data_28086 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Unr CSD789 ; _BMRB_accession_number 28086 _BMRB_flat_file_name bmr28086.str _Entry_type original _Submission_date 2020-02-18 _Accession_date 2020-02-18 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Hollmann 'Nele Merret' . . 2 Hennig Janosch . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 214 "13C chemical shifts" 408 "15N chemical shifts" 214 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-08-15 update BMRB 'update entry citation' 2020-07-13 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 28087 'dUnr Cterminal Q-rich' 28088 'dUnr CSD456' 28089 'dUnr CSD6' stop_ _Original_release_date 2020-02-18 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Pseudo-RNA binding domains mediate RNA structure specificity in Upstream of N-Ras ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 32697992 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Hollmann 'Nele Merret' . . 2 Jagtap 'Kumar Ankush' . . 3 Masiewicz Pawel . . 4 Guitart Tanit . . 5 Simon Bernd . . 6 Provaznik Jan . . 7 Stein Frank . . 8 Haberkant Per . . 9 Sweetapple 'Lara Jayne' . . 10 Villacorte Laura . . 11 Mooijman Dylan . . 12 Benes Vladimir . . 13 Savitski Mikhail . . 14 Gebauer Fatima . . 15 Hennig Janosch . . stop_ _Journal_abbreviation 'Cell Rep.' _Journal_name_full 'Cell reports' _Journal_volume 32 _Journal_issue 3 _Journal_ISSN 2211-1247 _Journal_CSD 0353 _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 107930 _Page_last 107930 _Year 2020 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Unr CSD789' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Unr CSD789' $Unr_CSD789 stop_ _System_molecular_weight 26165.47 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Unr_CSD789 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Unr_CSD789 _Molecular_mass 26165.47 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 235 _Mol_residue_sequence ; GSDAGQVYRGFIAVMKENFG FIETLSHDEEVFFHFSNYMG NPNWLELGQEVEYTLARNGN TSVSGNCLPAENVRMLPKNS IPQPAVLETTHNGVVARPLR CINPDQQEYAGLIEILDELR TTVISQHEFGITSLVNKRDL LQKGDLVSFRIDESGRAACV NAVRQKKRATVDSIKGQFGF LNFEVEDGKKLFFHMSEVQG NTVALHPGDTVEFSVVTNQR NGKSSACNVLKINDR ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 ASP 4 ALA 5 GLY 6 GLN 7 VAL 8 TYR 9 ARG 10 GLY 11 PHE 12 ILE 13 ALA 14 VAL 15 MET 16 LYS 17 GLU 18 ASN 19 PHE 20 GLY 21 PHE 22 ILE 23 GLU 24 THR 25 LEU 26 SER 27 HIS 28 ASP 29 GLU 30 GLU 31 VAL 32 PHE 33 PHE 34 HIS 35 PHE 36 SER 37 ASN 38 TYR 39 MET 40 GLY 41 ASN 42 PRO 43 ASN 44 TRP 45 LEU 46 GLU 47 LEU 48 GLY 49 GLN 50 GLU 51 VAL 52 GLU 53 TYR 54 THR 55 LEU 56 ALA 57 ARG 58 ASN 59 GLY 60 ASN 61 THR 62 SER 63 VAL 64 SER 65 GLY 66 ASN 67 CYS 68 LEU 69 PRO 70 ALA 71 GLU 72 ASN 73 VAL 74 ARG 75 MET 76 LEU 77 PRO 78 LYS 79 ASN 80 SER 81 ILE 82 PRO 83 GLN 84 PRO 85 ALA 86 VAL 87 LEU 88 GLU 89 THR 90 THR 91 HIS 92 ASN 93 GLY 94 VAL 95 VAL 96 ALA 97 ARG 98 PRO 99 LEU 100 ARG 101 CYS 102 ILE 103 ASN 104 PRO 105 ASP 106 GLN 107 GLN 108 GLU 109 TYR 110 ALA 111 GLY 112 LEU 113 ILE 114 GLU 115 ILE 116 LEU 117 ASP 118 GLU 119 LEU 120 ARG 121 THR 122 THR 123 VAL 124 ILE 125 SER 126 GLN 127 HIS 128 GLU 129 PHE 130 GLY 131 ILE 132 THR 133 SER 134 LEU 135 VAL 136 ASN 137 LYS 138 ARG 139 ASP 140 LEU 141 LEU 142 GLN 143 LYS 144 GLY 145 ASP 146 LEU 147 VAL 148 SER 149 PHE 150 ARG 151 ILE 152 ASP 153 GLU 154 SER 155 GLY 156 ARG 157 ALA 158 ALA 159 CYS 160 VAL 161 ASN 162 ALA 163 VAL 164 ARG 165 GLN 166 LYS 167 LYS 168 ARG 169 ALA 170 THR 171 VAL 172 ASP 173 SER 174 ILE 175 LYS 176 GLY 177 GLN 178 PHE 179 GLY 180 PHE 181 LEU 182 ASN 183 PHE 184 GLU 185 VAL 186 GLU 187 ASP 188 GLY 189 LYS 190 LYS 191 LEU 192 PHE 193 PHE 194 HIS 195 MET 196 SER 197 GLU 198 VAL 199 GLN 200 GLY 201 ASN 202 THR 203 VAL 204 ALA 205 LEU 206 HIS 207 PRO 208 GLY 209 ASP 210 THR 211 VAL 212 GLU 213 PHE 214 SER 215 VAL 216 VAL 217 THR 218 ASN 219 GLN 220 ARG 221 ASN 222 GLY 223 LYS 224 SER 225 SER 226 ALA 227 CYS 228 ASN 229 VAL 230 LEU 231 LYS 232 ILE 233 ASN 234 ASP 235 ARG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value UNP Q9VSK3 'Upstream of N-ras, isoform A' . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Unr_CSD789 'fruit fly' 7227 Eukaryota Metazoa Drosophila melanogaster stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $Unr_CSD789 'recombinant technology' . Escherichia coli . pETM-11 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Unr_CSD789 0.5 mM '[U-99% 13C; U-99% 15N]' 'sodium chloride' 50 mM 'natural abundance' 'sodium phosphate' 20 mM 'natural abundance' DTT 1 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_Cara _Saveframe_category software _Name Cara _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance III' _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.4 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio water C 13 protons ppm 4.706 internal indirect . . . 0.251449530 water H 1 protons ppm 4.706 internal direct . . . 1 water N 15 protons ppm 4.706 internal indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCA' '3D HNCACB' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'Unr CSD789' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 GLY H H 8.435 0.020 1 2 1 1 GLY CA C 44.664 0.3 1 3 1 1 GLY N N 109.172 0.3 1 4 2 2 SER H H 8.108 0.020 1 5 2 2 SER CA C 57.800 0.3 1 6 2 2 SER CB C 62.838 0.3 1 7 2 2 SER N N 115.983 0.3 1 8 3 3 ASP H H 8.275 0.020 1 9 3 3 ASP CA C 53.772 0.3 1 10 3 3 ASP CB C 40.280 0.3 1 11 3 3 ASP N N 122.702 0.3 1 12 4 4 ALA H H 8.128 0.020 1 13 4 4 ALA CA C 52.307 0.3 1 14 4 4 ALA CB C 17.964 0.3 1 15 4 4 ALA N N 124.868 0.3 1 16 5 5 GLY H H 8.220 0.020 1 17 5 5 GLY CA C 44.420 0.3 1 18 5 5 GLY N N 108.099 0.3 1 19 6 6 GLN H H 7.806 0.020 1 20 6 6 GLN CA C 55.188 0.3 1 21 6 6 GLN CB C 28.306 0.3 1 22 6 6 GLN N N 120.562 0.3 1 23 7 7 VAL H H 7.622 0.020 1 24 7 7 VAL CA C 60.730 0.3 1 25 7 7 VAL CB C 31.692 0.3 1 26 7 7 VAL N N 122.070 0.3 1 27 8 8 TYR H H 8.801 0.020 1 28 8 8 TYR CA C 55.798 0.3 1 29 8 8 TYR CB C 39.736 0.3 1 30 8 8 TYR N N 127.272 0.3 1 31 9 9 ARG H H 8.098 0.020 1 32 9 9 ARG CA C 53.723 0.3 1 33 9 9 ARG CB C 32.600 0.3 1 34 9 9 ARG N N 116.166 0.3 1 35 10 10 GLY H H 8.587 0.020 1 36 10 10 GLY CA C 44.884 0.3 1 37 10 10 GLY N N 108.229 0.3 1 38 11 11 PHE H H 8.699 0.020 1 39 11 11 PHE CA C 54.065 0.3 1 40 11 11 PHE CB C 41.853 0.3 1 41 11 11 PHE N N 117.355 0.3 1 42 12 12 ILE H H 9.183 0.020 1 43 12 12 ILE CA C 61.292 0.3 1 44 12 12 ILE CB C 33.870 0.3 1 45 12 12 ILE N N 124.755 0.3 1 46 13 13 ALA H H 9.266 0.020 1 47 13 13 ALA CA C 52.624 0.3 1 48 13 13 ALA CB C 21.411 0.3 1 49 13 13 ALA N N 132.059 0.3 1 50 15 15 MET H H 8.824 0.020 1 51 15 15 MET CA C 54.651 0.3 1 52 15 15 MET CB C 34.474 0.3 1 53 15 15 MET N N 125.603 0.3 1 54 16 16 LYS H H 8.232 0.020 1 55 16 16 LYS CA C 52.746 0.3 1 56 16 16 LYS CB C 29.394 0.3 1 57 16 16 LYS N N 124.445 0.3 1 58 17 17 GLU H H 7.824 0.020 1 59 17 17 GLU CA C 59.094 0.3 1 60 17 17 GLU CB C 27.943 0.3 1 61 17 17 GLU N N 118.979 0.3 1 62 18 18 ASN H H 7.043 0.020 1 63 18 18 ASN CA C 52.209 0.3 1 64 18 18 ASN CB C 38.479 0.3 1 65 18 18 ASN N N 112.455 0.3 1 66 20 20 GLY H H 7.667 0.020 1 67 20 20 GLY CA C 44.396 0.3 1 68 20 20 GLY N N 106.039 0.3 1 69 21 21 PHE H H 8.671 0.020 1 70 21 21 PHE CA C 55.945 0.3 1 71 21 21 PHE CB C 42.639 0.3 1 72 21 21 PHE N N 112.902 0.3 1 73 22 22 ILE H H 9.821 0.020 1 74 22 22 ILE CA C 59.558 0.3 1 75 22 22 ILE CB C 40.583 0.3 1 76 22 22 ILE N N 125.472 0.3 1 77 23 23 GLU H H 9.848 0.020 1 78 23 23 GLU CA C 55.237 0.3 1 79 23 23 GLU CB C 31.813 0.3 1 80 23 23 GLU N N 129.031 0.3 1 81 24 24 THR H H 8.069 0.020 1 82 24 24 THR CA C 61.560 0.3 1 83 24 24 THR CB C 70.035 0.3 1 84 24 24 THR N N 116.873 0.3 1 85 25 25 LEU H H 7.947 0.020 1 86 25 25 LEU CA C 57.459 0.3 1 87 25 25 LEU CB C 40.522 0.3 1 88 25 25 LEU N N 120.069 0.3 1 89 26 26 SER H H 7.604 0.020 1 90 26 26 SER CA C 57.581 0.3 1 91 26 26 SER CB C 61.568 0.3 1 92 26 26 SER N N 107.364 0.3 1 93 27 27 HIS H H 8.304 0.020 1 94 27 27 HIS CA C 55.701 0.3 1 95 27 27 HIS CB C 24.617 0.3 1 96 27 27 HIS N N 114.903 0.3 1 97 28 28 ASP H H 7.975 0.020 1 98 28 28 ASP CA C 52.526 0.3 1 99 28 28 ASP CB C 40.280 0.3 1 100 28 28 ASP N N 114.440 0.3 1 101 29 29 GLU H H 7.182 0.020 1 102 29 29 GLU CA C 54.504 0.3 1 103 29 29 GLU CB C 32.721 0.3 1 104 29 29 GLU N N 120.673 0.3 1 105 30 30 GLU H H 8.738 0.020 1 106 30 30 GLU CA C 52.429 0.3 1 107 30 30 GLU CB C 30.906 0.3 1 108 30 30 GLU N N 117.999 0.3 1 109 31 31 VAL H H 9.231 0.020 1 110 31 31 VAL CA C 60.266 0.3 1 111 31 31 VAL CB C 33.930 0.3 1 112 31 31 VAL N N 120.961 0.3 1 113 32 32 PHE H H 8.800 0.020 1 114 32 32 PHE CA C 57.288 0.3 1 115 32 32 PHE CB C 40.159 0.3 1 116 32 32 PHE N N 129.635 0.3 1 117 33 33 PHE H H 7.767 0.020 1 118 33 33 PHE CA C 55.285 0.3 1 119 33 33 PHE CB C 41.853 0.3 1 120 33 33 PHE N N 122.394 0.3 1 121 34 34 HIS H H 8.942 0.020 1 122 34 34 HIS CA C 56.067 0.3 1 123 34 34 HIS CB C 31.451 0.3 1 124 34 34 HIS N N 122.630 0.3 1 125 35 35 PHE H H 7.889 0.020 1 126 35 35 PHE CA C 57.263 0.3 1 127 35 35 PHE CB C 34.414 0.3 1 128 35 35 PHE N N 126.322 0.3 1 129 36 36 SER H H 9.923 0.020 1 130 36 36 SER CA C 60.804 0.3 1 131 36 36 SER CB C 61.634 0.3 1 132 36 36 SER N N 118.711 0.3 1 133 37 37 ASN H H 8.234 0.020 1 134 37 37 ASN CA C 53.039 0.3 1 135 37 37 ASN CB C 38.950 0.3 1 136 37 37 ASN N N 119.425 0.3 1 137 38 38 TYR H H 7.787 0.020 1 138 38 38 TYR CA C 55.920 0.3 1 139 38 38 TYR CB C 38.647 0.3 1 140 38 38 TYR N N 120.397 0.3 1 141 39 39 MET H H 8.248 0.020 1 142 39 39 MET CA C 53.479 0.3 1 143 39 39 MET CB C 29.455 0.3 1 144 39 39 MET N N 128.941 0.3 1 145 40 40 GLY H H 7.048 0.020 1 146 40 40 GLY CA C 43.712 0.3 1 147 40 40 GLY N N 110.220 0.3 1 148 43 43 ASN H H 7.873 0.020 1 149 43 43 ASN CA C 54.455 0.3 1 150 43 43 ASN CB C 36.773 0.3 1 151 43 43 ASN N N 115.739 0.3 1 152 44 44 TRP H H 7.291 0.020 1 153 44 44 TRP CA C 54.382 0.3 1 154 44 44 TRP CB C 28.790 0.3 1 155 44 44 TRP N N 117.519 0.3 1 156 45 45 LEU H H 6.884 0.020 1 157 45 45 LEU CA C 54.651 0.3 1 158 45 45 LEU CB C 41.792 0.3 1 159 45 45 LEU N N 121.776 0.3 1 160 46 46 GLU H H 7.749 0.020 1 161 46 46 GLU CA C 53.527 0.3 1 162 46 46 GLU CB C 31.632 0.3 1 163 46 46 GLU N N 120.837 0.3 1 164 47 47 LEU H H 8.401 0.020 1 165 47 47 LEU CA C 55.920 0.3 1 166 47 47 LEU CB C 40.462 0.3 1 167 47 47 LEU N N 119.667 0.3 1 168 48 48 GLY H H 9.885 0.020 1 169 48 48 GLY CA C 44.200 0.3 1 170 48 48 GLY N N 111.772 0.3 1 171 49 49 GLN H H 7.677 0.020 1 172 49 49 GLN CA C 56.238 0.3 1 173 49 49 GLN CB C 29.273 0.3 1 174 49 49 GLN N N 120.321 0.3 1 175 50 50 GLU H H 9.265 0.020 1 176 50 50 GLU CA C 56.726 0.3 1 177 50 50 GLU CB C 29.423 0.3 1 178 50 50 GLU N N 128.038 0.3 1 179 51 51 VAL H H 8.704 0.020 1 180 51 51 VAL CA C 58.411 0.3 1 181 51 51 VAL CB C 35.503 0.3 1 182 51 51 VAL N N 116.927 0.3 1 183 52 52 GLU H H 8.795 0.020 1 184 52 52 GLU CA C 52.697 0.3 1 185 52 52 GLU CB C 32.781 0.3 1 186 52 52 GLU N N 119.245 0.3 1 187 53 53 TYR H H 8.716 0.020 1 188 53 53 TYR CA C 55.994 0.3 1 189 53 53 TYR CB C 40.038 0.3 1 190 53 53 TYR N N 117.237 0.3 1 191 54 54 THR H H 8.638 0.020 1 192 54 54 THR CA C 59.387 0.3 1 193 54 54 THR CB C 70.035 0.3 1 194 54 54 THR N N 110.606 0.3 1 195 55 55 LEU H H 9.019 0.020 1 196 55 55 LEU CA C 53.479 0.3 1 197 55 55 LEU CB C 42.457 0.3 1 198 55 55 LEU N N 121.616 0.3 1 199 56 56 ALA H H 8.557 0.020 1 200 56 56 ALA CA C 51.452 0.3 1 201 56 56 ALA CB C 18.146 0.3 1 202 56 56 ALA N N 126.333 0.3 1 203 57 57 ARG H H 8.341 0.020 1 204 57 57 ARG CA C 55.749 0.3 1 205 57 57 ARG CB C 29.394 0.3 1 206 57 57 ARG N N 120.203 0.3 1 207 58 58 ASN H H 8.217 0.020 1 208 58 58 ASN CA C 52.429 0.3 1 209 58 58 ASN CB C 38.345 0.3 1 210 58 58 ASN N N 118.288 0.3 1 211 59 59 GLY H H 8.269 0.020 1 212 59 59 GLY CA C 44.811 0.3 1 213 59 59 GLY N N 109.035 0.3 1 214 60 60 ASN H H 8.233 0.020 1 215 60 60 ASN CA C 52.673 0.3 1 216 60 60 ASN CB C 38.043 0.3 1 217 60 60 ASN N N 119.015 0.3 1 218 61 61 THR H H 8.082 0.020 1 219 61 61 THR CA C 61.463 0.3 1 220 61 61 THR CB C 68.765 0.3 1 221 61 61 THR N N 114.400 0.3 1 222 62 62 SER H H 8.202 0.020 1 223 62 62 SER CA C 58.313 0.3 1 224 62 62 SER CB C 62.657 0.3 1 225 62 62 SER N N 118.010 0.3 1 226 63 63 VAL H H 7.665 0.020 1 227 63 63 VAL CA C 61.683 0.3 1 228 63 63 VAL CB C 31.209 0.3 1 229 63 63 VAL N N 120.157 0.3 1 230 64 64 SER H H 7.895 0.020 1 231 64 64 SER CA C 57.556 0.3 1 232 64 64 SER CB C 62.838 0.3 1 233 64 64 SER N N 117.447 0.3 1 234 65 65 GLY H H 8.174 0.020 1 235 65 65 GLY CA C 45.128 0.3 1 236 65 65 GLY N N 111.305 0.3 1 237 66 66 ASN H H 8.261 0.020 1 238 66 66 ASN CA C 52.795 0.3 1 239 66 66 ASN CB C 38.011 0.3 1 240 66 66 ASN N N 118.614 0.3 1 241 67 67 CYS H H 7.972 0.020 1 242 67 67 CYS CA C 57.581 0.3 1 243 67 67 CYS CB C 27.520 0.3 1 244 67 67 CYS N N 118.970 0.3 1 245 68 68 LEU H H 8.336 0.020 1 246 68 68 LEU CA C 52.404 0.3 1 247 68 68 LEU CB C 40.824 0.3 1 248 68 68 LEU N N 125.867 0.3 1 249 70 70 ALA H H 8.922 0.020 1 250 70 70 ALA CA C 50.060 0.3 1 251 70 70 ALA CB C 20.081 0.3 1 252 70 70 ALA N N 121.408 0.3 1 253 71 71 GLU H H 8.972 0.020 1 254 71 71 GLU CA C 54.162 0.3 1 255 71 71 GLU CB C 31.330 0.3 1 256 71 71 GLU N N 118.499 0.3 1 257 72 72 ASN H H 8.477 0.020 1 258 72 72 ASN CA C 53.820 0.3 1 259 72 72 ASN CB C 38.284 0.3 1 260 72 72 ASN N N 115.641 0.3 1 261 73 73 VAL H H 8.079 0.020 1 262 73 73 VAL CA C 61.780 0.3 1 263 73 73 VAL CB C 31.088 0.3 1 264 73 73 VAL N N 118.633 0.3 1 265 74 74 ARG H H 8.911 0.020 1 266 74 74 ARG CA C 53.625 0.3 1 267 74 74 ARG CB C 32.842 0.3 1 268 74 74 ARG N N 125.549 0.3 1 269 75 75 MET H H 8.700 0.020 1 270 75 75 MET CA C 56.873 0.3 1 271 75 75 MET CB C 32.842 0.3 1 272 75 75 MET N N 122.055 0.3 1 273 76 76 LEU H H 8.046 0.020 1 274 76 76 LEU CA C 51.184 0.3 1 275 76 76 LEU CB C 41.369 0.3 1 276 76 76 LEU N N 125.517 0.3 1 277 78 78 LYS H H 8.365 0.020 1 278 78 78 LYS CA C 56.921 0.3 1 279 78 78 LYS CB C 31.027 0.3 1 280 78 78 LYS N N 124.417 0.3 1 281 79 79 ASN H H 9.946 0.020 1 282 79 79 ASN CA C 54.529 0.3 1 283 79 79 ASN CB C 35.744 0.3 1 284 79 79 ASN N N 119.881 0.3 1 285 80 80 SER H H 8.203 0.020 1 286 80 80 SER CA C 60.681 0.3 1 287 80 80 SER CB C 63.140 0.3 1 288 80 80 SER N N 115.601 0.3 1 289 81 81 ILE H H 8.538 0.020 1 290 81 81 ILE CA C 58.631 0.3 1 291 81 81 ILE CB C 37.075 0.3 1 292 81 81 ILE N N 124.010 0.3 1 293 83 83 GLN H H 8.559 0.020 1 294 83 83 GLN CA C 52.282 0.3 1 295 83 83 GLN CB C 30.543 0.3 1 296 83 83 GLN N N 124.090 0.3 1 297 85 85 ALA H H 8.738 0.020 1 298 85 85 ALA CA C 51.745 0.3 1 299 85 85 ALA CB C 17.662 0.3 1 300 85 85 ALA N N 126.510 0.3 1 301 86 86 VAL H H 8.394 0.020 1 302 86 86 VAL CA C 62.366 0.3 1 303 86 86 VAL CB C 31.390 0.3 1 304 86 86 VAL N N 121.209 0.3 1 305 87 87 LEU H H 8.437 0.020 1 306 87 87 LEU CA C 55.481 0.3 1 307 87 87 LEU CB C 39.192 0.3 1 308 87 87 LEU N N 130.707 0.3 1 309 88 88 GLU H H 8.545 0.020 1 310 88 88 GLU CA C 58.801 0.3 1 311 88 88 GLU CB C 29.334 0.3 1 312 88 88 GLU N N 120.543 0.3 1 313 89 89 THR H H 7.218 0.020 1 314 89 89 THR CA C 63.660 0.3 1 315 89 89 THR CB C 68.462 0.3 1 316 89 89 THR N N 113.756 0.3 1 317 90 90 THR H H 8.323 0.020 1 318 90 90 THR CA C 62.049 0.3 1 319 90 90 THR CB C 68.462 0.3 1 320 90 90 THR N N 122.610 0.3 1 321 91 91 HIS H H 8.905 0.020 1 322 91 91 HIS CA C 53.772 0.3 1 323 91 91 HIS CB C 32.025 0.3 1 324 91 91 HIS N N 125.164 0.3 1 325 92 92 ASN H H 8.451 0.020 1 326 92 92 ASN CA C 51.940 0.3 1 327 92 92 ASN CB C 39.796 0.3 1 328 92 92 ASN N N 118.181 0.3 1 329 93 93 GLY H H 8.936 0.020 1 330 93 93 GLY CA C 44.518 0.3 1 331 93 93 GLY N N 109.143 0.3 1 332 94 94 VAL H H 8.947 0.020 1 333 94 94 VAL CA C 58.899 0.3 1 334 94 94 VAL CB C 34.112 0.3 1 335 94 94 VAL N N 120.056 0.3 1 336 95 95 VAL H H 8.970 0.020 1 337 95 95 VAL CA C 63.709 0.3 1 338 95 95 VAL CB C 29.878 0.3 1 339 95 95 VAL N N 127.299 0.3 1 340 96 96 ALA H H 9.078 0.020 1 341 96 96 ALA CA C 51.745 0.3 1 342 96 96 ALA CB C 19.295 0.3 1 343 96 96 ALA N N 135.778 0.3 1 344 97 97 ARG H H 7.817 0.020 1 345 97 97 ARG CA C 53.039 0.3 1 346 97 97 ARG CB C 33.222 0.3 1 347 97 97 ARG N N 120.406 0.3 1 348 99 99 LEU H H 8.261 0.020 1 349 99 99 LEU CA C 54.504 0.3 1 350 99 99 LEU CB C 42.695 0.3 1 351 99 99 LEU N N 118.614 0.3 1 352 100 100 ARG H H 7.889 0.020 1 353 100 100 ARG CA C 58.313 0.3 1 354 100 100 ARG CB C 29.697 0.3 1 355 100 100 ARG N N 124.226 0.3 1 356 102 102 ILE H H 7.497 0.020 1 357 102 102 ILE CA C 60.266 0.3 1 358 102 102 ILE N N 117.914 0.3 1 359 103 103 ASN H H 7.372 0.020 1 360 103 103 ASN CA C 49.987 0.3 1 361 103 103 ASN CB C 38.466 0.3 1 362 103 103 ASN N N 118.792 0.3 1 363 105 105 ASP H H 7.532 0.020 1 364 105 105 ASP CA C 54.040 0.3 1 365 105 105 ASP CB C 39.736 0.3 1 366 105 105 ASP N N 116.170 0.3 1 367 106 106 GLN H H 7.483 0.020 1 368 106 106 GLN CA C 54.822 0.3 1 369 106 106 GLN CB C 29.213 0.3 1 370 106 106 GLN N N 120.659 0.3 1 371 107 107 GLN H H 8.655 0.020 1 372 107 107 GLN CA C 57.678 0.3 1 373 107 107 GLN CB C 28.064 0.3 1 374 107 107 GLN N N 124.069 0.3 1 375 108 108 GLU H H 8.542 0.020 1 376 108 108 GLU CA C 56.213 0.3 1 377 108 108 GLU CB C 28.064 0.3 1 378 108 108 GLU N N 119.948 0.3 1 379 109 109 TYR H H 8.370 0.020 1 380 109 109 TYR CA C 60.291 0.3 1 381 109 109 TYR CB C 38.708 0.3 1 382 109 109 TYR N N 123.669 0.3 1 383 110 110 ALA H H 8.061 0.020 1 384 110 110 ALA CA C 51.794 0.3 1 385 110 110 ALA CB C 18.690 0.3 1 386 110 110 ALA N N 117.344 0.3 1 387 111 111 GLY H H 6.914 0.020 1 388 111 111 GLY CA C 43.151 0.3 1 389 111 111 GLY N N 106.792 0.3 1 390 112 112 LEU H H 8.983 0.020 1 391 112 112 LEU CA C 53.796 0.3 1 392 112 112 LEU CB C 47.779 0.3 1 393 112 112 LEU N N 120.298 0.3 1 394 113 113 ILE H H 9.230 0.020 1 395 113 113 ILE CA C 59.314 0.3 1 396 113 113 ILE CB C 40.280 0.3 1 397 113 113 ILE N N 129.221 0.3 1 398 114 114 GLU H H 8.908 0.020 1 399 114 114 GLU CA C 53.430 0.3 1 400 114 114 GLU CB C 31.753 0.3 1 401 114 114 GLU N N 124.937 0.3 1 402 115 115 ILE H H 8.445 0.020 1 403 115 115 ILE CA C 61.560 0.3 1 404 115 115 ILE CB C 37.196 0.3 1 405 115 115 ILE N N 121.686 0.3 1 406 116 116 LEU H H 8.685 0.020 1 407 116 116 LEU CA C 52.893 0.3 1 408 116 116 LEU CB C 43.788 0.3 1 409 116 116 LEU N N 128.002 0.3 1 410 123 123 VAL H H 8.284 0.020 1 411 123 123 VAL CA C 62.293 0.3 1 412 123 123 VAL CB C 30.906 0.3 1 413 123 123 VAL N N 125.304 0.3 1 414 124 124 ILE H H 9.330 0.020 1 415 124 124 ILE CA C 61.927 0.3 1 416 124 124 ILE CB C 36.893 0.3 1 417 124 124 ILE N N 129.779 0.3 1 418 125 125 SER H H 7.524 0.020 1 419 125 125 SER CA C 57.800 0.3 1 420 125 125 SER CB C 62.119 0.3 1 421 125 125 SER N N 112.374 0.3 1 422 126 126 GLN H H 7.792 0.020 1 423 126 126 GLN CA C 53.283 0.3 1 424 126 126 GLN CB C 31.209 0.3 1 425 126 126 GLN N N 116.713 0.3 1 426 127 127 HIS H H 8.850 0.020 1 427 127 127 HIS CA C 54.666 0.3 1 428 127 127 HIS CB C 31.269 0.3 1 429 127 127 HIS N N 119.336 0.3 1 430 128 128 GLU H H 9.240 0.020 1 431 128 128 GLU CA C 55.627 0.3 1 432 128 128 GLU CB C 30.725 0.3 1 433 128 128 GLU N N 126.229 0.3 1 434 129 129 PHE H H 7.773 0.020 1 435 129 129 PHE CA C 55.041 0.3 1 436 129 129 PHE CB C 42.518 0.3 1 437 129 129 PHE N N 114.182 0.3 1 438 130 130 GLY H H 7.542 0.020 1 439 130 130 GLY CA C 44.298 0.3 1 440 130 130 GLY N N 110.548 0.3 1 441 131 131 ILE H H 10.462 0.020 1 442 131 131 ILE CA C 60.828 0.3 1 443 131 131 ILE CB C 37.861 0.3 1 444 131 131 ILE N N 124.300 0.3 1 445 132 132 THR H H 7.240 0.020 1 446 132 132 THR CA C 62.562 0.3 1 447 132 132 THR CB C 66.648 0.3 1 448 132 132 THR N N 108.266 0.3 1 449 133 133 SER H H 7.742 0.020 1 450 133 133 SER CA C 59.925 0.3 1 451 133 133 SER CB C 63.019 0.3 1 452 133 133 SER N N 116.820 0.3 1 453 134 134 LEU H H 6.734 0.020 1 454 134 134 LEU CA C 54.431 0.3 1 455 134 134 LEU CB C 41.006 0.3 1 456 134 134 LEU N N 117.120 0.3 1 457 135 135 VAL H H 7.806 0.020 1 458 135 135 VAL CA C 65.492 0.3 1 459 135 135 VAL CB C 30.725 0.3 1 460 135 135 VAL N N 124.123 0.3 1 461 136 136 ASN H H 9.003 0.020 1 462 136 136 ASN CA C 50.671 0.3 1 463 136 136 ASN CB C 37.075 0.3 1 464 136 136 ASN N N 118.885 0.3 1 465 137 137 LYS H H 8.585 0.020 1 466 137 137 LYS CA C 57.922 0.3 1 467 137 137 LYS CB C 31.027 0.3 1 468 137 137 LYS N N 122.586 0.3 1 469 138 138 ARG H H 7.698 0.020 1 470 138 138 ARG CA C 55.285 0.3 1 471 138 138 ARG CB C 29.032 0.3 1 472 138 138 ARG N N 113.945 0.3 1 473 139 139 ASP H H 7.293 0.020 1 474 139 139 ASP CA C 53.894 0.3 1 475 139 139 ASP CB C 40.038 0.3 1 476 139 139 ASP N N 121.318 0.3 1 477 140 140 LEU H H 8.223 0.020 1 478 140 140 LEU CA C 53.918 0.3 1 479 140 140 LEU CB C 40.280 0.3 1 480 140 140 LEU N N 125.564 0.3 1 481 141 141 LEU H H 7.392 0.020 1 482 141 141 LEU CA C 53.796 0.3 1 483 141 141 LEU CB C 40.764 0.3 1 484 141 141 LEU N N 123.191 0.3 1 485 142 142 GLN H H 8.826 0.020 1 486 142 142 GLN CA C 52.893 0.3 1 487 142 142 GLN CB C 31.813 0.3 1 488 142 142 GLN N N 121.462 0.3 1 489 143 143 LYS H H 8.631 0.020 1 490 143 143 LYS CA C 57.898 0.3 1 491 143 143 LYS CB C 31.390 0.3 1 492 143 143 LYS N N 120.633 0.3 1 493 144 144 GLY H H 9.220 0.020 1 494 144 144 GLY CA C 44.005 0.3 1 495 144 144 GLY N N 116.113 0.3 1 496 145 145 ASP H H 8.085 0.020 1 497 145 145 ASP CA C 55.041 0.3 1 498 145 145 ASP CB C 39.675 0.3 1 499 145 145 ASP N N 122.373 0.3 1 500 146 146 LEU H H 8.395 0.020 1 501 146 146 LEU CA C 53.943 0.3 1 502 146 146 LEU CB C 40.706 0.3 1 503 146 146 LEU N N 122.705 0.3 1 504 147 147 VAL H H 8.463 0.020 1 505 147 147 VAL CA C 57.800 0.3 1 506 147 147 VAL CB C 34.958 0.3 1 507 147 147 VAL N N 113.556 0.3 1 508 148 148 SER H H 8.970 0.020 1 509 148 148 SER CA C 55.676 0.3 1 510 148 148 SER CB C 64.289 0.3 1 511 148 148 SER N N 117.866 0.3 1 512 149 149 PHE H H 9.038 0.020 1 513 149 149 PHE CA C 55.749 0.3 1 514 149 149 PHE CB C 39.857 0.3 1 515 149 149 PHE N N 120.264 0.3 1 516 150 150 ARG H H 8.669 0.020 1 517 150 150 ARG CA C 53.283 0.3 1 518 150 150 ARG CB C 33.386 0.3 1 519 150 150 ARG N N 118.566 0.3 1 520 151 151 ILE H H 9.184 0.020 1 521 151 151 ILE CA C 59.583 0.3 1 522 151 151 ILE CB C 39.192 0.3 1 523 151 151 ILE N N 122.557 0.3 1 524 152 152 ASP H H 8.869 0.020 1 525 152 152 ASP CA C 51.110 0.3 1 526 152 152 ASP CB C 42.397 0.3 1 527 152 152 ASP N N 123.817 0.3 1 528 153 153 GLU H H 8.581 0.020 1 529 153 153 GLU CA C 58.557 0.3 1 530 153 153 GLU CB C 29.152 0.3 1 531 153 153 GLU N N 116.656 0.3 1 532 154 154 SER H H 8.656 0.020 1 533 154 154 SER CA C 57.922 0.3 1 534 154 154 SER CB C 64.289 0.3 1 535 154 154 SER N N 115.471 0.3 1 536 155 155 GLY H H 8.332 0.020 1 537 155 155 GLY CA C 44.933 0.3 1 538 155 155 GLY N N 111.629 0.3 1 539 156 156 ARG H H 7.701 0.020 1 540 156 156 ARG CA C 55.725 0.3 1 541 156 156 ARG CB C 30.120 0.3 1 542 156 156 ARG N N 123.013 0.3 1 543 157 157 ALA H H 8.578 0.020 1 544 157 157 ALA CA C 51.037 0.3 1 545 157 157 ALA CB C 20.081 0.3 1 546 157 157 ALA N N 120.088 0.3 1 547 158 158 ALA H H 9.547 0.020 1 548 158 158 ALA CA C 50.085 0.3 1 549 158 158 ALA CB C 23.165 0.3 1 550 158 158 ALA N N 127.004 0.3 1 551 159 159 CYS H H 9.072 0.020 1 552 159 159 CYS CA C 58.533 0.3 1 553 159 159 CYS CB C 24.375 0.3 1 554 159 159 CYS N N 117.874 0.3 1 555 160 160 VAL H H 8.849 0.020 1 556 160 160 VAL CA C 62.195 0.3 1 557 160 160 VAL CB C 30.725 0.3 1 558 160 160 VAL N N 116.900 0.3 1 559 161 161 ASN H H 9.232 0.020 1 560 161 161 ASN CA C 51.525 0.3 1 561 161 161 ASN CB C 41.853 0.3 1 562 161 161 ASN N N 128.320 0.3 1 563 162 162 ALA H H 8.987 0.020 1 564 162 162 ALA CA C 51.965 0.3 1 565 162 162 ALA CB C 17.480 0.3 1 566 162 162 ALA N N 126.125 0.3 1 567 163 163 VAL H H 8.267 0.020 1 568 163 163 VAL CA C 62.171 0.3 1 569 163 163 VAL CB C 30.725 0.3 1 570 163 163 VAL N N 124.384 0.3 1 571 164 164 ARG H H 8.167 0.020 1 572 164 164 ARG CA C 54.529 0.3 1 573 164 164 ARG CB C 30.967 0.3 1 574 164 164 ARG N N 124.490 0.3 1 575 165 165 GLN H H 8.418 0.020 1 576 165 165 GLN CA C 55.041 0.3 1 577 165 165 GLN CB C 29.092 0.3 1 578 165 165 GLN N N 121.895 0.3 1 579 166 166 LYS H H 8.490 0.020 1 580 166 166 LYS CA C 55.066 0.3 1 581 166 166 LYS CB C 32.297 0.3 1 582 166 166 LYS N N 125.101 0.3 1 583 167 167 LYS H H 8.284 0.020 1 584 167 167 LYS CA C 52.551 0.3 1 585 167 167 LYS CB C 34.233 0.3 1 586 167 167 LYS N N 123.449 0.3 1 587 168 168 ARG H H 7.584 0.020 1 588 168 168 ARG CA C 53.967 0.3 1 589 168 168 ARG CB C 33.386 0.3 1 590 168 168 ARG N N 115.721 0.3 1 591 169 169 ALA H H 8.911 0.020 1 592 169 169 ALA CA C 50.915 0.3 1 593 169 169 ALA CB C 22.198 0.3 1 594 169 169 ALA N N 121.507 0.3 1 595 170 170 THR H H 8.263 0.020 1 596 170 170 THR CA C 59.143 0.3 1 597 170 170 THR CB C 70.942 0.3 1 598 170 170 THR N N 108.488 0.3 1 599 171 171 VAL H H 8.696 0.020 1 600 171 171 VAL CA C 62.562 0.3 1 601 171 171 VAL CB C 31.269 0.3 1 602 171 171 VAL N N 121.385 0.3 1 603 172 172 ASP H H 9.534 0.020 1 604 172 172 ASP CA C 56.091 0.3 1 605 172 172 ASP CB C 43.002 0.3 1 606 172 172 ASP N N 131.609 0.3 1 607 173 173 SER H H 7.540 0.020 1 608 173 173 SER CA C 56.653 0.3 1 609 173 173 SER CB C 63.685 0.3 1 610 173 173 SER N N 107.587 0.3 1 611 174 174 ILE H H 8.433 0.020 1 612 174 174 ILE CA C 60.291 0.3 1 613 174 174 ILE CB C 39.494 0.3 1 614 174 174 ILE N N 120.630 0.3 1 615 175 175 LYS H H 9.001 0.020 1 616 175 175 LYS CA C 54.138 0.3 1 617 175 175 LYS CB C 32.479 0.3 1 618 175 175 LYS N N 128.842 0.3 1 619 176 176 GLY H H 8.586 0.020 1 620 176 176 GLY CA C 46.422 0.3 1 621 176 176 GLY N N 115.778 0.3 1 622 177 177 GLN H H 8.540 0.020 1 623 177 177 GLN CA C 54.968 0.3 1 624 177 177 GLN CB C 27.757 0.3 1 625 177 177 GLN N N 123.975 0.3 1 626 178 178 PHE H H 7.458 0.020 1 627 178 178 PHE CA C 55.261 0.3 1 628 178 178 PHE CB C 41.369 0.3 1 629 178 178 PHE N N 117.395 0.3 1 630 179 179 GLY H H 7.891 0.020 1 631 179 179 GLY CA C 42.906 0.3 1 632 179 179 GLY N N 107.472 0.3 1 633 180 180 PHE H H 8.370 0.020 1 634 180 180 PHE CA C 56.457 0.3 1 635 180 180 PHE CB C 41.006 0.3 1 636 180 180 PHE N N 115.823 0.3 1 637 181 181 LEU H H 9.124 0.020 1 638 181 181 LEU CA C 52.649 0.3 1 639 181 181 LEU CB C 43.848 0.3 1 640 181 181 LEU N N 123.062 0.3 1 641 182 182 ASN H H 8.850 0.020 1 642 182 182 ASN CA C 52.464 0.3 1 643 182 182 ASN CB C 35.503 0.3 1 644 182 182 ASN N N 119.378 0.3 1 645 183 183 PHE H H 8.084 0.020 1 646 183 183 PHE CA C 58.045 0.3 1 647 183 183 PHE CB C 41.176 0.3 1 648 183 183 PHE N N 124.724 0.3 1 649 184 184 GLU H H 7.861 0.020 1 650 184 184 GLU CA C 54.870 0.3 1 651 184 184 GLU CB C 30.181 0.3 1 652 184 184 GLU N N 127.115 0.3 1 653 185 185 VAL H H 8.619 0.020 1 654 185 185 VAL CA C 61.560 0.3 1 655 185 185 VAL CB C 31.557 0.3 1 656 185 185 VAL N N 120.671 0.3 1 657 186 186 GLU H H 8.390 0.020 1 658 186 186 GLU CA C 55.676 0.3 1 659 186 186 GLU CB C 29.527 0.3 1 660 186 186 GLU N N 120.843 0.3 1 661 187 187 ASP H H 8.358 0.020 1 662 187 187 ASP CA C 55.017 0.3 1 663 187 187 ASP CB C 39.494 0.3 1 664 187 187 ASP N N 119.989 0.3 1 665 188 188 GLY H H 8.380 0.020 1 666 188 188 GLY CA C 45.275 0.3 1 667 188 188 GLY N N 110.959 0.3 1 668 189 189 LYS H H 7.765 0.020 1 669 189 189 LYS CA C 54.284 0.3 1 670 189 189 LYS CB C 32.176 0.3 1 671 189 189 LYS N N 121.149 0.3 1 672 190 190 LYS H H 8.214 0.020 1 673 190 190 LYS CA C 56.213 0.3 1 674 190 190 LYS CB C 31.609 0.3 1 675 190 190 LYS N N 123.042 0.3 1 676 191 191 LEU H H 8.322 0.020 1 677 191 191 LEU CA C 54.919 0.3 1 678 191 191 LEU CB C 42.457 0.3 1 679 191 191 LEU N N 125.035 0.3 1 680 194 194 HIS H H 9.081 0.020 1 681 194 194 HIS CA C 56.262 0.3 1 682 194 194 HIS CB C 31.209 0.3 1 683 194 194 HIS N N 122.317 0.3 1 684 195 195 MET H H 8.153 0.020 1 685 195 195 MET CA C 56.213 0.3 1 686 195 195 MET CB C 29.455 0.3 1 687 195 195 MET N N 125.914 0.3 1 688 196 196 SER H H 9.425 0.020 1 689 196 196 SER CA C 60.364 0.3 1 690 196 196 SER CB C 61.628 0.3 1 691 196 196 SER N N 117.711 0.3 1 692 197 197 GLU H H 8.206 0.020 1 693 197 197 GLU CA C 55.798 0.3 1 694 197 197 GLU CB C 29.032 0.3 1 695 197 197 GLU N N 120.024 0.3 1 696 198 198 VAL H H 7.478 0.020 1 697 198 198 VAL CA C 62.195 0.3 1 698 198 198 VAL CB C 30.181 0.3 1 699 198 198 VAL N N 122.465 0.3 1 700 199 199 GLN H H 8.796 0.020 1 701 199 199 GLN CA C 54.529 0.3 1 702 199 199 GLN CB C 28.548 0.3 1 703 199 199 GLN N N 128.093 0.3 1 704 200 200 GLY H H 8.260 0.020 1 705 200 200 GLY CA C 44.420 0.3 1 706 200 200 GLY N N 110.087 0.3 1 707 201 201 ASN H H 8.343 0.020 1 708 201 201 ASN CA C 52.966 0.3 1 709 201 201 ASN CB C 37.619 0.3 1 710 201 201 ASN N N 119.318 0.3 1 711 202 202 THR H H 8.176 0.020 1 712 202 202 THR CA C 62.537 0.3 1 713 202 202 THR CB C 68.039 0.3 1 714 202 202 THR N N 116.330 0.3 1 715 203 203 VAL H H 7.635 0.020 1 716 203 203 VAL CA C 61.927 0.3 1 717 203 203 VAL CB C 31.148 0.3 1 718 203 203 VAL N N 120.966 0.3 1 719 204 204 ALA H H 7.685 0.020 1 720 204 204 ALA CA C 50.866 0.3 1 721 204 204 ALA CB C 17.964 0.3 1 722 204 204 ALA N N 125.731 0.3 1 723 205 205 LEU H H 7.531 0.020 1 724 205 205 LEU CA C 53.405 0.3 1 725 205 205 LEU CB C 42.941 0.3 1 726 205 205 LEU N N 121.456 0.3 1 727 206 206 HIS H H 8.953 0.020 1 728 206 206 HIS CA C 52.038 0.3 1 729 206 206 HIS CB C 29.273 0.3 1 730 206 206 HIS N N 121.525 0.3 1 731 208 208 GLY H H 9.377 0.020 1 732 208 208 GLY CA C 44.249 0.3 1 733 208 208 GLY N N 114.476 0.3 1 734 209 209 ASP H H 7.878 0.020 1 735 209 209 ASP CA C 54.797 0.3 1 736 209 209 ASP CB C 40.280 0.3 1 737 209 209 ASP N N 121.831 0.3 1 738 210 210 THR H H 9.036 0.020 1 739 210 210 THR CA C 62.830 0.3 1 740 210 210 THR CB C 68.462 0.3 1 741 210 210 THR N N 118.995 0.3 1 742 211 211 VAL H H 8.851 0.020 1 743 211 211 VAL CA C 56.946 0.3 1 744 211 211 VAL CB C 33.870 0.3 1 745 211 211 VAL N N 118.150 0.3 1 746 212 212 GLU H H 8.930 0.020 1 747 212 212 GLU CA C 52.990 0.3 1 748 212 212 GLU CB C 32.721 0.3 1 749 212 212 GLU N N 120.643 0.3 1 750 213 213 PHE H H 8.087 0.020 1 751 213 213 PHE CA C 55.652 0.3 1 752 213 213 PHE CB C 39.736 0.3 1 753 213 213 PHE N N 117.394 0.3 1 754 214 214 SER H H 8.562 0.020 1 755 214 214 SER CA C 56.531 0.3 1 756 214 214 SER CB C 64.713 0.3 1 757 214 214 SER N N 113.419 0.3 1 758 215 215 VAL H H 8.867 0.020 1 759 215 215 VAL CA C 61.683 0.3 1 760 215 215 VAL CB C 31.753 0.3 1 761 215 215 VAL N N 124.419 0.3 1 762 216 216 VAL H H 8.834 0.020 1 763 216 216 VAL CA C 60.193 0.3 1 764 216 216 VAL CB C 33.144 0.3 1 765 216 216 VAL N N 128.193 0.3 1 766 217 217 THR H H 8.687 0.020 1 767 217 217 THR CA C 61.048 0.3 1 768 217 217 THR CB C 69.490 0.3 1 769 217 217 THR N N 123.735 0.3 1 770 218 218 ASN H H 8.622 0.020 1 771 218 218 ASN CA C 52.771 0.3 1 772 218 218 ASN CB C 37.680 0.3 1 773 218 218 ASN N N 127.367 0.3 1 774 219 219 GLN H H 9.064 0.020 1 775 219 219 GLN CA C 56.921 0.3 1 776 219 219 GLN CB C 27.520 0.3 1 777 219 219 GLN N N 126.089 0.3 1 778 220 220 ARG H H 8.334 0.020 1 779 220 220 ARG CA C 57.141 0.3 1 780 220 220 ARG CB C 28.906 0.3 1 781 220 220 ARG N N 118.176 0.3 1 782 221 221 ASN H H 7.382 0.020 1 783 221 221 ASN CA C 51.403 0.3 1 784 221 221 ASN CB C 38.284 0.3 1 785 221 221 ASN N N 112.883 0.3 1 786 222 222 GLY H H 8.161 0.020 1 787 222 222 GLY CA C 45.519 0.3 1 788 222 222 GLY N N 109.698 0.3 1 789 223 223 LYS H H 8.026 0.020 1 790 223 223 LYS CA C 55.530 0.3 1 791 223 223 LYS CB C 31.874 0.3 1 792 223 223 LYS N N 120.598 0.3 1 793 224 224 SER H H 8.798 0.020 1 794 224 224 SER CA C 57.800 0.3 1 795 224 224 SER CB C 64.289 0.3 1 796 224 224 SER N N 120.328 0.3 1 797 225 225 SER H H 8.795 0.020 1 798 225 225 SER CA C 57.019 0.3 1 799 225 225 SER CB C 65.145 0.3 1 800 225 225 SER N N 116.170 0.3 1 801 226 226 ALA H H 8.353 0.020 1 802 226 226 ALA CA C 49.523 0.3 1 803 226 226 ALA CB C 19.537 0.3 1 804 226 226 ALA N N 122.293 0.3 1 805 227 227 CYS H H 8.977 0.020 1 806 227 227 CYS CA C 55.530 0.3 1 807 227 227 CYS CB C 31.209 0.3 1 808 227 227 CYS N N 117.499 0.3 1 809 228 228 ASN H H 9.450 0.020 1 810 228 228 ASN CA C 53.747 0.3 1 811 228 228 ASN CB C 36.470 0.3 1 812 228 228 ASN N N 120.150 0.3 1 813 229 229 VAL H H 7.628 0.020 1 814 229 229 VAL CA C 62.439 0.3 1 815 229 229 VAL CB C 30.604 0.3 1 816 229 229 VAL N N 119.645 0.3 1 817 230 230 LEU H H 9.004 0.020 1 818 230 230 LEU CA C 52.649 0.3 1 819 230 230 LEU CB C 44.574 0.3 1 820 230 230 LEU N N 130.284 0.3 1 821 231 231 LYS H H 8.752 0.020 1 822 231 231 LYS CA C 56.921 0.3 1 823 231 231 LYS CB C 31.753 0.3 1 824 231 231 LYS N N 126.247 0.3 1 825 232 232 ILE H H 8.390 0.020 1 826 232 232 ILE CA C 58.557 0.3 1 827 232 232 ILE CB C 37.075 0.3 1 828 232 232 ILE N N 126.273 0.3 1 829 233 233 ASN H H 8.388 0.020 1 830 233 233 ASN CA C 52.868 0.3 1 831 233 233 ASN CB C 38.647 0.3 1 832 233 233 ASN N N 122.641 0.3 1 833 234 234 ASP H H 7.862 0.020 1 834 234 234 ASP CA C 55.334 0.3 1 835 234 234 ASP CB C 41.369 0.3 1 836 234 234 ASP N N 126.413 0.3 1 stop_ save_