data_5280 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5280 _Entry.Title ; Assignments of the 1H, 13C, and 15N, resonances of the winged helix domain of the proto-oncoprotein c-Qin (FoxG1B) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2002-02-06 _Entry.Accession_date 2002-02-06 _Entry.Last_release_date 2002-08-23 _Entry.Original_release_date 2002-08-23 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Dhammika Jayawardene . S. . 5280 2 Junmin Liu . . . 5280 3 Weixing Zhang . . . 5280 4 Richard Kriwacki . . . 5280 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5280 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 863 5280 '13C chemical shifts' 548 5280 '15N chemical shifts' 133 5280 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2002-08-23 2002-02-06 original author . 5280 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5280 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Letter to the Editor: Assignments of the 1H, 13C, and 15N, resonances of the winged helix domain of the proto-oncoprotein c-Qin (FoxG1B) ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 23 _Citation.Journal_issue 3 _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 243 _Citation.Page_last 244 _Citation.Year 2002 _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 Dhammika Jayawardene . S. . 5280 1 2 Junmin Liu . . . 5280 1 3 Weixing Zhang . . . 5280 1 4 Richard Kriwacki . . . 5280 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR assignments' 5280 1 cellular-Qin 5280 1 'Winged helix domain' 5280 1 FoxG1B 5280 1 stop_ save_ save_ref_1 _Citation.Sf_category citations _Citation.Sf_framecode ref_1 _Citation.Entry_ID 5280 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 7831308 _Citation.Full_citation ; Chang HW, Li J, Kretzschmar D, Vogt PK. Avian cellular homolog of the qin oncogene. Proc Natl Acad Sci U S A. 1995 Jan 17;92(2):447-51. ; _Citation.Title 'Avian cellular homolog of the qin oncogene.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full 'Proceedings of the National Academy of Sciences of the United States of America' _Citation.Journal_volume 92 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0027-8424 _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 447 _Citation.Page_last 451 _Citation.Year 1995 _Citation.Details ; We have isolated chicken cDNA clones of the c-qin gene, the cellular counterpart of the v-qin (Chinese for "avian") oncogene of avian sarcoma virus 31. There are several differences between the cellular and the viral qin sequences: (i) two nonconservative amino acid substitutions in the Qin coding region; (ii) a truncation in the carboxyl terminus of the viral protein due to a premature stop codon; (iii) a partial Gag sequence fused to the amino terminus of viral Qin; and (iv) eight cell-coded amino acids which link the cellular Qin coding domain to the viral Gag domain. We have also characterized the expression pattern of c-qin in chicken embryos by in situ hybridization and by Northern blot analysis. c-qin is abundantly expressed in the developing brain, and this expression is restricted to the telencephalon of early embryos. ; 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 'H W' Chang H. W. . 5280 2 2 J Li J. . . 5280 2 3 D Kretzschmar D. . . 5280 2 4 'P K' Vogt P. K. . 5280 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_c-Qin-WHD _Assembly.Sf_category assembly _Assembly.Sf_framecode system_c-Qin-WHD _Assembly.Entry_ID 5280 _Assembly.ID 1 _Assembly.Name 'cellular Qin winged helix domain' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details ; The molecule reported in this depositon contains only the winged helix domain (residues 131-253) of cellullar Qin. Also C 200 has been replaced by S. This mutation has been shown to not alter the structure or DNA binding properties of c-Qin-WHD. ; _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5280 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 c-Qin-WHD 1 $c-Qin-WHD . . . native . . . . . 5280 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . swissprot Q90964 . . . . . . 5280 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'cellular Qin winged helix domain' system 5280 1 c-Qin-WHD abbreviation 5280 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'DNA binding' 5280 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_c-Qin-WHD _Entity.Sf_category entity _Entity.Sf_framecode c-Qin-WHD _Entity.Entry_ID 5280 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'cellular Qin winged helix domain' _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 ; GSHMGKEGEKKNGKYEKPPF SYNALIMMAIRQSPEKRLTL NGIYEFIMKNFPYYRENKQG WQNSIRHNLSLNKSFVKVPR HYDDPGKGNYWMLDPSSDDV FIGGTTGKLRRRSTTSRAKL AFKRGAR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 127 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14720.8 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; The first 4 residues(GSHM)of the full sequence is a residual tag from cloning and is not a part of c-qin-whd. The fifth residue G in the full sequence corresponds to G 131 of the cellular Qin. ; _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no DBJ BAE21092 . "unnamed protein product [Mus musculus]" . . . . . 96.85 481 98.37 99.19 5.47e-82 . . . . 5280 1 2 no EMBL CAA52239 . "transcription factor [Homo sapiens]" . . . . . 96.06 477 98.36 98.36 1.07e-80 . . . . 5280 1 3 no EMBL CAF93027 . "unnamed protein product, partial [Tetraodon nigroviridis]" . . . . . 78.74 310 98.00 99.00 2.13e-65 . . . . 5280 1 4 no EMBL CAI91293 . "sloppy paired [Cupiennius salei]" . . . . . 59.06 75 97.33 98.67 3.19e-47 . . . . 5280 1 5 no GB AAA40812 . "BF-1 [Rattus norvegicus]" . . . . . 96.85 480 98.37 99.19 5.11e-82 . . . . 5280 1 6 no GB AAA66954 . "putative [Gallus gallus]" . . . . . 96.85 451 99.19 99.19 2.56e-83 . . . . 5280 1 7 no GB AAB08466 . "chicken brain factor-1 [Gallus gallus]" . . . . . 96.85 451 99.19 99.19 2.56e-83 . . . . 5280 1 8 no GB AAB42158 . "brain factor-1 [Mus musculus]" . . . . . 96.85 481 98.37 99.19 5.47e-82 . . . . 5280 1 9 no GB AAC18393 . "transcription factor BF-1 [Danio rerio]" . . . . . 96.85 420 98.37 99.19 3.15e-83 . . . . 5280 1 10 no PIR A47446 . "HNF-3/fork head family transcription factor Qin - avian sarcoma virus 31" . . . . . 96.85 387 98.37 98.37 1.33e-82 . . . . 5280 1 11 no PIR A54743 . "transcription factor HFK1 - human" . . . . . 96.06 476 98.36 98.36 2.44e-81 . . . . 5280 1 12 no PRF 2115219B . "brain factor 1" . . . . . 96.06 477 98.36 98.36 1.07e-80 . . . . 5280 1 13 no REF NP_001079165 . "forkhead box protein G1 [Xenopus laevis]" . . . . . 94.49 436 98.33 99.17 6.70e-80 . . . . 5280 1 14 no REF NP_001116933 . "forkhead box G1 [Xenopus (Silurana) tropicalis]" . . . . . 97.64 432 98.39 98.39 6.21e-81 . . . . 5280 1 15 no REF NP_001153584 . "forkhead box protein G1 [Mus musculus]" . . . . . 96.85 481 98.37 99.19 5.47e-82 . . . . 5280 1 16 no REF NP_005240 . "forkhead box protein G1 [Homo sapiens]" . . . . . 96.85 489 99.19 99.19 1.61e-82 . . . . 5280 1 17 no REF NP_032267 . "forkhead box protein G1 [Mus musculus]" . . . . . 96.85 481 98.37 99.19 5.47e-82 . . . . 5280 1 18 no SP P55316 . "RecName: Full=Forkhead box protein G1; AltName: Full=Brain factor 1; Short=BF-1; Short=BF1; AltName: Full=Brain factor 2; Short" . . . . . 96.85 489 99.19 99.19 1.61e-82 . . . . 5280 1 19 no SP P56260 . "RecName: Full=Transforming protein Qin; AltName: Full=Oncogene Qin [Avian sarcoma virus 31]" . . . . . 96.85 387 98.37 98.37 1.33e-82 . . . . 5280 1 20 no SP Q00939 . "RecName: Full=Forkhead box protein G1; Short=FoxG1; AltName: Full=Brain factor 1; Short=BF-1; Short=BF1; AltName: Full=Forkhead" . . . . . 96.85 480 98.37 99.19 5.11e-82 . . . . 5280 1 21 no SP Q1A1A1 . "RecName: Full=Forkhead box protein G1; Short=FoxG1 [Ceratotherium simum]" . . . . . 96.85 486 99.19 99.19 1.31e-82 . . . . 5280 1 22 no SP Q1A1A2 . "RecName: Full=Forkhead box protein G1; Short=FoxG1 [Equus burchellii]" . . . . . 96.85 488 99.19 99.19 1.73e-82 . . . . 5280 1 23 no TPG DAA17496 . "TPA: forkhead box protein G1-like [Bos taurus]" . . . . . 96.85 491 99.19 99.19 2.10e-82 . . . . 5280 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'cellular Qin winged helix domain' common 5280 1 C200S variant 5280 1 c-Qin-WHD abbreviation 5280 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 -4 GLY . 5280 1 2 -3 SER . 5280 1 3 -2 HIS . 5280 1 4 -1 MET . 5280 1 5 131 GLY . 5280 1 6 132 LYS . 5280 1 7 133 GLU . 5280 1 8 134 GLY . 5280 1 9 135 GLU . 5280 1 10 136 LYS . 5280 1 11 137 LYS . 5280 1 12 138 ASN . 5280 1 13 139 GLY . 5280 1 14 140 LYS . 5280 1 15 141 TYR . 5280 1 16 142 GLU . 5280 1 17 143 LYS . 5280 1 18 144 PRO . 5280 1 19 145 PRO . 5280 1 20 146 PHE . 5280 1 21 147 SER . 5280 1 22 148 TYR . 5280 1 23 149 ASN . 5280 1 24 150 ALA . 5280 1 25 151 LEU . 5280 1 26 152 ILE . 5280 1 27 153 MET . 5280 1 28 154 MET . 5280 1 29 155 ALA . 5280 1 30 156 ILE . 5280 1 31 157 ARG . 5280 1 32 158 GLN . 5280 1 33 159 SER . 5280 1 34 160 PRO . 5280 1 35 161 GLU . 5280 1 36 162 LYS . 5280 1 37 163 ARG . 5280 1 38 164 LEU . 5280 1 39 165 THR . 5280 1 40 166 LEU . 5280 1 41 167 ASN . 5280 1 42 168 GLY . 5280 1 43 169 ILE . 5280 1 44 170 TYR . 5280 1 45 171 GLU . 5280 1 46 172 PHE . 5280 1 47 173 ILE . 5280 1 48 174 MET . 5280 1 49 175 LYS . 5280 1 50 176 ASN . 5280 1 51 177 PHE . 5280 1 52 178 PRO . 5280 1 53 179 TYR . 5280 1 54 180 TYR . 5280 1 55 181 ARG . 5280 1 56 182 GLU . 5280 1 57 183 ASN . 5280 1 58 184 LYS . 5280 1 59 185 GLN . 5280 1 60 186 GLY . 5280 1 61 187 TRP . 5280 1 62 188 GLN . 5280 1 63 189 ASN . 5280 1 64 190 SER . 5280 1 65 191 ILE . 5280 1 66 192 ARG . 5280 1 67 193 HIS . 5280 1 68 194 ASN . 5280 1 69 195 LEU . 5280 1 70 196 SER . 5280 1 71 197 LEU . 5280 1 72 198 ASN . 5280 1 73 199 LYS . 5280 1 74 200 SER . 5280 1 75 201 PHE . 5280 1 76 202 VAL . 5280 1 77 203 LYS . 5280 1 78 204 VAL . 5280 1 79 205 PRO . 5280 1 80 206 ARG . 5280 1 81 207 HIS . 5280 1 82 208 TYR . 5280 1 83 209 ASP . 5280 1 84 210 ASP . 5280 1 85 211 PRO . 5280 1 86 212 GLY . 5280 1 87 213 LYS . 5280 1 88 214 GLY . 5280 1 89 215 ASN . 5280 1 90 216 TYR . 5280 1 91 217 TRP . 5280 1 92 218 MET . 5280 1 93 219 LEU . 5280 1 94 220 ASP . 5280 1 95 221 PRO . 5280 1 96 222 SER . 5280 1 97 223 SER . 5280 1 98 224 ASP . 5280 1 99 225 ASP . 5280 1 100 226 VAL . 5280 1 101 227 PHE . 5280 1 102 228 ILE . 5280 1 103 229 GLY . 5280 1 104 230 GLY . 5280 1 105 231 THR . 5280 1 106 232 THR . 5280 1 107 233 GLY . 5280 1 108 234 LYS . 5280 1 109 235 LEU . 5280 1 110 236 ARG . 5280 1 111 237 ARG . 5280 1 112 238 ARG . 5280 1 113 239 SER . 5280 1 114 240 THR . 5280 1 115 241 THR . 5280 1 116 242 SER . 5280 1 117 243 ARG . 5280 1 118 244 ALA . 5280 1 119 245 LYS . 5280 1 120 246 LEU . 5280 1 121 247 ALA . 5280 1 122 248 PHE . 5280 1 123 249 LYS . 5280 1 124 250 ARG . 5280 1 125 251 GLY . 5280 1 126 252 ALA . 5280 1 127 253 ARG . 5280 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 . GLY 1 1 5280 1 . SER 2 2 5280 1 . HIS 3 3 5280 1 . MET 4 4 5280 1 . GLY 5 5 5280 1 . LYS 6 6 5280 1 . GLU 7 7 5280 1 . GLY 8 8 5280 1 . GLU 9 9 5280 1 . LYS 10 10 5280 1 . LYS 11 11 5280 1 . ASN 12 12 5280 1 . GLY 13 13 5280 1 . LYS 14 14 5280 1 . TYR 15 15 5280 1 . GLU 16 16 5280 1 . LYS 17 17 5280 1 . PRO 18 18 5280 1 . PRO 19 19 5280 1 . PHE 20 20 5280 1 . SER 21 21 5280 1 . TYR 22 22 5280 1 . ASN 23 23 5280 1 . ALA 24 24 5280 1 . LEU 25 25 5280 1 . ILE 26 26 5280 1 . MET 27 27 5280 1 . MET 28 28 5280 1 . ALA 29 29 5280 1 . ILE 30 30 5280 1 . ARG 31 31 5280 1 . GLN 32 32 5280 1 . SER 33 33 5280 1 . PRO 34 34 5280 1 . GLU 35 35 5280 1 . LYS 36 36 5280 1 . ARG 37 37 5280 1 . LEU 38 38 5280 1 . THR 39 39 5280 1 . LEU 40 40 5280 1 . ASN 41 41 5280 1 . GLY 42 42 5280 1 . ILE 43 43 5280 1 . TYR 44 44 5280 1 . GLU 45 45 5280 1 . PHE 46 46 5280 1 . ILE 47 47 5280 1 . MET 48 48 5280 1 . LYS 49 49 5280 1 . ASN 50 50 5280 1 . PHE 51 51 5280 1 . PRO 52 52 5280 1 . TYR 53 53 5280 1 . TYR 54 54 5280 1 . ARG 55 55 5280 1 . GLU 56 56 5280 1 . ASN 57 57 5280 1 . LYS 58 58 5280 1 . GLN 59 59 5280 1 . GLY 60 60 5280 1 . TRP 61 61 5280 1 . GLN 62 62 5280 1 . ASN 63 63 5280 1 . SER 64 64 5280 1 . ILE 65 65 5280 1 . ARG 66 66 5280 1 . HIS 67 67 5280 1 . ASN 68 68 5280 1 . LEU 69 69 5280 1 . SER 70 70 5280 1 . LEU 71 71 5280 1 . ASN 72 72 5280 1 . LYS 73 73 5280 1 . SER 74 74 5280 1 . PHE 75 75 5280 1 . VAL 76 76 5280 1 . LYS 77 77 5280 1 . VAL 78 78 5280 1 . PRO 79 79 5280 1 . ARG 80 80 5280 1 . HIS 81 81 5280 1 . TYR 82 82 5280 1 . ASP 83 83 5280 1 . ASP 84 84 5280 1 . PRO 85 85 5280 1 . GLY 86 86 5280 1 . LYS 87 87 5280 1 . GLY 88 88 5280 1 . ASN 89 89 5280 1 . TYR 90 90 5280 1 . TRP 91 91 5280 1 . MET 92 92 5280 1 . LEU 93 93 5280 1 . ASP 94 94 5280 1 . PRO 95 95 5280 1 . SER 96 96 5280 1 . SER 97 97 5280 1 . ASP 98 98 5280 1 . ASP 99 99 5280 1 . VAL 100 100 5280 1 . PHE 101 101 5280 1 . ILE 102 102 5280 1 . GLY 103 103 5280 1 . GLY 104 104 5280 1 . THR 105 105 5280 1 . THR 106 106 5280 1 . GLY 107 107 5280 1 . LYS 108 108 5280 1 . LEU 109 109 5280 1 . ARG 110 110 5280 1 . ARG 111 111 5280 1 . ARG 112 112 5280 1 . SER 113 113 5280 1 . THR 114 114 5280 1 . THR 115 115 5280 1 . SER 116 116 5280 1 . ARG 117 117 5280 1 . ALA 118 118 5280 1 . LYS 119 119 5280 1 . LEU 120 120 5280 1 . ALA 121 121 5280 1 . PHE 122 122 5280 1 . LYS 123 123 5280 1 . ARG 124 124 5280 1 . GLY 125 125 5280 1 . ALA 126 126 5280 1 . ARG 127 127 5280 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 5280 _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 $c-Qin-WHD . 9031 . . 'Gallus gallus' chicken . . Eukaryota Metazoa Gallus gallus . . . brain . . . . . . . . . . . . . . . . . 5280 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 5280 _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 $c-Qin-WHD . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . plasmid . . pET_28a . . . ; The host-vector system used is extremely efficient. Using Bioflow 3000 Fermenter 150 mg protein per 10 g of 13C D-Glucose was obtained with in 8 hour period of growth. Glucose was obtained. ; . . 5280 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_13C_labelled _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_labelled _Sample.Entry_ID 5280 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'cellular Qin winged helix domain' '[U-98% 13C; U-98% 15N]' . . 1 $c-Qin-WHD . . 2.0 . . mM . . . . 5280 1 stop_ save_ save_15N_labelled _Sample.Sf_category sample _Sample.Sf_framecode 15N_labelled _Sample.Entry_ID 5280 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'cellular Qin winged helix domain' '[U-98% 15N]' . . 1 $c-Qin-WHD . . 2 . . mM . . . . 5280 2 stop_ save_ ####################### # Sample conditions # ####################### save_Cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Cond_1 _Sample_condition_list.Entry_ID 5280 _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 5.5 0.2 n/a 5280 1 temperature 313 0.1 K 5280 1 'ionic strength' 0.100 0.005 M 5280 1 stop_ save_ ############################ # Computer software used # ############################ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 5280 _Software.ID 1 _Software.Name Felix _Software.Version 98 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'NMR data processing' 5280 1 analysis 5280 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 5280 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5280 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer Varian INOVA . 600 . . . 5280 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 5280 _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 CBCA(CO)NH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 2 HNCACB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 3 HN(CO)CA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 4 HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 5 HNCO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 6 HN(CA)CO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 7 (H)C(CO)NH-TOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 8 H(CCO)NH-TOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 9 HBHA(CBCACO)NH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 10 HCCH-COSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 11 LRCC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 12 LRCH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 13 '15N-edited NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 14 '13C-edited NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 15 'aromatic- HB(CBCG)CDHD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 16 (HB)CB(CG)CDHD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 17 HB(CBCECD)CEHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 18 '(HB)CB(CGCD)CEHE edited 3D NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 19 '(HB)CB(CGCD)CEHE edited 4D NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5280 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name CBCA(CO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HN(CO)CA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name HN(CA)CO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name (H)C(CO)NH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name H(CCO)NH-TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name HBHA(CBCACO)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name HCCH-COSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_12 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_12 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name LRCC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_13 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_13 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name LRCH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_14 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_14 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name '15N-edited NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_15 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_15 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '13C-edited NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_16 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_16 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 15 _NMR_spec_expt.Name 'aromatic- HB(CBCG)CDHD' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_17 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_17 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 16 _NMR_spec_expt.Name (HB)CB(CG)CDHD _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_18 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_18 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 17 _NMR_spec_expt.Name HB(CBCECD)CEHE _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_19 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_19 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 18 _NMR_spec_expt.Name '(HB)CB(CGCD)CEHE edited 3D NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_20 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_20 _NMR_spec_expt.Entry_ID 5280 _NMR_spec_expt.ID 19 _NMR_spec_expt.Name '(HB)CB(CGCD)CEHE edited 4D NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5280 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 TSP 'methyl protons' . . . . ppm 0.00 external direct 1.0 external cylindrical parallel . . . . . . 5280 1 C 13 TSP 'methyl protons' . . . . ppm 0.00 external indirect 0.25144954 external cylindrical parallel . . . . . . 5280 1 N 15 TSP 'methyl protons' . . . . ppm 0.00 external indirect 0.10132900 external cylindrical parallel . . . . . . 5280 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 5280 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $15N_13C_labelled . 5280 1 . . 2 $15N_labelled . 5280 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 4 4 MET H H 1 8.52 0.01 . 1 . . . . . . . . 5280 1 2 . 1 1 4 4 MET HA H 1 4.63 0.01 . 1 . . . . . . . . 5280 1 3 . 1 1 4 4 MET HB2 H 1 2.24 0.01 . 1 . . . . . . . . 5280 1 4 . 1 1 4 4 MET HB3 H 1 2.24 0.01 . 1 . . . . . . . . 5280 1 5 . 1 1 4 4 MET HG2 H 1 2.71 0.01 . 2 . . . . . . . . 5280 1 6 . 1 1 4 4 MET HG3 H 1 2.61 0.01 . 2 . . . . . . . . 5280 1 7 . 1 1 4 4 MET C C 13 177.44 0.15 . 1 . . . . . . . . 5280 1 8 . 1 1 4 4 MET CA C 13 56.66 0.15 . 1 . . . . . . . . 5280 1 9 . 1 1 4 4 MET CB C 13 34.09 0.15 . 1 . . . . . . . . 5280 1 10 . 1 1 4 4 MET CG C 13 33.13 0.15 . 1 . . . . . . . . 5280 1 11 . 1 1 4 4 MET N N 15 122.66 0.2 . 1 . . . . . . . . 5280 1 12 . 1 1 5 5 GLY H H 1 8.53 0.01 . 1 . . . . . . . . 5280 1 13 . 1 1 5 5 GLY HA2 H 1 4.11 0.01 . 2 . . . . . . . . 5280 1 14 . 1 1 5 5 GLY CA C 13 46.33 0.15 . 1 . . . . . . . . 5280 1 15 . 1 1 5 5 GLY N N 15 111.31 0.2 . 1 . . . . . . . . 5280 1 16 . 1 1 6 6 LYS H H 1 7.15 0.01 . 1 . . . . . . . . 5280 1 17 . 1 1 6 6 LYS HA H 1 4.45 0.01 . 1 . . . . . . . . 5280 1 18 . 1 1 6 6 LYS HB2 H 1 1.96 0.01 . 1 . . . . . . . . 5280 1 19 . 1 1 6 6 LYS HB3 H 1 1.86 0.01 . 1 . . . . . . . . 5280 1 20 . 1 1 6 6 LYS HG2 H 1 1.53 0.01 . 1 . . . . . . . . 5280 1 21 . 1 1 6 6 LYS HG3 H 1 1.53 0.01 . 1 . . . . . . . . 5280 1 22 . 1 1 6 6 LYS HD2 H 1 1.70 0.01 . 1 . . . . . . . . 5280 1 23 . 1 1 6 6 LYS HD3 H 1 1.70 0.01 . 1 . . . . . . . . 5280 1 24 . 1 1 6 6 LYS HE2 H 1 3.08 0.01 . 1 . . . . . . . . 5280 1 25 . 1 1 6 6 LYS HE3 H 1 3.08 0.01 . 1 . . . . . . . . 5280 1 26 . 1 1 6 6 LYS C C 13 177.91 0.15 . 1 . . . . . . . . 5280 1 27 . 1 1 6 6 LYS CA C 13 57.40 0.15 . 1 . . . . . . . . 5280 1 28 . 1 1 6 6 LYS CB C 13 33.96 0.15 . 1 . . . . . . . . 5280 1 29 . 1 1 6 6 LYS CG C 13 25.77 0.15 . 1 . . . . . . . . 5280 1 30 . 1 1 6 6 LYS CD C 13 30.13 0.15 . 1 . . . . . . . . 5280 1 31 . 1 1 6 6 LYS CE C 13 43.19 0.15 . 1 . . . . . . . . 5280 1 32 . 1 1 6 6 LYS N N 15 121.92 0.2 . 1 . . . . . . . . 5280 1 33 . 1 1 7 7 GLU H H 1 8.68 0.01 . 1 . . . . . . . . 5280 1 34 . 1 1 7 7 GLU HA H 1 4.37 0.01 . 1 . . . . . . . . 5280 1 35 . 1 1 7 7 GLU HB2 H 1 2.10 0.01 . 1 . . . . . . . . 5280 1 36 . 1 1 7 7 GLU HB3 H 1 2.19 0.01 . 1 . . . . . . . . 5280 1 37 . 1 1 7 7 GLU HG2 H 1 2.42 0.01 . 1 . . . . . . . . 5280 1 38 . 1 1 7 7 GLU HG3 H 1 2.42 0.01 . 1 . . . . . . . . 5280 1 39 . 1 1 7 7 GLU C C 13 178.12 0.15 . 1 . . . . . . . . 5280 1 40 . 1 1 7 7 GLU CA C 13 58.33 0.15 . 1 . . . . . . . . 5280 1 41 . 1 1 7 7 GLU CB C 13 30.86 0.15 . 1 . . . . . . . . 5280 1 42 . 1 1 7 7 GLU CG C 13 37.09 0.15 . 1 . . . . . . . . 5280 1 43 . 1 1 7 7 GLU N N 15 122.79 0.2 . 1 . . . . . . . . 5280 1 44 . 1 1 8 8 GLY H H 1 8.45 0.01 . 1 . . . . . . . . 5280 1 45 . 1 1 8 8 GLY HA2 H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 46 . 1 1 8 8 GLY HA3 H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 47 . 1 1 8 8 GLY C C 13 175.08 0.15 . 1 . . . . . . . . 5280 1 48 . 1 1 8 8 GLY CA C 13 46.37 0.15 . 1 . . . . . . . . 5280 1 49 . 1 1 8 8 GLY N N 15 110.41 0.2 . 1 . . . . . . . . 5280 1 50 . 1 1 9 9 GLU H H 1 8.19 0.01 . 1 . . . . . . . . 5280 1 51 . 1 1 9 9 GLU HA H 1 4.39 0.01 . 1 . . . . . . . . 5280 1 52 . 1 1 9 9 GLU HB2 H 1 2.05 0.01 . 1 . . . . . . . . 5280 1 53 . 1 1 9 9 GLU HB3 H 1 2.14 0.01 . 1 . . . . . . . . 5280 1 54 . 1 1 9 9 GLU HG2 H 1 2.38 0.01 . 1 . . . . . . . . 5280 1 55 . 1 1 9 9 GLU HG3 H 1 2.38 0.01 . 1 . . . . . . . . 5280 1 56 . 1 1 9 9 GLU C C 13 177.30 0.15 . 1 . . . . . . . . 5280 1 57 . 1 1 9 9 GLU CA C 13 57.42 0.15 . 1 . . . . . . . . 5280 1 58 . 1 1 9 9 GLU CB C 13 31.35 0.15 . 1 . . . . . . . . 5280 1 59 . 1 1 9 9 GLU CG C 13 37.02 0.15 . 1 . . . . . . . . 5280 1 60 . 1 1 9 9 GLU N N 15 121.40 0.2 . 1 . . . . . . . . 5280 1 61 . 1 1 10 10 LYS H H 1 8.39 0.01 . 1 . . . . . . . . 5280 1 62 . 1 1 10 10 LYS HA H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 63 . 1 1 10 10 LYS HB2 H 1 1.84 0.01 . 1 . . . . . . . . 5280 1 64 . 1 1 10 10 LYS HB3 H 1 1.91 0.01 . 1 . . . . . . . . 5280 1 65 . 1 1 10 10 LYS HG2 H 1 1.49 0.01 . 2 . . . . . . . . 5280 1 66 . 1 1 10 10 LYS HG3 H 1 1.53 0.01 . 2 . . . . . . . . 5280 1 67 . 1 1 10 10 LYS HD2 H 1 1.76 0.01 . 1 . . . . . . . . 5280 1 68 . 1 1 10 10 LYS HD3 H 1 1.76 0.01 . 1 . . . . . . . . 5280 1 69 . 1 1 10 10 LYS HE2 H 1 3.08 0.01 . 1 . . . . . . . . 5280 1 70 . 1 1 10 10 LYS HE3 H 1 3.08 0.01 . 1 . . . . . . . . 5280 1 71 . 1 1 10 10 LYS C C 13 177.18 0.15 . 1 . . . . . . . . 5280 1 72 . 1 1 10 10 LYS CA C 13 57.21 0.15 . 1 . . . . . . . . 5280 1 73 . 1 1 10 10 LYS CB C 13 34.08 0.15 . 1 . . . . . . . . 5280 1 74 . 1 1 10 10 LYS CG C 13 25.88 0.15 . 1 . . . . . . . . 5280 1 75 . 1 1 10 10 LYS CD C 13 30.17 0.15 . 1 . . . . . . . . 5280 1 76 . 1 1 10 10 LYS CE C 13 43.28 0.15 . 1 . . . . . . . . 5280 1 77 . 1 1 10 10 LYS N N 15 123.72 0.2 . 1 . . . . . . . . 5280 1 78 . 1 1 11 11 LYS H H 1 8.44 0.01 . 1 . . . . . . . . 5280 1 79 . 1 1 11 11 LYS HA H 1 4.45 0.01 . 1 . . . . . . . . 5280 1 80 . 1 1 11 11 LYS HB2 H 1 1.95 0.01 . 1 . . . . . . . . 5280 1 81 . 1 1 11 11 LYS HB3 H 1 1.83 0.01 . 1 . . . . . . . . 5280 1 82 . 1 1 11 11 LYS HG2 H 1 1.53 0.01 . 1 . . . . . . . . 5280 1 83 . 1 1 11 11 LYS HG3 H 1 1.53 0.01 . 1 . . . . . . . . 5280 1 84 . 1 1 11 11 LYS HD2 H 1 1.78 0.01 . 1 . . . . . . . . 5280 1 85 . 1 1 11 11 LYS HD3 H 1 1.78 0.01 . 1 . . . . . . . . 5280 1 86 . 1 1 11 11 LYS HE2 H 1 3.09 0.01 . 1 . . . . . . . . 5280 1 87 . 1 1 11 11 LYS HE3 H 1 3.09 0.01 . 1 . . . . . . . . 5280 1 88 . 1 1 11 11 LYS C C 13 176.34 0.15 . 1 . . . . . . . . 5280 1 89 . 1 1 11 11 LYS CA C 13 57.17 0.15 . 1 . . . . . . . . 5280 1 90 . 1 1 11 11 LYS CB C 13 34.21 0.15 . 1 . . . . . . . . 5280 1 91 . 1 1 11 11 LYS CG C 13 25.86 0.15 . 1 . . . . . . . . 5280 1 92 . 1 1 11 11 LYS CD C 13 30.08 0.15 . 1 . . . . . . . . 5280 1 93 . 1 1 11 11 LYS CE C 13 43.35 0.15 . 1 . . . . . . . . 5280 1 94 . 1 1 11 11 LYS N N 15 124.32 0.2 . 1 . . . . . . . . 5280 1 95 . 1 1 12 12 ASN H H 1 8.11 0.01 . 1 . . . . . . . . 5280 1 96 . 1 1 12 12 ASN HA H 1 4.72 0.01 . 1 . . . . . . . . 5280 1 97 . 1 1 12 12 ASN HB2 H 1 2.72 0.01 . 2 . . . . . . . . 5280 1 98 . 1 1 12 12 ASN HB3 H 1 2.84 0.01 . 2 . . . . . . . . 5280 1 99 . 1 1 12 12 ASN C C 13 177.35 0.15 . 1 . . . . . . . . 5280 1 100 . 1 1 12 12 ASN CA C 13 55.93 0.15 . 1 . . . . . . . . 5280 1 101 . 1 1 12 12 ASN CB C 13 42.09 0.15 . 1 . . . . . . . . 5280 1 102 . 1 1 12 12 ASN N N 15 126.24 0.2 . 1 . . . . . . . . 5280 1 103 . 1 1 13 13 GLY H H 1 8.36 0.01 . 1 . . . . . . . . 5280 1 104 . 1 1 13 13 GLY HA2 H 1 3.92 0.01 . 2 . . . . . . . . 5280 1 105 . 1 1 13 13 GLY HA3 H 1 3.98 0.01 . 2 . . . . . . . . 5280 1 106 . 1 1 13 13 GLY C C 13 174.80 0.15 . 1 . . . . . . . . 5280 1 107 . 1 1 13 13 GLY CA C 13 46.68 0.15 . 1 . . . . . . . . 5280 1 108 . 1 1 13 13 GLY N N 15 114.90 0.2 . 1 . . . . . . . . 5280 1 109 . 1 1 14 14 LYS H H 1 8.14 0.01 . 1 . . . . . . . . 5280 1 110 . 1 1 14 14 LYS HA H 1 4.31 0.01 . 1 . . . . . . . . 5280 1 111 . 1 1 14 14 LYS HB2 H 1 1.67 0.01 . 2 . . . . . . . . 5280 1 112 . 1 1 14 14 LYS HB3 H 1 1.71 0.01 . 2 . . . . . . . . 5280 1 113 . 1 1 14 14 LYS HG2 H 1 1.25 0.01 . 2 . . . . . . . . 5280 1 114 . 1 1 14 14 LYS HG3 H 1 1.30 0.01 . 2 . . . . . . . . 5280 1 115 . 1 1 14 14 LYS HD2 H 1 1.68 0.01 . 1 . . . . . . . . 5280 1 116 . 1 1 14 14 LYS HD3 H 1 1.68 0.01 . 1 . . . . . . . . 5280 1 117 . 1 1 14 14 LYS HE2 H 1 3.03 0.01 . 1 . . . . . . . . 5280 1 118 . 1 1 14 14 LYS HE3 H 1 3.03 0.01 . 1 . . . . . . . . 5280 1 119 . 1 1 14 14 LYS C C 13 177.14 0.15 . 1 . . . . . . . . 5280 1 120 . 1 1 14 14 LYS CA C 13 57.51 0.15 . 1 . . . . . . . . 5280 1 121 . 1 1 14 14 LYS CB C 13 34.17 0.15 . 1 . . . . . . . . 5280 1 122 . 1 1 14 14 LYS CG C 13 25.63 0.15 . 1 . . . . . . . . 5280 1 123 . 1 1 14 14 LYS CD C 13 30.17 0.15 . 1 . . . . . . . . 5280 1 124 . 1 1 14 14 LYS CE C 13 43.20 0.15 . 1 . . . . . . . . 5280 1 125 . 1 1 14 14 LYS N N 15 121.35 0.2 . 1 . . . . . . . . 5280 1 126 . 1 1 15 15 TYR H H 1 8.26 0.01 . 1 . . . . . . . . 5280 1 127 . 1 1 15 15 TYR HA H 1 4.78 0.01 . 1 . . . . . . . . 5280 1 128 . 1 1 15 15 TYR HB2 H 1 2.88 0.01 . 2 . . . . . . . . 5280 1 129 . 1 1 15 15 TYR HB3 H 1 3.34 0.01 . 2 . . . . . . . . 5280 1 130 . 1 1 15 15 TYR HD1 H 1 7.25 0.01 . 1 . . . . . . . . 5280 1 131 . 1 1 15 15 TYR HD2 H 1 7.25 0.01 . 1 . . . . . . . . 5280 1 132 . 1 1 15 15 TYR HE1 H 1 6.92 0.01 . 1 . . . . . . . . 5280 1 133 . 1 1 15 15 TYR HE2 H 1 6.92 0.01 . 1 . . . . . . . . 5280 1 134 . 1 1 15 15 TYR C C 13 177.14 0.15 . 1 . . . . . . . . 5280 1 135 . 1 1 15 15 TYR CA C 13 58.46 0.15 . 1 . . . . . . . . 5280 1 136 . 1 1 15 15 TYR CB C 13 40.45 0.15 . 1 . . . . . . . . 5280 1 137 . 1 1 15 15 TYR CD1 C 13 133.13 0.15 . 1 . . . . . . . . 5280 1 138 . 1 1 15 15 TYR CD2 C 13 133.13 0.15 . 1 . . . . . . . . 5280 1 139 . 1 1 15 15 TYR CE1 C 13 117.93 0.15 . 1 . . . . . . . . 5280 1 140 . 1 1 15 15 TYR CE2 C 13 117.93 0.15 . 1 . . . . . . . . 5280 1 141 . 1 1 15 15 TYR N N 15 120.22 0.2 . 1 . . . . . . . . 5280 1 142 . 1 1 16 16 GLU H H 1 8.40 0.01 . 1 . . . . . . . . 5280 1 143 . 1 1 16 16 GLU HA H 1 4.43 0.01 . 1 . . . . . . . . 5280 1 144 . 1 1 16 16 GLU HB2 H 1 2.01 0.01 . 2 . . . . . . . . 5280 1 145 . 1 1 16 16 GLU HB3 H 1 1.92 0.01 . 2 . . . . . . . . 5280 1 146 . 1 1 16 16 GLU HG2 H 1 2.33 0.01 . 2 . . . . . . . . 5280 1 147 . 1 1 16 16 GLU HG3 H 1 2.28 0.01 . 2 . . . . . . . . 5280 1 148 . 1 1 16 16 GLU C C 13 176.65 0.15 . 1 . . . . . . . . 5280 1 149 . 1 1 16 16 GLU CA C 13 56.17 0.15 . 1 . . . . . . . . 5280 1 150 . 1 1 16 16 GLU CB C 13 32.32 0.15 . 1 . . . . . . . . 5280 1 151 . 1 1 16 16 GLU CG C 13 36.94 0.15 . 1 . . . . . . . . 5280 1 152 . 1 1 16 16 GLU N N 15 122.34 0.2 . 1 . . . . . . . . 5280 1 153 . 1 1 17 17 LYS H H 1 8.38 0.01 . 1 . . . . . . . . 5280 1 154 . 1 1 17 17 LYS HA H 1 2.96 0.01 . 1 . . . . . . . . 5280 1 155 . 1 1 17 17 LYS HB2 H 1 1.38 0.01 . 2 . . . . . . . . 5280 1 156 . 1 1 17 17 LYS HB3 H 1 0.91 0.01 . 2 . . . . . . . . 5280 1 157 . 1 1 17 17 LYS HG2 H 1 0.71 0.01 . 2 . . . . . . . . 5280 1 158 . 1 1 17 17 LYS HG3 H 1 1.21 0.01 . 2 . . . . . . . . 5280 1 159 . 1 1 17 17 LYS HD2 H 1 1.60 0.01 . 1 . . . . . . . . 5280 1 160 . 1 1 17 17 LYS HD3 H 1 1.60 0.01 . 1 . . . . . . . . 5280 1 161 . 1 1 17 17 LYS HE2 H 1 3.01 0.01 . 1 . . . . . . . . 5280 1 162 . 1 1 17 17 LYS HE3 H 1 3.01 0.01 . 1 . . . . . . . . 5280 1 163 . 1 1 17 17 LYS CA C 13 55.14 0.15 . 1 . . . . . . . . 5280 1 164 . 1 1 17 17 LYS CB C 13 33.68 0.15 . 1 . . . . . . . . 5280 1 165 . 1 1 17 17 LYS CG C 13 24.88 0.15 . 1 . . . . . . . . 5280 1 166 . 1 1 17 17 LYS CD C 13 30.60 0.15 . 1 . . . . . . . . 5280 1 167 . 1 1 17 17 LYS CE C 13 41.65 0.15 . 1 . . . . . . . . 5280 1 168 . 1 1 17 17 LYS N N 15 127.56 0.2 . 1 . . . . . . . . 5280 1 169 . 1 1 18 18 PRO HA H 1 4.41 0.01 . 1 . . . . . . . . 5280 1 170 . 1 1 18 18 PRO HB2 H 1 2.01 0.01 . 2 . . . . . . . . 5280 1 171 . 1 1 18 18 PRO HB3 H 1 2.09 0.01 . 2 . . . . . . . . 5280 1 172 . 1 1 18 18 PRO HG2 H 1 1.91 0.01 . 2 . . . . . . . . 5280 1 173 . 1 1 18 18 PRO HG3 H 1 1.94 0.01 . 2 . . . . . . . . 5280 1 174 . 1 1 18 18 PRO HD2 H 1 3.61 0.01 . 2 . . . . . . . . 5280 1 175 . 1 1 18 18 PRO HD3 H 1 3.65 0.01 . 2 . . . . . . . . 5280 1 176 . 1 1 18 18 PRO CA C 13 64.34 0.15 . 1 . . . . . . . . 5280 1 177 . 1 1 18 18 PRO CB C 13 31.79 0.15 . 1 . . . . . . . . 5280 1 178 . 1 1 18 18 PRO CG C 13 27.07 0.15 . 1 . . . . . . . . 5280 1 179 . 1 1 18 18 PRO CD C 13 50.20 0.15 . 1 . . . . . . . . 5280 1 180 . 1 1 18 18 PRO N N 15 130.53 0.2 . 1 . . . . . . . . 5280 1 181 . 1 1 19 19 PRO HA H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 182 . 1 1 19 19 PRO HB2 H 1 1.93 0.01 . 1 . . . . . . . . 5280 1 183 . 1 1 19 19 PRO HB3 H 1 1.93 0.01 . 1 . . . . . . . . 5280 1 184 . 1 1 19 19 PRO HG2 H 1 1.90 0.01 . 2 . . . . . . . . 5280 1 185 . 1 1 19 19 PRO HG3 H 1 1.03 0.01 . 2 . . . . . . . . 5280 1 186 . 1 1 19 19 PRO HD2 H 1 3.79 0.01 . 2 . . . . . . . . 5280 1 187 . 1 1 19 19 PRO HD3 H 1 3.24 0.01 . 2 . . . . . . . . 5280 1 188 . 1 1 19 19 PRO C C 13 176.11 0.15 . 1 . . . . . . . . 5280 1 189 . 1 1 19 19 PRO CA C 13 64.34 0.15 . 1 . . . . . . . . 5280 1 190 . 1 1 19 19 PRO CB C 13 30.98 0.15 . 1 . . . . . . . . 5280 1 191 . 1 1 19 19 PRO CG C 13 27.62 0.15 . 1 . . . . . . . . 5280 1 192 . 1 1 19 19 PRO CD C 13 51.20 0.15 . 1 . . . . . . . . 5280 1 193 . 1 1 19 19 PRO N N 15 130.53 0.2 . 1 . . . . . . . . 5280 1 194 . 1 1 20 20 PHE H H 1 6.60 0.01 . 1 . . . . . . . . 5280 1 195 . 1 1 20 20 PHE HA H 1 4.78 0.01 . 1 . . . . . . . . 5280 1 196 . 1 1 20 20 PHE HB2 H 1 2.31 0.01 . 1 . . . . . . . . 5280 1 197 . 1 1 20 20 PHE HB3 H 1 3.22 0.01 . 1 . . . . . . . . 5280 1 198 . 1 1 20 20 PHE HD1 H 1 6.99 0.01 . 1 . . . . . . . . 5280 1 199 . 1 1 20 20 PHE HD2 H 1 6.99 0.01 . 1 . . . . . . . . 5280 1 200 . 1 1 20 20 PHE HE1 H 1 7.57 0.01 . 1 . . . . . . . . 5280 1 201 . 1 1 20 20 PHE HE2 H 1 7.57 0.01 . 1 . . . . . . . . 5280 1 202 . 1 1 20 20 PHE CA C 13 57.54 0.15 . 1 . . . . . . . . 5280 1 203 . 1 1 20 20 PHE CB C 13 42.96 0.15 . 1 . . . . . . . . 5280 1 204 . 1 1 20 20 PHE CD1 C 13 131.03 0.15 . 1 . . . . . . . . 5280 1 205 . 1 1 20 20 PHE CD2 C 13 131.03 0.15 . 1 . . . . . . . . 5280 1 206 . 1 1 20 20 PHE CE1 C 13 131.87 0.15 . 1 . . . . . . . . 5280 1 207 . 1 1 20 20 PHE CE2 C 13 131.87 0.15 . 1 . . . . . . . . 5280 1 208 . 1 1 20 20 PHE N N 15 117.43 0.2 . 1 . . . . . . . . 5280 1 209 . 1 1 21 21 SER H H 1 7.39 0.01 . 1 . . . . . . . . 5280 1 210 . 1 1 21 21 SER HA H 1 4.41 0.01 . 1 . . . . . . . . 5280 1 211 . 1 1 21 21 SER HB2 H 1 4.20 0.01 . 2 . . . . . . . . 5280 1 212 . 1 1 21 21 SER C C 13 175.50 0.15 . 1 . . . . . . . . 5280 1 213 . 1 1 21 21 SER CA C 13 58.00 0.15 . 1 . . . . . . . . 5280 1 214 . 1 1 21 21 SER CB C 13 65.69 0.15 . 1 . . . . . . . . 5280 1 215 . 1 1 21 21 SER N N 15 120.86 0.2 . 1 . . . . . . . . 5280 1 216 . 1 1 22 22 TYR H H 1 8.44 0.01 . 1 . . . . . . . . 5280 1 217 . 1 1 22 22 TYR HA H 1 4.47 0.01 . 1 . . . . . . . . 5280 1 218 . 1 1 22 22 TYR HB2 H 1 3.00 0.01 . 2 . . . . . . . . 5280 1 219 . 1 1 22 22 TYR HB3 H 1 3.03 0.01 . 2 . . . . . . . . 5280 1 220 . 1 1 22 22 TYR HD1 H 1 7.24 0.01 . 1 . . . . . . . . 5280 1 221 . 1 1 22 22 TYR HD2 H 1 7.24 0.01 . 1 . . . . . . . . 5280 1 222 . 1 1 22 22 TYR HE1 H 1 7.15 0.01 . 1 . . . . . . . . 5280 1 223 . 1 1 22 22 TYR HE2 H 1 7.15 0.01 . 1 . . . . . . . . 5280 1 224 . 1 1 22 22 TYR C C 13 177.91 0.15 . 1 . . . . . . . . 5280 1 225 . 1 1 22 22 TYR CA C 13 62.30 0.15 . 1 . . . . . . . . 5280 1 226 . 1 1 22 22 TYR CB C 13 37.86 0.15 . 1 . . . . . . . . 5280 1 227 . 1 1 22 22 TYR CD1 C 13 131.84 0.15 . 1 . . . . . . . . 5280 1 228 . 1 1 22 22 TYR CD2 C 13 131.84 0.15 . 1 . . . . . . . . 5280 1 229 . 1 1 22 22 TYR CE1 C 13 118.90 0.15 . 1 . . . . . . . . 5280 1 230 . 1 1 22 22 TYR CE2 C 13 118.90 0.15 . 1 . . . . . . . . 5280 1 231 . 1 1 22 22 TYR N N 15 119.57 0.2 . 1 . . . . . . . . 5280 1 232 . 1 1 23 23 ASN H H 1 8.58 0.01 . 1 . . . . . . . . 5280 1 233 . 1 1 23 23 ASN HA H 1 4.65 0.01 . 1 . . . . . . . . 5280 1 234 . 1 1 23 23 ASN HB2 H 1 2.94 0.01 . 2 . . . . . . . . 5280 1 235 . 1 1 23 23 ASN HB3 H 1 2.85 0.01 . 2 . . . . . . . . 5280 1 236 . 1 1 23 23 ASN HD21 H 1 7.58 0.01 . 2 . . . . . . . . 5280 1 237 . 1 1 23 23 ASN HD22 H 1 6.89 0.01 . 2 . . . . . . . . 5280 1 238 . 1 1 23 23 ASN C C 13 178.04 0.15 . 1 . . . . . . . . 5280 1 239 . 1 1 23 23 ASN CA C 13 57.80 0.15 . 1 . . . . . . . . 5280 1 240 . 1 1 23 23 ASN CB C 13 39.47 0.15 . 1 . . . . . . . . 5280 1 241 . 1 1 23 23 ASN N N 15 116.79 0.2 . 1 . . . . . . . . 5280 1 242 . 1 1 23 23 ASN ND2 N 15 111.39 0.2 . 1 . . . . . . . . 5280 1 243 . 1 1 24 24 ALA H H 1 8.04 0.01 . 1 . . . . . . . . 5280 1 244 . 1 1 24 24 ALA HA H 1 4.21 0.01 . 1 . . . . . . . . 5280 1 245 . 1 1 24 24 ALA HB1 H 1 1.73 0.01 . 1 . . . . . . . . 5280 1 246 . 1 1 24 24 ALA HB2 H 1 1.73 0.01 . 1 . . . . . . . . 5280 1 247 . 1 1 24 24 ALA HB3 H 1 1.73 0.01 . 1 . . . . . . . . 5280 1 248 . 1 1 24 24 ALA C C 13 181.38 0.15 . 1 . . . . . . . . 5280 1 249 . 1 1 24 24 ALA CA C 13 56.34 0.15 . 1 . . . . . . . . 5280 1 250 . 1 1 24 24 ALA CB C 13 19.27 0.15 . 1 . . . . . . . . 5280 1 251 . 1 1 24 24 ALA N N 15 123.15 0.2 . 1 . . . . . . . . 5280 1 252 . 1 1 25 25 LEU H H 1 8.27 0.01 . 1 . . . . . . . . 5280 1 253 . 1 1 25 25 LEU HA H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 254 . 1 1 25 25 LEU HB2 H 1 1.31 0.01 . 2 . . . . . . . . 5280 1 255 . 1 1 25 25 LEU HB3 H 1 2.22 0.01 . 2 . . . . . . . . 5280 1 256 . 1 1 25 25 LEU HG H 1 1.78 0.01 . 1 . . . . . . . . 5280 1 257 . 1 1 25 25 LEU HD11 H 1 0.514 0.01 . 1 . . . . . . . . 5280 1 258 . 1 1 25 25 LEU HD12 H 1 0.514 0.01 . 1 . . . . . . . . 5280 1 259 . 1 1 25 25 LEU HD13 H 1 0.514 0.01 . 1 . . . . . . . . 5280 1 260 . 1 1 25 25 LEU HD21 H 1 0.668 0.01 . 1 . . . . . . . . 5280 1 261 . 1 1 25 25 LEU HD22 H 1 0.668 0.01 . 1 . . . . . . . . 5280 1 262 . 1 1 25 25 LEU HD23 H 1 0.668 0.01 . 1 . . . . . . . . 5280 1 263 . 1 1 25 25 LEU C C 13 179.30 0.15 . 1 . . . . . . . . 5280 1 264 . 1 1 25 25 LEU CA C 13 59.25 0.15 . 1 . . . . . . . . 5280 1 265 . 1 1 25 25 LEU CB C 13 43.23 0.15 . 1 . . . . . . . . 5280 1 266 . 1 1 25 25 LEU CG C 13 27.32 0.15 . 1 . . . . . . . . 5280 1 267 . 1 1 25 25 LEU CD1 C 13 24.95 0.15 . 1 . . . . . . . . 5280 1 268 . 1 1 25 25 LEU CD2 C 13 26.58 0.15 . 1 . . . . . . . . 5280 1 269 . 1 1 25 25 LEU N N 15 119.58 0.2 . 1 . . . . . . . . 5280 1 270 . 1 1 26 26 ILE H H 1 8.07 0.01 . 1 . . . . . . . . 5280 1 271 . 1 1 26 26 ILE HA H 1 3.34 0.01 . 1 . . . . . . . . 5280 1 272 . 1 1 26 26 ILE HB H 1 1.80 0.01 . 1 . . . . . . . . 5280 1 273 . 1 1 26 26 ILE HG12 H 1 0.72 0.01 . 2 . . . . . . . . 5280 1 274 . 1 1 26 26 ILE HG13 H 1 0.56 0.01 . 2 . . . . . . . . 5280 1 275 . 1 1 26 26 ILE HG21 H 1 0.15 0.01 . 1 . . . . . . . . 5280 1 276 . 1 1 26 26 ILE HG22 H 1 0.15 0.01 . 1 . . . . . . . . 5280 1 277 . 1 1 26 26 ILE HG23 H 1 0.15 0.01 . 1 . . . . . . . . 5280 1 278 . 1 1 26 26 ILE HD11 H 1 2.09 0.01 . 1 . . . . . . . . 5280 1 279 . 1 1 26 26 ILE HD12 H 1 2.09 0.01 . 1 . . . . . . . . 5280 1 280 . 1 1 26 26 ILE HD13 H 1 2.09 0.01 . 1 . . . . . . . . 5280 1 281 . 1 1 26 26 ILE C C 13 178.60 0.15 . 1 . . . . . . . . 5280 1 282 . 1 1 26 26 ILE CA C 13 66.99 0.15 . 1 . . . . . . . . 5280 1 283 . 1 1 26 26 ILE CB C 13 38.98 0.15 . 1 . . . . . . . . 5280 1 284 . 1 1 26 26 ILE CG1 C 13 30.31 0.15 . 1 . . . . . . . . 5280 1 285 . 1 1 26 26 ILE CG2 C 13 20.24 0.15 . 1 . . . . . . . . 5280 1 286 . 1 1 26 26 ILE CD1 C 13 15.23 0.15 . 1 . . . . . . . . 5280 1 287 . 1 1 26 26 ILE N N 15 118.68 0.2 . 1 . . . . . . . . 5280 1 288 . 1 1 27 27 MET H H 1 8.18 0.01 . 1 . . . . . . . . 5280 1 289 . 1 1 27 27 MET HA H 1 4.02 0.01 . 1 . . . . . . . . 5280 1 290 . 1 1 27 27 MET HB2 H 1 2.34 0.01 . 2 . . . . . . . . 5280 1 291 . 1 1 27 27 MET HB3 H 1 2.20 0.01 . 2 . . . . . . . . 5280 1 292 . 1 1 27 27 MET HG2 H 1 3.03 0.01 . 2 . . . . . . . . 5280 1 293 . 1 1 27 27 MET HG3 H 1 2.66 0.01 . 2 . . . . . . . . 5280 1 294 . 1 1 27 27 MET C C 13 178.67 0.15 . 1 . . . . . . . . 5280 1 295 . 1 1 27 27 MET CA C 13 61.08 0.15 . 1 . . . . . . . . 5280 1 296 . 1 1 27 27 MET CB C 13 34.01 0.15 . 1 . . . . . . . . 5280 1 297 . 1 1 27 27 MET CG C 13 34.05 0.15 . 1 . . . . . . . . 5280 1 298 . 1 1 27 27 MET N N 15 117.24 0.2 . 1 . . . . . . . . 5280 1 299 . 1 1 28 28 MET H H 1 8.40 0.01 . 1 . . . . . . . . 5280 1 300 . 1 1 28 28 MET HA H 1 3.85 0.01 . 1 . . . . . . . . 5280 1 301 . 1 1 28 28 MET HB2 H 1 2.31 0.01 . 1 . . . . . . . . 5280 1 302 . 1 1 28 28 MET HB3 H 1 2.12 0.01 . 1 . . . . . . . . 5280 1 303 . 1 1 28 28 MET HG2 H 1 2.72 0.01 . 1 . . . . . . . . 5280 1 304 . 1 1 28 28 MET HG3 H 1 2.56 0.01 . 1 . . . . . . . . 5280 1 305 . 1 1 28 28 MET C C 13 178.67 0.15 . 1 . . . . . . . . 5280 1 306 . 1 1 28 28 MET CA C 13 60.23 0.15 . 1 . . . . . . . . 5280 1 307 . 1 1 28 28 MET CB C 13 34.79 0.15 . 1 . . . . . . . . 5280 1 308 . 1 1 28 28 MET CG C 13 33.08 0.15 . 1 . . . . . . . . 5280 1 309 . 1 1 28 28 MET N N 15 118.72 0.2 . 1 . . . . . . . . 5280 1 310 . 1 1 29 29 ALA H H 1 7.64 0.01 . 1 . . . . . . . . 5280 1 311 . 1 1 29 29 ALA HA H 1 2.10 0.01 . 1 . . . . . . . . 5280 1 312 . 1 1 29 29 ALA HB1 H 1 1.23 0.01 . 1 . . . . . . . . 5280 1 313 . 1 1 29 29 ALA HB2 H 1 1.23 0.01 . 1 . . . . . . . . 5280 1 314 . 1 1 29 29 ALA HB3 H 1 1.23 0.01 . 1 . . . . . . . . 5280 1 315 . 1 1 29 29 ALA CA C 13 55.22 0.15 . 1 . . . . . . . . 5280 1 316 . 1 1 29 29 ALA CB C 13 20.25 0.15 . 1 . . . . . . . . 5280 1 317 . 1 1 29 29 ALA N N 15 121.56 0.2 . 1 . . . . . . . . 5280 1 318 . 1 1 30 30 ILE H H 1 8.03 0.01 . 1 . . . . . . . . 5280 1 319 . 1 1 30 30 ILE HA H 1 3.34 0.01 . 1 . . . . . . . . 5280 1 320 . 1 1 30 30 ILE HB H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 321 . 1 1 30 30 ILE HG12 H 1 1.87 0.01 . 2 . . . . . . . . 5280 1 322 . 1 1 30 30 ILE HG13 H 1 0.83 0.01 . 2 . . . . . . . . 5280 1 323 . 1 1 30 30 ILE HG21 H 1 0.90 0.01 . 1 . . . . . . . . 5280 1 324 . 1 1 30 30 ILE HG22 H 1 0.90 0.01 . 1 . . . . . . . . 5280 1 325 . 1 1 30 30 ILE HG23 H 1 0.90 0.01 . 1 . . . . . . . . 5280 1 326 . 1 1 30 30 ILE HD11 H 1 0.69 0.01 . 1 . . . . . . . . 5280 1 327 . 1 1 30 30 ILE HD12 H 1 0.69 0.01 . 1 . . . . . . . . 5280 1 328 . 1 1 30 30 ILE HD13 H 1 0.69 0.01 . 1 . . . . . . . . 5280 1 329 . 1 1 30 30 ILE C C 13 180.47 0.15 . 1 . . . . . . . . 5280 1 330 . 1 1 30 30 ILE CA C 13 66.95 0.15 . 1 . . . . . . . . 5280 1 331 . 1 1 30 30 ILE CB C 13 39.64 0.15 . 1 . . . . . . . . 5280 1 332 . 1 1 30 30 ILE CG1 C 13 30.82 0.15 . 1 . . . . . . . . 5280 1 333 . 1 1 30 30 ILE CG2 C 13 19.27 0.15 . 1 . . . . . . . . 5280 1 334 . 1 1 30 30 ILE CD1 C 13 13.00 0.15 . 1 . . . . . . . . 5280 1 335 . 1 1 30 30 ILE N N 15 116.94 0.2 . 1 . . . . . . . . 5280 1 336 . 1 1 31 31 ARG H H 1 8.66 0.01 . 1 . . . . . . . . 5280 1 337 . 1 1 31 31 ARG HA H 1 4.01 0.01 . 1 . . . . . . . . 5280 1 338 . 1 1 31 31 ARG HB2 H 1 1.99 0.01 . 2 . . . . . . . . 5280 1 339 . 1 1 31 31 ARG HB3 H 1 1.91 0.01 . 2 . . . . . . . . 5280 1 340 . 1 1 31 31 ARG HG2 H 1 1.90 0.01 . 2 . . . . . . . . 5280 1 341 . 1 1 31 31 ARG HG3 H 1 1.73 0.01 . 2 . . . . . . . . 5280 1 342 . 1 1 31 31 ARG HD2 H 1 3.17 0.01 . 1 . . . . . . . . 5280 1 343 . 1 1 31 31 ARG HD3 H 1 3.17 0.01 . 1 . . . . . . . . 5280 1 344 . 1 1 31 31 ARG C C 13 178.51 0.15 . 1 . . . . . . . . 5280 1 345 . 1 1 31 31 ARG CA C 13 60.77 0.15 . 1 . . . . . . . . 5280 1 346 . 1 1 31 31 ARG CB C 13 31.14 0.15 . 1 . . . . . . . . 5280 1 347 . 1 1 31 31 ARG CG C 13 29.45 0.15 . 1 . . . . . . . . 5280 1 348 . 1 1 31 31 ARG CD C 13 44.74 0.15 . 1 . . . . . . . . 5280 1 349 . 1 1 31 31 ARG N N 15 119.66 0.2 . 1 . . . . . . . . 5280 1 350 . 1 1 32 32 GLN H H 1 7.48 0.01 . 1 . . . . . . . . 5280 1 351 . 1 1 32 32 GLN HA H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 352 . 1 1 32 32 GLN HB2 H 1 2.11 0.01 . 1 . . . . . . . . 5280 1 353 . 1 1 32 32 GLN HB3 H 1 2.36 0.01 . 1 . . . . . . . . 5280 1 354 . 1 1 32 32 GLN HG2 H 1 2.47 0.01 . 2 . . . . . . . . 5280 1 355 . 1 1 32 32 GLN HG3 H 1 2.71 0.01 . 2 . . . . . . . . 5280 1 356 . 1 1 32 32 GLN HE21 H 1 7.65 0.01 . 2 . . . . . . . . 5280 1 357 . 1 1 32 32 GLN HE22 H 1 7.12 0.01 . 2 . . . . . . . . 5280 1 358 . 1 1 32 32 GLN C C 13 176.90 0.15 . 1 . . . . . . . . 5280 1 359 . 1 1 32 32 GLN CA C 13 57.01 0.15 . 1 . . . . . . . . 5280 1 360 . 1 1 32 32 GLN CB C 13 29.45 0.15 . 1 . . . . . . . . 5280 1 361 . 1 1 32 32 GLN CG C 13 35.51 0.15 . 1 . . . . . . . . 5280 1 362 . 1 1 32 32 GLN N N 15 114.57 0.2 . 1 . . . . . . . . 5280 1 363 . 1 1 32 32 GLN NE2 N 15 112.76 0.2 . 1 . . . . . . . . 5280 1 364 . 1 1 33 33 SER H H 1 7.55 0.01 . 1 . . . . . . . . 5280 1 365 . 1 1 33 33 SER HA H 1 4.82 0.01 . 1 . . . . . . . . 5280 1 366 . 1 1 33 33 SER HB2 H 1 4.16 0.01 . 2 . . . . . . . . 5280 1 367 . 1 1 33 33 SER HB3 H 1 4.30 0.01 . 2 . . . . . . . . 5280 1 368 . 1 1 33 33 SER CA C 13 58.25 0.15 . 1 . . . . . . . . 5280 1 369 . 1 1 33 33 SER CB C 13 63.77 0.15 . 1 . . . . . . . . 5280 1 370 . 1 1 33 33 SER N N 15 119.15 0.2 . 1 . . . . . . . . 5280 1 371 . 1 1 34 34 PRO HA H 1 4.49 0.01 . 1 . . . . . . . . 5280 1 372 . 1 1 34 34 PRO HB2 H 1 2.13 0.01 . 2 . . . . . . . . 5280 1 373 . 1 1 34 34 PRO HB3 H 1 2.57 0.01 . 2 . . . . . . . . 5280 1 374 . 1 1 34 34 PRO HG2 H 1 2.29 0.01 . 2 . . . . . . . . 5280 1 375 . 1 1 34 34 PRO HG3 H 1 2.33 0.01 . 2 . . . . . . . . 5280 1 376 . 1 1 34 34 PRO HD2 H 1 4.12 0.01 . 2 . . . . . . . . 5280 1 377 . 1 1 34 34 PRO HD3 H 1 4.13 0.01 . 2 . . . . . . . . 5280 1 378 . 1 1 34 34 PRO C C 13 179.33 0.15 . 1 . . . . . . . . 5280 1 379 . 1 1 34 34 PRO CA C 13 66.58 0.15 . 1 . . . . . . . . 5280 1 380 . 1 1 34 34 PRO CB C 13 33.14 0.15 . 1 . . . . . . . . 5280 1 381 . 1 1 34 34 PRO CG C 13 28.97 0.15 . 1 . . . . . . . . 5280 1 382 . 1 1 34 34 PRO CD C 13 51.84 0.15 . 1 . . . . . . . . 5280 1 383 . 1 1 34 34 PRO N N 15 130.53 0.2 . 1 . . . . . . . . 5280 1 384 . 1 1 35 35 GLU H H 1 8.48 0.15 . 1 . . . . . . . . 5280 1 385 . 1 1 35 35 GLU HA H 1 4.53 0.01 . 1 . . . . . . . . 5280 1 386 . 1 1 35 35 GLU HB2 H 1 2.00 0.01 . 2 . . . . . . . . 5280 1 387 . 1 1 35 35 GLU HB3 H 1 2.29 0.01 . 2 . . . . . . . . 5280 1 388 . 1 1 35 35 GLU HG2 H 1 2.34 0.01 . 2 . . . . . . . . 5280 1 389 . 1 1 35 35 GLU HG3 H 1 2.23 0.01 . 2 . . . . . . . . 5280 1 390 . 1 1 35 35 GLU C C 13 176.55 0.15 . 1 . . . . . . . . 5280 1 391 . 1 1 35 35 GLU CA C 13 56.83 0.15 . 1 . . . . . . . . 5280 1 392 . 1 1 35 35 GLU CB C 13 30.69 0.15 . 1 . . . . . . . . 5280 1 393 . 1 1 35 35 GLU CG C 13 37.62 0.15 . 1 . . . . . . . . 5280 1 394 . 1 1 35 35 GLU N N 15 114.45 0.2 . 1 . . . . . . . . 5280 1 395 . 1 1 36 36 LYS H H 1 8.09 0.01 . 1 . . . . . . . . 5280 1 396 . 1 1 36 36 LYS HA H 1 4.11 0.01 . 1 . . . . . . . . 5280 1 397 . 1 1 36 36 LYS HB2 H 1 2.22 0.01 . 1 . . . . . . . . 5280 1 398 . 1 1 36 36 LYS HB3 H 1 1.90 0.01 . 1 . . . . . . . . 5280 1 399 . 1 1 36 36 LYS HG2 H 1 1.56 0.01 . 2 . . . . . . . . 5280 1 400 . 1 1 36 36 LYS HG3 H 1 1.43 0.01 . 2 . . . . . . . . 5280 1 401 . 1 1 36 36 LYS HD2 H 1 1.74 0.01 . 2 . . . . . . . . 5280 1 402 . 1 1 36 36 LYS HE2 H 1 3.22 0.01 . 2 . . . . . . . . 5280 1 403 . 1 1 36 36 LYS HE3 H 1 3.13 0.01 . 2 . . . . . . . . 5280 1 404 . 1 1 36 36 LYS C C 13 175.67 0.15 . 1 . . . . . . . . 5280 1 405 . 1 1 36 36 LYS CA C 13 57.20 0.15 . 1 . . . . . . . . 5280 1 406 . 1 1 36 36 LYS CB C 13 29.58 0.15 . 1 . . . . . . . . 5280 1 407 . 1 1 36 36 LYS CG C 13 25.92 0.15 . 1 . . . . . . . . 5280 1 408 . 1 1 36 36 LYS CD C 13 29.70 0.15 . 1 . . . . . . . . 5280 1 409 . 1 1 36 36 LYS CE C 13 43.88 0.15 . 1 . . . . . . . . 5280 1 410 . 1 1 36 36 LYS N N 15 117.05 0.2 . 1 . . . . . . . . 5280 1 411 . 1 1 37 37 ARG H H 1 7.51 0.01 . 1 . . . . . . . . 5280 1 412 . 1 1 37 37 ARG HA H 1 5.36 0.01 . 1 . . . . . . . . 5280 1 413 . 1 1 37 37 ARG HB2 H 1 1.42 0.01 . 1 . . . . . . . . 5280 1 414 . 1 1 37 37 ARG HB3 H 1 2.00 0.01 . 1 . . . . . . . . 5280 1 415 . 1 1 37 37 ARG HG2 H 1 1.48 0.01 . 2 . . . . . . . . 5280 1 416 . 1 1 37 37 ARG HG3 H 1 1.14 0.01 . 2 . . . . . . . . 5280 1 417 . 1 1 37 37 ARG HD2 H 1 2.42 0.01 . 2 . . . . . . . . 5280 1 418 . 1 1 37 37 ARG HD3 H 1 2.71 0.01 . 2 . . . . . . . . 5280 1 419 . 1 1 37 37 ARG C C 13 175.15 0.15 . 1 . . . . . . . . 5280 1 420 . 1 1 37 37 ARG CA C 13 55.75 0.15 . 1 . . . . . . . . 5280 1 421 . 1 1 37 37 ARG CB C 13 33.10 0.15 . 1 . . . . . . . . 5280 1 422 . 1 1 37 37 ARG CG C 13 26.10 0.15 . 1 . . . . . . . . 5280 1 423 . 1 1 37 37 ARG CD C 13 44.69 0.15 . 1 . . . . . . . . 5280 1 424 . 1 1 37 37 ARG N N 15 112.78 0.2 . 1 . . . . . . . . 5280 1 425 . 1 1 38 38 LEU H H 1 8.83 0.01 . 1 . . . . . . . . 5280 1 426 . 1 1 38 38 LEU HA H 1 5.21 0.01 . 1 . . . . . . . . 5280 1 427 . 1 1 38 38 LEU HB2 H 1 1.55 0.01 . 1 . . . . . . . . 5280 1 428 . 1 1 38 38 LEU HB3 H 1 1.99 0.01 . 1 . . . . . . . . 5280 1 429 . 1 1 38 38 LEU HG H 1 0.71 0.01 . 1 . . . . . . . . 5280 1 430 . 1 1 38 38 LEU HD11 H 1 1.77 0.01 . 1 . . . . . . . . 5280 1 431 . 1 1 38 38 LEU HD12 H 1 1.77 0.01 . 1 . . . . . . . . 5280 1 432 . 1 1 38 38 LEU HD13 H 1 1.77 0.01 . 1 . . . . . . . . 5280 1 433 . 1 1 38 38 LEU HD21 H 1 1.20 0.01 . 1 . . . . . . . . 5280 1 434 . 1 1 38 38 LEU HD22 H 1 1.20 0.01 . 1 . . . . . . . . 5280 1 435 . 1 1 38 38 LEU HD23 H 1 1.20 0.01 . 1 . . . . . . . . 5280 1 436 . 1 1 38 38 LEU C C 13 178.00 0.15 . 1 . . . . . . . . 5280 1 437 . 1 1 38 38 LEU CA C 13 55.13 0.15 . 1 . . . . . . . . 5280 1 438 . 1 1 38 38 LEU CB C 13 51.29 0.15 . 1 . . . . . . . . 5280 1 439 . 1 1 38 38 LEU CG C 13 27.99 0.15 . 1 . . . . . . . . 5280 1 440 . 1 1 38 38 LEU CD1 C 13 28.28 0.15 . 1 . . . . . . . . 5280 1 441 . 1 1 38 38 LEU CD2 C 13 25.79 0.15 . 1 . . . . . . . . 5280 1 442 . 1 1 38 38 LEU N N 15 121.92 0.2 . 1 . . . . . . . . 5280 1 443 . 1 1 39 39 THR H H 1 8.41 0.01 . 1 . . . . . . . . 5280 1 444 . 1 1 39 39 THR HA H 1 5.01 0.01 . 1 . . . . . . . . 5280 1 445 . 1 1 39 39 THR HB H 1 4.77 0.01 . 1 . . . . . . . . 5280 1 446 . 1 1 39 39 THR HG1 H 1 4.77 0.01 . 2 . . . . . . . . 5280 1 447 . 1 1 39 39 THR HG21 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 448 . 1 1 39 39 THR HG22 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 449 . 1 1 39 39 THR HG23 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 450 . 1 1 39 39 THR C C 13 176.34 0.15 . 1 . . . . . . . . 5280 1 451 . 1 1 39 39 THR CA C 13 61.44 0.15 . 1 . . . . . . . . 5280 1 452 . 1 1 39 39 THR CB C 13 72.88 0.15 . 1 . . . . . . . . 5280 1 453 . 1 1 39 39 THR CG2 C 13 22.36 0.15 . 1 . . . . . . . . 5280 1 454 . 1 1 39 39 THR N N 15 112.46 0.2 . 1 . . . . . . . . 5280 1 455 . 1 1 40 40 LEU H H 1 9.31 0.01 . 1 . . . . . . . . 5280 1 456 . 1 1 40 40 LEU HA H 1 3.76 0.01 . 1 . . . . . . . . 5280 1 457 . 1 1 40 40 LEU HB2 H 1 1.70 0.01 . 1 . . . . . . . . 5280 1 458 . 1 1 40 40 LEU HB3 H 1 1.58 0.01 . 1 . . . . . . . . 5280 1 459 . 1 1 40 40 LEU HG H 1 1.04 0.01 . 1 . . . . . . . . 5280 1 460 . 1 1 40 40 LEU HD11 H 1 0.577 0.01 . 1 . . . . . . . . 5280 1 461 . 1 1 40 40 LEU HD12 H 1 0.577 0.01 . 1 . . . . . . . . 5280 1 462 . 1 1 40 40 LEU HD13 H 1 0.577 0.01 . 1 . . . . . . . . 5280 1 463 . 1 1 40 40 LEU HD21 H 1 0.896 0.01 . 1 . . . . . . . . 5280 1 464 . 1 1 40 40 LEU HD22 H 1 0.896 0.01 . 1 . . . . . . . . 5280 1 465 . 1 1 40 40 LEU HD23 H 1 0.896 0.01 . 1 . . . . . . . . 5280 1 466 . 1 1 40 40 LEU C C 13 178.65 0.15 . 1 . . . . . . . . 5280 1 467 . 1 1 40 40 LEU CA C 13 59.61 0.15 . 1 . . . . . . . . 5280 1 468 . 1 1 40 40 LEU CB C 13 42.72 0.15 . 1 . . . . . . . . 5280 1 469 . 1 1 40 40 LEU CG C 13 27.50 0.15 . 1 . . . . . . . . 5280 1 470 . 1 1 40 40 LEU CD1 C 13 24.75 0.15 . 1 . . . . . . . . 5280 1 471 . 1 1 40 40 LEU CD2 C 13 26.43 0.15 . 1 . . . . . . . . 5280 1 472 . 1 1 40 40 LEU N N 15 122.66 0.2 . 1 . . . . . . . . 5280 1 473 . 1 1 41 41 ASN H H 1 8.23 0.01 . 1 . . . . . . . . 5280 1 474 . 1 1 41 41 ASN HA H 1 4.39 0.01 . 1 . . . . . . . . 5280 1 475 . 1 1 41 41 ASN HB2 H 1 2.79 0.01 . 2 . . . . . . . . 5280 1 476 . 1 1 41 41 ASN HB3 H 1 2.85 0.01 . 2 . . . . . . . . 5280 1 477 . 1 1 41 41 ASN HD21 H 1 7.72 0.01 . 1 . . . . . . . . 5280 1 478 . 1 1 41 41 ASN HD22 H 1 7.10 0.01 . 1 . . . . . . . . 5280 1 479 . 1 1 41 41 ASN C C 13 178.74 0.15 . 1 . . . . . . . . 5280 1 480 . 1 1 41 41 ASN CA C 13 57.67 0.15 . 1 . . . . . . . . 5280 1 481 . 1 1 41 41 ASN CB C 13 39.14 0.15 . 1 . . . . . . . . 5280 1 482 . 1 1 41 41 ASN N N 15 114.67 0.2 . 1 . . . . . . . . 5280 1 483 . 1 1 41 41 ASN ND2 N 15 113.76 0.2 . 1 . . . . . . . . 5280 1 484 . 1 1 42 42 GLY H H 1 8.19 0.01 . 1 . . . . . . . . 5280 1 485 . 1 1 42 42 GLY HA2 H 1 4.02 0.01 . 2 . . . . . . . . 5280 1 486 . 1 1 42 42 GLY HA3 H 1 4.06 0.01 . 2 . . . . . . . . 5280 1 487 . 1 1 42 42 GLY C C 13 178.12 0.15 . 1 . . . . . . . . 5280 1 488 . 1 1 42 42 GLY CA C 13 48.40 0.15 . 1 . . . . . . . . 5280 1 489 . 1 1 42 42 GLY N N 15 109.70 0.2 . 1 . . . . . . . . 5280 1 490 . 1 1 43 43 ILE H H 1 8.28 0.01 . 1 . . . . . . . . 5280 1 491 . 1 1 43 43 ILE HA H 1 3.68 0.01 . 1 . . . . . . . . 5280 1 492 . 1 1 43 43 ILE HB H 1 2.07 0.01 . 1 . . . . . . . . 5280 1 493 . 1 1 43 43 ILE HG12 H 1 1.97 0.01 . 2 . . . . . . . . 5280 1 494 . 1 1 43 43 ILE HG13 H 1 0.66 0.01 . 2 . . . . . . . . 5280 1 495 . 1 1 43 43 ILE HG21 H 1 0.90 0.01 . 1 . . . . . . . . 5280 1 496 . 1 1 43 43 ILE HG22 H 1 0.90 0.01 . 1 . . . . . . . . 5280 1 497 . 1 1 43 43 ILE HG23 H 1 0.90 0.01 . 1 . . . . . . . . 5280 1 498 . 1 1 43 43 ILE HD11 H 1 0.57 0.01 . 1 . . . . . . . . 5280 1 499 . 1 1 43 43 ILE HD12 H 1 0.57 0.01 . 1 . . . . . . . . 5280 1 500 . 1 1 43 43 ILE HD13 H 1 0.57 0.01 . 1 . . . . . . . . 5280 1 501 . 1 1 43 43 ILE C C 13 178.77 0.15 . 1 . . . . . . . . 5280 1 502 . 1 1 43 43 ILE CA C 13 67.43 0.15 . 1 . . . . . . . . 5280 1 503 . 1 1 43 43 ILE CB C 13 38.93 0.15 . 1 . . . . . . . . 5280 1 504 . 1 1 43 43 ILE CG1 C 13 31.09 0.15 . 2 . . . . . . . . 5280 1 505 . 1 1 43 43 ILE CG2 C 13 19.14 0.15 . 2 . . . . . . . . 5280 1 506 . 1 1 43 43 ILE CD1 C 13 14.91 0.15 . 1 . . . . . . . . 5280 1 507 . 1 1 43 43 ILE N N 15 127.02 0.2 . 1 . . . . . . . . 5280 1 508 . 1 1 44 44 TYR H H 1 8.39 0.01 . 1 . . . . . . . . 5280 1 509 . 1 1 44 44 TYR HA H 1 4.86 0.01 . 1 . . . . . . . . 5280 1 510 . 1 1 44 44 TYR HB2 H 1 3.38 0.01 . 1 . . . . . . . . 5280 1 511 . 1 1 44 44 TYR HB3 H 1 3.62 0.01 . 1 . . . . . . . . 5280 1 512 . 1 1 44 44 TYR HD1 H 1 7.11 0.01 . 1 . . . . . . . . 5280 1 513 . 1 1 44 44 TYR HD2 H 1 7.11 0.01 . 1 . . . . . . . . 5280 1 514 . 1 1 44 44 TYR HE1 H 1 6.67 0.01 . 1 . . . . . . . . 5280 1 515 . 1 1 44 44 TYR HE2 H 1 6.67 0.01 . 1 . . . . . . . . 5280 1 516 . 1 1 44 44 TYR C C 13 179.75 0.15 . 1 . . . . . . . . 5280 1 517 . 1 1 44 44 TYR CA C 13 59.50 0.15 . 1 . . . . . . . . 5280 1 518 . 1 1 44 44 TYR CB C 13 37.70 0.15 . 1 . . . . . . . . 5280 1 519 . 1 1 44 44 TYR CD1 C 13 130.91 0.15 . 1 . . . . . . . . 5280 1 520 . 1 1 44 44 TYR CD2 C 13 130.91 0.15 . 1 . . . . . . . . 5280 1 521 . 1 1 44 44 TYR CE1 C 13 117.85 0.01 . 1 . . . . . . . . 5280 1 522 . 1 1 44 44 TYR CE2 C 13 117.85 0.01 . 1 . . . . . . . . 5280 1 523 . 1 1 44 44 TYR N N 15 118.86 0.2 . 1 . . . . . . . . 5280 1 524 . 1 1 45 45 GLU H H 1 8.92 0.01 . 1 . . . . . . . . 5280 1 525 . 1 1 45 45 GLU HA H 1 4.19 0.01 . 1 . . . . . . . . 5280 1 526 . 1 1 45 45 GLU HB2 H 1 2.28 0.01 . 2 . . . . . . . . 5280 1 527 . 1 1 45 45 GLU HB3 H 1 2.34 0.01 . 2 . . . . . . . . 5280 1 528 . 1 1 45 45 GLU HG2 H 1 2.47 0.01 . 2 . . . . . . . . 5280 1 529 . 1 1 45 45 GLU HG3 H 1 2.61 0.01 . 2 . . . . . . . . 5280 1 530 . 1 1 45 45 GLU C C 13 179.63 0.15 . 1 . . . . . . . . 5280 1 531 . 1 1 45 45 GLU CA C 13 60.89 0.15 . 1 . . . . . . . . 5280 1 532 . 1 1 45 45 GLU CB C 13 30.90 0.15 . 1 . . . . . . . . 5280 1 533 . 1 1 45 45 GLU CG C 13 37.34 0.15 . 1 . . . . . . . . 5280 1 534 . 1 1 45 45 GLU N N 15 119.00 0.2 . 1 . . . . . . . . 5280 1 535 . 1 1 46 46 PHE H H 1 8.14 0.01 . 1 . . . . . . . . 5280 1 536 . 1 1 46 46 PHE HA H 1 4.22 0.01 . 1 . . . . . . . . 5280 1 537 . 1 1 46 46 PHE HB2 H 1 3.41 0.01 . 1 . . . . . . . . 5280 1 538 . 1 1 46 46 PHE HB3 H 1 3.41 0.01 . 1 . . . . . . . . 5280 1 539 . 1 1 46 46 PHE HD1 H 1 7.32 0.01 . 1 . . . . . . . . 5280 1 540 . 1 1 46 46 PHE HD2 H 1 7.32 0.01 . 1 . . . . . . . . 5280 1 541 . 1 1 46 46 PHE HE1 H 1 7.35 0.01 . 1 . . . . . . . . 5280 1 542 . 1 1 46 46 PHE HE2 H 1 7.35 0.01 . 1 . . . . . . . . 5280 1 543 . 1 1 46 46 PHE C C 13 179.35 0.15 . 1 . . . . . . . . 5280 1 544 . 1 1 46 46 PHE CA C 13 63.19 0.15 . 1 . . . . . . . . 5280 1 545 . 1 1 46 46 PHE CB C 13 40.12 0.15 . 1 . . . . . . . . 5280 1 546 . 1 1 46 46 PHE CD1 C 13 132.43 0.15 . 1 . . . . . . . . 5280 1 547 . 1 1 46 46 PHE CD2 C 13 132.43 0.15 . 1 . . . . . . . . 5280 1 548 . 1 1 46 46 PHE CE1 C 13 131.03 0.15 . 1 . . . . . . . . 5280 1 549 . 1 1 46 46 PHE CE2 C 13 131.03 0.15 . 1 . . . . . . . . 5280 1 550 . 1 1 46 46 PHE N N 15 120.72 0.2 . 1 . . . . . . . . 5280 1 551 . 1 1 47 47 ILE H H 1 8.41 0.01 . 1 . . . . . . . . 5280 1 552 . 1 1 47 47 ILE HA H 1 3.73 0.01 . 1 . . . . . . . . 5280 1 553 . 1 1 47 47 ILE HB H 1 2.19 0.01 . 1 . . . . . . . . 5280 1 554 . 1 1 47 47 ILE HG12 H 1 1.08 0.01 . 2 . . . . . . . . 5280 1 555 . 1 1 47 47 ILE HG13 H 1 2.47 0.01 . 2 . . . . . . . . 5280 1 556 . 1 1 47 47 ILE HG21 H 1 0.31 0.01 . 1 . . . . . . . . 5280 1 557 . 1 1 47 47 ILE HG22 H 1 0.31 0.01 . 1 . . . . . . . . 5280 1 558 . 1 1 47 47 ILE HG23 H 1 0.31 0.01 . 1 . . . . . . . . 5280 1 559 . 1 1 47 47 ILE HD11 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 560 . 1 1 47 47 ILE HD12 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 561 . 1 1 47 47 ILE HD13 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 562 . 1 1 47 47 ILE C C 13 177.91 0.15 . 1 . . . . . . . . 5280 1 563 . 1 1 47 47 ILE CA C 13 67.44 0.15 . 1 . . . . . . . . 5280 1 564 . 1 1 47 47 ILE CB C 13 39.40 0.15 . 1 . . . . . . . . 5280 1 565 . 1 1 47 47 ILE CG1 C 13 31.56 0.15 . 2 . . . . . . . . 5280 1 566 . 1 1 47 47 ILE CG2 C 13 18.73 0.15 . 2 . . . . . . . . 5280 1 567 . 1 1 47 47 ILE CD1 C 13 16.69 0.15 . 1 . . . . . . . . 5280 1 568 . 1 1 47 47 ILE N N 15 121.58 0.2 . 1 . . . . . . . . 5280 1 569 . 1 1 48 48 MET H H 1 8.58 0.01 . 1 . . . . . . . . 5280 1 570 . 1 1 48 48 MET HA H 1 3.95 0.01 . 1 . . . . . . . . 5280 1 571 . 1 1 48 48 MET HB2 H 1 2.38 0.01 . 2 . . . . . . . . 5280 1 572 . 1 1 48 48 MET HB3 H 1 2.11 0.01 . 2 . . . . . . . . 5280 1 573 . 1 1 48 48 MET HG2 H 1 3.30 0.01 . 2 . . . . . . . . 5280 1 574 . 1 1 48 48 MET HG3 H 1 2.52 0.01 . 2 . . . . . . . . 5280 1 575 . 1 1 48 48 MET C C 13 178.32 0.15 . 1 . . . . . . . . 5280 1 576 . 1 1 48 48 MET CA C 13 61.08 0.15 . 1 . . . . . . . . 5280 1 577 . 1 1 48 48 MET CB C 13 34.65 0.15 . 1 . . . . . . . . 5280 1 578 . 1 1 48 48 MET CG C 13 34.15 0.15 . 1 . . . . . . . . 5280 1 579 . 1 1 48 48 MET N N 15 116.86 0.2 . 1 . . . . . . . . 5280 1 580 . 1 1 49 49 LYS H H 1 8.28 0.01 . 1 . . . . . . . . 5280 1 581 . 1 1 49 49 LYS HA H 1 4.04 0.01 . 1 . . . . . . . . 5280 1 582 . 1 1 49 49 LYS HB2 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 583 . 1 1 49 49 LYS HB3 H 1 1.96 0.01 . 1 . . . . . . . . 5280 1 584 . 1 1 49 49 LYS HG2 H 1 1.35 0.01 . 2 . . . . . . . . 5280 1 585 . 1 1 49 49 LYS HG3 H 1 1.51 0.01 . 2 . . . . . . . . 5280 1 586 . 1 1 49 49 LYS HD2 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 587 . 1 1 49 49 LYS HD3 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 588 . 1 1 49 49 LYS HE2 H 1 3.03 0.01 . 1 . . . . . . . . 5280 1 589 . 1 1 49 49 LYS HE3 H 1 3.03 0.01 . 1 . . . . . . . . 5280 1 590 . 1 1 49 49 LYS C C 13 178.86 0.15 . 1 . . . . . . . . 5280 1 591 . 1 1 49 49 LYS CA C 13 59.89 0.15 . 1 . . . . . . . . 5280 1 592 . 1 1 49 49 LYS CB C 13 33.84 0.15 . 1 . . . . . . . . 5280 1 593 . 1 1 49 49 LYS CG C 13 26.28 0.15 . 1 . . . . . . . . 5280 1 594 . 1 1 49 49 LYS CD C 13 30.40 0.15 . 1 . . . . . . . . 5280 1 595 . 1 1 49 49 LYS CE C 13 43.23 0.15 . 1 . . . . . . . . 5280 1 596 . 1 1 49 49 LYS N N 15 117.55 0.2 . 1 . . . . . . . . 5280 1 597 . 1 1 50 50 ASN H H 1 7.29 0.01 . 1 . . . . . . . . 5280 1 598 . 1 1 50 50 ASN HA H 1 4.21 0.01 . 1 . . . . . . . . 5280 1 599 . 1 1 50 50 ASN HB2 H 1 1.75 0.01 . 1 . . . . . . . . 5280 1 600 . 1 1 50 50 ASN HB3 H 1 1.45 0.01 . 1 . . . . . . . . 5280 1 601 . 1 1 50 50 ASN HD21 H 1 6.77 0.01 . 2 . . . . . . . . 5280 1 602 . 1 1 50 50 ASN HD22 H 1 6.28 0.01 . 2 . . . . . . . . 5280 1 603 . 1 1 50 50 ASN C C 13 175.08 0.15 . 1 . . . . . . . . 5280 1 604 . 1 1 50 50 ASN CA C 13 56.27 0.15 . 1 . . . . . . . . 5280 1 605 . 1 1 50 50 ASN CB C 13 41.35 0.15 . 1 . . . . . . . . 5280 1 606 . 1 1 50 50 ASN N N 15 114.19 0.2 . 1 . . . . . . . . 5280 1 607 . 1 1 50 50 ASN ND2 N 15 117.16 0.2 . 1 . . . . . . . . 5280 1 608 . 1 1 51 51 PHE H H 1 8.13 0.01 . 1 . . . . . . . . 5280 1 609 . 1 1 51 51 PHE HA H 1 5.23 0.01 . 1 . . . . . . . . 5280 1 610 . 1 1 51 51 PHE HB2 H 1 3.66 0.01 . 1 . . . . . . . . 5280 1 611 . 1 1 51 51 PHE HB3 H 1 3.13 0.01 . 1 . . . . . . . . 5280 1 612 . 1 1 51 51 PHE HD1 H 1 7.60 0.01 . 1 . . . . . . . . 5280 1 613 . 1 1 51 51 PHE HD2 H 1 7.60 0.01 . 1 . . . . . . . . 5280 1 614 . 1 1 51 51 PHE HE1 H 1 7.41 0.01 . 1 . . . . . . . . 5280 1 615 . 1 1 51 51 PHE HE2 H 1 7.41 0.01 . 1 . . . . . . . . 5280 1 616 . 1 1 51 51 PHE CA C 13 55.99 0.15 . 1 . . . . . . . . 5280 1 617 . 1 1 51 51 PHE CB C 13 40.80 0.15 . 1 . . . . . . . . 5280 1 618 . 1 1 51 51 PHE CG C 13 138.35 0.15 . 1 . . . . . . . . 5280 1 619 . 1 1 51 51 PHE CD1 C 13 132.78 0.15 . 1 . . . . . . . . 5280 1 620 . 1 1 51 51 PHE CD2 C 13 132.78 0.15 . 1 . . . . . . . . 5280 1 621 . 1 1 51 51 PHE CE1 C 13 130.50 0.15 . 3 . . . . . . . . 5280 1 622 . 1 1 51 51 PHE CE2 C 13 129.03 0.15 . 3 . . . . . . . . 5280 1 623 . 1 1 51 51 PHE N N 15 117.63 0.2 . 1 . . . . . . . . 5280 1 624 . 1 1 52 52 PRO HA H 1 4.17 0.01 . 1 . . . . . . . . 5280 1 625 . 1 1 52 52 PRO HB2 H 1 2.06 0.01 . 1 . . . . . . . . 5280 1 626 . 1 1 52 52 PRO HB3 H 1 1.22 0.01 . 1 . . . . . . . . 5280 1 627 . 1 1 52 52 PRO HG2 H 1 1.83 0.01 . 2 . . . . . . . . 5280 1 628 . 1 1 52 52 PRO HD2 H 1 3.82 0.01 . 1 . . . . . . . . 5280 1 629 . 1 1 52 52 PRO HD3 H 1 3.49 0.01 . 1 . . . . . . . . 5280 1 630 . 1 1 52 52 PRO C C 13 178.02 0.15 . 1 . . . . . . . . 5280 1 631 . 1 1 52 52 PRO CA C 13 66.11 0.15 . 1 . . . . . . . . 5280 1 632 . 1 1 52 52 PRO CB C 13 32.44 0.15 . 1 . . . . . . . . 5280 1 633 . 1 1 52 52 PRO CG C 13 28.20 0.15 . 1 . . . . . . . . 5280 1 634 . 1 1 52 52 PRO CD C 13 51.47 0.15 . 1 . . . . . . . . 5280 1 635 . 1 1 52 52 PRO N N 15 130.53 0.2 . 1 . . . . . . . . 5280 1 636 . 1 1 53 53 TYR H H 1 8.61 0.01 . 1 . . . . . . . . 5280 1 637 . 1 1 53 53 TYR HA H 1 3.97 0.01 . 1 . . . . . . . . 5280 1 638 . 1 1 53 53 TYR HB2 H 1 2.06 0.01 . 2 . . . . . . . . 5280 1 639 . 1 1 53 53 TYR HB3 H 1 3.13 0.01 . 2 . . . . . . . . 5280 1 640 . 1 1 53 53 TYR HD1 H 1 6.02 0.01 . 1 . . . . . . . . 5280 1 641 . 1 1 53 53 TYR HD2 H 1 6.02 0.01 . 1 . . . . . . . . 5280 1 642 . 1 1 53 53 TYR HE1 H 1 6.62 0.01 . 1 . . . . . . . . 5280 1 643 . 1 1 53 53 TYR HE2 H 1 6.62 0.01 . 1 . . . . . . . . 5280 1 644 . 1 1 53 53 TYR C C 13 178.04 0.15 . 1 . . . . . . . . 5280 1 645 . 1 1 53 53 TYR CA C 13 62.97 0.15 . 1 . . . . . . . . 5280 1 646 . 1 1 53 53 TYR CB C 13 41.42 0.15 . 1 . . . . . . . . 5280 1 647 . 1 1 53 53 TYR CD1 C 13 133.13 0.15 . 1 . . . . . . . . 5280 1 648 . 1 1 53 53 TYR CD2 C 13 133.13 0.15 . 1 . . . . . . . . 5280 1 649 . 1 1 53 53 TYR CE1 C 13 117.96 0.15 . 1 . . . . . . . . 5280 1 650 . 1 1 53 53 TYR CE2 C 13 117.96 0.15 . 1 . . . . . . . . 5280 1 651 . 1 1 53 53 TYR N N 15 119.71 0.2 . 1 . . . . . . . . 5280 1 652 . 1 1 54 54 TYR H H 1 8.19 0.01 . 1 . . . . . . . . 5280 1 653 . 1 1 54 54 TYR HA H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 654 . 1 1 54 54 TYR HB2 H 1 2.38 0.01 . 1 . . . . . . . . 5280 1 655 . 1 1 54 54 TYR HB3 H 1 2.31 0.01 . 1 . . . . . . . . 5280 1 656 . 1 1 54 54 TYR HD1 H 1 6.33 0.01 . 1 . . . . . . . . 5280 1 657 . 1 1 54 54 TYR HD2 H 1 6.33 0.01 . 1 . . . . . . . . 5280 1 658 . 1 1 54 54 TYR HE1 H 1 6.68 0.01 . 1 . . . . . . . . 5280 1 659 . 1 1 54 54 TYR HE2 H 1 6.68 0.01 . 1 . . . . . . . . 5280 1 660 . 1 1 54 54 TYR C C 13 176.65 0.15 . 1 . . . . . . . . 5280 1 661 . 1 1 54 54 TYR CA C 13 61.86 0.15 . 1 . . . . . . . . 5280 1 662 . 1 1 54 54 TYR CB C 13 38.70 0.15 . 1 . . . . . . . . 5280 1 663 . 1 1 54 54 TYR CD1 C 13 132.89 0.15 . 1 . . . . . . . . 5280 1 664 . 1 1 54 54 TYR CD2 C 13 132.89 0.15 . 1 . . . . . . . . 5280 1 665 . 1 1 54 54 TYR CE1 C 13 116.68 0.15 . 1 . . . . . . . . 5280 1 666 . 1 1 54 54 TYR CE2 C 13 116.68 0.15 . 1 . . . . . . . . 5280 1 667 . 1 1 54 54 TYR N N 15 115.32 0.2 . 1 . . . . . . . . 5280 1 668 . 1 1 55 55 ARG H H 1 7.80 0.01 . 1 . . . . . . . . 5280 1 669 . 1 1 55 55 ARG HA H 1 4.31 0.01 . 1 . . . . . . . . 5280 1 670 . 1 1 55 55 ARG HB2 H 1 2.20 0.01 . 1 . . . . . . . . 5280 1 671 . 1 1 55 55 ARG HB3 H 1 2.10 0.01 . 1 . . . . . . . . 5280 1 672 . 1 1 55 55 ARG HG2 H 1 1.91 0.01 . 2 . . . . . . . . 5280 1 673 . 1 1 55 55 ARG HG3 H 1 1.82 0.01 . 2 . . . . . . . . 5280 1 674 . 1 1 55 55 ARG HD2 H 1 3.42 0.01 . 2 . . . . . . . . 5280 1 675 . 1 1 55 55 ARG HD3 H 1 3.28 0.01 . 2 . . . . . . . . 5280 1 676 . 1 1 55 55 ARG C C 13 177.70 0.15 . 1 . . . . . . . . 5280 1 677 . 1 1 55 55 ARG CA C 13 59.65 0.15 . 1 . . . . . . . . 5280 1 678 . 1 1 55 55 ARG CB C 13 31.40 0.15 . 1 . . . . . . . . 5280 1 679 . 1 1 55 55 ARG CG C 13 29.07 0.15 . 1 . . . . . . . . 5280 1 680 . 1 1 55 55 ARG CD C 13 44.93 0.15 . 1 . . . . . . . . 5280 1 681 . 1 1 55 55 ARG N N 15 119.20 0.2 . 1 . . . . . . . . 5280 1 682 . 1 1 56 56 GLU H H 1 7.45 0.01 . 1 . . . . . . . . 5280 1 683 . 1 1 56 56 GLU HA H 1 4.53 0.01 . 1 . . . . . . . . 5280 1 684 . 1 1 56 56 GLU HB2 H 1 2.19 0.01 . 1 . . . . . . . . 5280 1 685 . 1 1 56 56 GLU HB3 H 1 1.95 0.01 . 1 . . . . . . . . 5280 1 686 . 1 1 56 56 GLU HG2 H 1 2.33 0.01 . 2 . . . . . . . . 5280 1 687 . 1 1 56 56 GLU HG3 H 1 2.39 0.01 . 2 . . . . . . . . 5280 1 688 . 1 1 56 56 GLU C C 13 177.07 0.15 . 1 . . . . . . . . 5280 1 689 . 1 1 56 56 GLU CA C 13 56.78 0.15 . 1 . . . . . . . . 5280 1 690 . 1 1 56 56 GLU CB C 13 31.81 0.15 . 1 . . . . . . . . 5280 1 691 . 1 1 56 56 GLU CG C 13 36.87 0.15 . 1 . . . . . . . . 5280 1 692 . 1 1 56 56 GLU N N 15 115.90 0.2 . 1 . . . . . . . . 5280 1 693 . 1 1 57 57 ASN H H 1 8.19 0.01 . 1 . . . . . . . . 5280 1 694 . 1 1 57 57 ASN HA H 1 4.75 0.01 . 1 . . . . . . . . 5280 1 695 . 1 1 57 57 ASN HB2 H 1 2.60 0.01 . 2 . . . . . . . . 5280 1 696 . 1 1 57 57 ASN HB3 H 1 2.90 0.01 . 2 . . . . . . . . 5280 1 697 . 1 1 57 57 ASN C C 13 177.07 0.15 . 1 . . . . . . . . 5280 1 698 . 1 1 57 57 ASN CA C 13 54.80 0.15 . 1 . . . . . . . . 5280 1 699 . 1 1 57 57 ASN CB C 13 39.44 0.15 . 1 . . . . . . . . 5280 1 700 . 1 1 57 57 ASN N N 15 119.79 0.2 . 1 . . . . . . . . 5280 1 701 . 1 1 58 58 LYS H H 1 8.50 0.01 . 1 . . . . . . . . 5280 1 702 . 1 1 58 58 LYS HA H 1 4.46 0.01 . 1 . . . . . . . . 5280 1 703 . 1 1 58 58 LYS HB2 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 704 . 1 1 58 58 LYS HB3 H 1 1.92 0.01 . 1 . . . . . . . . 5280 1 705 . 1 1 58 58 LYS HG2 H 1 1.56 0.01 . 2 . . . . . . . . 5280 1 706 . 1 1 58 58 LYS HG3 H 1 1.65 0.01 . 2 . . . . . . . . 5280 1 707 . 1 1 58 58 LYS HD2 H 1 1.47 0.01 . 1 . . . . . . . . 5280 1 708 . 1 1 58 58 LYS HD3 H 1 1.47 0.01 . 1 . . . . . . . . 5280 1 709 . 1 1 58 58 LYS HE2 H 1 2.89 0.01 . 1 . . . . . . . . 5280 1 710 . 1 1 58 58 LYS HE3 H 1 2.89 0.01 . 1 . . . . . . . . 5280 1 711 . 1 1 58 58 LYS CA C 13 58.20 0.15 . 1 . . . . . . . . 5280 1 712 . 1 1 58 58 LYS CB C 13 33.60 0.15 . 1 . . . . . . . . 5280 1 713 . 1 1 58 58 LYS CG C 13 26.14 0.15 . 1 . . . . . . . . 5280 1 714 . 1 1 58 58 LYS CD C 13 30.29 0.15 . 1 . . . . . . . . 5280 1 715 . 1 1 58 58 LYS CE C 13 43.33 0.15 . 1 . . . . . . . . 5280 1 716 . 1 1 58 58 LYS N N 15 122.25 0.2 . 1 . . . . . . . . 5280 1 717 . 1 1 59 59 GLN H H 1 8.48 0.01 . 1 . . . . . . . . 5280 1 718 . 1 1 59 59 GLN HA H 1 4.26 0.01 . 1 . . . . . . . . 5280 1 719 . 1 1 59 59 GLN HB2 H 1 2.24 0.01 . 2 . . . . . . . . 5280 1 720 . 1 1 59 59 GLN HB3 H 1 2.28 0.01 . 2 . . . . . . . . 5280 1 721 . 1 1 59 59 GLN HG2 H 1 2.47 0.01 . 2 . . . . . . . . 5280 1 722 . 1 1 59 59 GLN HG3 H 1 2.51 0.01 . 2 . . . . . . . . 5280 1 723 . 1 1 59 59 GLN HE21 H 1 6.96 0.01 . 2 . . . . . . . . 5280 1 724 . 1 1 59 59 GLN HE22 H 1 7.59 0.01 . 2 . . . . . . . . 5280 1 725 . 1 1 59 59 GLN C C 13 178.77 0.15 . 1 . . . . . . . . 5280 1 726 . 1 1 59 59 GLN CA C 13 58.29 0.15 . 1 . . . . . . . . 5280 1 727 . 1 1 59 59 GLN CB C 13 29.70 0.15 . 1 . . . . . . . . 5280 1 728 . 1 1 59 59 GLN CG C 13 35.26 0.15 . 1 . . . . . . . . 5280 1 729 . 1 1 59 59 GLN CD C 13 179.14 0.15 . 1 . . . . . . . . 5280 1 730 . 1 1 59 59 GLN N N 15 118.17 0.2 . 1 . . . . . . . . 5280 1 731 . 1 1 59 59 GLN NE2 N 15 112.98 0.2 . 1 . . . . . . . . 5280 1 732 . 1 1 60 60 GLY H H 1 8.50 0.01 . 1 . . . . . . . . 5280 1 733 . 1 1 60 60 GLY HA2 H 1 3.97 0.01 . 2 . . . . . . . . 5280 1 734 . 1 1 60 60 GLY HA3 H 1 4.25 0.01 . 2 . . . . . . . . 5280 1 735 . 1 1 60 60 GLY C C 13 177.77 0.15 . 1 . . . . . . . . 5280 1 736 . 1 1 60 60 GLY CA C 13 48.26 0.15 . 1 . . . . . . . . 5280 1 737 . 1 1 60 60 GLY N N 15 109.47 0.2 . 1 . . . . . . . . 5280 1 738 . 1 1 61 61 TRP H H 1 7.93 0.01 . 1 . . . . . . . . 5280 1 739 . 1 1 61 61 TRP HA H 1 4.52 0.01 . 1 . . . . . . . . 5280 1 740 . 1 1 61 61 TRP HB2 H 1 3.64 0.01 . 2 . . . . . . . . 5280 1 741 . 1 1 61 61 TRP HB3 H 1 3.69 0.01 . 2 . . . . . . . . 5280 1 742 . 1 1 61 61 TRP HD1 H 1 7.81 0.01 . 1 . . . . . . . . 5280 1 743 . 1 1 61 61 TRP C C 13 179.00 0.15 . 1 . . . . . . . . 5280 1 744 . 1 1 61 61 TRP CA C 13 59.96 0.15 . 1 . . . . . . . . 5280 1 745 . 1 1 61 61 TRP CB C 13 29.30 0.15 . 1 . . . . . . . . 5280 1 746 . 1 1 61 61 TRP CD1 C 13 129.18 0.15 . 1 . . . . . . . . 5280 1 747 . 1 1 61 61 TRP N N 15 122.80 0.2 . 1 . . . . . . . . 5280 1 748 . 1 1 62 62 GLN H H 1 7.81 0.01 . 1 . . . . . . . . 5280 1 749 . 1 1 62 62 GLN HA H 1 3.21 0.01 . 1 . . . . . . . . 5280 1 750 . 1 1 62 62 GLN HB2 H 1 1.27 0.01 . 1 . . . . . . . . 5280 1 751 . 1 1 62 62 GLN HB3 H 1 1.35 0.01 . 1 . . . . . . . . 5280 1 752 . 1 1 62 62 GLN HG2 H 1 0.13 0.01 . 2 . . . . . . . . 5280 1 753 . 1 1 62 62 GLN HG3 H 1 0.05 0.01 . 2 . . . . . . . . 5280 1 754 . 1 1 62 62 GLN HE21 H 1 6.67 0.01 . 2 . . . . . . . . 5280 1 755 . 1 1 62 62 GLN HE22 H 1 5.45 0.01 . 2 . . . . . . . . 5280 1 756 . 1 1 62 62 GLN C C 13 180.82 0.15 . 1 . . . . . . . . 5280 1 757 . 1 1 62 62 GLN CA C 13 61.37 0.15 . 1 . . . . . . . . 5280 1 758 . 1 1 62 62 GLN CB C 13 26.68 0.15 . 1 . . . . . . . . 5280 1 759 . 1 1 62 62 GLN CG C 13 33.15 0.15 . 1 . . . . . . . . 5280 1 760 . 1 1 62 62 GLN CD C 13 179.14 0.15 . 1 . . . . . . . . 5280 1 761 . 1 1 62 62 GLN N N 15 123.17 0.2 . 1 . . . . . . . . 5280 1 762 . 1 1 62 62 GLN NE2 N 15 108.35 0.2 . 1 . . . . . . . . 5280 1 763 . 1 1 63 63 ASN H H 1 7.97 0.01 . 1 . . . . . . . . 5280 1 764 . 1 1 63 63 ASN HA H 1 4.49 0.01 . 1 . . . . . . . . 5280 1 765 . 1 1 63 63 ASN HB2 H 1 2.99 0.01 . 1 . . . . . . . . 5280 1 766 . 1 1 63 63 ASN HB3 H 1 2.89 0.01 . 1 . . . . . . . . 5280 1 767 . 1 1 63 63 ASN HD21 H 1 7.75 0.01 . 2 . . . . . . . . 5280 1 768 . 1 1 63 63 ASN HD22 H 1 7.06 0.01 . 2 . . . . . . . . 5280 1 769 . 1 1 63 63 ASN C C 13 178.79 0.15 . 1 . . . . . . . . 5280 1 770 . 1 1 63 63 ASN CA C 13 57.07 0.15 . 1 . . . . . . . . 5280 1 771 . 1 1 63 63 ASN CB C 13 38.92 0.15 . 1 . . . . . . . . 5280 1 772 . 1 1 63 63 ASN N N 15 120.70 0.2 . 1 . . . . . . . . 5280 1 773 . 1 1 63 63 ASN ND2 N 15 114.23 0.2 . 1 . . . . . . . . 5280 1 774 . 1 1 64 64 SER H H 1 7.87 0.01 . 1 . . . . . . . . 5280 1 775 . 1 1 64 64 SER HA H 1 4.34 0.01 . 1 . . . . . . . . 5280 1 776 . 1 1 64 64 SER HB2 H 1 3.59 0.01 . 1 . . . . . . . . 5280 1 777 . 1 1 64 64 SER HB3 H 1 3.69 0.01 . 1 . . . . . . . . 5280 1 778 . 1 1 64 64 SER HG H 1 6.19 0.01 . 1 . . . . . . . . 5280 1 779 . 1 1 64 64 SER C C 13 178.04 0.15 . 1 . . . . . . . . 5280 1 780 . 1 1 64 64 SER CA C 13 63.68 0.15 . 1 . . . . . . . . 5280 1 781 . 1 1 64 64 SER CB C 13 63.70 0.15 . 1 . . . . . . . . 5280 1 782 . 1 1 64 64 SER N N 15 118.73 0.2 . 1 . . . . . . . . 5280 1 783 . 1 1 65 65 ILE H H 1 8.05 0.01 . 1 . . . . . . . . 5280 1 784 . 1 1 65 65 ILE HA H 1 3.66 0.01 . 1 . . . . . . . . 5280 1 785 . 1 1 65 65 ILE HB H 1 2.48 0.01 . 1 . . . . . . . . 5280 1 786 . 1 1 65 65 ILE HG12 H 1 1.80 0.01 . 2 . . . . . . . . 5280 1 787 . 1 1 65 65 ILE HG13 H 1 1.73 0.01 . 2 . . . . . . . . 5280 1 788 . 1 1 65 65 ILE HG21 H 1 0.83 0.01 . 1 . . . . . . . . 5280 1 789 . 1 1 65 65 ILE HG22 H 1 0.83 0.01 . 1 . . . . . . . . 5280 1 790 . 1 1 65 65 ILE HG23 H 1 0.83 0.01 . 1 . . . . . . . . 5280 1 791 . 1 1 65 65 ILE HD11 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 792 . 1 1 65 65 ILE HD12 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 793 . 1 1 65 65 ILE HD13 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 794 . 1 1 65 65 ILE C C 13 177.37 0.15 . 1 . . . . . . . . 5280 1 795 . 1 1 65 65 ILE CA C 13 64.64 0.15 . 1 . . . . . . . . 5280 1 796 . 1 1 65 65 ILE CB C 13 37.11 0.15 . 1 . . . . . . . . 5280 1 797 . 1 1 65 65 ILE CG1 C 13 29.40 0.15 . 1 . . . . . . . . 5280 1 798 . 1 1 65 65 ILE CG2 C 13 17.50 0.15 . 1 . . . . . . . . 5280 1 799 . 1 1 65 65 ILE CD1 C 13 12.53 0.15 . 1 . . . . . . . . 5280 1 800 . 1 1 65 65 ILE N N 15 123.15 0.2 . 1 . . . . . . . . 5280 1 801 . 1 1 66 66 ARG H H 1 7.67 0.01 . 1 . . . . . . . . 5280 1 802 . 1 1 66 66 ARG HA H 1 3.78 0.01 . 1 . . . . . . . . 5280 1 803 . 1 1 66 66 ARG HB2 H 1 2.06 0.01 . 1 . . . . . . . . 5280 1 804 . 1 1 66 66 ARG HB3 H 1 2.06 0.01 . 1 . . . . . . . . 5280 1 805 . 1 1 66 66 ARG HG2 H 1 1.83 0.01 . 2 . . . . . . . . 5280 1 806 . 1 1 66 66 ARG HG3 H 1 1.67 0.01 . 2 . . . . . . . . 5280 1 807 . 1 1 66 66 ARG HD2 H 1 2.84 0.01 . 1 . . . . . . . . 5280 1 808 . 1 1 66 66 ARG HD3 H 1 2.84 0.15 . 1 . . . . . . . . 5280 1 809 . 1 1 66 66 ARG C C 13 179.56 0.15 . 1 . . . . . . . . 5280 1 810 . 1 1 66 66 ARG CA C 13 61.24 0.15 . 1 . . . . . . . . 5280 1 811 . 1 1 66 66 ARG CB C 13 31.35 0.15 . 1 . . . . . . . . 5280 1 812 . 1 1 66 66 ARG CG C 13 31.04 0.15 . 1 . . . . . . . . 5280 1 813 . 1 1 66 66 ARG CD C 13 44.65 0.15 . 1 . . . . . . . . 5280 1 814 . 1 1 66 66 ARG N N 15 118.83 0.2 . 1 . . . . . . . . 5280 1 815 . 1 1 67 67 HIS H H 1 8.27 0.01 . 1 . . . . . . . . 5280 1 816 . 1 1 67 67 HIS HA H 1 4.48 0.01 . 1 . . . . . . . . 5280 1 817 . 1 1 67 67 HIS HB2 H 1 3.41 0.01 . 2 . . . . . . . . 5280 1 818 . 1 1 67 67 HIS HB3 H 1 3.44 0.01 . 2 . . . . . . . . 5280 1 819 . 1 1 67 67 HIS HD2 H 1 7.39 0.01 . 1 . . . . . . . . 5280 1 820 . 1 1 67 67 HIS C C 13 177.95 0.15 . 1 . . . . . . . . 5280 1 821 . 1 1 67 67 HIS CA C 13 59.88 0.15 . 1 . . . . . . . . 5280 1 822 . 1 1 67 67 HIS CB C 13 29.95 0.15 . 1 . . . . . . . . 5280 1 823 . 1 1 67 67 HIS CD2 C 13 119.80 0.15 . 1 . . . . . . . . 5280 1 824 . 1 1 68 68 ASN H H 1 8.32 0.01 . 1 . . . . . . . . 5280 1 825 . 1 1 68 68 ASN HA H 1 4.39 0.01 . 1 . . . . . . . . 5280 1 826 . 1 1 68 68 ASN HB2 H 1 3.00 0.01 . 1 . . . . . . . . 5280 1 827 . 1 1 68 68 ASN HB3 H 1 2.84 0.01 . 1 . . . . . . . . 5280 1 828 . 1 1 68 68 ASN HD21 H 1 7.44 0.01 . 2 . . . . . . . . 5280 1 829 . 1 1 68 68 ASN HD22 H 1 7.15 0.01 . 2 . . . . . . . . 5280 1 830 . 1 1 68 68 ASN C C 13 178.56 0.15 . 1 . . . . . . . . 5280 1 831 . 1 1 68 68 ASN CA C 13 58.25 0.15 . 1 . . . . . . . . 5280 1 832 . 1 1 68 68 ASN CB C 13 39.49 0.15 . 1 . . . . . . . . 5280 1 833 . 1 1 68 68 ASN N N 15 119.71 0.2 . 1 . . . . . . . . 5280 1 834 . 1 1 68 68 ASN ND2 N 15 111.14 0.2 . 1 . . . . . . . . 5280 1 835 . 1 1 69 69 LEU H H 1 8.00 0.01 . 1 . . . . . . . . 5280 1 836 . 1 1 69 69 LEU HA H 1 3.86 0.01 . 1 . . . . . . . . 5280 1 837 . 1 1 69 69 LEU HB2 H 1 1.19 0.01 . 1 . . . . . . . . 5280 1 838 . 1 1 69 69 LEU HB3 H 1 0.31 0.01 . 1 . . . . . . . . 5280 1 839 . 1 1 69 69 LEU HG H 1 -0.29 0.01 . 1 . . . . . . . . 5280 1 840 . 1 1 69 69 LEU HD11 H 1 -0.29 0.01 . 2 . . . . . . . . 5280 1 841 . 1 1 69 69 LEU HD12 H 1 -0.29 0.01 . 2 . . . . . . . . 5280 1 842 . 1 1 69 69 LEU HD13 H 1 -0.29 0.01 . 2 . . . . . . . . 5280 1 843 . 1 1 69 69 LEU HD21 H 1 -0.39 0.01 . 2 . . . . . . . . 5280 1 844 . 1 1 69 69 LEU HD22 H 1 -0.39 0.01 . 2 . . . . . . . . 5280 1 845 . 1 1 69 69 LEU HD23 H 1 -0.39 0.01 . 2 . . . . . . . . 5280 1 846 . 1 1 69 69 LEU C C 13 177.93 0.15 . 1 . . . . . . . . 5280 1 847 . 1 1 69 69 LEU CA C 13 58.75 0.15 . 1 . . . . . . . . 5280 1 848 . 1 1 69 69 LEU CB C 13 42.34 0.15 . 1 . . . . . . . . 5280 1 849 . 1 1 69 69 LEU CG C 13 26.22 0.15 . 1 . . . . . . . . 5280 1 850 . 1 1 69 69 LEU CD1 C 13 24.67 0.15 . 2 . . . . . . . . 5280 1 851 . 1 1 69 69 LEU CD2 C 13 24.27 0.15 . 1 . . . . . . . . 5280 1 852 . 1 1 69 69 LEU N N 15 120.27 0.2 . 1 . . . . . . . . 5280 1 853 . 1 1 70 70 SER H H 1 7.18 0.01 . 1 . . . . . . . . 5280 1 854 . 1 1 70 70 SER HA H 1 4.50 0.01 . 1 . . . . . . . . 5280 1 855 . 1 1 70 70 SER HB2 H 1 4.11 0.01 . 2 . . . . . . . . 5280 1 856 . 1 1 70 70 SER HB3 H 1 4.16 0.01 . 2 . . . . . . . . 5280 1 857 . 1 1 70 70 SER HG H 1 5.19 0.01 . 1 . . . . . . . . 5280 1 858 . 1 1 70 70 SER C C 13 176.16 0.15 . 1 . . . . . . . . 5280 1 859 . 1 1 70 70 SER CA C 13 61.56 0.15 . 1 . . . . . . . . 5280 1 860 . 1 1 70 70 SER CB C 13 65.16 0.15 . 1 . . . . . . . . 5280 1 861 . 1 1 70 70 SER N N 15 109.51 0.2 . 1 . . . . . . . . 5280 1 862 . 1 1 71 71 LEU H H 1 7.49 0.01 . 1 . . . . . . . . 5280 1 863 . 1 1 71 71 LEU HA H 1 4.55 0.01 . 1 . . . . . . . . 5280 1 864 . 1 1 71 71 LEU HB2 H 1 1.72 0.01 . 2 . . . . . . . . 5280 1 865 . 1 1 71 71 LEU HB3 H 1 1.67 0.01 . 2 . . . . . . . . 5280 1 866 . 1 1 71 71 LEU HG H 1 0.92 0.01 . 1 . . . . . . . . 5280 1 867 . 1 1 71 71 LEU HD11 H 1 0.85 0.01 . 2 . . . . . . . . 5280 1 868 . 1 1 71 71 LEU HD12 H 1 0.85 0.01 . 2 . . . . . . . . 5280 1 869 . 1 1 71 71 LEU HD13 H 1 0.85 0.01 . 2 . . . . . . . . 5280 1 870 . 1 1 71 71 LEU HD21 H 1 0.92 0.01 . 2 . . . . . . . . 5280 1 871 . 1 1 71 71 LEU HD22 H 1 0.92 0.01 . 2 . . . . . . . . 5280 1 872 . 1 1 71 71 LEU HD23 H 1 0.92 0.01 . 2 . . . . . . . . 5280 1 873 . 1 1 71 71 LEU C C 13 177.86 0.15 . 1 . . . . . . . . 5280 1 874 . 1 1 71 71 LEU CA C 13 56.40 0.15 . 1 . . . . . . . . 5280 1 875 . 1 1 71 71 LEU CB C 13 45.00 0.15 . 1 . . . . . . . . 5280 1 876 . 1 1 71 71 LEU CG C 13 27.75 0.15 . 1 . . . . . . . . 5280 1 877 . 1 1 71 71 LEU CD1 C 13 25.84 0.15 . 2 . . . . . . . . 5280 1 878 . 1 1 71 71 LEU CD2 C 13 24.44 0.15 . 2 . . . . . . . . 5280 1 879 . 1 1 71 71 LEU N N 15 120.54 0.2 . 1 . . . . . . . . 5280 1 880 . 1 1 72 72 ASN H H 1 7.88 0.01 . 1 . . . . . . . . 5280 1 881 . 1 1 72 72 ASN HA H 1 4.89 0.01 . 1 . . . . . . . . 5280 1 882 . 1 1 72 72 ASN HB2 H 1 2.97 0.01 . 2 . . . . . . . . 5280 1 883 . 1 1 72 72 ASN HB3 H 1 3.24 0.01 . 2 . . . . . . . . 5280 1 884 . 1 1 72 72 ASN HD21 H 1 7.03 0.01 . 2 . . . . . . . . 5280 1 885 . 1 1 72 72 ASN HD22 H 1 7.40 0.01 . 2 . . . . . . . . 5280 1 886 . 1 1 72 72 ASN C C 13 176.53 0.15 . 1 . . . . . . . . 5280 1 887 . 1 1 72 72 ASN CA C 13 54.42 0.15 . 1 . . . . . . . . 5280 1 888 . 1 1 72 72 ASN CB C 13 40.68 0.15 . 1 . . . . . . . . 5280 1 889 . 1 1 72 72 ASN N N 15 119.28 0.2 . 1 . . . . . . . . 5280 1 890 . 1 1 72 72 ASN ND2 N 15 112.94 0.2 . 1 . . . . . . . . 5280 1 891 . 1 1 73 73 LYS H H 1 8.62 0.01 . 1 . . . . . . . . 5280 1 892 . 1 1 73 73 LYS HA H 1 4.45 0.01 . 1 . . . . . . . . 5280 1 893 . 1 1 73 73 LYS HB2 H 1 1.96 0.01 . 1 . . . . . . . . 5280 1 894 . 1 1 73 73 LYS HB3 H 1 2.08 0.01 . 1 . . . . . . . . 5280 1 895 . 1 1 73 73 LYS HG2 H 1 1.65 0.01 . 2 . . . . . . . . 5280 1 896 . 1 1 73 73 LYS HG3 H 1 1.85 0.01 . 2 . . . . . . . . 5280 1 897 . 1 1 73 73 LYS HD2 H 1 1.85 0.01 . 1 . . . . . . . . 5280 1 898 . 1 1 73 73 LYS HD3 H 1 1.85 0.01 . 1 . . . . . . . . 5280 1 899 . 1 1 73 73 LYS HE2 H 1 3.22 0.01 . 1 . . . . . . . . 5280 1 900 . 1 1 73 73 LYS HE3 H 1 3.22 0.01 . 1 . . . . . . . . 5280 1 901 . 1 1 73 73 LYS C C 13 177.93 0.15 . 1 . . . . . . . . 5280 1 902 . 1 1 73 73 LYS CA C 13 58.49 0.15 . 1 . . . . . . . . 5280 1 903 . 1 1 73 73 LYS CB C 13 32.63 0.15 . 1 . . . . . . . . 5280 1 904 . 1 1 73 73 LYS CG C 13 25.70 0.15 . 1 . . . . . . . . 5280 1 905 . 1 1 73 73 LYS CD C 13 29.86 0.15 . 1 . . . . . . . . 5280 1 906 . 1 1 73 73 LYS CE C 13 43.40 0.15 . 1 . . . . . . . . 5280 1 907 . 1 1 73 73 LYS N N 15 124.78 0.2 . 1 . . . . . . . . 5280 1 908 . 1 1 74 74 SER H H 1 8.40 0.01 . 1 . . . . . . . . 5280 1 909 . 1 1 74 74 SER HA H 1 4.27 0.01 . 1 . . . . . . . . 5280 1 910 . 1 1 74 74 SER HB2 H 1 2.99 0.01 . 1 . . . . . . . . 5280 1 911 . 1 1 74 74 SER HB3 H 1 3.50 0.01 . 1 . . . . . . . . 5280 1 912 . 1 1 74 74 SER C C 13 173.75 0.15 . 1 . . . . . . . . 5280 1 913 . 1 1 74 74 SER CA C 13 62.04 0.15 . 1 . . . . . . . . 5280 1 914 . 1 1 74 74 SER CB C 13 64.11 0.15 . 1 . . . . . . . . 5280 1 915 . 1 1 74 74 SER N N 15 115.24 0.2 . 1 . . . . . . . . 5280 1 916 . 1 1 75 75 PHE H H 1 7.80 0.01 . 1 . . . . . . . . 5280 1 917 . 1 1 75 75 PHE HA H 1 5.63 0.01 . 1 . . . . . . . . 5280 1 918 . 1 1 75 75 PHE HB2 H 1 3.35 0.01 . 1 . . . . . . . . 5280 1 919 . 1 1 75 75 PHE HB3 H 1 3.42 0.01 . 1 . . . . . . . . 5280 1 920 . 1 1 75 75 PHE HD1 H 1 7.35 0.01 . 1 . . . . . . . . 5280 1 921 . 1 1 75 75 PHE HD2 H 1 7.35 0.01 . 1 . . . . . . . . 5280 1 922 . 1 1 75 75 PHE HE1 H 1 7.16 0.01 . 1 . . . . . . . . 5280 1 923 . 1 1 75 75 PHE HE2 H 1 7.16 0.01 . 1 . . . . . . . . 5280 1 924 . 1 1 75 75 PHE C C 13 175.71 0.15 . 1 . . . . . . . . 5280 1 925 . 1 1 75 75 PHE CA C 13 56.50 0.15 . 1 . . . . . . . . 5280 1 926 . 1 1 75 75 PHE CB C 13 41.39 0.15 . 1 . . . . . . . . 5280 1 927 . 1 1 75 75 PHE CD1 C 13 131.95 0.15 . 1 . . . . . . . . 5280 1 928 . 1 1 75 75 PHE CD2 C 13 131.95 0.15 . 1 . . . . . . . . 5280 1 929 . 1 1 75 75 PHE CE1 C 13 130.79 0.15 . 1 . . . . . . . . 5280 1 930 . 1 1 75 75 PHE CE2 C 13 130.79 0.15 . 1 . . . . . . . . 5280 1 931 . 1 1 75 75 PHE N N 15 120.10 0.2 . 1 . . . . . . . . 5280 1 932 . 1 1 76 76 VAL H H 1 9.38 0.01 . 1 . . . . . . . . 5280 1 933 . 1 1 76 76 VAL HA H 1 4.65 0.01 . 1 . . . . . . . . 5280 1 934 . 1 1 76 76 VAL HB H 1 2.02 0.01 . 1 . . . . . . . . 5280 1 935 . 1 1 76 76 VAL HG11 H 1 1.02 0.01 . 1 . . . . . . . . 5280 1 936 . 1 1 76 76 VAL HG12 H 1 1.02 0.01 . 1 . . . . . . . . 5280 1 937 . 1 1 76 76 VAL HG13 H 1 1.02 0.01 . 1 . . . . . . . . 5280 1 938 . 1 1 76 76 VAL HG21 H 1 1.01 0.01 . 1 . . . . . . . . 5280 1 939 . 1 1 76 76 VAL HG22 H 1 1.01 0.01 . 1 . . . . . . . . 5280 1 940 . 1 1 76 76 VAL HG23 H 1 1.01 0.01 . 1 . . . . . . . . 5280 1 941 . 1 1 76 76 VAL C C 13 175.11 0.15 . 1 . . . . . . . . 5280 1 942 . 1 1 76 76 VAL CA C 13 61.65 0.15 . 1 . . . . . . . . 5280 1 943 . 1 1 76 76 VAL CB C 13 36.13 0.15 . 1 . . . . . . . . 5280 1 944 . 1 1 76 76 VAL CG1 C 13 22.23 0.15 . 1 . . . . . . . . 5280 1 945 . 1 1 76 76 VAL CG2 C 13 21.64 0.15 . 1 . . . . . . . . 5280 1 946 . 1 1 76 76 VAL N N 15 122.30 0.2 . 1 . . . . . . . . 5280 1 947 . 1 1 77 77 LYS H H 1 8.34 0.01 . 1 . . . . . . . . 5280 1 948 . 1 1 77 77 LYS HA H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 949 . 1 1 77 77 LYS HB2 H 1 1.02 0.01 . 1 . . . . . . . . 5280 1 950 . 1 1 77 77 LYS HB3 H 1 1.21 0.01 . 1 . . . . . . . . 5280 1 951 . 1 1 77 77 LYS HG2 H 1 0.50 0.01 . 2 . . . . . . . . 5280 1 952 . 1 1 77 77 LYS HG3 H 1 1.44 0.01 . 2 . . . . . . . . 5280 1 953 . 1 1 77 77 LYS HD2 H 1 1.11 0.01 . 1 . . . . . . . . 5280 1 954 . 1 1 77 77 LYS HD3 H 1 1.11 0.01 . 1 . . . . . . . . 5280 1 955 . 1 1 77 77 LYS HE2 H 1 2.85 0.01 . 1 . . . . . . . . 5280 1 956 . 1 1 77 77 LYS HE3 H 1 2.85 0.01 . 1 . . . . . . . . 5280 1 957 . 1 1 77 77 LYS C C 13 177.39 0.15 . 1 . . . . . . . . 5280 1 958 . 1 1 77 77 LYS CA C 13 56.40 0.15 . 1 . . . . . . . . 5280 1 959 . 1 1 77 77 LYS CB C 13 33.70 0.15 . 1 . . . . . . . . 5280 1 960 . 1 1 77 77 LYS CG C 13 25.40 0.15 . 1 . . . . . . . . 5280 1 961 . 1 1 77 77 LYS CD C 13 30.37 0.15 . 1 . . . . . . . . 5280 1 962 . 1 1 77 77 LYS CE C 13 42.96 0.15 . 1 . . . . . . . . 5280 1 963 . 1 1 77 77 LYS N N 15 127.54 0.2 . 1 . . . . . . . . 5280 1 964 . 1 1 78 78 VAL H H 1 8.64 0.01 . 1 . . . . . . . . 5280 1 965 . 1 1 78 78 VAL HA H 1 4.49 0.01 . 1 . . . . . . . . 5280 1 966 . 1 1 78 78 VAL HB H 1 2.00 0.01 . 1 . . . . . . . . 5280 1 967 . 1 1 78 78 VAL HG11 H 1 1.02 0.01 . 1 . . . . . . . . 5280 1 968 . 1 1 78 78 VAL HG12 H 1 1.02 0.01 . 1 . . . . . . . . 5280 1 969 . 1 1 78 78 VAL HG13 H 1 1.02 0.01 . 1 . . . . . . . . 5280 1 970 . 1 1 78 78 VAL HG21 H 1 0.91 0.01 . 1 . . . . . . . . 5280 1 971 . 1 1 78 78 VAL HG22 H 1 0.91 0.01 . 1 . . . . . . . . 5280 1 972 . 1 1 78 78 VAL HG23 H 1 0.91 0.01 . 1 . . . . . . . . 5280 1 973 . 1 1 78 78 VAL CA C 13 60.21 0.15 . 1 . . . . . . . . 5280 1 974 . 1 1 78 78 VAL CB C 13 34.66 0.15 . 1 . . . . . . . . 5280 1 975 . 1 1 78 78 VAL CG1 C 13 21.89 0.15 . 1 . . . . . . . . 5280 1 976 . 1 1 78 78 VAL CG2 C 13 21.89 0.15 . 1 . . . . . . . . 5280 1 977 . 1 1 78 78 VAL N N 15 126.89 0.2 . 1 . . . . . . . . 5280 1 978 . 1 1 79 79 PRO HA H 1 4.52 0.01 . 1 . . . . . . . . 5280 1 979 . 1 1 79 79 PRO HB2 H 1 2.31 0.01 . 2 . . . . . . . . 5280 1 980 . 1 1 79 79 PRO HB3 H 1 1.83 0.01 . 2 . . . . . . . . 5280 1 981 . 1 1 79 79 PRO HG2 H 1 2.05 0.01 . 2 . . . . . . . . 5280 1 982 . 1 1 79 79 PRO HG3 H 1 2.00 0.01 . 2 . . . . . . . . 5280 1 983 . 1 1 79 79 PRO HD2 H 1 3.87 0.01 . 2 . . . . . . . . 5280 1 984 . 1 1 79 79 PRO HD3 H 1 3.72 0.01 . 2 . . . . . . . . 5280 1 985 . 1 1 79 79 PRO C C 13 177.51 0.15 . 1 . . . . . . . . 5280 1 986 . 1 1 79 79 PRO CA C 13 63.80 0.15 . 1 . . . . . . . . 5280 1 987 . 1 1 79 79 PRO CB C 13 33.18 0.15 . 1 . . . . . . . . 5280 1 988 . 1 1 79 79 PRO CG C 13 28.42 0.15 . 1 . . . . . . . . 5280 1 989 . 1 1 79 79 PRO CD C 13 52.12 0.15 . 1 . . . . . . . . 5280 1 990 . 1 1 79 79 PRO N N 15 130.53 0.2 . 1 . . . . . . . . 5280 1 991 . 1 1 80 80 ARG H H 1 8.23 0.01 . 1 . . . . . . . . 5280 1 992 . 1 1 80 80 ARG HA H 1 4.22 0.01 . 1 . . . . . . . . 5280 1 993 . 1 1 80 80 ARG HB2 H 1 1.66 0.01 . 1 . . . . . . . . 5280 1 994 . 1 1 80 80 ARG HB3 H 1 1.78 0.01 . 1 . . . . . . . . 5280 1 995 . 1 1 80 80 ARG HG2 H 1 1.44 0.01 . 2 . . . . . . . . 5280 1 996 . 1 1 80 80 ARG HG3 H 1 1.37 0.01 . 2 . . . . . . . . 5280 1 997 . 1 1 80 80 ARG HD2 H 1 3.00 0.01 . 2 . . . . . . . . 5280 1 998 . 1 1 80 80 ARG HD3 H 1 3.10 0.01 . 2 . . . . . . . . 5280 1 999 . 1 1 80 80 ARG C C 13 177.46 0.15 . 1 . . . . . . . . 5280 1 1000 . 1 1 80 80 ARG CA C 13 57.59 0.15 . 1 . . . . . . . . 5280 1 1001 . 1 1 80 80 ARG CB C 13 32.13 0.15 . 1 . . . . . . . . 5280 1 1002 . 1 1 80 80 ARG CG C 13 28.26 0.15 . 1 . . . . . . . . 5280 1 1003 . 1 1 80 80 ARG CD C 13 44.43 0.15 . 1 . . . . . . . . 5280 1 1004 . 1 1 80 80 ARG N N 15 121.71 0.2 . 1 . . . . . . . . 5280 1 1005 . 1 1 81 81 HIS H H 1 8.95 0.01 . 1 . . . . . . . . 5280 1 1006 . 1 1 81 81 HIS HA H 1 4.80 0.01 . 1 . . . . . . . . 5280 1 1007 . 1 1 81 81 HIS HB2 H 1 3.16 0.01 . 1 . . . . . . . . 5280 1 1008 . 1 1 81 81 HIS HB3 H 1 3.31 0.01 . 1 . . . . . . . . 5280 1 1009 . 1 1 81 81 HIS HD2 H 1 7.24 0.01 . 1 . . . . . . . . 5280 1 1010 . 1 1 81 81 HIS C C 13 177.16 0.15 . 1 . . . . . . . . 5280 1 1011 . 1 1 81 81 HIS CA C 13 55.92 0.15 . 1 . . . . . . . . 5280 1 1012 . 1 1 81 81 HIS CB C 13 30.68 0.15 . 1 . . . . . . . . 5280 1 1013 . 1 1 81 81 HIS CD2 C 13 119.36 0.15 . 1 . . . . . . . . 5280 1 1014 . 1 1 81 81 HIS N N 15 120.92 0.2 . 1 . . . . . . . . 5280 1 1015 . 1 1 82 82 TYR H H 1 8.43 0.01 . 1 . . . . . . . . 5280 1 1016 . 1 1 82 82 TYR HA H 1 4.39 0.01 . 1 . . . . . . . . 5280 1 1017 . 1 1 82 82 TYR HB2 H 1 3.12 0.01 . 1 . . . . . . . . 5280 1 1018 . 1 1 82 82 TYR HB3 H 1 3.12 0.01 . 1 . . . . . . . . 5280 1 1019 . 1 1 82 82 TYR HD1 H 1 7.20 0.01 . 1 . . . . . . . . 5280 1 1020 . 1 1 82 82 TYR HD2 H 1 7.20 0.01 . 1 . . . . . . . . 5280 1 1021 . 1 1 82 82 TYR HE1 H 1 6.93 0.01 . 1 . . . . . . . . 5280 1 1022 . 1 1 82 82 TYR HE2 H 1 6.93 0.01 . 1 . . . . . . . . 5280 1 1023 . 1 1 82 82 TYR C C 13 176.37 0.15 . 1 . . . . . . . . 5280 1 1024 . 1 1 82 82 TYR CA C 13 60.59 0.15 . 1 . . . . . . . . 5280 1 1025 . 1 1 82 82 TYR CB C 13 39.13 0.15 . 1 . . . . . . . . 5280 1 1026 . 1 1 82 82 TYR CD1 C 13 132.78 0.15 . 1 . . . . . . . . 5280 1 1027 . 1 1 82 82 TYR CD2 C 13 132.78 0.15 . 1 . . . . . . . . 5280 1 1028 . 1 1 82 82 TYR CE1 C 13 117.91 0.15 . 1 . . . . . . . . 5280 1 1029 . 1 1 82 82 TYR CE2 C 13 117.91 0.15 . 1 . . . . . . . . 5280 1 1030 . 1 1 82 82 TYR N N 15 122.28 0.2 . 1 . . . . . . . . 5280 1 1031 . 1 1 83 83 ASP H H 1 8.37 0.01 . 1 . . . . . . . . 5280 1 1032 . 1 1 83 83 ASP HA H 1 4.58 0.01 . 1 . . . . . . . . 5280 1 1033 . 1 1 83 83 ASP HB2 H 1 2.79 0.01 . 1 . . . . . . . . 5280 1 1034 . 1 1 83 83 ASP HB3 H 1 2.58 0.01 . 1 . . . . . . . . 5280 1 1035 . 1 1 83 83 ASP C C 13 176.39 0.15 . 1 . . . . . . . . 5280 1 1036 . 1 1 83 83 ASP CA C 13 54.52 0.15 . 1 . . . . . . . . 5280 1 1037 . 1 1 83 83 ASP CB C 13 40.92 0.15 . 1 . . . . . . . . 5280 1 1038 . 1 1 83 83 ASP CG C 13 177.84 0.15 . 1 . . . . . . . . 5280 1 1039 . 1 1 83 83 ASP N N 15 118.78 0.2 . 1 . . . . . . . . 5280 1 1040 . 1 1 84 84 ASP H H 1 7.71 0.01 . 1 . . . . . . . . 5280 1 1041 . 1 1 84 84 ASP HA H 1 5.03 0.01 . 1 . . . . . . . . 5280 1 1042 . 1 1 84 84 ASP HB2 H 1 2.93 0.01 . 2 . . . . . . . . 5280 1 1043 . 1 1 84 84 ASP HB3 H 1 2.67 0.01 . 2 . . . . . . . . 5280 1 1044 . 1 1 84 84 ASP CA C 13 53.02 0.15 . 1 . . . . . . . . 5280 1 1045 . 1 1 84 84 ASP CB C 13 42.41 0.15 . 1 . . . . . . . . 5280 1 1046 . 1 1 84 84 ASP N N 15 121.04 0.2 . 1 . . . . . . . . 5280 1 1047 . 1 1 85 85 PRO HA H 1 4.54 0.01 . 1 . . . . . . . . 5280 1 1048 . 1 1 85 85 PRO HB2 H 1 2.14 0.01 . 1 . . . . . . . . 5280 1 1049 . 1 1 85 85 PRO HB3 H 1 2.39 0.01 . 1 . . . . . . . . 5280 1 1050 . 1 1 85 85 PRO HG2 H 1 2.01 0.01 . 1 . . . . . . . . 5280 1 1051 . 1 1 85 85 PRO HG3 H 1 2.06 0.01 . 1 . . . . . . . . 5280 1 1052 . 1 1 85 85 PRO HD2 H 1 3.88 0.01 . 1 . . . . . . . . 5280 1 1053 . 1 1 85 85 PRO HD3 H 1 3.92 0.01 . 1 . . . . . . . . 5280 1 1054 . 1 1 85 85 PRO C C 13 178.86 0.15 . 1 . . . . . . . . 5280 1 1055 . 1 1 85 85 PRO CA C 13 64.95 0.15 . 1 . . . . . . . . 5280 1 1056 . 1 1 85 85 PRO CB C 13 33.02 0.15 . 1 . . . . . . . . 5280 1 1057 . 1 1 85 85 PRO CG C 13 28.22 0.15 . 1 . . . . . . . . 5280 1 1058 . 1 1 85 85 PRO CD C 13 51.84 0.15 . 1 . . . . . . . . 5280 1 1059 . 1 1 85 85 PRO N N 15 130.53 0.2 . 1 . . . . . . . . 5280 1 1060 . 1 1 86 86 GLY H H 1 8.60 0.01 . 1 . . . . . . . . 5280 1 1061 . 1 1 86 86 GLY HA2 H 1 4.02 0.01 . 1 . . . . . . . . 5280 1 1062 . 1 1 86 86 GLY HA3 H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 1063 . 1 1 86 86 GLY C C 13 174.92 0.15 . 1 . . . . . . . . 5280 1 1064 . 1 1 86 86 GLY CA C 13 46.51 0.15 . 1 . . . . . . . . 5280 1 1065 . 1 1 86 86 GLY N N 15 109.15 0.2 . 1 . . . . . . . . 5280 1 1066 . 1 1 87 87 LYS H H 1 7.97 0.01 . 1 . . . . . . . . 5280 1 1067 . 1 1 87 87 LYS HA H 1 4.50 0.01 . 1 . . . . . . . . 5280 1 1068 . 1 1 87 87 LYS HB2 H 1 1.86 0.01 . 1 . . . . . . . . 5280 1 1069 . 1 1 87 87 LYS HB3 H 1 1.98 0.01 . 1 . . . . . . . . 5280 1 1070 . 1 1 87 87 LYS HG2 H 1 1.49 0.01 . 2 . . . . . . . . 5280 1 1071 . 1 1 87 87 LYS HG3 H 1 1.44 0.01 . 2 . . . . . . . . 5280 1 1072 . 1 1 87 87 LYS HD2 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1073 . 1 1 87 87 LYS HD3 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1074 . 1 1 87 87 LYS HE2 H 1 3.08 0.01 . 1 . . . . . . . . 5280 1 1075 . 1 1 87 87 LYS HE3 H 1 3.08 0.01 . 1 . . . . . . . . 5280 1 1076 . 1 1 87 87 LYS C C 13 177.74 0.15 . 1 . . . . . . . . 5280 1 1077 . 1 1 87 87 LYS CA C 13 56.85 0.15 . 1 . . . . . . . . 5280 1 1078 . 1 1 87 87 LYS CB C 13 34.60 0.15 . 1 . . . . . . . . 5280 1 1079 . 1 1 87 87 LYS CG C 13 26.09 0.15 . 1 . . . . . . . . 5280 1 1080 . 1 1 87 87 LYS CD C 13 30.10 0.15 . 1 . . . . . . . . 5280 1 1081 . 1 1 87 87 LYS CE C 13 43.37 0.15 . 1 . . . . . . . . 5280 1 1082 . 1 1 87 87 LYS N N 15 119.64 0.2 . 1 . . . . . . . . 5280 1 1083 . 1 1 88 88 GLY H H 1 8.19 0.01 . 1 . . . . . . . . 5280 1 1084 . 1 1 88 88 GLY HA2 H 1 3.97 0.01 . 2 . . . . . . . . 5280 1 1085 . 1 1 88 88 GLY HA3 H 1 4.21 0.01 . 2 . . . . . . . . 5280 1 1086 . 1 1 88 88 GLY CA C 13 45.84 0.15 . 1 . . . . . . . . 5280 1 1087 . 1 1 88 88 GLY N N 15 109.24 0.2 . 1 . . . . . . . . 5280 1 1088 . 1 1 89 89 ASN H H 1 8.03 0.01 . 1 . . . . . . . . 5280 1 1089 . 1 1 89 89 ASN HA H 1 4.82 0.01 . 1 . . . . . . . . 5280 1 1090 . 1 1 89 89 ASN HB2 H 1 2.47 0.01 . 1 . . . . . . . . 5280 1 1091 . 1 1 89 89 ASN HB3 H 1 2.38 0.01 . 1 . . . . . . . . 5280 1 1092 . 1 1 89 89 ASN HD21 H 1 7.26 0.01 . 2 . . . . . . . . 5280 1 1093 . 1 1 89 89 ASN HD22 H 1 6.55 0.01 . 2 . . . . . . . . 5280 1 1094 . 1 1 89 89 ASN C C 13 175.43 0.15 . 1 . . . . . . . . 5280 1 1095 . 1 1 89 89 ASN CA C 13 54.33 0.15 . 1 . . . . . . . . 5280 1 1096 . 1 1 89 89 ASN CB C 13 41.57 0.15 . 1 . . . . . . . . 5280 1 1097 . 1 1 89 89 ASN N N 15 116.95 0.2 . 1 . . . . . . . . 5280 1 1098 . 1 1 89 89 ASN ND2 N 15 114.71 0.2 . 1 . . . . . . . . 5280 1 1099 . 1 1 90 90 TYR H H 1 8.67 0.01 . 1 . . . . . . . . 5280 1 1100 . 1 1 90 90 TYR HA H 1 4.61 0.01 . 1 . . . . . . . . 5280 1 1101 . 1 1 90 90 TYR HB2 H 1 2.70 0.01 . 1 . . . . . . . . 5280 1 1102 . 1 1 90 90 TYR HB3 H 1 2.80 0.01 . 1 . . . . . . . . 5280 1 1103 . 1 1 90 90 TYR HD1 H 1 6.88 0.01 . 1 . . . . . . . . 5280 1 1104 . 1 1 90 90 TYR HD2 H 1 6.88 0.01 . 1 . . . . . . . . 5280 1 1105 . 1 1 90 90 TYR HE1 H 1 6.91 0.01 . 1 . . . . . . . . 5280 1 1106 . 1 1 90 90 TYR HE2 H 1 6.91 0.01 . 1 . . . . . . . . 5280 1 1107 . 1 1 90 90 TYR C C 13 175.39 0.15 . 1 . . . . . . . . 5280 1 1108 . 1 1 90 90 TYR CA C 13 58.66 0.15 . 1 . . . . . . . . 5280 1 1109 . 1 1 90 90 TYR CB C 13 42.50 0.15 . 1 . . . . . . . . 5280 1 1110 . 1 1 90 90 TYR CD1 C 13 132.43 0.15 . 1 . . . . . . . . 5280 1 1111 . 1 1 90 90 TYR CD2 C 13 132.43 0.15 . 1 . . . . . . . . 5280 1 1112 . 1 1 90 90 TYR CE1 C 13 118.55 0.15 . 1 . . . . . . . . 5280 1 1113 . 1 1 90 90 TYR CE2 C 13 118.55 0.15 . 1 . . . . . . . . 5280 1 1114 . 1 1 90 90 TYR N N 15 118.81 0.2 . 1 . . . . . . . . 5280 1 1115 . 1 1 91 91 TRP H H 1 9.13 0.01 . 1 . . . . . . . . 5280 1 1116 . 1 1 91 91 TRP HA H 1 5.37 0.01 . 1 . . . . . . . . 5280 1 1117 . 1 1 91 91 TRP HB2 H 1 2.99 0.01 . 1 . . . . . . . . 5280 1 1118 . 1 1 91 91 TRP HB3 H 1 2.99 0.01 . 1 . . . . . . . . 5280 1 1119 . 1 1 91 91 TRP HD1 H 1 6.97 0.01 . 1 . . . . . . . . 5280 1 1120 . 1 1 91 91 TRP C C 13 176.01 0.15 . 1 . . . . . . . . 5280 1 1121 . 1 1 91 91 TRP CA C 13 57.80 0.15 . 1 . . . . . . . . 5280 1 1122 . 1 1 91 91 TRP CB C 13 32.46 0.15 . 1 . . . . . . . . 5280 1 1123 . 1 1 91 91 TRP CD1 C 13 125.41 0.15 . 1 . . . . . . . . 5280 1 1124 . 1 1 91 91 TRP N N 15 122.28 0.2 . 1 . . . . . . . . 5280 1 1125 . 1 1 92 92 MET H H 1 9.39 0.01 . 1 . . . . . . . . 5280 1 1126 . 1 1 92 92 MET HA H 1 5.14 0.01 . 1 . . . . . . . . 5280 1 1127 . 1 1 92 92 MET HB2 H 1 2.24 0.01 . 1 . . . . . . . . 5280 1 1128 . 1 1 92 92 MET HB3 H 1 2.33 0.01 . 1 . . . . . . . . 5280 1 1129 . 1 1 92 92 MET HG2 H 1 2.80 0.01 . 2 . . . . . . . . 5280 1 1130 . 1 1 92 92 MET HG3 H 1 2.41 0.01 . 2 . . . . . . . . 5280 1 1131 . 1 1 92 92 MET C C 13 175.32 0.15 . 1 . . . . . . . . 5280 1 1132 . 1 1 92 92 MET CA C 13 55.11 0.15 . 1 . . . . . . . . 5280 1 1133 . 1 1 92 92 MET CB C 13 38.60 0.15 . 1 . . . . . . . . 5280 1 1134 . 1 1 92 92 MET CG C 13 32.56 0.15 . 1 . . . . . . . . 5280 1 1135 . 1 1 92 92 MET N N 15 119.01 0.2 . 1 . . . . . . . . 5280 1 1136 . 1 1 93 93 LEU H H 1 9.05 0.01 . 1 . . . . . . . . 5280 1 1137 . 1 1 93 93 LEU HA H 1 5.14 0.01 . 1 . . . . . . . . 5280 1 1138 . 1 1 93 93 LEU HB2 H 1 1.65 0.01 . 1 . . . . . . . . 5280 1 1139 . 1 1 93 93 LEU HB3 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 1140 . 1 1 93 93 LEU HG H 1 1.85 0.01 . 1 . . . . . . . . 5280 1 1141 . 1 1 93 93 LEU HD11 H 1 1.09 0.01 . 2 . . . . . . . . 5280 1 1142 . 1 1 93 93 LEU HD12 H 1 1.09 0.01 . 2 . . . . . . . . 5280 1 1143 . 1 1 93 93 LEU HD13 H 1 1.09 0.01 . 2 . . . . . . . . 5280 1 1144 . 1 1 93 93 LEU HD21 H 1 0.89 0.01 . 2 . . . . . . . . 5280 1 1145 . 1 1 93 93 LEU HD22 H 1 0.89 0.01 . 2 . . . . . . . . 5280 1 1146 . 1 1 93 93 LEU HD23 H 1 0.89 0.01 . 2 . . . . . . . . 5280 1 1147 . 1 1 93 93 LEU C C 13 178.25 0.15 . 1 . . . . . . . . 5280 1 1148 . 1 1 93 93 LEU CA C 13 55.23 0.15 . 1 . . . . . . . . 5280 1 1149 . 1 1 93 93 LEU CB C 13 43.48 0.15 . 1 . . . . . . . . 5280 1 1150 . 1 1 93 93 LEU CG C 13 28.65 0.15 . 1 . . . . . . . . 5280 1 1151 . 1 1 93 93 LEU CD1 C 13 25.90 0.15 . 2 . . . . . . . . 5280 1 1152 . 1 1 93 93 LEU CD2 C 13 26.37 0.15 . 2 . . . . . . . . 5280 1 1153 . 1 1 93 93 LEU N N 15 121.38 0.2 . 1 . . . . . . . . 5280 1 1154 . 1 1 94 94 ASP H H 1 8.69 0.01 . 1 . . . . . . . . 5280 1 1155 . 1 1 94 94 ASP HA H 1 4.77 0.01 . 1 . . . . . . . . 5280 1 1156 . 1 1 94 94 ASP HB2 H 1 2.66 0.01 . 1 . . . . . . . . 5280 1 1157 . 1 1 94 94 ASP HB3 H 1 2.83 0.01 . 1 . . . . . . . . 5280 1 1158 . 1 1 94 94 ASP CA C 13 53.12 0.15 . 1 . . . . . . . . 5280 1 1159 . 1 1 94 94 ASP CB C 13 43.02 0.15 . 1 . . . . . . . . 5280 1 1160 . 1 1 94 94 ASP CG C 13 177.84 0.15 . 1 . . . . . . . . 5280 1 1161 . 1 1 94 94 ASP N N 15 124.59 0.2 . 1 . . . . . . . . 5280 1 1162 . 1 1 95 95 PRO HA H 1 4.57 0.01 . 1 . . . . . . . . 5280 1 1163 . 1 1 95 95 PRO HB2 H 1 2.40 0.01 . 1 . . . . . . . . 5280 1 1164 . 1 1 95 95 PRO HB3 H 1 2.11 0.01 . 1 . . . . . . . . 5280 1 1165 . 1 1 95 95 PRO HG2 H 1 2.18 0.01 . 1 . . . . . . . . 5280 1 1166 . 1 1 95 95 PRO HG3 H 1 2.11 0.01 . 1 . . . . . . . . 5280 1 1167 . 1 1 95 95 PRO HD2 H 1 4.08 0.01 . 1 . . . . . . . . 5280 1 1168 . 1 1 95 95 PRO HD3 H 1 4.00 0.01 . 1 . . . . . . . . 5280 1 1169 . 1 1 95 95 PRO CA C 13 65.40 0.15 . 1 . . . . . . . . 5280 1 1170 . 1 1 95 95 PRO CB C 13 33.15 0.15 . 1 . . . . . . . . 5280 1 1171 . 1 1 95 95 PRO CG C 13 28.18 0.15 . 1 . . . . . . . . 5280 1 1172 . 1 1 95 95 PRO CD C 13 52.32 0.15 . 1 . . . . . . . . 5280 1 1173 . 1 1 95 95 PRO N N 15 130.53 0.2 . 1 . . . . . . . . 5280 1 1174 . 1 1 96 96 SER H H 1 8.63 0.01 . 1 . . . . . . . . 5280 1 1175 . 1 1 96 96 SER HA H 1 4.49 0.01 . 1 . . . . . . . . 5280 1 1176 . 1 1 96 96 SER HB2 H 1 4.04 0.01 . 2 . . . . . . . . 5280 1 1177 . 1 1 96 96 SER HB3 H 1 4.00 0.01 . 2 . . . . . . . . 5280 1 1178 . 1 1 96 96 SER C C 13 176.06 0.15 . 1 . . . . . . . . 5280 1 1179 . 1 1 96 96 SER CA C 13 60.62 0.15 . 1 . . . . . . . . 5280 1 1180 . 1 1 96 96 SER CB C 13 64.52 0.15 . 1 . . . . . . . . 5280 1 1181 . 1 1 96 96 SER N N 15 115.72 0.2 . 1 . . . . . . . . 5280 1 1182 . 1 1 97 97 SER H H 1 8.04 0.01 . 1 . . . . . . . . 5280 1 1183 . 1 1 97 97 SER HA H 1 4.51 0.01 . 1 . . . . . . . . 5280 1 1184 . 1 1 97 97 SER HB2 H 1 4.02 0.01 . 2 . . . . . . . . 5280 1 1185 . 1 1 97 97 SER HB3 H 1 3.97 0.01 . 2 . . . . . . . . 5280 1 1186 . 1 1 97 97 SER C C 13 176.06 0.15 . 1 . . . . . . . . 5280 1 1187 . 1 1 97 97 SER CA C 13 59.91 0.15 . 1 . . . . . . . . 5280 1 1188 . 1 1 97 97 SER CB C 13 65.07 0.15 . 1 . . . . . . . . 5280 1 1189 . 1 1 97 97 SER N N 15 117.76 0.2 . 1 . . . . . . . . 5280 1 1190 . 1 1 98 98 ASP H H 1 8.10 0.01 . 1 . . . . . . . . 5280 1 1191 . 1 1 98 98 ASP HA H 1 4.71 0.01 . 1 . . . . . . . . 5280 1 1192 . 1 1 98 98 ASP HB2 H 1 2.72 0.01 . 2 . . . . . . . . 5280 1 1193 . 1 1 98 98 ASP HB3 H 1 2.84 0.01 . 2 . . . . . . . . 5280 1 1194 . 1 1 98 98 ASP CA C 13 55.77 0.15 . 1 . . . . . . . . 5280 1 1195 . 1 1 98 98 ASP CB C 13 42.20 0.15 . 1 . . . . . . . . 5280 1 1196 . 1 1 98 98 ASP N N 15 123.15 0.2 . 1 . . . . . . . . 5280 1 1197 . 1 1 99 99 ASP H H 1 8.24 0.01 . 1 . . . . . . . . 5280 1 1198 . 1 1 99 99 ASP HA H 1 4.72 0.01 . 1 . . . . . . . . 5280 1 1199 . 1 1 99 99 ASP HB2 H 1 2.74 0.01 . 2 . . . . . . . . 5280 1 1200 . 1 1 99 99 ASP HB3 H 1 2.71 0.01 . 2 . . . . . . . . 5280 1 1201 . 1 1 99 99 ASP C C 13 177.30 0.15 . 1 . . . . . . . . 5280 1 1202 . 1 1 99 99 ASP CA C 13 55.69 0.15 . 1 . . . . . . . . 5280 1 1203 . 1 1 99 99 ASP CB C 13 42.00 0.15 . 1 . . . . . . . . 5280 1 1204 . 1 1 99 99 ASP N N 15 120.99 0.2 . 1 . . . . . . . . 5280 1 1205 . 1 1 100 100 VAL H H 1 7.87 0.01 . 1 . . . . . . . . 5280 1 1206 . 1 1 100 100 VAL HA H 1 4.11 0.01 . 1 . . . . . . . . 5280 1 1207 . 1 1 100 100 VAL HB H 1 2.11 0.01 . 1 . . . . . . . . 5280 1 1208 . 1 1 100 100 VAL HG11 H 1 0.88 0.01 . 1 . . . . . . . . 5280 1 1209 . 1 1 100 100 VAL HG12 H 1 0.88 0.01 . 1 . . . . . . . . 5280 1 1210 . 1 1 100 100 VAL HG13 H 1 0.88 0.01 . 1 . . . . . . . . 5280 1 1211 . 1 1 100 100 VAL HG21 H 1 0.91 0.01 . 1 . . . . . . . . 5280 1 1212 . 1 1 100 100 VAL HG22 H 1 0.91 0.01 . 1 . . . . . . . . 5280 1 1213 . 1 1 100 100 VAL HG23 H 1 0.91 0.01 . 1 . . . . . . . . 5280 1 1214 . 1 1 100 100 VAL C C 13 176.89 0.15 . 1 . . . . . . . . 5280 1 1215 . 1 1 100 100 VAL CA C 13 63.75 0.15 . 1 . . . . . . . . 5280 1 1216 . 1 1 100 100 VAL CB C 13 33.44 0.15 . 1 . . . . . . . . 5280 1 1217 . 1 1 100 100 VAL CG1 C 13 22.17 0.15 . 1 . . . . . . . . 5280 1 1218 . 1 1 100 100 VAL CG2 C 13 21.65 0.15 . 1 . . . . . . . . 5280 1 1219 . 1 1 100 100 VAL N N 15 119.76 0.2 . 1 . . . . . . . . 5280 1 1220 . 1 1 101 101 PHE H H 1 8.27 0.01 . 1 . . . . . . . . 5280 1 1221 . 1 1 101 101 PHE HA H 1 4.77 0.01 . 1 . . . . . . . . 5280 1 1222 . 1 1 101 101 PHE HB2 H 1 3.16 0.01 . 2 . . . . . . . . 5280 1 1223 . 1 1 101 101 PHE HB3 H 1 3.22 0.01 . 2 . . . . . . . . 5280 1 1224 . 1 1 101 101 PHE HD1 H 1 7.34 0.01 . 1 . . . . . . . . 5280 1 1225 . 1 1 101 101 PHE HD2 H 1 7.34 0.01 . 1 . . . . . . . . 5280 1 1226 . 1 1 101 101 PHE HE1 H 1 6.85 0.01 . 1 . . . . . . . . 5280 1 1227 . 1 1 101 101 PHE HE2 H 1 6.85 0.01 . 1 . . . . . . . . 5280 1 1228 . 1 1 101 101 PHE CA C 13 58.92 0.15 . 1 . . . . . . . . 5280 1 1229 . 1 1 101 101 PHE CB C 13 40.53 0.15 . 1 . . . . . . . . 5280 1 1230 . 1 1 101 101 PHE CD1 C 13 131.40 0.15 . 1 . . . . . . . . 5280 1 1231 . 1 1 101 101 PHE CD2 C 13 131.40 0.15 . 1 . . . . . . . . 5280 1 1232 . 1 1 101 101 PHE CE1 C 13 130.50 0.15 . 1 . . . . . . . . 5280 1 1233 . 1 1 101 101 PHE CE2 C 13 130.50 0.15 . 1 . . . . . . . . 5280 1 1234 . 1 1 101 101 PHE N N 15 123.73 0.2 . 1 . . . . . . . . 5280 1 1235 . 1 1 102 102 ILE H H 1 8.06 0.01 . 1 . . . . . . . . 5280 1 1236 . 1 1 102 102 ILE HA H 1 4.24 0.01 . 1 . . . . . . . . 5280 1 1237 . 1 1 102 102 ILE HB H 1 1.96 0.01 . 1 . . . . . . . . 5280 1 1238 . 1 1 102 102 ILE HG12 H 1 1.53 0.01 . 2 . . . . . . . . 5280 1 1239 . 1 1 102 102 ILE HG13 H 1 1.25 0.01 . 2 . . . . . . . . 5280 1 1240 . 1 1 102 102 ILE HG21 H 1 0.99 0.01 . 1 . . . . . . . . 5280 1 1241 . 1 1 102 102 ILE HG22 H 1 0.99 0.01 . 1 . . . . . . . . 5280 1 1242 . 1 1 102 102 ILE HG23 H 1 0.99 0.01 . 1 . . . . . . . . 5280 1 1243 . 1 1 102 102 ILE HD11 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 1244 . 1 1 102 102 ILE HD12 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 1245 . 1 1 102 102 ILE HD13 H 1 0.95 0.01 . 1 . . . . . . . . 5280 1 1246 . 1 1 102 102 ILE C C 13 177.39 0.15 . 1 . . . . . . . . 5280 1 1247 . 1 1 102 102 ILE CA C 13 62.36 0.15 . 1 . . . . . . . . 5280 1 1248 . 1 1 102 102 ILE CB C 13 39.73 0.15 . 1 . . . . . . . . 5280 1 1249 . 1 1 102 102 ILE CG1 C 13 28.43 0.15 . 1 . . . . . . . . 5280 1 1250 . 1 1 102 102 ILE CG2 C 13 18.55 0.15 . 1 . . . . . . . . 5280 1 1251 . 1 1 102 102 ILE CD1 C 13 13.99 0.15 . 1 . . . . . . . . 5280 1 1252 . 1 1 102 102 ILE N N 15 123.02 0.2 . 1 . . . . . . . . 5280 1 1253 . 1 1 103 103 GLY H H 1 8.15 0.01 . 1 . . . . . . . . 5280 1 1254 . 1 1 103 103 GLY HA2 H 1 4.02 0.01 . 2 . . . . . . . . 5280 1 1255 . 1 1 103 103 GLY HA3 H 1 4.06 0.01 . 2 . . . . . . . . 5280 1 1256 . 1 1 103 103 GLY C C 13 175.60 0.15 . 1 . . . . . . . . 5280 1 1257 . 1 1 103 103 GLY CA C 13 46.50 0.15 . 1 . . . . . . . . 5280 1 1258 . 1 1 103 103 GLY N N 15 112.44 0.2 . 1 . . . . . . . . 5280 1 1259 . 1 1 104 104 GLY H H 1 8.30 0.01 . 1 . . . . . . . . 5280 1 1260 . 1 1 104 104 GLY HA2 H 1 4.16 0.01 . 1 . . . . . . . . 5280 1 1261 . 1 1 104 104 GLY HA3 H 1 4.16 0.01 . 1 . . . . . . . . 5280 1 1262 . 1 1 104 104 GLY C C 13 175.64 0.15 . 1 . . . . . . . . 5280 1 1263 . 1 1 104 104 GLY CA C 13 46.49 0.15 . 1 . . . . . . . . 5280 1 1264 . 1 1 104 104 GLY N N 15 109.49 0.2 . 1 . . . . . . . . 5280 1 1265 . 1 1 105 105 THR H H 1 8.24 0.01 . 1 . . . . . . . . 5280 1 1266 . 1 1 105 105 THR HA H 1 4.52 0.01 . 1 . . . . . . . . 5280 1 1267 . 1 1 105 105 THR HB H 1 4.40 0.01 . 1 . . . . . . . . 5280 1 1268 . 1 1 105 105 THR HG21 H 1 1.31 0.01 . 1 . . . . . . . . 5280 1 1269 . 1 1 105 105 THR HG22 H 1 1.31 0.01 . 1 . . . . . . . . 5280 1 1270 . 1 1 105 105 THR HG23 H 1 1.31 0.01 . 1 . . . . . . . . 5280 1 1271 . 1 1 105 105 THR C C 13 176.13 0.15 . 1 . . . . . . . . 5280 1 1272 . 1 1 105 105 THR CA C 13 63.16 0.15 . 1 . . . . . . . . 5280 1 1273 . 1 1 105 105 THR CB C 13 70.70 0.15 . 1 . . . . . . . . 5280 1 1274 . 1 1 105 105 THR CG2 C 13 22.64 0.15 . 1 . . . . . . . . 5280 1 1275 . 1 1 105 105 THR N N 15 114.00 0.2 . 1 . . . . . . . . 5280 1 1276 . 1 1 106 106 THR H H 1 8.21 0.01 . 1 . . . . . . . . 5280 1 1277 . 1 1 106 106 THR HA H 1 4.53 0.01 . 1 . . . . . . . . 5280 1 1278 . 1 1 106 106 THR HB H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 1279 . 1 1 106 106 THR HG21 H 1 1.30 0.01 . 1 . . . . . . . . 5280 1 1280 . 1 1 106 106 THR HG22 H 1 1.30 0.01 . 1 . . . . . . . . 5280 1 1281 . 1 1 106 106 THR HG23 H 1 1.30 0.01 . 1 . . . . . . . . 5280 1 1282 . 1 1 106 106 THR C C 13 176.23 0.15 . 1 . . . . . . . . 5280 1 1283 . 1 1 106 106 THR CA C 13 63.29 0.15 . 1 . . . . . . . . 5280 1 1284 . 1 1 106 106 THR CB C 13 70.80 0.15 . 1 . . . . . . . . 5280 1 1285 . 1 1 106 106 THR CG2 C 13 22.61 0.15 . 1 . . . . . . . . 5280 1 1286 . 1 1 106 106 THR N N 15 115.85 0.2 . 1 . . . . . . . . 5280 1 1287 . 1 1 107 107 GLY H H 1 8.40 0.01 . 1 . . . . . . . . 5280 1 1288 . 1 1 107 107 GLY HA2 H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 1289 . 1 1 107 107 GLY HA3 H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 1290 . 1 1 107 107 GLY C C 13 175.20 0.15 . 1 . . . . . . . . 5280 1 1291 . 1 1 107 107 GLY CA C 13 46.67 0.15 . 1 . . . . . . . . 5280 1 1292 . 1 1 107 107 GLY N N 15 111.84 0.2 . 1 . . . . . . . . 5280 1 1293 . 1 1 108 108 LYS H H 1 8.17 0.01 . 1 . . . . . . . . 5280 1 1294 . 1 1 108 108 LYS HA H 1 4.39 0.01 . 1 . . . . . . . . 5280 1 1295 . 1 1 108 108 LYS HB2 H 1 1.84 0.01 . 2 . . . . . . . . 5280 1 1296 . 1 1 108 108 LYS HB3 H 1 1.93 0.01 . 2 . . . . . . . . 5280 1 1297 . 1 1 108 108 LYS HG2 H 1 1.53 0.01 . 2 . . . . . . . . 5280 1 1298 . 1 1 108 108 LYS HG3 H 1 1.49 0.01 . 2 . . . . . . . . 5280 1 1299 . 1 1 108 108 LYS HD2 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1300 . 1 1 108 108 LYS HD3 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1301 . 1 1 108 108 LYS HE2 H 1 3.01 0.01 . 1 . . . . . . . . 5280 1 1302 . 1 1 108 108 LYS HE3 H 1 3.01 0.01 . 1 . . . . . . . . 5280 1 1303 . 1 1 108 108 LYS C C 13 177.56 0.15 . 1 . . . . . . . . 5280 1 1304 . 1 1 108 108 LYS CA C 13 57.60 0.15 . 1 . . . . . . . . 5280 1 1305 . 1 1 108 108 LYS CB C 13 34.00 0.15 . 1 . . . . . . . . 5280 1 1306 . 1 1 108 108 LYS CG C 13 26.01 0.15 . 1 . . . . . . . . 5280 1 1307 . 1 1 108 108 LYS CD C 13 30.16 0.15 . 1 . . . . . . . . 5280 1 1308 . 1 1 108 108 LYS CE C 13 43.26 0.15 . 1 . . . . . . . . 5280 1 1309 . 1 1 108 108 LYS N N 15 121.38 0.2 . 1 . . . . . . . . 5280 1 1310 . 1 1 109 109 LEU H H 1 8.19 0.01 . 1 . . . . . . . . 5280 1 1311 . 1 1 109 109 LEU HA H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 1312 . 1 1 109 109 LEU HB2 H 1 1.72 0.01 . 2 . . . . . . . . 5280 1 1313 . 1 1 109 109 LEU HG H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1314 . 1 1 109 109 LEU HD11 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 1315 . 1 1 109 109 LEU HD12 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 1316 . 1 1 109 109 LEU HD13 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 1317 . 1 1 109 109 LEU HD21 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 1318 . 1 1 109 109 LEU HD22 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 1319 . 1 1 109 109 LEU HD23 H 1 0.97 0.01 . 1 . . . . . . . . 5280 1 1320 . 1 1 109 109 LEU C C 13 178.18 0.15 . 1 . . . . . . . . 5280 1 1321 . 1 1 109 109 LEU CA C 13 56.32 0.15 . 1 . . . . . . . . 5280 1 1322 . 1 1 109 109 LEU CB C 13 43.35 0.15 . 1 . . . . . . . . 5280 1 1323 . 1 1 109 109 LEU CG C 13 28.19 0.15 . 1 . . . . . . . . 5280 1 1324 . 1 1 109 109 LEU CD1 C 13 24.73 0.15 . 2 . . . . . . . . 5280 1 1325 . 1 1 109 109 LEU CD2 C 13 25.92 0.15 . 2 . . . . . . . . 5280 1 1326 . 1 1 109 109 LEU N N 15 123.06 0.2 . 1 . . . . . . . . 5280 1 1327 . 1 1 110 110 ARG H H 1 8.31 0.01 . 1 . . . . . . . . 5280 1 1328 . 1 1 110 110 ARG HA H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 1329 . 1 1 110 110 ARG HB2 H 1 1.92 0.01 . 2 . . . . . . . . 5280 1 1330 . 1 1 110 110 ARG HB3 H 1 1.87 0.01 . 2 . . . . . . . . 5280 1 1331 . 1 1 110 110 ARG HG2 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 1332 . 1 1 110 110 ARG HG3 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 1333 . 1 1 110 110 ARG HD2 H 1 3.31 0.01 . 1 . . . . . . . . 5280 1 1334 . 1 1 110 110 ARG HD3 H 1 3.31 0.01 . 1 . . . . . . . . 5280 1 1335 . 1 1 110 110 ARG C C 13 177.02 0.15 . 1 . . . . . . . . 5280 1 1336 . 1 1 110 110 ARG CA C 13 57.04 0.15 . 1 . . . . . . . . 5280 1 1337 . 1 1 110 110 ARG CB C 13 31.73 0.15 . 1 . . . . . . . . 5280 1 1338 . 1 1 110 110 ARG CG C 13 28.22 0.15 . 1 . . . . . . . . 5280 1 1339 . 1 1 110 110 ARG CD C 13 44.51 0.15 . 1 . . . . . . . . 5280 1 1340 . 1 1 110 110 ARG N N 15 122.88 0.2 . 1 . . . . . . . . 5280 1 1341 . 1 1 111 111 ARG H H 1 8.34 0.01 . 1 . . . . . . . . 5280 1 1342 . 1 1 111 111 ARG HA H 1 4.43 0.01 . 1 . . . . . . . . 5280 1 1343 . 1 1 111 111 ARG HB2 H 1 1.96 0.01 . 1 . . . . . . . . 5280 1 1344 . 1 1 111 111 ARG HB3 H 1 1.85 0.01 . 1 . . . . . . . . 5280 1 1345 . 1 1 111 111 ARG HG2 H 1 1.74 0.01 . 2 . . . . . . . . 5280 1 1346 . 1 1 111 111 ARG HD2 H 1 3.36 0.01 . 2 . . . . . . . . 5280 1 1347 . 1 1 111 111 ARG C C 13 177.16 0.15 . 1 . . . . . . . . 5280 1 1348 . 1 1 111 111 ARG CA C 13 57.12 0.15 . 1 . . . . . . . . 5280 1 1349 . 1 1 111 111 ARG CB C 13 31.86 0.15 . 1 . . . . . . . . 5280 1 1350 . 1 1 111 111 ARG CG C 13 28.28 0.15 . 1 . . . . . . . . 5280 1 1351 . 1 1 111 111 ARG CD C 13 43.10 0.15 . 1 . . . . . . . . 5280 1 1352 . 1 1 111 111 ARG N N 15 123.15 0.2 . 1 . . . . . . . . 5280 1 1353 . 1 1 112 112 ARG H H 1 8.47 0.01 . 1 . . . . . . . . 5280 1 1354 . 1 1 112 112 ARG HA H 1 4.45 0.01 . 1 . . . . . . . . 5280 1 1355 . 1 1 112 112 ARG HB2 H 1 1.96 0.01 . 1 . . . . . . . . 5280 1 1356 . 1 1 112 112 ARG HB3 H 1 1.91 0.01 . 1 . . . . . . . . 5280 1 1357 . 1 1 112 112 ARG HG2 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 1358 . 1 1 112 112 ARG HG3 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 1359 . 1 1 112 112 ARG HD2 H 1 3.31 0.01 . 1 . . . . . . . . 5280 1 1360 . 1 1 112 112 ARG HD3 H 1 3.31 0.01 . 1 . . . . . . . . 5280 1 1361 . 1 1 112 112 ARG CA C 13 57.22 0.15 . 1 . . . . . . . . 5280 1 1362 . 1 1 112 112 ARG CB C 13 31.97 0.15 . 1 . . . . . . . . 5280 1 1363 . 1 1 112 112 ARG CG C 13 28.23 0.15 . 1 . . . . . . . . 5280 1 1364 . 1 1 112 112 ARG CD C 13 44.51 0.15 . 1 . . . . . . . . 5280 1 1365 . 1 1 112 112 ARG N N 15 123.54 0.2 . 1 . . . . . . . . 5280 1 1366 . 1 1 113 113 SER H H 1 8.33 0.01 . 1 . . . . . . . . 5280 1 1367 . 1 1 113 113 SER HA H 1 4.66 0.01 . 1 . . . . . . . . 5280 1 1368 . 1 1 113 113 SER HB2 H 1 4.00 0.01 . 1 . . . . . . . . 5280 1 1369 . 1 1 113 113 SER HB3 H 1 4.00 0.01 . 1 . . . . . . . . 5280 1 1370 . 1 1 113 113 SER HG H 1 5.19 0.01 . 1 . . . . . . . . 5280 1 1371 . 1 1 113 113 SER C C 13 175.81 0.15 . 1 . . . . . . . . 5280 1 1372 . 1 1 113 113 SER CA C 13 59.27 0.15 . 1 . . . . . . . . 5280 1 1373 . 1 1 113 113 SER CB C 13 64.92 0.15 . 1 . . . . . . . . 5280 1 1374 . 1 1 113 113 SER N N 15 118.14 0.2 . 1 . . . . . . . . 5280 1 1375 . 1 1 114 114 THR H H 1 8.22 0.01 . 1 . . . . . . . . 5280 1 1376 . 1 1 114 114 THR HA H 1 4.53 0.01 . 1 . . . . . . . . 5280 1 1377 . 1 1 114 114 THR HB H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 1378 . 1 1 114 114 THR HG21 H 1 1.33 0.01 . 1 . . . . . . . . 5280 1 1379 . 1 1 114 114 THR HG22 H 1 1.33 0.01 . 1 . . . . . . . . 5280 1 1380 . 1 1 114 114 THR HG23 H 1 1.33 0.01 . 1 . . . . . . . . 5280 1 1381 . 1 1 114 114 THR C C 13 175.83 0.15 . 1 . . . . . . . . 5280 1 1382 . 1 1 114 114 THR CA C 13 62.94 0.15 . 1 . . . . . . . . 5280 1 1383 . 1 1 114 114 THR CB C 13 70.99 0.15 . 1 . . . . . . . . 5280 1 1384 . 1 1 114 114 THR CG2 C 13 22.60 0.15 . 1 . . . . . . . . 5280 1 1385 . 1 1 114 114 THR N N 15 116.70 0.2 . 1 . . . . . . . . 5280 1 1386 . 1 1 115 115 THR H H 1 8.22 0.01 . 1 . . . . . . . . 5280 1 1387 . 1 1 115 115 THR HA H 1 4.49 0.01 . 1 . . . . . . . . 5280 1 1388 . 1 1 115 115 THR HB H 1 4.35 0.01 . 1 . . . . . . . . 5280 1 1389 . 1 1 115 115 THR HG21 H 1 1.31 0.01 . 1 . . . . . . . . 5280 1 1390 . 1 1 115 115 THR HG22 H 1 1.31 0.01 . 1 . . . . . . . . 5280 1 1391 . 1 1 115 115 THR HG23 H 1 1.31 0.01 . 1 . . . . . . . . 5280 1 1392 . 1 1 115 115 THR C C 13 175.60 0.15 . 1 . . . . . . . . 5280 1 1393 . 1 1 115 115 THR CA C 13 62.99 0.15 . 1 . . . . . . . . 5280 1 1394 . 1 1 115 115 THR CB C 13 70.98 0.15 . 1 . . . . . . . . 5280 1 1395 . 1 1 115 115 THR CG2 C 13 22.65 0.15 . 1 . . . . . . . . 5280 1 1396 . 1 1 115 115 THR N N 15 116.88 0.2 . 1 . . . . . . . . 5280 1 1397 . 1 1 116 116 SER H H 1 8.36 0.01 . 1 . . . . . . . . 5280 1 1398 . 1 1 116 116 SER HA H 1 4.57 0.01 . 1 . . . . . . . . 5280 1 1399 . 1 1 116 116 SER HB2 H 1 4.02 0.01 . 2 . . . . . . . . 5280 1 1400 . 1 1 116 116 SER HB3 H 1 3.97 0.01 . 2 . . . . . . . . 5280 1 1401 . 1 1 116 116 SER C C 13 177.49 0.15 . 1 . . . . . . . . 5280 1 1402 . 1 1 116 116 SER CA C 13 59.59 0.15 . 1 . . . . . . . . 5280 1 1403 . 1 1 116 116 SER CB C 13 64.80 0.15 . 1 . . . . . . . . 5280 1 1404 . 1 1 116 116 SER N N 15 119.22 0.2 . 1 . . . . . . . . 5280 1 1405 . 1 1 117 117 ARG H H 1 8.47 0.01 . 1 . . . . . . . . 5280 1 1406 . 1 1 117 117 ARG HA H 1 4.45 0.01 . 1 . . . . . . . . 5280 1 1407 . 1 1 117 117 ARG HB2 H 1 1.95 0.01 . 1 . . . . . . . . 5280 1 1408 . 1 1 117 117 ARG HB3 H 1 1.86 0.01 . 1 . . . . . . . . 5280 1 1409 . 1 1 117 117 ARG HG2 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 1410 . 1 1 117 117 ARG HG3 H 1 1.74 0.01 . 1 . . . . . . . . 5280 1 1411 . 1 1 117 117 ARG HD2 H 1 3.31 0.01 . 2 . . . . . . . . 5280 1 1412 . 1 1 117 117 ARG CA C 13 57.39 0.15 . 1 . . . . . . . . 5280 1 1413 . 1 1 117 117 ARG CB C 13 31.66 0.15 . 1 . . . . . . . . 5280 1 1414 . 1 1 117 117 ARG CG C 13 28.23 0.15 . 1 . . . . . . . . 5280 1 1415 . 1 1 117 117 ARG CD C 13 44.55 0.15 . 1 . . . . . . . . 5280 1 1416 . 1 1 117 117 ARG N N 15 124.07 0.2 . 1 . . . . . . . . 5280 1 1417 . 1 1 118 118 ALA H H 1 8.25 0.01 . 1 . . . . . . . . 5280 1 1418 . 1 1 118 118 ALA HA H 1 4.38 0.01 . 1 . . . . . . . . 5280 1 1419 . 1 1 118 118 ALA HB1 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1420 . 1 1 118 118 ALA HB2 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1421 . 1 1 118 118 ALA HB3 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1422 . 1 1 118 118 ALA C C 13 177.00 0.15 . 1 . . . . . . . . 5280 1 1423 . 1 1 118 118 ALA CA C 13 53.82 0.15 . 1 . . . . . . . . 5280 1 1424 . 1 1 118 118 ALA CB C 13 20.19 0.15 . 1 . . . . . . . . 5280 1 1425 . 1 1 118 118 ALA N N 15 125.45 0.2 . 1 . . . . . . . . 5280 1 1426 . 1 1 119 119 LYS H H 1 8.18 0.01 . 1 . . . . . . . . 5280 1 1427 . 1 1 119 119 LYS HA H 1 4.39 0.01 . 1 . . . . . . . . 5280 1 1428 . 1 1 119 119 LYS HB2 H 1 1.91 0.01 . 2 . . . . . . . . 5280 1 1429 . 1 1 119 119 LYS HB3 H 1 1.86 0.01 . 2 . . . . . . . . 5280 1 1430 . 1 1 119 119 LYS HG2 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1431 . 1 1 119 119 LYS HG3 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1432 . 1 1 119 119 LYS HD2 H 1 1.54 0.01 . 1 . . . . . . . . 5280 1 1433 . 1 1 119 119 LYS HD3 H 1 1.54 0.01 . 1 . . . . . . . . 5280 1 1434 . 1 1 119 119 LYS HE2 H 1 2.85 0.01 . 1 . . . . . . . . 5280 1 1435 . 1 1 119 119 LYS HE3 H 1 2.85 0.01 . 1 . . . . . . . . 5280 1 1436 . 1 1 119 119 LYS C C 13 177.58 0.15 . 1 . . . . . . . . 5280 1 1437 . 1 1 119 119 LYS CA C 13 57.52 0.15 . 1 . . . . . . . . 5280 1 1438 . 1 1 119 119 LYS CB C 13 33.77 0.15 . 1 . . . . . . . . 5280 1 1439 . 1 1 119 119 LYS CG C 13 26.04 0.15 . 1 . . . . . . . . 5280 1 1440 . 1 1 119 119 LYS CD C 13 30.18 0.15 . 1 . . . . . . . . 5280 1 1441 . 1 1 119 119 LYS CE C 13 43.32 0.15 . 1 . . . . . . . . 5280 1 1442 . 1 1 119 119 LYS N N 15 121.02 0.2 . 1 . . . . . . . . 5280 1 1443 . 1 1 120 120 LEU H H 1 8.13 0.01 . 1 . . . . . . . . 5280 1 1444 . 1 1 120 120 LEU HA H 1 4.44 0.01 . 1 . . . . . . . . 5280 1 1445 . 1 1 120 120 LEU HB2 H 1 1.72 0.01 . 2 . . . . . . . . 5280 1 1446 . 1 1 120 120 LEU HB3 H 1 1.63 0.01 . 2 . . . . . . . . 5280 1 1447 . 1 1 120 120 LEU HG H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1448 . 1 1 120 120 LEU HD11 H 1 1.02 0.01 . 2 . . . . . . . . 5280 1 1449 . 1 1 120 120 LEU HD12 H 1 1.02 0.01 . 2 . . . . . . . . 5280 1 1450 . 1 1 120 120 LEU HD13 H 1 1.02 0.01 . 2 . . . . . . . . 5280 1 1451 . 1 1 120 120 LEU HD21 H 1 0.97 0.01 . 2 . . . . . . . . 5280 1 1452 . 1 1 120 120 LEU HD22 H 1 0.97 0.01 . 2 . . . . . . . . 5280 1 1453 . 1 1 120 120 LEU HD23 H 1 0.97 0.01 . 2 . . . . . . . . 5280 1 1454 . 1 1 120 120 LEU C C 13 177.86 0.15 . 1 . . . . . . . . 5280 1 1455 . 1 1 120 120 LEU CA C 13 56.15 0.15 . 1 . . . . . . . . 5280 1 1456 . 1 1 120 120 LEU CB C 13 43.43 0.15 . 1 . . . . . . . . 5280 1 1457 . 1 1 120 120 LEU CG C 13 26.01 0.15 . 1 . . . . . . . . 5280 1 1458 . 1 1 120 120 LEU CD1 C 13 26.00 0.15 . 2 . . . . . . . . 5280 1 1459 . 1 1 120 120 LEU CD2 C 13 24.59 0.15 . 2 . . . . . . . . 5280 1 1460 . 1 1 120 120 LEU N N 15 123.69 0.2 . 1 . . . . . . . . 5280 1 1461 . 1 1 121 121 ALA H H 1 8.17 0.01 . 1 . . . . . . . . 5280 1 1462 . 1 1 121 121 ALA HA H 1 4.43 0.01 . 1 . . . . . . . . 5280 1 1463 . 1 1 121 121 ALA HB1 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1464 . 1 1 121 121 ALA HB2 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1465 . 1 1 121 121 ALA HB3 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1466 . 1 1 121 121 ALA CA C 13 53.43 0.15 . 1 . . . . . . . . 5280 1 1467 . 1 1 121 121 ALA CB C 13 20.28 0.15 . 1 . . . . . . . . 5280 1 1468 . 1 1 121 121 ALA N N 15 125.18 0.2 . 1 . . . . . . . . 5280 1 1469 . 1 1 122 122 PHE H H 1 7.69 0.01 . 1 . . . . . . . . 5280 1 1470 . 1 1 122 122 PHE HA H 1 4.76 0.01 . 1 . . . . . . . . 5280 1 1471 . 1 1 122 122 PHE HB2 H 1 3.16 0.01 . 2 . . . . . . . . 5280 1 1472 . 1 1 122 122 PHE HB3 H 1 3.25 0.01 . 2 . . . . . . . . 5280 1 1473 . 1 1 122 122 PHE HD1 H 1 6.80 0.01 . 1 . . . . . . . . 5280 1 1474 . 1 1 122 122 PHE HD2 H 1 6.80 0.01 . 1 . . . . . . . . 5280 1 1475 . 1 1 122 122 PHE HE1 H 1 6.85 0.01 . 1 . . . . . . . . 5280 1 1476 . 1 1 122 122 PHE HE2 H 1 6.85 0.01 . 1 . . . . . . . . 5280 1 1477 . 1 1 122 122 PHE C C 13 176.48 0.15 . 1 . . . . . . . . 5280 1 1478 . 1 1 122 122 PHE CA C 13 58.57 0.15 . 1 . . . . . . . . 5280 1 1479 . 1 1 122 122 PHE CB C 13 40.68 0.15 . 1 . . . . . . . . 5280 1 1480 . 1 1 122 122 PHE CD1 C 13 131.35 0.15 . 1 . . . . . . . . 5280 1 1481 . 1 1 122 122 PHE CD2 C 13 131.35 0.15 . 1 . . . . . . . . 5280 1 1482 . 1 1 122 122 PHE CE1 C 13 130.50 0.15 . 1 . . . . . . . . 5280 1 1483 . 1 1 122 122 PHE CE2 C 13 130.50 0.15 . 1 . . . . . . . . 5280 1 1484 . 1 1 122 122 PHE N N 15 120.04 0.2 . 1 . . . . . . . . 5280 1 1485 . 1 1 123 123 LYS H H 1 8.21 0.01 . 1 . . . . . . . . 5280 1 1486 . 1 1 123 123 LYS HA H 1 4.45 0.01 . 1 . . . . . . . . 5280 1 1487 . 1 1 123 123 LYS HB2 H 1 1.86 0.01 . 2 . . . . . . . . 5280 1 1488 . 1 1 123 123 LYS HB3 H 1 1.81 0.01 . 2 . . . . . . . . 5280 1 1489 . 1 1 123 123 LYS HG2 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1490 . 1 1 123 123 LYS HG3 H 1 1.49 0.01 . 1 . . . . . . . . 5280 1 1491 . 1 1 123 123 LYS HD2 H 1 1.80 0.01 . 1 . . . . . . . . 5280 1 1492 . 1 1 123 123 LYS HD3 H 1 1.80 0.01 . 1 . . . . . . . . 5280 1 1493 . 1 1 123 123 LYS HE2 H 1 3.17 0.01 . 1 . . . . . . . . 5280 1 1494 . 1 1 123 123 LYS HE3 H 1 3.17 0.01 . 1 . . . . . . . . 5280 1 1495 . 1 1 123 123 LYS C C 13 177.30 0.15 . 1 . . . . . . . . 5280 1 1496 . 1 1 123 123 LYS CA C 13 57.13 0.15 . 1 . . . . . . . . 5280 1 1497 . 1 1 123 123 LYS CB C 13 34.29 0.15 . 1 . . . . . . . . 5280 1 1498 . 1 1 123 123 LYS CG C 13 25.80 0.15 . 1 . . . . . . . . 5280 1 1499 . 1 1 123 123 LYS CD C 13 30.15 0.15 . 1 . . . . . . . . 5280 1 1500 . 1 1 123 123 LYS CE C 13 43.22 0.15 . 1 . . . . . . . . 5280 1 1501 . 1 1 123 123 LYS N N 15 124.11 0.2 . 1 . . . . . . . . 5280 1 1502 . 1 1 124 124 ARG H H 1 8.37 0.01 . 1 . . . . . . . . 5280 1 1503 . 1 1 124 124 ARG HA H 1 4.39 0.01 . 1 . . . . . . . . 5280 1 1504 . 1 1 124 124 ARG HB2 H 1 1.91 0.01 . 1 . . . . . . . . 5280 1 1505 . 1 1 124 124 ARG HB3 H 1 1.96 0.01 . 1 . . . . . . . . 5280 1 1506 . 1 1 124 124 ARG HG2 H 1 1.77 0.01 . 1 . . . . . . . . 5280 1 1507 . 1 1 124 124 ARG HG3 H 1 1.77 0.01 . 1 . . . . . . . . 5280 1 1508 . 1 1 124 124 ARG HD2 H 1 3.33 0.01 . 1 . . . . . . . . 5280 1 1509 . 1 1 124 124 ARG HD3 H 1 3.33 0.01 . 1 . . . . . . . . 5280 1 1510 . 1 1 124 124 ARG C C 13 177.66 0.15 . 1 . . . . . . . . 5280 1 1511 . 1 1 124 124 ARG CA C 13 57.45 0.15 . 1 . . . . . . . . 5280 1 1512 . 1 1 124 124 ARG CB C 13 31.69 0.15 . 1 . . . . . . . . 5280 1 1513 . 1 1 124 124 ARG CG C 13 28.24 0.15 . 1 . . . . . . . . 5280 1 1514 . 1 1 124 124 ARG CD C 13 44.56 0.15 . 1 . . . . . . . . 5280 1 1515 . 1 1 124 124 ARG N N 15 123.72 0.2 . 1 . . . . . . . . 5280 1 1516 . 1 1 125 125 GLY H H 1 8.48 0.01 . 1 . . . . . . . . 5280 1 1517 . 1 1 125 125 GLY HA2 H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 1518 . 1 1 125 125 GLY HA3 H 1 4.06 0.01 . 1 . . . . . . . . 5280 1 1519 . 1 1 125 125 GLY C C 13 174.52 0.15 . 1 . . . . . . . . 5280 1 1520 . 1 1 125 125 GLY CA C 13 46.24 0.15 . 1 . . . . . . . . 5280 1 1521 . 1 1 125 125 GLY N N 15 111.48 0.2 . 1 . . . . . . . . 5280 1 1522 . 1 1 126 126 ALA H H 1 8.19 0.01 . 1 . . . . . . . . 5280 1 1523 . 1 1 126 126 ALA HA H 1 4.38 0.01 . 1 . . . . . . . . 5280 1 1524 . 1 1 126 126 ALA HB1 H 1 1.51 0.01 . 1 . . . . . . . . 5280 1 1525 . 1 1 126 126 ALA HB2 H 1 1.51 0.01 . 1 . . . . . . . . 5280 1 1526 . 1 1 126 126 ALA HB3 H 1 1.51 0.01 . 1 . . . . . . . . 5280 1 1527 . 1 1 126 126 ALA C C 13 177.77 0.15 . 1 . . . . . . . . 5280 1 1528 . 1 1 126 126 ALA CA C 13 53.60 0.15 . 1 . . . . . . . . 5280 1 1529 . 1 1 126 126 ALA CB C 13 20.51 0.15 . 1 . . . . . . . . 5280 1 1530 . 1 1 126 126 ALA N N 15 124.98 0.2 . 1 . . . . . . . . 5280 1 1531 . 1 1 127 127 ARG H H 1 7.93 0.01 . 1 . . . . . . . . 5280 1 1532 . 1 1 127 127 ARG HA H 1 4.25 0.01 . 1 . . . . . . . . 5280 1 1533 . 1 1 127 127 ARG HB2 H 1 1.96 0.01 . 2 . . . . . . . . 5280 1 1534 . 1 1 127 127 ARG HB3 H 1 1.81 0.01 . 2 . . . . . . . . 5280 1 1535 . 1 1 127 127 ARG HG2 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1536 . 1 1 127 127 ARG HG3 H 1 1.72 0.01 . 1 . . . . . . . . 5280 1 1537 . 1 1 127 127 ARG HD2 H 1 3.31 0.01 . 1 . . . . . . . . 5280 1 1538 . 1 1 127 127 ARG HD3 H 1 3.31 0.01 . 1 . . . . . . . . 5280 1 1539 . 1 1 127 127 ARG HE H 1 7.33 0.01 . 1 . . . . . . . . 5280 1 1540 . 1 1 127 127 ARG CA C 13 58.45 0.15 . 1 . . . . . . . . 5280 1 1541 . 1 1 127 127 ARG CB C 13 32.56 0.15 . 1 . . . . . . . . 5280 1 1542 . 1 1 127 127 ARG CG C 13 28.28 0.15 . 1 . . . . . . . . 5280 1 1543 . 1 1 127 127 ARG CD C 13 43.10 0.15 . 1 . . . . . . . . 5280 1 1544 . 1 1 127 127 ARG N N 15 125.70 0.01 . 1 . . . . . . . . 5280 1 stop_ save_