1 711 . 1 1 59 59 VAL CA C 13 66.38 0.1 . 1 . . . . . . . . 5686 1 712 . 1 1 59 59 VAL CB C 13 30.67 0.1 . 1 . . . . . . . . 5686 1 713 . 1 1 59 59 VAL CG1 C 13 22.32 0.1 . 2 . . . . . . . . 5686 1 714 . 1 1 59 59 VAL CG2 C 13 20.34 0.1 . 2 . . . . . . . . 5686 1 715 . 1 1 59 59 VAL N N 15 118.5 0.2 . 1 . . . . . . . . 5686 1 716 . 1 1 60 60 SER H H 1 7.577 0.02 . 1 . . . . . . . . 5686 1 717 . 1 1 60 60 SER HA H 1 4.114 0.02 . 1 . . . . . . . . 5686 1 718 . 1 1 60 60 SER HB2 H 1 3.937 0.02 . 1 . . . . . . . . 5686 1 719 . 1 1 60 60 SER HB3 H 1 3.937 0.02 . 1 . . . . . . . . 5686 1 720 . 1 1 60 60 SER C C 13 176.5 0.2 . 1 . . . . . . . . 5686 1 721 . 1 1 60 60 SER CA C 13 60.53 0.1 . 1 . . . . . . . . 5686 1 722 . 1 1 60 60 SER CB C 13 61.78 0.1 . 1 . . . . . . . . 5686 1 723 . 1 1 60 60 SER N N 15 111.1 0.2 . 1 . . . . . . . . 5686 1 724 . 1 1 61 61 ARG H H 1 7.403 0.02 . 1 . . . . . . . . 5686 1 725 . 1 1 61 61 ARG HA H 1 4.088 0.02 . 1 . . . . . . . . 5686 1 726 . 1 1 61 61 ARG HB2 H 1 1.849 0.02 . 2 . . . . . . . . 5686 1 727 . 1 1 61 61 ARG HB3 H 1 1.714 0.02 . 2 . . . . . . . . 5686 1 728 . 1 1 61 61 ARG HG2 H 1 1.697 0.02 . 2 . . . . . . . . 5686 1 729 . 1 1 61 61 ARG HG3 H 1 1.443 0.02 . 2 . . . . . . . . 5686 1 730 . 1 1 61 61 ARG HD2 H 1 3.168 0.02 . 1 . . . . . . . . 5686 1 731 . 1 1 61 61 ARG HD3 H 1 3.168 0.02 . 1 . . . . . . . . 5686 1 732 . 1 1 61 61 ARG C C 13 178.8 0.2 . 1 . . . . . . . . 5686 1 733 . 1 1 61 61 ARG CA C 13 58.13 0.1 . 1 . . . . . . . . 5686 1 734 . 1 1 61 61 ARG CB C 13 29.56 0.1 . 1 . . . . . . . . 5686 1 735 . 1 1 61 61 ARG CG C 13 26.86 0.1 . 1 . . . . . . . . 5686 1 736 . 1 1 61 61 ARG CD C 13 42.76 0.1 . 1 . . . . . . . . 5686 1 737 . 1 1 61 61 ARG N N 15 120.4 0.2 . 1 . . . . . . . . 5686 1 738 . 1 1 62 62 ILE H H 1 8.234 0.02 . 1 . . . . . . . . 5686 1 739 . 1 1 62 62 ILE HA H 1 3.79 0.02 . 1 . . . . . . . . 5686 1 740 . 1 1 62 62 ILE HB H 1 1.49 0.02 . 1 . . . . . . . . 5686 1 741 . 1 1 62 62 ILE HG12 H 1 0.8983 0.02 . 2 . . . . . . . . 5686 1 742 . 1 1 62 62 ILE HG13 H 1 0.7586 0.02 . 2 . . . . . . . . 5686 1 743 . 1 1 62 62 ILE HG21 H 1 0.5711 0.02 . 1 . . . . . . . . 5686 1 744 . 1 1 62 62 ILE HG22 H 1 0.5711 0.02 . 1 . . . . . . . . 5686 1 745 . 1 1 62 62 ILE HG23 H 1 0.5711 0.02 . 1 . . . . . . . . 5686 1 746 . 1 1 62 62 ILE HD11 H 1 0.496 0.02 . 1 . . . . . . . . 5686 1 747 . 1 1 62 62 ILE HD12 H 1 0.496 0.02 . 1 . . . . . . . . 5686 1 748 . 1 1 62 62 ILE HD13 H 1 0.496 0.02 . 1 . . . . . . . . 5686 1 749 . 1 1 62 62 ILE C C 13 177.5 0.2 . 1 . . . . . . . . 5686 1 750 . 1 1 62 62 ILE CA C 13 62.4 0.1 . 1 . . . . . . . . 5686 1 751 . 1 1 62 62 ILE CB C 13 36.15 0.1 . 1 . . . . . . . . 5686 1 752 . 1 1 62 62 ILE CG1 C 13 26.76 0.1 . 1 . . . . . . . . 5686 1 753 . 1 1 62 62 ILE CG2 C 13 18.22 0.1 . 1 . . . . . . . . 5686 1 754 . 1 1 62 62 ILE CD1 C 13 12.54 0.1 . 1 . . . . . . . . 5686 1 755 . 1 1 62 62 ILE N N 15 118.7 0.2 . 1 . . . . . . . . 5686 1 756 . 1 1 63 63 LYS H H 1 7.921 0.02 . 1 . . . . . . . . 5686 1 757 . 1 1 63 63 LYS HA H 1 4 0.02 . 1 . . . . . . . . 5686 1 758 . 1 1 63 63 LYS HB2 H 1 1.965 0.02 . 2 . . . . . . . . 5686 1 759 . 1 1 63 63 LYS HB3 H 1 1.75 0.02 . 2 . . . . . . . . 5686 1 760 . 1 1 63 63 LYS HG2 H 1 1.541 0.02 . 2 . . . . . . . . 5686 1 761 . 1 1 63 63 LYS HG3 H 1 1.458 0.02 . 2 . . . . . . . . 5686 1 762 . 1 1 63 63 LYS HD2 H 1 1.33 0.02 . 1 . . . . . . . . 5686 1 763 . 1 1 63 63 LYS HD3 H 1 1.33 0.02 . 1 . . . . . . . . 5686 1 764 . 1 1 63 63 LYS HE2 H 1 3.019 0.02 . 1 . . . . . . . . 5686 1 765 . 1 1 63 63 LYS HE3 H 1 3.019 0.02 . 1 . . . . . . . . 5686 1 766 . 1 1 63 63 LYS C C 13 177.7 0.2 . 1 . . . . . . . . 5686 1 767 . 1 1 63 63 LYS CA C 13 56.75 0.1 . 1 . . . . . . . . 5686 1 768 . 1 1 63 63 LYS CB C 13 30.33 0.1 . 1 . . . . . . . . 5686 1 769 . 1 1 63 63 LYS CG C 13 24.45 0.1 . 1 . . . . . . . . 5686 1 770 . 1 1 63 63 LYS N N 15 119.1 0.2 . 1 . . . . . . . . 5686 1 771 . 1 1 64 64 GLU H H 1 7.367 0.02 . 1 . . . . . . . . 5686 1 772 . 1 1 64 64 GLU HA H 1 4.013 0.02 . 1 . . . . . . . . 5686 1 773 . 1 1 64 64 GLU HB2 H 1 2.036 0.02 . 2 . . . . . . . . 5686 1 774 . 1 1 64 64 GLU HB3 H 1 1.987 0.02 . 2 . . . . . . . . 5686 1 775 . 1 1 64 64 GLU HG2 H 1 2.326 0.02 . 2 . . . . . . . . 5686 1 776 . 1 1 64 64 GLU HG3 H 1 2.156 0.02 . 2 . . . . . . . . 5686 1 777 . 1 1 64 64 GLU C C 13 177.2 0.2 . 1 . . . . . . . . 5686 1 778 . 1 1 64 64 GLU CA C 13 57.4 0.1 . 1 . . . . . . . . 5686 1 779 . 1 1 64 64 GLU CB C 13 29.12 0.1 . 1 . . . . . . . . 5686 1 780 . 1 1 64 64 GLU CG C 13 35.36 0.1 . 1 . . . . . . . . 5686 1 781 . 1 1 64 64 GLU N N 15 117.3 0.2 . 1 . . . . . . . . 5686 1 782 . 1 1 65 65 LYS H H 1 7.16 0.02 . 1 . . . . . . . . 5686 1 783 . 1 1 65 65 LYS HA H 1 4.047 0.02 . 1 . . . . . . . . 5686 1 784 . 1 1 65 65 LYS HB2 H 1 1.551 0.02 . 2 . . . . . . . . 5686 1 785 . 1 1 65 65 LYS HB3 H 1 1.359 0.02 . 2 . . . . . . . . 5686 1 786 . 1 1 65 65 LYS HG2 H 1 1.278 0.02 . 2 . . . . . . . . 5686 1 787 . 1 1 65 65 LYS HG3 H 1 0.9962 0.02 . 2 . . . . . . . . 5686 1 788 . 1 1 65 65 LYS HD2 H 1 1.532 0.02 . 1 . . . . . . . . 5686 1 789 . 1 1 65 65 LYS HD3 H 1 1.532 0.02 . 1 . . . . . . . . 5686 1 790 . 1 1 65 65 LYS HE2 H 1 2.841 0.02 . 1 . . . . . . . . 5686 1 791 . 1 1 65 65 LYS HE3 H 1 2.841 0.02 . 1 . . . . . . . . 5686 1 792 . 1 1 65 65 LYS C C 13 175.9 0.2 . 1 . . . . . . . . 5686 1 793 . 1 1 65 65 LYS CA C 13 56.76 0.1 . 1 . . . . . . . . 5686 1 794 . 1 1 65 65 LYS CB C 13 33.59 0.1 . 1 . . . . . . . . 5686 1 795 . 1 1 65 65 LYS CG C 13 24.2 0.1 . 1 . . . . . . . . 5686 1 796 . 1 1 65 65 LYS CD C 13 28.3 0.1 . 1 . . . . . . . . 5686 1 797 . 1 1 65 65 LYS N N 15 116.8 0.2 . 1 . . . . . . . . 5686 1 798 . 1 1 66 66 HIS H H 1 8.288 0.02 . 1 . . . . . . . . 5686 1 799 . 1 1 66 66 HIS HA H 1 4.873 0.02 . 1 . . . . . . . . 5686 1 800 . 1 1 66 66 HIS HB2 H 1 3.004 0.02 . 1 . . . . . . . . 5686 1 801 . 1 1 66 66 HIS HB3 H 1 3.004 0.02 . 1 . . . . . . . . 5686 1 802 . 1 1 66 66 HIS HD2 H 1 6.903 0.02 . 1 . . . . . . . . 5686 1 803 . 1 1 66 66 HIS C C 13 174.6 0.2 . 1 . . . . . . . . 5686 1 804 . 1 1 66 66 HIS CA C 13 53.2 0.1 . 1 . . . . . . . . 5686 1 805 . 1 1 66 66 HIS CB C 13 29.21 0.1 . 1 . . . . . . . . 5686 1 806 . 1 1 66 66 HIS N N 15 119.2 0.2 . 1 . . . . . . . . 5686 1 807 . 1 1 67 67 SER H H 1 8.274 0.02 . 1 . . . . . . . . 5686 1 808 . 1 1 67 67 SER HA H 1 4.326 0.02 . 1 . . . . . . . . 5686 1 809 . 1 1 67 67 SER HB2 H 1 3.932 0.02 . 1 . . . . . . . . 5686 1 810 . 1 1 67 67 SER HB3 H 1 3.932 0.02 . 1 . . . . . . . . 5686 1 811 . 1 1 67 67 SER C C 13 175.2 0.2 . 1 . . . . . . . . 5686 1 812 . 1 1 67 67 SER CA C 13 60.08 0.1 . 1 . . . . . . . . 5686 1 813 . 1 1 67 67 SER CB C 13 63.13 0.1 . 1 . . . . . . . . 5686 1 814 . 1 1 67 67 SER N N 15 116 0.2 . 1 . . . . . . . . 5686 1 815 . 1 1 68 68 SER H H 1 8.363 0.02 . 1 . . . . . . . . 5686 1 816 . 1 1 68 68 SER HA H 1 4.496 0.02 . 1 . . . . . . . . 5686 1 817 . 1 1 68 68 SER HB2 H 1 3.986 0.02 . 2 . . . . . . . . 5686 1 818 . 1 1 68 68 SER HB3 H 1 3.865 0.02 . 2 . . . . . . . . 5686 1 819 . 1 1 68 68 SER C C 13 173.8 0.2 . 1 . . . . . . . . 5686 1 820 . 1 1 68 68 SER CA C 13 57.43 0.1 . 1 . . . . . . . . 5686 1 821 . 1 1 68 68 SER CB C 13 62.7 0.1 . 1 . . . . . . . . 5686 1 822 . 1 1 68 68 SER N N 15 114.8 0.2 . 1 . . . . . . . . 5686 1 823 . 1 1 69 69 ILE H H 1 7.471 0.02 . 1 . . . . . . . . 5686 1 824 . 1 1 69 69 ILE HA H 1 3.979 0.02 . 1 . . . . . . . . 5686 1 825 . 1 1 69 69 ILE HB H 1 1.654 0.02 . 1 . . . . . . . . 5686 1 826 . 1 1 69 69 ILE HG12 H 1 1.387 0.02 . 2 . . . . . . . . 5686 1 827 . 1 1 69 69 ILE HG13 H 1 1.105 0.02 . 2 . . . . . . . . 5686 1 828 . 1 1 69 69 ILE HG21 H 1 0.7174 0.02 . 1 . . . . . . . . 5686 1 829 . 1 1 69 69 ILE HG22 H 1 0.7174 0.02 . 1 . . . . . . . . 5686 1 830 . 1 1 69 69 ILE HG23 H 1 0.7174 0.02 . 1 . . . . . . . . 5686 1 831 . 1 1 69 69 ILE HD11 H 1 0.6289 0.02 . 1 . . . . . . . . 5686 1 832 . 1 1 69 69 ILE HD12 H 1 0.6289 0.02 . 1 . . . . . . . . 5686 1 833 . 1 1 69 69 ILE HD13 H 1 0.6289 0.02 . 1 . . . . . . . . 5686 1 834 . 1 1 69 69 ILE C C 13 173.6 0.2 . 1 . . . . . . . . 5686 1 835 . 1 1 69 69 ILE CA C 13 61 0.1 . 1 . . . . . . . . 5686 1 836 . 1 1 69 69 ILE CB C 13 38.51 0.1 . 1 . . . . . . . . 5686 1 837 . 1 1 69 69 ILE CG1 C 13 28.27 0.1 . 1 . . . . . . . . 5686 1 838 . 1 1 69 69 ILE CG2 C 13 16.3 0.1 . 1 . . . . . . . . 5686 1 839 . 1 1 69 69 ILE CD1 C 13 14.23 0.1 . 1 . . . . . . . . 5686 1 840 . 1 1 69 69 ILE N N 15 123.5 0.2 . 1 . . . . . . . . 5686 1 841 . 1 1 70 70 VAL H H 1 7.357 0.02 . 1 . . . . . . . . 5686 1 842 . 1 1 70 70 VAL HA H 1 4.212 0.02 . 1 . . . . . . . . 5686 1 843 . 1 1 70 70 VAL HB H 1 1.836 0.02 . 1 . . . . . . . . 5686 1 844 . 1 1 70 70 VAL HG11 H 1 0.8662 0.02 . 2 . . . . . . . . 5686 1 845 . 1 1 70 70 VAL HG12 H 1 0.8662 0.02 . 2 . . . . . . . . 5686 1 846 . 1 1 70 70 VAL HG13 H 1 0.8662 0.02 . 2 . . . . . . . . 5686 1 847 . 1 1 70 70 VAL HG21 H 1 1.037 0.02 . 2 . . . . . . . . 5686 1 848 . 1 1 70 70 VAL HG22 H 1 1.037 0.02 . 2 . . . . . . . . 5686 1 849 . 1 1 70 70 VAL HG23 H 1 1.037 0.02 . 2 . . . . . . . . 5686 1 850 . 1 1 70 70 VAL C C 13 175.1 0.2 . 1 . . . . . . . . 5686 1 851 . 1 1 70 70 VAL CA C 13 61.21 0.1 . 1 . . . . . . . . 5686 1 852 . 1 1 70 70 VAL CB C 13 31.69 0.1 . 1 . . . . . . . . 5686 1 853 . 1 1 70 70 VAL CG1 C 13 21.56 0.1 . 2 . . . . . . . . 5686 1 854 . 1 1 70 70 VAL CG2 C 13 20.95 0.1 . 2 . . . . . . . . 5686 1 855 . 1 1 70 70 VAL N N 15 128.1 0.2 . 1 . . . . . . . . 5686 1 856 . 1 1 71 71 VAL H H 1 9.722 0.02 . 1 . . . . . . . . 5686 1 857 . 1 1 71 71 VAL HA H 1 5.017 0.02 . 1 . . . . . . . . 5686 1 858 . 1 1 71 71 VAL HB H 1 1.898 0.02 . 1 . . . . . . . . 5686 1 859 . 1 1 71 71 VAL HG11 H 1 0.864 0.02 . 2 . . . . . . . . 5686 1 860 . 1 1 71 71 VAL HG12 H 1 0.864 0.02 . 2 . . . . . . . . 5686 1 861 . 1 1 71 71 VAL HG13 H 1 0.864 0.02 . 2 . . . . . . . . 5686 1 862 . 1 1 71 71 VAL HG21 H 1 0.822 0.02 . 2 . . . . . . . . 5686 1 863 . 1 1 71 71 VAL HG22 H 1 0.822 0.02 . 2 . . . . . . . . 5686 1 864 . 1 1 71 71 VAL HG23 H 1 0.822 0.02 . 2 . . . . . . . . 5686 1 865 . 1 1 71 71 VAL C C 13 174 0.2 . 1 . . . . . . . . 5686 1 866 . 1 1 71 71 VAL CA C 13 59.81 0.1 . 1 . . . . . . . . 5686 1 867 . 1 1 71 71 VAL CB C 13 33.54 0.1 . 1 . . . . . . . . 5686 1 868 . 1 1 71 71 VAL CG2 C 13 21.34 0.1 . 2 . . . . . . . . 5686 1 869 . 1 1 71 71 VAL N N 15 126.9 0.2 . 1 . . . . . . . . 5686 1 870 . 1 1 72 72 LEU H H 1 9.403 0.02 . 1 . . . . . . . . 5686 1 871 . 1 1 72 72 LEU HA H 1 4.699 0.02 . 1 . . . . . . . . 5686 1 872 . 1 1 72 72 LEU HB2 H 1 1.594 0.02 . 2 . . . . . . . . 5686 1 873 . 1 1 72 72 LEU HB3 H 1 1.236 0.02 . 2 . . . . . . . . 5686 1 874 . 1 1 72 72 LEU HD11 H 1 0.6981 0.02 . 2 . . . . . . . . 5686 1 875 . 1 1 72 72 LEU HD12 H 1 0.6981 0.02 . 2 . . . . . . . . 5686 1 876 . 1 1 72 72 LEU HD13 H 1 0.6981 0.02 . 2 . . . . . . . . 5686 1 877 . 1 1 72 72 LEU HD21 H 1 0.6614 0.02 . 2 . . . . . . . . 5686 1 878 . 1 1 72 72 LEU HD22 H 1 0.6614 0.02 . 2 . . . . . . . . 5686 1 879 . 1 1 72 72 LEU HD23 H 1 0.6614 0.02 . 2 . . . . . . . . 5686 1 880 . 1 1 72 72 LEU C C 13 174.3 0.2 . 1 . . . . . . . . 5686 1 881 . 1 1 72 72 LEU CA C 13 52.21 0.1 . 1 . . . . . . . . 5686 1 882 . 1 1 72 72 LEU CB C 13 42.37 0.1 . 1 . . . . . . . . 5686 1 883 . 1 1 72 72 LEU CD1 C 13 25 0.1 . 2 . . . . . . . . 5686 1 884 . 1 1 72 72 LEU CD2 C 13 24.45 0.1 . 2 . . . . . . . . 5686 1 885 . 1 1 72 72 LEU N N 15 128.2 0.2 . 1 . . . . . . . . 5686 1 886 . 1 1 73 73 VAL H H 1 7.845 0.02 . 1 . . . . . . . . 5686 1 887 . 1 1 73 73 VAL HA H 1 4.597 0.02 . 1 . . . . . . . . 5686 1 888 . 1 1 73 73 VAL HB H 1 1.949 0.02 . 1 . . . . . . . . 5686 1 889 . 1 1 73 73 VAL HG11 H 1 0.8014 0.02 . 2 . . . . . . . . 5686 1 890 . 1 1 73 73 VAL HG12 H 1 0.8014 0.02 . 2 . . . . . . . . 5686 1 891 . 1 1 73 73 VAL HG13 H 1 0.8014 0.02 . 2 . . . . . . . . 5686 1 892 . 1 1 73 73 VAL HG21 H 1 0.805 0.02 . 2 . . . . . . . . 5686 1 893 . 1 1 73 73 VAL HG22 H 1 0.805 0.02 . 2 . . . . . . . . 5686 1 894 . 1 1 73 73 VAL HG23 H 1 0.805 0.02 . 2 . . . . . . . . 5686 1 895 . 1 1 73 73 VAL C C 13 173.5 0.2 . 1 . . . . . . . . 5686 1 896 . 1 1 73 73 VAL CA C 13 60.3 0.1 . 1 . . . . . . . . 5686 1 897 . 1 1 73 73 VAL CB C 13 33.38 0.1 . 1 . . . . . . . . 5686 1 898 . 1 1 73 73 VAL CG1 C 13 21.81 0.1 . 2 . . . . . . . . 5686 1 899 . 1 1 73 73 VAL CG2 C 13 20.38 0.1 . 2 . . . . . . . . 5686 1 900 . 1 1 73 73 VAL N N 15 123.7 0.2 . 1 . . . . . . . . 5686 1 901 . 1 1 74 74 SER H H 1 8.409 0.02 . 1 . . . . . . . . 5686 1 902 . 1 1 74 74 SER HA H 1 5.548 0.02 . 1 . . . . . . . . 5686 1 903 . 1 1 74 74 SER HB2 H 1 3.498 0.02 . 2 . . . . . . . . 5686 1 904 . 1 1 74 74 SER HB3 H 1 3.452 0.02 . 2 . . . . . . . . 5686 1 905 . 1 1 74 74 SER C C 13 173.8 0.2 . 1 . . . . . . . . 5686 1 906 . 1 1 74 74 SER CA C 13 53.85 0.1 . 1 . . . . . . . . 5686 1 907 . 1 1 74 74 SER CB C 13 64.69 0.1 . 1 . . . . . . . . 5686 1 908 . 1 1 74 74 SER N N 15 121.6 0.2 . 1 . . . . . . . . 5686 1 909 . 1 1 75 75 SER H H 1 7.986 0.02 . 1 . . . . . . . . 5686 1 910 . 1 1 75 75 SER HA H 1 4.745 0.02 . 1 . . . . . . . . 5686 1 911 . 1 1 75 75 SER HB2 H 1 3.351 0.02 . 2 . . . . . . . . 5686 1 912 . 1 1 75 75 SER HB3 H 1 3.056 0.02 . 2 . . . . . . . . 5686 1 913 . 1 1 75 75 SER C C 13 173.7 0.2 . 1 . . . . . . . . 5686 1 914 . 1 1 75 75 SER CA C 13 54.69 0.1 . 1 . . . . . . . . 5686 1 915 . 1 1 75 75 SER CB C 13 64.86 0.1 . 1 . . . . . . . . 5686 1 916 . 1 1 75 75 SER N N 15 116.1 0.2 . 1 . . . . . . . . 5686 1 917 . 1 1 76 76 ASP H H 1 8.649 0.02 . 1 . . . . . . . . 5686 1 918 . 1 1 76 76 ASP HA H 1 4.571 0.02 . 1 . . . . . . . . 5686 1 919 . 1 1 76 76 ASP HB2 H 1 2.571 0.02 . 2 . . . . . . . . 5686 1 920 . 1 1 76 76 ASP HB3 H 1 2.426 0.02 . 2 . . . . . . . . 5686 1 921 . 1 1 76 76 ASP C C 13 175 0.2 . 1 . . . . . . . . 5686 1 922 . 1 1 76 76 ASP CA C 13 53.52 0.1 . 1 . . . . . . . . 5686 1 923 . 1 1 76 76 ASP CB C 13 40.47 0.1 . 1 . . . . . . . . 5686 1 924 . 1 1 76 76 ASP N N 15 125.5 0.2 . 1 . . . . . . . . 5686 1 925 . 1 1 77 77 ASN H H 1 8.17 0.02 . 1 . . . . . . . . 5686 1 926 . 1 1 77 77 ASN HA H 1 5.015 0.02 . 1 . . . . . . . . 5686 1 927 . 1 1 77 77 ASN HB2 H 1 2.665 0.02 . 2 . . . . . . . . 5686 1 928 . 1 1 77 77 ASN HB3 H 1 2.449 0.02 . 2 . . . . . . . . 5686 1 929 . 1 1 77 77 ASN CA C 13 50.13 0.1 . 1 . . . . . . . . 5686 1 930 . 1 1 77 77 ASN CB C 13 38.21 0.1 . 1 . . . . . . . . 5686 1 931 . 1 1 77 77 ASN N N 15 117.5 0.2 . 1 . . . . . . . . 5686 1 932 . 1 1 78 78 PRO HA H 1 4.92 0.02 . 1 . . . . . . . . 5686 1 933 . 1 1 78 78 PRO HB2 H 1 1.949 0.02 . 2 . . . . . . . . 5686 1 934 . 1 1 78 78 PRO HB3 H 1 1.9 0.02 . 2 . . . . . . . . 5686 1 935 . 1 1 78 78 PRO HG2 H 1 2.149 0.02 . 2 . . . . . . . . 5686 1 936 . 1 1 78 78 PRO HG3 H 1 1.937 0.02 . 2 . . . . . . . . 5686 1 937 . 1 1 78 78 PRO HD2 H 1 3.578 0.02 . 2 . . . . . . . . 5686 1 938 . 1 1 78 78 PRO HD3 H 1 3.361 0.02 . 2 . . . . . . . . 5686 1 939 . 1 1 78 78 PRO C C 13 177.6 0.2 . 1 . . . . . . . . 5686 1 940 . 1 1 78 78 PRO CA C 13 62.05 0.1 . 1 . . . . . . . . 5686 1 941 . 1 1 78 78 PRO CB C 13 31.79 0.1 . 1 . . . . . . . . 5686 1 942 . 1 1 78 78 PRO CG C 13 26.79 0.1 . 1 . . . . . . . . 5686 1 943 . 1 1 78 78 PRO CD C 13 48.94 0.1 . 1 . . . . . . . . 5686 1 944 . 1 1 79 79 THR H H 1 7.619 0.02 . 1 . . . . . . . . 5686 1 945 . 1 1 79 79 THR HA H 1 4.693 0.02 . 1 . . . . . . . . 5686 1 946 . 1 1 79 79 THR HB H 1 4.533 0.02 . 1 . . . . . . . . 5686 1 947 . 1 1 79 79 THR HG21 H 1 1.192 0.02 . 1 . . . . . . . . 5686 1 948 . 1 1 79 79 THR HG22 H 1 1.192 0.02 . 1 . . . . . . . . 5686 1 949 . 1 1 79 79 THR HG23 H 1 1.192 0.02 . 1 . . . . . . . . 5686 1 950 . 1 1 79 79 THR CA C 13 58.34 0.1 . 1 . . . . . . . . 5686 1 951 . 1 1 79 79 THR CB C 13 72.96 0.1 . 1 . . . . . . . . 5686 1 952 . 1 1 79 79 THR CG2 C 13 20.93 0.1 . 2 . . . . . . . . 5686 1 953 . 1 1 79 79 THR N N 15 111.1 0.2 . 1 . . . . . . . . 5686 1 954 . 1 1 80 80 SER HA H 1 3.951 0.02 . 1 . . . . . . . . 5686 1 955 . 1 1 80 80 SER HB2 H 1 3.84 0.02 . 2 . . . . . . . . 5686 1 956 . 1 1 80 80 SER HB3 H 1 3.779 0.02 . 2 . . . . . . . . 5686 1 957 . 1 1 80 80 SER C C 13 174.8 0.2 . 1 . . . . . . . . 5686 1 958 . 1 1 80 80 SER CA C 13 60.94 0.1 . 1 . . . . . . . . 5686 1 959 . 1 1 80 80 SER CB C 13 61.4 0.1 . 1 . . . . . . . . 5686 1 960 . 1 1 81 81 GLU H H 1 8.492 0.02 . 1 . . . . . . . . 5686 1 961 . 1 1 81 81 GLU HA H 1 3.718 0.02 . 1 . . . . . . . . 5686 1 962 . 1 1 81 81 GLU HB2 H 1 1.932 0.02 . 2 . . . . . . . . 5686 1 963 . 1 1 81 81 GLU HB3 H 1 1.773 0.02 . 2 . . . . . . . . 5686 1 964 . 1 1 81 81 GLU HG2 H 1 2.266 0.02 . 2 . . . . . . . . 5686 1 965 . 1 1 81 81 GLU HG3 H 1 2.134 0.02 . 2 . . . . . . . . 5686 1 966 . 1 1 81 81 GLU C C 13 177.9 0.2 . 1 . . . . . . . . 5686 1 967 . 1 1 81 81 GLU CA C 13 59 0.1 . 1 . . . . . . . . 5686 1 968 . 1 1 81 81 GLU CB C 13 28.07 0.1 . 1 . . . . . . . . 5686 1 969 . 1 1 81 81 GLU CG C 13 36.12 0.1 . 1 . . . . . . . . 5686 1 970 . 1 1 81 81 GLU N N 15 118.6 0.2 . 1 . . . . . . . . 5686 1 971 . 1 1 82 82 GLU H H 1 7.823 0.02 . 1 . . . . . . . . 5686 1 972 . 1 1 82 82 GLU HA H 1 3.882 0.02 . 1 . . . . . . . . 5686 1 973 . 1 1 82 82 GLU HB2 H 1 2.157 0.02 . 2 . . . . . . . . 5686 1 974 . 1 1 82 82 GLU HB3 H 1 2.009 0.02 . 2 . . . . . . . . 5686 1 975 . 1 1 82 82 GLU HG2 H 1 2.328 0.02 . 1 . . . . . . . . 5686 1 976 . 1 1 82 82 GLU HG3 H 1 2.328 0.02 . 1 . . . . . . . . 5686 1 977 . 1 1 82 82 GLU C C 13 176.2 0.2 . 1 . . . . . . . . 5686 1 978 . 1 1 82 82 GLU CA C 13 58.53 0.1 . 1 . . . . . . . . 5686 1 979 . 1 1 82 82 GLU CB C 13 29.72 0.1 . 1 . . . . . . . . 5686 1 980 . 1 1 82 82 GLU CG C 13 37.6 0.1 . 1 . . . . . . . . 5686 1 981 . 1 1 82 82 GLU N N 15 120.2 0.2 . 1 . . . . . . . . 5686 1 982 . 1 1 83 83 GLU H H 1 7.633 0.02 . 1 . . . . . . . . 5686 1 983 . 1 1 83 83 GLU HA H 1 3.719 0.02 . 1 . . . . . . . . 5686 1 984 . 1 1 83 83 GLU HB2 H 1 2.197 0.02 . 2 . . . . . . . . 5686 1 985 . 1 1 83 83 GLU HB3 H 1 1.895 0.02 . 2 . . . . . . . . 5686 1 986 . 1 1 83 83 GLU HG2 H 1 2.184 0.02 . 2 . . . . . . . . 5686 1 987 . 1 1 83 83 GLU HG3 H 1 2.141 0.02 . 2 . . . . . . . . 5686 1 988 . 1 1 83 83 GLU C C 13 177.1 0.2 . 1 . . . . . . . . 5686 1 989 . 1 1 83 83 GLU CA C 13 59.08 0.1 . 1 . . . . . . . . 5686 1 990 . 1 1 83 83 GLU CB C 13 29.1 0.1 . 1 . . . . . . . . 5686 1 991 . 1 1 83 83 GLU CG C 13 35.85 0.1 . 1 . . . . . . . . 5686 1 992 . 1 1 83 83 GLU N N 15 121.6 0.2 . 1 . . . . . . . . 5686 1 993 . 1 1 84 84 VAL H H 1 7.939 0.02 . 1 . . . . . . . . 5686 1 994 . 1 1 84 84 VAL HA H 1 3.287 0.02 . 1 . . . . . . . . 5686 1 995 . 1 1 84 84 VAL HB H 1 1.87 0.02 . 1 . . . . . . . . 5686 1 996 . 1 1 84 84 VAL HG11 H 1 0.7859 0.02 . 2 . . . . . . . . 5686 1 997 . 1 1 84 84 VAL HG12 H 1 0.7859 0.02 . 2 . . . . . . . . 5686 1 998 . 1 1 84 84 VAL HG13 H 1 0.7859 0.02 . 2 . . . . . . . . 5686 1 999 . 1 1 84 84 VAL HG21 H 1 0.721 0.02 . 2 . . . . . . . . 5686 1 1000 . 1 1 84 84 VAL HG22 H 1 0.721 0.02 . 2 . . . . . . . . 5686 1 1001 . 1 1 84 84 VAL HG23 H 1 0.721 0.02 . 2 . . . . . . . . 5686 1 1002 . 1 1 84 84 VAL C C 13 177.6 0.2 . 1 . . . . . . . . 5686 1 1003 . 1 1 84 84 VAL CA C 13 66.23 0.1 . 1 . . . . . . . . 5686 1 1004 . 1 1 84 84 VAL CB C 13 30.67 0.1 . 1 . . . . . . . . 5686 1 1005 . 1 1 84 84 VAL CG1 C 13 21.9 0.1 . 2 . . . . . . . . 5686 1 1006 . 1 1 84 84 VAL CG2 C 13 20.45 0.1 . 2 . . . . . . . . 5686 1 1007 . 1 1 84 84 VAL N N 15 115.6 0.2 . 1 . . . . . . . . 5686 1 1008 . 1 1 85 85 HIS H H 1 7.851 0.02 . 1 . . . . . . . . 5686 1 1009 . 1 1 85 85 HIS HA H 1 4.385 0.02 . 1 . . . . . . . . 5686 1 1010 . 1 1 85 85 HIS HB2 H 1 3.086 0.02 . 1 . . . . . . . . 5686 1 1011 . 1 1 85 85 HIS HB3 H 1 3.086 0.02 . 1 . . . . . . . . 5686 1 1012 . 1 1 85 85 HIS HD1 H 1 8.925 0.02 . 1 . . . . . . . . 5686 1 1013 . 1 1 85 85 HIS HD2 H 1 6.943 0.02 . 1 . . . . . . . . 5686 1 1014 . 1 1 85 85 HIS C C 13 176.7 0.2 . 1 . . . . . . . . 5686 1 1015 . 1 1 85 85 HIS CA C 13 57.47 0.1 . 1 . . . . . . . . 5686 1 1016 . 1 1 85 85 HIS CB C 13 29.27 0.1 . 1 . . . . . . . . 5686 1 1017 . 1 1 85 85 HIS N N 15 116.7 0.2 . 1 . . . . . . . . 5686 1 1018 . 1 1 86 86 ALA H H 1 8.934 0.02 . 1 . . . . . . . . 5686 1 1019 . 1 1 86 86 ALA HA H 1 3.711 0.02 . 1 . . . . . . . . 5686 1 1020 . 1 1 86 86 ALA HB1 H 1 1.126 0.02 . 1 . . . . . . . . 5686 1 1021 . 1 1 86 86 ALA HB2 H 1 1.126 0.02 . 1 . . . . . . . . 5686 1 1022 . 1 1 86 86 ALA HB3 H 1 1.126 0.02 . 1 . . . . . . . . 5686 1 1023 . 1 1 86 86 ALA C C 13 178.9 0.2 . 1 . . . . . . . . 5686 1 1024 . 1 1 86 86 ALA CA C 13 54.94 0.1 . 1 . . . . . . . . 5686 1 1025 . 1 1 86 86 ALA CB C 13 16.2 0.1 . 1 . . . . . . . . 5686 1 1026 . 1 1 86 86 ALA N N 15 121.1 0.2 . 1 . . . . . . . . 5686 1 1027 . 1 1 87 87 PHE H H 1 7.758 0.02 . 1 . . . . . . . . 5686 1 1028 . 1 1 87 87 PHE HA H 1 4.526 0.02 . 1 . . . . . . . . 5686 1 1029 . 1 1 87 87 PHE HB2 H 1 3.277 0.02 . 2 . . . . . . . . 5686 1 1030 . 1 1 87 87 PHE HB3 H 1 2.789 0.02 . 2 . . . . . . . . 5686 1 1031 . 1 1 87 87 PHE HD1 H 1 7.29 0.02 . 1 . . . . . . . . 5686 1 1032 . 1 1 87 87 PHE HD2 H 1 7.29 0.02 . 1 . . . . . . . . 5686 1 1033 . 1 1 87 87 PHE HE1 H 1 7.733 0.02 . 1 . . . . . . . . 5686 1 1034 . 1 1 87 87 PHE HE2 H 1 7.733 0.02 . 1 . . . . . . . . 5686 1 1035 . 1 1 87 87 PHE C C 13 180.1 0.2 . 1 . . . . . . . . 5686 1 1036 . 1 1 87 87 PHE CA C 13 61.5 0.1 . 1 . . . . . . . . 5686 1 1037 . 1 1 87 87 PHE CB C 13 37.85 0.1 . 1 . . . . . . . . 5686 1 1038 . 1 1 87 87 PHE N N 15 116.3 0.2 . 1 . . . . . . . . 5686 1 1039 . 1 1 88 88 GLU H H 1 8.95 0.02 . 1 . . . . . . . . 5686 1 1040 . 1 1 88 88 GLU HA H 1 3.995 0.02 . 1 . . . . . . . . 5686 1 1041 . 1 1 88 88 GLU HB2 H 1 2.254 0.02 . 2 . . . . . . . . 5686 1 1042 . 1 1 88 88 GLU HB3 H 1 1.99 0.02 . 2 . . . . . . . . 5686 1 1043 . 1 1 88 88 GLU HG2 H 1 2.634 0.02 . 2 . . . . . . . . 5686 1 1044 . 1 1 88 88 GLU HG3 H 1 2.191 0.02 . 2 . . . . . . . . 5686 1 1045 . 1 1 88 88 GLU C C 13 178.7 0.2 . 1 . . . . . . . . 5686 1 1046 . 1 1 88 88 GLU CA C 13 58.92 0.1 . 1 . . . . . . . . 5686 1 1047 . 1 1 88 88 GLU CB C 13 28.52 0.1 . 1 . . . . . . . . 5686 1 1048 . 1 1 88 88 GLU CG C 13 36.35 0.1 . 1 . . . . . . . . 5686 1 1049 . 1 1 88 88 GLU N N 15 121.3 0.2 . 1 . . . . . . . . 5686 1 1050 . 1 1 89 89 GLN H H 1 8.094 0.02 . 1 . . . . . . . . 5686 1 1051 . 1 1 89 89 GLN HA H 1 4.162 0.02 . 1 . . . . . . . . 5686 1 1052 . 1 1 89 89 GLN HB2 H 1 2.263 0.02 . 2 . . . . . . . . 5686 1 1053 . 1 1 89 89 GLN HB3 H 1 1.937 0.02 . 2 . . . . . . . . 5686 1 1054 . 1 1 89 89 GLN HG2 H 1 2.357 0.02 . 2 . . . . . . . . 5686 1 1055 . 1 1 89 89 GLN HG3 H 1 2.169 0.02 . 2 . . . . . . . . 5686 1 1056 . 1 1 89 89 GLN C C 13 174.9 0.2 . 1 . . . . . . . . 5686 1 1057 . 1 1 89 89 GLN CA C 13 54.92 0.1 . 1 . . . . . . . . 5686 1 1058 . 1 1 89 89 GLN CB C 13 28.09 0.1 . 1 . . . . . . . . 5686 1 1059 . 1 1 89 89 GLN CG C 13 33.62 0.1 . 1 . . . . . . . . 5686 1 1060 . 1 1 89 89 GLN N N 15 115.8 0.2 . 1 . . . . . . . . 5686 1 1061 . 1 1 90 90 GLY H H 1 7.599 0.02 . 1 . . . . . . . . 5686 1 1062 . 1 1 90 90 GLY HA2 H 1 4.316 0.02 . 2 . . . . . . . . 5686 1 1063 . 1 1 90 90 GLY HA3 H 1 3.591 0.02 . 2 . . . . . . . . 5686 1 1064 . 1 1 90 90 GLY C C 13 173.9 0.2 . 1 . . . . . . . . 5686 1 1065 . 1 1 90 90 GLY CA C 13 43.66 0.1 . 1 . . . . . . . . 5686 1 1066 . 1 1 90 90 GLY N N 15 103.6 0.2 . 1 . . . . . . . . 5686 1 1067 . 1 1 91 91 ALA H H 1 8.451 0.02 . 1 . . . . . . . . 5686 1 1068 . 1 1 91 91 ALA HA H 1 3.992 0.02 . 1 . . . . . . . . 5686 1 1069 . 1 1 91 91 ALA HB1 H 1 1.081 0.02 . 1 . . . . . . . . 5686 1 1070 . 1 1 91 91 ALA HB2 H 1 1.081 0.02 . 1 . . . . . . . . 5686 1 1071 . 1 1 91 91 ALA HB3 H 1 1.081 0.02 . 1 . . . . . . . . 5686 1 1072 . 1 1 91 91 ALA C C 13 175.6 0.2 . 1 . . . . . . . . 5686 1 1073 . 1 1 91 91 ALA CA C 13 52.28 0.1 . 1 . . . . . . . . 5686 1 1074 . 1 1 91 91 ALA CB C 13 17.73 0.1 . 1 . . . . . . . . 5686 1 1075 . 1 1 91 91 ALA N N 15 121.7 0.2 . 1 . . . . . . . . 5686 1 1076 . 1 1 92 92 ASP H H 1 9.147 0.02 . 1 . . . . . . . . 5686 1 1077 . 1 1 92 92 ASP HA H 1 5.08 0.02 . 1 . . . . . . . . 5686 1 1078 . 1 1 92 92 ASP HB2 H 1 2.656 0.02 . 2 . . . . . . . . 5686 1 1079 . 1 1 92 92 ASP HB3 H 1 2.428 0.02 . 2 . . . . . . . . 5686 1 1080 . 1 1 92 92 ASP C C 13 176.6 0.2 . 1 . . . . . . . . 5686 1 1081 . 1 1 92 92 ASP CA C 13 54.42 0.1 . 1 . . . . . . . . 5686 1 1082 . 1 1 92 92 ASP CB C 13 42.63 0.1 . 1 . . . . . . . . 5686 1 1083 . 1 1 92 92 ASP N N 15 116.9 0.2 . 1 . . . . . . . . 5686 1 1084 . 1 1 93 93 ASP H H 1 7.984 0.02 . 1 . . . . . . . . 5686 1 1085 . 1 1 93 93 ASP HA H 1 4.695 0.02 . 1 . . . . . . . . 5686 1 1086 . 1 1 93 93 ASP HB2 H 1 2.449 0.02 . 1 . . . . . . . . 5686 1 1087 . 1 1 93 93 ASP HB3 H 1 2.449 0.02 . 1 . . . . . . . . 5686 1 1088 . 1 1 93 93 ASP C C 13 171.8 0.2 . 1 . . . . . . . . 5686 1 1089 . 1 1 93 93 ASP CA C 13 52.37 0.1 . 1 . . . . . . . . 5686 1 1090 . 1 1 93 93 ASP CB C 13 45.34 0.1 . 1 . . . . . . . . 5686 1 1091 . 1 1 93 93 ASP N N 15 115.9 0.2 . 1 . . . . . . . . 5686 1 1092 . 1 1 94 94 TYR H H 1 9.484 0.02 . 1 . . . . . . . . 5686 1 1093 . 1 1 94 94 TYR HA H 1 5.225 0.02 . 1 . . . . . . . . 5686 1 1094 . 1 1 94 94 TYR HB2 H 1 2.613 0.02 . 2 . . . . . . . . 5686 1 1095 . 1 1 94 94 TYR HB3 H 1 1.914 0.02 . 2 . . . . . . . . 5686 1 1096 . 1 1 94 94 TYR HD1 H 1 6.521 0.02 . 1 . . . . . . . . 5686 1 1097 . 1 1 94 94 TYR HD2 H 1 6.521 0.02 . 1 . . . . . . . . 5686 1 1098 . 1 1 94 94 TYR HE1 H 1 6.434 0.02 . 1 . . . . . . . . 5686 1 1099 . 1 1 94 94 TYR HE2 H 1 6.434 0.02 . 1 . . . . . . . . 5686 1 1100 . 1 1 94 94 TYR C C 13 173.6 0.2 . 1 . . . . . . . . 5686 1 1101 . 1 1 94 94 TYR CA C 13 56.64 0.1 . 1 . . . . . . . . 5686 1 1102 . 1 1 94 94 TYR CB C 13 40.92 0.1 . 1 . . . . . . . . 5686 1 1103 . 1 1 94 94 TYR N N 15 124.4 0.2 . 1 . . . . . . . . 5686 1 1104 . 1 1 95 95 ILE H H 1 8.843 0.02 . 1 . . . . . . . . 5686 1 1105 . 1 1 95 95 ILE HA H 1 4.19 0.02 . 1 . . . . . . . . 5686 1 1106 . 1 1 95 95 ILE HB H 1 1.629 0.02 . 1 . . . . . . . . 5686 1 1107 . 1 1 95 95 ILE HG12 H 1 1.281 0.02 . 2 . . . . . . . . 5686 1 1108 . 1 1 95 95 ILE HG13 H 1 0.7829 0.02 . 2 . . . . . . . . 5686 1 1109 . 1 1 95 95 ILE HG21 H 1 0.9636 0.02 . 1 . . . . . . . . 5686 1 1110 . 1 1 95 95 ILE HG22 H 1 0.9636 0.02 . 1 . . . . . . . . 5686 1 1111 . 1 1 95 95 ILE HG23 H 1 0.9636 0.02 . 1 . . . . . . . . 5686 1 1112 . 1 1 95 95 ILE HD11 H 1 0.6279 0.02 . 1 . . . . . . . . 5686 1 1113 . 1 1 95 95 ILE HD12 H 1 0.6279 0.02 . 1 . . . . . . . . 5686 1 1114 . 1 1 95 95 ILE HD13 H 1 0.6279 0.02 . 1 . . . . . . . . 5686 1 1115 . 1 1 95 95 ILE C C 13 172.6 0.2 . 1 . . . . . . . . 5686 1 1116 . 1 1 95 95 ILE CA C 13 59.14 0.1 . 1 . . . . . . . . 5686 1 1117 . 1 1 95 95 ILE CB C 13 41.08 0.1 . 1 . . . . . . . . 5686 1 1118 . 1 1 95 95 ILE CG1 C 13 26.24 0.1 . 1 . . . . . . . . 5686 1 1119 . 1 1 95 95 ILE CG2 C 13 17.79 0.1 . 1 . . . . . . . . 5686 1 1120 . 1 1 95 95 ILE CD1 C 13 14.87 0.1 . 1 . . . . . . . . 5686 1 1121 . 1 1 95 95 ILE N N 15 129.1 0.2 . 1 . . . . . . . . 5686 1 1122 . 1 1 96 96 ALA H H 1 8.445 0.02 . 1 . . . . . . . . 5686 1 1123 . 1 1 96 96 ALA HA H 1 4.261 0.02 . 1 . . . . . . . . 5686 1 1124 . 1 1 96 96 ALA HB1 H 1 1.26 0.02 . 1 . . . . . . . . 5686 1 1125 . 1 1 96 96 ALA HB2 H 1 1.26 0.02 . 1 . . . . . . . . 5686 1 1126 . 1 1 96 96 ALA HB3 H 1 1.26 0.02 . 1 . . . . . . . . 5686 1 1127 . 1 1 96 96 ALA C C 13 175.5 0.2 . 1 . . . . . . . . 5686 1 1128 . 1 1 96 96 ALA CA C 13 50.74 0.1 . 1 . . . . . . . . 5686 1 1129 . 1 1 96 96 ALA CB C 13 19.33 0.1 . 1 . . . . . . . . 5686 1 1130 . 1 1 96 96 ALA N N 15 128.2 0.2 . 1 . . . . . . . . 5686 1 1131 . 1 1 97 97 LYS H H 1 7.55 0.02 . 1 . . . . . . . . 5686 1 1132 . 1 1 97 97 LYS HA H 1 3.634 0.02 . 1 . . . . . . . . 5686 1 1133 . 1 1 97 97 LYS HB2 H 1 1.269 0.02 . 2 . . . . . . . . 5686 1 1134 . 1 1 97 97 LYS HB3 H 1 1.025 0.02 . 2 . . . . . . . . 5686 1 1135 . 1 1 97 97 LYS HG2 H 1 0.7741 0.02 . 2 . . . . . . . . 5686 1 1136 . 1 1 97 97 LYS HG3 H 1 0.08242 0.02 . 2 . . . . . . . . 5686 1 1137 . 1 1 97 97 LYS HD2 H 1 1.303 0.02 . 2 . . . . . . . . 5686 1 1138 . 1 1 97 97 LYS HD3 H 1 1.185 0.02 . 2 . . . . . . . . 5686 1 1139 . 1 1 97 97 LYS HE2 H 1 2.534 0.02 . 2 . . . . . . . . 5686 1 1140 . 1 1 97 97 LYS HE3 H 1 2.443 0.02 . 2 . . . . . . . . 5686 1 1141 . 1 1 97 97 LYS CA C 13 52.79 0.1 . 1 . . . . . . . . 5686 1 1142 . 1 1 97 97 LYS CB C 13 32.38 0.1 . 1 . . . . . . . . 5686 1 1143 . 1 1 97 97 LYS CG C 13 24.58 0.1 . 1 . . . . . . . . 5686 1 1144 . 1 1 97 97 LYS CD C 13 28.98 0.1 . 1 . . . . . . . . 5686 1 1145 . 1 1 97 97 LYS CE C 13 40 0.1 . 1 . . . . . . . . 5686 1 1146 . 1 1 97 97 LYS N N 15 119.6 0.2 . 1 . . . . . . . . 5686 1 1147 . 1 1 98 98 PRO HA H 1 4.001 0.02 . 1 . . . . . . . . 5686 1 1148 . 1 1 98 98 PRO HB2 H 1 2.22 0.02 . 2 . . . . . . . . 5686 1 1149 . 1 1 98 98 PRO HB3 H 1 1.87 0.02 . 2 . . . . . . . . 5686 1 1150 . 1 1 98 98 PRO HG2 H 1 1.776 0.02 . 1 . . . . . . . . 5686 1 1151 . 1 1 98 98 PRO HG3 H 1 1.776 0.02 . 1 . . . . . . . . 5686 1 1152 . 1 1 98 98 PRO HD2 H 1 3.455 0.02 . 2 . . . . . . . . 5686 1 1153 . 1 1 98 98 PRO HD3 H 1 3.356 0.02 . 2 . . . . . . . . 5686 1 1154 . 1 1 98 98 PRO C C 13 175.6 0.2 . 1 . . . . . . . . 5686 1 1155 . 1 1 98 98 PRO CA C 13 60.33 0.1 . 1 . . . . . . . . 5686 1 1156 . 1 1 98 98 PRO CB C 13 33.36 0.1 . 1 . . . . . . . . 5686 1 1157 . 1 1 98 98 PRO CG C 13 23.88 0.1 . 1 . . . . . . . . 5686 1 1158 . 1 1 98 98 PRO CD C 13 49.59 0.1 . 1 . . . . . . . . 5686 1 1159 . 1 1 99 99 TYR H H 1 7.844 0.02 . 1 . . . . . . . . 5686 1 1160 . 1 1 99 99 TYR HA H 1 4.573 0.02 . 1 . . . . . . . . 5686 1 1161 . 1 1 99 99 TYR HB2 H 1 3.055 0.02 . 2 . . . . . . . . 5686 1 1162 . 1 1 99 99 TYR HB3 H 1 2.377 0.02 . 2 . . . . . . . . 5686 1 1163 . 1 1 99 99 TYR HD1 H 1 6.975 0.02 . 1 . . . . . . . . 5686 1 1164 . 1 1 99 99 TYR HD2 H 1 6.975 0.02 . 1 . . . . . . . . 5686 1 1165 . 1 1 99 99 TYR HE1 H 1 6.427 0.02 . 1 . . . . . . . . 5686 1 1166 . 1 1 99 99 TYR HE2 H 1 6.427 0.02 . 1 . . . . . . . . 5686 1 1167 . 1 1 99 99 TYR C C 13 176.8 0.2 . 1 . . . . . . . . 5686 1 1168 . 1 1 99 99 TYR CA C 13 55.6 0.1 . 1 . . . . . . . . 5686 1 1169 . 1 1 99 99 TYR CB C 13 36.28 0.1 . 1 . . . . . . . . 5686 1 1170 . 1 1 99 99 TYR N N 15 122.7 0.2 . 1 . . . . . . . . 5686 1 1171 . 1 1 100 100 ARG H H 1 9.301 0.02 . 1 . . . . . . . . 5686 1 1172 . 1 1 100 100 ARG HA H 1 3.927 0.02 . 1 . . . . . . . . 5686 1 1173 . 1 1 100 100 ARG HB2 H 1 1.838 0.02 . 2 . . . . . . . . 5686 1 1174 . 1 1 100 100 ARG HB3 H 1 1.619 0.02 . 2 . . . . . . . . 5686 1 1175 . 1 1 100 100 ARG HD2 H 1 3.126 0.02 . 2 . . . . . . . . 5686 1 1176 . 1 1 100 100 ARG HD3 H 1 3.064 0.02 . 2 . . . . . . . . 5686 1 1177 . 1 1 100 100 ARG C C 13 177.2 0.2 . 1 . . . . . . . . 5686 1 1178 . 1 1 100 100 ARG CA C 13 59.23 0.1 . 1 . . . . . . . . 5686 1 1179 . 1 1 100 100 ARG CB C 13 28.72 0.1 . 1 . . . . . . . . 5686 1 1180 . 1 1 100 100 ARG CD C 13 41.55 0.1 . 1 . . . . . . . . 5686 1 1181 . 1 1 100 100 ARG N N 15 124.8 0.2 . 1 . . . . . . . . 5686 1 1182 . 1 1 101 101 SER H H 1 7.286 0.02 . 1 . . . . . . . . 5686 1 1183 . 1 1 101 101 SER HA H 1 4.443 0.02 . 1 . . . . . . . . 5686 1 1184 . 1 1 101 101 SER HB2 H 1 4.199 0.02 . 2 . . . . . . . . 5686 1 1185 . 1 1 101 101 SER HB3 H 1 4.074 0.02 . 2 . . . . . . . . 5686 1 1186 . 1 1 101 101 SER CA C 13 56.43 0.1 . 1 . . . . . . . . 5686 1 1187 . 1 1 101 101 SER CB C 13 63.58 0.1 . 1 . . . . . . . . 5686 1 1188 . 1 1 101 101 SER N N 15 105.5 0.2 . 1 . . . . . . . . 5686 1 1189 . 1 1 102 102 ILE HA H 1 3.728 0.02 . 1 . . . . . . . . 5686 1 1190 . 1 1 102 102 ILE HB H 1 2.039 0.02 . 1 . . . . . . . . 5686 1 1191 . 1 1 102 102 ILE HG12 H 1 1.554 0.02 . 2 . . . . . . . . 5686 1 1192 . 1 1 102 102 ILE HG13 H 1 1.349 0.02 . 2 . . . . . . . . 5686 1 1193 . 1 1 102 102 ILE HG21 H 1 0.7334 0.02 . 1 . . . . . . . . 5686 1 1194 . 1 1 102 102 ILE HG22 H 1 0.7334 0.02 . 1 . . . . . . . . 5686 1 1195 . 1 1 102 102 ILE HG23 H 1 0.7334 0.02 . 1 . . . . . . . . 5686 1 1196 . 1 1 102 102 ILE HD11 H 1 0.6149 0.02 . 1 . . . . . . . . 5686 1 1197 . 1 1 102 102 ILE HD12 H 1 0.6149 0.02 . 1 . . . . . . . . 5686 1 1198 . 1 1 102 102 ILE HD13 H 1 0.6149 0.02 . 1 . . . . . . . . 5686 1 1199 . 1 1 102 102 ILE C C 13 177.3 0.2 . 1 . . . . . . . . 5686 1 1200 . 1 1 102 102 ILE CA C 13 61.65 0.1 . 1 . . . . . . . . 5686 1 1201 . 1 1 102 102 ILE CB C 13 34.01 0.1 . 1 . . . . . . . . 5686 1 1202 . 1 1 102 102 ILE CG1 C 13 26.75 0.1 . 1 . . . . . . . . 5686 1 1203 . 1 1 102 102 ILE CG2 C 13 17.07 0.1 . 1 . . . . . . . . 5686 1 1204 . 1 1 102 102 ILE CD1 C 13 8.427 0.1 . 1 . . . . . . . . 5686 1 1205 . 1 1 103 103 LYS H H 1 8.179 0.02 . 1 . . . . . . . . 5686 1 1206 . 1 1 103 103 LYS HA H 1 3.734 0.02 . 1 . . . . . . . . 5686 1 1207 . 1 1 103 103 LYS HB2 H 1 1.631 0.02 . 2 . . . . . . . . 5686 1 1208 . 1 1 103 103 LYS HB3 H 1 1.564 0.02 . 2 . . . . . . . . 5686 1 1209 . 1 1 103 103 LYS HG2 H 1 1.466 0.02 . 2 . . . . . . . . 5686 1 1210 . 1 1 103 103 LYS HG3 H 1 1.306 0.02 . 2 . . . . . . . . 5686 1 1211 . 1 1 103 103 LYS HD2 H 1 1.598 0.02 . 1 . . . . . . . . 5686 1 1212 . 1 1 103 103 LYS HD3 H 1 1.598 0.02 . 1 . . . . . . . . 5686 1 1213 . 1 1 103 103 LYS HE2 H 1 2.881 0.02 . 1 . . . . . . . . 5686 1 1214 . 1 1 103 103 LYS HE3 H 1 2.881 0.02 . 1 . . . . . . . . 5686 1 1215 . 1 1 103 103 LYS C C 13 178.7 0.2 . 1 . . . . . . . . 5686 1 1216 . 1 1 103 103 LYS CA C 13 59.19 0.1 . 1 . . . . . . . . 5686 1 1217 . 1 1 103 103 LYS CB C 13 31.41 0.1 . 1 . . . . . . . . 5686 1 1218 . 1 1 103 103 LYS CG C 13 24.83 0.1 . 1 . . . . . . . . 5686 1 1219 . 1 1 103 103 LYS CD C 13 28.27 0.1 . 1 . . . . . . . . 5686 1 1220 . 1 1 103 103 LYS N N 15 120.3 0.2 . 1 . . . . . . . . 5686 1 1221 . 1 1 104 104 ALA H H 1 8.163 0.02 . 1 . . . . . . . . 5686 1 1222 . 1 1 104 104 ALA HA H 1 3.864 0.02 . 1 . . . . . . . . 5686 1 1223 . 1 1 104 104 ALA HB1 H 1 1.399 0.02 . 1 . . . . . . . . 5686 1 1224 . 1 1 104 104 ALA HB2 H 1 1.399 0.02 . 1 . . . . . . . . 5686 1 1225 . 1 1 104 104 ALA HB3 H 1 1.399 0.02 . 1 . . . . . . . . 5686 1 1226 . 1 1 104 104 ALA C C 13 179 0.2 . 1 . . . . . . . . 5686 1 1227 . 1 1 104 104 ALA CA C 13 54.26 0.1 . 1 . . . . . . . . 5686 1 1228 . 1 1 104 104 ALA CB C 13 16.73 0.1 . 1 . . . . . . . . 5686 1 1229 . 1 1 104 104 ALA N N 15 122.1 0.2 . 1 . . . . . . . . 5686 1 1230 . 1 1 105 105 LEU H H 1 7.434 0.02 . 1 . . . . . . . . 5686 1 1231 . 1 1 105 105 LEU HA H 1 3.991 0.02 . 1 . . . . . . . . 5686 1 1232 . 1 1 105 105 LEU HB2 H 1 1.749 0.02 . 2 . . . . . . . . 5686 1 1233 . 1 1 105 105 LEU HB3 H 1 1.048 0.02 . 2 . . . . . . . . 5686 1 1234 . 1 1 105 105 LEU HG H 1 0.9701 0.02 . 1 . . . . . . . . 5686 1 1235 . 1 1 105 105 LEU HD11 H 1 -0.02922 0.02 . 2 . . . . . . . . 5686 1 1236 . 1 1 105 105 LEU HD12 H 1 -0.02922 0.02 . 2 . . . . . . . . 5686 1 1237 . 1 1 105 105 LEU HD13 H 1 -0.02922 0.02 . 2 . . . . . . . . 5686 1 1238 . 1 1 105 105 LEU HD21 H 1 0.3822 0.02 . 2 . . . . . . . . 5686 1 1239 . 1 1 105 105 LEU HD22 H 1 0.3822 0.02 . 2 . . . . . . . . 5686 1 1240 . 1 1 105 105 LEU HD23 H 1 0.3822 0.02 . 2 . . . . . . . . 5686 1 1241 . 1 1 105 105 LEU C C 13 177.7 0.2 . 1 . . . . . . . . 5686 1 1242 . 1 1 105 105 LEU CA C 13 56.46 0.1 . 1 . . . . . . . . 5686 1 1243 . 1 1 105 105 LEU CB C 13 40.45 0.1 . 1 . . . . . . . . 5686 1 1244 . 1 1 105 105 LEU CG C 13 25.46 0.1 . 1 . . . . . . . . 5686 1 1245 . 1 1 105 105 LEU CD1 C 13 24.22 0.1 . 2 . . . . . . . . 5686 1 1246 . 1 1 105 105 LEU CD2 C 13 21.01 0.1 . 2 . . . . . . . . 5686 1 1247 . 1 1 105 105 LEU N N 15 121.3 0.2 . 1 . . . . . . . . 5686 1 1248 . 1 1 106 106 VAL H H 1 8.568 0.02 . 1 . . . . . . . . 5686 1 1249 . 1 1 106 106 VAL HA H 1 3.118 0.02 . 1 . . . . . . . . 5686 1 1250 . 1 1 106 106 VAL HB H 1 1.95 0.02 . 1 . . . . . . . . 5686 1 1251 . 1 1 106 106 VAL HG11 H 1 0.7233 0.02 . 2 . . . . . . . . 5686 1 1252 . 1 1 106 106 VAL HG12 H 1 0.7233 0.02 . 2 . . . . . . . . 5686 1 1253 . 1 1 106 106 VAL HG13 H 1 0.7233 0.02 . 2 . . . . . . . . 5686 1 1254 . 1 1 106 106 VAL HG21 H 1 0.7 0.02 . 2 . . . . . . . . 5686 1 1255 . 1 1 106 106 VAL HG22 H 1 0.7 0.02 . 2 . . . . . . . . 5686 1 1256 . 1 1 106 106 VAL HG23 H 1 0.7 0.02 . 2 . . . . . . . . 5686 1 1257 . 1 1 106 106 VAL C C 13 176.2 0.2 . 1 . . . . . . . . 5686 1 1258 . 1 1 106 106 VAL CA C 13 66.31 0.1 . 1 . . . . . . . . 5686 1 1259 . 1 1 106 106 VAL CB C 13 30.2 0.1 . 1 . . . . . . . . 5686 1 1260 . 1 1 106 106 VAL CG1 C 13 22.07 0.1 . 2 . . . . . . . . 5686 1 1261 . 1 1 106 106 VAL CG2 C 13 20.57 0.1 . 2 . . . . . . . . 5686 1 1262 . 1 1 106 106 VAL N N 15 119.1 0.2 . 1 . . . . . . . . 5686 1 1263 . 1 1 107 107 ALA H H 1 7.798 0.02 . 1 . . . . . . . . 5686 1 1264 . 1 1 107 107 ALA HA H 1 4.082 0.02 . 1 . . . . . . . . 5686 1 1265 . 1 1 107 107 ALA HB1 H 1 1.516 0.02 . 1 . . . . . . . . 5686 1 1266 . 1 1 107 107 ALA HB2 H 1 1.516 0.02 . 1 . . . . . . . . 5686 1 1267 . 1 1 107 107 ALA HB3 H 1 1.516 0.02 . 1 . . . . . . . . 5686 1 1268 . 1 1 107 107 ALA C C 13 178.6 0.2 . 1 . . . . . . . . 5686 1 1269 . 1 1 107 107 ALA CA C 13 53.93 0.1 . 1 . . . . . . . . 5686 1 1270 . 1 1 107 107 ALA CB C 13 17.46 0.1 . 1 . . . . . . . . 5686 1 1271 . 1 1 107 107 ALA N N 15 121.3 0.2 . 1 . . . . . . . . 5686 1 1272 . 1 1 108 108 ARG H H 1 7.207 0.02 . 1 . . . . . . . . 5686 1 1273 . 1 1 108 108 ARG HA H 1 4.027 0.02 . 1 . . . . . . . . 5686 1 1274 . 1 1 108 108 ARG HB2 H 1 2.22 0.02 . 2 . . . . . . . . 5686 1 1275 . 1 1 108 108 ARG HB3 H 1 1.765 0.02 . 2 . . . . . . . . 5686 1 1276 . 1 1 108 108 ARG HG2 H 1 1.543 0.02 . 1 . . . . . . . . 5686 1 1277 . 1 1 108 108 ARG HG3 H 1 1.543 0.02 . 1 . . . . . . . . 5686 1 1278 . 1 1 108 108 ARG HD2 H 1 3.037 0.02 . 1 . . . . . . . . 5686 1 1279 . 1 1 108 108 ARG HD3 H 1 3.037 0.02 . 1 . . . . . . . . 5686 1 1280 . 1 1 108 108 ARG C C 13 176.6 0.2 . 1 . . . . . . . . 5686 1 1281 . 1 1 108 108 ARG CA C 13 57.63 0.1 . 1 . . . . . . . . 5686 1 1282 . 1 1 108 108 ARG CB C 13 29.99 0.1 . 1 . . . . . . . . 5686 1 1283 . 1 1 108 108 ARG N N 15 120.4 0.2 . 1 . . . . . . . . 5686 1 1284 . 1 1 109 109 ILE H H 1 8.067 0.02 . 1 . . . . . . . . 5686 1 1285 . 1 1 109 109 ILE HA H 1 2.957 0.02 . 1 . . . . . . . . 5686 1 1286 . 1 1 109 109 ILE HB H 1 1.616 0.02 . 1 . . . . . . . . 5686 1 1287 . 1 1 109 109 ILE HG21 H 1 0.4114 0.02 . 1 . . . . . . . . 5686 1 1288 . 1 1 109 109 ILE HG22 H 1 0.4114 0.02 . 1 . . . . . . . . 5686 1 1289 . 1 1 109 109 ILE HG23 H 1 0.4114 0.02 . 1 . . . . . . . . 5686 1 1290 . 1 1 109 109 ILE HD11 H 1 0.457 0.02 . 1 . . . . . . . . 5686 1 1291 . 1 1 109 109 ILE HD12 H 1 0.457 0.02 . 1 . . . . . . . . 5686 1 1292 . 1 1 109 109 ILE HD13 H 1 0.457 0.02 . 1 . . . . . . . . 5686 1 1293 . 1 1 109 109 ILE C C 13 176.6 0.2 . 1 . . . . . . . . 5686 1 1294 . 1 1 109 109 ILE CA C 13 66.07 0.1 . 1 . . . . . . . . 5686 1 1295 . 1 1 109 109 ILE CB C 13 36.42 0.1 . 1 . . . . . . . . 5686 1 1296 . 1 1 109 109 ILE CG2 C 13 15.83 0.1 . 2 . . . . . . . . 5686 1 1297 . 1 1 109 109 ILE CD1 C 13 12.7 0.1 . 2 . . . . . . . . 5686 1 1298 . 1 1 109 109 ILE N N 15 120.1 0.2 . 1 . . . . . . . . 5686 1 1299 . 1 1 110 110 GLU H H 1 8.351 0.02 . 1 . . . . . . . . 5686 1 1300 . 1 1 110 110 GLU HA H 1 3.637 0.02 . 1 . . . . . . . . 5686 1 1301 . 1 1 110 110 GLU HB2 H 1 2.035 0.02 . 2 . . . . . . . . 5686 1 1302 . 1 1 110 110 GLU HB3 H 1 1.988 0.02 . 2 . . . . . . . . 5686 1 1303 . 1 1 110 110 GLU HG2 H 1 2.353 0.02 . 2 . . . . . . . . 5686 1 1304 . 1 1 110 110 GLU HG3 H 1 2.089 0.02 . 2 . . . . . . . . 5686 1 1305 . 1 1 110 110 GLU C C 13 178.7 0.2 . 1 . . . . . . . . 5686 1 1306 . 1 1 110 110 GLU CA C 13 59.36 0.1 . 1 . . . . . . . . 5686 1 1307 . 1 1 110 110 GLU CB C 13 29.07 0.1 . 1 . . . . . . . . 5686 1 1308 . 1 1 110 110 GLU CG C 13 36.33 0.1 . 1 . . . . . . . . 5686 1 1309 . 1 1 110 110 GLU N N 15 117.3 0.2 . 1 . . . . . . . . 5686 1 1310 . 1 1 111 111 ALA H H 1 7.621 0.02 . 1 . . . . . . . . 5686 1 1311 . 1 1 111 111 ALA HA H 1 3.989 0.02 . 1 . . . . . . . . 5686 1 1312 . 1 1 111 111 ALA HB1 H 1 1.408 0.02 . 1 . . . . . . . . 5686 1 1313 . 1 1 111 111 ALA HB2 H 1 1.408 0.02 . 1 . . . . . . . . 5686 1 1314 . 1 1 111 111 ALA HB3 H 1 1.408 0.02 . 1 . . . . . . . . 5686 1 1315 . 1 1 111 111 ALA C C 13 180.1 0.2 . 1 . . . . . . . . 5686 1 1316 . 1 1 111 111 ALA CA C 13 54.33 0.1 . 1 . . . . . . . . 5686 1 1317 . 1 1 111 111 ALA CB C 13 18.73 0.1 . 1 . . . . . . . . 5686 1 1318 . 1 1 111 111 ALA N N 15 121.3 0.2 . 1 . . . . . . . . 5686 1 1319 . 1 1 112 112 ARG H H 1 7.961 0.02 . 1 . . . . . . . . 5686 1 1320 . 1 1 112 112 ARG HA H 1 4.256 0.02 . 1 . . . . . . . . 5686 1 1321 . 1 1 112 112 ARG HB2 H 1 1.995 0.02 . 2 . . . . . . . . 5686 1 1322 . 1 1 112 112 ARG HB3 H 1 1.965 0.02 . 2 . . . . . . . . 5686 1 1323 . 1 1 112 112 ARG HG2 H 1 1.554 0.02 . 2 . . . . . . . . 5686 1 1324 . 1 1 112 112 ARG HG3 H 1 1.509 0.02 . 2 . . . . . . . . 5686 1 1325 . 1 1 112 112 ARG HD2 H 1 2.965 0.02 . 1 . . . . . . . . 5686 1 1326 . 1 1 112 112 ARG HD3 H 1 2.965 0.02 . 1 . . . . . . . . 5686 1 1327 . 1 1 112 112 ARG C C 13 176.7 0.2 . 1 . . . . . . . . 5686 1 1328 . 1 1 112 112 ARG CA C 13 55.62 0.1 . 1 . . . . . . . . 5686 1 1329 . 1 1 112 112 ARG CB C 13 28.34 0.1 . 1 . . . . . . . . 5686 1 1330 . 1 1 112 112 ARG CG C 13 26.73 0.1 . 1 . . . . . . . . 5686 1 1331 . 1 1 112 112 ARG N N 15 117.6 0.2 . 1 . . . . . . . . 5686 1 1332 . 1 1 113 113 LEU H H 1 8.423 0.02 . 1 . . . . . . . . 5686 1 1333 . 1 1 113 113 LEU HA H 1 4.414 0.02 . 1 . . . . . . . . 5686 1 1334 . 1 1 113 113 LEU HB2 H 1 1.635 0.02 . 1 . . . . . . . . 5686 1 1335 . 1 1 113 113 LEU HB3 H 1 1.635 0.02 . 1 . . . . . . . . 5686 1 1336 . 1 1 113 113 LEU HG H 1 1.446 0.02 . 1 . . . . . . . . 5686 1 1337 . 1 1 113 113 LEU HD11 H 1 0.8075 0.02 . 2 . . . . . . . . 5686 1 1338 . 1 1 113 113 LEU HD12 H 1 0.8075 0.02 . 2 . . . . . . . . 5686 1 1339 . 1 1 113 113 LEU HD13 H 1 0.8075 0.02 . 2 . . . . . . . . 5686 1 1340 . 1 1 113 113 LEU HD21 H 1 0.4453 0.02 . 2 . . . . . . . . 5686 1 1341 . 1 1 113 113 LEU HD22 H 1 0.4453 0.02 . 2 . . . . . . . . 5686 1 1342 . 1 1 113 113 LEU HD23 H 1 0.4453 0.02 . 2 . . . . . . . . 5686 1 1343 . 1 1 113 113 LEU C C 13 177 0.2 . 1 . . . . . . . . 5686 1 1344 . 1 1 113 113 LEU CA C 13 54.31 0.1 . 1 . . . . . . . . 5686 1 1345 . 1 1 113 113 LEU CB C 13 41.72 0.1 . 1 . . . . . . . . 5686 1 1346 . 1 1 113 113 LEU CG C 13 25.2 0.1 . 1 . . . . . . . . 5686 1 1347 . 1 1 113 113 LEU CD1 C 13 22.46 0.1 . 2 . . . . . . . . 5686 1 1348 . 1 1 113 113 LEU N N 15 123.9 0.2 . 1 . . . . . . . . 5686 1 1349 . 1 1 114 114 ARG H H 1 7.992 0.02 . 1 . . . . . . . . 5686 1 1350 . 1 1 114 114 ARG HA H 1 4.109 0.02 . 1 . . . . . . . . 5686 1 1351 . 1 1 114 114 ARG HB2 H 1 1.864 0.02 . 1 . . . . . . . . 5686 1 1352 . 1 1 114 114 ARG HB3 H 1 1.864 0.02 . 1 . . . . . . . . 5686 1 1353 . 1 1 114 114 ARG HG2 H 1 1.704 0.02 . 2 . . . . . . . . 5686 1 1354 . 1 1 114 114 ARG HG3 H 1 1.543 0.02 . 2 . . . . . . . . 5686 1 1355 . 1 1 114 114 ARG HD2 H 1 3.174 0.02 . 1 . . . . . . . . 5686 1 1356 . 1 1 114 114 ARG HD3 H 1 3.174 0.02 . 1 . . . . . . . . 5686 1 1357 . 1 1 114 114 ARG C C 13 176.6 0.2 . 1 . . . . . . . . 5686 1 1358 . 1 1 114 114 ARG CA C 13 57.03 0.1 . 1 . . . . . . . . 5686 1 1359 . 1 1 114 114 ARG CB C 13 29.65 0.1 . 1 . . . . . . . . 5686 1 1360 . 1 1 114 114 ARG CG C 13 26.45 0.1 . 1 . . . . . . . . 5686 1 1361 . 1 1 114 114 ARG CD C 13 43 0.1 . 1 . . . . . . . . 5686 1 1362 . 1 1 114 114 ARG N N 15 122 0.2 . 1 . . . . . . . . 5686 1 1363 . 1 1 115 115 PHE H H 1 8.267 0.02 . 1 . . . . . . . . 5686 1 1364 . 1 1 115 115 PHE HA H 1 4.442 0.02 . 1 . . . . . . . . 5686 1 1365 . 1 1 115 115 PHE HB2 H 1 3.007 0.02 . 2 . . . . . . . . 5686 1 1366 . 1 1 115 115 PHE HB3 H 1 2.925 0.02 . 2 . . . . . . . . 5686 1 1367 . 1 1 115 115 PHE HD1 H 1 6.93 0.02 . 1 . . . . . . . . 5686 1 1368 . 1 1 115 115 PHE HD2 H 1 6.93 0.02 . 1 . . . . . . . . 5686 1 1369 . 1 1 115 115 PHE C C 13 175.8 0.2 . 1 . . . . . . . . 5686 1 1370 . 1 1 115 115 PHE CA C 13 57.59 0.1 . 1 . . . . . . . . 5686 1 1371 . 1 1 115 115 PHE CB C 13 37.98 0.1 . 1 . . . . . . . . 5686 1 1372 . 1 1 115 115 PHE N N 15 115.5 0.2 . 1 . . . . . . . . 5686 1 1373 . 1 1 116 116 TRP H H 1 8.208 0.02 . 1 . . . . . . . . 5686 1 1374 . 1 1 116 116 TRP HA H 1 4.367 0.02 . 1 . . . . . . . . 5686 1 1375 . 1 1 116 116 TRP HB2 H 1 3.27 0.02 . 2 . . . . . . . . 5686 1 1376 . 1 1 116 116 TRP HB3 H 1 3.072 0.02 . 2 . . . . . . . . 5686 1 1377 . 1 1 116 116 TRP HD1 H 1 7.155 0.02 . 1 . . . . . . . . 5686 1 1378 . 1 1 116 116 TRP HE1 H 1 10.24 0.02 . 1 . . . . . . . . 5686 1 1379 . 1 1 116 116 TRP HE3 H 1 7.494 0.02 . 2 . . . . . . . . 5686 1 1380 . 1 1 116 116 TRP C C 13 176.6 0.2 . 1 . . . . . . . . 5686 1 1381 . 1 1 116 116 TRP CA C 13 57.48 0.1 . 1 . . . . . . . . 5686 1 1382 . 1 1 116 116 TRP CB C 13 28.76 0.1 . 1 . . . . . . . . 5686 1 1383 . 1 1 116 116 TRP N N 15 117.9 0.2 . 1 . . . . . . . . 5686 1 1384 . 1 1 116 116 TRP NE1 N 15 129.7 0.02 . 1 . . . . . . . . 5686 1 1385 . 1 1 117 117 GLY H H 1 7.714 0.02 . 1 . . . . . . . . 5686 1 1386 . 1 1 117 117 GLY HA2 H 1 3.699 0.02 . 2 . . . . . . . . 5686 1 1387 . 1 1 117 117 GLY HA3 H 1 3.629 0.02 . 2 . . . . . . . . 5686 1 1388 . 1 1 117 117 GLY C C 13 173.9 0.2 . 1 . . . . . . . . 5686 1 1389 . 1 1 117 117 GLY CA C 13 44.7 0.1 . 1 . . . . . . . . 5686 1 1390 . 1 1 117 117 GLY N N 15 106.1 0.2 . 1 . . . . . . . . 5686 1 1391 . 1 1 118 118 SER H H 1 8.149 0.02 . 1 . . . . . . . . 5686 1 1392 . 1 1 118 118 SER HA H 1 4.33 0.02 . 1 . . . . . . . . 5686 1 1393 . 1 1 118 118 SER HB2 H 1 3.938 0.02 . 2 . . . . . . . . 5686 1 1394 . 1 1 118 118 SER HB3 H 1 3.798 0.02 . 2 . . . . . . . . 5686 1 1395 . 1 1 118 118 SER C C 13 173 0.2 . 1 . . . . . . . . 5686 1 1396 . 1 1 118 118 SER CA C 13 57.87 0.1 . 1 . . . . . . . . 5686 1 1397 . 1 1 118 118 SER CB C 13 62.73 0.1 . 1 . . . . . . . . 5686 1 1398 . 1 1 118 118 SER N N 15 115.5 0.2 . 1 . . . . . . . . 5686 1 1399 . 1 1 119 119 ASN H H 1 8.002 0.02 . 1 . . . . . . . . 5686 1 1400 . 1 1 119 119 ASN HA H 1 4.64 0.02 . 1 . . . . . . . . 5686 1 1401 . 1 1 119 119 ASN HB2 H 1 2.716 0.02 . 2 . . . . . . . . 5686 1 1402 . 1 1 119 119 ASN HB3 H 1 2.615 0.02 . 2 . . . . . . . . 5686 1 1403 . 1 1 119 119 ASN C C 13 174.3 0.2 . 1 . . . . . . . . 5686 1 1404 . 1 1 119 119 ASN CA C 13 52.44 0.1 . 1 . . . . . . . . 5686 1 1405 . 1 1 119 119 ASN CB C 13 37.75 0.1 . 1 . . . . . . . . 5686 1 1406 . 1 1 119 119 ASN N N 15 123.4 0.2 . 1 . . . . . . . . 5686 1 1407 . 1 1 120 120 VAL H H 1 7.734 0.02 . 1 . . . . . . . . 5686 1 1408 . 1 1 120 120 VAL HA H 1 4.268 0.02 . 1 . . . . . . . . 5686 1 1409 . 1 1 120 120 VAL HB H 1 1.94 0.02 . 1 . . . . . . . . 5686 1 1410 . 1 1 120 120 VAL HG11 H 1 0.9066 0.02 . 2 . . . . . . . . 5686 1 1411 . 1 1 120 120 VAL HG12 H 1 0.9066 0.02 . 2 . . . . . . . . 5686 1 1412 . 1 1 120 120 VAL HG13 H 1 0.9066 0.02 . 2 . . . . . . . . 5686 1 1413 . 1 1 120 120 VAL HG21 H 1 0.8448 0.02 . 2 . . . . . . . . 5686 1 1414 . 1 1 120 120 VAL HG22 H 1 0.8448 0.02 . 2 . . . . . . . . 5686 1 1415 . 1 1 120 120 VAL HG23 H 1 0.8448 0.02 . 2 . . . . . . . . 5686 1 1416 . 1 1 120 120 VAL C C 13 173.4 0.2 . 1 . . . . . . . . 5686 1 1417 . 1 1 120 120 VAL CA C 13 62.55 0.1 . 1 . . . . . . . . 5686 1 1418 . 1 1 120 120 VAL CB C 13 32.8 0.1 . 1 . . . . . . . . 5686 1 1419 . 1 1 120 120 VAL CG1 C 13 20.85 0.1 . 2 . . . . . . . . 5686 1 1420 . 1 1 120 120 VAL N N 15 118.4 0.2 . 1 . . . . . . . . 5686 1 1421 . 1 1 121 121 ILE H H 1 8.862 0.02 . 1 . . . . . . . . 5686 1 1422 . 1 1 121 121 ILE HA H 1 4.147 0.02 . 1 . . . . . . . . 5686 1 1423 . 1 1 121 121 ILE HB H 1 1.727 0.02 . 1 . . . . . . . . 5686 1 1424 . 1 1 121 121 ILE HG12 H 1 1.606 0.02 . 2 . . . . . . . . 5686 1 1425 . 1 1 121 121 ILE HG13 H 1 0.8632 0.02 . 2 . . . . . . . . 5686 1 1426 . 1 1 121 121 ILE HG21 H 1 0.6559 0.02 . 1 . . . . . . . . 5686 1 1427 . 1 1 121 121 ILE HG22 H 1 0.6559 0.02 . 1 . . . . . . . . 5686 1 1428 . 1 1 121 121 ILE HG23 H 1 0.6559 0.02 . 1 . . . . . . . . 5686 1 1429 . 1 1 121 121 ILE HD11 H 1 0.6603 0.02 . 1 . . . . . . . . 5686 1 1430 . 1 1 121 121 ILE HD12 H 1 0.6603 0.02 . 1 . . . . . . . . 5686 1 1431 . 1 1 121 121 ILE HD13 H 1 0.6603 0.02 . 1 . . . . . . . . 5686 1 1432 . 1 1 121 121 ILE C C 13 171.8 0.2 . 1 . . . . . . . . 5686 1 1433 . 1 1 121 121 ILE CA C 13 60.66 0.1 . 1 . . . . . . . . 5686 1 1434 . 1 1 121 121 ILE CB C 13 39.75 0.1 . 1 . . . . . . . . 5686 1 1435 . 1 1 121 121 ILE CG1 C 13 26.69 0.1 . 1 . . . . . . . . 5686 1 1436 . 1 1 121 121 ILE CG2 C 13 16.5 0.1 . 1 . . . . . . . . 5686 1 1437 . 1 1 121 121 ILE CD1 C 13 14.81 0.1 . 1 . . . . . . . . 5686 1 1438 . 1 1 121 121 ILE N N 15 127.4 0.2 . 1 . . . . . . . . 5686 1 1439 . 1 1 122 122 GLU H H 1 8.559 0.02 . 1 . . . . . . . . 5686 1 1440 . 1 1 122 122 GLU HA H 1 5.042 0.02 . 1 . . . . . . . . 5686 1 1441 . 1 1 122 122 GLU HB2 H 1 1.96 0.02 . 2 . . . . . . . . 5686 1 1442 . 1 1 122 122 GLU HB3 H 1 1.839 0.02 . 2 . . . . . . . . 5686 1 1443 . 1 1 122 122 GLU HG2 H 1 2.109 0.02 . 2 . . . . . . . . 5686 1 1444 . 1 1 122 122 GLU HG3 H 1 2.044 0.02 . 2 . . . . . . . . 5686 1 1445 . 1 1 122 122 GLU C C 13 173.2 0.2 . 1 . . . . . . . . 5686 1 1446 . 1 1 122 122 GLU CA C 13 54.83 0.1 . 1 . . . . . . . . 5686 1 1447 . 1 1 122 122 GLU CB C 13 31.37 0.1 . 1 . . . . . . . . 5686 1 1448 . 1 1 122 122 GLU CG C 13 36.11 0.1 . 1 . . . . . . . . 5686 1 1449 . 1 1 122 122 GLU N N 15 128.1 0.2 . 1 . . . . . . . . 5686 1 1450 . 1 1 123 123 ILE H H 1 9.04 0.02 . 1 . . . . . . . . 5686 1 1451 . 1 1 123 123 ILE HA H 1 4.302 0.02 . 1 . . . . . . . . 5686 1 1452 . 1 1 123 123 ILE HB H 1 1.957 0.02 . 1 . . . . . . . . 5686 1 1453 . 1 1 123 123 ILE HG12 H 1 1.427 0.02 . 2 . . . . . . . . 5686 1 1454 . 1 1 123 123 ILE HG13 H 1 1.042 0.02 . 2 . . . . . . . . 5686 1 1455 . 1 1 123 123 ILE HG21 H 1 1.151 0.02 . 1 . . . . . . . . 5686 1 1456 . 1 1 123 123 ILE HG22 H 1 1.151 0.02 . 1 . . . . . . . . 5686 1 1457 . 1 1 123 123 ILE HG23 H 1 1.151 0.02 . 1 . . . . . . . . 5686 1 1458 . 1 1 123 123 ILE HD11 H 1 0.8058 0.02 . 1 . . . . . . . . 5686 1 1459 . 1 1 123 123 ILE HD12 H 1 0.8058 0.02 . 1 . . . . . . . . 5686 1 1460 . 1 1 123 123 ILE HD13 H 1 0.8058 0.02 . 1 . . . . . . . . 5686 1 1461 . 1 1 123 123 ILE C C 13 173.1 0.2 . 1 . . . . . . . . 5686 1 1462 . 1 1 123 123 ILE CA C 13 59.26 0.1 . 1 . . . . . . . . 5686 1 1463 . 1 1 123 123 ILE CB C 13 40.22 0.1 . 1 . . . . . . . . 5686 1 1464 . 1 1 123 123 ILE CG1 C 13 27.22 0.1 . 1 . . . . . . . . 5686 1 1465 . 1 1 123 123 ILE CG2 C 13 18.42 0.1 . 1 . . . . . . . . 5686 1 1466 . 1 1 123 123 ILE CD1 C 13 15.04 0.1 . 1 . . . . . . . . 5686 1 1467 . 1 1 123 123 ILE N N 15 127.2 0.2 . 1 . . . . . . . . 5686 1 1468 . 1 1 124 124 GLY H H 1 8.88 0.02 . 1 . . . . . . . . 5686 1 1469 . 1 1 124 124 GLY HA2 H 1 3.663 0.02 . 2 . . . . . . . . 5686 1 1470 . 1 1 124 124 GLY HA3 H 1 3.978 0.02 . 2 . . . . . . . . 5686 1 1471 . 1 1 124 124 GLY CA C 13 47.47 0.1 . 1 . . . . . . . . 5686 1 1472 . 1 1 124 124 GLY N N 15 115.4 0.2 . 1 . . . . . . . . 5686 1 1473 . 1 1 125 125 ASP H H 1 8.299 0.02 . 1 . . . . . . . . 5686 1 1474 . 1 1 125 125 ASP HA H 1 4.695 0.02 . 1 . . . . . . . . 5686 1 1475 . 1 1 125 125 ASP C C 13 171.5 0.2 . 1 . . . . . . . . 5686 1 1476 . 1 1 125 125 ASP CA C 13 55.06 0.1 . 1 . . . . . . . . 5686 1 1477 . 1 1 125 125 ASP CB C 13 42.25 0.1 . 1 . . . . . . . . 5686 1 1478 . 1 1 125 125 ASP N N 15 119.1 0.2 . 1 . . . . . . . . 5686 1 1479 . 1 1 126 126 LEU H H 1 8.753 0.02 . 1 . . . . . . . . 5686 1 1480 . 1 1 126 126 LEU HA H 1 5.265 0.02 . 1 . . . . . . . . 5686 1 1481 . 1 1 126 126 LEU HB2 H 1 2.169 0.02 . 2 . . . . . . . . 5686 1 1482 . 1 1 126 126 LEU HB3 H 1 1.205 0.02 . 2 . . . . . . . . 5686 1 1483 . 1 1 126 126 LEU HG H 1 1.353 0.02 . 1 . . . . . . . . 5686 1 1484 . 1 1 126 126 LEU HD11 H 1 0.575 0.02 . 2 . . . . . . . . 5686 1 1485 . 1 1 126 126 LEU HD12 H 1 0.575 0.02 . 2 . . . . . . . . 5686 1 1486 . 1 1 126 126 LEU HD13 H 1 0.575 0.02 . 2 . . . . . . . . 5686 1 1487 . 1 1 126 126 LEU HD21 H 1 0.627 0.02 . 2 . . . . . . . . 5686 1 1488 . 1 1 126 126 LEU HD22 H 1 0.627 0.02 . 2 . . . . . . . . 5686 1 1489 . 1 1 126 126 LEU HD23 H 1 0.627 0.02 . 2 . . . . . . . . 5686 1 1490 . 1 1 126 126 LEU C C 13 172.4 0.2 . 1 . . . . . . . . 5686 1 1491 . 1 1 126 126 LEU CA C 13 53.89 0.1 . 1 . . . . . . . . 5686 1 1492 . 1 1 126 126 LEU CB C 13 45.82 0.1 . 1 . . . . . . . . 5686 1 1493 . 1 1 126 126 LEU CG C 13 27.01 0.1 . 1 . . . . . . . . 5686 1 1494 . 1 1 126 126 LEU CD1 C 13 25.66 0.1 . 2 . . . . . . . . 5686 1 1495 . 1 1 126 126 LEU CD2 C 13 24.25 0.1 . 2 . . . . . . . . 5686 1 1496 . 1 1 126 126 LEU N N 15 124.8 0.2 . 1 . . . . . . . . 5686 1 1497 . 1 1 127 127 THR H H 1 9.314 0.02 . 1 . . . . . . . . 5686 1 1498 . 1 1 127 127 THR HA H 1 5.16 0.02 . 1 . . . . . . . . 5686 1 1499 . 1 1 127 127 THR HB H 1 3.876 0.02 . 1 . . . . . . . . 5686 1 1500 . 1 1 127 127 THR HG21 H 1 1.013 0.02 . 1 . . . . . . . . 5686 1 1501 . 1 1 127 127 THR HG22 H 1 1.013 0.02 . 1 . . . . . . . . 5686 1 1502 . 1 1 127 127 THR HG23 H 1 1.013 0.02 . 1 . . . . . . . . 5686 1 1503 . 1 1 127 127 THR C C 13 171.2 0.2 . 1 . . . . . . . . 5686 1 1504 . 1 1 127 127 THR CA C 13 61.32 0.1 . 1 . . . . . . . . 5686 1 1505 . 1 1 127 127 THR CB C 13 71.04 0.1 . 1 . . . . . . . . 5686 1 1506 . 1 1 127 127 THR CG2 C 13 21.16 0.1 . 1 . . . . . . . . 5686 1 1507 . 1 1 127 127 THR N N 15 122 0.2 . 1 . . . . . . . . 5686 1 1508 . 1 1 128 128 ILE H H 1 9.366 0.02 . 1 . . . . . . . . 5686 1 1509 . 1 1 128 128 ILE HA H 1 4.518 0.02 . 1 . . . . . . . . 5686 1 1510 . 1 1 128 128 ILE HB H 1 1.662 0.02 . 1 . . . . . . . . 5686 1 1511 . 1 1 128 128 ILE HG12 H 1 0.919 0.02 . 2 . . . . . . . . 5686 1 1512 . 1 1 128 128 ILE HG13 H 1 0.756 0.02 . 2 . . . . . . . . 5686 1 1513 . 1 1 128 128 ILE HG21 H 1 0.6695 0.02 . 1 . . . . . . . . 5686 1 1514 . 1 1 128 128 ILE HG22 H 1 0.6695 0.02 . 1 . . . . . . . . 5686 1 1515 . 1 1 128 128 ILE HG23 H 1 0.6695 0.02 . 1 . . . . . . . . 5686 1 1516 . 1 1 128 128 ILE HD11 H 1 0.4886 0.02 . 1 . . . . . . . . 5686 1 1517 . 1 1 128 128 ILE HD12 H 1 0.4886 0.02 . 1 . . . . . . . . 5686 1 1518 . 1 1 128 128 ILE HD13 H 1 0.4886 0.02 . 1 . . . . . . . . 5686 1 1519 . 1 1 128 128 ILE C C 13 172.4 0.2 . 1 . . . . . . . . 5686 1 1520 . 1 1 128 128 ILE CA C 13 60.43 0.1 . 1 . . . . . . . . 5686 1 1521 . 1 1 128 128 ILE CB C 13 41.08 0.1 . 1 . . . . . . . . 5686 1 1522 . 1 1 128 128 ILE CG2 C 13 17.75 0.1 . 1 . . . . . . . . 5686 1 1523 . 1 1 128 128 ILE CD1 C 13 13.67 0.1 . 1 . . . . . . . . 5686 1 1524 . 1 1 128 128 ILE N N 15 126 0.2 . 1 . . . . . . . . 5686 1 1525 . 1 1 129 129 SER H H 1 9.163 0.02 . 1 . . . . . . . . 5686 1 1526 . 1 1 129 129 SER HA H 1 5.263 0.02 . 1 . . . . . . . . 5686 1 1527 . 1 1 129 129 SER HB2 H 1 4.024 0.02 . 2 . . . . . . . . 5686 1 1528 . 1 1 129 129 SER HB3 H 1 3.57 0.02 . 2 . . . . . . . . 5686 1 1529 . 1 1 129 129 SER CA C 13 53 0.1 . 1 . . . . . . . . 5686 1 1530 . 1 1 129 129 SER CB C 13 62.49 0.1 . 1 . . . . . . . . 5686 1 1531 . 1 1 129 129 SER N N 15 121.7 0.2 . 1 . . . . . . . . 5686 1 1532 . 1 1 130 130 PRO HA H 1 4.493 0.02 . 1 . . . . . . . . 5686 1 1533 . 1 1 130 130 PRO HB2 H 1 2.497 0.02 . 1 . . . . . . . . 5686 1 1534 . 1 1 130 130 PRO HB3 H 1 2.497 0.02 . 1 . . . . . . . . 5686 1 1535 . 1 1 130 130 PRO HG2 H 1 2.046 0.02 . 2 . . . . . . . . 5686 1 1536 . 1 1 130 130 PRO HG3 H 1 1.755 0.02 . 2 . . . . . . . . 5686 1 1537 . 1 1 130 130 PRO HD2 H 1 4.064 0.02 . 2 . . . . . . . . 5686 1 1538 . 1 1 130 130 PRO HD3 H 1 3.946 0.02 . 2 . . . . . . . . 5686 1 1539 . 1 1 130 130 PRO C C 13 176.2 0.2 . 1 . . . . . . . . 5686 1 1540 . 1 1 130 130 PRO CA C 13 65.24 0.1 . 1 . . . . . . . . 5686 1 1541 . 1 1 130 130 PRO CB C 13 32.43 0.1 . 1 . . . . . . . . 5686 1 1542 . 1 1 130 130 PRO CG C 13 27.75 0.1 . 1 . . . . . . . . 5686 1 1543 . 1 1 130 130 PRO CD C 13 51.58 0.1 . 1 . . . . . . . . 5686 1 1544 . 1 1 131 131 ASP H H 1 9.026 0.02 . 1 . . . . . . . . 5686 1 1545 . 1 1 131 131 ASP HA H 1 4.389 0.02 . 1 . . . . . . . . 5686 1 1546 . 1 1 131 131 ASP HB2 H 1 2.659 0.02 . 1 . . . . . . . . 5686 1 1547 . 1 1 131 131 ASP HB3 H 1 2.659 0.02 . 1 . . . . . . . . 5686 1 1548 . 1 1 131 131 ASP C C 13 174.9 0.2 . 1 . . . . . . . . 5686 1 1549 . 1 1 131 131 ASP CA C 13 56.39 0.1 . 1 . . . . . . . . 5686 1 1550 . 1 1 131 131 ASP CB C 13 39.7 0.1 . 1 . . . . . . . . 5686 1 1551 . 1 1 131 131 ASP N N 15 116.5 0.2 . 1 . . . . . . . . 5686 1 1552 . 1 1 132 132 GLU H H 1 7.048 0.02 . 1 . . . . . . . . 5686 1 1553 . 1 1 132 132 GLU HA H 1 4.313 0.02 . 1 . . . . . . . . 5686 1 1554 . 1 1 132 132 GLU HB2 H 1 1.798 0.02 . 2 . . . . . . . . 5686 1 1555 . 1 1 132 132 GLU HB3 H 1 1.598 0.02 . 2 . . . . . . . . 5686 1 1556 . 1 1 132 132 GLU HG2 H 1 2.044 0.02 . 2 . . . . . . . . 5686 1 1557 . 1 1 132 132 GLU HG3 H 1 2 0.02 . 2 . . . . . . . . 5686 1 1558 . 1 1 132 132 GLU C C 13 172.3 0.2 . 1 . . . . . . . . 5686 1 1559 . 1 1 132 132 GLU CA C 13 55.07 0.1 . 1 . . . . . . . . 5686 1 1560 . 1 1 132 132 GLU CB C 13 31.53 0.1 . 1 . . . . . . . . 5686 1 1561 . 1 1 132 132 GLU CG C 13 36.79 0.1 . 1 . . . . . . . . 5686 1 1562 . 1 1 132 132 GLU N N 15 114.5 0.2 . 1 . . . . . . . . 5686 1 1563 . 1 1 133 133 GLU H H 1 7.538 0.02 . 1 . . . . . . . . 5686 1 1564 . 1 1 133 133 GLU HA H 1 2.461 0.02 . 1 . . . . . . . . 5686 1 1565 . 1 1 133 133 GLU HB2 H 1 1.896 0.02 . 2 . . . . . . . . 5686 1 1566 . 1 1 133 133 GLU HB3 H 1 1.485 0.02 . 2 . . . . . . . . 5686 1 1567 . 1 1 133 133 GLU HG2 H 1 1.633 0.02 . 2 . . . . . . . . 5686 1 1568 . 1 1 133 133 GLU HG3 H 1 1.47 0.02 . 2 . . . . . . . . 5686 1 1569 . 1 1 133 133 GLU C C 13 171.5 0.2 . 1 . . . . . . . . 5686 1 1570 . 1 1 133 133 GLU CA C 13 56.2 0.1 . 1 . . . . . . . . 5686 1 1571 . 1 1 133 133 GLU CB C 13 27.79 0.1 . 1 . . . . . . . . 5686 1 1572 . 1 1 133 133 GLU CG C 13 37.06 0.1 . 1 . . . . . . . . 5686 1 1573 . 1 1 133 133 GLU N N 15 119.1 0.2 . 1 . . . . . . . . 5686 1 1574 . 1 1 134 134 LYS H H 1 7.043 0.02 . 1 . . . . . . . . 5686 1 1575 . 1 1 134 134 LYS HA H 1 4.956 0.02 . 1 . . . . . . . . 5686 1 1576 . 1 1 134 134 LYS HB2 H 1 1.479 0.02 . 2 . . . . . . . . 5686 1 1577 . 1 1 134 134 LYS HB3 H 1 1.451 0.02 . 2 . . . . . . . . 5686 1 1578 . 1 1 134 134 LYS HG2 H 1 1.304 0.02 . 2 . . . . . . . . 5686 1 1579 . 1 1 134 134 LYS HG3 H 1 1.159 0.02 . 2 . . . . . . . . 5686 1 1580 . 1 1 134 134 LYS HD2 H 1 1.498 0.02 . 2 . . . . . . . . 5686 1 1581 . 1 1 134 134 LYS HD3 H 1 1.457 0.02 . 2 . . . . . . . . 5686 1 1582 . 1 1 134 134 LYS HE2 H 1 2.796 0.02 . 1 . . . . . . . . 5686 1 1583 . 1 1 134 134 LYS HE3 H 1 2.796 0.02 . 1 . . . . . . . . 5686 1 1584 . 1 1 134 134 LYS C C 13 172.4 0.2 . 1 . . . . . . . . 5686 1 1585 . 1 1 134 134 LYS CA C 13 54.49 0.1 . 1 . . . . . . . . 5686 1 1586 . 1 1 134 134 LYS CB C 13 37.37 0.1 . 1 . . . . . . . . 5686 1 1587 . 1 1 134 134 LYS CG C 13 24.57 0.1 . 1 . . . . . . . . 5686 1 1588 . 1 1 134 134 LYS CD C 13 29 0.1 . 1 . . . . . . . . 5686 1 1589 . 1 1 134 134 LYS CE C 13 41.39 0.1 . 1 . . . . . . . . 5686 1 1590 . 1 1 134 134 LYS N N 15 115.8 0.2 . 1 . . . . . . . . 5686 1 1591 . 1 1 135 135 ILE H H 1 8.759 0.02 . 1 . . . . . . . . 5686 1 1592 . 1 1 135 135 ILE HA H 1 4.864 0.02 . 1 . . . . . . . . 5686 1 1593 . 1 1 135 135 ILE HB H 1 1.959 0.02 . 1 . . . . . . . . 5686 1 1594 . 1 1 135 135 ILE HG12 H 1 1.785 0.02 . 2 . . . . . . . . 5686 1 1595 . 1 1 135 135 ILE HG13 H 1 1.074 0.02 . 2 . . . . . . . . 5686 1 1596 . 1 1 135 135 ILE HG21 H 1 0.803 0.02 . 1 . . . . . . . . 5686 1 1597 . 1 1 135 135 ILE HG22 H 1 0.803 0.02 . 1 . . . . . . . . 5686 1 1598 . 1 1 135 135 ILE HG23 H 1 0.803 0.02 . 1 . . . . . . . . 5686 1 1599 . 1 1 135 135 ILE HD11 H 1 0.839 0.02 . 1 . . . . . . . . 5686 1 1600 . 1 1 135 135 ILE HD12 H 1 0.839 0.02 . 1 . . . . . . . . 5686 1 1601 . 1 1 135 135 ILE HD13 H 1 0.839 0.02 . 1 . . . . . . . . 5686 1 1602 . 1 1 135 135 ILE C C 13 171.9 0.2 . 1 . . . . . . . . 5686 1 1603 . 1 1 135 135 ILE CA C 13 59.64 0.1 . 1 . . . . . . . . 5686 1 1604 . 1 1 135 135 ILE CB C 13 40.17 0.1 . 1 . . . . . . . . 5686 1 1605 . 1 1 135 135 ILE CG1 C 13 28.02 0.1 . 1 . . . . . . . . 5686 1 1606 . 1 1 135 135 ILE CG2 C 13 18.08 0.1 . 1 . . . . . . . . 5686 1 1607 . 1 1 135 135 ILE CD1 C 13 15.31 0.1 . 1 . . . . . . . . 5686 1 1608 . 1 1 135 135 ILE N N 15 124.3 0.2 . 1 . . . . . . . . 5686 1 1609 . 1 1 136 136 ILE H H 1 9.087 0.02 . 1 . . . . . . . . 5686 1 1610 . 1 1 136 136 ILE HA H 1 4.733 0.02 . 1 . . . . . . . . 5686 1 1611 . 1 1 136 136 ILE HB H 1 1.649 0.02 . 1 . . . . . . . . 5686 1 1612 . 1 1 136 136 ILE HG12 H 1 1.336 0.02 . 2 . . . . . . . . 5686 1 1613 . 1 1 136 136 ILE HG13 H 1 0.9496 0.02 . 2 . . . . . . . . 5686 1 1614 . 1 1 136 136 ILE HD11 H 1 0.706 0.02 . 1 . . . . . . . . 5686 1 1615 . 1 1 136 136 ILE HD12 H 1 0.706 0.02 . 1 . . . . . . . . 5686 1 1616 . 1 1 136 136 ILE HD13 H 1 0.706 0.02 . 1 . . . . . . . . 5686 1 1617 . 1 1 136 136 ILE C C 13 172.4 0.2 . 1 . . . . . . . . 5686 1 1618 . 1 1 136 136 ILE CA C 13 59.12 0.1 . 1 . . . . . . . . 5686 1 1619 . 1 1 136 136 ILE CB C 13 39.96 0.1 . 1 . . . . . . . . 5686 1 1620 . 1 1 136 136 ILE CG1 C 13 27.32 0.1 . 1 . . . . . . . . 5686 1 1621 . 1 1 136 136 ILE CD1 C 13 12.78 0.1 . 1 . . . . . . . . 5686 1 1622 . 1 1 136 136 ILE N N 15 126 0.2 . 1 . . . . . . . . 5686 1 1623 . 1 1 137 137 TYR H H 1 9.16 0.02 . 1 . . . . . . . . 5686 1 1624 . 1 1 137 137 TYR HA H 1 5.38 0.02 . 1 . . . . . . . . 5686 1 1625 . 1 1 137 137 TYR HB2 H 1 2.77 0.02 . 2 . . . . . . . . 5686 1 1626 . 1 1 137 137 TYR HB3 H 1 2.468 0.02 . 2 . . . . . . . . 5686 1 1627 . 1 1 137 137 TYR HD1 H 1 6.861 0.02 . 1 . . . . . . . . 5686 1 1628 . 1 1 137 137 TYR HD2 H 1 6.861 0.02 . 1 . . . . . . . . 5686 1 1629 . 1 1 137 137 TYR C C 13 172.9 0.2 . 1 . . . . . . . . 5686 1 1630 . 1 1 137 137 TYR CA C 13 55.9 0.1 . 1 . . . . . . . . 5686 1 1631 . 1 1 137 137 TYR CB C 13 40.86 0.1 . 1 . . . . . . . . 5686 1 1632 . 1 1 137 137 TYR N N 15 126.9 0.2 . 1 . . . . . . . . 5686 1 1633 . 1 1 138 138 LYS H H 1 8.427 0.02 . 1 . . . . . . . . 5686 1 1634 . 1 1 138 138 LYS HA H 1 3.682 0.02 . 1 . . . . . . . . 5686 1 1635 . 1 1 138 138 LYS HB2 H 1 1.736 0.02 . 2 . . . . . . . . 5686 1 1636 . 1 1 138 138 LYS HB3 H 1 1.329 0.02 . 2 . . . . . . . . 5686 1 1637 . 1 1 138 138 LYS HG2 H 1 0.7834 0.02 . 2 . . . . . . . . 5686 1 1638 . 1 1 138 138 LYS HG3 H 1 0.2326 0.02 . 2 . . . . . . . . 5686 1 1639 . 1 1 138 138 LYS HE2 H 1 2.523 0.02 . 2 . . . . . . . . 5686 1 1640 . 1 1 138 138 LYS HE3 H 1 2.339 0.02 . 2 . . . . . . . . 5686 1 1641 . 1 1 138 138 LYS C C 13 174.5 0.2 . 1 . . . . . . . . 5686 1 1642 . 1 1 138 138 LYS CA C 13 57.32 0.1 . 1 . . . . . . . . 5686 1 1643 . 1 1 138 138 LYS CB C 13 30.23 0.1 . 1 . . . . . . . . 5686 1 1644 . 1 1 138 138 LYS CG C 13 25.32 0.1 . 1 . . . . . . . . 5686 1 1645 . 1 1 138 138 LYS CE C 13 42.08 0.1 . 1 . . . . . . . . 5686 1 1646 . 1 1 138 138 LYS N N 15 126.2 0.2 . 1 . . . . . . . . 5686 1 1647 . 1 1 139 139 GLY H H 1 8.085 0.02 . 1 . . . . . . . . 5686 1 1648 . 1 1 139 139 GLY HA2 H 1 3.433 0.02 . 2 . . . . . . . . 5686 1 1649 . 1 1 139 139 GLY HA3 H 1 4.072 0.02 . 2 . . . . . . . . 5686 1 1650 . 1 1 139 139 GLY C C 13 171.3 0.2 . 1 . . . . . . . . 5686 1 1651 . 1 1 139 139 GLY CA C 13 45.31 0.1 . 1 . . . . . . . . 5686 1 1652 . 1 1 139 139 GLY N N 15 102.7 0.2 . 1 . . . . . . . . 5686 1 1653 . 1 1 140 140 ARG H H 1 7.882 0.02 . 1 . . . . . . . . 5686 1 1654 . 1 1 140 140 ARG HA H 1 4.619 0.02 . 1 . . . . . . . . 5686 1 1655 . 1 1 140 140 ARG HB2 H 1 1.9 0.02 . 1 . . . . . . . . 5686 1 1656 . 1 1 140 140 ARG HB3 H 1 1.9 0.02 . 1 . . . . . . . . 5686 1 1657 . 1 1 140 140 ARG HG2 H 1 1.642 0.02 . 1 . . . . . . . . 5686 1 1658 . 1 1 140 140 ARG HG3 H 1 1.642 0.02 . 1 . . . . . . . . 5686 1 1659 . 1 1 140 140 ARG HD2 H 1 3.202 0.02 . 1 . . . . . . . . 5686 1 1660 . 1 1 140 140 ARG HD3 H 1 3.202 0.02 . 1 . . . . . . . . 5686 1 1661 . 1 1 140 140 ARG C C 13 172.5 0.2 . 1 . . . . . . . . 5686 1 1662 . 1 1 140 140 ARG CA C 13 54.17 0.1 . 1 . . . . . . . . 5686 1 1663 . 1 1 140 140 ARG CB C 13 31.87 0.1 . 1 . . . . . . . . 5686 1 1664 . 1 1 140 140 ARG CG C 13 26.53 0.1 . 1 . . . . . . . . 5686 1 1665 . 1 1 140 140 ARG CD C 13 43.2 0.1 . 1 . . . . . . . . 5686 1 1666 . 1 1 140 140 ARG N N 15 121.9 0.2 . 1 . . . . . . . . 5686 1 1667 . 1 1 141 141 GLU H H 1 8.734 0.02 . 1 . . . . . . . . 5686 1 1668 . 1 1 141 141 GLU HA H 1 4.883 0.02 . 1 . . . . . . . . 5686 1 1669 . 1 1 141 141 GLU HB2 H 1 1.909 0.02 . 1 . . . . . . . . 5686 1 1670 . 1 1 141 141 GLU HB3 H 1 1.909 0.02 . 1 . . . . . . . . 5686 1 1671 . 1 1 141 141 GLU HG2 H 1 2.285 0.02 . 2 . . . . . . . . 5686 1 1672 . 1 1 141 141 GLU HG3 H 1 2.088 0.02 . 2 . . . . . . . . 5686 1 1673 . 1 1 141 141 GLU C C 13 174.5 0.2 . 1 . . . . . . . . 5686 1 1674 . 1 1 141 141 GLU CA C 13 56.48 0.1 . 1 . . . . . . . . 5686 1 1675 . 1 1 141 141 GLU CB C 13 30.5 0.1 . 1 . . . . . . . . 5686 1 1676 . 1 1 141 141 GLU CG C 13 36.72 0.1 . 1 . . . . . . . . 5686 1 1677 . 1 1 141 141 GLU N N 15 124.7 0.2 . 1 . . . . . . . . 5686 1 1678 . 1 1 142 142 VAL H H 1 8.563 0.02 . 1 . . . . . . . . 5686 1 1679 . 1 1 142 142 VAL HA H 1 4.288 0.02 . 1 . . . . . . . . 5686 1 1680 . 1 1 142 142 VAL HB H 1 1.864 0.02 . 1 . . . . . . . . 5686 1 1681 . 1 1 142 142 VAL HG11 H 1 0.8933 0.02 . 1 . . . . . . . . 5686 1 1682 . 1 1 142 142 VAL HG12 H 1 0.8933 0.02 . 1 . . . . . . . . 5686 1 1683 . 1 1 142 142 VAL HG13 H 1 0.8933 0.02 . 1 . . . . . . . . 5686 1 1684 . 1 1 142 142 VAL HG21 H 1 0.8933 0.02 . 1 . . . . . . . . 5686 1 1685 . 1 1 142 142 VAL HG22 H 1 0.8933 0.02 . 1 . . . . . . . . 5686 1 1686 . 1 1 142 142 VAL HG23 H 1 0.8933 0.02 . 1 . . . . . . . . 5686 1 1687 . 1 1 142 142 VAL C C 13 173.4 0.2 . 1 . . . . . . . . 5686 1 1688 . 1 1 142 142 VAL CA C 13 60.65 0.1 . 1 . . . . . . . . 5686 1 1689 . 1 1 142 142 VAL CB C 13 33.75 0.1 . 1 . . . . . . . . 5686 1 1690 . 1 1 142 142 VAL CG1 C 13 20.97 0.1 . 1 . . . . . . . . 5686 1 1691 . 1 1 142 142 VAL CG2 C 13 20.97 0.1 . 1 . . . . . . . . 5686 1 1692 . 1 1 142 142 VAL N N 15 124.2 0.2 . 1 . . . . . . . . 5686 1 1693 . 1 1 143 143 GLU H H 1 8.868 0.02 . 1 . . . . . . . . 5686 1 1694 . 1 1 143 143 GLU HA H 1 4.453 0.02 . 1 . . . . . . . . 5686 1 1695 . 1 1 143 143 GLU HB2 H 1 2.009 0.02 . 2 . . . . . . . . 5686 1 1696 . 1 1 143 143 GLU HB3 H 1 1.9 0.02 . 2 . . . . . . . . 5686 1 1697 . 1 1 143 143 GLU HG2 H 1 2.185 0.02 . 2 . . . . . . . . 5686 1 1698 . 1 1 143 143 GLU HG3 H 1 2.024 0.02 . 2 . . . . . . . . 5686 1 1699 . 1 1 143 143 GLU C C 13 172.7 0.2 . 1 . . . . . . . . 5686 1 1700 . 1 1 143 143 GLU CA C 13 56.1 0.1 . 1 . . . . . . . . 5686 1 1701 . 1 1 143 143 GLU CB C 13 29.38 0.1 . 1 . . . . . . . . 5686 1 1702 . 1 1 143 143 GLU CG C 13 36.32 0.1 . 1 . . . . . . . . 5686 1 1703 . 1 1 143 143 GLU N N 15 128.3 0.2 . 1 . . . . . . . . 5686 1 1704 . 1 1 144 144 VAL H H 1 7.827 0.02 . 1 . . . . . . . . 5686 1 1705 . 1 1 144 144 VAL HA H 1 4.076 0.02 . 1 . . . . . . . . 5686 1 1706 . 1 1 144 144 VAL HB H 1 1.93 0.02 . 1 . . . . . . . . 5686 1 1707 . 1 1 144 144 VAL HG11 H 1 0.7475 0.02 . 1 . . . . . . . . 5686 1 1708 . 1 1 144 144 VAL HG12 H 1 0.7475 0.02 . 1 . . . . . . . . 5686 1 1709 . 1 1 144 144 VAL HG13 H 1 0.7475 0.02 . 1 . . . . . . . . 5686 1 1710 . 1 1 144 144 VAL HG21 H 1 0.7475 0.02 . 1 . . . . . . . . 5686 1 1711 . 1 1 144 144 VAL HG22 H 1 0.7475 0.02 . 1 . . . . . . . . 5686 1 1712 . 1 1 144 144 VAL HG23 H 1 0.7475 0.02 . 1 . . . . . . . . 5686 1 1713 . 1 1 144 144 VAL C C 13 171.2 0.2 . 1 . . . . . . . . 5686 1 1714 . 1 1 144 144 VAL CA C 13 62.19 0.1 . 1 . . . . . . . . 5686 1 1715 . 1 1 144 144 VAL CB C 13 33.67 0.1 . 1 . . . . . . . . 5686 1 1716 . 1 1 144 144 VAL CG1 C 13 21.3 0.1 . 1 . . . . . . . . 5686 1 1717 . 1 1 144 144 VAL CG2 C 13 21.3 0.1 . 1 . . . . . . . . 5686 1 1718 . 1 1 144 144 VAL N N 15 126.6 0.2 . 1 . . . . . . . . 5686 1 1719 . 1 1 145 145 LYS H H 1 8.176 0.02 . 1 . . . . . . . . 5686 1 1720 . 1 1 145 145 LYS HA H 1 4.596 0.02 . 1 . . . . . . . . 5686 1 1721 . 1 1 145 145 LYS HB2 H 1 1.769 0.02 . 2 . . . . . . . . 5686 1 1722 . 1 1 145 145 LYS HB3 H 1 1.62 0.02 . 2 . . . . . . . . 5686 1 1723 . 1 1 145 145 LYS HG2 H 1 1.323 0.02 . 2 . . . . . . . . 5686 1 1724 . 1 1 145 145 LYS HG3 H 1 1.163 0.02 . 2 . . . . . . . . 5686 1 1725 . 1 1 145 145 LYS HD2 H 1 1.658 0.02 . 1 . . . . . . . . 5686 1 1726 . 1 1 145 145 LYS HD3 H 1 1.532 0.02 . 1 . . . . . . . . 5686 1 1727 . 1 1 145 145 LYS HE2 H 1 2.881 0.02 . 1 . . . . . . . . 5686 1 1728 . 1 1 145 145 LYS HE3 H 1 2.881 0.02 . 1 . . . . . . . . 5686 1 1729 . 1 1 145 145 LYS C C 13 175.3 0.2 . 1 . . . . . . . . 5686 1 1730 . 1 1 145 145 LYS CA C 13 53.9 0.1 . 1 . . . . . . . . 5686 1 1731 . 1 1 145 145 LYS CB C 13 36.14 0.1 . 1 . . . . . . . . 5686 1 1732 . 1 1 145 145 LYS CG C 13 24.42 0.1 . 1 . . . . . . . . 5686 1 1733 . 1 1 145 145 LYS CD C 13 28.12 0.1 . 1 . . . . . . . . 5686 1 1734 . 1 1 145 145 LYS N N 15 123.6 0.2 . 1 . . . . . . . . 5686 1 1735 . 1 1 146 146 GLY H H 1 8.831 0.02 . 1 . . . . . . . . 5686 1 1736 . 1 1 146 146 GLY HA2 H 1 3.966 0.02 . 1 . . . . . . . . 5686 1 1737 . 1 1 146 146 GLY HA3 H 1 3.966 0.02 . 1 . . . . . . . . 5686 1 1738 . 1 1 146 146 GLY C C 13 173.8 0.2 . 1 . . . . . . . . 5686 1 1739 . 1 1 146 146 GLY CA C 13 45.14 0.1 . 1 . . . . . . . . 5686 1 1740 . 1 1 146 146 GLY N N 15 108.4 0.2 . 1 . . . . . . . . 5686 1 1741 . 1 1 147 147 LYS H H 1 8.148 0.02 . 1 . . . . . . . . 5686 1 1742 . 1 1 147 147 LYS HA H 1 4.701 0.02 . 1 . . . . . . . . 5686 1 1743 . 1 1 147 147 LYS N N 15 115.1 0.2 . 1 . . . . . . . . 5686 1 1744 . 1 1 148 148 PRO HA H 1 3.944 0.02 . 1 . . . . . . . . 5686 1 1745 . 1 1 148 148 PRO HB2 H 1 2.381 0.02 . 2 . . . . . . . . 5686 1 1746 . 1 1 148 148 PRO HB3 H 1 2.244 0.02 . 2 . . . . . . . . 5686 1 1747 . 1 1 148 148 PRO HG2 H 1 2.003 0.02 . 2 . . . . . . . . 5686 1 1748 . 1 1 148 148 PRO HG3 H 1 1.542 0.02 . 2 . . . . . . . . 5686 1 1749 . 1 1 148 148 PRO HD2 H 1 3.754 0.02 . 1 . . . . . . . . 5686 1 1750 . 1 1 148 148 PRO HD3 H 1 3.754 0.02 . 1 . . . . . . . . 5686 1 1751 . 1 1 148 148 PRO C C 13 175 0.2 . 1 . . . . . . . . 5686 1 1752 . 1 1 148 148 PRO CA C 13 66.63 0.1 . 1 . . . . . . . . 5686 1 1753 . 1 1 148 148 PRO CB C 13 30.65 0.1 . 1 . . . . . . . . 5686 1 1754 . 1 1 148 148 PRO CG C 13 27.78 0.1 . 1 . . . . . . . . 5686 1 1755 . 1 1 148 148 PRO CD C 13 50.13 0.1 . 1 . . . . . . . . 5686 1 1756 . 1 1 149 149 PHE H H 1 6.861 0.02 . 1 . . . . . . . . 5686 1 1757 . 1 1 149 149 PHE HA H 1 3.633 0.02 . 1 . . . . . . . . 5686 1 1758 . 1 1 149 149 PHE HB2 H 1 3.422 0.02 . 2 . . . . . . . . 5686 1 1759 . 1 1 149 149 PHE HB3 H 1 2.885 0.02 . 2 . . . . . . . . 5686 1 1760 . 1 1 149 149 PHE HD1 H 1 7.073 0.02 . 1 . . . . . . . . 5686 1 1761 . 1 1 149 149 PHE HD2 H 1 7.073 0.02 . 1 . . . . . . . . 5686 1 1762 . 1 1 149 149 PHE C C 13 175.6 0.2 . 1 . . . . . . . . 5686 1 1763 . 1 1 149 149 PHE CA C 13 61.68 0.1 . 1 . . . . . . . . 5686 1 1764 . 1 1 149 149 PHE CB C 13 38.07 0.1 . 1 . . . . . . . . 5686 1 1765 . 1 1 149 149 PHE N N 15 116.4 0.2 . 1 . . . . . . . . 5686 1 1766 . 1 1 150 150 GLU H H 1 8.004 0.02 . 1 . . . . . . . . 5686 1 1767 . 1 1 150 150 GLU HA H 1 3.819 0.02 . 1 . . . . . . . . 5686 1 1768 . 1 1 150 150 GLU HB2 H 1 2.009 0.02 . 1 . . . . . . . . 5686 1 1769 . 1 1 150 150 GLU HB3 H 1 2.009 0.02 . 1 . . . . . . . . 5686 1 1770 . 1 1 150 150 GLU HG2 H 1 2.378 0.02 . 2 . . . . . . . . 5686 1 1771 . 1 1 150 150 GLU HG3 H 1 2.188 0.02 . 2 . . . . . . . . 5686 1 1772 . 1 1 150 150 GLU C C 13 177.6 0.2 . 1 . . . . . . . . 5686 1 1773 . 1 1 150 150 GLU CA C 13 59.81 0.1 . 1 . . . . . . . . 5686 1 1774 . 1 1 150 150 GLU CB C 13 30.05 0.1 . 1 . . . . . . . . 5686 1 1775 . 1 1 150 150 GLU CG C 13 36.82 0.1 . 1 . . . . . . . . 5686 1 1776 . 1 1 150 150 GLU N N 15 121.6 0.2 . 1 . . . . . . . . 5686 1 1777 . 1 1 151 151 VAL H H 1 8.55 0.02 . 1 . . . . . . . . 5686 1 1778 . 1 1 151 151 VAL HA H 1 3.352 0.02 . 1 . . . . . . . . 5686 1 1779 . 1 1 151 151 VAL HB H 1 2.074 0.02 . 1 . . . . . . . . 5686 1 1780 . 1 1 151 151 VAL HG11 H 1 0.9808 0.02 . 2 . . . . . . . . 5686 1 1781 . 1 1 151 151 VAL HG12 H 1 0.9808 0.02 . 2 . . . . . . . . 5686 1 1782 . 1 1 151 151 VAL HG13 H 1 0.9808 0.02 . 2 . . . . . . . . 5686 1 1783 . 1 1 151 151 VAL HG21 H 1 0.6963 0.02 . 2 . . . . . . . . 5686 1 1784 . 1 1 151 151 VAL HG22 H 1 0.6963 0.02 . 2 . . . . . . . . 5686 1 1785 . 1 1 151 151 VAL HG23 H 1 0.6963 0.02 . 2 . . . . . . . . 5686 1 1786 . 1 1 151 151 VAL C C 13 174.2 0.2 . 1 . . . . . . . . 5686 1 1787 . 1 1 151 151 VAL CA C 13 66.39 0.1 . 1 . . . . . . . . 5686 1 1788 . 1 1 151 151 VAL CB C 13 31.37 0.1 . 1 . . . . . . . . 5686 1 1789 . 1 1 151 151 VAL CG1 C 13 23.68 0.1 . 2 . . . . . . . . 5686 1 1790 . 1 1 151 151 VAL CG2 C 13 21.16 0.1 . 2 . . . . . . . . 5686 1 1791 . 1 1 151 151 VAL N N 15 120.8 0.2 . 1 . . . . . . . . 5686 1 1792 . 1 1 152 152 LEU H H 1 7.861 0.02 . 1 . . . . . . . . 5686 1 1793 . 1 1 152 152 LEU HA H 1 3.709 0.02 . 1 . . . . . . . . 5686 1 1794 . 1 1 152 152 LEU HB2 H 1 1.683 0.02 . 2 . . . . . . . . 5686 1 1795 . 1 1 152 152 LEU HB3 H 1 1.437 0.02 . 2 . . . . . . . . 5686 1 1796 . 1 1 152 152 LEU HG H 1 1.404 0.02 . 1 . . . . . . . . 5686 1 1797 . 1 1 152 152 LEU HD11 H 1 0.9132 0.02 . 2 . . . . . . . . 5686 1 1798 . 1 1 152 152 LEU HD12 H 1 0.9132 0.02 . 2 . . . . . . . . 5686 1 1799 . 1 1 152 152 LEU HD13 H 1 0.9132 0.02 . 2 . . . . . . . . 5686 1 1800 . 1 1 152 152 LEU HD21 H 1 0.755 0.02 . 2 . . . . . . . . 5686 1 1801 . 1 1 152 152 LEU HD22 H 1 0.755 0.02 . 2 . . . . . . . . 5686 1 1802 . 1 1 152 152 LEU HD23 H 1 0.755 0.02 . 2 . . . . . . . . 5686 1 1803 . 1 1 152 152 LEU C C 13 175.6 0.2 . 1 . . . . . . . . 5686 1 1804 . 1 1 152 152 LEU CA C 13 58.03 0.1 . 1 . . . . . . . . 5686 1 1805 . 1 1 152 152 LEU CB C 13 41.15 0.1 . 1 . . . . . . . . 5686 1 1806 . 1 1 152 152 LEU CG C 13 26.71 0.1 . 1 . . . . . . . . 5686 1 1807 . 1 1 152 152 LEU CD1 C 13 23.48 0.1 . 2 . . . . . . . . 5686 1 1808 . 1 1 152 152 LEU N N 15 120 0.2 . 1 . . . . . . . . 5686 1 1809 . 1 1 153 153 THR H H 1 8.014 0.02 . 1 . . . . . . . . 5686 1 1810 . 1 1 153 153 THR HA H 1 3.182 0.02 . 1 . . . . . . . . 5686 1 1811 . 1 1 153 153 THR HB H 1 3.817 0.02 . 1 . . . . . . . . 5686 1 1812 . 1 1 153 153 THR HG21 H 1 0.8547 0.02 . 1 . . . . . . . . 5686 1 1813 . 1 1 153 153 THR HG22 H 1 0.8547 0.02 . 1 . . . . . . . . 5686 1 1814 . 1 1 153 153 THR HG23 H 1 0.8547 0.02 . 1 . . . . . . . . 5686 1 1815 . 1 1 153 153 THR C C 13 173.1 0.2 . 1 . . . . . . . . 5686 1 1816 . 1 1 153 153 THR CA C 13 67.5 0.1 . 1 . . . . . . . . 5686 1 1817 . 1 1 153 153 THR CB C 13 67.72 0.1 . 1 . . . . . . . . 5686 1 1818 . 1 1 153 153 THR CG2 C 13 21.27 0.1 . 1 . . . . . . . . 5686 1 1819 . 1 1 153 153 THR N N 15 113.5 0.2 . 1 . . . . . . . . 5686 1 1820 . 1 1 154 154 HIS H H 1 7.987 0.02 . 1 . . . . . . . . 5686 1 1821 . 1 1 154 154 HIS HA H 1 3.974 0.02 . 1 . . . . . . . . 5686 1 1822 . 1 1 154 154 HIS HB2 H 1 3.079 0.02 . 2 . . . . . . . . 5686 1 1823 . 1 1 154 154 HIS HB3 H 1 3.003 0.02 . 2 . . . . . . . . 5686 1 1824 . 1 1 154 154 HIS C C 13 176.7 0.2 . 1 . . . . . . . . 5686 1 1825 . 1 1 154 154 HIS CA C 13 60.52 0.1 . 1 . . . . . . . . 5686 1 1826 . 1 1 154 154 HIS CB C 13 31.07 0.1 . 1 . . . . . . . . 5686 1 1827 . 1 1 154 154 HIS N N 15 121.3 0.2 . 1 . . . . . . . . 5686 1 1828 . 1 1 155 155 LEU H H 1 8.333 0.02 . 1 . . . . . . . . 5686 1 1829 . 1 1 155 155 LEU HA H 1 4.024 0.02 . 1 . . . . . . . . 5686 1 1830 . 1 1 155 155 LEU HB2 H 1 2.034 0.02 . 2 . . . . . . . . 5686 1 1831 . 1 1 155 155 LEU HB3 H 1 1.58 0.02 . 2 . . . . . . . . 5686 1 1832 . 1 1 155 155 LEU HG H 1 0.7064 0.02 . 1 . . . . . . . . 5686 1 1833 . 1 1 155 155 LEU HD11 H 1 0.933 0.02 . 2 . . . . . . . . 5686 1 1834 . 1 1 155 155 LEU HD12 H 1 0.933 0.02 . 2 . . . . . . . . 5686 1 1835 . 1 1 155 155 LEU HD13 H 1 0.933 0.02 . 2 . . . . . . . . 5686 1 1836 . 1 1 155 155 LEU HD21 H 1 0.7175 0.02 . 2 . . . . . . . . 5686 1 1837 . 1 1 155 155 LEU HD22 H 1 0.7175 0.02 . 2 . . . . . . . . 5686 1 1838 . 1 1 155 155 LEU HD23 H 1 0.7175 0.02 . 2 . . . . . . . . 5686 1 1839 . 1 1 155 155 LEU C C 13 176.9 0.2 . 1 . . . . . . . . 5686 1 1840 . 1 1 155 155 LEU CA C 13 58.1 0.1 . 1 . . . . . . . . 5686 1 1841 . 1 1 155 155 LEU CB C 13 41.14 0.1 . 1 . . . . . . . . 5686 1 1842 . 1 1 155 155 LEU CG C 13 27.27 0.1 . 1 . . . . . . . . 5686 1 1843 . 1 1 155 155 LEU N N 15 117.2 0.2 . 1 . . . . . . . . 5686 1 1844 . 1 1 156 156 ALA H H 1 8.428 0.02 . 1 . . . . . . . . 5686 1 1845 . 1 1 156 156 ALA HA H 1 2.936 0.02 . 1 . . . . . . . . 5686 1 1846 . 1 1 156 156 ALA HB1 H 1 0.5776 0.02 . 1 . . . . . . . . 5686 1 1847 . 1 1 156 156 ALA HB2 H 1 0.5776 0.02 . 1 . . . . . . . . 5686 1 1848 . 1 1 156 156 ALA HB3 H 1 0.5776 0.02 . 1 . . . . . . . . 5686 1 1849 . 1 1 156 156 ALA C C 13 177.7 0.2 . 1 . . . . . . . . 5686 1 1850 . 1 1 156 156 ALA CA C 13 54.73 0.1 . 1 . . . . . . . . 5686 1 1851 . 1 1 156 156 ALA CB C 13 17.06 0.1 . 1 . . . . . . . . 5686 1 1852 . 1 1 156 156 ALA N N 15 121.3 0.2 . 1 . . . . . . . . 5686 1 1853 . 1 1 157 157 ARG H H 1 8.097 0.02 . 1 . . . . . . . . 5686 1 1854 . 1 1 157 157 ARG HA H 1 3.763 0.02 . 1 . . . . . . . . 5686 1 1855 . 1 1 157 157 ARG HB2 H 1 1.592 0.02 . 2 . . . . . . . . 5686 1 1856 . 1 1 157 157 ARG HB3 H 1 1.402 0.02 . 2 . . . . . . . . 5686 1 1857 . 1 1 157 157 ARG HG2 H 1 1.637 0.02 . 2 . . . . . . . . 5686 1 1858 . 1 1 157 157 ARG HG3 H 1 1.302 0.02 . 2 . . . . . . . . 5686 1 1859 . 1 1 157 157 ARG HD2 H 1 2.96 0.02 . 1 . . . . . . . . 5686 1 1860 . 1 1 157 157 ARG HD3 H 1 2.96 0.02 . 1 . . . . . . . . 5686 1 1861 . 1 1 157 157 ARG C C 13 174.3 0.2 . 1 . . . . . . . . 5686 1 1862 . 1 1 157 157 ARG CA C 13 58.21 0.1 . 1 . . . . . . . . 5686 1 1863 . 1 1 157 157 ARG CB C 13 29.79 0.1 . 1 . . . . . . . . 5686 1 1864 . 1 1 157 157 ARG CG C 13 27.89 0.1 . 1 . . . . . . . . 5686 1 1865 . 1 1 157 157 ARG CD C 13 42.9 0.1 . 1 . . . . . . . . 5686 1 1866 . 1 1 157 157 ARG N N 15 117.4 0.2 . 1 . . . . . . . . 5686 1 1867 . 1 1 158 158 HIS H H 1 7.304 0.02 . 1 . . . . . . . . 5686 1 1868 . 1 1 158 158 HIS HA H 1 4.643 0.02 . 1 . . . . . . . . 5686 1 1869 . 1 1 158 158 HIS HB2 H 1 3.226 0.02 . 2 . . . . . . . . 5686 1 1870 . 1 1 158 158 HIS HB3 H 1 2.541 0.02 . 2 . . . . . . . . 5686 1 1871 . 1 1 158 158 HIS C C 13 173.1 0.2 . 1 . . . . . . . . 5686 1 1872 . 1 1 158 158 HIS CA C 13 54.56 0.1 . 1 . . . . . . . . 5686 1 1873 . 1 1 158 158 HIS CB C 13 27.63 0.1 . 1 . . . . . . . . 5686 1 1874 . 1 1 158 158 HIS N N 15 118.3 0.2 . 1 . . . . . . . . 5686 1 1875 . 1 1 159 159 ARG H H 1 6.709 0.02 . 1 . . . . . . . . 5686 1 1876 . 1 1 159 159 ARG HA H 1 4.462 0.02 . 1 . . . . . . . . 5686 1 1877 . 1 1 159 159 ARG HB2 H 1 2.226 0.02 . 2 . . . . . . . . 5686 1 1878 . 1 1 159 159 ARG HB3 H 1 1.967 0.02 . 2 . . . . . . . . 5686 1 1879 . 1 1 159 159 ARG HG2 H 1 1.618 0.02 . 1 . . . . . . . . 5686 1 1880 . 1 1 159 159 ARG HG3 H 1 1.618 0.02 . 1 . . . . . . . . 5686 1 1881 . 1 1 159 159 ARG HD2 H 1 3.321 0.02 . 2 . . . . . . . . 5686 1 1882 . 1 1 159 159 ARG HD3 H 1 3.158 0.02 . 2 . . . . . . . . 5686 1 1883 . 1 1 159 159 ARG C C 13 173.1 0.2 . 1 . . . . . . . . 5686 1 1884 . 1 1 159 159 ARG CA C 13 58.33 0.1 . 1 . . . . . . . . 5686 1 1885 . 1 1 159 159 ARG CB C 13 29.63 0.1 . 1 . . . . . . . . 5686 1 1886 . 1 1 159 159 ARG CG C 13 26.34 0.1 . 1 . . . . . . . . 5686 1 1887 . 1 1 159 159 ARG CD C 13 43.59 0.1 . 1 . . . . . . . . 5686 1 1888 . 1 1 159 159 ARG N N 15 117.2 0.2 . 1 . . . . . . . . 5686 1 1889 . 1 1 160 160 ASP H H 1 8.842 0.02 . 1 . . . . . . . . 5686 1 1890 . 1 1 160 160 ASP HA H 1 4.468 0.02 . 1 . . . . . . . . 5686 1 1891 . 1 1 160 160 ASP HB2 H 1 2.865 0.02 . 2 . . . . . . . . 5686 1 1892 . 1 1 160 160 ASP HB3 H 1 2.781 0.02 . 2 . . . . . . . . 5686 1 1893 . 1 1 160 160 ASP C C 13 172 0.2 . 1 . . . . . . . . 5686 1 1894 . 1 1 160 160 ASP CA C 13 54.91 0.1 . 1 . . . . . . . . 5686 1 1895 . 1 1 160 160 ASP CB C 13 39.92 0.1 . 1 . . . . . . . . 5686 1 1896 . 1 1 160 160 ASP N N 15 117.4 0.2 . 1 . . . . . . . . 5686 1 1897 . 1 1 161 161 GLN H H 1 8.314 0.02 . 1 . . . . . . . . 5686 1 1898 . 1 1 161 161 GLN HA H 1 4.659 0.02 . 1 . . . . . . . . 5686 1 1899 . 1 1 161 161 GLN HB2 H 1 2.038 0.02 . 2 . . . . . . . . 5686 1 1900 . 1 1 161 161 GLN HB3 H 1 1.996 0.02 . 2 . . . . . . . . 5686 1 1901 . 1 1 161 161 GLN HG2 H 1 2.301 0.02 . 2 . . . . . . . . 5686 1 1902 . 1 1 161 161 GLN HG3 H 1 2.232 0.02 . 2 . . . . . . . . 5686 1 1903 . 1 1 161 161 GLN C C 13 172 0.2 . 1 . . . . . . . . 5686 1 1904 . 1 1 161 161 GLN CA C 13 54.06 0.1 . 1 . . . . . . . . 5686 1 1905 . 1 1 161 161 GLN CB C 13 31.62 0.1 . 1 . . . . . . . . 5686 1 1906 . 1 1 161 161 GLN CG C 13 33.1 0.1 . 1 . . . . . . . . 5686 1 1907 . 1 1 161 161 GLN N N 15 119 0.2 . 1 . . . . . . . . 5686 1 1908 . 1 1 162 162 ILE H H 1 8.269 0.02 . 1 . . . . . . . . 5686 1 1909 . 1 1 162 162 ILE HA H 1 4.102 0.02 . 1 . . . . . . . . 5686 1 1910 . 1 1 162 162 ILE HB H 1 1.581 0.02 . 1 . . . . . . . . 5686 1 1911 . 1 1 162 162 ILE HG12 H 1 1.71 0.02 . 2 . . . . . . . . 5686 1 1912 . 1 1 162 162 ILE HG13 H 1 0.6142 0.02 . 2 . . . . . . . . 5686 1 1913 . 1 1 162 162 ILE HG21 H 1 0.4856 0.02 . 1 . . . . . . . . 5686 1 1914 . 1 1 162 162 ILE HG22 H 1 0.4856 0.02 . 1 . . . . . . . . 5686 1 1915 . 1 1 162 162 ILE HG23 H 1 0.4856 0.02 . 1 . . . . . . . . 5686 1 1916 . 1 1 162 162 ILE HD11 H 1 0.7578 0.02 . 1 . . . . . . . . 5686 1 1917 . 1 1 162 162 ILE HD12 H 1 0.7578 0.02 . 1 . . . . . . . . 5686 1 1918 . 1 1 162 162 ILE HD13 H 1 0.7578 0.02 . 1 . . . . . . . . 5686 1 1919 . 1 1 162 162 ILE C C 13 173.7 0.2 . 1 . . . . . . . . 5686 1 1920 . 1 1 162 162 ILE CA C 13 61.26 0.1 . 1 . . . . . . . . 5686 1 1921 . 1 1 162 162 ILE CB C 13 37.93 0.1 . 1 . . . . . . . . 5686 1 1922 . 1 1 162 162 ILE CG1 C 13 28.57 0.1 . 1 . . . . . . . . 5686 1 1923 . 1 1 162 162 ILE CG2 C 13 17.48 0.1 . 1 . . . . . . . . 5686 1 1924 . 1 1 162 162 ILE CD1 C 13 13.77 0.1 . 1 . . . . . . . . 5686 1 1925 . 1 1 162 162 ILE N N 15 120.5 0.2 . 1 . . . . . . . . 5686 1 1926 . 1 1 163 163 VAL H H 1 9.344 0.02 . 1 . . . . . . . . 5686 1 1927 . 1 1 163 163 VAL HA H 1 4.29 0.02 . 1 . . . . . . . . 5686 1 1928 . 1 1 163 163 VAL HB H 1 1.955 0.02 . 1 . . . . . . . . 5686 1 1929 . 1 1 163 163 VAL HG11 H 1 1.061 0.02 . 2 . . . . . . . . 5686 1 1930 . 1 1 163 163 VAL HG12 H 1 1.061 0.02 . 2 . . . . . . . . 5686 1 1931 . 1 1 163 163 VAL HG13 H 1 1.061 0.02 . 2 . . . . . . . . 5686 1 1932 . 1 1 163 163 VAL HG21 H 1 0.95 0.02 . 2 . . . . . . . . 5686 1 1933 . 1 1 163 163 VAL HG22 H 1 0.95 0.02 . 2 . . . . . . . . 5686 1 1934 . 1 1 163 163 VAL HG23 H 1 0.95 0.02 . 2 . . . . . . . . 5686 1 1935 . 1 1 163 163 VAL C C 13 173.4 0.2 . 1 . . . . . . . . 5686 1 1936 . 1 1 163 163 VAL CA C 13 61.43 0.1 . 1 . . . . . . . . 5686 1 1937 . 1 1 163 163 VAL CB C 13 33.13 0.1 . 1 . . . . . . . . 5686 1 1938 . 1 1 163 163 VAL CG1 C 13 21.64 0.1 . 2 . . . . . . . . 5686 1 1939 . 1 1 163 163 VAL N N 15 131.9 0.2 . 1 . . . . . . . . 5686 1 1940 . 1 1 164 164 SER H H 1 8.812 0.02 . 1 . . . . . . . . 5686 1 1941 . 1 1 164 164 SER HA H 1 4.794 0.02 . 1 . . . . . . . . 5686 1 1942 . 1 1 164 164 SER HB2 H 1 4.45 0.02 . 2 . . . . . . . . 5686 1 1943 . 1 1 164 164 SER HB3 H 1 4.085 0.02 . 2 . . . . . . . . 5686 1 1944 . 1 1 164 164 SER C C 13 172.8 0.2 . 1 . . . . . . . . 5686 1 1945 . 1 1 164 164 SER CA C 13 57.47 0.1 . 1 . . . . . . . . 5686 1 1946 . 1 1 164 164 SER CB C 13 65.61 0.1 . 1 . . . . . . . . 5686 1 1947 . 1 1 164 164 SER N N 15 123.4 0.2 . 1 . . . . . . . . 5686 1 1948 . 1 1 165 165 LYS H H 1 9.124 0.02 . 1 . . . . . . . . 5686 1 1949 . 1 1 165 165 LYS HA H 1 3.981 0.02 . 1 . . . . . . . . 5686 1 1950 . 1 1 165 165 LYS HB2 H 1 1.96 0.02 . 2 . . . . . . . . 5686 1 1951 . 1 1 165 165 LYS HB3 H 1 1.787 0.02 . 2 . . . . . . . . 5686 1 1952 . 1 1 165 165 LYS HG2 H 1 1.457 0.02 . 1 . . . . . . . . 5686 1 1953 . 1 1 165 165 LYS HG3 H 1 1.457 0.02 . 1 . . . . . . . . 5686 1 1954 . 1 1 165 165 LYS HD2 H 1 1.693 0.02 . 2 . . . . . . . . 5686 1 1955 . 1 1 165 165 LYS HD3 H 1 1.592 0.02 . 2 . . . . . . . . 5686 1 1956 . 1 1 165 165 LYS HE2 H 1 2.958 0.02 . 1 . . . . . . . . 5686 1 1957 . 1 1 165 165 LYS HE3 H 1 2.958 0.02 . 1 . . . . . . . . 5686 1 1958 . 1 1 165 165 LYS C C 13 175.2 0.2 . 1 . . . . . . . . 5686 1 1959 . 1 1 165 165 LYS CA C 13 60.16 0.1 . 1 . . . . . . . . 5686 1 1960 . 1 1 165 165 LYS CB C 13 32.15 0.1 . 1 . . . . . . . . 5686 1 1961 . 1 1 165 165 LYS CG C 13 25.35 0.1 . 1 . . . . . . . . 5686 1 1962 . 1 1 165 165 LYS CD C 13 29.45 0.1 . 1 . . . . . . . . 5686 1 1963 . 1 1 165 165 LYS CE C 13 43.85 0.1 . 1 . . . . . . . . 5686 1 1964 . 1 1 165 165 LYS N N 15 119.9 0.2 . 1 . . . . . . . . 5686 1 1965 . 1 1 166 166 GLU H H 1 8.793 0.02 . 1 . . . . . . . . 5686 1 1966 . 1 1 166 166 GLU HA H 1 3.795 0.02 . 1 . . . . . . . . 5686 1 1967 . 1 1 166 166 GLU HB2 H 1 2.035 0.02 . 2 . . . . . . . . 5686 1 1968 . 1 1 166 166 GLU HB3 H 1 1.927 0.02 . 2 . . . . . . . . 5686 1 1969 . 1 1 166 166 GLU HG2 H 1 2.487 0.02 . 2 . . . . . . . . 5686 1 1970 . 1 1 166 166 GLU HG3 H 1 2.155 0.02 . 2 . . . . . . . . 5686 1 1971 . 1 1 166 166 GLU C C 13 176.5 0.2 . 1 . . . . . . . . 5686 1 1972 . 1 1 166 166 GLU CA C 13 61.04 0.1 . 1 . . . . . . . . 5686 1 1973 . 1 1 166 166 GLU CB C 13 28.15 0.1 . 1 . . . . . . . . 5686 1 1974 . 1 1 166 166 GLU CG C 13 37.3 0.1 . 1 . . . . . . . . 5686 1 1975 . 1 1 166 166 GLU N N 15 117.3 0.2 . 1 . . . . . . . . 5686 1 1976 . 1 1 167 167 GLN H H 1 7.862 0.02 . 1 . . . . . . . . 5686 1 1977 . 1 1 167 167 GLN HA H 1 4.023 0.02 . 1 . . . . . . . . 5686 1 1978 . 1 1 167 167 GLN HB2 H 1 2.369 0.02 . 2 . . . . . . . . 5686 1 1979 . 1 1 167 167 GLN HB3 H 1 1.935 0.02 . 2 . . . . . . . . 5686 1 1980 . 1 1 167 167 GLN HG2 H 1 2.385 0.02 . 1 . . . . . . . . 5686 1 1981 . 1 1 167 167 GLN HG3 H 1 2.385 0.02 . 1 . . . . . . . . 5686 1 1982 . 1 1 167 167 GLN C C 13 176.3 0.2 . 1 . . . . . . . . 5686 1 1983 . 1 1 167 167 GLN CA C 13 58.41 0.1 . 1 . . . . . . . . 5686 1 1984 . 1 1 167 167 GLN CB C 13 28.67 0.1 . 1 . . . . . . . . 5686 1 1985 . 1 1 167 167 GLN CG C 13 34.45 0.1 . 1 . . . . . . . . 5686 1 1986 . 1 1 167 167 GLN N N 15 119.3 0.2 . 1 . . . . . . . . 5686 1 1987 . 1 1 168 168 LEU H H 1 7.844 0.02 . 1 . . . . . . . . 5686 1 1988 . 1 1 168 168 LEU HA H 1 3.648 0.02 . 1 . . . . . . . . 5686 1 1989 . 1 1 168 168 LEU HB2 H 1 1.993 0.02 . 2 . . . . . . . . 5686 1 1990 . 1 1 168 168 LEU HB3 H 1 1.356 0.02 . 2 . . . . . . . . 5686 1 1991 . 1 1 168 168 LEU HG H 1 1.71 0.02 . 1 . . . . . . . . 5686 1 1992 . 1 1 168 168 LEU HD11 H 1 0.7726 0.02 . 2 . . . . . . . . 5686 1 1993 . 1 1 168 168 LEU HD12 H 1 0.7726 0.02 . 2 . . . . . . . . 5686 1 1994 . 1 1 168 168 LEU HD13 H 1 0.7726 0.02 . 2 . . . . . . . . 5686 1 1995 . 1 1 168 168 LEU HD21 H 1 0.6703 0.02 . 2 . . . . . . . . 5686 1 1996 . 1 1 168 168 LEU HD22 H 1 0.6703 0.02 . 2 . . . . . . . . 5686 1 1997 . 1 1 168 168 LEU HD23 H 1 0.6703 0.02 . 2 . . . . . . . . 5686 1 1998 . 1 1 168 168 LEU C C 13 172.7 0.2 . 1 . . . . . . . . 5686 1 1999 . 1 1 168 168 LEU CA C 13 57.65 0.1 . 1 . . . . . . . . 5686 1 2000 . 1 1 168 168 LEU CB C 13 42.72 0.1 . 1 . . . . . . . . 5686 1 2001 . 1 1 168 168 LEU CG C 13 26.64 0.1 . 1 . . . . . . . . 5686 1 2002 . 1 1 168 168 LEU CD1 C 13 26.12 0.1 . 2 . . . . . . . . 5686 1 2003 . 1 1 168 168 LEU CD2 C 13 24.3 0.1 . 2 . . . . . . . . 5686 1 2004 . 1 1 168 168 LEU N N 15 120.1 0.2 . 1 . . . . . . . . 5686 1 2005 . 1 1 169 169 LEU H H 1 8.301 0.02 . 1 . . . . . . . . 5686 1 2006 . 1 1 169 169 LEU HA H 1 4.243 0.02 . 1 . . . . . . . . 5686 1 2007 . 1 1 169 169 LEU HB2 H 1 1.734 0.02 . 2 . . . . . . . . 5686 1 2008 . 1 1 169 169 LEU HB3 H 1 1.448 0.02 . 2 . . . . . . . . 5686 1 2009 . 1 1 169 169 LEU HG H 1 1.534 0.02 . 1 . . . . . . . . 5686 1 2010 . 1 1 169 169 LEU HD11 H 1 0.5555 0.02 . 2 . . . . . . . . 5686 1 2011 . 1 1 169 169 LEU HD12 H 1 0.5555 0.02 . 2 . . . . . . . . 5686 1 2012 . 1 1 169 169 LEU HD13 H 1 0.5555 0.02 . 2 . . . . . . . . 5686 1 2013 . 1 1 169 169 LEU HD21 H 1 0.3621 0.02 . 2 . . . . . . . . 5686 1 2014 . 1 1 169 169 LEU HD22 H 1 0.3621 0.02 . 2 . . . . . . . . 5686 1 2015 . 1 1 169 169 LEU HD23 H 1 0.3621 0.02 . 2 . . . . . . . . 5686 1 2016 . 1 1 169 169 LEU C C 13 176.7 0.2 . 1 . . . . . . . . 5686 1 2017 . 1 1 169 169 LEU CA C 13 58.2 0.1 . 1 . . . . . . . . 5686 1 2018 . 1 1 169 169 LEU CB C 13 41.89 0.1 . 1 . . . . . . . . 5686 1 2019 . 1 1 169 169 LEU CD1 C 13 24.73 0.1 . 2 . . . . . . . . 5686 1 2020 . 1 1 169 169 LEU CD2 C 13 23.62 0.1 . 2 . . . . . . . . 5686 1 2021 . 1 1 169 169 LEU N N 15 118.8 0.2 . 1 . . . . . . . . 5686 1 2022 . 1 1 170 170 ASP H H 1 7.715 0.02 . 1 . . . . . . . . 5686 1 2023 . 1 1 170 170 ASP HA H 1 4.306 0.02 . 1 . . . . . . . . 5686 1 2024 . 1 1 170 170 ASP HB2 H 1 2.632 0.02 . 2 . . . . . . . . 5686 1 2025 . 1 1 170 170 ASP HB3 H 1 2.509 0.02 . 2 . . . . . . . . 5686 1 2026 . 1 1 170 170 ASP C C 13 175.8 0.2 . 1 . . . . . . . . 5686 1 2027 . 1 1 170 170 ASP CA C 13 56.25 0.1 . 1 . . . . . . . . 5686 1 2028 . 1 1 170 170 ASP CB C 13 41.28 0.1 . 1 . . . . . . . . 5686 1 2029 . 1 1 170 170 ASP N N 15 115.3 0.2 . 1 . . . . . . . . 5686 1 2030 . 1 1 171 171 ALA H H 1 7.652 0.02 . 1 . . . . . . . . 5686 1 2031 . 1 1 171 171 ALA HA H 1 4.166 0.02 . 1 . . . . . . . . 5686 1 2032 . 1 1 171 171 ALA HB1 H 1 1.184 0.02 . 1 . . . . . . . . 5686 1 2033 . 1 1 171 171 ALA HB2 H 1 1.184 0.02 . 1 . . . . . . . . 5686 1 2034 . 1 1 171 171 ALA HB3 H 1 1.184 0.02 . 1 . . . . . . . . 5686 1 2035 . 1 1 171 171 ALA C C 13 177.2 0.2 . 1 . . . . . . . . 5686 1 2036 . 1 1 171 171 ALA CA C 13 53.78 0.1 . 1 . . . . . . . . 5686 1 2037 . 1 1 171 171 ALA CB C 13 18.88 0.1 . 1 . . . . . . . . 5686 1 2038 . 1 1 171 171 ALA N N 15 117.3 0.2 . 1 . . . . . . . . 5686 1 2039 . 1 1 172 172 ILE H H 1 7.62 0.02 . 1 . . . . . . . . 5686 1 2040 . 1 1 172 172 ILE HA H 1 3.938 0.02 . 1 . . . . . . . . 5686 1 2041 . 1 1 172 172 ILE HB H 1 1.876 0.02 . 1 . . . . . . . . 5686 1 2042 . 1 1 172 172 ILE HG12 H 1 1.141 0.02 . 2 . . . . . . . . 5686 1 2043 . 1 1 172 172 ILE HG13 H 1 0.9627 0.02 . 2 . . . . . . . . 5686 1 2044 . 1 1 172 172 ILE HG21 H 1 -0.1235 0.02 . 1 . . . . . . . . 5686 1 2045 . 1 1 172 172 ILE HG22 H 1 -0.1235 0.02 . 1 . . . . . . . . 5686 1 2046 . 1 1 172 172 ILE HG23 H 1 -0.1235 0.02 . 1 . . . . . . . . 5686 1 2047 . 1 1 172 172 ILE HD11 H 1 0.557 0.02 . 1 . . . . . . . . 5686 1 2048 . 1 1 172 172 ILE HD12 H 1 0.557 0.02 . 1 . . . . . . . . 5686 1 2049 . 1 1 172 172 ILE HD13 H 1 0.557 0.02 . 1 . . . . . . . . 5686 1 2050 . 1 1 172 172 ILE C C 13 173.1 0.2 . 1 . . . . . . . . 5686 1 2051 . 1 1 172 172 ILE CA C 13 61.25 0.1 . 1 . . . . . . . . 5686 1 2052 . 1 1 172 172 ILE CB C 13 38.74 0.1 . 1 . . . . . . . . 5686 1 2053 . 1 1 172 172 ILE CG1 C 13 28.01 0.1 . 1 . . . . . . . . 5686 1 2054 . 1 1 172 172 ILE CG2 C 13 17.89 0.1 . 1 . . . . . . . . 5686 1 2055 . 1 1 172 172 ILE CD1 C 13 13.43 0.1 . 1 . . . . . . . . 5686 1 2056 . 1 1 172 172 ILE N N 15 115.2 0.2 . 1 . . . . . . . . 5686 1 2057 . 1 1 173 173 TRP H H 1 8.313 0.02 . 1 . . . . . . . . 5686 1 2058 . 1 1 173 173 TRP HA H 1 4.377 0.02 . 1 . . . . . . . . 5686 1 2059 . 1 1 173 173 TRP HB2 H 1 3.267 0.02 . 2 . . . . . . . . 5686 1 2060 . 1 1 173 173 TRP HB3 H 1 2.984 0.02 . 2 . . . . . . . . 5686 1 2061 . 1 1 173 173 TRP HD1 H 1 7.286 0.02 . 1 . . . . . . . . 5686 1 2062 . 1 1 173 173 TRP HE1 H 1 10.33 0.02 . 1 . . . . . . . . 5686 1 2063 . 1 1 173 173 TRP HZ3 H 1 6.527 0.02 . 1 . . . . . . . . 5686 1 2064 . 1 1 173 173 TRP C C 13 173.4 0.2 . 1 . . . . . . . . 5686 1 2065 . 1 1 173 173 TRP CA C 13 60.6 0.1 . 1 . . . . . . . . 5686 1 2066 . 1 1 173 173 TRP CB C 13 30 0.1 . 1 . . . . . . . . 5686 1 2067 . 1 1 173 173 TRP N N 15 123.6 0.2 . 1 . . . . . . . . 5686 1 2068 . 1 1 173 173 TRP NE1 N 15 128.5 0.02 . 1 . . . . . . . . 5686 1 2069 . 1 1 174 174 GLU H H 1 8.606 0.02 . 1 . . . . . . . . 5686 1 2070 . 1 1 174 174 GLU HA H 1 4.131 0.02 . 1 . . . . . . . . 5686 1 2071 . 1 1 174 174 GLU HB2 H 1 2.033 0.02 . 1 . . . . . . . . 5686 1 2072 . 1 1 174 174 GLU HB3 H 1 2.033 0.02 . 1 . . . . . . . . 5686 1 2073 . 1 1 174 174 GLU HG2 H 1 2.266 0.02 . 2 . . . . . . . . 5686 1 2074 . 1 1 174 174 GLU HG3 H 1 2.226 0.02 . 2 . . . . . . . . 5686 1 2075 . 1 1 174 174 GLU C C 13 174.5 0.2 . 1 . . . . . . . . 5686 1 2076 . 1 1 174 174 GLU CA C 13 57.82 0.1 . 1 . . . . . . . . 5686 1 2077 . 1 1 174 174 GLU CB C 13 29.57 0.1 . 1 . . . . . . . . 5686 1 2078 . 1 1 174 174 GLU CG C 13 36.38 0.1 . 1 . . . . . . . . 5686 1 2079 . 1 1 174 174 GLU N N 15 121.5 0.2 . 1 . . . . . . . . 5686 1 2080 . 1 1 175 175 GLU H H 1 8.397 0.02 . 1 . . . . . . . . 5686 1 2081 . 1 1 175 175 GLU HA H 1 4.638 0.02 . 1 . . . . . . . . 5686 1 2082 . 1 1 175 175 GLU HB2 H 1 1.994 0.02 . 1 . . . . . . . . 5686 1 2083 . 1 1 175 175 GLU HB3 H 1 1.994 0.02 . 1 . . . . . . . . 5686 1 2084 . 1 1 175 175 GLU HG2 H 1 2.191 0.02 . 1 . . . . . . . . 5686 1 2085 . 1 1 175 175 GLU HG3 H 1 2.191 0.02 . 1 . . . . . . . . 5686 1 2086 . 1 1 175 175 GLU CA C 13 54.33 0.1 . 1 . . . . . . . . 5686 1 2087 . 1 1 175 175 GLU CB C 13 29.53 0.1 . 1 . . . . . . . . 5686 1 2088 . 1 1 175 175 GLU CG C 13 35.81 0.1 . 1 . . . . . . . . 5686 1 2089 . 1 1 175 175 GLU N N 15 118 0.2 . 1 . . . . . . . . 5686 1 2090 . 1 1 176 176 PRO HA H 1 4.082 0.02 . 1 . . . . . . . . 5686 1 2091 . 1 1 176 176 PRO HB2 H 1 2.211 0.02 . 1 . . . . . . . . 5686 1 2092 . 1 1 176 176 PRO HB3 H 1 2.211 0.02 . 1 . . . . . . . . 5686 1 2093 . 1 1 176 176 PRO HG2 H 1 2.019 0.02 . 2 . . . . . . . . 5686 1 2094 . 1 1 176 176 PRO HG3 H 1 1.886 0.02 . 2 . . . . . . . . 5686 1 2095 . 1 1 176 176 PRO HD2 H 1 3.716 0.02 . 1 . . . . . . . . 5686 1 2096 . 1 1 176 176 PRO HD3 H 1 3.716 0.02 . 1 . . . . . . . . 5686 1 2097 . 1 1 176 176 PRO C C 13 175.4 0.2 . 1 . . . . . . . . 5686 1 2098 . 1 1 176 176 PRO CA C 13 64.43 0.1 . 1 . . . . . . . . 5686 1 2099 . 1 1 176 176 PRO CB C 13 31.76 0.1 . 1 . . . . . . . . 5686 1 2100 . 1 1 176 176 PRO CG C 13 27.19 0.1 . 1 . . . . . . . . 5686 1 2101 . 1 1 176 176 PRO CD C 13 50.34 0.1 . 1 . . . . . . . . 5686 1 2102 . 1 1 177 177 GLU H H 1 8.742 0.02 . 1 . . . . . . . . 5686 1 2103 . 1 1 177 177 GLU HA H 1 4.184 0.02 . 1 . . . . . . . . 5686 1 2104 . 1 1 177 177 GLU HB2 H 1 2.028 0.02 . 1 . . . . . . . . 5686 1 2105 . 1 1 177 177 GLU HB3 H 1 2.028 0.02 . 1 . . . . . . . . 5686 1 2106 . 1 1 177 177 GLU HG2 H 1 2.236 0.02 . 1 . . . . . . . . 5686 1 2107 . 1 1 177 177 GLU HG3 H 1 2.236 0.02 . 1 . . . . . . . . 5686 1 2108 . 1 1 177 177 GLU C C 13 175.1 0.2 . 1 . . . . . . . . 5686 1 2109 . 1 1 177 177 GLU CA C 13 57.48 0.1 . 1 . . . . . . . . 5686 1 2110 . 1 1 177 177 GLU CB C 13 28.63 0.1 . 1 . . . . . . . . 5686 1 2111 . 1 1 177 177 GLU CG C 13 36.35 0.1 . 1 . . . . . . . . 5686 1 2112 . 1 1 177 177 GLU N N 15 116.1 0.2 . 1 . . . . . . . . 5686 1 2113 . 1 1 178 178 MET H H 1 7.994 0.02 . 1 . . . . . . . . 5686 1 2114 . 1 1 178 178 MET HA H 1 4.512 0.02 . 1 . . . . . . . . 5686 1 2115 . 1 1 178 178 MET HB2 H 1 2.217 0.02 . 2 . . . . . . . . 5686 1 2116 . 1 1 178 178 MET HB3 H 1 2.081 0.02 . 2 . . . . . . . . 5686 1 2117 . 1 1 178 178 MET HG2 H 1 2.649 0.02 . 2 . . . . . . . . 5686 1 2118 . 1 1 178 178 MET HG3 H 1 2.411 0.02 . 2 . . . . . . . . 5686 1 2119 . 1 1 178 178 MET HE1 H 1 2.026 0.02 . 1 . . . . . . . . 5686 1 2120 . 1 1 178 178 MET HE2 H 1 2.026 0.02 . 1 . . . . . . . . 5686 1 2121 . 1 1 178 178 MET HE3 H 1 2.026 0.02 . 1 . . . . . . . . 5686 1 2122 . 1 1 178 178 MET C C 13 174.1 0.2 . 1 . . . . . . . . 5686 1 2123 . 1 1 178 178 MET CA C 13 54.8 0.1 . 1 . . . . . . . . 5686 1 2124 . 1 1 178 178 MET CB C 13 32.22 0.1 . 1 . . . . . . . . 5686 1 2125 . 1 1 178 178 MET CG C 13 32.07 0.1 . 1 . . . . . . . . 5686 1 2126 . 1 1 178 178 MET CE C 13 16.55 0.1 . 1 . . . . . . . . 5686 1 2127 . 1 1 178 178 MET N N 15 116.8 0.2 . 1 . . . . . . . . 5686 1 2128 . 1 1 179 179 VAL H H 1 7.328 0.02 . 1 . . . . . . . . 5686 1 2129 . 1 1 179 179 VAL HA H 1 4.197 0.02 . 1 . . . . . . . . 5686 1 2130 . 1 1 179 179 VAL HB H 1 1.988 0.02 . 1 . . . . . . . . 5686 1 2131 . 1 1 179 179 VAL HG11 H 1 0.7162 0.02 . 2 . . . . . . . . 5686 1 2132 . 1 1 179 179 VAL HG12 H 1 0.7162 0.02 . 2 . . . . . . . . 5686 1 2133 . 1 1 179 179 VAL HG13 H 1 0.7162 0.02 . 2 . . . . . . . . 5686 1 2134 . 1 1 179 179 VAL HG21 H 1 0.689 0.02 . 2 . . . . . . . . 5686 1 2135 . 1 1 179 179 VAL HG22 H 1 0.689 0.02 . 2 . . . . . . . . 5686 1 2136 . 1 1 179 179 VAL HG23 H 1 0.689 0.02 . 2 . . . . . . . . 5686 1 2137 . 1 1 179 179 VAL C C 13 173.1 0.2 . 1 . . . . . . . . 5686 1 2138 . 1 1 179 179 VAL CA C 13 61.07 0.1 . 1 . . . . . . . . 5686 1 2139 . 1 1 179 179 VAL CB C 13 32.69 0.1 . 1 . . . . . . . . 5686 1 2140 . 1 1 179 179 VAL CG1 C 13 21.08 0.1 . 2 . . . . . . . . 5686 1 2141 . 1 1 179 179 VAL CG2 C 13 19.63 0.1 . 2 . . . . . . . . 5686 1 2142 . 1 1 179 179 VAL N N 15 116.8 0.2 . 1 . . . . . . . . 5686 1 2143 . 1 1 180 180 THR H H 1 7.547 0.02 . 1 . . . . . . . . 5686 1 2144 . 1 1 180 180 THR HA H 1 4.637 0.02 . 1 . . . . . . . . 5686 1 2145 . 1 1 180 180 THR HB H 1 4.314 0.02 . 1 . . . . . . . . 5686 1 2146 . 1 1 180 180 THR HG21 H 1 1.185 0.02 . 1 . . . . . . . . 5686 1 2147 . 1 1 180 180 THR HG22 H 1 1.185 0.02 . 1 . . . . . . . . 5686 1 2148 . 1 1 180 180 THR HG23 H 1 1.185 0.02 . 1 . . . . . . . . 5686 1 2149 . 1 1 180 180 THR CA C 13 59 0.1 . 1 . . . . . . . . 5686 1 2150 . 1 1 180 180 THR CB C 13 68.68 0.1 . 1 . . . . . . . . 5686 1 2151 . 1 1 180 180 THR CG2 C 13 21.24 0.1 . 2 . . . . . . . . 5686 1 2152 . 1 1 180 180 THR N N 15 115.6 0.2 . 1 . . . . . . . . 5686 1 2153 . 1 1 182 182 ASN HA H 1 4.623 0.02 . 1 . . . . . . . . 5686 1 2154 . 1 1 182 182 ASN HB2 H 1 2.815 0.02 . 2 . . . . . . . . 5686 1 2155 . 1 1 182 182 ASN HB3 H 1 2.736 0.02 . 2 . . . . . . . . 5686 1 2156 . 1 1 182 182 ASN C C 13 174 0.2 . 1 . . . . . . . . 5686 1 2157 . 1 1 182 182 ASN CA C 13 54.36 0.1 . 1 . . . . . . . . 5686 1 2158 . 1 1 182 182 ASN CB C 13 37.73 0.1 . 1 . . . . . . . . 5686 1 2159 . 1 1 183 183 VAL H H 1 7.305 0.02 . 1 . . . . . . . . 5686 1 2160 . 1 1 183 183 VAL HA H 1 3.706 0.02 . 1 . . . . . . . . 5686 1 2161 . 1 1 183 183 VAL HB H 1 1.959 0.02 . 1 . . . . . . . . 5686 1 2162 . 1 1 183 183 VAL HG11 H 1 0.73 0.02 . 2 . . . . . . . . 5686 1 2163 . 1 1 183 183 VAL HG12 H 1 0.73 0.02 . 2 . . . . . . . . 5686 1 2164 . 1 1 183 183 VAL HG13 H 1 0.73 0.02 . 2 . . . . . . . . 5686 1 2165 . 1 1 183 183 VAL HG21 H 1 0.0646 0.02 . 2 . . . . . . . . 5686 1 2166 . 1 1 183 183 VAL HG22 H 1 0.0646 0.02 . 2 . . . . . . . . 5686 1 2167 . 1 1 183 183 VAL HG23 H 1 0.0646 0.02 . 2 . . . . . . . . 5686 1 2168 . 1 1 183 183 VAL C C 13 175.8 0.2 . 1 . . . . . . . . 5686 1 2169 . 1 1 183 183 VAL CA C 13 65.27 0.1 . 1 . . . . . . . . 5686 1 2170 . 1 1 183 183 VAL CB C 13 30.72 0.1 . 1 . . . . . . . . 5686 1 2171 . 1 1 183 183 VAL CG1 C 13 20.93 0.1 . 2 . . . . . . . . 5686 1 2172 . 1 1 183 183 VAL CG2 C 13 18.18 0.1 . 2 . . . . . . . . 5686 1 2173 . 1 1 183 183 VAL N N 15 114.5 0.2 . 1 . . . . . . . . 5686 1 2174 . 1 1 184 184 ILE H H 1 7.583 0.02 . 1 . . . . . . . . 5686 1 2175 . 1 1 184 184 ILE HA H 1 3.567 0.02 . 1 . . . . . . . . 5686 1 2176 . 1 1 184 184 ILE HB H 1 1.86 0.02 . 1 . . . . . . . . 5686 1 2177 . 1 1 184 184 ILE HG12 H 1 1.241 0.02 . 2 . . . . . . . . 5686 1 2178 . 1 1 184 184 ILE HG13 H 1 1.032 0.02 . 2 . . . . . . . . 5686 1 2179 . 1 1 184 184 ILE HG21 H 1 0.5661 0.02 . 1 . . . . . . . . 5686 1 2180 . 1 1 184 184 ILE HG22 H 1 0.5661 0.02 . 1 . . . . . . . . 5686 1 2181 . 1 1 184 184 ILE HG23 H 1 0.5661 0.02 . 1 . . . . . . . . 5686 1 2182 . 1 1 184 184 ILE HD11 H 1 0.585 0.02 . 1 . . . . . . . . 5686 1 2183 . 1 1 184 184 ILE HD12 H 1 0.585 0.02 . 1 . . . . . . . . 5686 1 2184 . 1 1 184 184 ILE HD13 H 1 0.585 0.02 . 1 . . . . . . . . 5686 1 2185 . 1 1 184 184 ILE C C 13 174.7 0.2 . 1 . . . . . . . . 5686 1 2186 . 1 1 184 184 ILE CA C 13 62.73 0.1 . 1 . . . . . . . . 5686 1 2187 . 1 1 184 184 ILE CB C 13 35.6 0.1 . 1 . . . . . . . . 5686 1 2188 . 1 1 184 184 ILE CG1 C 13 28.08 0.1 . 1 . . . . . . . . 5686 1 2189 . 1 1 184 184 ILE CG2 C 13 18.48 0.1 . 1 . . . . . . . . 5686 1 2190 . 1 1 184 184 ILE CD1 C 13 13.17 0.1 . 1 . . . . . . . . 5686 1 2191 . 1 1 184 184 ILE N N 15 120.7 0.2 . 1 . . . . . . . . 5686 1 2192 . 1 1 185 185 GLU H H 1 7.657 0.02 . 1 . . . . . . . . 5686 1 2193 . 1 1 185 185 GLU HA H 1 3.734 0.02 . 1 . . . . . . . . 5686 1 2194 . 1 1 185 185 GLU HB2 H 1 2.103 0.02 . 2 . . . . . . . . 5686 1 2195 . 1 1 185 185 GLU HB3 H 1 2.014 0.02 . 2 . . . . . . . . 5686 1 2196 . 1 1 185 185 GLU HG2 H 1 2.333 0.02 . 2 . . . . . . . . 5686 1 2197 . 1 1 185 185 GLU HG3 H 1 2.269 0.02 . 2 . . . . . . . . 5686 1 2198 . 1 1 185 185 GLU C C 13 177.4 0.2 . 1 . . . . . . . . 5686 1 2199 . 1 1 185 185 GLU CA C 13 60.04 0.1 . 1 . . . . . . . . 5686 1 2200 . 1 1 185 185 GLU CB C 13 28.42 0.1 . 1 . . . . . . . . 5686 1 2201 . 1 1 185 185 GLU CG C 13 36.83 0.1 . 1 . . . . . . . . 5686 1 2202 . 1 1 185 185 GLU N N 15 120.4 0.2 . 1 . . . . . . . . 5686 1 2203 . 1 1 186 186 VAL H H 1 7.939 0.02 . 1 . . . . . . . . 5686 1 2204 . 1 1 186 186 VAL HA H 1 3.663 0.02 . 1 . . . . . . . . 5686 1 2205 . 1 1 186 186 VAL HB H 1 2.009 0.02 . 1 . . . . . . . . 5686 1 2206 . 1 1 186 186 VAL HG11 H 1 0.9313 0.02 . 1 . . . . . . . . 5686 1 2207 . 1 1 186 186 VAL HG12 H 1 0.9313 0.02 . 1 . . . . . . . . 5686 1 2208 . 1 1 186 186 VAL HG13 H 1 0.9313 0.02 . 1 . . . . . . . . 5686 1 2209 . 1 1 186 186 VAL HG21 H 1 0.9313 0.02 . 1 . . . . . . . . 5686 1 2210 . 1 1 186 186 VAL HG22 H 1 0.9313 0.02 . 1 . . . . . . . . 5686 1 2211 . 1 1 186 186 VAL HG23 H 1 0.9313 0.02 . 1 . . . . . . . . 5686 1 2212 . 1 1 186 186 VAL C C 13 176.2 0.2 . 1 . . . . . . . . 5686 1 2213 . 1 1 186 186 VAL CA C 13 66.31 0.1 . 1 . . . . . . . . 5686 1 2214 . 1 1 186 186 VAL CB C 13 31.67 0.1 . 1 . . . . . . . . 5686 1 2215 . 1 1 186 186 VAL CG1 C 13 20.73 0.1 . 1 . . . . . . . . 5686 1 2216 . 1 1 186 186 VAL CG2 C 13 20.73 0.1 . 1 . . . . . . . . 5686 1 2217 . 1 1 186 186 VAL N N 15 119.2 0.2 . 1 . . . . . . . . 5686 1 2218 . 1 1 187 187 ALA H H 1 7.617 0.02 . 1 . . . . . . . . 5686 1 2219 . 1 1 187 187 ALA HA H 1 4.176 0.02 . 1 . . . . . . . . 5686 1 2220 . 1 1 187 187 ALA HB1 H 1 1.522 0.02 . 1 . . . . . . . . 5686 1 2221 . 1 1 187 187 ALA HB2 H 1 1.522 0.02 . 1 . . . . . . . . 5686 1 2222 . 1 1 187 187 ALA HB3 H 1 1.522 0.02 . 1 . . . . . . . . 5686 1 2223 . 1 1 187 187 ALA C C 13 177.3 0.2 . 1 . . . . . . . . 5686 1 2224 . 1 1 187 187 ALA CA C 13 55.42 0.1 . 1 . . . . . . . . 5686 1 2225 . 1 1 187 187 ALA CB C 13 17.39 0.1 . 1 . . . . . . . . 5686 1 2226 . 1 1 187 187 ALA N N 15 122.7 0.2 . 1 . . . . . . . . 5686 1 2227 . 1 1 188 188 ILE H H 1 8.524 0.02 . 1 . . . . . . . . 5686 1 2228 . 1 1 188 188 ILE HA H 1 3.599 0.02 . 1 . . . . . . . . 5686 1 2229 . 1 1 188 188 ILE HB H 1 1.869 0.02 . 1 . . . . . . . . 5686 1 2230 . 1 1 188 188 ILE HG12 H 1 0.993 0.02 . 1 . . . . . . . . 5686 1 2231 . 1 1 188 188 ILE HG13 H 1 0.993 0.02 . 1 . . . . . . . . 5686 1 2232 . 1 1 188 188 ILE HG21 H 1 0.665 0.02 . 1 . . . . . . . . 5686 1 2233 . 1 1 188 188 ILE HG22 H 1 0.665 0.02 . 1 . . . . . . . . 5686 1 2234 . 1 1 188 188 ILE HG23 H 1 0.665 0.02 . 1 . . . . . . . . 5686 1 2235 . 1 1 188 188 ILE HD11 H 1 0.0618 0.02 . 1 . . . . . . . . 5686 1 2236 . 1 1 188 188 ILE HD12 H 1 0.0618 0.02 . 1 . . . . . . . . 5686 1 2237 . 1 1 188 188 ILE HD13 H 1 0.0618 0.02 . 1 . . . . . . . . 5686 1 2238 . 1 1 188 188 ILE C C 13 175.9 0.2 . 1 . . . . . . . . 5686 1 2239 . 1 1 188 188 ILE CA C 13 63.13 0.1 . 1 . . . . . . . . 5686 1 2240 . 1 1 188 188 ILE CB C 13 35.55 0.1 . 1 . . . . . . . . 5686 1 2241 . 1 1 188 188 ILE CG1 C 13 27.37 0.1 . 1 . . . . . . . . 5686 1 2242 . 1 1 188 188 ILE CG2 C 13 15.97 0.1 . 1 . . . . . . . . 5686 1 2243 . 1 1 188 188 ILE CD1 C 13 10.66 0.1 . 1 . . . . . . . . 5686 1 2244 . 1 1 188 188 ILE N N 15 117.9 0.2 . 1 . . . . . . . . 5686 1 2245 . 1 1 189 189 ASN H H 1 8.249 0.02 . 1 . . . . . . . . 5686 1 2246 . 1 1 189 189 ASN HA H 1 4.45 0.02 . 1 . . . . . . . . 5686 1 2247 . 1 1 189 189 ASN HB2 H 1 2.917 0.02 . 2 . . . . . . . . 5686 1 2248 . 1 1 189 189 ASN HB3 H 1 2.846 0.02 . 2 . . . . . . . . 5686 1 2249 . 1 1 189 189 ASN C C 13 175.7 0.2 . 1 . . . . . . . . 5686 1 2250 . 1 1 189 189 ASN CA C 13 56.56 0.1 . 1 . . . . . . . . 5686 1 2251 . 1 1 189 189 ASN CB C 13 37.87 0.1 . 1 . . . . . . . . 5686 1 2252 . 1 1 189 189 ASN N N 15 119 0.2 . 1 . . . . . . . . 5686 1 2253 . 1 1 190 190 GLN H H 1 8.044 0.02 . 1 . . . . . . . . 5686 1 2254 . 1 1 190 190 GLN HA H 1 4.094 0.02 . 1 . . . . . . . . 5686 1 2255 . 1 1 190 190 GLN HB2 H 1 2.379 0.02 . 2 . . . . . . . . 5686 1 2256 . 1 1 190 190 GLN HB3 H 1 1.972 0.02 . 2 . . . . . . . . 5686 1 2257 . 1 1 190 190 GLN HG2 H 1 2.542 0.02 . 2 . . . . . . . . 5686 1 2258 . 1 1 190 190 GLN HG3 H 1 2.438 0.02 . 2 . . . . . . . . 5686 1 2259 . 1 1 190 190 GLN C C 13 177.3 0.2 . 1 . . . . . . . . 5686 1 2260 . 1 1 190 190 GLN CA C 13 58.93 0.1 . 1 . . . . . . . . 5686 1 2261 . 1 1 190 190 GLN CB C 13 28.33 0.1 . 1 . . . . . . . . 5686 1 2262 . 1 1 190 190 GLN CG C 13 34.05 0.1 . 1 . . . . . . . . 5686 1 2263 . 1 1 190 190 GLN N N 15 119.4 0.2 . 1 . . . . . . . . 5686 1 2264 . 1 1 191 191 ILE H H 1 7.868 0.02 . 1 . . . . . . . . 5686 1 2265 . 1 1 191 191 ILE HA H 1 3.352 0.02 . 1 . . . . . . . . 5686 1 2266 . 1 1 191 191 ILE HB H 1 2.102 0.02 . 1 . . . . . . . . 5686 1 2267 . 1 1 191 191 ILE HG12 H 1 1.901 0.02 . 2 . . . . . . . . 5686 1 2268 . 1 1 191 191 ILE HG13 H 1 0.7059 0.02 . 2 . . . . . . . . 5686 1 2269 . 1 1 191 191 ILE HG21 H 1 0.8932 0.02 . 1 . . . . . . . . 5686 1 2270 . 1 1 191 191 ILE HG22 H 1 0.8932 0.02 . 1 . . . . . . . . 5686 1 2271 . 1 1 191 191 ILE HG23 H 1 0.8932 0.02 . 1 . . . . . . . . 5686 1 2272 . 1 1 191 191 ILE HD11 H 1 0.8502 0.02 . 1 . . . . . . . . 5686 1 2273 . 1 1 191 191 ILE HD12 H 1 0.8502 0.02 . 1 . . . . . . . . 5686 1 2274 . 1 1 191 191 ILE HD13 H 1 0.8502 0.02 . 1 . . . . . . . . 5686 1 2275 . 1 1 191 191 ILE C C 13 176.1 0.2 . 1 . . . . . . . . 5686 1 2276 . 1 1 191 191 ILE CA C 13 66.39 0.1 . 1 . . . . . . . . 5686 1 2277 . 1 1 191 191 ILE CB C 13 37.88 0.1 . 1 . . . . . . . . 5686 1 2278 . 1 1 191 191 ILE CG1 C 13 29.31 0.1 . 1 . . . . . . . . 5686 1 2279 . 1 1 191 191 ILE CG2 C 13 17.88 0.1 . 1 . . . . . . . . 5686 1 2280 . 1 1 191 191 ILE CD1 C 13 14.01 0.1 . 1 . . . . . . . . 5686 1 2281 . 1 1 191 191 ILE N N 15 120.2 0.2 . 1 . . . . . . . . 5686 1 2282 . 1 1 192 192 ARG H H 1 8.107 0.02 . 1 . . . . . . . . 5686 1 2283 . 1 1 192 192 ARG HA H 1 4.058 0.02 . 1 . . . . . . . . 5686 1 2284 . 1 1 192 192 ARG HB2 H 1 1.939 0.02 . 1 . . . . . . . . 5686 1 2285 . 1 1 192 192 ARG HB3 H 1 1.939 0.02 . 1 . . . . . . . . 5686 1 2286 . 1 1 192 192 ARG HD2 H 1 3.153 0.02 . 1 . . . . . . . . 5686 1 2287 . 1 1 192 192 ARG HD3 H 1 3.153 0.02 . 1 . . . . . . . . 5686 1 2288 . 1 1 192 192 ARG C C 13 175.7 0.2 . 1 . . . . . . . . 5686 1 2289 . 1 1 192 192 ARG CA C 13 59.81 0.1 . 1 . . . . . . . . 5686 1 2290 . 1 1 192 192 ARG CB C 13 29.45 0.1 . 1 . . . . . . . . 5686 1 2291 . 1 1 192 192 ARG CD C 13 43.75 0.1 . 1 . . . . . . . . 5686 1 2292 . 1 1 192 192 ARG N N 15 118.3 0.2 . 1 . . . . . . . . 5686 1 2293 . 1 1 193 193 GLN H H 1 8.265 0.02 . 1 . . . . . . . . 5686 1 2294 . 1 1 193 193 GLN HA H 1 4.034 0.02 . 1 . . . . . . . . 5686 1 2295 . 1 1 193 193 GLN HB2 H 1 2.11 0.02 . 2 . . . . . . . . 5686 1 2296 . 1 1 193 193 GLN HB3 H 1 1.925 0.02 . 2 . . . . . . . . 5686 1 2297 . 1 1 193 193 GLN HG2 H 1 2.444 0.02 . 1 . . . . . . . . 5686 1 2298 . 1 1 193 193 GLN HG3 H 1 2.444 0.02 . 1 . . . . . . . . 5686 1 2299 . 1 1 193 193 GLN C C 13 175.4 0.2 . 1 . . . . . . . . 5686 1 2300 . 1 1 193 193 GLN CA C 13 57.89 0.1 . 1 . . . . . . . . 5686 1 2301 . 1 1 193 193 GLN CB C 13 28.86 0.1 . 1 . . . . . . . . 5686 1 2302 . 1 1 193 193 GLN CG C 13 33.59 0.1 . 1 . . . . . . . . 5686 1 2303 . 1 1 193 193 GLN N N 15 115.5 0.2 . 1 . . . . . . . . 5686 1 2304 . 1 1 194 194 LYS H H 1 7.966 0.02 . 1 . . . . . . . . 5686 1 2305 . 1 1 194 194 LYS HA H 1 4.302 0.02 . 1 . . . . . . . . 5686 1 2306 . 1 1 194 194 LYS HB2 H 1 1.741 0.02 . 2 . . . . . . . . 5686 1 2307 . 1 1 194 194 LYS HB3 H 1 1.732 0.02 . 2 . . . . . . . . 5686 1 2308 . 1 1 194 194 LYS HD2 H 1 1.585 0.02 . 2 . . . . . . . . 5686 1 2309 . 1 1 194 194 LYS HD3 H 1 1.541 0.02 . 2 . . . . . . . . 5686 1 2310 . 1 1 194 194 LYS HE2 H 1 3.071 0.02 . 1 . . . . . . . . 5686 1 2311 . 1 1 194 194 LYS HE3 H 1 3.071 0.02 . 1 . . . . . . . . 5686 1 2312 . 1 1 194 194 LYS C C 13 173.5 0.2 . 1 . . . . . . . . 5686 1 2313 . 1 1 194 194 LYS CA C 13 55.8 0.1 . 1 . . . . . . . . 5686 1 2314 . 1 1 194 194 LYS CB C 13 33.59 0.1 . 1 . . . . . . . . 5686 1 2315 . 1 1 194 194 LYS CG C 13 24.75 0.1 . 1 . . . . . . . . 5686 1 2316 . 1 1 194 194 LYS N N 15 114.3 0.2 . 1 . . . . . . . . 5686 1 2317 . 1 1 195 195 MET H H 1 8.033 0.02 . 1 . . . . . . . . 5686 1 2318 . 1 1 195 195 MET HA H 1 4.449 0.02 . 1 . . . . . . . . 5686 1 2319 . 1 1 195 195 MET HB2 H 1 1.868 0.02 . 2 . . . . . . . . 5686 1 2320 . 1 1 195 195 MET HB3 H 1 1.738 0.02 . 2 . . . . . . . . 5686 1 2321 . 1 1 195 195 MET HG2 H 1 2.161 0.02 . 1 . . . . . . . . 5686 1 2322 . 1 1 195 195 MET HG3 H 1 2.161 0.02 . 1 . . . . . . . . 5686 1 2323 . 1 1 195 195 MET HE1 H 1 1.631 0.02 . 1 . . . . . . . . 5686 1 2324 . 1 1 195 195 MET HE2 H 1 1.631 0.02 . 1 . . . . . . . . 5686 1 2325 . 1 1 195 195 MET HE3 H 1 1.631 0.02 . 1 . . . . . . . . 5686 1 2326 . 1 1 195 195 MET C C 13 172 0.2 . 1 . . . . . . . . 5686 1 2327 . 1 1 195 195 MET CA C 13 56.73 0.1 . 1 . . . . . . . . 5686 1 2328 . 1 1 195 195 MET CB C 13 33.77 0.1 . 1 . . . . . . . . 5686 1 2329 . 1 1 195 195 MET CG C 13 32.02 0.1 . 1 . . . . . . . . 5686 1 2330 . 1 1 195 195 MET CE C 13 17.32 0.1 . 1 . . . . . . . . 5686 1 2331 . 1 1 195 195 MET N N 15 117.1 0.2 . 1 . . . . . . . . 5686 1 2332 . 1 1 196 196 ASP H H 1 8.307 0.02 . 1 . . . . . . . . 5686 1 2333 . 1 1 196 196 ASP HA H 1 4.059 0.02 . 1 . . . . . . . . 5686 1 2334 . 1 1 196 196 ASP HB2 H 1 3.024 0.02 . 2 . . . . . . . . 5686 1 2335 . 1 1 196 196 ASP HB3 H 1 2.781 0.02 . 2 . . . . . . . . 5686 1 2336 . 1 1 196 196 ASP C C 13 176.3 0.2 . 1 . . . . . . . . 5686 1 2337 . 1 1 196 196 ASP CA C 13 58.38 0.1 . 1 . . . . . . . . 5686 1 2338 . 1 1 196 196 ASP CB C 13 39.53 0.1 . 1 . . . . . . . . 5686 1 2339 . 1 1 196 196 ASP N N 15 119.9 0.2 . 1 . . . . . . . . 5686 1 2340 . 1 1 197 197 LYS H H 1 8.517 0.02 . 1 . . . . . . . . 5686 1 2341 . 1 1 197 197 LYS HA H 1 4.255 0.02 . 1 . . . . . . . . 5686 1 2342 . 1 1 197 197 LYS HB2 H 1 1.927 0.02 . 2 . . . . . . . . 5686 1 2343 . 1 1 197 197 LYS HB3 H 1 1.66 0.02 . 2 . . . . . . . . 5686 1 2344 . 1 1 197 197 LYS HG2 H 1 1.474 0.02 . 2 . . . . . . . . 5686 1 2345 . 1 1 197 197 LYS HG3 H 1 1.369 0.02 . 2 . . . . . . . . 5686 1 2346 . 1 1 197 197 LYS CA C 13 60.22 0.1 . 1 . . . . . . . . 5686 1 2347 . 1 1 197 197 LYS CB C 13 29.01 0.1 . 1 . . . . . . . . 5686 1 2348 . 1 1 197 197 LYS N N 15 115.8 0.2 . 1 . . . . . . . . 5686 1 2349 . 1 1 198 198 PRO HA H 1 4.3 0.02 . 1 . . . . . . . . 5686 1 2350 . 1 1 198 198 PRO HB2 H 1 2.247 0.02 . 1 . . . . . . . . 5686 1 2351 . 1 1 198 198 PRO HB3 H 1 2.247 0.02 . 1 . . . . . . . . 5686 1 2352 . 1 1 198 198 PRO HG2 H 1 1.847 0.02 . 2 . . . . . . . . 5686 1 2353 . 1 1 198 198 PRO HG3 H 1 1.651 0.02 . 2 . . . . . . . . 5686 1 2354 . 1 1 198 198 PRO HD2 H 1 3.447 0.02 . 2 . . . . . . . . 5686 1 2355 . 1 1 198 198 PRO HD3 H 1 3.217 0.02 . 2 . . . . . . . . 5686 1 2356 . 1 1 198 198 PRO C C 13 176.4 0.2 . 1 . . . . . . . . 5686 1 2357 . 1 1 198 198 PRO CA C 13 65.13 0.1 . 1 . . . . . . . . 5686 1 2358 . 1 1 198 198 PRO CB C 13 30.9 0.1 . 1 . . . . . . . . 5686 1 2359 . 1 1 198 198 PRO CG C 13 28.22 0.1 . 1 . . . . . . . . 5686 1 2360 . 1 1 198 198 PRO CD C 13 49.9 0.1 . 1 . . . . . . . . 5686 1 2361 . 1 1 199 199 LEU H H 1 7.531 0.02 . 1 . . . . . . . . 5686 1 2362 . 1 1 199 199 LEU HA H 1 4.302 0.02 . 1 . . . . . . . . 5686 1 2363 . 1 1 199 199 LEU HB2 H 1 1.528 0.02 . 2 . . . . . . . . 5686 1 2364 . 1 1 199 199 LEU HB3 H 1 1.028 0.02 . 2 . . . . . . . . 5686 1 2365 . 1 1 199 199 LEU HD11 H 1 0.434 0.02 . 2 . . . . . . . . 5686 1 2366 . 1 1 199 199 LEU HD12 H 1 0.434 0.02 . 2 . . . . . . . . 5686 1 2367 . 1 1 199 199 LEU HD13 H 1 0.434 0.02 . 2 . . . . . . . . 5686 1 2368 . 1 1 199 199 LEU HD21 H 1 0.7449 0.02 . 2 . . . . . . . . 5686 1 2369 . 1 1 199 199 LEU HD22 H 1 0.7449 0.02 . 2 . . . . . . . . 5686 1 2370 . 1 1 199 199 LEU HD23 H 1 0.7449 0.02 . 2 . . . . . . . . 5686 1 2371 . 1 1 199 199 LEU C C 13 175.3 0.2 . 1 . . . . . . . . 5686 1 2372 . 1 1 199 199 LEU CA C 13 54.55 0.1 . 1 . . . . . . . . 5686 1 2373 . 1 1 199 199 LEU CB C 13 41.78 0.1 . 1 . . . . . . . . 5686 1 2374 . 1 1 199 199 LEU CD1 C 13 24.13 0.1 . 2 . . . . . . . . 5686 1 2375 . 1 1 199 199 LEU CD2 C 13 21.15 0.1 . 2 . . . . . . . . 5686 1 2376 . 1 1 199 199 LEU N N 15 113 0.2 . 1 . . . . . . . . 5686 1 2377 . 1 1 200 200 GLY H H 1 7.852 0.02 . 1 . . . . . . . . 5686 1 2378 . 1 1 200 200 GLY HA2 H 1 3.928 0.02 . 2 . . . . . . . . 5686 1 2379 . 1 1 200 200 GLY HA3 H 1 3.898 0.02 . 2 . . . . . . . . 5686 1 2380 . 1 1 200 200 GLY C C 13 172.6 0.2 . 1 . . . . . . . . 5686 1 2381 . 1 1 200 200 GLY CA C 13 46.44 0.1 . 1 . . . . . . . . 5686 1 2382 . 1 1 200 200 GLY N N 15 109.6 0.2 . 1 . . . . . . . . 5686 1 2383 . 1 1 201 201 ILE H H 1 7.519 0.02 . 1 . . . . . . . . 5686 1 2384 . 1 1 201 201 ILE HA H 1 4.729 0.02 . 1 . . . . . . . . 5686 1 2385 . 1 1 201 201 ILE HB H 1 1.738 0.02 . 1 . . . . . . . . 5686 1 2386 . 1 1 201 201 ILE HG12 H 1 0.8461 0.02 . 2 . . . . . . . . 5686 1 2387 . 1 1 201 201 ILE HG13 H 1 0.5261 0.02 . 2 . . . . . . . . 5686 1 2388 . 1 1 201 201 ILE HG21 H 1 0.6615 0.02 . 1 . . . . . . . . 5686 1 2389 . 1 1 201 201 ILE HG22 H 1 0.6615 0.02 . 1 . . . . . . . . 5686 1 2390 . 1 1 201 201 ILE HG23 H 1 0.6615 0.02 . 1 . . . . . . . . 5686 1 2391 . 1 1 201 201 ILE HD11 H 1 -0.0409 0.02 . 1 . . . . . . . . 5686 1 2392 . 1 1 201 201 ILE HD12 H 1 -0.0409 0.02 . 1 . . . . . . . . 5686 1 2393 . 1 1 201 201 ILE HD13 H 1 -0.0409 0.02 . 1 . . . . . . . . 5686 1 2394 . 1 1 201 201 ILE C C 13 171.7 0.2 . 1 . . . . . . . . 5686 1 2395 . 1 1 201 201 ILE CA C 13 58.74 0.1 . 1 . . . . . . . . 5686 1 2396 . 1 1 201 201 ILE CB C 13 41.73 0.1 . 1 . . . . . . . . 5686 1 2397 . 1 1 201 201 ILE CG1 C 13 24.49 0.1 . 1 . . . . . . . . 5686 1 2398 . 1 1 201 201 ILE CG2 C 13 17.1 0.1 . 1 . . . . . . . . 5686 1 2399 . 1 1 201 201 ILE CD1 C 13 12.9 0.1 . 1 . . . . . . . . 5686 1 2400 . 1 1 201 201 ILE N N 15 111.9 0.2 . 1 . . . . . . . . 5686 1 2401 . 1 1 202 202 SER H H 1 7.797 0.02 . 1 . . . . . . . . 5686 1 2402 . 1 1 202 202 SER HA H 1 4.962 0.02 . 1 . . . . . . . . 5686 1 2403 . 1 1 202 202 SER HB2 H 1 3.522 0.02 . 1 . . . . . . . . 5686 1 2404 . 1 1 202 202 SER HB3 H 1 3.522 0.02 . 1 . . . . . . . . 5686 1 2405 . 1 1 202 202 SER C C 13 171.9 0.2 . 1 . . . . . . . . 5686 1 2406 . 1 1 202 202 SER CA C 13 56.12 0.1 . 1 . . . . . . . . 5686 1 2407 . 1 1 202 202 SER CB C 13 64.19 0.1 . 1 . . . . . . . . 5686 1 2408 . 1 1 202 202 SER N N 15 113.4 0.2 . 1 . . . . . . . . 5686 1 2409 . 1 1 203 203 THR H H 1 9.062 0.02 . 1 . . . . . . . . 5686 1 2410 . 1 1 203 203 THR HA H 1 3.924 0.02 . 1 . . . . . . . . 5686 1 2411 . 1 1 203 203 THR HB H 1 3.615 0.02 . 1 . . . . . . . . 5686 1 2412 . 1 1 203 203 THR HG21 H 1 0.7632 0.02 . 1 . . . . . . . . 5686 1 2413 . 1 1 203 203 THR HG22 H 1 0.7632 0.02 . 1 . . . . . . . . 5686 1 2414 . 1 1 203 203 THR HG23 H 1 0.7632 0.02 . 1 . . . . . . . . 5686 1 2415 . 1 1 203 203 THR C C 13 172.5 0.2 . 1 . . . . . . . . 5686 1 2416 . 1 1 203 203 THR CA C 13 62.75 0.1 . 1 . . . . . . . . 5686 1 2417 . 1 1 203 203 THR CB C 13 69.24 0.1 . 1 . . . . . . . . 5686 1 2418 . 1 1 203 203 THR CG2 C 13 20.46 0.1 . 1 . . . . . . . . 5686 1 2419 . 1 1 203 203 THR N N 15 116.3 0.2 . 1 . . . . . . . . 5686 1 2420 . 1 1 204 204 VAL H H 1 7.489 0.02 . 1 . . . . . . . . 5686 1 2421 . 1 1 204 204 VAL HA H 1 4.746 0.02 . 1 . . . . . . . . 5686 1 2422 . 1 1 204 204 VAL HB H 1 1.864 0.02 . 1 . . . . . . . . 5686 1 2423 . 1 1 204 204 VAL HG11 H 1 0.853 0.02 . 2 . . . . . . . . 5686 1 2424 . 1 1 204 204 VAL HG12 H 1 0.853 0.02 . 2 . . . . . . . . 5686 1 2425 . 1 1 204 204 VAL HG13 H 1 0.853 0.02 . 2 . . . . . . . . 5686 1 2426 . 1 1 204 204 VAL HG21 H 1 0.8972 0.02 . 2 . . . . . . . . 5686 1 2427 . 1 1 204 204 VAL HG22 H 1 0.8972 0.02 . 2 . . . . . . . . 5686 1 2428 . 1 1 204 204 VAL HG23 H 1 0.8972 0.02 . 2 . . . . . . . . 5686 1 2429 . 1 1 204 204 VAL C C 13 172.8 0.2 . 1 . . . . . . . . 5686 1 2430 . 1 1 204 204 VAL CA C 13 60.13 0.1 . 1 . . . . . . . . 5686 1 2431 . 1 1 204 204 VAL CB C 13 34.65 0.1 . 1 . . . . . . . . 5686 1 2432 . 1 1 204 204 VAL CG1 C 13 22.22 0.1 . 2 . . . . . . . . 5686 1 2433 . 1 1 204 204 VAL CG2 C 13 20.87 0.1 . 2 . . . . . . . . 5686 1 2434 . 1 1 204 204 VAL N N 15 118.2 0.2 . 1 . . . . . . . . 5686 1 2435 . 1 1 205 205 GLU H H 1 9.408 0.02 . 1 . . . . . . . . 5686 1 2436 . 1 1 205 205 GLU HA H 1 4.793 0.02 . 1 . . . . . . . . 5686 1 2437 . 1 1 205 205 GLU HB2 H 1 2.057 0.02 . 2 . . . . . . . . 5686 1 2438 . 1 1 205 205 GLU HB3 H 1 1.983 0.02 . 2 . . . . . . . . 5686 1 2439 . 1 1 205 205 GLU HG2 H 1 2.09 0.02 . 1 . . . . . . . . 5686 1 2440 . 1 1 205 205 GLU HG3 H 1 2.09 0.02 . 1 . . . . . . . . 5686 1 2441 . 1 1 205 205 GLU C C 13 172.9 0.2 . 1 . . . . . . . . 5686 1 2442 . 1 1 205 205 GLU CA C 13 53.32 0.1 . 1 . . . . . . . . 5686 1 2443 . 1 1 205 205 GLU CB C 13 32.68 0.1 . 1 . . . . . . . . 5686 1 2444 . 1 1 205 205 GLU CG C 13 35.38 0.1 . 1 . . . . . . . . 5686 1 2445 . 1 1 205 205 GLU N N 15 128.3 0.2 . 1 . . . . . . . . 5686 1 2446 . 1 1 206 206 THR H H 1 8.926 0.02 . 1 . . . . . . . . 5686 1 2447 . 1 1 206 206 THR HA H 1 4.3 0.02 . 1 . . . . . . . . 5686 1 2448 . 1 1 206 206 THR HB H 1 4.041 0.02 . 1 . . . . . . . . 5686 1 2449 . 1 1 206 206 THR HG21 H 1 1.03 0.02 . 1 . . . . . . . . 5686 1 2450 . 1 1 206 206 THR HG22 H 1 1.03 0.02 . 1 . . . . . . . . 5686 1 2451 . 1 1 206 206 THR HG23 H 1 1.03 0.02 . 1 . . . . . . . . 5686 1 2452 . 1 1 206 206 THR C C 13 171.5 0.2 . 1 . . . . . . . . 5686 1 2453 . 1 1 206 206 THR CA C 13 62.05 0.1 . 1 . . . . . . . . 5686 1 2454 . 1 1 206 206 THR CB C 13 68.8 0.1 . 1 . . . . . . . . 5686 1 2455 . 1 1 206 206 THR CG2 C 13 21.88 0.1 . 1 . . . . . . . . 5686 1 2456 . 1 1 206 206 THR N N 15 121.9 0.2 . 1 . . . . . . . . 5686 1 2457 . 1 1 207 207 VAL H H 1 8.541 0.02 . 1 . . . . . . . . 5686 1 2458 . 1 1 207 207 VAL HA H 1 4.027 0.02 . 1 . . . . . . . . 5686 1 2459 . 1 1 207 207 VAL HB H 1 1.518 0.02 . 1 . . . . . . . . 5686 1 2460 . 1 1 207 207 VAL HG11 H 1 0.7407 0.02 . 2 . . . . . . . . 5686 1 2461 . 1 1 207 207 VAL HG12 H 1 0.7407 0.02 . 2 . . . . . . . . 5686 1 2462 . 1 1 207 207 VAL HG13 H 1 0.7407 0.02 . 2 . . . . . . . . 5686 1 2463 . 1 1 207 207 VAL HG21 H 1 0.599 0.02 . 2 . . . . . . . . 5686 1 2464 . 1 1 207 207 VAL HG22 H 1 0.599 0.02 . 2 . . . . . . . . 5686 1 2465 . 1 1 207 207 VAL HG23 H 1 0.599 0.02 . 2 . . . . . . . . 5686 1 2466 . 1 1 207 207 VAL CA C 13 60.9 0.1 . 1 . . . . . . . . 5686 1 2467 . 1 1 207 207 VAL CB C 13 30.6 0.1 . 1 . . . . . . . . 5686 1 2468 . 1 1 207 207 VAL CG1 C 13 20.86 0.1 . 2 . . . . . . . . 5686 1 2469 . 1 1 207 207 VAL CG2 C 13 19.4 0.1 . 2 . . . . . . . . 5686 1 2470 . 1 1 207 207 VAL N N 15 129.1 0.2 . 1 . . . . . . . . 5686 1 2471 . 1 1 209 209 ARG HA H 1 3.947 0.02 . 1 . . . . . . . . 5686 1 2472 . 1 1 209 209 ARG HB2 H 1 1.991 0.02 . 1 . . . . . . . . 5686 1 2473 . 1 1 209 209 ARG HB3 H 1 1.991 0.02 . 1 . . . . . . . . 5686 1 2474 . 1 1 209 209 ARG HG2 H 1 1.532 0.02 . 1 . . . . . . . . 5686 1 2475 . 1 1 209 209 ARG HG3 H 1 1.532 0.02 . 1 . . . . . . . . 5686 1 2476 . 1 1 209 209 ARG HD2 H 1 3.124 0.02 . 1 . . . . . . . . 5686 1 2477 . 1 1 209 209 ARG HD3 H 1 3.124 0.02 . 1 . . . . . . . . 5686 1 2478 . 1 1 209 209 ARG C C 13 173.8 0.2 . 1 . . . . . . . . 5686 1 2479 . 1 1 209 209 ARG CA C 13 57.72 0.1 . 1 . . . . . . . . 5686 1 2480 . 1 1 209 209 ARG CB C 13 28.54 0.1 . 1 . . . . . . . . 5686 1 2481 . 1 1 209 209 ARG CG C 13 27.55 0.1 . 1 . . . . . . . . 5686 1 2482 . 1 1 209 209 ARG CD C 13 42.93 0.1 . 1 . . . . . . . . 5686 1 2483 . 1 1 210 210 ARG H H 1 8.217 0.02 . 1 . . . . . . . . 5686 1 2484 . 1 1 210 210 ARG HA H 1 4.455 0.02 . 1 . . . . . . . . 5686 1 2485 . 1 1 210 210 ARG HB2 H 1 1.738 0.02 . 1 . . . . . . . . 5686 1 2486 . 1 1 210 210 ARG HB3 H 1 1.738 0.02 . 1 . . . . . . . . 5686 1 2487 . 1 1 210 210 ARG HG2 H 1 1.504 0.02 . 1 . . . . . . . . 5686 1 2488 . 1 1 210 210 ARG HG3 H 1 1.504 0.02 . 1 . . . . . . . . 5686 1 2489 . 1 1 210 210 ARG HD2 H 1 3.046 0.02 . 1 . . . . . . . . 5686 1 2490 . 1 1 210 210 ARG HD3 H 1 3.046 0.02 . 1 . . . . . . . . 5686 1 2491 . 1 1 210 210 ARG C C 13 173.6 0.2 . 1 . . . . . . . . 5686 1 2492 . 1 1 210 210 ARG CA C 13 56.65 0.1 . 1 . . . . . . . . 5686 1 2493 . 1 1 210 210 ARG CB C 13 32.74 0.1 . 1 . . . . . . . . 5686 1 2494 . 1 1 210 210 ARG CG C 13 26.34 0.1 . 1 . . . . . . . . 5686 1 2495 . 1 1 210 210 ARG CD C 13 42.82 0.1 . 1 . . . . . . . . 5686 1 2496 . 1 1 210 210 ARG N N 15 117.6 0.2 . 1 . . . . . . . . 5686 1 2497 . 1 1 211 211 GLY H H 1 7.714 0.02 . 1 . . . . . . . . 5686 1 2498 . 1 1 211 211 GLY HA2 H 1 4.379 0.02 . 2 . . . . . . . . 5686 1 2499 . 1 1 211 211 GLY HA3 H 1 3.269 0.02 . 2 . . . . . . . . 5686 1 2500 . 1 1 211 211 GLY C C 13 168.5 0.2 . 1 . . . . . . . . 5686 1 2501 . 1 1 211 211 GLY CA C 13 45.08 0.1 . 1 . . . . . . . . 5686 1 2502 . 1 1 211 211 GLY N N 15 105.9 0.2 . 1 . . . . . . . . 5686 1 2503 . 1 1 212 212 TYR H H 1 8.972 0.02 . 1 . . . . . . . . 5686 1 2504 . 1 1 212 212 TYR HA H 1 5.334 0.02 . 1 . . . . . . . . 5686 1 2505 . 1 1 212 212 TYR HB2 H 1 2.818 0.02 . 2 . . . . . . . . 5686 1 2506 . 1 1 212 212 TYR HB3 H 1 2.424 0.02 . 2 . . . . . . . . 5686 1 2507 . 1 1 212 212 TYR HD1 H 1 6.828 0.02 . 1 . . . . . . . . 5686 1 2508 . 1 1 212 212 TYR HD2 H 1 6.828 0.02 . 1 . . . . . . . . 5686 1 2509 . 1 1 212 212 TYR HE1 H 1 6.594 0.02 . 1 . . . . . . . . 5686 1 2510 . 1 1 212 212 TYR HE2 H 1 6.594 0.02 . 1 . . . . . . . . 5686 1 2511 . 1 1 212 212 TYR C C 13 171.3 0.2 . 1 . . . . . . . . 5686 1 2512 . 1 1 212 212 TYR CA C 13 56.42 0.1 . 1 . . . . . . . . 5686 1 2513 . 1 1 212 212 TYR CB C 13 43.08 0.1 . 1 . . . . . . . . 5686 1 2514 . 1 1 212 212 TYR N N 15 123 0.2 . 1 . . . . . . . . 5686 1 2515 . 1 1 213 213 ARG H H 1 8.932 0.02 . 1 . . . . . . . . 5686 1 2516 . 1 1 213 213 ARG HA H 1 5.219 0.02 . 1 . . . . . . . . 5686 1 2517 . 1 1 213 213 ARG HB2 H 1 1.747 0.02 . 2 . . . . . . . . 5686 1 2518 . 1 1 213 213 ARG HB3 H 1 1.507 0.02 . 2 . . . . . . . . 5686 1 2519 . 1 1 213 213 ARG HG2 H 1 1.508 0.02 . 1 . . . . . . . . 5686 1 2520 . 1 1 213 213 ARG HG3 H 1 1.508 0.02 . 1 . . . . . . . . 5686 1 2521 . 1 1 213 213 ARG HD2 H 1 3.061 0.02 . 2 . . . . . . . . 5686 1 2522 . 1 1 213 213 ARG HD3 H 1 2.766 0.02 . 2 . . . . . . . . 5686 1 2523 . 1 1 213 213 ARG C C 13 172.4 0.2 . 1 . . . . . . . . 5686 1 2524 . 1 1 213 213 ARG CA C 13 54.12 0.1 . 1 . . . . . . . . 5686 1 2525 . 1 1 213 213 ARG CB C 13 35.44 0.1 . 1 . . . . . . . . 5686 1 2526 . 1 1 213 213 ARG CG C 13 25.61 0.1 . 1 . . . . . . . . 5686 1 2527 . 1 1 213 213 ARG CD C 13 43.54 0.1 . 1 . . . . . . . . 5686 1 2528 . 1 1 213 213 ARG N N 15 118.7 0.2 . 1 . . . . . . . . 5686 1 2529 . 1 1 214 214 PHE H H 1 9.746 0.02 . 1 . . . . . . . . 5686 1 2530 . 1 1 214 214 PHE HA H 1 5.039 0.02 . 1 . . . . . . . . 5686 1 2531 . 1 1 214 214 PHE HB2 H 1 3.079 0.02 . 2 . . . . . . . . 5686 1 2532 . 1 1 214 214 PHE HB3 H 1 2.691 0.02 . 2 . . . . . . . . 5686 1 2533 . 1 1 214 214 PHE HD1 H 1 7.137 0.02 . 1 . . . . . . . . 5686 1 2534 . 1 1 214 214 PHE HD2 H 1 7.137 0.02 . 1 . . . . . . . . 5686 1 2535 . 1 1 214 214 PHE C C 13 172.7 0.2 . 1 . . . . . . . . 5686 1 2536 . 1 1 214 214 PHE CA C 13 57.58 0.1 . 1 . . . . . . . . 5686 1 2537 . 1 1 214 214 PHE CB C 13 39.47 0.1 . 1 . . . . . . . . 5686 1 2538 . 1 1 214 214 PHE N N 15 129.2 0.2 . 1 . . . . . . . . 5686 1 2539 . 1 1 215 215 CYS H H 1 8.543 0.02 . 1 . . . . . . . . 5686 1 2540 . 1 1 215 215 CYS HA H 1 4.805 0.02 . 1 . . . . . . . . 5686 1 2541 . 1 1 215 215 CYS HB2 H 1 3.001 0.02 . 2 . . . . . . . . 5686 1 2542 . 1 1 215 215 CYS HB3 H 1 2.224 0.02 . 2 . . . . . . . . 5686 1 2543 . 1 1 215 215 CYS C C 13 170.6 0.2 . 1 . . . . . . . . 5686 1 2544 . 1 1 215 215 CYS CA C 13 55.99 0.1 . 1 . . . . . . . . 5686 1 2545 . 1 1 215 215 CYS CB C 13 30.07 0.1 . 1 . . . . . . . . 5686 1 2546 . 1 1 215 215 CYS N N 15 125.3 0.2 . 1 . . . . . . . . 5686 1 2547 . 1 1 216 216 TYR H H 1 6.07 0.02 . 1 . . . . . . . . 5686 1 2548 . 1 1 216 216 TYR HA H 1 4.475 0.02 . 1 . . . . . . . . 5686 1 2549 . 1 1 216 216 TYR HB2 H 1 3.035 0.02 . 1 . . . . . . . . 5686 1 2550 . 1 1 216 216 TYR HB3 H 1 3.035 0.02 . 1 . . . . . . . . 5686 1 2551 . 1 1 216 216 TYR HD1 H 1 7.103 0.02 . 1 . . . . . . . . 5686 1 2552 . 1 1 216 216 TYR HD2 H 1 7.103 0.02 . 1 . . . . . . . . 5686 1 2553 . 1 1 216 216 TYR CA C 13 57.53 0.1 . 1 . . . . . . . . 5686 1 2554 . 1 1 216 216 TYR CB C 13 38.86 0.1 . 1 . . . . . . . . 5686 1 2555 . 1 1 216 216 TYR N N 15 124.7 0.2 . 1 . . . . . . . . 5686 1 2556 . 1 1 219 219 PRO HA H 1 4.321 0.02 . 1 . . . . . . . . 5686 1 2557 . 1 1 219 219 PRO HB2 H 1 2.198 0.02 . 1 . . . . . . . . 5686 1 2558 . 1 1 219 219 PRO HB3 H 1 2.198 0.02 . 1 . . . . . . . . 5686 1 2559 . 1 1 219 219 PRO HG2 H 1 1.936 0.02 . 1 . . . . . . . . 5686 1 2560 . 1 1 219 219 PRO HG3 H 1 1.936 0.02 . 1 . . . . . . . . 5686 1 2561 . 1 1 219 219 PRO C C 13 174.3 0.2 . 1 . . . . . . . . 5686 1 2562 . 1 1 219 219 PRO CA C 13 62.41 0.1 . 1 . . . . . . . . 5686 1 2563 . 1 1 219 219 PRO CB C 13 31.71 0.1 . 1 . . . . . . . . 5686 1 2564 . 1 1 219 219 PRO CG C 13 27.07 0.1 . 1 . . . . . . . . 5686 1 2565 . 1 1 220 220 ALA H H 1 8.306 0.02 . 1 . . . . . . . . 5686 1 2566 . 1 1 220 220 ALA HA H 1 4.251 0.02 . 1 . . . . . . . . 5686 1 2567 . 1 1 220 220 ALA HB1 H 1 1.319 0.02 . 1 . . . . . . . . 5686 1 2568 . 1 1 220 220 ALA HB2 H 1 1.319 0.02 . 1 . . . . . . . . 5686 1 2569 . 1 1 220 220 ALA HB3 H 1 1.319 0.02 . 1 . . . . . . . . 5686 1 2570 . 1 1 220 220 ALA C C 13 175.6 0.2 . 1 . . . . . . . . 5686 1 2571 . 1 1 220 220 ALA CA C 13 51.96 0.1 . 1 . . . . . . . . 5686 1 2572 . 1 1 220 220 ALA CB C 13 18.99 0.1 . 1 . . . . . . . . 5686 1 2573 . 1 1 220 220 ALA N N 15 124.6 0.2 . 1 . . . . . . . . 5686 1 2574 . 1 1 221 221 CYS H H 1 7.862 0.02 . 1 . . . . . . . . 5686 1 2575 . 1 1 221 221 CYS HA H 1 4.438 0.02 . 1 . . . . . . . . 5686 1 2576 . 1 1 221 221 CYS HB2 H 1 2.864 0.02 . 1 . . . . . . . . 5686 1 2577 . 1 1 221 221 CYS HB3 H 1 2.864 0.02 . 1 . . . . . . . . 5686 1 2578 . 1 1 221 221 CYS C C 13 172 0.2 . 1 . . . . . . . . 5686 1 2579 . 1 1 221 221 CYS CA C 13 57.41 0.1 . 1 . . . . . . . . 5686 1 2580 . 1 1 221 221 CYS CB C 13 27.78 0.1 . 1 . . . . . . . . 5686 1 2581 . 1 1 221 221 CYS N N 15 119.2 0.2 . 1 . . . . . . . . 5686 1 2582 . 1 1 222 222 GLU H H 1 8.429 0.02 . 1 . . . . . . . . 5686 1 2583 . 1 1 222 222 GLU HA H 1 4.31 0.02 . 1 . . . . . . . . 5686 1 2584 . 1 1 222 222 GLU HB2 H 1 2.073 0.02 . 2 . . . . . . . . 5686 1 2585 . 1 1 222 222 GLU HB3 H 1 1.861 0.02 . 2 . . . . . . . . 5686 1 2586 . 1 1 222 222 GLU HG2 H 1 2.212 0.02 . 2 . . . . . . . . 5686 1 2587 . 1 1 222 222 GLU HG3 H 1 2.038 0.02 . 2 . . . . . . . . 5686 1 2588 . 1 1 222 222 GLU C C 13 173.1 0.2 . 1 . . . . . . . . 5686 1 2589 . 1 1 222 222 GLU CA C 13 56.04 0.1 . 1 . . . . . . . . 5686 1 2590 . 1 1 222 222 GLU CB C 13 30.29 0.1 . 1 . . . . . . . . 5686 1 2591 . 1 1 222 222 GLU CG C 13 36.16 0.1 . 1 . . . . . . . . 5686 1 2592 . 1 1 222 222 GLU N N 15 123.6 0.2 . 1 . . . . . . . . 5686 1 2593 . 1 1 223 223 GLU H H 1 7.96 0.02 . 1 . . . . . . . . 5686 1 2594 . 1 1 223 223 GLU HA H 1 4.075 0.02 . 1 . . . . . . . . 5686 1 2595 . 1 1 223 223 GLU HB2 H 1 1.977 0.02 . 2 . . . . . . . . 5686 1 2596 . 1 1 223 223 GLU HB3 H 1 1.848 0.02 . 2 . . . . . . . . 5686 1 2597 . 1 1 223 223 GLU HG2 H 1 2.143 0.02 . 1 . . . . . . . . 5686 1 2598 . 1 1 223 223 GLU HG3 H 1 2.143 0.02 . 1 . . . . . . . . 5686 1 2599 . 1 1 223 223 GLU CA C 13 57.93 0.1 . 1 . . . . . . . . 5686 1 2600 . 1 1 223 223 GLU CB C 13 31.02 0.1 . 1 . . . . . . . . 5686 1 2601 . 1 1 223 223 GLU CG C 13 36.43 0.1 . 1 . . . . . . . . 5686 1 2602 . 1 1 223 223 GLU N N 15 127.2 0.2 . 1 . . . . . . . . 5686 1 stop_ save_