data_18552 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18552 _Entry.Title ; TM4-Cx43CT ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-06-27 _Entry.Accession_date 2012-06-27 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Rosslyn Grosely . . . 18552 2 Fabien Kieken . . . 18552 3 Paul Sorgen . L. . 18552 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18552 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 413 18552 '15N chemical shifts' 132 18552 '1H chemical shifts' 722 18552 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2014-02-19 2012-06-27 update BMRB 'update entry citation' 18552 1 . . 2013-02-20 2012-06-27 original author 'original release' 18552 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18552 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23065337 _Citation.Full_citation . _Citation.Title '1H, 13C, and 15N backbone resonance assignments of the connexin43 carboxyl terminal domain attached to the 4th transmembrane domain in detergent micelles.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 7 _Citation.Journal_issue 2 _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 299 _Citation.Page_last 303 _Citation.Year 2013 _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 Rosslyn Grosely . . . 18552 1 2 Fabien Kieken . . . 18552 1 3 Paul Sorgen . L. . 18552 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID connexin43 18552 1 'gap junction' 18552 1 'intrinsically disordered proteins' 18552 1 'LPPG detergent micelles' 18552 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18552 _Assembly.ID 1 _Assembly.Name 'TM4-Cx43CT monomer' _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 . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'TM4-Cx43CT monomer' 1 $TM4-Cx43CT A . yes native no no . . . 18552 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_TM4-Cx43CT _Entity.Sf_category entity _Entity.Sf_framecode TM4-Cx43CT _Entity.Entry_ID 18552 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name TM4-Cx43CT _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 ; MGSSHHHHHHSSGLVPRGSH MDCFLSRPTEKTIFIIFMLV VSLVSLALNIIELFYVFFKG VKDRVKGRSDPYHATTGPLS PSKDCGSPKYAYFNGCSSPT APLSPMSPPGYKLVTGDRNN SSCRNYNKQASEQNWANYSA EQNRMGQAGSTISNSHAQPF DFPDDNQNAKKVAAGHELQP LAIVDQRPSSRASSRASSRP RPDDLEI ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'The first 21 residues are the affinity tag and linker sequence. Asp 22 corresponds with Asp 197 of full-length Connexin43.' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 207 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1R5S . "Connexin 43 Carboxyl Terminal Domain" . . . . . 63.77 132 99.24 99.24 1.80e-87 . . . . 18552 1 2 no DBJ BAC26375 . "unnamed protein product [Mus musculus]" . . . . . 90.82 382 98.40 99.47 4.86e-132 . . . . 18552 1 3 no DBJ BAC29656 . "unnamed protein product [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 4 no DBJ BAC38285 . "unnamed protein product [Mus musculus]" . . . . . 52.17 108 99.07 100.00 4.58e-70 . . . . 18552 1 5 no DBJ BAE26592 . "unnamed protein product [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 6 no DBJ BAE38502 . "unnamed protein product [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 7 no EMBL CAA29855 . "unnamed protein product [Rattus norvegicus]" . . . . . 90.82 382 98.94 99.47 9.69e-133 . . . . 18552 1 8 no EMBL CAA43778 . "connexin 43 [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 9 no EMBL CAA44640 . "Connexin 43 [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 10 no EMBL CAC21170 . "connexin 43 [Sus scrofa]" . . . . . 57.00 125 97.46 99.15 7.61e-79 . . . . 18552 1 11 no EMBL CAJ18535 . "Npm1 [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 12 no GB AAA37444 . "connexin 43 [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 13 no GB AAH06894 . "Gap junction protein, alpha 1 [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 14 no GB AAH55375 . "Gja1 protein [Mus musculus]" . . . . . 90.82 434 98.40 99.47 1.82e-131 . . . . 18552 1 15 no GB AAH81842 . "Gap junction protein, alpha 1 [Rattus norvegicus]" . . . . . 90.82 382 98.94 99.47 9.69e-133 . . . . 18552 1 16 no GB AAM34255 . "connexin 47 [Mesocricetus auratus]" . . . . . 58.94 160 97.54 99.18 1.02e-81 . . . . 18552 1 17 no PRF 1404339A . "connexin 43" . . . . . 90.82 382 98.94 99.47 9.69e-133 . . . . 18552 1 18 no PRF 1714172A . "connexin 43" . . . . . 90.82 382 98.94 99.47 1.05e-132 . . . . 18552 1 19 no REF NP_001002951 . "gap junction alpha-1 protein [Canis lupus familiaris]" . . . . . 90.82 382 97.34 99.47 1.34e-117 . . . . 18552 1 20 no REF NP_001185877 . "gap junction alpha-1 protein [Oryctolagus cuniculus]" . . . . . 90.82 382 97.34 99.47 1.48e-117 . . . . 18552 1 21 no REF NP_001231004 . "gap junction alpha-1 protein [Cricetulus griseus]" . . . . . 90.82 382 98.40 99.47 3.66e-132 . . . . 18552 1 22 no REF NP_001268545 . "gap junction alpha-1 protein [Mesocricetus auratus]" . . . . . 90.82 382 97.87 99.47 7.51e-132 . . . . 18552 1 23 no REF NP_034418 . "gap junction alpha-1 protein [Mus musculus]" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 24 no SP P08050 . "RecName: Full=Gap junction alpha-1 protein; AltName: Full=Connexin-43; Short=Cx43; AltName: Full=Gap junction 43 kDa heart prot" . . . . . 90.82 382 98.94 99.47 9.69e-133 . . . . 18552 1 25 no SP P23242 . "RecName: Full=Gap junction alpha-1 protein; AltName: Full=Connexin-43; Short=Cx43; AltName: Full=Gap junction 43 kDa heart prot" . . . . . 90.82 382 98.40 99.47 5.42e-132 . . . . 18552 1 26 no SP Q6TYA7 . "RecName: Full=Gap junction alpha-1 protein; AltName: Full=Connexin-43; Short=Cx43" . . . . . 90.82 382 97.34 99.47 1.48e-117 . . . . 18552 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 . 18552 1 2 . GLY . 18552 1 3 . SER . 18552 1 4 . SER . 18552 1 5 . HIS . 18552 1 6 . HIS . 18552 1 7 . HIS . 18552 1 8 . HIS . 18552 1 9 . HIS . 18552 1 10 . HIS . 18552 1 11 . SER . 18552 1 12 . SER . 18552 1 13 . GLY . 18552 1 14 . LEU . 18552 1 15 . VAL . 18552 1 16 . PRO . 18552 1 17 . ARG . 18552 1 18 . GLY . 18552 1 19 . SER . 18552 1 20 . HIS . 18552 1 21 . MET . 18552 1 22 . ASP . 18552 1 23 . CYS . 18552 1 24 . PHE . 18552 1 25 . LEU . 18552 1 26 . SER . 18552 1 27 . ARG . 18552 1 28 . PRO . 18552 1 29 . THR . 18552 1 30 . GLU . 18552 1 31 . LYS . 18552 1 32 . THR . 18552 1 33 . ILE . 18552 1 34 . PHE . 18552 1 35 . ILE . 18552 1 36 . ILE . 18552 1 37 . PHE . 18552 1 38 . MET . 18552 1 39 . LEU . 18552 1 40 . VAL . 18552 1 41 . VAL . 18552 1 42 . SER . 18552 1 43 . LEU . 18552 1 44 . VAL . 18552 1 45 . SER . 18552 1 46 . LEU . 18552 1 47 . ALA . 18552 1 48 . LEU . 18552 1 49 . ASN . 18552 1 50 . ILE . 18552 1 51 . ILE . 18552 1 52 . GLU . 18552 1 53 . LEU . 18552 1 54 . PHE . 18552 1 55 . TYR . 18552 1 56 . VAL . 18552 1 57 . PHE . 18552 1 58 . PHE . 18552 1 59 . LYS . 18552 1 60 . GLY . 18552 1 61 . VAL . 18552 1 62 . LYS . 18552 1 63 . ASP . 18552 1 64 . ARG . 18552 1 65 . VAL . 18552 1 66 . LYS . 18552 1 67 . GLY . 18552 1 68 . ARG . 18552 1 69 . SER . 18552 1 70 . ASP . 18552 1 71 . PRO . 18552 1 72 . TYR . 18552 1 73 . HIS . 18552 1 74 . ALA . 18552 1 75 . THR . 18552 1 76 . THR . 18552 1 77 . GLY . 18552 1 78 . PRO . 18552 1 79 . LEU . 18552 1 80 . SER . 18552 1 81 . PRO . 18552 1 82 . SER . 18552 1 83 . LYS . 18552 1 84 . ASP . 18552 1 85 . CYS . 18552 1 86 . GLY . 18552 1 87 . SER . 18552 1 88 . PRO . 18552 1 89 . LYS . 18552 1 90 . TYR . 18552 1 91 . ALA . 18552 1 92 . TYR . 18552 1 93 . PHE . 18552 1 94 . ASN . 18552 1 95 . GLY . 18552 1 96 . CYS . 18552 1 97 . SER . 18552 1 98 . SER . 18552 1 99 . PRO . 18552 1 100 . THR . 18552 1 101 . ALA . 18552 1 102 . PRO . 18552 1 103 . LEU . 18552 1 104 . SER . 18552 1 105 . PRO . 18552 1 106 . MET . 18552 1 107 . SER . 18552 1 108 . PRO . 18552 1 109 . PRO . 18552 1 110 . GLY . 18552 1 111 . TYR . 18552 1 112 . LYS . 18552 1 113 . LEU . 18552 1 114 . VAL . 18552 1 115 . THR . 18552 1 116 . GLY . 18552 1 117 . ASP . 18552 1 118 . ARG . 18552 1 119 . ASN . 18552 1 120 . ASN . 18552 1 121 . SER . 18552 1 122 . SER . 18552 1 123 . CYS . 18552 1 124 . ARG . 18552 1 125 . ASN . 18552 1 126 . TYR . 18552 1 127 . ASN . 18552 1 128 . LYS . 18552 1 129 . GLN . 18552 1 130 . ALA . 18552 1 131 . SER . 18552 1 132 . GLU . 18552 1 133 . GLN . 18552 1 134 . ASN . 18552 1 135 . TRP . 18552 1 136 . ALA . 18552 1 137 . ASN . 18552 1 138 . TYR . 18552 1 139 . SER . 18552 1 140 . ALA . 18552 1 141 . GLU . 18552 1 142 . GLN . 18552 1 143 . ASN . 18552 1 144 . ARG . 18552 1 145 . MET . 18552 1 146 . GLY . 18552 1 147 . GLN . 18552 1 148 . ALA . 18552 1 149 . GLY . 18552 1 150 . SER . 18552 1 151 . THR . 18552 1 152 . ILE . 18552 1 153 . SER . 18552 1 154 . ASN . 18552 1 155 . SER . 18552 1 156 . HIS . 18552 1 157 . ALA . 18552 1 158 . GLN . 18552 1 159 . PRO . 18552 1 160 . PHE . 18552 1 161 . ASP . 18552 1 162 . PHE . 18552 1 163 . PRO . 18552 1 164 . ASP . 18552 1 165 . ASP . 18552 1 166 . ASN . 18552 1 167 . GLN . 18552 1 168 . ASN . 18552 1 169 . ALA . 18552 1 170 . LYS . 18552 1 171 . LYS . 18552 1 172 . VAL . 18552 1 173 . ALA . 18552 1 174 . ALA . 18552 1 175 . GLY . 18552 1 176 . HIS . 18552 1 177 . GLU . 18552 1 178 . LEU . 18552 1 179 . GLN . 18552 1 180 . PRO . 18552 1 181 . LEU . 18552 1 182 . ALA . 18552 1 183 . ILE . 18552 1 184 . VAL . 18552 1 185 . ASP . 18552 1 186 . GLN . 18552 1 187 . ARG . 18552 1 188 . PRO . 18552 1 189 . SER . 18552 1 190 . SER . 18552 1 191 . ARG . 18552 1 192 . ALA . 18552 1 193 . SER . 18552 1 194 . SER . 18552 1 195 . ARG . 18552 1 196 . ALA . 18552 1 197 . SER . 18552 1 198 . SER . 18552 1 199 . ARG . 18552 1 200 . PRO . 18552 1 201 . ARG . 18552 1 202 . PRO . 18552 1 203 . ASP . 18552 1 204 . ASP . 18552 1 205 . LEU . 18552 1 206 . GLU . 18552 1 207 . ILE . 18552 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 18552 1 . GLY 2 2 18552 1 . SER 3 3 18552 1 . SER 4 4 18552 1 . HIS 5 5 18552 1 . HIS 6 6 18552 1 . HIS 7 7 18552 1 . HIS 8 8 18552 1 . HIS 9 9 18552 1 . HIS 10 10 18552 1 . SER 11 11 18552 1 . SER 12 12 18552 1 . GLY 13 13 18552 1 . LEU 14 14 18552 1 . VAL 15 15 18552 1 . PRO 16 16 18552 1 . ARG 17 17 18552 1 . GLY 18 18 18552 1 . SER 19 19 18552 1 . HIS 20 20 18552 1 . MET 21 21 18552 1 . ASP 22 22 18552 1 . CYS 23 23 18552 1 . PHE 24 24 18552 1 . LEU 25 25 18552 1 . SER 26 26 18552 1 . ARG 27 27 18552 1 . PRO 28 28 18552 1 . THR 29 29 18552 1 . GLU 30 30 18552 1 . LYS 31 31 18552 1 . THR 32 32 18552 1 . ILE 33 33 18552 1 . PHE 34 34 18552 1 . ILE 35 35 18552 1 . ILE 36 36 18552 1 . PHE 37 37 18552 1 . MET 38 38 18552 1 . LEU 39 39 18552 1 . VAL 40 40 18552 1 . VAL 41 41 18552 1 . SER 42 42 18552 1 . LEU 43 43 18552 1 . VAL 44 44 18552 1 . SER 45 45 18552 1 . LEU 46 46 18552 1 . ALA 47 47 18552 1 . LEU 48 48 18552 1 . ASN 49 49 18552 1 . ILE 50 50 18552 1 . ILE 51 51 18552 1 . GLU 52 52 18552 1 . LEU 53 53 18552 1 . PHE 54 54 18552 1 . TYR 55 55 18552 1 . VAL 56 56 18552 1 . PHE 57 57 18552 1 . PHE 58 58 18552 1 . LYS 59 59 18552 1 . GLY 60 60 18552 1 . VAL 61 61 18552 1 . LYS 62 62 18552 1 . ASP 63 63 18552 1 . ARG 64 64 18552 1 . VAL 65 65 18552 1 . LYS 66 66 18552 1 . GLY 67 67 18552 1 . ARG 68 68 18552 1 . SER 69 69 18552 1 . ASP 70 70 18552 1 . PRO 71 71 18552 1 . TYR 72 72 18552 1 . HIS 73 73 18552 1 . ALA 74 74 18552 1 . THR 75 75 18552 1 . THR 76 76 18552 1 . GLY 77 77 18552 1 . PRO 78 78 18552 1 . LEU 79 79 18552 1 . SER 80 80 18552 1 . PRO 81 81 18552 1 . SER 82 82 18552 1 . LYS 83 83 18552 1 . ASP 84 84 18552 1 . CYS 85 85 18552 1 . GLY 86 86 18552 1 . SER 87 87 18552 1 . PRO 88 88 18552 1 . LYS 89 89 18552 1 . TYR 90 90 18552 1 . ALA 91 91 18552 1 . TYR 92 92 18552 1 . PHE 93 93 18552 1 . ASN 94 94 18552 1 . GLY 95 95 18552 1 . CYS 96 96 18552 1 . SER 97 97 18552 1 . SER 98 98 18552 1 . PRO 99 99 18552 1 . THR 100 100 18552 1 . ALA 101 101 18552 1 . PRO 102 102 18552 1 . LEU 103 103 18552 1 . SER 104 104 18552 1 . PRO 105 105 18552 1 . MET 106 106 18552 1 . SER 107 107 18552 1 . PRO 108 108 18552 1 . PRO 109 109 18552 1 . GLY 110 110 18552 1 . TYR 111 111 18552 1 . LYS 112 112 18552 1 . LEU 113 113 18552 1 . VAL 114 114 18552 1 . THR 115 115 18552 1 . GLY 116 116 18552 1 . ASP 117 117 18552 1 . ARG 118 118 18552 1 . ASN 119 119 18552 1 . ASN 120 120 18552 1 . SER 121 121 18552 1 . SER 122 122 18552 1 . CYS 123 123 18552 1 . ARG 124 124 18552 1 . ASN 125 125 18552 1 . TYR 126 126 18552 1 . ASN 127 127 18552 1 . LYS 128 128 18552 1 . GLN 129 129 18552 1 . ALA 130 130 18552 1 . SER 131 131 18552 1 . GLU 132 132 18552 1 . GLN 133 133 18552 1 . ASN 134 134 18552 1 . TRP 135 135 18552 1 . ALA 136 136 18552 1 . ASN 137 137 18552 1 . TYR 138 138 18552 1 . SER 139 139 18552 1 . ALA 140 140 18552 1 . GLU 141 141 18552 1 . GLN 142 142 18552 1 . ASN 143 143 18552 1 . ARG 144 144 18552 1 . MET 145 145 18552 1 . GLY 146 146 18552 1 . GLN 147 147 18552 1 . ALA 148 148 18552 1 . GLY 149 149 18552 1 . SER 150 150 18552 1 . THR 151 151 18552 1 . ILE 152 152 18552 1 . SER 153 153 18552 1 . ASN 154 154 18552 1 . SER 155 155 18552 1 . HIS 156 156 18552 1 . ALA 157 157 18552 1 . GLN 158 158 18552 1 . PRO 159 159 18552 1 . PHE 160 160 18552 1 . ASP 161 161 18552 1 . PHE 162 162 18552 1 . PRO 163 163 18552 1 . ASP 164 164 18552 1 . ASP 165 165 18552 1 . ASN 166 166 18552 1 . GLN 167 167 18552 1 . ASN 168 168 18552 1 . ALA 169 169 18552 1 . LYS 170 170 18552 1 . LYS 171 171 18552 1 . VAL 172 172 18552 1 . ALA 173 173 18552 1 . ALA 174 174 18552 1 . GLY 175 175 18552 1 . HIS 176 176 18552 1 . GLU 177 177 18552 1 . LEU 178 178 18552 1 . GLN 179 179 18552 1 . PRO 180 180 18552 1 . LEU 181 181 18552 1 . ALA 182 182 18552 1 . ILE 183 183 18552 1 . VAL 184 184 18552 1 . ASP 185 185 18552 1 . GLN 186 186 18552 1 . ARG 187 187 18552 1 . PRO 188 188 18552 1 . SER 189 189 18552 1 . SER 190 190 18552 1 . ARG 191 191 18552 1 . ALA 192 192 18552 1 . SER 193 193 18552 1 . SER 194 194 18552 1 . ARG 195 195 18552 1 . ALA 196 196 18552 1 . SER 197 197 18552 1 . SER 198 198 18552 1 . ARG 199 199 18552 1 . PRO 200 200 18552 1 . ARG 201 201 18552 1 . PRO 202 202 18552 1 . ASP 203 203 18552 1 . ASP 204 204 18552 1 . LEU 205 205 18552 1 . GLU 206 206 18552 1 . ILE 207 207 18552 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 18552 _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 $TM4-Cx43CT . 10116 organism . 'Rattus norvegicus' Rat . . Eukaryota Metazoa Rattus norvegicus . . . . . . . . . . . . . . . . . . . . . 18552 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 18552 _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 $TM4-Cx43CT . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli DE3 C41 . . . . . . . . . . . . . . pET-14 . . . . . . 18552 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18552 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TM4-Cx43CT '[U-13C; U-15N]' . . 1 $TM4-Cx43CT . . 0.850 . . mM . . . . 18552 1 2 MES 'natural abundance' . . . . . . 20 . . mM . . . . 18552 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 18552 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 18552 1 5 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18552 1 6 LPPG 'natural abundance' . . . . . . 8 . . % . . . . 18552 1 7 TFE '[U-99% 2H]' . . . . . . 10 . . % . . . . 18552 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18552 _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 5.8 . pH 18552 1 pressure 1 . atm 18552 1 temperature 273 . K 18552 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18552 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 18552 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18552 1 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 18552 _Software.ID 2 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 18552 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18552 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 18552 _Software.ID 3 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 18552 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18552 3 'data analysis' 18552 3 'peak picking' 18552 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18552 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18552 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18552 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 18552 1 2 spectrometer_2 Varian INOVA . 600 . . . 18552 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 18552 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18552 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18552 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18552 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18552 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18552 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18552 1 7 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18552 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18552 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18552 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm . . direct 0.251449530 . . . . . . . . . 18552 1 H 1 water protons . . . . ppm . . direct 1.0 . . . . . . . . . 18552 1 N 15 water protons . . . . ppm . . direct 0.101329118 . . . . . . . . . 18552 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18552 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 18552 1 2 '3D CBCA(CO)NH' . . . 18552 1 3 '3D HNCACB' . . . 18552 1 4 '3D HNCO' . . . 18552 1 5 '3D HN(CO)CA' . . . 18552 1 6 '3D 1H-15N NOESY' . . . 18552 1 7 '3D 1H-15N TOCSY' . . . 18552 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 12 12 SER H H 1 8.3430 0.05 . 1 . . . . 12 SER HN . 18552 1 2 . 1 1 12 12 SER HA H 1 4.5390 0.05 . 1 . . . . 12 SER HA . 18552 1 3 . 1 1 12 12 SER HB2 H 1 3.9010 0.05 . 2 . . . . 12 SER HB1 . 18552 1 4 . 1 1 12 12 SER HB3 H 1 3.9010 0.05 . 2 . . . . 12 SER HB2 . 18552 1 5 . 1 1 12 12 SER C C 13 172.0580 0.3 . 1 . . . . 12 SER C . 18552 1 6 . 1 1 12 12 SER CA C 13 55.9260 0.3 . 1 . . . . 12 SER CA . 18552 1 7 . 1 1 12 12 SER CB C 13 61.1110 0.3 . 1 . . . . 12 SER CB . 18552 1 8 . 1 1 12 12 SER N N 15 117.4950 0.3 . 1 . . . . 12 SER N . 18552 1 9 . 1 1 13 13 GLY H H 1 8.2860 0.05 . 1 . . . . 13 GLY HN . 18552 1 10 . 1 1 13 13 GLY HA2 H 1 3.9570 0.05 . 2 . . . . 13 GLY HA1 . 18552 1 11 . 1 1 13 13 GLY HA3 H 1 3.9570 0.05 . 2 . . . . 13 GLY HA2 . 18552 1 12 . 1 1 13 13 GLY C C 13 170.9480 0.3 . 1 . . . . 13 GLY C . 18552 1 13 . 1 1 13 13 GLY CA C 13 42.3900 0.3 . 1 . . . . 13 GLY CA . 18552 1 14 . 1 1 13 13 GLY N N 15 110.0250 0.3 . 1 . . . . 13 GLY N . 18552 1 15 . 1 1 14 14 LEU H H 1 7.9660 0.05 . 1 . . . . 14 LEU HN . 18552 1 16 . 1 1 14 14 LEU HA H 1 4.1110 0.05 . 1 . . . . 14 LEU HA . 18552 1 17 . 1 1 14 14 LEU HB2 H 1 1.5810 0.05 . 2 . . . . 14 LEU HB1 . 18552 1 18 . 1 1 14 14 LEU HB3 H 1 1.5810 0.05 . 2 . . . . 14 LEU HB2 . 18552 1 19 . 1 1 14 14 LEU HG H 1 1.5810 0.05 . 1 . . . . 14 LEU HG . 18552 1 20 . 1 1 14 14 LEU HD11 H 1 0.8430 0.05 . 2 . . . . 14 LEU HD11 . 18552 1 21 . 1 1 14 14 LEU HD12 H 1 0.8430 0.05 . 2 . . . . 14 LEU HD11 . 18552 1 22 . 1 1 14 14 LEU HD13 H 1 0.8430 0.05 . 2 . . . . 14 LEU HD11 . 18552 1 23 . 1 1 14 14 LEU HD21 H 1 0.8430 0.05 . 2 . . . . 14 LEU HD21 . 18552 1 24 . 1 1 14 14 LEU HD22 H 1 0.8430 0.05 . 2 . . . . 14 LEU HD21 . 18552 1 25 . 1 1 14 14 LEU HD23 H 1 0.8430 0.05 . 2 . . . . 14 LEU HD21 . 18552 1 26 . 1 1 14 14 LEU C C 13 173.6590 0.3 . 1 . . . . 14 LEU C . 18552 1 27 . 1 1 14 14 LEU CA C 13 52.9500 0.3 . 1 . . . . 14 LEU CA . 18552 1 28 . 1 1 14 14 LEU CB C 13 39.7510 0.3 . 1 . . . . 14 LEU CB . 18552 1 29 . 1 1 14 14 LEU N N 15 120.8310 0.3 . 1 . . . . 14 LEU N . 18552 1 30 . 1 1 15 15 VAL H H 1 7.6050 0.05 . 1 . . . . 15 VAL HN . 18552 1 31 . 1 1 15 15 VAL HA H 1 4.3310 0.05 . 1 . . . . 15 VAL HA . 18552 1 32 . 1 1 15 15 VAL HB H 1 2.0320 0.05 . 1 . . . . 15 VAL HB . 18552 1 33 . 1 1 15 15 VAL HG11 H 1 0.8940 0.05 . 2 . . . . 15 VAL HG11 . 18552 1 34 . 1 1 15 15 VAL HG12 H 1 0.8940 0.05 . 2 . . . . 15 VAL HG11 . 18552 1 35 . 1 1 15 15 VAL HG13 H 1 0.8940 0.05 . 2 . . . . 15 VAL HG11 . 18552 1 36 . 1 1 15 15 VAL HG21 H 1 0.8940 0.05 . 2 . . . . 15 VAL HG21 . 18552 1 37 . 1 1 15 15 VAL HG22 H 1 0.8940 0.05 . 2 . . . . 15 VAL HG21 . 18552 1 38 . 1 1 15 15 VAL HG23 H 1 0.8940 0.05 . 2 . . . . 15 VAL HG21 . 18552 1 39 . 1 1 15 15 VAL C C 13 171.6300 0.3 . 1 . . . . 15 VAL C . 18552 1 40 . 1 1 15 15 VAL CA C 13 56.8520 0.3 . 1 . . . . 15 VAL CA . 18552 1 41 . 1 1 15 15 VAL CB C 13 29.9000 0.3 . 1 . . . . 15 VAL CB . 18552 1 42 . 1 1 15 15 VAL N N 15 117.9320 0.3 . 1 . . . . 15 VAL N . 18552 1 43 . 1 1 17 17 ARG H H 1 8.2780 0.05 . 1 . . . . 17 ARG HN . 18552 1 44 . 1 1 17 17 ARG HA H 1 4.3040 0.05 . 1 . . . . 17 ARG HA . 18552 1 45 . 1 1 17 17 ARG HB2 H 1 1.7090 0.05 . 2 . . . . 17 ARG HB1 . 18552 1 46 . 1 1 17 17 ARG HB3 H 1 1.7090 0.05 . 2 . . . . 17 ARG HB2 . 18552 1 47 . 1 1 17 17 ARG HG2 H 1 1.7090 0.05 . 2 . . . . 17 ARG HG1 . 18552 1 48 . 1 1 17 17 ARG HG3 H 1 1.7090 0.05 . 2 . . . . 17 ARG HG2 . 18552 1 49 . 1 1 17 17 ARG HD2 H 1 3.1780 0.05 . 2 . . . . 17 ARG HD1 . 18552 1 50 . 1 1 17 17 ARG HD3 H 1 3.1780 0.05 . 2 . . . . 17 ARG HD2 . 18552 1 51 . 1 1 17 17 ARG C C 13 174.2080 0.3 . 1 . . . . 17 ARG C . 18552 1 52 . 1 1 17 17 ARG CA C 13 53.4200 0.3 . 1 . . . . 17 ARG CA . 18552 1 53 . 1 1 17 17 ARG CB C 13 28.0830 0.3 . 1 . . . . 17 ARG CB . 18552 1 54 . 1 1 17 17 ARG N N 15 121.4070 0.3 . 1 . . . . 17 ARG N . 18552 1 55 . 1 1 18 18 GLY H H 1 8.5290 0.05 . 1 . . . . 18 GLY HN . 18552 1 56 . 1 1 18 18 GLY HA2 H 1 4.0090 0.05 . 2 . . . . 18 GLY HA1 . 18552 1 57 . 1 1 18 18 GLY HA3 H 1 4.0130 0.05 . 2 . . . . 18 GLY HA2 . 18552 1 58 . 1 1 18 18 GLY C C 13 171.5410 0.3 . 1 . . . . 18 GLY C . 18552 1 59 . 1 1 18 18 GLY CA C 13 42.5080 0.3 . 1 . . . . 18 GLY CA . 18552 1 60 . 1 1 18 18 GLY N N 15 110.0390 0.3 . 1 . . . . 18 GLY N . 18552 1 61 . 1 1 26 26 SER H H 1 7.7560 0.05 . 1 . . . . 26 SER HN . 18552 1 62 . 1 1 26 26 SER N N 15 115.7950 0.3 . 1 . . . . 26 SER N . 18552 1 63 . 1 1 67 67 GLY CA C 13 42.9140 0.3 . 1 . . . . 67 GLY CA . 18552 1 64 . 1 1 68 68 ARG H H 1 7.8350 0.05 . 1 . . . . 68 ARG HN . 18552 1 65 . 1 1 68 68 ARG HA H 1 4.3100 0.05 . 1 . . . . 68 ARG HA . 18552 1 66 . 1 1 68 68 ARG HB2 H 1 1.8650 0.05 . 2 . . . . 68 ARG HB1 . 18552 1 67 . 1 1 68 68 ARG HB3 H 1 1.7830 0.05 . 2 . . . . 68 ARG HB2 . 18552 1 68 . 1 1 68 68 ARG HD2 H 1 3.1330 0.05 . 2 . . . . 68 ARG HD1 . 18552 1 69 . 1 1 68 68 ARG HD3 H 1 3.1330 0.05 . 2 . . . . 68 ARG HD2 . 18552 1 70 . 1 1 68 68 ARG C C 13 173.5290 0.3 . 1 . . . . 68 ARG C . 18552 1 71 . 1 1 68 68 ARG CA C 13 53.5060 0.3 . 1 . . . . 68 ARG CA . 18552 1 72 . 1 1 68 68 ARG CB C 13 27.8630 0.3 . 1 . . . . 68 ARG CB . 18552 1 73 . 1 1 68 68 ARG N N 15 119.5660 0.3 . 1 . . . . 68 ARG N . 18552 1 74 . 1 1 69 69 SER H H 1 8.0840 0.05 . 1 . . . . 69 SER HN . 18552 1 75 . 1 1 69 69 SER HA H 1 4.4460 0.05 . 1 . . . . 69 SER HA . 18552 1 76 . 1 1 69 69 SER HB2 H 1 3.8170 0.05 . 2 . . . . 69 SER HB1 . 18552 1 77 . 1 1 69 69 SER HB3 H 1 3.8170 0.05 . 2 . . . . 69 SER HB2 . 18552 1 78 . 1 1 69 69 SER C C 13 170.8860 0.3 . 1 . . . . 69 SER C . 18552 1 79 . 1 1 69 69 SER CA C 13 55.5970 0.3 . 1 . . . . 69 SER CA . 18552 1 80 . 1 1 69 69 SER CB C 13 61.0890 0.3 . 1 . . . . 69 SER CB . 18552 1 81 . 1 1 69 69 SER N N 15 115.6330 0.3 . 1 . . . . 69 SER N . 18552 1 82 . 1 1 70 70 ASP H H 1 8.1270 0.05 . 1 . . . . 70 ASP HN . 18552 1 83 . 1 1 70 70 ASP HA H 1 4.8790 0.05 . 1 . . . . 70 ASP HA . 18552 1 84 . 1 1 70 70 ASP HB2 H 1 2.7590 0.05 . 2 . . . . 70 ASP HB1 . 18552 1 85 . 1 1 70 70 ASP HB3 H 1 2.6100 0.05 . 2 . . . . 70 ASP HB2 . 18552 1 86 . 1 1 70 70 ASP C C 13 172.2530 0.3 . 1 . . . . 70 ASP C . 18552 1 87 . 1 1 70 70 ASP CA C 13 49.2230 0.3 . 1 . . . . 70 ASP CA . 18552 1 88 . 1 1 70 70 ASP CB C 13 38.5590 0.3 . 1 . . . . 70 ASP CB . 18552 1 89 . 1 1 70 70 ASP N N 15 122.3540 0.3 . 1 . . . . 70 ASP N . 18552 1 90 . 1 1 71 71 PRO CA C 13 60.8760 0.3 . 1 . . . . 71 PRO CA . 18552 1 91 . 1 1 71 71 PRO CB C 13 28.9740 0.3 . 1 . . . . 71 PRO CB . 18552 1 92 . 1 1 72 72 TYR H H 1 8.0140 0.05 . 1 . . . . 72 TYR HN . 18552 1 93 . 1 1 72 72 TYR HA H 1 4.4270 0.05 . 1 . . . . 72 TYR HA . 18552 1 94 . 1 1 72 72 TYR HB2 H 1 2.9910 0.05 . 2 . . . . 72 TYR HB1 . 18552 1 95 . 1 1 72 72 TYR HB3 H 1 2.8300 0.05 . 2 . . . . 72 TYR HB2 . 18552 1 96 . 1 1 72 72 TYR HD1 H 1 7.8300 0.05 . 3 . . . . 72 TYR HD1 . 18552 1 97 . 1 1 72 72 TYR HD2 H 1 7.8300 0.05 . 3 . . . . 72 TYR HD2 . 18552 1 98 . 1 1 72 72 TYR HE1 H 1 6.7790 0.05 . 3 . . . . 72 TYR HE1 . 18552 1 99 . 1 1 72 72 TYR HE2 H 1 6.7790 0.05 . 3 . . . . 72 TYR HE2 . 18552 1 100 . 1 1 72 72 TYR C C 13 173.1150 0.3 . 1 . . . . 72 TYR C . 18552 1 101 . 1 1 72 72 TYR CA C 13 55.5400 0.3 . 1 . . . . 72 TYR CA . 18552 1 102 . 1 1 72 72 TYR CB C 13 35.1820 0.3 . 1 . . . . 72 TYR CB . 18552 1 103 . 1 1 72 72 TYR N N 15 117.8330 0.3 . 1 . . . . 72 TYR N . 18552 1 104 . 1 1 73 73 HIS H H 1 7.8220 0.05 . 1 . . . . 73 HIS HN . 18552 1 105 . 1 1 73 73 HIS HA H 1 4.5700 0.05 . 1 . . . . 73 HIS HA . 18552 1 106 . 1 1 73 73 HIS HB2 H 1 3.0750 0.05 . 2 . . . . 73 HIS HB1 . 18552 1 107 . 1 1 73 73 HIS HB3 H 1 3.2580 0.05 . 2 . . . . 73 HIS HB2 . 18552 1 108 . 1 1 73 73 HIS HD1 H 1 8.1140 0.05 . 1 . . . . 73 HIS HD1 . 18552 1 109 . 1 1 73 73 HIS HD2 H 1 7.7930 0.05 . 1 . . . . 73 HIS HD2 . 18552 1 110 . 1 1 73 73 HIS HE1 H 1 8.1140 0.05 . 1 . . . . 73 HIS HE1 . 18552 1 111 . 1 1 73 73 HIS HE2 H 1 7.7930 0.05 . 1 . . . . 73 HIS HE2 . 18552 1 112 . 1 1 73 73 HIS C C 13 171.1680 0.3 . 1 . . . . 73 HIS C . 18552 1 113 . 1 1 73 73 HIS CA C 13 52.9420 0.3 . 1 . . . . 73 HIS CA . 18552 1 114 . 1 1 73 73 HIS CB C 13 26.3180 0.3 . 1 . . . . 73 HIS CB . 18552 1 115 . 1 1 73 73 HIS N N 15 118.6840 0.3 . 1 . . . . 73 HIS N . 18552 1 116 . 1 1 74 74 ALA H H 1 8.1400 0.05 . 1 . . . . 74 ALA HN . 18552 1 117 . 1 1 74 74 ALA HA H 1 4.3410 0.05 . 1 . . . . 74 ALA HA . 18552 1 118 . 1 1 74 74 ALA HB1 H 1 1.3710 0.05 . 1 . . . . 74 ALA HB1 . 18552 1 119 . 1 1 74 74 ALA HB2 H 1 1.3710 0.05 . 1 . . . . 74 ALA HB1 . 18552 1 120 . 1 1 74 74 ALA HB3 H 1 1.3710 0.05 . 1 . . . . 74 ALA HB1 . 18552 1 121 . 1 1 74 74 ALA C C 13 175.0710 0.3 . 1 . . . . 74 ALA C . 18552 1 122 . 1 1 74 74 ALA CA C 13 49.9340 0.3 . 1 . . . . 74 ALA CA . 18552 1 123 . 1 1 74 74 ALA CB C 13 16.4930 0.3 . 1 . . . . 74 ALA CB . 18552 1 124 . 1 1 74 74 ALA N N 15 124.5120 0.3 . 1 . . . . 74 ALA N . 18552 1 125 . 1 1 75 75 THR H H 1 8.1040 0.05 . 1 . . . . 75 THR HN . 18552 1 126 . 1 1 75 75 THR HA H 1 4.4000 0.05 . 1 . . . . 75 THR HA . 18552 1 127 . 1 1 75 75 THR HB H 1 4.2380 0.05 . 1 . . . . 75 THR HB . 18552 1 128 . 1 1 75 75 THR HG21 H 1 1.1780 0.05 . 1 . . . . 75 THR HG21 . 18552 1 129 . 1 1 75 75 THR HG22 H 1 1.1780 0.05 . 1 . . . . 75 THR HG21 . 18552 1 130 . 1 1 75 75 THR HG23 H 1 1.1780 0.05 . 1 . . . . 75 THR HG21 . 18552 1 131 . 1 1 75 75 THR C C 13 171.9070 0.3 . 1 . . . . 75 THR C . 18552 1 132 . 1 1 75 75 THR CA C 13 58.9070 0.3 . 1 . . . . 75 THR CA . 18552 1 133 . 1 1 75 75 THR CB C 13 67.0160 0.3 . 1 . . . . 75 THR CB . 18552 1 134 . 1 1 75 75 THR N N 15 112.6350 0.3 . 1 . . . . 75 THR N . 18552 1 135 . 1 1 76 76 THR H H 1 7.9470 0.05 . 1 . . . . 76 THR HN . 18552 1 136 . 1 1 76 76 THR HA H 1 4.4020 0.05 . 1 . . . . 76 THR HA . 18552 1 137 . 1 1 76 76 THR HB H 1 4.2320 0.05 . 1 . . . . 76 THR HB . 18552 1 138 . 1 1 76 76 THR HG21 H 1 1.1840 0.05 . 1 . . . . 76 THR HG21 . 18552 1 139 . 1 1 76 76 THR HG22 H 1 1.1840 0.05 . 1 . . . . 76 THR HG21 . 18552 1 140 . 1 1 76 76 THR HG23 H 1 1.1840 0.05 . 1 . . . . 76 THR HG21 . 18552 1 141 . 1 1 76 76 THR C C 13 171.8680 0.3 . 1 . . . . 76 THR C . 18552 1 142 . 1 1 76 76 THR CA C 13 58.8170 0.3 . 1 . . . . 76 THR CA . 18552 1 143 . 1 1 76 76 THR CB C 13 67.1070 0.3 . 1 . . . . 76 THR CB . 18552 1 144 . 1 1 76 76 THR N N 15 114.6820 0.3 . 1 . . . . 76 THR N . 18552 1 145 . 1 1 77 77 GLY H H 1 8.1240 0.05 . 1 . . . . 77 GLY HN . 18552 1 146 . 1 1 77 77 GLY HA2 H 1 4.0770 0.05 . 2 . . . . 77 GLY HA1 . 18552 1 147 . 1 1 77 77 GLY HA3 H 1 4.0770 0.05 . 2 . . . . 77 GLY HA2 . 18552 1 148 . 1 1 77 77 GLY C C 13 169.3700 0.3 . 1 . . . . 77 GLY C . 18552 1 149 . 1 1 77 77 GLY CA C 13 41.9400 0.3 . 1 . . . . 77 GLY CA . 18552 1 150 . 1 1 77 77 GLY N N 15 110.6410 0.3 . 1 . . . . 77 GLY N . 18552 1 151 . 1 1 78 78 PRO CA C 13 60.1840 0.3 . 1 . . . . 78 PRO CA . 18552 1 152 . 1 1 78 78 PRO CB C 13 28.9190 0.3 . 1 . . . . 78 PRO CB . 18552 1 153 . 1 1 79 79 LEU H H 1 7.8690 0.05 . 1 . . . . 79 LEU HN . 18552 1 154 . 1 1 79 79 LEU HA H 1 4.3260 0.05 . 1 . . . . 79 LEU HA . 18552 1 155 . 1 1 79 79 LEU HB2 H 1 1.5770 0.05 . 2 . . . . 79 LEU HB1 . 18552 1 156 . 1 1 79 79 LEU HB3 H 1 1.5770 0.05 . 2 . . . . 79 LEU HB2 . 18552 1 157 . 1 1 79 79 LEU HG H 1 1.5770 0.05 . 1 . . . . 79 LEU HG . 18552 1 158 . 1 1 79 79 LEU HD11 H 1 0.8910 0.05 . 2 . . . . 79 LEU HD11 . 18552 1 159 . 1 1 79 79 LEU HD12 H 1 0.8910 0.05 . 2 . . . . 79 LEU HD11 . 18552 1 160 . 1 1 79 79 LEU HD13 H 1 0.8910 0.05 . 2 . . . . 79 LEU HD11 . 18552 1 161 . 1 1 79 79 LEU HD21 H 1 0.8910 0.05 . 2 . . . . 79 LEU HD21 . 18552 1 162 . 1 1 79 79 LEU HD22 H 1 0.8910 0.05 . 2 . . . . 79 LEU HD21 . 18552 1 163 . 1 1 79 79 LEU HD23 H 1 0.8910 0.05 . 2 . . . . 79 LEU HD21 . 18552 1 164 . 1 1 79 79 LEU C C 13 173.4440 0.3 . 1 . . . . 79 LEU C . 18552 1 165 . 1 1 79 79 LEU CA C 13 51.9800 0.3 . 1 . . . . 79 LEU CA . 18552 1 166 . 1 1 79 79 LEU CB C 13 39.5980 0.3 . 1 . . . . 79 LEU CB . 18552 1 167 . 1 1 79 79 LEU N N 15 119.8870 0.3 . 1 . . . . 79 LEU N . 18552 1 168 . 1 1 80 80 SER H H 1 8.0310 0.05 . 1 . . . . 80 SER HN . 18552 1 169 . 1 1 80 80 SER HA H 1 4.7170 0.05 . 1 . . . . 80 SER HA . 18552 1 170 . 1 1 80 80 SER HB2 H 1 3.8150 0.05 . 2 . . . . 80 SER HB1 . 18552 1 171 . 1 1 80 80 SER HB3 H 1 3.8150 0.05 . 2 . . . . 80 SER HB2 . 18552 1 172 . 1 1 80 80 SER C C 13 172.0820 0.3 . 1 . . . . 80 SER C . 18552 1 173 . 1 1 80 80 SER CA C 13 53.3930 0.3 . 1 . . . . 80 SER CA . 18552 1 174 . 1 1 80 80 SER CB C 13 60.9130 0.3 . 1 . . . . 80 SER CB . 18552 1 175 . 1 1 80 80 SER N N 15 116.3600 0.3 . 1 . . . . 80 SER N . 18552 1 176 . 1 1 81 81 PRO CA C 13 60.8735 0.3 . 1 . . . . 81 PRO CA . 18552 1 177 . 1 1 81 81 PRO CB C 13 28.9610 0.3 . 1 . . . . 81 PRO CB . 18552 1 178 . 1 1 82 82 SER H H 1 8.2060 0.05 . 1 . . . . 82 SER HN . 18552 1 179 . 1 1 82 82 SER HA H 1 4.4520 0.05 . 1 . . . . 82 SER HA . 18552 1 180 . 1 1 82 82 SER HB2 H 1 3.8990 0.05 . 2 . . . . 82 SER HB1 . 18552 1 181 . 1 1 82 82 SER HB3 H 1 3.8990 0.05 . 2 . . . . 82 SER HB2 . 18552 1 182 . 1 1 82 82 SER C C 13 172.0040 0.3 . 1 . . . . 82 SER C . 18552 1 183 . 1 1 82 82 SER CA C 13 55.8620 0.3 . 1 . . . . 82 SER CA . 18552 1 184 . 1 1 82 82 SER CB C 13 60.8160 0.3 . 1 . . . . 82 SER CB . 18552 1 185 . 1 1 82 82 SER N N 15 114.4700 0.3 . 1 . . . . 82 SER N . 18552 1 186 . 1 1 83 83 LYS H H 1 8.1980 0.05 . 1 . . . . 83 LYS HN . 18552 1 187 . 1 1 83 83 LYS HA H 1 4.2900 0.05 . 1 . . . . 83 LYS HA . 18552 1 188 . 1 1 83 83 LYS HB2 H 1 1.7630 0.05 . 2 . . . . 83 LYS HB1 . 18552 1 189 . 1 1 83 83 LYS HB3 H 1 1.7630 0.05 . 2 . . . . 83 LYS HB2 . 18552 1 190 . 1 1 83 83 LYS HG2 H 1 1.4140 0.05 . 2 . . . . 83 LYS HG1 . 18552 1 191 . 1 1 83 83 LYS HG3 H 1 1.4140 0.05 . 2 . . . . 83 LYS HG2 . 18552 1 192 . 1 1 83 83 LYS HD2 H 1 1.7630 0.05 . 2 . . . . 83 LYS HD1 . 18552 1 193 . 1 1 83 83 LYS HD3 H 1 1.7630 0.05 . 2 . . . . 83 LYS HD2 . 18552 1 194 . 1 1 83 83 LYS HZ1 H 1 7.8420 0.05 . 1 . . . . 83 LYS HZ1 . 18552 1 195 . 1 1 83 83 LYS HZ2 H 1 7.8420 0.05 . 1 . . . . 83 LYS HZ1 . 18552 1 196 . 1 1 83 83 LYS HZ3 H 1 7.8420 0.05 . 1 . . . . 83 LYS HZ1 . 18552 1 197 . 1 1 83 83 LYS C C 13 173.3900 0.3 . 1 . . . . 83 LYS C . 18552 1 198 . 1 1 83 83 LYS CA C 13 53.6730 0.3 . 1 . . . . 83 LYS CA . 18552 1 199 . 1 1 83 83 LYS CB C 13 30.0280 0.3 . 1 . . . . 83 LYS CB . 18552 1 200 . 1 1 83 83 LYS N N 15 122.6880 0.3 . 1 . . . . 83 LYS N . 18552 1 201 . 1 1 84 84 ASP H H 1 8.2100 0.05 . 1 . . . . 84 ASP HN . 18552 1 202 . 1 1 84 84 ASP HA H 1 4.5430 0.05 . 1 . . . . 84 ASP HA . 18552 1 203 . 1 1 84 84 ASP HB2 H 1 2.6130 0.05 . 2 . . . . 84 ASP HB1 . 18552 1 204 . 1 1 84 84 ASP HB3 H 1 2.6130 0.05 . 2 . . . . 84 ASP HB2 . 18552 1 205 . 1 1 84 84 ASP C C 13 173.5060 0.3 . 1 . . . . 84 ASP C . 18552 1 206 . 1 1 84 84 ASP CA C 13 51.3400 0.3 . 1 . . . . 84 ASP CA . 18552 1 207 . 1 1 84 84 ASP CB C 13 38.1260 0.3 . 1 . . . . 84 ASP CB . 18552 1 208 . 1 1 84 84 ASP N N 15 120.5680 0.3 . 1 . . . . 84 ASP N . 18552 1 209 . 1 1 85 85 CYS H H 1 8.1410 0.05 . 1 . . . . 85 CYS HN . 18552 1 210 . 1 1 85 85 CYS HA H 1 4.5880 0.05 . 1 . . . . 85 CYS HA . 18552 1 211 . 1 1 85 85 CYS HB2 H 1 2.9240 0.05 . 2 . . . . 85 CYS HB2 . 18552 1 212 . 1 1 85 85 CYS C C 13 172.1860 0.3 . 1 . . . . 85 CYS C . 18552 1 213 . 1 1 85 85 CYS CA C 13 55.8270 0.3 . 1 . . . . 85 CYS CA . 18552 1 214 . 1 1 85 85 CYS CB C 13 25.2150 0.3 . 1 . . . . 85 CYS CB . 18552 1 215 . 1 1 85 85 CYS N N 15 118.9990 0.3 . 1 . . . . 85 CYS N . 18552 1 216 . 1 1 86 86 GLY H H 1 8.3840 0.05 . 1 . . . . 86 GLY HN . 18552 1 217 . 1 1 86 86 GLY HA2 H 1 3.9460 0.05 . 2 . . . . 86 GLY HA1 . 18552 1 218 . 1 1 86 86 GLY HA3 H 1 3.9460 0.05 . 2 . . . . 86 GLY HA2 . 18552 1 219 . 1 1 86 86 GLY C C 13 170.9180 0.3 . 1 . . . . 86 GLY C . 18552 1 220 . 1 1 86 86 GLY CA C 13 42.3500 0.3 . 1 . . . . 86 GLY CA . 18552 1 221 . 1 1 86 86 GLY N N 15 110.5160 0.3 . 1 . . . . 86 GLY N . 18552 1 222 . 1 1 87 87 SER H H 1 7.9490 0.05 . 1 . . . . 87 SER HN . 18552 1 223 . 1 1 87 87 SER HA H 1 4.6240 0.05 . 1 . . . . 87 SER HA . 18552 1 224 . 1 1 87 87 SER HB2 H 1 3.8130 0.05 . 2 . . . . 87 SER HB1 . 18552 1 225 . 1 1 87 87 SER HB3 H 1 3.8130 0.05 . 2 . . . . 87 SER HB2 . 18552 1 226 . 1 1 87 87 SER C C 13 170.2300 0.3 . 1 . . . . 87 SER C . 18552 1 227 . 1 1 87 87 SER CA C 13 53.3390 0.3 . 1 . . . . 87 SER CA . 18552 1 228 . 1 1 87 87 SER CB C 13 60.6330 0.3 . 1 . . . . 87 SER CB . 18552 1 229 . 1 1 87 87 SER N N 15 116.1980 0.3 . 1 . . . . 87 SER N . 18552 1 230 . 1 1 88 88 PRO CA C 13 60.5910 0.3 . 1 . . . . 88 PRO CA . 18552 1 231 . 1 1 88 88 PRO CB C 13 29.4330 0.3 . 1 . . . . 88 PRO CB . 18552 1 232 . 1 1 89 89 LYS H H 1 8.0830 0.05 . 1 . . . . 89 LYS HN . 18552 1 233 . 1 1 89 89 LYS HA H 1 4.0880 0.05 . 1 . . . . 89 LYS HA . 18552 1 234 . 1 1 89 89 LYS HB2 H 1 1.9400 0.05 . 2 . . . . 89 LYS HB1 . 18552 1 235 . 1 1 89 89 LYS HG2 H 1 1.2020 0.05 . 2 . . . . 89 LYS HG1 . 18552 1 236 . 1 1 89 89 LYS HG3 H 1 1.2020 0.05 . 2 . . . . 89 LYS HG2 . 18552 1 237 . 1 1 89 89 LYS HD2 H 1 1.5960 0.05 . 2 . . . . 89 LYS HD1 . 18552 1 238 . 1 1 89 89 LYS HD3 H 1 1.5960 0.05 . 2 . . . . 89 LYS HD2 . 18552 1 239 . 1 1 89 89 LYS HE2 H 1 2.6630 0.05 . 2 . . . . 89 LYS HE1 . 18552 1 240 . 1 1 89 89 LYS HZ1 H 1 7.7610 0.05 . 1 . . . . 89 LYS HZ1 . 18552 1 241 . 1 1 89 89 LYS HZ2 H 1 7.7610 0.05 . 1 . . . . 89 LYS HZ1 . 18552 1 242 . 1 1 89 89 LYS HZ3 H 1 7.7610 0.05 . 1 . . . . 89 LYS HZ1 . 18552 1 243 . 1 1 89 89 LYS C C 13 173.5720 0.3 . 1 . . . . 89 LYS C . 18552 1 244 . 1 1 89 89 LYS CA C 13 54.1990 0.3 . 1 . . . . 89 LYS CA . 18552 1 245 . 1 1 89 89 LYS CB C 13 29.7460 0.3 . 1 . . . . 89 LYS CB . 18552 1 246 . 1 1 89 89 LYS N N 15 119.9700 0.3 . 1 . . . . 89 LYS N . 18552 1 247 . 1 1 90 90 TYR H H 1 7.6540 0.05 . 1 . . . . 90 TYR HN . 18552 1 248 . 1 1 90 90 TYR HA H 1 4.4670 0.05 . 1 . . . . 90 TYR HA . 18552 1 249 . 1 1 90 90 TYR HB2 H 1 2.9910 0.05 . 2 . . . . 90 TYR HB1 . 18552 1 250 . 1 1 90 90 TYR HB3 H 1 2.8600 0.05 . 2 . . . . 90 TYR HB2 . 18552 1 251 . 1 1 90 90 TYR HD1 H 1 7.0350 0.05 . 3 . . . . 90 TYR HD1 . 18552 1 252 . 1 1 90 90 TYR HD2 H 1 7.0350 0.05 . 3 . . . . 90 TYR HD2 . 18552 1 253 . 1 1 90 90 TYR HE1 H 1 6.6350 0.05 . 3 . . . . 90 TYR HE1 . 18552 1 254 . 1 1 90 90 TYR HE2 H 1 6.6350 0.05 . 3 . . . . 90 TYR HE2 . 18552 1 255 . 1 1 90 90 TYR C C 13 172.9360 0.3 . 1 . . . . 90 TYR C . 18552 1 256 . 1 1 90 90 TYR CA C 13 54.7580 0.3 . 1 . . . . 90 TYR CA . 18552 1 257 . 1 1 90 90 TYR CB C 13 35.7370 0.3 . 1 . . . . 90 TYR CB . 18552 1 258 . 1 1 90 90 TYR N N 15 118.1330 0.3 . 1 . . . . 90 TYR N . 18552 1 259 . 1 1 91 91 ALA H H 1 7.8520 0.05 . 1 . . . . 91 ALA HN . 18552 1 260 . 1 1 91 91 ALA HA H 1 4.1770 0.05 . 1 . . . . 91 ALA HA . 18552 1 261 . 1 1 91 91 ALA HB1 H 1 1.2080 0.05 . 1 . . . . 91 ALA HB1 . 18552 1 262 . 1 1 91 91 ALA HB2 H 1 1.2080 0.05 . 1 . . . . 91 ALA HB1 . 18552 1 263 . 1 1 91 91 ALA HB3 H 1 1.2080 0.05 . 1 . . . . 91 ALA HB1 . 18552 1 264 . 1 1 91 91 ALA C C 13 174.4880 0.3 . 1 . . . . 91 ALA C . 18552 1 265 . 1 1 91 91 ALA CA C 13 50.0250 0.3 . 1 . . . . 91 ALA CA . 18552 1 266 . 1 1 91 91 ALA CB C 13 16.1900 0.3 . 1 . . . . 91 ALA CB . 18552 1 267 . 1 1 91 91 ALA N N 15 123.6390 0.3 . 1 . . . . 91 ALA N . 18552 1 268 . 1 1 92 92 TYR H H 1 7.6390 0.05 . 1 . . . . 92 TYR HN . 18552 1 269 . 1 1 92 92 TYR HA H 1 4.3700 0.05 . 1 . . . . 92 TYR HA . 18552 1 270 . 1 1 92 92 TYR HB2 H 1 2.8020 0.05 . 2 . . . . 92 TYR HB1 . 18552 1 271 . 1 1 92 92 TYR HB3 H 1 2.8020 0.05 . 2 . . . . 92 TYR HB2 . 18552 1 272 . 1 1 92 92 TYR HD1 H 1 6.9070 0.05 . 3 . . . . 92 TYR HD1 . 18552 1 273 . 1 1 92 92 TYR HD2 H 1 6.9070 0.05 . 3 . . . . 92 TYR HD2 . 18552 1 274 . 1 1 92 92 TYR HE1 H 1 6.4750 0.05 . 3 . . . . 92 TYR HE1 . 18552 1 275 . 1 1 92 92 TYR HE2 H 1 6.4750 0.05 . 3 . . . . 92 TYR HE2 . 18552 1 276 . 1 1 92 92 TYR C C 13 172.9740 0.3 . 1 . . . . 92 TYR C . 18552 1 277 . 1 1 92 92 TYR CA C 13 55.4810 0.3 . 1 . . . . 92 TYR CA . 18552 1 278 . 1 1 92 92 TYR CB C 13 35.9390 0.3 . 1 . . . . 92 TYR CB . 18552 1 279 . 1 1 92 92 TYR N N 15 117.5200 0.3 . 1 . . . . 92 TYR N . 18552 1 280 . 1 1 93 93 PHE H H 1 7.8070 0.05 . 1 . . . . 93 PHE HN . 18552 1 281 . 1 1 93 93 PHE HA H 1 4.5440 0.05 . 1 . . . . 93 PHE HA . 18552 1 282 . 1 1 93 93 PHE HB2 H 1 3.1340 0.05 . 2 . . . . 93 PHE HB1 . 18552 1 283 . 1 1 93 93 PHE HB3 H 1 2.9710 0.05 . 2 . . . . 93 PHE HB2 . 18552 1 284 . 1 1 93 93 PHE C C 13 172.6550 0.3 . 1 . . . . 93 PHE C . 18552 1 285 . 1 1 93 93 PHE CA C 13 55.2130 0.3 . 1 . . . . 93 PHE CA . 18552 1 286 . 1 1 93 93 PHE CB C 13 36.4090 0.3 . 1 . . . . 93 PHE CB . 18552 1 287 . 1 1 93 93 PHE N N 15 119.1960 0.3 . 1 . . . . 93 PHE N . 18552 1 288 . 1 1 94 94 ASN H H 1 8.1020 0.05 . 1 . . . . 94 ASN HN . 18552 1 289 . 1 1 94 94 ASN HB2 H 1 2.7060 0.05 . 2 . . . . 94 ASN HB1 . 18552 1 290 . 1 1 94 94 ASN HB3 H 1 2.7060 0.05 . 2 . . . . 94 ASN HB2 . 18552 1 291 . 1 1 94 94 ASN HD21 H 1 7.6440 0.05 . 2 . . . . 94 ASN HD21 . 18552 1 292 . 1 1 94 94 ASN HD22 H 1 7.1030 0.05 . 2 . . . . 94 ASN HD22 . 18552 1 293 . 1 1 94 94 ASN C C 13 172.7790 0.3 . 1 . . . . 94 ASN C . 18552 1 294 . 1 1 94 94 ASN CA C 13 50.5240 0.3 . 1 . . . . 94 ASN CA . 18552 1 295 . 1 1 94 94 ASN CB C 13 36.1720 0.3 . 1 . . . . 94 ASN CB . 18552 1 296 . 1 1 94 94 ASN N N 15 119.6210 0.3 . 1 . . . . 94 ASN N . 18552 1 297 . 1 1 95 95 GLY H H 1 7.8400 0.05 . 1 . . . . 95 GLY HN . 18552 1 298 . 1 1 95 95 GLY HA2 H 1 3.8830 0.05 . 2 . . . . 95 GLY HA1 . 18552 1 299 . 1 1 95 95 GLY HA3 H 1 3.8830 0.05 . 2 . . . . 95 GLY HA2 . 18552 1 300 . 1 1 95 95 GLY C C 13 171.3020 0.3 . 1 . . . . 95 GLY C . 18552 1 301 . 1 1 95 95 GLY CA C 13 42.7650 0.3 . 1 . . . . 95 GLY CA . 18552 1 302 . 1 1 95 95 GLY N N 15 108.1200 0.3 . 1 . . . . 95 GLY N . 18552 1 303 . 1 1 96 96 CYS H H 1 8.0090 0.05 . 1 . . . . 96 CYS HN . 18552 1 304 . 1 1 96 96 CYS HA H 1 4.5050 0.05 . 1 . . . . 96 CYS HA . 18552 1 305 . 1 1 96 96 CYS HB2 H 1 2.9040 0.05 . 2 . . . . 96 CYS HB1 . 18552 1 306 . 1 1 96 96 CYS C C 13 171.6340 0.3 . 1 . . . . 96 CYS C . 18552 1 307 . 1 1 96 96 CYS CA C 13 55.5330 0.3 . 1 . . . . 96 CYS CA . 18552 1 308 . 1 1 96 96 CYS CB C 13 25.3450 0.3 . 1 . . . . 96 CYS CB . 18552 1 309 . 1 1 96 96 CYS N N 15 118.1070 0.3 . 1 . . . . 96 CYS N . 18552 1 310 . 1 1 97 97 SER H H 1 8.2450 0.05 . 1 . . . . 97 SER HN . 18552 1 311 . 1 1 97 97 SER HA H 1 4.4950 0.05 . 1 . . . . 97 SER HA . 18552 1 312 . 1 1 97 97 SER HB2 H 1 3.8230 0.05 . 2 . . . . 97 SER HB1 . 18552 1 313 . 1 1 97 97 SER HB3 H 1 3.8230 0.05 . 2 . . . . 97 SER HB2 . 18552 1 314 . 1 1 97 97 SER C C 13 171.0880 0.3 . 1 . . . . 97 SER C . 18552 1 315 . 1 1 97 97 SER CA C 13 55.7750 0.3 . 1 . . . . 97 SER CA . 18552 1 316 . 1 1 97 97 SER CB C 13 61.0850 0.3 . 1 . . . . 97 SER CB . 18552 1 317 . 1 1 97 97 SER N N 15 117.3970 0.3 . 1 . . . . 97 SER N . 18552 1 318 . 1 1 98 98 SER H H 1 8.0690 0.05 . 1 . . . . 98 SER HN . 18552 1 319 . 1 1 98 98 SER HA H 1 4.6430 0.05 . 1 . . . . 98 SER HA . 18552 1 320 . 1 1 98 98 SER HB2 H 1 3.8120 0.05 . 2 . . . . 98 SER HB1 . 18552 1 321 . 1 1 98 98 SER HB3 H 1 3.8120 0.05 . 2 . . . . 98 SER HB2 . 18552 1 322 . 1 1 98 98 SER C C 13 170.3400 0.3 . 1 . . . . 98 SER C . 18552 1 323 . 1 1 98 98 SER CA C 13 53.2940 0.3 . 1 . . . . 98 SER CA . 18552 1 324 . 1 1 98 98 SER CB C 13 60.8710 0.3 . 1 . . . . 98 SER CB . 18552 1 325 . 1 1 98 98 SER N N 15 117.6540 0.3 . 1 . . . . 98 SER N . 18552 1 326 . 1 1 99 99 PRO CA C 13 60.7070 0.3 . 1 . . . . 99 PRO CA . 18552 1 327 . 1 1 99 99 PRO CB C 13 29.0840 0.3 . 1 . . . . 99 PRO CB . 18552 1 328 . 1 1 100 100 THR H H 1 7.8820 0.05 . 1 . . . . 100 THR HN . 18552 1 329 . 1 1 100 100 THR HA H 1 4.2790 0.05 . 1 . . . . 100 THR HA . 18552 1 330 . 1 1 100 100 THR HB H 1 4.2070 0.05 . 1 . . . . 100 THR HB . 18552 1 331 . 1 1 100 100 THR HG21 H 1 1.1450 0.05 . 1 . . . . 100 THR HG21 . 18552 1 332 . 1 1 100 100 THR HG22 H 1 1.1450 0.05 . 1 . . . . 100 THR HG21 . 18552 1 333 . 1 1 100 100 THR HG23 H 1 1.1450 0.05 . 1 . . . . 100 THR HG21 . 18552 1 334 . 1 1 100 100 THR C C 13 171.1440 0.3 . 1 . . . . 100 THR C . 18552 1 335 . 1 1 100 100 THR CA C 13 58.6400 0.3 . 1 . . . . 100 THR CA . 18552 1 336 . 1 1 100 100 THR CB C 13 66.9690 0.3 . 1 . . . . 100 THR CB . 18552 1 337 . 1 1 100 100 THR N N 15 111.6220 0.3 . 1 . . . . 100 THR N . 18552 1 338 . 1 1 101 101 ALA H H 1 7.9350 0.05 . 1 . . . . 101 ALA HN . 18552 1 339 . 1 1 101 101 ALA HA H 1 4.5410 0.05 . 1 . . . . 101 ALA HA . 18552 1 340 . 1 1 101 101 ALA HB1 H 1 1.3510 0.05 . 1 . . . . 101 ALA HB1 . 18552 1 341 . 1 1 101 101 ALA HB2 H 1 1.3510 0.05 . 1 . . . . 101 ALA HB1 . 18552 1 342 . 1 1 101 101 ALA HB3 H 1 1.3510 0.05 . 1 . . . . 101 ALA HB1 . 18552 1 343 . 1 1 101 101 ALA C C 13 172.7300 0.3 . 1 . . . . 101 ALA C . 18552 1 344 . 1 1 101 101 ALA CA C 13 47.9490 0.3 . 1 . . . . 101 ALA CA . 18552 1 345 . 1 1 101 101 ALA CB C 13 15.6370 0.3 . 1 . . . . 101 ALA CB . 18552 1 346 . 1 1 101 101 ALA N N 15 126.5820 0.3 . 1 . . . . 101 ALA N . 18552 1 347 . 1 1 102 102 PRO CA C 13 60.5210 0.3 . 1 . . . . 102 PRO CA . 18552 1 348 . 1 1 102 102 PRO CB C 13 29.2100 0.3 . 1 . . . . 102 PRO CB . 18552 1 349 . 1 1 103 103 LEU H H 1 8.1040 0.05 . 1 . . . . 103 LEU HN . 18552 1 350 . 1 1 103 103 LEU HA H 1 4.3460 0.05 . 1 . . . . 103 LEU HA . 18552 1 351 . 1 1 103 103 LEU HB2 H 1 1.5900 0.05 . 2 . . . . 103 LEU HB1 . 18552 1 352 . 1 1 103 103 LEU HB3 H 1 1.5900 0.05 . 2 . . . . 103 LEU HB2 . 18552 1 353 . 1 1 103 103 LEU HG H 1 1.5900 0.05 . 1 . . . . 103 LEU HG . 18552 1 354 . 1 1 103 103 LEU HD11 H 1 0.8330 0.05 . 2 . . . . 103 LEU HD11 . 18552 1 355 . 1 1 103 103 LEU HD12 H 1 0.8330 0.05 . 2 . . . . 103 LEU HD11 . 18552 1 356 . 1 1 103 103 LEU HD13 H 1 0.8330 0.05 . 2 . . . . 103 LEU HD11 . 18552 1 357 . 1 1 103 103 LEU HD21 H 1 0.8330 0.05 . 2 . . . . 103 LEU HD21 . 18552 1 358 . 1 1 103 103 LEU HD22 H 1 0.8330 0.05 . 2 . . . . 103 LEU HD21 . 18552 1 359 . 1 1 103 103 LEU HD23 H 1 0.8330 0.05 . 2 . . . . 103 LEU HD21 . 18552 1 360 . 1 1 103 103 LEU C C 13 174.0620 0.3 . 1 . . . . 103 LEU C . 18552 1 361 . 1 1 103 103 LEU CA C 13 51.9370 0.3 . 1 . . . . 103 LEU CA . 18552 1 362 . 1 1 103 103 LEU CB C 13 39.3230 0.3 . 1 . . . . 103 LEU CB . 18552 1 363 . 1 1 103 103 LEU N N 15 120.4080 0.3 . 1 . . . . 103 LEU N . 18552 1 364 . 1 1 104 104 SER H H 1 7.9610 0.05 . 1 . . . . 104 SER HN . 18552 1 365 . 1 1 104 104 SER HA H 1 4.6240 0.05 . 1 . . . . 104 SER HA . 18552 1 366 . 1 1 104 104 SER HB2 H 1 3.8070 0.05 . 2 . . . . 104 SER HB1 . 18552 1 367 . 1 1 104 104 SER HB3 H 1 3.8070 0.05 . 2 . . . . 104 SER HB2 . 18552 1 368 . 1 1 104 104 SER C C 13 170.1800 0.3 . 1 . . . . 104 SER C . 18552 1 369 . 1 1 104 104 SER CA C 13 53.3230 0.3 . 1 . . . . 104 SER CA . 18552 1 370 . 1 1 104 104 SER CB C 13 60.7090 0.3 . 1 . . . . 104 SER CB . 18552 1 371 . 1 1 104 104 SER N N 15 116.6350 0.3 . 1 . . . . 104 SER N . 18552 1 372 . 1 1 105 105 PRO CA C 13 60.8730 0.3 . 1 . . . . 105 PRO CA . 18552 1 373 . 1 1 105 105 PRO CB C 13 28.9320 0.3 . 1 . . . . 105 PRO CB . 18552 1 374 . 1 1 106 106 MET H H 1 8.0090 0.05 . 1 . . . . 106 MET HN . 18552 1 375 . 1 1 106 106 MET HA H 1 4.2570 0.05 . 1 . . . . 106 MET HA . 18552 1 376 . 1 1 106 106 MET HB2 H 1 2.0570 0.05 . 2 . . . . 106 MET HB1 . 18552 1 377 . 1 1 106 106 MET HB3 H 1 1.9370 0.05 . 2 . . . . 106 MET HB2 . 18552 1 378 . 1 1 106 106 MET HG2 H 1 2.4900 0.05 . 2 . . . . 106 MET HG1 . 18552 1 379 . 1 1 106 106 MET HG3 H 1 2.4900 0.05 . 2 . . . . 106 MET HG2 . 18552 1 380 . 1 1 106 106 MET C C 13 172.7670 0.3 . 1 . . . . 106 MET C . 18552 1 381 . 1 1 106 106 MET CA C 13 52.5090 0.3 . 1 . . . . 106 MET CA . 18552 1 382 . 1 1 106 106 MET CB C 13 30.2210 0.3 . 1 . . . . 106 MET CB . 18552 1 383 . 1 1 106 106 MET N N 15 118.1070 0.3 . 1 . . . . 106 MET N . 18552 1 384 . 1 1 107 107 SER H H 1 7.9510 0.05 . 1 . . . . 107 SER HN . 18552 1 385 . 1 1 107 107 SER HA H 1 4.6480 0.05 . 1 . . . . 107 SER HA . 18552 1 386 . 1 1 107 107 SER HB2 H 1 3.7510 0.05 . 2 . . . . 107 SER HB1 . 18552 1 387 . 1 1 107 107 SER HB3 H 1 3.7510 0.05 . 2 . . . . 107 SER HB2 . 18552 1 388 . 1 1 107 107 SER C C 13 170.1800 0.3 . 1 . . . . 107 SER C . 18552 1 389 . 1 1 107 107 SER CA C 13 53.2930 0.3 . 1 . . . . 107 SER CA . 18552 1 390 . 1 1 107 107 SER CB C 13 60.7150 0.3 . 1 . . . . 107 SER CB . 18552 1 391 . 1 1 107 107 SER N N 15 116.7590 0.3 . 1 . . . . 107 SER N . 18552 1 392 . 1 1 109 109 PRO CA C 13 60.7520 0.3 . 1 . . . . 109 PRO CA . 18552 1 393 . 1 1 109 109 PRO CB C 13 28.5840 0.3 . 1 . . . . 109 PRO CB . 18552 1 394 . 1 1 110 110 GLY H H 1 8.2700 0.05 . 1 . . . . 110 GLY HN . 18552 1 395 . 1 1 110 110 GLY HA2 H 1 3.9600 0.05 . 2 . . . . 110 GLY HA1 . 18552 1 396 . 1 1 110 110 GLY HA3 H 1 3.9600 0.05 . 2 . . . . 110 GLY HA2 . 18552 1 397 . 1 1 110 110 GLY C C 13 171.6600 0.3 . 1 . . . . 110 GLY C . 18552 1 398 . 1 1 110 110 GLY CA C 13 42.6590 0.3 . 1 . . . . 110 GLY CA . 18552 1 399 . 1 1 110 110 GLY N N 15 107.7660 0.3 . 1 . . . . 110 GLY N . 18552 1 400 . 1 1 111 111 TYR H H 1 7.7630 0.05 . 1 . . . . 111 TYR HN . 18552 1 401 . 1 1 111 111 TYR HA H 1 4.3450 0.05 . 1 . . . . 111 TYR HA . 18552 1 402 . 1 1 111 111 TYR HB2 H 1 2.9760 0.05 . 2 . . . . 111 TYR HB1 . 18552 1 403 . 1 1 111 111 TYR HB3 H 1 2.9760 0.05 . 2 . . . . 111 TYR HB2 . 18552 1 404 . 1 1 111 111 TYR HD1 H 1 7.0210 0.05 . 3 . . . . 111 TYR HD1 . 18552 1 405 . 1 1 111 111 TYR HD2 H 1 7.0210 0.05 . 3 . . . . 111 TYR HD2 . 18552 1 406 . 1 1 111 111 TYR HE1 H 1 6.7680 0.05 . 3 . . . . 111 TYR HE1 . 18552 1 407 . 1 1 111 111 TYR HE2 H 1 6.7680 0.05 . 3 . . . . 111 TYR HE2 . 18552 1 408 . 1 1 111 111 TYR C C 13 173.6830 0.3 . 1 . . . . 111 TYR C . 18552 1 409 . 1 1 111 111 TYR CA C 13 56.2930 0.3 . 1 . . . . 111 TYR CA . 18552 1 410 . 1 1 111 111 TYR CB C 13 35.7740 0.3 . 1 . . . . 111 TYR CB . 18552 1 411 . 1 1 111 111 TYR N N 15 119.5560 0.3 . 1 . . . . 111 TYR N . 18552 1 412 . 1 1 112 112 LYS H H 1 8.1440 0.05 . 1 . . . . 112 LYS HN . 18552 1 413 . 1 1 112 112 LYS HA H 1 4.4220 0.05 . 1 . . . . 112 LYS HA . 18552 1 414 . 1 1 112 112 LYS C C 13 173.7910 0.3 . 1 . . . . 112 LYS C . 18552 1 415 . 1 1 112 112 LYS CA C 13 53.3590 0.3 . 1 . . . . 112 LYS CA . 18552 1 416 . 1 1 112 112 LYS CB C 13 29.7740 0.3 . 1 . . . . 112 LYS CB . 18552 1 417 . 1 1 112 112 LYS N N 15 119.4750 0.3 . 1 . . . . 112 LYS N . 18552 1 418 . 1 1 113 113 LEU H H 1 7.7880 0.05 . 1 . . . . 113 LEU HN . 18552 1 419 . 1 1 113 113 LEU HA H 1 4.2210 0.05 . 1 . . . . 113 LEU HA . 18552 1 420 . 1 1 113 113 LEU HB2 H 1 1.6160 0.05 . 2 . . . . 113 LEU HB1 . 18552 1 421 . 1 1 113 113 LEU HB3 H 1 1.6160 0.05 . 2 . . . . 113 LEU HB2 . 18552 1 422 . 1 1 113 113 LEU HG H 1 1.6160 0.05 . 1 . . . . 113 LEU HG . 18552 1 423 . 1 1 113 113 LEU HD11 H 1 0.8580 0.05 . 2 . . . . 113 LEU HD11 . 18552 1 424 . 1 1 113 113 LEU HD12 H 1 0.8580 0.05 . 2 . . . . 113 LEU HD11 . 18552 1 425 . 1 1 113 113 LEU HD13 H 1 0.8580 0.05 . 2 . . . . 113 LEU HD11 . 18552 1 426 . 1 1 113 113 LEU HD21 H 1 0.8580 0.05 . 2 . . . . 113 LEU HD21 . 18552 1 427 . 1 1 113 113 LEU HD22 H 1 0.8580 0.05 . 2 . . . . 113 LEU HD21 . 18552 1 428 . 1 1 113 113 LEU HD23 H 1 0.8580 0.05 . 2 . . . . 113 LEU HD21 . 18552 1 429 . 1 1 113 113 LEU C C 13 174.7080 0.3 . 1 . . . . 113 LEU C . 18552 1 430 . 1 1 113 113 LEU CA C 13 53.4410 0.3 . 1 . . . . 113 LEU CA . 18552 1 431 . 1 1 113 113 LEU CB C 13 39.4530 0.3 . 1 . . . . 113 LEU CB . 18552 1 432 . 1 1 113 113 LEU N N 15 120.8130 0.3 . 1 . . . . 113 LEU N . 18552 1 433 . 1 1 114 114 VAL H H 1 7.7270 0.05 . 1 . . . . 114 VAL HN . 18552 1 434 . 1 1 114 114 VAL HA H 1 4.1120 0.05 . 1 . . . . 114 VAL HA . 18552 1 435 . 1 1 114 114 VAL HB H 1 2.1220 0.05 . 1 . . . . 114 VAL HB . 18552 1 436 . 1 1 114 114 VAL HG11 H 1 0.8960 0.05 . 2 . . . . 114 VAL HG11 . 18552 1 437 . 1 1 114 114 VAL HG12 H 1 0.8960 0.05 . 2 . . . . 114 VAL HG11 . 18552 1 438 . 1 1 114 114 VAL HG13 H 1 0.8960 0.05 . 2 . . . . 114 VAL HG11 . 18552 1 439 . 1 1 114 114 VAL HG21 H 1 0.8910 0.05 . 2 . . . . 114 VAL HG21 . 18552 1 440 . 1 1 114 114 VAL HG22 H 1 0.8910 0.05 . 2 . . . . 114 VAL HG21 . 18552 1 441 . 1 1 114 114 VAL HG23 H 1 0.8910 0.05 . 2 . . . . 114 VAL HG21 . 18552 1 442 . 1 1 114 114 VAL C C 13 173.5800 0.3 . 1 . . . . 114 VAL C . 18552 1 443 . 1 1 114 114 VAL CA C 13 60.0570 0.3 . 1 . . . . 114 VAL CA . 18552 1 444 . 1 1 114 114 VAL CB C 13 29.6860 0.3 . 1 . . . . 114 VAL CB . 18552 1 445 . 1 1 114 114 VAL N N 15 117.2100 0.3 . 1 . . . . 114 VAL N . 18552 1 446 . 1 1 115 115 THR H H 1 7.8160 0.05 . 1 . . . . 115 THR HN . 18552 1 447 . 1 1 115 115 THR HA H 1 4.3200 0.05 . 1 . . . . 115 THR HA . 18552 1 448 . 1 1 115 115 THR HB H 1 4.2710 0.05 . 1 . . . . 115 THR HB . 18552 1 449 . 1 1 115 115 THR C C 13 172.5430 0.3 . 1 . . . . 115 THR C . 18552 1 450 . 1 1 115 115 THR CA C 13 59.1680 0.3 . 1 . . . . 115 THR CA . 18552 1 451 . 1 1 115 115 THR CB C 13 67.0850 0.3 . 1 . . . . 115 THR CB . 18552 1 452 . 1 1 115 115 THR N N 15 113.3300 0.3 . 1 . . . . 115 THR N . 18552 1 453 . 1 1 116 116 GLY H H 1 8.0450 0.05 . 1 . . . . 116 GLY HN . 18552 1 454 . 1 1 116 116 GLY HA2 H 1 3.9420 0.05 . 2 . . . . 116 GLY HA1 . 18552 1 455 . 1 1 116 116 GLY HA3 H 1 3.9420 0.05 . 2 . . . . 116 GLY HA2 . 18552 1 456 . 1 1 116 116 GLY C C 13 171.0430 0.3 . 1 . . . . 116 GLY C . 18552 1 457 . 1 1 116 116 GLY CA C 13 42.6250 0.3 . 1 . . . . 116 GLY CA . 18552 1 458 . 1 1 116 116 GLY N N 15 110.0960 0.3 . 1 . . . . 116 GLY N . 18552 1 459 . 1 1 117 117 ASP H H 1 8.1730 0.05 . 1 . . . . 117 ASP HN . 18552 1 460 . 1 1 117 117 ASP HA H 1 4.5870 0.05 . 1 . . . . 117 ASP HA . 18552 1 461 . 1 1 117 117 ASP HB2 H 1 2.6090 0.05 . 2 . . . . 117 ASP HB1 . 18552 1 462 . 1 1 117 117 ASP HB3 H 1 2.6090 0.05 . 2 . . . . 117 ASP HB2 . 18552 1 463 . 1 1 117 117 ASP C C 13 173.8710 0.3 . 1 . . . . 117 ASP C . 18552 1 464 . 1 1 117 117 ASP CA C 13 51.4400 0.3 . 1 . . . . 117 ASP CA . 18552 1 465 . 1 1 117 117 ASP CB C 13 38.2580 0.3 . 1 . . . . 117 ASP CB . 18552 1 466 . 1 1 117 117 ASP N N 15 120.3200 0.3 . 1 . . . . 117 ASP N . 18552 1 467 . 1 1 118 118 ARG H H 1 8.2320 0.05 . 1 . . . . 118 ARG HN . 18552 1 468 . 1 1 118 118 ARG HA H 1 4.2500 0.05 . 1 . . . . 118 ARG HA . 18552 1 469 . 1 1 118 118 ARG HB2 H 1 1.7570 0.05 . 2 . . . . 118 ARG HB1 . 18552 1 470 . 1 1 118 118 ARG HB3 H 1 1.7570 0.05 . 2 . . . . 118 ARG HB2 . 18552 1 471 . 1 1 118 118 ARG HG2 H 1 1.7570 0.05 . 2 . . . . 118 ARG HG1 . 18552 1 472 . 1 1 118 118 ARG HG3 H 1 1.7570 0.05 . 2 . . . . 118 ARG HG2 . 18552 1 473 . 1 1 118 118 ARG C C 13 173.6380 0.3 . 1 . . . . 118 ARG C . 18552 1 474 . 1 1 118 118 ARG CA C 13 53.6580 0.3 . 1 . . . . 118 ARG CA . 18552 1 475 . 1 1 118 118 ARG CB C 13 27.5100 0.3 . 1 . . . . 118 ARG CB . 18552 1 476 . 1 1 118 118 ARG N N 15 121.1410 0.3 . 1 . . . . 118 ARG N . 18552 1 477 . 1 1 119 119 ASN H H 1 8.3630 0.05 . 1 . . . . 119 ASN HN . 18552 1 478 . 1 1 119 119 ASN HA H 1 4.5770 0.05 . 1 . . . . 119 ASN HA . 18552 1 479 . 1 1 119 119 ASN HB2 H 1 2.7180 0.05 . 2 . . . . 119 ASN HB1 . 18552 1 480 . 1 1 119 119 ASN HB3 H 1 2.7180 0.05 . 2 . . . . 119 ASN HB2 . 18552 1 481 . 1 1 119 119 ASN C C 13 172.3930 0.3 . 1 . . . . 119 ASN C . 18552 1 482 . 1 1 119 119 ASN CA C 13 50.7160 0.3 . 1 . . . . 119 ASN CA . 18552 1 483 . 1 1 119 119 ASN CB C 13 35.9250 0.3 . 1 . . . . 119 ASN CB . 18552 1 484 . 1 1 119 119 ASN N N 15 118.3630 0.3 . 1 . . . . 119 ASN N . 18552 1 485 . 1 1 120 120 ASN H H 1 8.2020 0.05 . 1 . . . . 120 ASN HN . 18552 1 486 . 1 1 120 120 ASN HA H 1 4.7050 0.05 . 1 . . . . 120 ASN HA . 18552 1 487 . 1 1 120 120 ASN HB2 H 1 2.7990 0.05 . 2 . . . . 120 ASN HB1 . 18552 1 488 . 1 1 120 120 ASN HB3 H 1 2.7990 0.05 . 2 . . . . 120 ASN HB2 . 18552 1 489 . 1 1 120 120 ASN C C 13 172.8280 0.3 . 1 . . . . 120 ASN C . 18552 1 490 . 1 1 120 120 ASN CA C 13 50.5840 0.3 . 1 . . . . 120 ASN CA . 18552 1 491 . 1 1 120 120 ASN CB C 13 35.8500 0.3 . 1 . . . . 120 ASN CB . 18552 1 492 . 1 1 120 120 ASN N N 15 118.9530 0.3 . 1 . . . . 120 ASN N . 18552 1 493 . 1 1 121 121 SER H H 1 8.2630 0.05 . 1 . . . . 121 SER HN . 18552 1 494 . 1 1 121 121 SER HA H 1 4.4620 0.05 . 1 . . . . 121 SER HA . 18552 1 495 . 1 1 121 121 SER HB2 H 1 3.8790 0.05 . 2 . . . . 121 SER HB1 . 18552 1 496 . 1 1 121 121 SER HB3 H 1 3.8790 0.05 . 2 . . . . 121 SER HB2 . 18552 1 497 . 1 1 121 121 SER C C 13 174.0210 0.3 . 1 . . . . 121 SER C . 18552 1 498 . 1 1 121 121 SER CA C 13 56.2270 0.3 . 1 . . . . 121 SER CA . 18552 1 499 . 1 1 121 121 SER CB C 13 61.3180 0.3 . 1 . . . . 121 SER CB . 18552 1 500 . 1 1 121 121 SER N N 15 117.2190 0.3 . 1 . . . . 121 SER N . 18552 1 501 . 1 1 122 122 SER H H 1 8.2630 0.05 . 1 . . . . 122 SER HN . 18552 1 502 . 1 1 122 122 SER HA H 1 4.4910 0.05 . 1 . . . . 122 SER HA . 18552 1 503 . 1 1 122 122 SER HB2 H 1 3.8970 0.05 . 2 . . . . 122 SER HB1 . 18552 1 504 . 1 1 122 122 SER HB3 H 1 3.8970 0.05 . 2 . . . . 122 SER HB2 . 18552 1 505 . 1 1 122 122 SER C C 13 171.6920 0.3 . 1 . . . . 122 SER C . 18552 1 506 . 1 1 122 122 SER CA C 13 55.6950 0.3 . 1 . . . . 122 SER CA . 18552 1 507 . 1 1 122 122 SER CB C 13 60.4550 0.3 . 1 . . . . 122 SER CB . 18552 1 508 . 1 1 122 122 SER N N 15 117.2190 0.3 . 1 . . . . 122 SER N . 18552 1 509 . 1 1 123 123 CYS H H 1 8.1300 0.05 . 1 . . . . 123 CYS HN . 18552 1 510 . 1 1 123 123 CYS HA H 1 4.4640 0.05 . 1 . . . . 123 CYS HA . 18552 1 511 . 1 1 123 123 CYS HB2 H 1 2.9200 0.05 . 2 . . . . 123 CYS HB1 . 18552 1 512 . 1 1 123 123 CYS C C 13 174.2120 0.3 . 1 . . . . 123 CYS C . 18552 1 513 . 1 1 123 123 CYS CA C 13 56.0000 0.3 . 1 . . . . 123 CYS CA . 18552 1 514 . 1 1 123 123 CYS CB C 13 24.3280 0.3 . 1 . . . . 123 CYS CB . 18552 1 515 . 1 1 123 123 CYS N N 15 120.0450 0.3 . 1 . . . . 123 CYS N . 18552 1 516 . 1 1 124 124 ARG H H 1 8.1520 0.05 . 1 . . . . 124 ARG HN . 18552 1 517 . 1 1 124 124 ARG HA H 1 4.2610 0.05 . 1 . . . . 124 ARG HA . 18552 1 518 . 1 1 124 124 ARG HB2 H 1 1.7240 0.05 . 2 . . . . 124 ARG HB1 . 18552 1 519 . 1 1 124 124 ARG HB3 H 1 1.7240 0.05 . 2 . . . . 124 ARG HB2 . 18552 1 520 . 1 1 124 124 ARG HG2 H 1 1.7240 0.05 . 2 . . . . 124 ARG HG1 . 18552 1 521 . 1 1 124 124 ARG HG3 H 1 1.7240 0.05 . 2 . . . . 124 ARG HG2 . 18552 1 522 . 1 1 124 124 ARG HD2 H 1 3.1520 0.05 . 2 . . . . 124 ARG HD1 . 18552 1 523 . 1 1 124 124 ARG HD3 H 1 3.1520 0.05 . 2 . . . . 124 ARG HD2 . 18552 1 524 . 1 1 124 124 ARG C C 13 173.1130 0.3 . 1 . . . . 124 ARG C . 18552 1 525 . 1 1 124 124 ARG CA C 13 56.1400 0.3 . 1 . . . . 124 ARG CA . 18552 1 526 . 1 1 124 124 ARG CB C 13 27.2390 0.3 . 1 . . . . 124 ARG CB . 18552 1 527 . 1 1 124 124 ARG N N 15 122.2800 0.3 . 1 . . . . 124 ARG N . 18552 1 528 . 1 1 125 125 ASN H H 1 8.1410 0.05 . 1 . . . . 125 ASN HN . 18552 1 529 . 1 1 125 125 ASN HA H 1 4.4370 0.05 . 1 . . . . 125 ASN HA . 18552 1 530 . 1 1 125 125 ASN C C 13 172.0770 0.3 . 1 . . . . 125 ASN C . 18552 1 531 . 1 1 125 125 ASN CA C 13 50.4090 0.3 . 1 . . . . 125 ASN CA . 18552 1 532 . 1 1 125 125 ASN CB C 13 35.6730 0.3 . 1 . . . . 125 ASN CB . 18552 1 533 . 1 1 125 125 ASN N N 15 118.9990 0.3 . 1 . . . . 125 ASN N . 18552 1 534 . 1 1 126 126 TYR H H 1 7.9630 0.05 . 1 . . . . 126 TYR HN . 18552 1 535 . 1 1 126 126 TYR HA H 1 4.4700 0.05 . 1 . . . . 126 TYR HA . 18552 1 536 . 1 1 126 126 TYR HB2 H 1 2.9690 0.05 . 2 . . . . 126 TYR HB1 . 18552 1 537 . 1 1 126 126 TYR HB3 H 1 2.9690 0.05 . 2 . . . . 126 TYR HB2 . 18552 1 538 . 1 1 126 126 TYR HD1 H 1 7.0600 0.05 . 3 . . . . 126 TYR HD1 . 18552 1 539 . 1 1 126 126 TYR HD2 H 1 7.0600 0.05 . 3 . . . . 126 TYR HD2 . 18552 1 540 . 1 1 126 126 TYR HE1 H 1 6.7880 0.05 . 3 . . . . 126 TYR HE1 . 18552 1 541 . 1 1 126 126 TYR HE2 H 1 6.7880 0.05 . 3 . . . . 126 TYR HE2 . 18552 1 542 . 1 1 126 126 TYR C C 13 174.2240 0.3 . 1 . . . . 126 TYR C . 18552 1 543 . 1 1 126 126 TYR CA C 13 55.5240 0.3 . 1 . . . . 126 TYR CA . 18552 1 544 . 1 1 126 126 TYR CB C 13 35.6750 0.3 . 1 . . . . 126 TYR CB . 18552 1 545 . 1 1 126 126 TYR N N 15 120.6130 0.3 . 1 . . . . 126 TYR N . 18552 1 546 . 1 1 127 127 ASN H H 1 8.1710 0.05 . 1 . . . . 127 ASN HN . 18552 1 547 . 1 1 127 127 ASN HA H 1 4.2320 0.05 . 1 . . . . 127 ASN HA . 18552 1 548 . 1 1 127 127 ASN HB2 H 1 2.7120 0.05 . 2 . . . . 127 ASN HB1 . 18552 1 549 . 1 1 127 127 ASN HB3 H 1 2.7120 0.05 . 2 . . . . 127 ASN HB2 . 18552 1 550 . 1 1 127 127 ASN HD21 H 1 7.3110 0.05 . 2 . . . . 127 ASN HD21 . 18552 1 551 . 1 1 127 127 ASN C C 13 172.5430 0.3 . 1 . . . . 127 ASN C . 18552 1 552 . 1 1 127 127 ASN CA C 13 50.5000 0.3 . 1 . . . . 127 ASN CA . 18552 1 553 . 1 1 127 127 ASN CB C 13 35.8130 0.3 . 1 . . . . 127 ASN CB . 18552 1 554 . 1 1 127 127 ASN N N 15 119.9020 0.3 . 1 . . . . 127 ASN N . 18552 1 555 . 1 1 128 128 LYS H H 1 8.0350 0.05 . 1 . . . . 128 LYS HN . 18552 1 556 . 1 1 128 128 LYS HA H 1 4.1700 0.05 . 1 . . . . 128 LYS HA . 18552 1 557 . 1 1 128 128 LYS HB2 H 1 1.7320 0.05 . 2 . . . . 128 LYS HB1 . 18552 1 558 . 1 1 128 128 LYS HB3 H 1 1.7320 0.05 . 2 . . . . 128 LYS HB2 . 18552 1 559 . 1 1 128 128 LYS HG2 H 1 1.3650 0.05 . 2 . . . . 128 LYS HG1 . 18552 1 560 . 1 1 128 128 LYS HD2 H 1 1.7320 0.05 . 2 . . . . 128 LYS HD1 . 18552 1 561 . 1 1 128 128 LYS HD3 H 1 1.7320 0.05 . 2 . . . . 128 LYS HD2 . 18552 1 562 . 1 1 128 128 LYS C C 13 174.0380 0.3 . 1 . . . . 128 LYS C . 18552 1 563 . 1 1 128 128 LYS CA C 13 54.3310 0.3 . 1 . . . . 128 LYS CA . 18552 1 564 . 1 1 128 128 LYS CB C 13 29.9550 0.3 . 1 . . . . 128 LYS CB . 18552 1 565 . 1 1 128 128 LYS N N 15 121.6780 0.3 . 1 . . . . 128 LYS N . 18552 1 566 . 1 1 129 129 GLN H H 1 8.1800 0.05 . 1 . . . . 129 GLN HN . 18552 1 567 . 1 1 129 129 GLN HB2 H 1 1.8320 0.05 . 2 . . . . 129 GLN HB1 . 18552 1 568 . 1 1 129 129 GLN HB3 H 1 1.8320 0.05 . 2 . . . . 129 GLN HB2 . 18552 1 569 . 1 1 129 129 GLN HG2 H 1 2.2950 0.05 . 2 . . . . 129 GLN HG1 . 18552 1 570 . 1 1 129 129 GLN HG3 H 1 2.2950 0.05 . 2 . . . . 129 GLN HG2 . 18552 1 571 . 1 1 129 129 GLN C C 13 173.5850 0.3 . 1 . . . . 129 GLN C . 18552 1 572 . 1 1 129 129 GLN CA C 13 53.5540 0.3 . 1 . . . . 129 GLN CA . 18552 1 573 . 1 1 129 129 GLN CB C 13 26.3420 0.3 . 1 . . . . 129 GLN CB . 18552 1 574 . 1 1 129 129 GLN N N 15 120.0320 0.3 . 1 . . . . 129 GLN N . 18552 1 575 . 1 1 130 130 ALA H H 1 8.1020 0.05 . 1 . . . . 130 ALA HN . 18552 1 576 . 1 1 130 130 ALA HA H 1 4.2430 0.05 . 1 . . . . 130 ALA HA . 18552 1 577 . 1 1 130 130 ALA HB1 H 1 1.3550 0.05 . 1 . . . . 130 ALA HB1 . 18552 1 578 . 1 1 130 130 ALA HB2 H 1 1.3550 0.05 . 1 . . . . 130 ALA HB1 . 18552 1 579 . 1 1 130 130 ALA HB3 H 1 1.3550 0.05 . 1 . . . . 130 ALA HB1 . 18552 1 580 . 1 1 130 130 ALA C C 13 175.3040 0.3 . 1 . . . . 130 ALA C . 18552 1 581 . 1 1 130 130 ALA CA C 13 50.2950 0.3 . 1 . . . . 130 ALA CA . 18552 1 582 . 1 1 130 130 ALA CB C 13 16.1440 0.3 . 1 . . . . 130 ALA CB . 18552 1 583 . 1 1 130 130 ALA N N 15 124.1250 0.3 . 1 . . . . 130 ALA N . 18552 1 584 . 1 1 131 131 SER H H 1 8.0740 0.05 . 1 . . . . 131 SER HN . 18552 1 585 . 1 1 131 131 SER HA H 1 4.4290 0.05 . 1 . . . . 131 SER HA . 18552 1 586 . 1 1 131 131 SER HB2 H 1 3.8480 0.05 . 2 . . . . 131 SER HB1 . 18552 1 587 . 1 1 131 131 SER HB3 H 1 3.8480 0.05 . 2 . . . . 131 SER HB2 . 18552 1 588 . 1 1 131 131 SER C C 13 172.2170 0.3 . 1 . . . . 131 SER C . 18552 1 589 . 1 1 131 131 SER CA C 13 55.9860 0.3 . 1 . . . . 131 SER CA . 18552 1 590 . 1 1 131 131 SER CB C 13 60.9680 0.3 . 1 . . . . 131 SER CB . 18552 1 591 . 1 1 131 131 SER N N 15 113.9880 0.3 . 1 . . . . 131 SER N . 18552 1 592 . 1 1 132 132 GLU H H 1 8.2310 0.05 . 1 . . . . 132 GLU HN . 18552 1 593 . 1 1 132 132 GLU HA H 1 4.1790 0.05 . 1 . . . . 132 GLU HA . 18552 1 594 . 1 1 132 132 GLU HB2 H 1 1.9430 0.05 . 2 . . . . 132 GLU HB1 . 18552 1 595 . 1 1 132 132 GLU HB3 H 1 1.9430 0.05 . 2 . . . . 132 GLU HB2 . 18552 1 596 . 1 1 132 132 GLU HG2 H 1 2.2190 0.05 . 2 . . . . 132 GLU HG1 . 18552 1 597 . 1 1 132 132 GLU HG3 H 1 2.2190 0.05 . 2 . . . . 132 GLU HG2 . 18552 1 598 . 1 1 132 132 GLU C C 13 174.0590 0.3 . 1 . . . . 132 GLU C . 18552 1 599 . 1 1 132 132 GLU CA C 13 54.3340 0.3 . 1 . . . . 132 GLU CA . 18552 1 600 . 1 1 132 132 GLU CB C 13 27.0620 0.3 . 1 . . . . 132 GLU CB . 18552 1 601 . 1 1 132 132 GLU N N 15 122.0140 0.3 . 1 . . . . 132 GLU N . 18552 1 602 . 1 1 133 133 GLN H H 1 8.0720 0.05 . 1 . . . . 133 GLN HN . 18552 1 603 . 1 1 133 133 GLN HA H 1 4.1470 0.05 . 1 . . . . 133 GLN HA . 18552 1 604 . 1 1 133 133 GLN HB2 H 1 1.8380 0.05 . 2 . . . . 133 GLN HB1 . 18552 1 605 . 1 1 133 133 GLN HB3 H 1 2.1230 0.05 . 2 . . . . 133 GLN HB2 . 18552 1 606 . 1 1 133 133 GLN HG2 H 1 2.3290 0.05 . 2 . . . . 133 GLN HG1 . 18552 1 607 . 1 1 133 133 GLN HG3 H 1 2.3290 0.05 . 2 . . . . 133 GLN HG2 . 18552 1 608 . 1 1 133 133 GLN HE21 H 1 7.2510 0.05 . 2 . . . . 133 GLN HE21 . 18552 1 609 . 1 1 133 133 GLN HE22 H 1 7.7720 0.05 . 2 . . . . 133 GLN HE22 . 18552 1 610 . 1 1 133 133 GLN C C 13 173.1130 0.3 . 1 . . . . 133 GLN C . 18552 1 611 . 1 1 133 133 GLN CA C 13 53.7530 0.3 . 1 . . . . 133 GLN CA . 18552 1 612 . 1 1 133 133 GLN CB C 13 26.3060 0.3 . 1 . . . . 133 GLN CB . 18552 1 613 . 1 1 133 133 GLN N N 15 119.6810 0.3 . 1 . . . . 133 GLN N . 18552 1 614 . 1 1 134 134 ASN H H 1 8.1410 0.05 . 1 . . . . 134 ASN HN . 18552 1 615 . 1 1 134 134 ASN HA H 1 4.4560 0.05 . 1 . . . . 134 ASN HA . 18552 1 616 . 1 1 134 134 ASN HB2 H 1 2.7030 0.05 . 2 . . . . 134 ASN HB1 . 18552 1 617 . 1 1 134 134 ASN HB3 H 1 2.7030 0.05 . 2 . . . . 134 ASN HB2 . 18552 1 618 . 1 1 134 134 ASN C C 13 172.7470 0.3 . 1 . . . . 134 ASN C . 18552 1 619 . 1 1 134 134 ASN CA C 13 50.7970 0.3 . 1 . . . . 134 ASN CA . 18552 1 620 . 1 1 134 134 ASN CB C 13 36.0300 0.3 . 1 . . . . 134 ASN CB . 18552 1 621 . 1 1 134 134 ASN N N 15 118.9990 0.3 . 1 . . . . 134 ASN N . 18552 1 622 . 1 1 135 135 TRP H H 1 7.9230 0.05 . 1 . . . . 135 TRP HN . 18552 1 623 . 1 1 135 135 TRP HA H 1 4.5440 0.05 . 1 . . . . 135 TRP HA . 18552 1 624 . 1 1 135 135 TRP HB2 H 1 3.2490 0.05 . 2 . . . . 135 TRP HB1 . 18552 1 625 . 1 1 135 135 TRP HB3 H 1 3.1650 0.05 . 2 . . . . 135 TRP HB2 . 18552 1 626 . 1 1 135 135 TRP C C 13 173.8540 0.3 . 1 . . . . 135 TRP C . 18552 1 627 . 1 1 135 135 TRP CA C 13 54.9200 0.3 . 1 . . . . 135 TRP CA . 18552 1 628 . 1 1 135 135 TRP CB C 13 26.4360 0.3 . 1 . . . . 135 TRP CB . 18552 1 629 . 1 1 135 135 TRP N N 15 121.1310 0.3 . 1 . . . . 135 TRP N . 18552 1 630 . 1 1 136 136 ALA H H 1 7.9300 0.05 . 1 . . . . 136 ALA HN . 18552 1 631 . 1 1 136 136 ALA HA H 1 4.1030 0.05 . 1 . . . . 136 ALA HA . 18552 1 632 . 1 1 136 136 ALA HB1 H 1 1.1920 0.05 . 1 . . . . 136 ALA HB1 . 18552 1 633 . 1 1 136 136 ALA HB2 H 1 1.1920 0.05 . 1 . . . . 136 ALA HB1 . 18552 1 634 . 1 1 136 136 ALA HB3 H 1 1.1920 0.05 . 1 . . . . 136 ALA HB1 . 18552 1 635 . 1 1 136 136 ALA C C 13 175.0590 0.3 . 1 . . . . 136 ALA C . 18552 1 636 . 1 1 136 136 ALA CA C 13 50.4520 0.3 . 1 . . . . 136 ALA CA . 18552 1 637 . 1 1 136 136 ALA CB C 13 15.9170 0.3 . 1 . . . . 136 ALA CB . 18552 1 638 . 1 1 136 136 ALA N N 15 123.5860 0.3 . 1 . . . . 136 ALA N . 18552 1 639 . 1 1 137 137 ASN H H 1 7.9210 0.05 . 1 . . . . 137 ASN HN . 18552 1 640 . 1 1 137 137 ASN HA H 1 4.2760 0.05 . 1 . . . . 137 ASN HA . 18552 1 641 . 1 1 137 137 ASN HB2 H 1 2.7040 0.05 . 2 . . . . 137 ASN HB1 . 18552 1 642 . 1 1 137 137 ASN HB3 H 1 2.6120 0.05 . 2 . . . . 137 ASN HB2 . 18552 1 643 . 1 1 137 137 ASN HD21 H 1 7.7150 0.05 . 2 . . . . 137 ASN HD21 . 18552 1 644 . 1 1 137 137 ASN C C 13 172.6250 0.3 . 1 . . . . 137 ASN C . 18552 1 645 . 1 1 137 137 ASN CA C 13 50.5690 0.3 . 1 . . . . 137 ASN CA . 18552 1 646 . 1 1 137 137 ASN CB C 13 35.6980 0.3 . 1 . . . . 137 ASN CB . 18552 1 647 . 1 1 137 137 ASN N N 15 116.4660 0.3 . 1 . . . . 137 ASN N . 18552 1 648 . 1 1 138 138 TYR H H 1 7.8750 0.05 . 1 . . . . 138 TYR HN . 18552 1 649 . 1 1 138 138 TYR HA H 1 4.4560 0.05 . 1 . . . . 138 TYR HA . 18552 1 650 . 1 1 138 138 TYR HB2 H 1 2.9780 0.05 . 2 . . . . 138 TYR HB1 . 18552 1 651 . 1 1 138 138 TYR HB3 H 1 2.9780 0.05 . 2 . . . . 138 TYR HB2 . 18552 1 652 . 1 1 138 138 TYR HD1 H 1 7.0290 0.05 . 3 . . . . 138 TYR HD1 . 18552 1 653 . 1 1 138 138 TYR HD2 H 1 7.0290 0.05 . 3 . . . . 138 TYR HD2 . 18552 1 654 . 1 1 138 138 TYR HE1 H 1 6.7420 0.05 . 3 . . . . 138 TYR HE1 . 18552 1 655 . 1 1 138 138 TYR HE2 H 1 6.7420 0.05 . 3 . . . . 138 TYR HE2 . 18552 1 656 . 1 1 138 138 TYR C C 13 173.4440 0.3 . 1 . . . . 138 TYR C . 18552 1 657 . 1 1 138 138 TYR CA C 13 55.8990 0.3 . 1 . . . . 138 TYR CA . 18552 1 658 . 1 1 138 138 TYR CB C 13 35.7570 0.3 . 1 . . . . 138 TYR CB . 18552 1 659 . 1 1 138 138 TYR N N 15 120.3970 0.3 . 1 . . . . 138 TYR N . 18552 1 660 . 1 1 139 139 SER H H 1 8.0060 0.05 . 1 . . . . 139 SER HN . 18552 1 661 . 1 1 139 139 SER HA H 1 4.2000 0.05 . 1 . . . . 139 SER HA . 18552 1 662 . 1 1 139 139 SER HB2 H 1 3.7600 0.05 . 2 . . . . 139 SER HB1 . 18552 1 663 . 1 1 139 139 SER C C 13 172.0720 0.3 . 1 . . . . 139 SER C . 18552 1 664 . 1 1 139 139 SER CA C 13 55.9120 0.3 . 1 . . . . 139 SER CA . 18552 1 665 . 1 1 139 139 SER CB C 13 60.9670 0.3 . 1 . . . . 139 SER CB . 18552 1 666 . 1 1 139 139 SER N N 15 116.5140 0.3 . 1 . . . . 139 SER N . 18552 1 667 . 1 1 140 140 ALA H H 1 8.0760 0.05 . 1 . . . . 140 ALA HN . 18552 1 668 . 1 1 140 140 ALA HA H 1 4.2070 0.05 . 1 . . . . 140 ALA HA . 18552 1 669 . 1 1 140 140 ALA HB1 H 1 1.3940 0.05 . 1 . . . . 140 ALA HB1 . 18552 1 670 . 1 1 140 140 ALA HB2 H 1 1.3940 0.05 . 1 . . . . 140 ALA HB1 . 18552 1 671 . 1 1 140 140 ALA HB3 H 1 1.3940 0.05 . 1 . . . . 140 ALA HB1 . 18552 1 672 . 1 1 140 140 ALA C C 13 175.8510 0.3 . 1 . . . . 140 ALA C . 18552 1 673 . 1 1 140 140 ALA CA C 13 50.5670 0.3 . 1 . . . . 140 ALA CA . 18552 1 674 . 1 1 140 140 ALA CB C 13 15.9890 0.3 . 1 . . . . 140 ALA CB . 18552 1 675 . 1 1 140 140 ALA N N 15 125.5190 0.3 . 1 . . . . 140 ALA N . 18552 1 676 . 1 1 141 141 GLU H H 1 8.1530 0.05 . 1 . . . . 141 GLU HN . 18552 1 677 . 1 1 141 141 GLU HA H 1 4.1360 0.05 . 1 . . . . 141 GLU HA . 18552 1 678 . 1 1 141 141 GLU HB2 H 1 1.9490 0.05 . 2 . . . . 141 GLU HB1 . 18552 1 679 . 1 1 141 141 GLU HB3 H 1 1.9490 0.05 . 2 . . . . 141 GLU HB2 . 18552 1 680 . 1 1 141 141 GLU HG2 H 1 2.2410 0.05 . 2 . . . . 141 GLU HG1 . 18552 1 681 . 1 1 141 141 GLU HG3 H 1 2.2420 0.05 . 2 . . . . 141 GLU HG2 . 18552 1 682 . 1 1 141 141 GLU C C 13 174.6180 0.3 . 1 . . . . 141 GLU C . 18552 1 683 . 1 1 141 141 GLU CA C 13 54.5440 0.3 . 1 . . . . 141 GLU CA . 18552 1 684 . 1 1 141 141 GLU CB C 13 26.8570 0.3 . 1 . . . . 141 GLU CB . 18552 1 685 . 1 1 141 141 GLU N N 15 118.5630 0.3 . 1 . . . . 141 GLU N . 18552 1 686 . 1 1 142 142 GLN H H 1 8.0520 0.05 . 1 . . . . 142 GLN HN . 18552 1 687 . 1 1 142 142 GLN HA H 1 4.1620 0.05 . 1 . . . . 142 GLN HA . 18552 1 688 . 1 1 142 142 GLN HB2 H 1 1.9650 0.05 . 2 . . . . 142 GLN HB1 . 18552 1 689 . 1 1 142 142 GLN HB3 H 1 1.9650 0.05 . 2 . . . . 142 GLN HB2 . 18552 1 690 . 1 1 142 142 GLN HG2 H 1 2.2620 0.05 . 2 . . . . 142 GLN HG1 . 18552 1 691 . 1 1 142 142 GLN HG3 H 1 2.2620 0.05 . 2 . . . . 142 GLN HG2 . 18552 1 692 . 1 1 142 142 GLN HE21 H 1 7.1930 0.05 . 2 . . . . 142 GLN HE21 . 18552 1 693 . 1 1 142 142 GLN HE22 H 1 7.8310 0.05 . 2 . . . . 142 GLN HE22 . 18552 1 694 . 1 1 142 142 GLN C C 13 171.4970 0.3 . 1 . . . . 142 GLN C . 18552 1 695 . 1 1 142 142 GLN CA C 13 53.8530 0.3 . 1 . . . . 142 GLN CA . 18552 1 696 . 1 1 142 142 GLN CB C 13 25.9040 0.3 . 1 . . . . 142 GLN CB . 18552 1 697 . 1 1 142 142 GLN N N 15 119.3000 0.3 . 1 . . . . 142 GLN N . 18552 1 698 . 1 1 143 143 ASN H H 1 8.1530 0.05 . 1 . . . . 143 ASN HN . 18552 1 699 . 1 1 143 143 ASN HA H 1 4.2870 0.05 . 1 . . . . 143 ASN HA . 18552 1 700 . 1 1 143 143 ASN HB2 H 1 2.7690 0.05 . 2 . . . . 143 ASN HB1 . 18552 1 701 . 1 1 143 143 ASN HB3 H 1 2.7690 0.05 . 2 . . . . 143 ASN HB2 . 18552 1 702 . 1 1 143 143 ASN C C 13 172.9480 0.3 . 1 . . . . 143 ASN C . 18552 1 703 . 1 1 143 143 ASN CA C 13 50.7390 0.3 . 1 . . . . 143 ASN CA . 18552 1 704 . 1 1 143 143 ASN CB C 13 35.8480 0.3 . 1 . . . . 143 ASN CB . 18552 1 705 . 1 1 143 143 ASN N N 15 118.3220 0.3 . 1 . . . . 143 ASN N . 18552 1 706 . 1 1 144 144 ARG H H 1 8.0620 0.05 . 1 . . . . 144 ARG HN . 18552 1 707 . 1 1 144 144 ARG HA H 1 4.2460 0.05 . 1 . . . . 144 ARG HA . 18552 1 708 . 1 1 144 144 ARG HB2 H 1 1.8900 0.05 . 2 . . . . 144 ARG HB1 . 18552 1 709 . 1 1 144 144 ARG HB3 H 1 1.7900 0.05 . 2 . . . . 144 ARG HB2 . 18552 1 710 . 1 1 144 144 ARG HG2 H 1 1.6960 0.05 . 2 . . . . 144 ARG HG1 . 18552 1 711 . 1 1 144 144 ARG HG3 H 1 1.6960 0.05 . 2 . . . . 144 ARG HG2 . 18552 1 712 . 1 1 144 144 ARG HD2 H 1 3.3870 0.05 . 2 . . . . 144 ARG HD1 . 18552 1 713 . 1 1 144 144 ARG HD3 H 1 3.3870 0.05 . 2 . . . . 144 ARG HD2 . 18552 1 714 . 1 1 144 144 ARG C C 13 173.9560 0.3 . 1 . . . . 144 ARG C . 18552 1 715 . 1 1 144 144 ARG CA C 13 54.1620 0.3 . 1 . . . . 144 ARG CA . 18552 1 716 . 1 1 144 144 ARG CB C 13 27.6270 0.3 . 1 . . . . 144 ARG CB . 18552 1 717 . 1 1 144 144 ARG N N 15 120.5470 0.3 . 1 . . . . 144 ARG N . 18552 1 718 . 1 1 145 145 MET H H 1 8.1440 0.05 . 1 . . . . 145 MET HN . 18552 1 719 . 1 1 145 145 MET HA H 1 4.3970 0.05 . 1 . . . . 145 MET HA . 18552 1 720 . 1 1 145 145 MET HB2 H 1 2.0380 0.05 . 2 . . . . 145 MET HB1 . 18552 1 721 . 1 1 145 145 MET HB3 H 1 2.0380 0.05 . 2 . . . . 145 MET HB2 . 18552 1 722 . 1 1 145 145 MET HG2 H 1 2.5400 0.05 . 2 . . . . 145 MET HG1 . 18552 1 723 . 1 1 145 145 MET HG3 H 1 2.5400 0.05 . 2 . . . . 145 MET HG2 . 18552 1 724 . 1 1 145 145 MET C C 13 174.1960 0.3 . 1 . . . . 145 MET C . 18552 1 725 . 1 1 145 145 MET CA C 13 53.3590 0.3 . 1 . . . . 145 MET CA . 18552 1 726 . 1 1 145 145 MET CB C 13 29.7610 0.3 . 1 . . . . 145 MET CB . 18552 1 727 . 1 1 145 145 MET N N 15 119.4750 0.3 . 1 . . . . 145 MET N . 18552 1 728 . 1 1 146 146 GLY H H 1 8.1820 0.05 . 1 . . . . 146 GLY HN . 18552 1 729 . 1 1 146 146 GLY HA2 H 1 3.9140 0.05 . 2 . . . . 146 GLY HA1 . 18552 1 730 . 1 1 146 146 GLY HA3 H 1 3.9140 0.05 . 2 . . . . 146 GLY HA2 . 18552 1 731 . 1 1 146 146 GLY C C 13 171.5640 0.3 . 1 . . . . 146 GLY C . 18552 1 732 . 1 1 146 146 GLY CA C 13 42.6270 0.3 . 1 . . . . 146 GLY CA . 18552 1 733 . 1 1 146 146 GLY N N 15 108.9960 0.3 . 1 . . . . 146 GLY N . 18552 1 734 . 1 1 147 147 GLN H H 1 8.0700 0.05 . 1 . . . . 147 GLN HN . 18552 1 735 . 1 1 147 147 GLN HA H 1 4.3140 0.05 . 1 . . . . 147 GLN HA . 18552 1 736 . 1 1 147 147 GLN HB2 H 1 1.9450 0.05 . 2 . . . . 147 GLN HB1 . 18552 1 737 . 1 1 147 147 GLN HB3 H 1 1.9450 0.05 . 2 . . . . 147 GLN HB2 . 18552 1 738 . 1 1 147 147 GLN HG2 H 1 2.3100 0.05 . 2 . . . . 147 GLN HG1 . 18552 1 739 . 1 1 147 147 GLN HG3 H 1 2.3100 0.05 . 2 . . . . 147 GLN HG2 . 18552 1 740 . 1 1 147 147 GLN C C 13 173.2710 0.3 . 1 . . . . 147 GLN C . 18552 1 741 . 1 1 147 147 GLN CA C 13 53.1500 0.3 . 1 . . . . 147 GLN CA . 18552 1 742 . 1 1 147 147 GLN CB C 13 26.4530 0.3 . 1 . . . . 147 GLN CB . 18552 1 743 . 1 1 147 147 GLN N N 15 119.5770 0.3 . 1 . . . . 147 GLN N . 18552 1 744 . 1 1 148 148 ALA H H 1 8.2580 0.05 . 1 . . . . 148 ALA HN . 18552 1 745 . 1 1 148 148 ALA HA H 1 4.2840 0.05 . 1 . . . . 148 ALA HA . 18552 1 746 . 1 1 148 148 ALA HB1 H 1 1.3750 0.05 . 1 . . . . 148 ALA HB1 . 18552 1 747 . 1 1 148 148 ALA HB2 H 1 1.3750 0.05 . 1 . . . . 148 ALA HB1 . 18552 1 748 . 1 1 148 148 ALA HB3 H 1 1.3750 0.05 . 1 . . . . 148 ALA HB1 . 18552 1 749 . 1 1 148 148 ALA C C 13 175.4690 0.3 . 1 . . . . 148 ALA C . 18552 1 750 . 1 1 148 148 ALA CA C 13 50.1700 0.3 . 1 . . . . 148 ALA CA . 18552 1 751 . 1 1 148 148 ALA CB C 13 16.1840 0.3 . 1 . . . . 148 ALA CB . 18552 1 752 . 1 1 148 148 ALA N N 15 124.7420 0.3 . 1 . . . . 148 ALA N . 18552 1 753 . 1 1 149 149 GLY H H 1 8.2460 0.05 . 1 . . . . 149 GLY HN . 18552 1 754 . 1 1 149 149 GLY HA2 H 1 3.9420 0.05 . 2 . . . . 149 GLY HA1 . 18552 1 755 . 1 1 149 149 GLY HA3 H 1 3.9420 0.05 . 2 . . . . 149 GLY HA2 . 18552 1 756 . 1 1 149 149 GLY C C 13 171.5410 0.3 . 1 . . . . 149 GLY C . 18552 1 757 . 1 1 149 149 GLY CA C 13 42.5400 0.3 . 1 . . . . 149 GLY CA . 18552 1 758 . 1 1 149 149 GLY N N 15 107.6960 0.3 . 1 . . . . 149 GLY N . 18552 1 759 . 1 1 150 150 SER H H 1 8.0520 0.05 . 1 . . . . 150 SER HN . 18552 1 760 . 1 1 150 150 SER HA H 1 4.5150 0.05 . 1 . . . . 150 SER HA . 18552 1 761 . 1 1 150 150 SER HB2 H 1 3.8580 0.05 . 2 . . . . 150 SER HB1 . 18552 1 762 . 1 1 150 150 SER HB3 H 1 3.8580 0.05 . 2 . . . . 150 SER HB2 . 18552 1 763 . 1 1 150 150 SER C C 13 172.1450 0.3 . 1 . . . . 150 SER C . 18552 1 764 . 1 1 150 150 SER CA C 13 55.7500 0.3 . 1 . . . . 150 SER CA . 18552 1 765 . 1 1 150 150 SER CB C 13 61.1550 0.3 . 1 . . . . 150 SER CB . 18552 1 766 . 1 1 150 150 SER N N 15 115.1270 0.3 . 1 . . . . 150 SER N . 18552 1 767 . 1 1 151 151 THR H H 1 8.1130 0.05 . 1 . . . . 151 THR HN . 18552 1 768 . 1 1 151 151 THR HA H 1 4.3390 0.05 . 1 . . . . 151 THR HA . 18552 1 769 . 1 1 151 151 THR HB H 1 4.2490 0.05 . 1 . . . . 151 THR HB . 18552 1 770 . 1 1 151 151 THR HG21 H 1 1.1640 0.05 . 1 . . . . 151 THR HG21 . 18552 1 771 . 1 1 151 151 THR HG22 H 1 1.1640 0.05 . 1 . . . . 151 THR HG21 . 18552 1 772 . 1 1 151 151 THR HG23 H 1 1.1640 0.05 . 1 . . . . 151 THR HG21 . 18552 1 773 . 1 1 151 151 THR C C 13 171.9650 0.3 . 1 . . . . 151 THR C . 18552 1 774 . 1 1 151 151 THR CA C 13 59.2250 0.3 . 1 . . . . 151 THR CA . 18552 1 775 . 1 1 151 151 THR CB C 13 66.9370 0.3 . 1 . . . . 151 THR CB . 18552 1 776 . 1 1 151 151 THR N N 15 115.6070 0.3 . 1 . . . . 151 THR N . 18552 1 777 . 1 1 152 152 ILE H H 1 7.9800 0.05 . 1 . . . . 152 ILE HN . 18552 1 778 . 1 1 152 152 ILE HA H 1 4.1630 0.05 . 1 . . . . 152 ILE HA . 18552 1 779 . 1 1 152 152 ILE HB H 1 1.8390 0.05 . 1 . . . . 152 ILE HB . 18552 1 780 . 1 1 152 152 ILE HG12 H 1 1.4320 0.05 . 1 . . . . 152 ILE HG11 . 18552 1 781 . 1 1 152 152 ILE HG13 H 1 1.1560 0.05 . 1 . . . . 152 ILE HG12 . 18552 1 782 . 1 1 152 152 ILE HG21 H 1 0.8620 0.05 . 1 . . . . 152 ILE HG21 . 18552 1 783 . 1 1 152 152 ILE HG22 H 1 0.8620 0.05 . 1 . . . . 152 ILE HG21 . 18552 1 784 . 1 1 152 152 ILE HG23 H 1 0.8620 0.05 . 1 . . . . 152 ILE HG21 . 18552 1 785 . 1 1 152 152 ILE HD11 H 1 0.8620 0.05 . 1 . . . . 152 ILE HD11 . 18552 1 786 . 1 1 152 152 ILE HD12 H 1 0.8620 0.05 . 1 . . . . 152 ILE HD11 . 18552 1 787 . 1 1 152 152 ILE HD13 H 1 0.8620 0.05 . 1 . . . . 152 ILE HD11 . 18552 1 788 . 1 1 152 152 ILE C C 13 173.5060 0.3 . 1 . . . . 152 ILE C . 18552 1 789 . 1 1 152 152 ILE CA C 13 58.7690 0.3 . 1 . . . . 152 ILE CA . 18552 1 790 . 1 1 152 152 ILE CB C 13 35.7760 0.3 . 1 . . . . 152 ILE CB . 18552 1 791 . 1 1 152 152 ILE N N 15 122.0030 0.3 . 1 . . . . 152 ILE N . 18552 1 792 . 1 1 153 153 SER H H 1 8.1600 0.05 . 1 . . . . 153 SER HN . 18552 1 793 . 1 1 153 153 SER HA H 1 4.4200 0.05 . 1 . . . . 153 SER HA . 18552 1 794 . 1 1 153 153 SER HB2 H 1 3.8090 0.05 . 2 . . . . 153 SER HB1 . 18552 1 795 . 1 1 153 153 SER HB3 H 1 3.8090 0.05 . 2 . . . . 153 SER HB2 . 18552 1 796 . 1 1 153 153 SER C C 13 171.6120 0.3 . 1 . . . . 153 SER C . 18552 1 797 . 1 1 153 153 SER CA C 13 55.5560 0.3 . 1 . . . . 153 SER CA . 18552 1 798 . 1 1 153 153 SER CB C 13 60.9830 0.3 . 1 . . . . 153 SER CB . 18552 1 799 . 1 1 153 153 SER N N 15 118.6350 0.3 . 1 . . . . 153 SER N . 18552 1 800 . 1 1 154 154 ASN H H 1 8.2680 0.05 . 1 . . . . 154 ASN HN . 18552 1 801 . 1 1 154 154 ASN HA H 1 4.5470 0.05 . 1 . . . . 154 ASN HA . 18552 1 802 . 1 1 154 154 ASN HB2 H 1 2.7730 0.05 . 2 . . . . 154 ASN HB1 . 18552 1 803 . 1 1 154 154 ASN HB3 H 1 2.7730 0.05 . 2 . . . . 154 ASN HB2 . 18552 1 804 . 1 1 154 154 ASN C C 13 172.5420 0.3 . 1 . . . . 154 ASN C . 18552 1 805 . 1 1 154 154 ASN CA C 13 50.4470 0.3 . 1 . . . . 154 ASN CA . 18552 1 806 . 1 1 154 154 ASN CB C 13 36.0060 0.3 . 1 . . . . 154 ASN CB . 18552 1 807 . 1 1 154 154 ASN N N 15 120.7100 0.3 . 1 . . . . 154 ASN N . 18552 1 808 . 1 1 155 155 SER H H 1 8.1130 0.05 . 1 . . . . 155 SER HN . 18552 1 809 . 1 1 155 155 SER C C 13 170.9040 0.3 . 1 . . . . 155 SER C . 18552 1 810 . 1 1 155 155 SER CA C 13 55.8160 0.3 . 1 . . . . 155 SER CA . 18552 1 811 . 1 1 155 155 SER CB C 13 60.9520 0.3 . 1 . . . . 155 SER CB . 18552 1 812 . 1 1 155 155 SER N N 15 115.6090 0.3 . 1 . . . . 155 SER N . 18552 1 813 . 1 1 156 156 HIS H H 1 8.2860 0.05 . 1 . . . . 156 HIS HN . 18552 1 814 . 1 1 156 156 HIS HA H 1 4.4200 0.05 . 1 . . . . 156 HIS HA . 18552 1 815 . 1 1 156 156 HIS HB2 H 1 2.6590 0.05 . 2 . . . . 156 HIS HB1 . 18552 1 816 . 1 1 156 156 HIS C C 13 171.2750 0.3 . 1 . . . . 156 HIS C . 18552 1 817 . 1 1 156 156 HIS CA C 13 52.6600 0.3 . 1 . . . . 156 HIS CA . 18552 1 818 . 1 1 156 156 HIS CB C 13 26.2560 0.3 . 1 . . . . 156 HIS CB . 18552 1 819 . 1 1 156 156 HIS N N 15 119.4800 0.3 . 1 . . . . 156 HIS N . 18552 1 820 . 1 1 157 157 ALA H H 1 8.0670 0.05 . 1 . . . . 157 ALA HN . 18552 1 821 . 1 1 157 157 ALA HA H 1 4.2870 0.05 . 1 . . . . 157 ALA HA . 18552 1 822 . 1 1 157 157 ALA HB1 H 1 1.3190 0.05 . 1 . . . . 157 ALA HB1 . 18552 1 823 . 1 1 157 157 ALA HB2 H 1 1.3190 0.05 . 1 . . . . 157 ALA HB1 . 18552 1 824 . 1 1 157 157 ALA HB3 H 1 1.3190 0.05 . 1 . . . . 157 ALA HB1 . 18552 1 825 . 1 1 157 157 ALA C C 13 174.2240 0.3 . 1 . . . . 157 ALA C . 18552 1 826 . 1 1 157 157 ALA CA C 13 49.6110 0.3 . 1 . . . . 157 ALA CA . 18552 1 827 . 1 1 157 157 ALA CB C 13 16.4610 0.3 . 1 . . . . 157 ALA CB . 18552 1 828 . 1 1 157 157 ALA N N 15 124.3600 0.3 . 1 . . . . 157 ALA N . 18552 1 829 . 1 1 158 158 GLN H H 1 8.1800 0.05 . 1 . . . . 158 GLN HN . 18552 1 830 . 1 1 158 158 GLN HA H 1 4.2340 0.05 . 1 . . . . 158 GLN HA . 18552 1 831 . 1 1 158 158 GLN HB2 H 1 1.9730 0.05 . 2 . . . . 158 GLN HB1 . 18552 1 832 . 1 1 158 158 GLN HB3 H 1 1.9730 0.05 . 2 . . . . 158 GLN HB2 . 18552 1 833 . 1 1 158 158 GLN HG2 H 1 2.3410 0.05 . 2 . . . . 158 GLN HG1 . 18552 1 834 . 1 1 158 158 GLN HG3 H 1 2.3410 0.05 . 2 . . . . 158 GLN HG2 . 18552 1 835 . 1 1 158 158 GLN C C 13 171.5500 0.3 . 1 . . . . 158 GLN C . 18552 1 836 . 1 1 158 158 GLN CA C 13 49.9250 0.3 . 1 . . . . 158 GLN CA . 18552 1 837 . 1 1 158 158 GLN CB C 13 26.2630 0.3 . 1 . . . . 158 GLN CB . 18552 1 838 . 1 1 158 158 GLN N N 15 120.0320 0.3 . 1 . . . . 158 GLN N . 18552 1 839 . 1 1 159 159 PRO CA C 13 60.4860 0.3 . 1 . . . . 159 PRO CA . 18552 1 840 . 1 1 159 159 PRO CB C 13 28.8630 0.3 . 1 . . . . 159 PRO CB . 18552 1 841 . 1 1 160 160 PHE H H 1 7.7330 0.05 . 1 . . . . 160 PHE HN . 18552 1 842 . 1 1 160 160 PHE HA H 1 4.5240 0.05 . 1 . . . . 160 PHE HA . 18552 1 843 . 1 1 160 160 PHE HB2 H 1 2.9430 0.05 . 2 . . . . 160 PHE HB1 . 18552 1 844 . 1 1 160 160 PHE HB3 H 1 2.9430 0.05 . 2 . . . . 160 PHE HB2 . 18552 1 845 . 1 1 160 160 PHE HD1 H 1 7.3090 0.05 . 3 . . . . 160 PHE HD1 . 18552 1 846 . 1 1 160 160 PHE HD2 H 1 7.3090 0.05 . 3 . . . . 160 PHE HD2 . 18552 1 847 . 1 1 160 160 PHE HE1 H 1 7.5140 0.05 . 3 . . . . 160 PHE HE1 . 18552 1 848 . 1 1 160 160 PHE HE2 H 1 7.5140 0.05 . 3 . . . . 160 PHE HE2 . 18552 1 849 . 1 1 160 160 PHE C C 13 172.0730 0.3 . 1 . . . . 160 PHE C . 18552 1 850 . 1 1 160 160 PHE CA C 13 54.3300 0.3 . 1 . . . . 160 PHE CA . 18552 1 851 . 1 1 160 160 PHE CB C 13 36.5700 0.3 . 1 . . . . 160 PHE CB . 18552 1 852 . 1 1 160 160 PHE N N 15 117.8690 0.3 . 1 . . . . 160 PHE N . 18552 1 853 . 1 1 161 161 ASP H H 1 7.9160 0.05 . 1 . . . . 161 ASP HN . 18552 1 854 . 1 1 161 161 ASP HA H 1 4.5440 0.05 . 1 . . . . 161 ASP HA . 18552 1 855 . 1 1 161 161 ASP HB2 H 1 2.4600 0.05 . 2 . . . . 161 ASP HB1 . 18552 1 856 . 1 1 161 161 ASP HB3 H 1 2.4600 0.05 . 2 . . . . 161 ASP HB2 . 18552 1 857 . 1 1 161 161 ASP C C 13 172.2130 0.3 . 1 . . . . 161 ASP C . 18552 1 858 . 1 1 161 161 ASP CA C 13 52.9510 0.3 . 1 . . . . 161 ASP CA . 18552 1 859 . 1 1 161 161 ASP CB C 13 38.3740 0.3 . 1 . . . . 161 ASP CB . 18552 1 860 . 1 1 161 161 ASP N N 15 121.0410 0.3 . 1 . . . . 161 ASP N . 18552 1 861 . 1 1 162 162 PHE H H 1 7.9540 0.05 . 1 . . . . 162 PHE HN . 18552 1 862 . 1 1 162 162 PHE HA H 1 4.2700 0.05 . 1 . . . . 162 PHE HA . 18552 1 863 . 1 1 162 162 PHE HB2 H 1 3.1220 0.05 . 2 . . . . 162 PHE HB1 . 18552 1 864 . 1 1 162 162 PHE HB3 H 1 2.8830 0.05 . 2 . . . . 162 PHE HB2 . 18552 1 865 . 1 1 162 162 PHE C C 13 174.0970 0.3 . 1 . . . . 162 PHE C . 18552 1 866 . 1 1 162 162 PHE CA C 13 50.9900 0.3 . 1 . . . . 162 PHE CA . 18552 1 867 . 1 1 162 162 PHE CB C 13 38.2840 0.3 . 1 . . . . 162 PHE CB . 18552 1 868 . 1 1 162 162 PHE N N 15 121.0580 0.3 . 1 . . . . 162 PHE N . 18552 1 869 . 1 1 163 163 PRO CA C 13 60.4200 0.3 . 1 . . . . 163 PRO CA . 18552 1 870 . 1 1 163 163 PRO CB C 13 29.0460 0.3 . 1 . . . . 163 PRO CB . 18552 1 871 . 1 1 164 164 ASP H H 1 8.1560 0.05 . 1 . . . . 164 ASP HN . 18552 1 872 . 1 1 164 164 ASP HA H 1 4.5810 0.05 . 1 . . . . 164 ASP HA . 18552 1 873 . 1 1 164 164 ASP HB2 H 1 2.6550 0.05 . 2 . . . . 164 ASP HB1 . 18552 1 874 . 1 1 164 164 ASP HB3 H 1 2.6550 0.05 . 2 . . . . 164 ASP HB2 . 18552 1 875 . 1 1 164 164 ASP C C 13 173.3900 0.3 . 1 . . . . 164 ASP C . 18552 1 876 . 1 1 164 164 ASP CA C 13 51.5320 0.3 . 1 . . . . 164 ASP CA . 18552 1 877 . 1 1 164 164 ASP CB C 13 38.3990 0.3 . 1 . . . . 164 ASP CB . 18552 1 878 . 1 1 164 164 ASP N N 15 120.0520 0.3 . 1 . . . . 164 ASP N . 18552 1 879 . 1 1 165 165 ASP H H 1 8.1950 0.05 . 1 . . . . 165 ASP HN . 18552 1 880 . 1 1 165 165 ASP HA H 1 4.3720 0.05 . 1 . . . . 165 ASP HA . 18552 1 881 . 1 1 165 165 ASP HB2 H 1 2.6590 0.05 . 2 . . . . 165 ASP HB1 . 18552 1 882 . 1 1 165 165 ASP C C 13 173.7350 0.3 . 1 . . . . 165 ASP C . 18552 1 883 . 1 1 165 165 ASP CA C 13 51.6430 0.3 . 1 . . . . 165 ASP CA . 18552 1 884 . 1 1 165 165 ASP CB C 13 38.2360 0.3 . 1 . . . . 165 ASP CB . 18552 1 885 . 1 1 165 165 ASP N N 15 120.7070 0.3 . 1 . . . . 165 ASP N . 18552 1 886 . 1 1 166 166 ASN H H 1 8.3310 0.05 . 1 . . . . 166 ASN HN . 18552 1 887 . 1 1 166 166 ASN HA H 1 4.6090 0.05 . 1 . . . . 166 ASN HA . 18552 1 888 . 1 1 166 166 ASN HB2 H 1 2.7940 0.05 . 2 . . . . 166 ASN HB1 . 18552 1 889 . 1 1 166 166 ASN HB3 H 1 2.7940 0.05 . 2 . . . . 166 ASN HB2 . 18552 1 890 . 1 1 166 166 ASN C C 13 173.1500 0.3 . 1 . . . . 166 ASN C . 18552 1 891 . 1 1 166 166 ASN CA C 13 51.1100 0.3 . 1 . . . . 166 ASN CA . 18552 1 892 . 1 1 166 166 ASN CB C 13 35.8870 0.3 . 1 . . . . 166 ASN CB . 18552 1 893 . 1 1 166 166 ASN N N 15 118.6800 0.3 . 1 . . . . 166 ASN N . 18552 1 894 . 1 1 167 167 GLN H H 1 8.2950 0.05 . 1 . . . . 167 GLN HN . 18552 1 895 . 1 1 167 167 GLN HA H 1 4.1910 0.05 . 1 . . . . 167 GLN HA . 18552 1 896 . 1 1 167 167 GLN HB2 H 1 1.9990 0.05 . 2 . . . . 167 GLN HB1 . 18552 1 897 . 1 1 167 167 GLN HB3 H 1 1.9990 0.05 . 2 . . . . 167 GLN HB2 . 18552 1 898 . 1 1 167 167 GLN HG2 H 1 2.3280 0.05 . 2 . . . . 167 GLN HG1 . 18552 1 899 . 1 1 167 167 GLN HG3 H 1 2.3280 0.05 . 2 . . . . 167 GLN HG2 . 18552 1 900 . 1 1 167 167 GLN C C 13 173.7140 0.3 . 1 . . . . 167 GLN C . 18552 1 901 . 1 1 167 167 GLN CA C 13 54.0800 0.3 . 1 . . . . 167 GLN CA . 18552 1 902 . 1 1 167 167 GLN CB C 13 26.0210 0.3 . 1 . . . . 167 GLN CB . 18552 1 903 . 1 1 167 167 GLN N N 15 119.7040 0.3 . 1 . . . . 167 GLN N . 18552 1 904 . 1 1 168 168 ASN H H 1 8.2370 0.05 . 1 . . . . 168 ASN HN . 18552 1 905 . 1 1 168 168 ASN HA H 1 4.5950 0.05 . 1 . . . . 168 ASN HA . 18552 1 906 . 1 1 168 168 ASN HB2 H 1 2.7640 0.05 . 2 . . . . 168 ASN HB1 . 18552 1 907 . 1 1 168 168 ASN HB3 H 1 2.7640 0.05 . 2 . . . . 168 ASN HB2 . 18552 1 908 . 1 1 168 168 ASN C C 13 172.7320 0.3 . 1 . . . . 168 ASN C . 18552 1 909 . 1 1 168 168 ASN CA C 13 51.2340 0.3 . 1 . . . . 168 ASN CA . 18552 1 910 . 1 1 168 168 ASN CB C 13 35.8630 0.3 . 1 . . . . 168 ASN CB . 18552 1 911 . 1 1 168 168 ASN N N 15 118.3300 0.3 . 1 . . . . 168 ASN N . 18552 1 912 . 1 1 169 169 ALA H H 1 7.9950 0.05 . 1 . . . . 169 ALA HN . 18552 1 913 . 1 1 169 169 ALA HA H 1 4.2020 0.05 . 1 . . . . 169 ALA HA . 18552 1 914 . 1 1 169 169 ALA HB1 H 1 1.3650 0.05 . 1 . . . . 169 ALA HB1 . 18552 1 915 . 1 1 169 169 ALA HB2 H 1 1.3650 0.05 . 1 . . . . 169 ALA HB1 . 18552 1 916 . 1 1 169 169 ALA HB3 H 1 1.3650 0.05 . 1 . . . . 169 ALA HB1 . 18552 1 917 . 1 1 169 169 ALA C C 13 175.3420 0.3 . 1 . . . . 169 ALA C . 18552 1 918 . 1 1 169 169 ALA CA C 13 50.4950 0.3 . 1 . . . . 169 ALA CA . 18552 1 919 . 1 1 169 169 ALA CB C 13 16.1190 0.3 . 1 . . . . 169 ALA CB . 18552 1 920 . 1 1 169 169 ALA N N 15 123.3740 0.3 . 1 . . . . 169 ALA N . 18552 1 921 . 1 1 170 170 LYS H H 1 7.9720 0.05 . 1 . . . . 170 LYS HN . 18552 1 922 . 1 1 170 170 LYS HA H 1 4.1990 0.05 . 1 . . . . 170 LYS HA . 18552 1 923 . 1 1 170 170 LYS HB2 H 1 1.7640 0.05 . 2 . . . . 170 LYS HB1 . 18552 1 924 . 1 1 170 170 LYS HB3 H 1 1.7640 0.05 . 2 . . . . 170 LYS HB2 . 18552 1 925 . 1 1 170 170 LYS HG2 H 1 1.4480 0.05 . 2 . . . . 170 LYS HG1 . 18552 1 926 . 1 1 170 170 LYS HG3 H 1 1.4480 0.05 . 2 . . . . 170 LYS HG2 . 18552 1 927 . 1 1 170 170 LYS HD2 H 1 1.7640 0.05 . 2 . . . . 170 LYS HD1 . 18552 1 928 . 1 1 170 170 LYS HD3 H 1 1.7640 0.05 . 2 . . . . 170 LYS HD2 . 18552 1 929 . 1 1 170 170 LYS C C 13 174.1290 0.3 . 1 . . . . 170 LYS C . 18552 1 930 . 1 1 170 170 LYS CA C 13 53.9650 0.3 . 1 . . . . 170 LYS CA . 18552 1 931 . 1 1 170 170 LYS CB C 13 29.9300 0.3 . 1 . . . . 170 LYS CB . 18552 1 932 . 1 1 170 170 LYS N N 15 118.9250 0.3 . 1 . . . . 170 LYS N . 18552 1 933 . 1 1 171 171 LYS H H 1 8.0030 0.05 . 1 . . . . 171 LYS HN . 18552 1 934 . 1 1 171 171 LYS HA H 1 4.2680 0.05 . 1 . . . . 171 LYS HA . 18552 1 935 . 1 1 171 171 LYS HB2 H 1 1.7760 0.05 . 2 . . . . 171 LYS HB1 . 18552 1 936 . 1 1 171 171 LYS HB3 H 1 1.7760 0.05 . 2 . . . . 171 LYS HB2 . 18552 1 937 . 1 1 171 171 LYS HG2 H 1 1.3740 0.05 . 2 . . . . 171 LYS HG1 . 18552 1 938 . 1 1 171 171 LYS HG3 H 1 1.3740 0.05 . 2 . . . . 171 LYS HG2 . 18552 1 939 . 1 1 171 171 LYS HD2 H 1 1.7760 0.05 . 2 . . . . 171 LYS HD1 . 18552 1 940 . 1 1 171 171 LYS HD3 H 1 1.7760 0.05 . 2 . . . . 171 LYS HD2 . 18552 1 941 . 1 1 171 171 LYS C C 13 174.1170 0.3 . 1 . . . . 171 LYS C . 18552 1 942 . 1 1 171 171 LYS CA C 13 53.8990 0.3 . 1 . . . . 171 LYS CA . 18552 1 943 . 1 1 171 171 LYS CB C 13 29.9460 0.3 . 1 . . . . 171 LYS CB . 18552 1 944 . 1 1 171 171 LYS N N 15 121.4800 0.3 . 1 . . . . 171 LYS N . 18552 1 945 . 1 1 172 172 VAL H H 1 7.9100 0.05 . 1 . . . . 172 VAL HN . 18552 1 946 . 1 1 172 172 VAL HA H 1 4.0280 0.05 . 1 . . . . 172 VAL HA . 18552 1 947 . 1 1 172 172 VAL HB H 1 2.0340 0.05 . 1 . . . . 172 VAL HB . 18552 1 948 . 1 1 172 172 VAL HG11 H 1 0.8920 0.05 . 2 . . . . 172 VAL HG11 . 18552 1 949 . 1 1 172 172 VAL HG12 H 1 0.8920 0.05 . 2 . . . . 172 VAL HG11 . 18552 1 950 . 1 1 172 172 VAL HG13 H 1 0.8920 0.05 . 2 . . . . 172 VAL HG11 . 18552 1 951 . 1 1 172 172 VAL HG21 H 1 0.8920 0.05 . 2 . . . . 172 VAL HG21 . 18552 1 952 . 1 1 172 172 VAL HG22 H 1 0.8920 0.05 . 2 . . . . 172 VAL HG21 . 18552 1 953 . 1 1 172 172 VAL HG23 H 1 0.8920 0.05 . 2 . . . . 172 VAL HG21 . 18552 1 954 . 1 1 172 172 VAL C C 13 173.3400 0.3 . 1 . . . . 172 VAL C . 18552 1 955 . 1 1 172 172 VAL CA C 13 59.8570 0.3 . 1 . . . . 172 VAL CA . 18552 1 956 . 1 1 172 172 VAL CB C 13 29.8100 0.3 . 1 . . . . 172 VAL CB . 18552 1 957 . 1 1 172 172 VAL N N 15 120.1050 0.3 . 1 . . . . 172 VAL N . 18552 1 958 . 1 1 173 173 ALA H H 1 8.1300 0.05 . 1 . . . . 173 ALA HN . 18552 1 959 . 1 1 173 173 ALA HA H 1 4.2740 0.05 . 1 . . . . 173 ALA HA . 18552 1 960 . 1 1 173 173 ALA HB1 H 1 1.3470 0.05 . 1 . . . . 173 ALA HB1 . 18552 1 961 . 1 1 173 173 ALA HB2 H 1 1.3470 0.05 . 1 . . . . 173 ALA HB1 . 18552 1 962 . 1 1 173 173 ALA HB3 H 1 1.3470 0.05 . 1 . . . . 173 ALA HB1 . 18552 1 963 . 1 1 173 173 ALA C C 13 174.6090 0.3 . 1 . . . . 173 ALA C . 18552 1 964 . 1 1 173 173 ALA CA C 13 49.9350 0.3 . 1 . . . . 173 ALA CA . 18552 1 965 . 1 1 173 173 ALA CB C 13 16.2790 0.3 . 1 . . . . 173 ALA CB . 18552 1 966 . 1 1 173 173 ALA N N 15 126.3620 0.3 . 1 . . . . 173 ALA N . 18552 1 967 . 1 1 174 174 ALA H H 1 8.0520 0.05 . 1 . . . . 174 ALA HN . 18552 1 968 . 1 1 174 174 ALA HA H 1 4.2560 0.05 . 1 . . . . 174 ALA HA . 18552 1 969 . 1 1 174 174 ALA HB1 H 1 1.3620 0.05 . 1 . . . . 174 ALA HB1 . 18552 1 970 . 1 1 174 174 ALA HB2 H 1 1.3620 0.05 . 1 . . . . 174 ALA HB1 . 18552 1 971 . 1 1 174 174 ALA HB3 H 1 1.3620 0.05 . 1 . . . . 174 ALA HB1 . 18552 1 972 . 1 1 174 174 ALA C C 13 175.4690 0.3 . 1 . . . . 174 ALA C . 18552 1 973 . 1 1 174 174 ALA CA C 13 49.9550 0.3 . 1 . . . . 174 ALA CA . 18552 1 974 . 1 1 174 174 ALA CB C 13 16.2200 0.3 . 1 . . . . 174 ALA CB . 18552 1 975 . 1 1 174 174 ALA N N 15 122.7080 0.3 . 1 . . . . 174 ALA N . 18552 1 976 . 1 1 175 175 GLY H H 1 8.2700 0.05 . 1 . . . . 175 GLY HN . 18552 1 977 . 1 1 175 175 GLY HA2 H 1 3.8770 0.05 . 2 . . . . 175 GLY HA1 . 18552 1 978 . 1 1 175 175 GLY HA3 H 1 3.8770 0.05 . 2 . . . . 175 GLY HA2 . 18552 1 979 . 1 1 175 175 GLY C C 13 171.4970 0.3 . 1 . . . . 175 GLY C . 18552 1 980 . 1 1 175 175 GLY CA C 13 42.5490 0.3 . 1 . . . . 175 GLY CA . 18552 1 981 . 1 1 175 175 GLY N N 15 107.3880 0.3 . 1 . . . . 175 GLY N . 18552 1 982 . 1 1 176 176 HIS H H 1 8.1490 0.05 . 1 . . . . 176 HIS HN . 18552 1 983 . 1 1 176 176 HIS HA H 1 4.5940 0.05 . 1 . . . . 176 HIS HA . 18552 1 984 . 1 1 176 176 HIS HB2 H 1 3.1780 0.05 . 2 . . . . 176 HIS HB1 . 18552 1 985 . 1 1 176 176 HIS HB3 H 1 2.9320 0.05 . 2 . . . . 176 HIS HB2 . 18552 1 986 . 1 1 176 176 HIS C C 13 173.8630 0.3 . 1 . . . . 176 HIS C . 18552 1 987 . 1 1 176 176 HIS CA C 13 52.8130 0.3 . 1 . . . . 176 HIS CA . 18552 1 988 . 1 1 176 176 HIS CB C 13 26.4330 0.3 . 1 . . . . 176 HIS CB . 18552 1 989 . 1 1 176 176 HIS N N 15 117.6990 0.3 . 1 . . . . 176 HIS N . 18552 1 990 . 1 1 177 177 GLU H H 1 8.5230 0.05 . 1 . . . . 177 GLU HN . 18552 1 991 . 1 1 177 177 GLU HA H 1 4.2480 0.05 . 1 . . . . 177 GLU HA . 18552 1 992 . 1 1 177 177 GLU HB2 H 1 1.9300 0.05 . 2 . . . . 177 GLU HB1 . 18552 1 993 . 1 1 177 177 GLU HB3 H 1 1.9300 0.05 . 2 . . . . 177 GLU HB2 . 18552 1 994 . 1 1 177 177 GLU HG2 H 1 2.2330 0.05 . 2 . . . . 177 GLU HG1 . 18552 1 995 . 1 1 177 177 GLU HG3 H 1 2.2330 0.05 . 2 . . . . 177 GLU HG2 . 18552 1 996 . 1 1 177 177 GLU C C 13 173.3460 0.3 . 1 . . . . 177 GLU C . 18552 1 997 . 1 1 177 177 GLU CA C 13 54.1210 0.3 . 1 . . . . 177 GLU CA . 18552 1 998 . 1 1 177 177 GLU CB C 13 26.9330 0.3 . 1 . . . . 177 GLU CB . 18552 1 999 . 1 1 177 177 GLU N N 15 121.0370 0.3 . 1 . . . . 177 GLU N . 18552 1 1000 . 1 1 178 178 LEU H H 1 8.1100 0.05 . 1 . . . . 178 LEU HN . 18552 1 1001 . 1 1 178 178 LEU HA H 1 4.3340 0.05 . 1 . . . . 178 LEU HA . 18552 1 1002 . 1 1 178 178 LEU HB2 H 1 1.5870 0.05 . 2 . . . . 178 LEU HB1 . 18552 1 1003 . 1 1 178 178 LEU HB3 H 1 1.5870 0.05 . 2 . . . . 178 LEU HB2 . 18552 1 1004 . 1 1 178 178 LEU HD11 H 1 0.8460 0.05 . 2 . . . . 178 LEU HD11 . 18552 1 1005 . 1 1 178 178 LEU HD12 H 1 0.8460 0.05 . 2 . . . . 178 LEU HD11 . 18552 1 1006 . 1 1 178 178 LEU HD13 H 1 0.8460 0.05 . 2 . . . . 178 LEU HD11 . 18552 1 1007 . 1 1 178 178 LEU HD21 H 1 0.8460 0.05 . 2 . . . . 178 LEU HD21 . 18552 1 1008 . 1 1 178 178 LEU HD22 H 1 0.8460 0.05 . 2 . . . . 178 LEU HD21 . 18552 1 1009 . 1 1 178 178 LEU HD23 H 1 0.8460 0.05 . 2 . . . . 178 LEU HD21 . 18552 1 1010 . 1 1 178 178 LEU C C 13 173.3490 0.3 . 1 . . . . 178 LEU C . 18552 1 1011 . 1 1 178 178 LEU CA C 13 51.8440 0.3 . 1 . . . . 178 LEU CA . 18552 1 1012 . 1 1 178 178 LEU CB C 13 39.4410 0.3 . 1 . . . . 178 LEU CB . 18552 1 1013 . 1 1 178 178 LEU N N 15 122.2540 0.3 . 1 . . . . 178 LEU N . 18552 1 1014 . 1 1 179 179 GLN H H 1 8.0490 0.05 . 1 . . . . 179 GLN HN . 18552 1 1015 . 1 1 179 179 GLN HA H 1 4.4750 0.05 . 1 . . . . 179 GLN HA . 18552 1 1016 . 1 1 179 179 GLN HB2 H 1 2.0920 0.05 . 2 . . . . 179 GLN HB1 . 18552 1 1017 . 1 1 179 179 GLN HB3 H 1 1.9630 0.05 . 2 . . . . 179 GLN HB2 . 18552 1 1018 . 1 1 179 179 GLN HG2 H 1 2.3550 0.05 . 2 . . . . 179 GLN HG1 . 18552 1 1019 . 1 1 179 179 GLN HG3 H 1 2.3550 0.05 . 2 . . . . 179 GLN HG2 . 18552 1 1020 . 1 1 179 179 GLN C C 13 173.3400 0.3 . 1 . . . . 179 GLN C . 18552 1 1021 . 1 1 179 179 GLN CA C 13 51.7190 0.3 . 1 . . . . 179 GLN CA . 18552 1 1022 . 1 1 179 179 GLN CB C 13 26.0630 0.3 . 1 . . . . 179 GLN CB . 18552 1 1023 . 1 1 179 179 GLN N N 15 121.7600 0.3 . 1 . . . . 179 GLN N . 18552 1 1024 . 1 1 180 180 PRO CA C 13 61.4480 0.3 . 1 . . . . 180 PRO CA . 18552 1 1025 . 1 1 180 180 PRO CB C 13 29.0130 0.3 . 1 . . . . 180 PRO CB . 18552 1 1026 . 1 1 181 181 LEU H H 1 7.9150 0.05 . 1 . . . . 181 LEU HN . 18552 1 1027 . 1 1 181 181 LEU HA H 1 4.2160 0.05 . 1 . . . . 181 LEU HA . 18552 1 1028 . 1 1 181 181 LEU HB2 H 1 1.6210 0.05 . 2 . . . . 181 LEU HB1 . 18552 1 1029 . 1 1 181 181 LEU HB3 H 1 1.6210 0.05 . 2 . . . . 181 LEU HB2 . 18552 1 1030 . 1 1 181 181 LEU HG H 1 1.6210 0.05 . 1 . . . . 181 LEU HG . 18552 1 1031 . 1 1 181 181 LEU C C 13 174.5350 0.3 . 1 . . . . 181 LEU C . 18552 1 1032 . 1 1 181 181 LEU CA C 13 52.9820 0.3 . 1 . . . . 181 LEU CA . 18552 1 1033 . 1 1 181 181 LEU CB C 13 38.9860 0.3 . 1 . . . . 181 LEU CB . 18552 1 1034 . 1 1 181 181 LEU N N 15 117.5690 0.3 . 1 . . . . 181 LEU N . 18552 1 1035 . 1 1 182 182 ALA H H 1 7.9250 0.05 . 1 . . . . 182 ALA HN . 18552 1 1036 . 1 1 182 182 ALA HA H 1 4.2450 0.05 . 1 . . . . 182 ALA HA . 18552 1 1037 . 1 1 182 182 ALA HB1 H 1 1.4010 0.05 . 1 . . . . 182 ALA HB1 . 18552 1 1038 . 1 1 182 182 ALA HB2 H 1 1.4010 0.05 . 1 . . . . 182 ALA HB1 . 18552 1 1039 . 1 1 182 182 ALA HB3 H 1 1.4010 0.05 . 1 . . . . 182 ALA HB1 . 18552 1 1040 . 1 1 182 182 ALA C C 13 175.3520 0.3 . 1 . . . . 182 ALA C . 18552 1 1041 . 1 1 182 182 ALA CA C 13 50.4670 0.3 . 1 . . . . 182 ALA CA . 18552 1 1042 . 1 1 182 182 ALA CB C 13 16.0340 0.3 . 1 . . . . 182 ALA CB . 18552 1 1043 . 1 1 182 182 ALA N N 15 122.5260 0.3 . 1 . . . . 182 ALA N . 18552 1 1044 . 1 1 183 183 ILE H H 1 7.6130 0.05 . 1 . . . . 183 ILE HN . 18552 1 1045 . 1 1 183 183 ILE HA H 1 4.0160 0.05 . 1 . . . . 183 ILE HA . 18552 1 1046 . 1 1 183 183 ILE HB H 1 1.9150 0.05 . 1 . . . . 183 ILE HB . 18552 1 1047 . 1 1 183 183 ILE HG12 H 1 1.5830 0.05 . 1 . . . . 183 ILE HG12 . 18552 1 1048 . 1 1 183 183 ILE HG21 H 1 0.8930 0.05 . 1 . . . . 183 ILE HG21 . 18552 1 1049 . 1 1 183 183 ILE HG22 H 1 0.8930 0.05 . 1 . . . . 183 ILE HG21 . 18552 1 1050 . 1 1 183 183 ILE HG23 H 1 0.8930 0.05 . 1 . . . . 183 ILE HG21 . 18552 1 1051 . 1 1 183 183 ILE HD11 H 1 0.8930 0.05 . 1 . . . . 183 ILE HD11 . 18552 1 1052 . 1 1 183 183 ILE HD12 H 1 0.8930 0.05 . 1 . . . . 183 ILE HD11 . 18552 1 1053 . 1 1 183 183 ILE HD13 H 1 0.8930 0.05 . 1 . . . . 183 ILE HD11 . 18552 1 1054 . 1 1 183 183 ILE C C 13 173.6590 0.3 . 1 . . . . 183 ILE C . 18552 1 1055 . 1 1 183 183 ILE CA C 13 59.4890 0.3 . 1 . . . . 183 ILE CA . 18552 1 1056 . 1 1 183 183 ILE CB C 13 35.5020 0.3 . 1 . . . . 183 ILE CB . 18552 1 1057 . 1 1 183 183 ILE N N 15 116.7020 0.3 . 1 . . . . 183 ILE N . 18552 1 1058 . 1 1 184 184 VAL H H 1 7.5590 0.05 . 1 . . . . 184 VAL HN . 18552 1 1059 . 1 1 184 184 VAL HA H 1 4.0130 0.05 . 1 . . . . 184 VAL HA . 18552 1 1060 . 1 1 184 184 VAL HB H 1 2.1380 0.05 . 1 . . . . 184 VAL HB . 18552 1 1061 . 1 1 184 184 VAL HG11 H 1 0.9310 0.05 . 2 . . . . 184 VAL HG11 . 18552 1 1062 . 1 1 184 184 VAL HG12 H 1 0.9310 0.05 . 2 . . . . 184 VAL HG11 . 18552 1 1063 . 1 1 184 184 VAL HG13 H 1 0.9310 0.05 . 2 . . . . 184 VAL HG11 . 18552 1 1064 . 1 1 184 184 VAL HG21 H 1 0.9310 0.05 . 2 . . . . 184 VAL HG21 . 18552 1 1065 . 1 1 184 184 VAL HG22 H 1 0.9310 0.05 . 2 . . . . 184 VAL HG21 . 18552 1 1066 . 1 1 184 184 VAL HG23 H 1 0.9310 0.05 . 2 . . . . 184 VAL HG21 . 18552 1 1067 . 1 1 184 184 VAL C C 13 173.2290 0.3 . 1 . . . . 184 VAL C . 18552 1 1068 . 1 1 184 184 VAL CA C 13 60.0870 0.3 . 1 . . . . 184 VAL CA . 18552 1 1069 . 1 1 184 184 VAL CB C 13 29.5110 0.3 . 1 . . . . 184 VAL CB . 18552 1 1070 . 1 1 184 184 VAL N N 15 118.4670 0.3 . 1 . . . . 184 VAL N . 18552 1 1071 . 1 1 185 185 ASP H H 1 7.9540 0.05 . 1 . . . . 185 ASP HN . 18552 1 1072 . 1 1 185 185 ASP HA H 1 4.6620 0.05 . 1 . . . . 185 ASP HA . 18552 1 1073 . 1 1 185 185 ASP HB2 H 1 2.6480 0.05 . 2 . . . . 185 ASP HB1 . 18552 1 1074 . 1 1 185 185 ASP C C 13 173.3040 0.3 . 1 . . . . 185 ASP C . 18552 1 1075 . 1 1 185 185 ASP CA C 13 52.9510 0.3 . 1 . . . . 185 ASP CA . 18552 1 1076 . 1 1 185 185 ASP CB C 13 36.3800 0.3 . 1 . . . . 185 ASP CB . 18552 1 1077 . 1 1 185 185 ASP N N 15 121.0580 0.3 . 1 . . . . 185 ASP N . 18552 1 1078 . 1 1 186 186 GLN H H 1 7.9630 0.05 . 1 . . . . 186 GLN HN . 18552 1 1079 . 1 1 186 186 GLN HB2 H 1 2.1740 0.05 . 2 . . . . 186 GLN HB1 . 18552 1 1080 . 1 1 186 186 GLN HB3 H 1 1.9340 0.05 . 2 . . . . 186 GLN HB2 . 18552 1 1081 . 1 1 186 186 GLN HG2 H 1 2.3240 0.05 . 2 . . . . 186 GLN HG1 . 18552 1 1082 . 1 1 186 186 GLN HG3 H 1 2.3240 0.05 . 2 . . . . 186 GLN HG2 . 18552 1 1083 . 1 1 186 186 GLN C C 13 174.1290 0.3 . 1 . . . . 186 GLN C . 18552 1 1084 . 1 1 186 186 GLN CA C 13 52.5670 0.3 . 1 . . . . 186 GLN CA . 18552 1 1085 . 1 1 186 186 GLN CB C 13 26.3480 0.3 . 1 . . . . 186 GLN CB . 18552 1 1086 . 1 1 186 186 GLN N N 15 119.4370 0.3 . 1 . . . . 186 GLN N . 18552 1 1087 . 1 1 187 187 ARG H H 1 8.0370 0.05 . 1 . . . . 187 ARG HN . 18552 1 1088 . 1 1 187 187 ARG HA H 1 4.1520 0.05 . 1 . . . . 187 ARG HA . 18552 1 1089 . 1 1 187 187 ARG HB2 H 1 1.7400 0.05 . 2 . . . . 187 ARG HB1 . 18552 1 1090 . 1 1 187 187 ARG HB3 H 1 1.7400 0.05 . 2 . . . . 187 ARG HB2 . 18552 1 1091 . 1 1 187 187 ARG HG2 H 1 1.7400 0.05 . 2 . . . . 187 ARG HG1 . 18552 1 1092 . 1 1 187 187 ARG HG3 H 1 1.7400 0.05 . 2 . . . . 187 ARG HG2 . 18552 1 1093 . 1 1 187 187 ARG C C 13 174.0360 0.3 . 1 . . . . 187 ARG C . 18552 1 1094 . 1 1 187 187 ARG CA C 13 51.7930 0.3 . 1 . . . . 187 ARG CA . 18552 1 1095 . 1 1 187 187 ARG CB C 13 26.8770 0.3 . 1 . . . . 187 ARG CB . 18552 1 1096 . 1 1 187 187 ARG N N 15 121.4710 0.3 . 1 . . . . 187 ARG N . 18552 1 1097 . 1 1 188 188 PRO CA C 13 61.1410 0.3 . 1 . . . . 188 PRO CA . 18552 1 1098 . 1 1 188 188 PRO CB C 13 29.1640 0.3 . 1 . . . . 188 PRO CB . 18552 1 1099 . 1 1 189 189 SER H H 1 8.1500 0.05 . 1 . . . . 189 SER HN . 18552 1 1100 . 1 1 189 189 SER HA H 1 4.3990 0.05 . 1 . . . . 189 SER HA . 18552 1 1101 . 1 1 189 189 SER HB2 H 1 3.8340 0.05 . 2 . . . . 189 SER HB1 . 18552 1 1102 . 1 1 189 189 SER HB3 H 1 3.8340 0.05 . 2 . . . . 189 SER HB2 . 18552 1 1103 . 1 1 189 189 SER C C 13 172.2680 0.3 . 1 . . . . 189 SER C . 18552 1 1104 . 1 1 189 189 SER CA C 13 55.5760 0.3 . 1 . . . . 189 SER CA . 18552 1 1105 . 1 1 189 189 SER CB C 13 61.1520 0.3 . 1 . . . . 189 SER CB . 18552 1 1106 . 1 1 189 189 SER N N 15 115.1400 0.3 . 1 . . . . 189 SER N . 18552 1 1107 . 1 1 190 190 SER H H 1 8.2000 0.05 . 1 . . . . 190 SER HN . 18552 1 1108 . 1 1 190 190 SER HA H 1 4.4910 0.05 . 1 . . . . 190 SER HA . 18552 1 1109 . 1 1 190 190 SER HB2 H 1 3.8950 0.05 . 2 . . . . 190 SER HB1 . 18552 1 1110 . 1 1 190 190 SER C C 13 172.1170 0.3 . 1 . . . . 190 SER C . 18552 1 1111 . 1 1 190 190 SER CA C 13 55.9560 0.3 . 1 . . . . 190 SER CA . 18552 1 1112 . 1 1 190 190 SER CB C 13 61.4390 0.3 . 1 . . . . 190 SER CB . 18552 1 1113 . 1 1 190 190 SER N N 15 117.5680 0.3 . 1 . . . . 190 SER N . 18552 1 1114 . 1 1 191 191 ARG H H 1 8.1280 0.05 . 1 . . . . 191 ARG HN . 18552 1 1115 . 1 1 191 191 ARG HA H 1 4.2940 0.05 . 1 . . . . 191 ARG HA . 18552 1 1116 . 1 1 191 191 ARG HB2 H 1 1.7650 0.05 . 2 . . . . 191 ARG HB1 . 18552 1 1117 . 1 1 191 191 ARG HB3 H 1 1.7650 0.05 . 2 . . . . 191 ARG HB2 . 18552 1 1118 . 1 1 191 191 ARG HG2 H 1 1.7650 0.05 . 2 . . . . 191 ARG HG1 . 18552 1 1119 . 1 1 191 191 ARG HG3 H 1 1.7650 0.05 . 2 . . . . 191 ARG HG2 . 18552 1 1120 . 1 1 191 191 ARG C C 13 173.6450 0.3 . 1 . . . . 191 ARG C . 18552 1 1121 . 1 1 191 191 ARG CA C 13 53.4190 0.3 . 1 . . . . 191 ARG CA . 18552 1 1122 . 1 1 191 191 ARG CB C 13 27.3670 0.3 . 1 . . . . 191 ARG CB . 18552 1 1123 . 1 1 191 191 ARG N N 15 122.2240 0.3 . 1 . . . . 191 ARG N . 18552 1 1124 . 1 1 192 192 ALA H H 1 8.1370 0.05 . 1 . . . . 192 ALA HN . 18552 1 1125 . 1 1 192 192 ALA HA H 1 4.2720 0.05 . 1 . . . . 192 ALA HA . 18552 1 1126 . 1 1 192 192 ALA HB1 H 1 1.3940 0.05 . 1 . . . . 192 ALA HB1 . 18552 1 1127 . 1 1 192 192 ALA HB2 H 1 1.3940 0.05 . 1 . . . . 192 ALA HB1 . 18552 1 1128 . 1 1 192 192 ALA HB3 H 1 1.3940 0.05 . 1 . . . . 192 ALA HB1 . 18552 1 1129 . 1 1 192 192 ALA C C 13 175.2970 0.3 . 1 . . . . 192 ALA C . 18552 1 1130 . 1 1 192 192 ALA CA C 13 50.3250 0.3 . 1 . . . . 192 ALA CA . 18552 1 1131 . 1 1 192 192 ALA CB C 13 16.1550 0.3 . 1 . . . . 192 ALA CB . 18552 1 1132 . 1 1 192 192 ALA N N 15 123.8930 0.3 . 1 . . . . 192 ALA N . 18552 1 1133 . 1 1 193 193 SER H H 1 8.0390 0.05 . 1 . . . . 193 SER HN . 18552 1 1134 . 1 1 193 193 SER HA H 1 4.4740 0.05 . 1 . . . . 193 SER HA . 18552 1 1135 . 1 1 193 193 SER HB2 H 1 3.8610 0.05 . 2 . . . . 193 SER HB1 . 18552 1 1136 . 1 1 193 193 SER HB3 H 1 3.8610 0.05 . 2 . . . . 193 SER HB2 . 18552 1 1137 . 1 1 193 193 SER C C 13 172.2420 0.3 . 1 . . . . 193 SER C . 18552 1 1138 . 1 1 193 193 SER CA C 13 55.6540 0.3 . 1 . . . . 193 SER CA . 18552 1 1139 . 1 1 193 193 SER CB C 13 60.9470 0.3 . 1 . . . . 193 SER CB . 18552 1 1140 . 1 1 193 193 SER N N 15 114.0400 0.3 . 1 . . . . 193 SER N . 18552 1 1141 . 1 1 194 194 SER H H 1 8.1600 0.05 . 1 . . . . 194 SER HN . 18552 1 1142 . 1 1 194 194 SER HA H 1 4.4940 0.05 . 1 . . . . 194 SER HA . 18552 1 1143 . 1 1 194 194 SER HB2 H 1 3.8980 0.05 . 2 . . . . 194 SER HB1 . 18552 1 1144 . 1 1 194 194 SER HB3 H 1 3.8980 0.05 . 2 . . . . 194 SER HB2 . 18552 1 1145 . 1 1 194 194 SER C C 13 172.1170 0.3 . 1 . . . . 194 SER C . 18552 1 1146 . 1 1 194 194 SER CA C 13 55.9570 0.3 . 1 . . . . 194 SER CA . 18552 1 1147 . 1 1 194 194 SER CB C 13 60.8270 0.3 . 1 . . . . 194 SER CB . 18552 1 1148 . 1 1 194 194 SER N N 15 117.4050 0.3 . 1 . . . . 194 SER N . 18552 1 1149 . 1 1 195 195 ARG H H 1 8.1490 0.05 . 1 . . . . 195 ARG HN . 18552 1 1150 . 1 1 195 195 ARG HA H 1 4.0870 0.05 . 1 . . . . 195 ARG HA . 18552 1 1151 . 1 1 195 195 ARG HB2 H 1 1.6420 0.05 . 2 . . . . 195 ARG HB1 . 18552 1 1152 . 1 1 195 195 ARG HB3 H 1 1.6420 0.05 . 2 . . . . 195 ARG HB2 . 18552 1 1153 . 1 1 195 195 ARG HG2 H 1 1.6420 0.05 . 2 . . . . 195 ARG HG1 . 18552 1 1154 . 1 1 195 195 ARG HG3 H 1 1.6420 0.05 . 2 . . . . 195 ARG HG2 . 18552 1 1155 . 1 1 195 195 ARG C C 13 173.6450 0.3 . 1 . . . . 195 ARG C . 18552 1 1156 . 1 1 195 195 ARG CA C 13 53.4790 0.3 . 1 . . . . 195 ARG CA . 18552 1 1157 . 1 1 195 195 ARG CB C 13 27.6380 0.3 . 1 . . . . 195 ARG CB . 18552 1 1158 . 1 1 195 195 ARG N N 15 122.2840 0.3 . 1 . . . . 195 ARG N . 18552 1 1159 . 1 1 196 196 ALA H H 1 8.1230 0.05 . 1 . . . . 196 ALA HN . 18552 1 1160 . 1 1 196 196 ALA HA H 1 4.2440 0.05 . 1 . . . . 196 ALA HA . 18552 1 1161 . 1 1 196 196 ALA HB1 H 1 1.3600 0.05 . 1 . . . . 196 ALA HB1 . 18552 1 1162 . 1 1 196 196 ALA HB2 H 1 1.3600 0.05 . 1 . . . . 196 ALA HB1 . 18552 1 1163 . 1 1 196 196 ALA HB3 H 1 1.3600 0.05 . 1 . . . . 196 ALA HB1 . 18552 1 1164 . 1 1 196 196 ALA C C 13 175.0950 0.3 . 1 . . . . 196 ALA C . 18552 1 1165 . 1 1 196 196 ALA CA C 13 50.2160 0.3 . 1 . . . . 196 ALA CA . 18552 1 1166 . 1 1 196 196 ALA CB C 13 16.2420 0.3 . 1 . . . . 196 ALA CB . 18552 1 1167 . 1 1 196 196 ALA N N 15 124.0660 0.3 . 1 . . . . 196 ALA N . 18552 1 1168 . 1 1 197 197 SER H H 1 8.0600 0.05 . 1 . . . . 197 SER HN . 18552 1 1169 . 1 1 197 197 SER HA H 1 4.4790 0.05 . 1 . . . . 197 SER HA . 18552 1 1170 . 1 1 197 197 SER HB2 H 1 3.8650 0.05 . 2 . . . . 197 SER HB1 . 18552 1 1171 . 1 1 197 197 SER HB3 H 1 3.8650 0.05 . 2 . . . . 197 SER HB2 . 18552 1 1172 . 1 1 197 197 SER C C 13 171.7880 0.3 . 1 . . . . 197 SER C . 18552 1 1173 . 1 1 197 197 SER CA C 13 55.7650 0.3 . 1 . . . . 197 SER CA . 18552 1 1174 . 1 1 197 197 SER CB C 13 60.9840 0.3 . 1 . . . . 197 SER CB . 18552 1 1175 . 1 1 197 197 SER N N 15 113.9610 0.3 . 1 . . . . 197 SER N . 18552 1 1176 . 1 1 198 198 SER H H 1 8.1030 0.05 . 1 . . . . 198 SER HN . 18552 1 1177 . 1 1 198 198 SER HA H 1 4.4640 0.05 . 1 . . . . 198 SER HA . 18552 1 1178 . 1 1 198 198 SER HB2 H 1 3.8560 0.05 . 2 . . . . 198 SER HB1 . 18552 1 1179 . 1 1 198 198 SER HB3 H 1 3.8560 0.05 . 2 . . . . 198 SER HB2 . 18552 1 1180 . 1 1 198 198 SER C C 13 171.1430 0.3 . 1 . . . . 198 SER C . 18552 1 1181 . 1 1 198 198 SER CA C 13 55.5830 0.3 . 1 . . . . 198 SER CA . 18552 1 1182 . 1 1 198 198 SER CB C 13 61.0290 0.3 . 1 . . . . 198 SER CB . 18552 1 1183 . 1 1 198 198 SER N N 15 117.2280 0.3 . 1 . . . . 198 SER N . 18552 1 1184 . 1 1 199 199 ARG H H 1 8.0460 0.05 . 1 . . . . 199 ARG HN . 18552 1 1185 . 1 1 199 199 ARG HA H 1 4.3980 0.05 . 1 . . . . 199 ARG HA . 18552 1 1186 . 1 1 199 199 ARG HB2 H 1 1.8190 0.05 . 2 . . . . 199 ARG HB1 . 18552 1 1187 . 1 1 199 199 ARG HB3 H 1 1.8190 0.05 . 2 . . . . 199 ARG HB2 . 18552 1 1188 . 1 1 199 199 ARG HG2 H 1 1.6860 0.05 . 2 . . . . 199 ARG HG1 . 18552 1 1189 . 1 1 199 199 ARG HG3 H 1 1.6860 0.05 . 2 . . . . 199 ARG HG2 . 18552 1 1190 . 1 1 199 199 ARG HD2 H 1 3.1880 0.05 . 2 . . . . 199 ARG HD1 . 18552 1 1191 . 1 1 199 199 ARG HD3 H 1 3.1880 0.05 . 2 . . . . 199 ARG HD2 . 18552 1 1192 . 1 1 199 199 ARG C C 13 171.2560 0.3 . 1 . . . . 199 ARG C . 18552 1 1193 . 1 1 199 199 ARG CA C 13 51.2590 0.3 . 1 . . . . 199 ARG CA . 18552 1 1194 . 1 1 199 199 ARG CB C 13 27.4060 0.3 . 1 . . . . 199 ARG CB . 18552 1 1195 . 1 1 199 199 ARG N N 15 123.0160 0.3 . 1 . . . . 199 ARG N . 18552 1 1196 . 1 1 200 200 PRO C C 13 173.6230 0.3 . 1 . . . . 200 PRO C . 18552 1 1197 . 1 1 200 200 PRO CA C 13 60.2460 0.3 . 1 . . . . 200 PRO CA . 18552 1 1198 . 1 1 200 200 PRO CB C 13 29.0760 0.3 . 1 . . . . 200 PRO CB . 18552 1 1199 . 1 1 201 201 ARG H H 1 8.3130 0.05 . 1 . . . . 201 ARG HN . 18552 1 1200 . 1 1 201 201 ARG HA H 1 4.3240 0.05 . 1 . . . . 201 ARG HA . 18552 1 1201 . 1 1 201 201 ARG HB2 H 1 1.8790 0.05 . 2 . . . . 201 ARG HB1 . 18552 1 1202 . 1 1 201 201 ARG HB3 H 1 1.7900 0.05 . 2 . . . . 201 ARG HB2 . 18552 1 1203 . 1 1 201 201 ARG HG2 H 1 1.7130 0.05 . 2 . . . . 201 ARG HG1 . 18552 1 1204 . 1 1 201 201 ARG HG3 H 1 1.7130 0.05 . 2 . . . . 201 ARG HG2 . 18552 1 1205 . 1 1 201 201 ARG HD2 H 1 3.2080 0.05 . 2 . . . . 201 ARG HD1 . 18552 1 1206 . 1 1 201 201 ARG HD3 H 1 3.2080 0.05 . 2 . . . . 201 ARG HD2 . 18552 1 1207 . 1 1 201 201 ARG C C 13 172.1670 0.3 . 1 . . . . 201 ARG C . 18552 1 1208 . 1 1 201 201 ARG CA C 13 50.8920 0.3 . 1 . . . . 201 ARG CA . 18552 1 1209 . 1 1 201 201 ARG CB C 13 27.7420 0.3 . 1 . . . . 201 ARG CB . 18552 1 1210 . 1 1 201 201 ARG N N 15 121.5150 0.3 . 1 . . . . 201 ARG N . 18552 1 1211 . 1 1 202 202 PRO CA C 13 60.8490 0.3 . 1 . . . . 202 PRO CA . 18552 1 1212 . 1 1 202 202 PRO CB C 13 29.0120 0.3 . 1 . . . . 202 PRO CB . 18552 1 1213 . 1 1 203 203 ASP H H 1 8.2500 0.05 . 1 . . . . 203 ASP HN . 18552 1 1214 . 1 1 203 203 ASP HA H 1 4.4950 0.05 . 1 . . . . 203 ASP HA . 18552 1 1215 . 1 1 203 203 ASP HB2 H 1 2.6140 0.05 . 2 . . . . 203 ASP HB1 . 18552 1 1216 . 1 1 203 203 ASP HB3 H 1 2.6140 0.05 . 2 . . . . 203 ASP HB2 . 18552 1 1217 . 1 1 203 203 ASP C C 13 173.3040 0.3 . 1 . . . . 203 ASP C . 18552 1 1218 . 1 1 203 203 ASP CA C 13 51.6280 0.3 . 1 . . . . 203 ASP CA . 18552 1 1219 . 1 1 203 203 ASP CB C 13 37.9220 0.3 . 1 . . . . 203 ASP CB . 18552 1 1220 . 1 1 203 203 ASP N N 15 118.1080 0.3 . 1 . . . . 203 ASP N . 18552 1 1221 . 1 1 204 204 ASP H H 1 8.0000 0.05 . 1 . . . . 204 ASP HN . 18552 1 1222 . 1 1 204 204 ASP HA H 1 4.5640 0.05 . 1 . . . . 204 ASP HA . 18552 1 1223 . 1 1 204 204 ASP HB2 H 1 2.6530 0.05 . 2 . . . . 204 ASP HB1 . 18552 1 1224 . 1 1 204 204 ASP C C 13 173.4440 0.3 . 1 . . . . 204 ASP C . 18552 1 1225 . 1 1 204 204 ASP CA C 13 51.6650 0.3 . 1 . . . . 204 ASP CA . 18552 1 1226 . 1 1 204 204 ASP CB C 13 38.0300 0.3 . 1 . . . . 204 ASP CB . 18552 1 1227 . 1 1 204 204 ASP N N 15 119.1980 0.3 . 1 . . . . 204 ASP N . 18552 1 1228 . 1 1 205 205 LEU H H 1 7.8730 0.05 . 1 . . . . 205 LEU HN . 18552 1 1229 . 1 1 205 205 LEU HA H 1 4.3110 0.05 . 1 . . . . 205 LEU HA . 18552 1 1230 . 1 1 205 205 LEU HB2 H 1 1.5960 0.05 . 2 . . . . 205 LEU HB1 . 18552 1 1231 . 1 1 205 205 LEU HB3 H 1 1.5960 0.05 . 2 . . . . 205 LEU HB2 . 18552 1 1232 . 1 1 205 205 LEU HG H 1 1.5960 0.05 . 1 . . . . 205 LEU HG . 18552 1 1233 . 1 1 205 205 LEU HD11 H 1 0.8520 0.05 . 2 . . . . 205 LEU HD11 . 18552 1 1234 . 1 1 205 205 LEU HD12 H 1 0.8520 0.05 . 2 . . . . 205 LEU HD11 . 18552 1 1235 . 1 1 205 205 LEU HD13 H 1 0.8520 0.05 . 2 . . . . 205 LEU HD11 . 18552 1 1236 . 1 1 205 205 LEU HD21 H 1 0.8520 0.05 . 2 . . . . 205 LEU HD21 . 18552 1 1237 . 1 1 205 205 LEU HD22 H 1 0.8520 0.05 . 2 . . . . 205 LEU HD21 . 18552 1 1238 . 1 1 205 205 LEU HD23 H 1 0.8520 0.05 . 2 . . . . 205 LEU HD21 . 18552 1 1239 . 1 1 205 205 LEU C C 13 174.2120 0.3 . 1 . . . . 205 LEU C . 18552 1 1240 . 1 1 205 205 LEU CA C 13 52.1420 0.3 . 1 . . . . 205 LEU CA . 18552 1 1241 . 1 1 205 205 LEU CB C 13 39.6500 0.3 . 1 . . . . 205 LEU CB . 18552 1 1242 . 1 1 205 205 LEU N N 15 121.1830 0.3 . 1 . . . . 205 LEU N . 18552 1 1243 . 1 1 206 206 GLU H H 1 8.1620 0.05 . 1 . . . . 206 GLU HN . 18552 1 1244 . 1 1 206 206 GLU HA H 1 4.3140 0.05 . 1 . . . . 206 GLU HA . 18552 1 1245 . 1 1 206 206 GLU HB2 H 1 2.0400 0.05 . 2 . . . . 206 GLU HB1 . 18552 1 1246 . 1 1 206 206 GLU HB3 H 1 1.9010 0.05 . 2 . . . . 206 GLU HB2 . 18552 1 1247 . 1 1 206 206 GLU HG2 H 1 2.2200 0.05 . 2 . . . . 206 GLU HG1 . 18552 1 1248 . 1 1 206 206 GLU HG3 H 1 2.2160 0.05 . 2 . . . . 206 GLU HG2 . 18552 1 1249 . 1 1 206 206 GLU C C 13 172.3790 0.3 . 1 . . . . 206 GLU C . 18552 1 1250 . 1 1 206 206 GLU CA C 13 53.4850 0.3 . 1 . . . . 206 GLU CA . 18552 1 1251 . 1 1 206 206 GLU CB C 13 27.2390 0.3 . 1 . . . . 206 GLU CB . 18552 1 1252 . 1 1 206 206 GLU N N 15 122.0470 0.3 . 1 . . . . 206 GLU N . 18552 1 1253 . 1 1 207 207 ILE H H 1 7.4970 0.05 . 1 . . . . 207 ILE HN . 18552 1 1254 . 1 1 207 207 ILE HA H 1 4.0650 0.05 . 1 . . . . 207 ILE HA . 18552 1 1255 . 1 1 207 207 ILE HB H 1 2.2030 0.05 . 1 . . . . 207 ILE HB . 18552 1 1256 . 1 1 207 207 ILE HG12 H 1 1.4320 0.05 . 1 . . . . 207 ILE HG11 . 18552 1 1257 . 1 1 207 207 ILE HG13 H 1 1.7810 0.05 . 1 . . . . 207 ILE HG12 . 18552 1 1258 . 1 1 207 207 ILE HG21 H 1 0.8460 0.05 . 1 . . . . 207 ILE HG21 . 18552 1 1259 . 1 1 207 207 ILE HG22 H 1 0.8460 0.05 . 1 . . . . 207 ILE HG21 . 18552 1 1260 . 1 1 207 207 ILE HG23 H 1 0.8460 0.05 . 1 . . . . 207 ILE HG21 . 18552 1 1261 . 1 1 207 207 ILE HD11 H 1 0.8460 0.05 . 1 . . . . 207 ILE HD11 . 18552 1 1262 . 1 1 207 207 ILE HD12 H 1 0.8460 0.05 . 1 . . . . 207 ILE HD11 . 18552 1 1263 . 1 1 207 207 ILE HD13 H 1 0.8460 0.05 . 1 . . . . 207 ILE HD11 . 18552 1 1264 . 1 1 207 207 ILE C C 13 172.3790 0.3 . 1 . . . . 207 ILE C . 18552 1 1265 . 1 1 207 207 ILE CA C 13 59.9580 0.3 . 1 . . . . 207 ILE CA . 18552 1 1266 . 1 1 207 207 ILE CB C 13 36.8490 0.3 . 1 . . . . 207 ILE CB . 18552 1 1267 . 1 1 207 207 ILE N N 15 125.6870 0.3 . 1 . . . . 207 ILE N . 18552 1 stop_ save_