data_27462 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone chemical shift assignments for Apo form of Biliverdin reductase B ; _BMRB_accession_number 27462 _BMRB_flat_file_name bmr27462.str _Entry_type original _Submission_date 2018-04-23 _Accession_date 2018-04-23 _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 Paukovich Natasia A. . 2 Eisenmesser Elan Z. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 537 "13C chemical shifts" 558 "15N chemical shifts" 184 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-09-18 original BMRB . stop_ loop_ _Related_BMRB_accession_number _Relationship 27463 'Holo form of Biliverdin reductase B' stop_ _Original_release_date 2018-04-23 save_ ############################# # Citation for this entry # ############################# save_BLVRB_citaiton_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Biliverdin Reductase B Dynamics Are Coupled to Coenzyme Binding. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29932944 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Paukovich Natasia . . 2 Xue Mengjun . . 3 Elder James R. . 4 Redzic Jasmina S. . 5 Blue Ashley . . 6 Pike Hamish . . 7 Miller Brian G. . 8 Pitts Todd M. . 9 Pollock David D. . 10 Hansen Kirk . . 11 D'Alessandro Angelo . . 12 Eisenmesser 'Elan Zohar' Z. . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_name_full 'Journal of molecular biology' _Journal_volume 430 _Journal_issue '18 Pt B' _Journal_ISSN 1089-8638 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 3234 _Page_last 3250 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Biliverdin reductase B' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label BLVRB $BLVRB stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function 'reduce flavins' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_BLVRB _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common BLVRB _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 206 _Mol_residue_sequence ; MAVKKIAIFGATGQTGLTTL AQAVQAGYEVTVLVRDSSRL PSEGPRPAHVVVGDVLQAAD VDKTVAGQDAVIVLLGTRND LSPTTVMSEGARNIVAAMKA HGVDKVVACTSAFLLWDPTK VPPRLQAVTDDHIRMHKVLR ESGLKYVAVMPPHIGDQPLT GAYTVTLDGRGPSRVISKHD LGHFMLRCLTTDEYDGHSTY PSHQYQ ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 VAL 4 LYS 5 LYS 6 ILE 7 ALA 8 ILE 9 PHE 10 GLY 11 ALA 12 THR 13 GLY 14 GLN 15 THR 16 GLY 17 LEU 18 THR 19 THR 20 LEU 21 ALA 22 GLN 23 ALA 24 VAL 25 GLN 26 ALA 27 GLY 28 TYR 29 GLU 30 VAL 31 THR 32 VAL 33 LEU 34 VAL 35 ARG 36 ASP 37 SER 38 SER 39 ARG 40 LEU 41 PRO 42 SER 43 GLU 44 GLY 45 PRO 46 ARG 47 PRO 48 ALA 49 HIS 50 VAL 51 VAL 52 VAL 53 GLY 54 ASP 55 VAL 56 LEU 57 GLN 58 ALA 59 ALA 60 ASP 61 VAL 62 ASP 63 LYS 64 THR 65 VAL 66 ALA 67 GLY 68 GLN 69 ASP 70 ALA 71 VAL 72 ILE 73 VAL 74 LEU 75 LEU 76 GLY 77 THR 78 ARG 79 ASN 80 ASP 81 LEU 82 SER 83 PRO 84 THR 85 THR 86 VAL 87 MET 88 SER 89 GLU 90 GLY 91 ALA 92 ARG 93 ASN 94 ILE 95 VAL 96 ALA 97 ALA 98 MET 99 LYS 100 ALA 101 HIS 102 GLY 103 VAL 104 ASP 105 LYS 106 VAL 107 VAL 108 ALA 109 CYS 110 THR 111 SER 112 ALA 113 PHE 114 LEU 115 LEU 116 TRP 117 ASP 118 PRO 119 THR 120 LYS 121 VAL 122 PRO 123 PRO 124 ARG 125 LEU 126 GLN 127 ALA 128 VAL 129 THR 130 ASP 131 ASP 132 HIS 133 ILE 134 ARG 135 MET 136 HIS 137 LYS 138 VAL 139 LEU 140 ARG 141 GLU 142 SER 143 GLY 144 LEU 145 LYS 146 TYR 147 VAL 148 ALA 149 VAL 150 MET 151 PRO 152 PRO 153 HIS 154 ILE 155 GLY 156 ASP 157 GLN 158 PRO 159 LEU 160 THR 161 GLY 162 ALA 163 TYR 164 THR 165 VAL 166 THR 167 LEU 168 ASP 169 GLY 170 ARG 171 GLY 172 PRO 173 SER 174 ARG 175 VAL 176 ILE 177 SER 178 LYS 179 HIS 180 ASP 181 LEU 182 GLY 183 HIS 184 PHE 185 MET 186 LEU 187 ARG 188 CYS 189 LEU 190 THR 191 THR 192 ASP 193 GLU 194 TYR 195 ASP 196 GLY 197 HIS 198 SER 199 THR 200 TYR 201 PRO 202 SER 203 HIS 204 GLN 205 TYR 206 GLN stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $BLVRB Human 9606 Eukaryota Metazoa Homo sapiens 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 _Details $BLVRB 'recombinant technology' . Escherichia coli . pET21 '37 degree growth' stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_apo_1 _Saveframe_category sample _Sample_type solution _Details 'free enzyme' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $BLVRB 500 uM '[U-100% 13C; U-100% 15N; U-80% 2H]' Bis-Tris 50 mM 'natural abundance' NaCl 50 mM 'natural abundance' DTT 1 mM 'natural abundance' stop_ save_ save_apo_2 _Saveframe_category sample _Sample_type solution _Details 'free enzyme' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $BLVRB 500 uM '[U-100% 15N]' Bis-Tris 50 mM 'natural abundance' NaCl 50 mM 'natural abundance' DTT 1 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CcpNMR _Saveframe_category software _Name CcpNMR _Version . loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HN(CO)CA_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $apo_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $apo_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $apo_1 save_ save_3D_HN(COCA)CB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(COCA)CB' _Sample_label $apo_1 save_ save_3D_1H-15N_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $apo_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details '50mM Bis-Tris buffer' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 50 . mM pH 6.5 . pH pressure 1 . atm temperature 273 . 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 DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na 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 '3D HN(CO)CA' '3D HNCA' '3D HNCACB' '3D HN(COCA)CB' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $apo_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name BLVRB _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 MET H H 8.360 . . 2 1 1 MET CA C 55.066 . . 3 1 1 MET CB C 32.809 . . 4 1 1 MET N N 121.855 . . 5 2 2 ALA H H 8.314 . . 6 2 2 ALA HA H 4.435 . . 7 2 2 ALA HB H 1.344 . . 8 2 2 ALA CA C 51.813 . . 9 2 2 ALA CB C 18.746 . . 10 2 2 ALA N N 125.276 . . 11 3 3 VAL H H 8.312 . . 12 3 3 VAL HA H 3.901 . . 13 3 3 VAL HB H 2.093 . . 14 3 3 VAL C C 174.629 . . 15 3 3 VAL CA C 62.676 . . 16 3 3 VAL CB C 32.366 . . 17 3 3 VAL N N 121.394 . . 18 4 4 LYS H H 9.189 . . 19 4 4 LYS C C 175.319 . . 20 4 4 LYS CA C 57.056 . . 21 4 4 LYS CB C 35.634 . . 22 4 4 LYS N N 126.053 . . 23 5 5 LYS H H 8.899 . . 24 5 5 LYS HA H 3.866 . . 25 5 5 LYS C C 176.707 . . 26 5 5 LYS CA C 55.281 . . 27 5 5 LYS CB C 32.717 . . 28 5 5 LYS N N 122.682 . . 29 6 6 ILE H H 8.281 . . 30 6 6 ILE C C 173.953 . . 31 6 6 ILE CA C 57.835 . . 32 6 6 ILE CB C 41.792 . . 33 6 6 ILE N N 115.781 . . 34 7 7 ALA H H 7.636 . . 35 7 7 ALA HA H 5.672 . . 36 7 7 ALA HB H 1.036 . . 37 7 7 ALA C C 176.570 . . 38 7 7 ALA CA C 48.482 . . 39 7 7 ALA CB C 21.602 . . 40 7 7 ALA N N 120.723 . . 41 8 8 ILE H H 8.256 . . 42 8 8 ILE HA H 4.947 . . 43 8 8 ILE C C 175.426 . . 44 8 8 ILE CA C 60.182 . . 45 8 8 ILE CB C 40.660 . . 46 8 8 ILE N N 117.016 . . 47 9 9 PHE H H 8.832 . . 48 9 9 PHE C C 175.271 . . 49 9 9 PHE CA C 57.343 . . 50 9 9 PHE CB C 40.392 . . 51 9 9 PHE N N 127.208 . . 52 10 10 GLY H H 9.381 . . 53 10 10 GLY HA2 H 4.356 . . 54 10 10 GLY HA3 H 4.172 . . 55 10 10 GLY C C 176.542 . . 56 10 10 GLY CA C 45.630 . . 57 10 10 GLY N N 114.339 . . 58 11 11 ALA H H 9.161 . . 59 11 11 ALA HA H 3.675 . . 60 11 11 ALA HB H 1.231 . . 61 11 11 ALA C C 174.560 . . 62 11 11 ALA CA C 53.975 . . 63 11 11 ALA CB C 19.332 . . 64 11 11 ALA N N 121.775 . . 65 12 12 THR H H 7.479 . . 66 12 12 THR HA H 4.301 . . 67 12 12 THR C C 176.447 . . 68 12 12 THR CA C 61.267 . . 69 12 12 THR CB C 68.544 . . 70 12 12 THR CG2 C 24.117 . . 71 12 12 THR N N 131.637 . . 72 13 13 GLY H H 7.365 . . 73 13 13 GLY HA2 H 4.280 . . 74 13 13 GLY HA3 H 4.280 . . 75 13 13 GLY C C 173.655 . . 76 13 13 GLY CA C 44.414 . . 77 13 13 GLY N N 108.217 . . 78 14 14 GLN H H 8.661 . . 79 14 14 GLN HA H 3.941 . . 80 14 14 GLN C C 179.634 . . 81 14 14 GLN CA C 59.601 . . 82 14 14 GLN CB C 28.082 . . 83 14 14 GLN N N 117.358 . . 84 15 15 THR H H 8.477 . . 85 15 15 THR HA H 3.909 . . 86 15 15 THR C C 177.614 . . 87 15 15 THR CA C 65.553 . . 88 15 15 THR CB C 67.210 . . 89 15 15 THR CG2 C 21.296 . . 90 15 15 THR N N 114.896 . . 91 16 16 GLY H H 8.737 . . 92 16 16 GLY HA2 H 3.352 . . 93 16 16 GLY HA3 H 4.114 . . 94 16 16 GLY C C 175.149 . . 95 16 16 GLY CA C 48.245 . . 96 16 16 GLY N N 116.701 . . 97 17 17 LEU H H 8.465 . . 98 17 17 LEU HA H 4.208 . . 99 17 17 LEU HB2 H 1.465 . . 100 17 17 LEU HB3 H 1.787 . . 101 17 17 LEU C C 180.999 . . 102 17 17 LEU CA C 58.346 . . 103 17 17 LEU CB C 42.162 . . 104 17 17 LEU N N 121.205 . . 105 18 18 THR H H 6.963 . . 106 18 18 THR HA H 4.812 . . 107 18 18 THR HB H 4.362 . . 108 18 18 THR C C 175.574 . . 109 18 18 THR CA C 62.133 . . 110 18 18 THR CB C 67.591 . . 111 18 18 THR N N 111.766 . . 112 19 19 THR H H 8.010 . . 113 19 19 THR HA H 4.035 . . 114 19 19 THR HB H 3.608 . . 115 19 19 THR C C 175.649 . . 116 19 19 THR CA C 68.449 . . 117 19 19 THR CB C 67.155 . . 118 19 19 THR N N 122.976 . . 119 20 20 LEU H H 8.864 . . 120 20 20 LEU HA H 3.737 . . 121 20 20 LEU HB2 H 1.434 . . 122 20 20 LEU HB3 H 2.239 . . 123 20 20 LEU C C 177.021 . . 124 20 20 LEU CA C 58.632 . . 125 20 20 LEU CB C 41.396 . . 126 20 20 LEU N N 121.350 . . 127 21 21 ALA H H 7.763 . . 128 21 21 ALA HA H 3.877 . . 129 21 21 ALA HB H 1.624 . . 130 21 21 ALA C C 180.390 . . 131 21 21 ALA CA C 55.455 . . 132 21 21 ALA CB C 17.808 . . 133 21 21 ALA N N 119.876 . . 134 22 22 GLN H H 8.538 . . 135 22 22 GLN HA H 4.007 . . 136 22 22 GLN HB2 H 2.079 . . 137 22 22 GLN HG2 H 2.832 . . 138 22 22 GLN HG3 H 2.122 . . 139 22 22 GLN C C 179.376 . . 140 22 22 GLN CA C 59.197 . . 141 22 22 GLN CB C 30.399 . . 142 22 22 GLN CG C 36.094 . . 143 22 22 GLN N N 115.945 . . 144 23 23 ALA H H 8.953 . . 145 23 23 ALA HA H 4.156 . . 146 23 23 ALA HB H 1.451 . . 147 23 23 ALA C C 179.369 . . 148 23 23 ALA CA C 54.655 . . 149 23 23 ALA CB C 18.523 . . 150 23 23 ALA N N 123.848 . . 151 24 24 VAL H H 8.406 . . 152 24 24 VAL HA H 3.791 . . 153 24 24 VAL HB H 2.038 . . 154 24 24 VAL C C 181.601 . . 155 24 24 VAL CA C 66.230 . . 156 24 24 VAL CB C 31.808 . . 157 24 24 VAL N N 118.876 . . 158 25 25 GLN H H 8.210 . . 159 25 25 GLN HA H 4.090 . . 160 25 25 GLN HB2 H 2.158 . . 161 25 25 GLN HB3 H 2.190 . . 162 25 25 GLN HG2 H 2.474 . . 163 25 25 GLN HG3 H 2.525 . . 164 25 25 GLN C C 177.248 . . 165 25 25 GLN CA C 58.694 . . 166 25 25 GLN CB C 28.052 . . 167 25 25 GLN CG C 34.215 . . 168 25 25 GLN N N 120.401 . . 169 26 26 ALA H H 7.761 . . 170 26 26 ALA HA H 4.319 . . 171 26 26 ALA HB H 1.567 . . 172 26 26 ALA C C 177.554 . . 173 26 26 ALA CA C 52.219 . . 174 26 26 ALA CB C 18.595 . . 175 26 26 ALA N N 118.983 . . 176 27 27 GLY H H 7.660 . . 177 27 27 GLY HA2 H 4.197 . . 178 27 27 GLY HA3 H 3.723 . . 179 27 27 GLY C C 175.334 . . 180 27 27 GLY CA C 44.841 . . 181 27 27 GLY N N 104.404 . . 182 28 28 TYR H H 7.695 . . 183 28 28 TYR HA H 4.485 . . 184 28 28 TYR HB2 H 2.633 . . 185 28 28 TYR HB3 H 2.428 . . 186 28 28 TYR C C 175.540 . . 187 28 28 TYR CA C 59.379 . . 188 28 28 TYR CB C 37.957 . . 189 28 28 TYR N N 117.820 . . 190 29 29 GLU H H 9.023 . . 191 29 29 GLU HA H 4.633 . . 192 29 29 GLU HB2 H 2.110 . . 193 29 29 GLU HB3 H 2.110 . . 194 29 29 GLU C C 176.470 . . 195 29 29 GLU CA C 55.043 . . 196 29 29 GLU CB C 29.254 . . 197 29 29 GLU N N 125.621 . . 198 30 30 VAL H H 9.303 . . 199 30 30 VAL HA H 4.715 . . 200 30 30 VAL HB H 1.908 . . 201 30 30 VAL C C 175.534 . . 202 30 30 VAL CA C 62.528 . . 203 30 30 VAL CB C 33.479 . . 204 30 30 VAL CG1 C 21.956 . . 205 30 30 VAL N N 130.978 . . 206 31 31 THR H H 9.354 . . 207 31 31 THR HA H 5.614 . . 208 31 31 THR HB H 3.803 . . 209 31 31 THR HG2 H 1.108 . . 210 31 31 THR C C 173.526 . . 211 31 31 THR CA C 61.276 . . 212 31 31 THR CB C 70.143 . . 213 31 31 THR CG2 C 20.492 . . 214 31 31 THR N N 125.665 . . 215 32 32 VAL H H 8.220 . . 216 32 32 VAL HA H 4.970 . . 217 32 32 VAL HB H 2.179 . . 218 32 32 VAL C C 172.173 . . 219 32 32 VAL CA C 57.593 . . 220 32 32 VAL CB C 33.182 . . 221 32 32 VAL N N 115.629 . . 222 33 33 LEU H H 5.884 . . 223 33 33 LEU HA H 5.581 . . 224 33 33 LEU C C 176.875 . . 225 33 33 LEU CA C 53.219 . . 226 33 33 LEU CB C 41.513 . . 227 33 33 LEU N N 122.115 . . 228 34 34 VAL H H 9.123 . . 229 34 34 VAL HA H 5.093 . . 230 34 34 VAL HB H 2.162 . . 231 34 34 VAL HG1 H 0.860 . . 232 34 34 VAL HG2 H 0.602 . . 233 34 34 VAL C C 174.278 . . 234 34 34 VAL CA C 58.112 . . 235 34 34 VAL CB C 34.904 . . 236 34 34 VAL N N 121.769 . . 237 35 35 ARG H H 8.725 . . 238 35 35 ARG HA H 4.540 . . 239 35 35 ARG C C 176.866 . . 240 35 35 ARG CA C 57.394 . . 241 35 35 ARG CB C 30.380 . . 242 35 35 ARG N N 122.344 . . 243 36 36 ASP H H 7.430 . . 244 36 36 ASP HA H 4.779 . . 245 36 36 ASP HB2 H 2.666 . . 246 36 36 ASP HB3 H 2.650 . . 247 36 36 ASP C C 176.906 . . 248 36 36 ASP CA C 52.620 . . 249 36 36 ASP CB C 42.450 . . 250 36 36 ASP N N 114.350 . . 251 37 37 SER H H 9.200 . . 252 37 37 SER HA H 3.899 . . 253 37 37 SER HB2 H 3.650 . . 254 37 37 SER C C 176.053 . . 255 37 37 SER CA C 60.747 . . 256 37 37 SER N N 120.333 . . 257 38 38 SER H H 8.808 . . 258 38 38 SER HA H 4.418 . . 259 38 38 SER HB2 H 3.975 . . 260 38 38 SER HB3 H 4.012 . . 261 38 38 SER C C 174.871 . . 262 38 38 SER CA C 60.439 . . 263 38 38 SER CB C 62.835 . . 264 38 38 SER N N 119.287 . . 265 39 39 ARG H H 7.418 . . 266 39 39 ARG HA H 3.983 . . 267 39 39 ARG HB2 H 2.203 . . 268 39 39 ARG HB3 H 2.450 . . 269 39 39 ARG CA C 55.435 . . 270 39 39 ARG CB C 29.532 . . 271 39 39 ARG N N 118.352 . . 272 40 40 LEU H H 7.203 . . 273 40 40 LEU CA C 52.053 . . 274 40 40 LEU CB C 40.013 . . 275 40 40 LEU N N 119.290 . . 276 41 41 PRO HA H 4.454 . . 277 41 41 PRO HB2 H 2.018 . . 278 41 41 PRO HB3 H 2.428 . . 279 41 41 PRO CA C 62.841 . . 280 41 41 PRO CB C 31.918 . . 281 41 41 PRO CG C 27.167 . . 282 42 42 SER H H 8.758 . . 283 42 42 SER HA H 4.312 . . 284 42 42 SER HB2 H 3.913 . . 285 42 42 SER HB3 H 3.937 . . 286 42 42 SER CA C 59.372 . . 287 42 42 SER CB C 63.442 . . 288 42 42 SER N N 118.028 . . 289 43 43 GLU H H 7.955 . . 290 43 43 GLU HA H 4.551 . . 291 43 43 GLU HB2 H 1.940 . . 292 43 43 GLU HB3 H 2.007 . . 293 43 43 GLU HG2 H 2.089 . . 294 43 43 GLU CA C 55.058 . . 295 43 43 GLU CB C 30.701 . . 296 43 43 GLU CG C 35.370 . . 297 43 43 GLU N N 119.481 . . 298 44 44 GLY H H 8.179 . . 299 44 44 GLY HA2 H 4.174 . . 300 44 44 GLY HA3 H 3.957 . . 301 44 44 GLY CA C 44.204 . . 302 44 44 GLY N N 108.906 . . 303 45 45 PRO CA C 61.513 . . 304 45 45 PRO CB C 34.258 . . 305 46 46 ARG H H 8.844 . . 306 46 46 ARG CA C 52.955 . . 307 46 46 ARG CB C 29.564 . . 308 46 46 ARG N N 123.489 . . 309 47 47 PRO HA H 4.231 . . 310 47 47 PRO HB2 H 1.929 . . 311 47 47 PRO HB3 H 1.929 . . 312 47 47 PRO C C 174.509 . . 313 47 47 PRO CA C 61.508 . . 314 47 47 PRO CB C 31.046 . . 315 48 48 ALA H H 7.661 . . 316 48 48 ALA HA H 4.028 . . 317 48 48 ALA HB H 1.167 . . 318 48 48 ALA C C 177.851 . . 319 48 48 ALA CA C 53.958 . . 320 48 48 ALA CB C 19.075 . . 321 48 48 ALA N N 123.410 . . 322 49 49 HIS H H 7.984 . . 323 49 49 HIS HA H 5.030 . . 324 49 49 HIS HB2 H 3.268 . . 325 49 49 HIS HB3 H 3.268 . . 326 49 49 HIS C C 173.374 . . 327 49 49 HIS CA C 53.239 . . 328 49 49 HIS CB C 31.213 . . 329 49 49 HIS N N 111.434 . . 330 50 50 VAL H H 8.931 . . 331 50 50 VAL HA H 4.317 . . 332 50 50 VAL HB H 1.921 . . 333 50 50 VAL C C 174.727 . . 334 50 50 VAL CA C 61.594 . . 335 50 50 VAL CB C 33.620 . . 336 50 50 VAL N N 125.172 . . 337 51 51 VAL H H 9.057 . . 338 51 51 VAL HA H 2.324 . . 339 51 51 VAL HB H 1.994 . . 340 51 51 VAL HG1 H 4.113 . . 341 51 51 VAL HG2 H 4.113 . . 342 51 51 VAL C C 174.405 . . 343 51 51 VAL CA C 61.030 . . 344 51 51 VAL CB C 32.169 . . 345 51 51 VAL N N 131.616 . . 346 52 52 VAL H H 8.420 . . 347 52 52 VAL HA H 5.122 . . 348 52 52 VAL HB H 1.935 . . 349 52 52 VAL HG1 H 0.860 . . 350 52 52 VAL HG2 H 0.860 . . 351 52 52 VAL C C 176.717 . . 352 52 52 VAL CA C 60.097 . . 353 52 52 VAL CB C 31.342 . . 354 52 52 VAL N N 128.417 . . 355 53 53 GLY H H 8.631 . . 356 53 53 GLY HA2 H 3.786 . . 357 53 53 GLY HA3 H 4.050 . . 358 53 53 GLY C C 170.785 . . 359 53 53 GLY CA C 45.757 . . 360 53 53 GLY N N 116.486 . . 361 54 54 ASP H H 9.581 . . 362 54 54 ASP HA H 4.846 . . 363 54 54 ASP HB2 H 2.610 . . 364 54 54 ASP HB3 H 2.573 . . 365 54 54 ASP C C 176.389 . . 366 54 54 ASP CA C 52.668 . . 367 54 54 ASP CB C 45.791 . . 368 54 54 ASP N N 120.792 . . 369 55 55 VAL H H 8.268 . . 370 55 55 VAL HA H 3.812 . . 371 55 55 VAL HB H 9.919 . . 372 55 55 VAL C C 174.303 . . 373 55 55 VAL CA C 62.425 . . 374 55 55 VAL CB C 31.588 . . 375 55 55 VAL CG1 C 22.503 . . 376 55 55 VAL CG2 C 19.106 . . 377 55 55 VAL N N 124.469 . . 378 56 56 LEU H H 8.252 . . 379 56 56 LEU HA H 3.981 . . 380 56 56 LEU HB2 H 1.561 . . 381 56 56 LEU HB3 H 1.561 . . 382 56 56 LEU C C 177.466 . . 383 56 56 LEU CA C 54.638 . . 384 56 56 LEU CB C 39.622 . . 385 56 56 LEU N N 117.132 . . 386 57 57 GLN H H 8.131 . . 387 57 57 GLN HA H 4.596 . . 388 57 57 GLN HB2 H 2.221 . . 389 57 57 GLN HB3 H 2.221 . . 390 57 57 GLN C C 175.531 . . 391 57 57 GLN CA C 53.350 . . 392 57 57 GLN CB C 27.658 . . 393 57 57 GLN N N 120.907 . . 394 58 58 ALA H H 9.052 . . 395 58 58 ALA HA H 3.664 . . 396 58 58 ALA HB H 1.426 . . 397 58 58 ALA C C 179.735 . . 398 58 58 ALA CA C 56.183 . . 399 58 58 ALA CB C 17.838 . . 400 58 58 ALA N N 130.552 . . 401 59 59 ALA H H 8.994 . . 402 59 59 ALA HA H 4.183 . . 403 59 59 ALA HB H 1.449 . . 404 59 59 ALA C C 180.243 . . 405 59 59 ALA CA C 54.759 . . 406 59 59 ALA CB C 18.022 . . 407 59 59 ALA N N 117.812 . . 408 60 60 ASP H H 7.140 . . 409 60 60 ASP HA H 4.325 . . 410 60 60 ASP HB2 H 2.419 . . 411 60 60 ASP HB3 H 3.401 . . 412 60 60 ASP C C 178.732 . . 413 60 60 ASP CA C 56.701 . . 414 60 60 ASP CB C 39.415 . . 415 60 60 ASP N N 119.524 . . 416 61 61 VAL H H 7.587 . . 417 61 61 VAL HA H 3.493 . . 418 61 61 VAL HB H 2.075 . . 419 61 61 VAL C C 178.210 . . 420 61 61 VAL CA C 66.892 . . 421 61 61 VAL CB C 31.038 . . 422 61 61 VAL N N 121.552 . . 423 62 62 ASP H H 8.762 . . 424 62 62 ASP HA H 4.162 . . 425 62 62 ASP HB2 H 2.793 . . 426 62 62 ASP HB3 H 2.793 . . 427 62 62 ASP C C 176.918 . . 428 62 62 ASP CA C 59.219 . . 429 62 62 ASP CB C 42.314 . . 430 62 62 ASP N N 121.684 . . 431 63 63 LYS H H 7.261 . . 432 63 63 LYS HA H 4.017 . . 433 63 63 LYS C C 177.719 . . 434 63 63 LYS CA C 58.065 . . 435 63 63 LYS CB C 32.312 . . 436 63 63 LYS N N 113.189 . . 437 64 64 THR H H 7.406 . . 438 64 64 THR HA H 3.700 . . 439 64 64 THR HB H 4.350 . . 440 64 64 THR HG2 H 0.587 . . 441 64 64 THR C C 173.465 . . 442 64 64 THR CA C 65.899 . . 443 64 64 THR CB C 68.290 . . 444 64 64 THR CG2 C 21.143 . . 445 64 64 THR N N 116.054 . . 446 65 65 VAL H H 7.810 . . 447 65 65 VAL HA H 3.385 . . 448 65 65 VAL HB H 1.843 . . 449 65 65 VAL C C 174.533 . . 450 65 65 VAL CA C 64.385 . . 451 65 65 VAL CB C 32.243 . . 452 65 65 VAL N N 117.952 . . 453 66 66 ALA H H 7.109 . . 454 66 66 ALA HA H 2.913 . . 455 66 66 ALA HB H 0.788 . . 456 66 66 ALA C C 178.663 . . 457 66 66 ALA CA C 53.927 . . 458 66 66 ALA CB C 17.070 . . 459 66 66 ALA N N 120.503 . . 460 67 67 GLY H H 8.239 . . 461 67 67 GLY HA2 H 3.686 . . 462 67 67 GLY HA3 H 3.934 . . 463 67 67 GLY C C 174.883 . . 464 67 67 GLY CA C 45.633 . . 465 67 67 GLY N N 109.673 . . 466 68 68 GLN H H 7.382 . . 467 68 68 GLN HA H 4.506 . . 468 68 68 GLN HB2 H 2.377 . . 469 68 68 GLN HB3 H 1.634 . . 470 68 68 GLN C C 175.525 . . 471 68 68 GLN CA C 53.505 . . 472 68 68 GLN CB C 27.581 . . 473 68 68 GLN N N 115.027 . . 474 69 69 ASP H H 9.199 . . 475 69 69 ASP HA H 5.033 . . 476 69 69 ASP HB2 H 3.096 . . 477 69 69 ASP HB3 H 3.042 . . 478 69 69 ASP C C 176.772 . . 479 69 69 ASP CA C 55.783 . . 480 69 69 ASP CB C 44.010 . . 481 69 69 ASP N N 116.050 . . 482 70 70 ALA H H 7.858 . . 483 70 70 ALA HA H 4.867 . . 484 70 70 ALA HB H 1.314 . . 485 70 70 ALA C C 174.956 . . 486 70 70 ALA CA C 51.387 . . 487 70 70 ALA CB C 22.952 . . 488 70 70 ALA N N 116.941 . . 489 71 71 VAL H H 8.335 . . 490 71 71 VAL HA H 4.984 . . 491 71 71 VAL HB H 1.995 . . 492 71 71 VAL C C 173.789 . . 493 71 71 VAL CA C 60.656 . . 494 71 71 VAL CB C 35.714 . . 495 71 71 VAL CG1 C 21.282 . . 496 71 71 VAL N N 116.831 . . 497 72 72 ILE H H 9.081 . . 498 72 72 ILE HA H 5.917 . . 499 72 72 ILE HB H 1.791 . . 500 72 72 ILE C C 175.071 . . 501 72 72 ILE CA C 59.515 . . 502 72 72 ILE CB C 39.421 . . 503 72 72 ILE N N 125.077 . . 504 73 73 VAL H H 9.245 . . 505 73 73 VAL C C 173.981 . . 506 73 73 VAL CA C 62.575 . . 507 73 73 VAL CB C 32.683 . . 508 73 73 VAL N N 127.117 . . 509 74 74 LEU H H 8.655 . . 510 74 74 LEU C C 176.330 . . 511 74 74 LEU CA C 53.651 . . 512 74 74 LEU CB C 41.531 . . 513 74 74 LEU N N 131.678 . . 514 75 75 LEU H H 6.542 . . 515 75 75 LEU C C 177.219 . . 516 75 75 LEU CA C 54.792 . . 517 75 75 LEU CB C 42.741 . . 518 75 75 LEU N N 116.380 . . 519 76 76 GLY H H 8.480 . . 520 76 76 GLY HA2 H 4.122 . . 521 76 76 GLY HA3 H 4.507 . . 522 76 76 GLY C C 173.648 . . 523 76 76 GLY CA C 45.060 . . 524 76 76 GLY N N 108.609 . . 525 77 77 THR H H 8.237 . . 526 77 77 THR CA C 60.852 . . 527 77 77 THR CB C 69.526 . . 528 77 77 THR N N 111.819 . . 529 78 78 ARG H H 8.561 . . 530 78 78 ARG CA C 56.477 . . 531 78 78 ARG CB C 26.865 . . 532 78 78 ARG N N 122.728 . . 533 79 79 ASN H H 8.542 . . 534 79 79 ASN HA H 4.700 . . 535 79 79 ASN HB2 H 2.924 . . 536 79 79 ASN HB3 H 2.924 . . 537 79 79 ASN C C 174.429 . . 538 79 79 ASN CA C 53.478 . . 539 79 79 ASN CB C 38.332 . . 540 79 79 ASN N N 117.597 . . 541 80 80 ASP H H 7.834 . . 542 80 80 ASP HB2 H 2.726 . . 543 80 80 ASP HB3 H 2.726 . . 544 80 80 ASP C C 176.395 . . 545 80 80 ASP CA C 54.321 . . 546 80 80 ASP CB C 40.995 . . 547 80 80 ASP N N 120.285 . . 548 81 81 LEU H H 8.444 . . 549 81 81 LEU HA H 4.460 . . 550 81 81 LEU HB2 H 1.788 . . 551 81 81 LEU HB3 H 1.788 . . 552 81 81 LEU C C 177.474 . . 553 81 81 LEU CA C 54.658 . . 554 81 81 LEU CB C 41.209 . . 555 81 81 LEU N N 122.386 . . 556 82 82 SER H H 7.816 . . 557 82 82 SER HA H 4.615 . . 558 82 82 SER HB2 H 3.899 . . 559 82 82 SER HB3 H 3.828 . . 560 82 82 SER C C 171.288 . . 561 82 82 SER CA C 57.471 . . 562 82 82 SER CB C 62.513 . . 563 82 82 SER N N 117.441 . . 564 83 83 PRO HA H 4.403 . . 565 83 83 PRO CA C 63.408 . . 566 83 83 PRO CB C 31.361 . . 567 84 84 THR H H 8.220 . . 568 84 84 THR HA H 4.676 . . 569 84 84 THR C C 172.563 . . 570 84 84 THR CA C 60.492 . . 571 84 84 THR CB C 69.802 . . 572 84 84 THR N N 116.341 . . 573 85 85 THR H H 8.002 . . 574 85 85 THR C C 175.344 . . 575 85 85 THR CA C 60.517 . . 576 85 85 THR CB C 68.970 . . 577 85 85 THR N N 112.574 . . 578 86 86 VAL H H 8.079 . . 579 86 86 VAL CA C 64.918 . . 580 86 86 VAL CB C 31.418 . . 581 86 86 VAL N N 118.969 . . 582 87 87 MET H H 7.632 . . 583 87 87 MET HA H 4.046 . . 584 87 87 MET C C 178.543 . . 585 87 87 MET CA C 58.897 . . 586 87 87 MET CB C 31.440 . . 587 87 87 MET N N 116.121 . . 588 88 88 SER H H 9.013 . . 589 88 88 SER C C 177.222 . . 590 88 88 SER CA C 62.235 . . 591 88 88 SER CB C 60.771 . . 592 88 88 SER N N 116.991 . . 593 89 89 GLU H H 8.739 . . 594 89 89 GLU HA H 4.056 . . 595 89 89 GLU HB2 H 1.996 . . 596 89 89 GLU C C 179.898 . . 597 89 89 GLU CA C 59.207 . . 598 89 89 GLU CB C 28.860 . . 599 89 89 GLU N N 123.485 . . 600 90 90 GLY H H 8.133 . . 601 90 90 GLY HA2 H 3.720 . . 602 90 90 GLY HA3 H 3.461 . . 603 90 90 GLY C C 175.600 . . 604 90 90 GLY CA C 47.456 . . 605 90 90 GLY N N 107.968 . . 606 91 91 ALA H H 8.436 . . 607 91 91 ALA HA H 3.756 . . 608 91 91 ALA HB H 1.362 . . 609 91 91 ALA C C 178.462 . . 610 91 91 ALA CA C 55.233 . . 611 91 91 ALA CB C 17.426 . . 612 91 91 ALA N N 121.966 . . 613 92 92 ARG H H 8.095 . . 614 92 92 ARG HA H 3.707 . . 615 92 92 ARG HB2 H 1.951 . . 616 92 92 ARG HB3 H 1.945 . . 617 92 92 ARG C C 179.463 . . 618 92 92 ARG CA C 60.168 . . 619 92 92 ARG CB C 29.433 . . 620 92 92 ARG N N 118.388 . . 621 93 93 ASN H H 7.660 . . 622 93 93 ASN HA H 4.559 . . 623 93 93 ASN HB2 H 3.220 . . 624 93 93 ASN HB3 H 2.489 . . 625 93 93 ASN C C 178.280 . . 626 93 93 ASN CA C 55.223 . . 627 93 93 ASN CB C 37.024 . . 628 93 93 ASN N N 118.036 . . 629 94 94 ILE H H 8.398 . . 630 94 94 ILE HA H 3.188 . . 631 94 94 ILE HB H 1.585 . . 632 94 94 ILE HG2 H 0.501 . . 633 94 94 ILE C C 177.097 . . 634 94 94 ILE CA C 66.010 . . 635 94 94 ILE CB C 38.191 . . 636 94 94 ILE CG2 C 17.191 . . 637 94 94 ILE N N 123.798 . . 638 95 95 VAL H H 8.658 . . 639 95 95 VAL HA H 3.481 . . 640 95 95 VAL HB H 2.037 . . 641 95 95 VAL C C 177.466 . . 642 95 95 VAL CA C 66.526 . . 643 95 95 VAL CB C 31.263 . . 644 95 95 VAL N N 118.966 . . 645 96 96 ALA H H 7.664 . . 646 96 96 ALA HA H 4.063 . . 647 96 96 ALA HB H 1.522 . . 648 96 96 ALA C C 180.994 . . 649 96 96 ALA CA C 55.006 . . 650 96 96 ALA CB C 17.618 . . 651 96 96 ALA N N 120.327 . . 652 97 97 ALA H H 7.814 . . 653 97 97 ALA HA H 4.420 . . 654 97 97 ALA HB H 1.546 . . 655 97 97 ALA C C 179.723 . . 656 97 97 ALA CA C 54.424 . . 657 97 97 ALA CB C 19.146 . . 658 97 97 ALA N N 120.291 . . 659 98 98 MET H H 8.931 . . 660 98 98 MET HA H 3.638 . . 661 98 98 MET HB2 H 1.731 . . 662 98 98 MET HB3 H 1.731 . . 663 98 98 MET C C 179.144 . . 664 98 98 MET CA C 60.523 . . 665 98 98 MET CB C 32.193 . . 666 98 98 MET N N 119.200 . . 667 99 99 LYS H H 8.405 . . 668 99 99 LYS HA H 4.055 . . 669 99 99 LYS C C 179.881 . . 670 99 99 LYS CA C 59.035 . . 671 99 99 LYS CB C 31.681 . . 672 99 99 LYS N N 117.341 . . 673 100 100 ALA H H 7.841 . . 674 100 100 ALA HA H 4.042 . . 675 100 100 ALA HB H 1.281 . . 676 100 100 ALA C C 179.416 . . 677 100 100 ALA CA C 54.369 . . 678 100 100 ALA CB C 18.134 . . 679 100 100 ALA N N 120.774 . . 680 101 101 HIS H H 7.671 . . 681 101 101 HIS HA H 4.781 . . 682 101 101 HIS HB2 H 3.606 . . 683 101 101 HIS HB3 H 2.824 . . 684 101 101 HIS C C 175.055 . . 685 101 101 HIS CA C 56.062 . . 686 101 101 HIS CB C 30.443 . . 687 101 101 HIS N N 111.810 . . 688 102 102 GLY H H 7.688 . . 689 102 102 GLY HA2 H 3.979 . . 690 102 102 GLY HA3 H 3.979 . . 691 102 102 GLY C C 174.070 . . 692 102 102 GLY CA C 47.190 . . 693 102 102 GLY N N 110.873 . . 694 103 103 VAL H H 8.455 . . 695 103 103 VAL HA H 4.149 . . 696 103 103 VAL HB H 1.743 . . 697 103 103 VAL C C 176.465 . . 698 103 103 VAL CA C 61.606 . . 699 103 103 VAL CB C 31.921 . . 700 103 103 VAL N N 122.337 . . 701 104 104 ASP H H 8.574 . . 702 104 104 ASP HA H 4.923 . . 703 104 104 ASP HB2 H 2.725 . . 704 104 104 ASP HB3 H 2.600 . . 705 104 104 ASP C C 175.156 . . 706 104 104 ASP CA C 54.716 . . 707 104 104 ASP CB C 43.038 . . 708 104 104 ASP N N 124.961 . . 709 105 105 LYS H H 6.664 . . 710 105 105 LYS C C 173.488 . . 711 105 105 LYS CA C 54.723 . . 712 105 105 LYS CB C 34.266 . . 713 105 105 LYS N N 118.771 . . 714 106 106 VAL H H 9.317 . . 715 106 106 VAL HA H 5.531 . . 716 106 106 VAL HB H 1.800 . . 717 106 106 VAL C C 171.937 . . 718 106 106 VAL CA C 57.283 . . 719 106 106 VAL CB C 34.062 . . 720 106 106 VAL N N 126.075 . . 721 107 107 VAL H H 8.654 . . 722 107 107 VAL HA H 4.887 . . 723 107 107 VAL HB H 2.082 . . 724 107 107 VAL C C 175.168 . . 725 107 107 VAL CA C 60.218 . . 726 107 107 VAL CB C 33.446 . . 727 107 107 VAL N N 128.737 . . 728 108 108 ALA H H 8.677 . . 729 108 108 ALA HA H 5.680 . . 730 108 108 ALA HB H 1.407 . . 731 108 108 ALA C C 175.435 . . 732 108 108 ALA CA C 49.941 . . 733 108 108 ALA CB C 24.099 . . 734 108 108 ALA N N 125.137 . . 735 109 109 CYS H H 8.229 . . 736 109 109 CYS C C 174.607 . . 737 109 109 CYS CA C 57.433 . . 738 109 109 CYS CB C 29.370 . . 739 109 109 CYS N N 124.434 . . 740 110 110 THR H H 8.949 . . 741 110 110 THR C C 173.780 . . 742 110 110 THR CA C 60.388 . . 743 110 110 THR CB C 68.149 . . 744 110 110 THR N N 118.969 . . 745 111 111 SER H H 8.084 . . 746 111 111 SER C C 173.181 . . 747 111 111 SER CA C 57.328 . . 748 111 111 SER CB C 65.551 . . 749 111 111 SER N N 114.753 . . 750 112 112 ALA H H 8.247 . . 751 112 112 ALA C C 177.312 . . 752 112 112 ALA CA C 53.977 . . 753 112 112 ALA CB C 18.471 . . 754 112 112 ALA N N 125.403 . . 755 113 113 PHE H H 7.935 . . 756 113 113 PHE HA H 4.698 . . 757 113 113 PHE HB2 H 2.738 . . 758 113 113 PHE HB3 H 2.738 . . 759 113 113 PHE CA C 60.564 . . 760 113 113 PHE N N 115.388 . . 761 114 114 LEU H H 7.621 . . 762 114 114 LEU C C 177.921 . . 763 114 114 LEU CA C 58.834 . . 764 114 114 LEU CB C 40.209 . . 765 114 114 LEU N N 121.183 . . 766 115 115 LEU H H 7.935 . . 767 115 115 LEU HA H 4.494 . . 768 115 115 LEU C C 177.357 . . 769 115 115 LEU CA C 54.220 . . 770 115 115 LEU CB C 42.085 . . 771 115 115 LEU N N 118.760 . . 772 116 116 TRP H H 7.464 . . 773 116 116 TRP HE1 H 9.946 . . 774 116 116 TRP CA C 56.358 . . 775 116 116 TRP CB C 29.978 . . 776 116 116 TRP N N 121.244 . . 777 116 116 TRP NE1 N 128.070 . . 778 117 117 ASP H H 8.231 . . 779 117 117 ASP CA C 54.792 . . 780 117 117 ASP CB C 41.044 . . 781 117 117 ASP N N 120.646 . . 782 118 118 PRO C C 179.189 . . 783 118 118 PRO CA C 64.572 . . 784 118 118 PRO CB C 32.048 . . 785 119 119 THR H H 8.475 . . 786 119 119 THR C C 176.120 . . 787 119 119 THR CA C 63.239 . . 788 119 119 THR CB C 69.195 . . 789 119 119 THR N N 108.286 . . 790 120 120 LYS H H 8.213 . . 791 120 120 LYS C C 176.473 . . 792 120 120 LYS CA C 54.769 . . 793 120 120 LYS CB C 32.529 . . 794 120 120 LYS N N 120.406 . . 795 121 121 VAL H H 7.175 . . 796 121 121 VAL C C 174.335 . . 797 121 121 VAL CA C 60.841 . . 798 121 121 VAL CB C 32.303 . . 799 121 121 VAL N N 122.529 . . 800 123 123 PRO HA H 4.275 . . 801 123 123 PRO HB2 H 1.968 . . 802 123 123 PRO HB3 H 2.389 . . 803 123 123 PRO C C 179.571 . . 804 123 123 PRO CA C 65.694 . . 805 123 123 PRO CB C 31.481 . . 806 124 124 ARG H H 8.634 . . 807 124 124 ARG HA H 4.238 . . 808 124 124 ARG C C 176.818 . . 809 124 124 ARG CA C 57.763 . . 810 124 124 ARG CB C 28.790 . . 811 124 124 ARG CG C 26.514 . . 812 124 124 ARG N N 115.367 . . 813 125 125 LEU H H 7.953 . . 814 125 125 LEU HA H 4.592 . . 815 125 125 LEU C C 178.204 . . 816 125 125 LEU CA C 53.358 . . 817 125 125 LEU CB C 41.695 . . 818 125 125 LEU N N 117.386 . . 819 126 126 GLN H H 7.670 . . 820 126 126 GLN HA H 3.607 . . 821 126 126 GLN HB2 H 2.108 . . 822 126 126 GLN HB3 H 2.108 . . 823 126 126 GLN C C 176.404 . . 824 126 126 GLN CA C 59.395 . . 825 126 126 GLN CB C 28.196 . . 826 126 126 GLN CG C 33.324 . . 827 126 126 GLN N N 124.679 . . 828 127 127 ALA H H 8.533 . . 829 127 127 ALA HA H 4.252 . . 830 127 127 ALA HB H 1.384 . . 831 127 127 ALA C C 181.484 . . 832 127 127 ALA CA C 55.341 . . 833 127 127 ALA CB C 17.174 . . 834 127 127 ALA N N 122.081 . . 835 128 128 VAL H H 8.280 . . 836 128 128 VAL C C 177.383 . . 837 128 128 VAL CA C 65.155 . . 838 128 128 VAL CB C 31.020 . . 839 128 128 VAL N N 118.054 . . 840 129 129 THR H H 7.715 . . 841 129 129 THR CA C 67.266 . . 842 129 129 THR N N 118.220 . . 843 130 130 ASP H H 8.058 . . 844 130 130 ASP HA H 4.496 . . 845 130 130 ASP HB2 H 3.028 . . 846 130 130 ASP HB3 H 2.629 . . 847 130 130 ASP C C 179.310 . . 848 130 130 ASP CA C 57.565 . . 849 130 130 ASP CB C 39.798 . . 850 130 130 ASP N N 121.708 . . 851 131 131 ASP H H 7.431 . . 852 131 131 ASP HA H 5.101 . . 853 131 131 ASP HB2 H 2.834 . . 854 131 131 ASP HB3 H 2.530 . . 855 131 131 ASP C C 179.271 . . 856 131 131 ASP CA C 57.173 . . 857 131 131 ASP CB C 41.995 . . 858 131 131 ASP N N 119.764 . . 859 132 132 HIS H H 8.620 . . 860 132 132 HIS CA C 59.400 . . 861 132 132 HIS CB C 32.708 . . 862 132 132 HIS N N 121.408 . . 863 133 133 ILE H H 9.018 . . 864 133 133 ILE CA C 66.185 . . 865 133 133 ILE CB C 37.513 . . 866 133 133 ILE N N 120.993 . . 867 134 134 ARG H H 7.755 . . 868 134 134 ARG C C 179.100 . . 869 134 134 ARG CA C 60.136 . . 870 134 134 ARG CB C 31.552 . . 871 134 134 ARG N N 119.030 . . 872 135 135 MET H H 8.844 . . 873 135 135 MET HA H 3.595 . . 874 135 135 MET C C 176.296 . . 875 135 135 MET CA C 59.455 . . 876 135 135 MET CB C 32.317 . . 877 135 135 MET N N 120.685 . . 878 136 136 HIS H H 8.989 . . 879 136 136 HIS HA H 4.482 . . 880 136 136 HIS HB2 H 3.066 . . 881 136 136 HIS HB3 H 3.322 . . 882 136 136 HIS C C 176.786 . . 883 136 136 HIS CA C 59.108 . . 884 136 136 HIS CB C 31.700 . . 885 136 136 HIS N N 119.679 . . 886 137 137 LYS H H 8.128 . . 887 137 137 LYS C C 178.087 . . 888 137 137 LYS CA C 60.034 . . 889 137 137 LYS CB C 32.011 . . 890 137 137 LYS N N 118.469 . . 891 138 138 VAL H H 7.567 . . 892 138 138 VAL HA H 3.572 . . 893 138 138 VAL HB H 2.197 . . 894 138 138 VAL HG1 H 1.023 . . 895 138 138 VAL HG2 H 0.716 . . 896 138 138 VAL C C 179.421 . . 897 138 138 VAL CA C 65.548 . . 898 138 138 VAL CB C 31.287 . . 899 138 138 VAL CG1 C 20.692 . . 900 138 138 VAL CG2 C 22.602 . . 901 138 138 VAL N N 117.635 . . 902 139 139 LEU H H 7.666 . . 903 139 139 LEU HA H 3.501 . . 904 139 139 LEU HB2 H -0.541 . . 905 139 139 LEU HB3 H 1.165 . . 906 139 139 LEU HG H 0.472 . . 907 139 139 LEU HD1 H 0.480 . . 908 139 139 LEU HD2 H 0.342 . . 909 139 139 LEU C C 180.368 . . 910 139 139 LEU CA C 57.894 . . 911 139 139 LEU CB C 39.202 . . 912 139 139 LEU CG C 26.425 . . 913 139 139 LEU N N 118.797 . . 914 140 140 ARG H H 9.154 . . 915 140 140 ARG HA H 4.133 . . 916 140 140 ARG HB2 H 1.724 . . 917 140 140 ARG HB3 H 1.724 . . 918 140 140 ARG C C 178.172 . . 919 140 140 ARG CA C 59.107 . . 920 140 140 ARG CB C 29.343 . . 921 140 140 ARG N N 123.784 . . 922 141 141 GLU H H 8.058 . . 923 141 141 GLU HA H 4.331 . . 924 141 141 GLU HB2 H 2.264 . . 925 141 141 GLU HB3 H 2.031 . . 926 141 141 GLU C C 177.736 . . 927 141 141 GLU CA C 56.662 . . 928 141 141 GLU CB C 28.675 . . 929 141 141 GLU CG C 36.372 . . 930 141 141 GLU N N 116.014 . . 931 142 142 SER H H 7.258 . . 932 142 142 SER HA H 4.083 . . 933 142 142 SER HB2 H 4.327 . . 934 142 142 SER HB3 H 4.327 . . 935 142 142 SER C C 175.275 . . 936 142 142 SER CA C 60.929 . . 937 142 142 SER CB C 65.132 . . 938 142 142 SER N N 113.328 . . 939 143 143 GLY H H 7.738 . . 940 143 143 GLY HA2 H 4.250 . . 941 143 143 GLY HA3 H 3.824 . . 942 143 143 GLY C C 174.437 . . 943 143 143 GLY CA C 45.629 . . 944 143 143 GLY N N 110.266 . . 945 144 144 LEU H H 7.791 . . 946 144 144 LEU HA H 5.251 . . 947 144 144 LEU C C 177.276 . . 948 144 144 LEU CA C 53.792 . . 949 144 144 LEU CB C 41.262 . . 950 144 144 LEU N N 120.897 . . 951 145 145 LYS H H 8.504 . . 952 145 145 LYS C C 173.728 . . 953 145 145 LYS CA C 56.835 . . 954 145 145 LYS CB C 30.445 . . 955 145 145 LYS N N 121.748 . . 956 146 146 TYR H H 8.145 . . 957 146 146 TYR HA H 6.071 . . 958 146 146 TYR HB2 H 2.820 . . 959 146 146 TYR HB3 H 2.666 . . 960 146 146 TYR C C 176.212 . . 961 146 146 TYR CA C 53.010 . . 962 146 146 TYR CB C 40.215 . . 963 146 146 TYR N N 126.548 . . 964 147 147 VAL H H 8.761 . . 965 147 147 VAL HA H 4.118 . . 966 147 147 VAL HB H 2.037 . . 967 147 147 VAL C C 172.714 . . 968 147 147 VAL CA C 61.799 . . 969 147 147 VAL CB C 32.609 . . 970 147 147 VAL N N 131.660 . . 971 148 148 ALA H H 7.243 . . 972 148 148 ALA HA H 4.567 . . 973 148 148 ALA HB H 1.356 . . 974 148 148 ALA C C 175.900 . . 975 148 148 ALA CA C 50.646 . . 976 148 148 ALA CB C 19.233 . . 977 148 148 ALA N N 130.008 . . 978 149 149 VAL H H 8.504 . . 979 149 149 VAL HA H 4.343 . . 980 149 149 VAL HB H 1.966 . . 981 149 149 VAL C C 174.455 . . 982 149 149 VAL CA C 62.200 . . 983 149 149 VAL CB C 31.264 . . 984 149 149 VAL N N 127.496 . . 985 150 150 MET H H 8.956 . . 986 150 150 MET C C 171.140 . . 987 150 150 MET CA C 53.497 . . 988 150 150 MET CB C 32.010 . . 989 150 150 MET N N 129.069 . . 990 152 152 PRO HA H 4.580 . . 991 152 152 PRO C C 173.013 . . 992 152 152 PRO CA C 61.326 . . 993 152 152 PRO CB C 29.297 . . 994 153 153 HIS H H 7.285 . . 995 153 153 HIS HA H 4.185 . . 996 153 153 HIS C C 174.005 . . 997 153 153 HIS CA C 57.883 . . 998 153 153 HIS CB C 30.502 . . 999 153 153 HIS N N 116.742 . . 1000 154 154 ILE H H 7.511 . . 1001 154 154 ILE HA H 4.817 . . 1002 154 154 ILE C C 177.396 . . 1003 154 154 ILE CA C 59.694 . . 1004 154 154 ILE CB C 37.976 . . 1005 154 154 ILE N N 125.844 . . 1006 155 155 GLY H H 8.690 . . 1007 155 155 GLY HA2 H 4.474 . . 1008 155 155 GLY HA3 H 3.909 . . 1009 155 155 GLY C C 174.143 . . 1010 155 155 GLY CA C 43.316 . . 1011 155 155 GLY N N 115.137 . . 1012 156 156 ASP H H 8.227 . . 1013 156 156 ASP HA H 4.797 . . 1014 156 156 ASP HB2 H 2.865 . . 1015 156 156 ASP HB3 H 2.429 . . 1016 156 156 ASP C C 176.182 . . 1017 156 156 ASP CA C 53.403 . . 1018 156 156 ASP CB C 41.543 . . 1019 156 156 ASP N N 118.064 . . 1020 157 157 GLN H H 8.861 . . 1021 157 157 GLN C C 172.531 . . 1022 157 157 GLN CA C 56.511 . . 1023 157 157 GLN CB C 24.837 . . 1024 157 157 GLN N N 121.613 . . 1025 158 158 PRO HA H 4.351 . . 1026 158 158 PRO HB2 H 1.786 . . 1027 158 158 PRO HB3 H 2.275 . . 1028 158 158 PRO C C 174.923 . . 1029 158 158 PRO CA C 63.213 . . 1030 158 158 PRO CB C 32.015 . . 1031 159 159 LEU H H 7.837 . . 1032 159 159 LEU HA H 3.854 . . 1033 159 159 LEU C C 177.033 . . 1034 159 159 LEU CA C 56.240 . . 1035 159 159 LEU CB C 42.119 . . 1036 159 159 LEU N N 119.417 . . 1037 160 160 THR H H 10.210 . . 1038 160 160 THR HA H 4.670 . . 1039 160 160 THR HB H 4.095 . . 1040 160 160 THR HG2 H 1.557 . . 1041 160 160 THR C C 176.964 . . 1042 160 160 THR CA C 62.365 . . 1043 160 160 THR CB C 71.681 . . 1044 160 160 THR CG2 C 21.855 . . 1045 160 160 THR N N 119.364 . . 1046 161 161 GLY H H 9.079 . . 1047 161 161 GLY HA2 H 3.748 . . 1048 161 161 GLY HA3 H 2.776 . . 1049 161 161 GLY C C 173.848 . . 1050 161 161 GLY CA C 45.772 . . 1051 161 161 GLY N N 112.432 . . 1052 162 162 ALA H H 8.012 . . 1053 162 162 ALA HA H 4.278 . . 1054 162 162 ALA HB H 1.067 . . 1055 162 162 ALA C C 174.106 . . 1056 162 162 ALA CA C 51.387 . . 1057 162 162 ALA CB C 19.009 . . 1058 162 162 ALA N N 122.851 . . 1059 163 163 TYR H H 5.877 . . 1060 163 163 TYR HA H 4.170 . . 1061 163 163 TYR HB2 H 2.952 . . 1062 163 163 TYR HB3 H 2.952 . . 1063 163 163 TYR C C 174.152 . . 1064 163 163 TYR CA C 53.973 . . 1065 163 163 TYR CB C 38.917 . . 1066 163 163 TYR N N 113.179 . . 1067 164 164 THR H H 8.959 . . 1068 164 164 THR HA H 4.429 . . 1069 164 164 THR HB H 4.132 . . 1070 164 164 THR C C 173.969 . . 1071 164 164 THR CA C 61.565 . . 1072 164 164 THR CB C 70.891 . . 1073 164 164 THR N N 114.940 . . 1074 165 165 VAL H H 8.804 . . 1075 165 165 VAL HA H 4.564 . . 1076 165 165 VAL HB H 2.061 . . 1077 165 165 VAL CA C 61.655 . . 1078 165 165 VAL CB C 32.860 . . 1079 165 165 VAL N N 124.973 . . 1080 166 166 THR H H 8.307 . . 1081 166 166 THR N N 125.483 . . 1082 168 168 ASP CA C 54.704 . . 1083 169 169 GLY H H 7.322 . . 1084 169 169 GLY C C 170.835 . . 1085 169 169 GLY CA C 44.894 . . 1086 169 169 GLY N N 102.697 . . 1087 170 170 ARG H H 8.078 . . 1088 170 170 ARG CA C 55.341 . . 1089 170 170 ARG CB C 30.348 . . 1090 170 170 ARG N N 116.481 . . 1091 175 175 VAL HA H 5.384 . . 1092 175 175 VAL HB H 2.180 . . 1093 175 175 VAL C C 172.160 . . 1094 175 175 VAL CA C 60.141 . . 1095 175 175 VAL CB C 35.860 . . 1096 176 176 ILE H H 8.656 . . 1097 176 176 ILE HA H 4.867 . . 1098 176 176 ILE HB H 1.767 . . 1099 176 176 ILE C C 172.587 . . 1100 176 176 ILE CA C 55.409 . . 1101 176 176 ILE CB C 41.870 . . 1102 176 176 ILE N N 121.280 . . 1103 177 177 SER H H 9.195 . . 1104 177 177 SER C C 176.876 . . 1105 177 177 SER CA C 57.204 . . 1106 177 177 SER CB C 64.664 . . 1107 177 177 SER N N 121.477 . . 1108 178 178 LYS H H 9.086 . . 1109 178 178 LYS C C 176.092 . . 1110 178 178 LYS CA C 58.830 . . 1111 178 178 LYS CB C 30.434 . . 1112 178 178 LYS N N 124.235 . . 1113 179 179 HIS H H 7.220 . . 1114 179 179 HIS HA H 4.400 . . 1115 179 179 HIS HB2 H 2.625 . . 1116 179 179 HIS HB3 H 3.178 . . 1117 179 179 HIS C C 178.704 . . 1118 179 179 HIS CA C 58.049 . . 1119 179 179 HIS CB C 31.081 . . 1120 179 179 HIS N N 117.487 . . 1121 180 180 ASP H H 7.305 . . 1122 180 180 ASP HA H 4.835 . . 1123 180 180 ASP HB2 H 2.674 . . 1124 180 180 ASP HB3 H 2.674 . . 1125 180 180 ASP C C 176.803 . . 1126 180 180 ASP CA C 56.622 . . 1127 180 180 ASP CB C 41.127 . . 1128 180 180 ASP N N 120.821 . . 1129 181 181 LEU H H 8.721 . . 1130 181 181 LEU HA H 3.777 . . 1131 181 181 LEU HB2 H 1.126 . . 1132 181 181 LEU HB3 H 2.007 . . 1133 181 181 LEU C C 178.461 . . 1134 181 181 LEU CA C 57.363 . . 1135 181 181 LEU CB C 40.679 . . 1136 181 181 LEU N N 121.290 . . 1137 182 182 GLY H H 8.097 . . 1138 182 182 GLY HA2 H 3.805 . . 1139 182 182 GLY HA3 H 3.510 . . 1140 182 182 GLY C C 174.045 . . 1141 182 182 GLY CA C 48.597 . . 1142 182 182 GLY N N 106.218 . . 1143 183 183 HIS H H 8.052 . . 1144 183 183 HIS HA H 3.996 . . 1145 183 183 HIS HB2 H 3.745 . . 1146 183 183 HIS C C 179.369 . . 1147 183 183 HIS CA C 61.051 . . 1148 183 183 HIS CB C 30.961 . . 1149 183 183 HIS N N 121.898 . . 1150 184 184 PHE H H 8.759 . . 1151 184 184 PHE HA H 4.581 . . 1152 184 184 PHE C C 177.734 . . 1153 184 184 PHE CA C 61.007 . . 1154 184 184 PHE CB C 37.692 . . 1155 184 184 PHE N N 121.428 . . 1156 185 185 MET H H 8.430 . . 1157 185 185 MET HA H 3.614 . . 1158 185 185 MET HB2 H 1.661 . . 1159 185 185 MET HB3 H 2.276 . . 1160 185 185 MET C C 177.617 . . 1161 185 185 MET CA C 59.159 . . 1162 185 185 MET CB C 31.247 . . 1163 185 185 MET N N 117.935 . . 1164 186 186 LEU H H 7.401 . . 1165 186 186 LEU HA H 3.882 . . 1166 186 186 LEU HB2 H 1.332 . . 1167 186 186 LEU HB3 H 1.834 . . 1168 186 186 LEU C C 181.165 . . 1169 186 186 LEU CA C 56.628 . . 1170 186 186 LEU CB C 40.157 . . 1171 186 186 LEU N N 113.090 . . 1172 187 187 ARG H H 8.178 . . 1173 187 187 ARG HA H 4.021 . . 1174 187 187 ARG HB2 H 2.212 . . 1175 187 187 ARG HB3 H 1.990 . . 1176 187 187 ARG C C 180.455 . . 1177 187 187 ARG CA C 58.738 . . 1178 187 187 ARG CB C 29.439 . . 1179 187 187 ARG N N 124.785 . . 1180 188 188 CYS H H 7.608 . . 1181 188 188 CYS HA H 4.020 . . 1182 188 188 CYS HB2 H 2.609 . . 1183 188 188 CYS HB3 H 3.074 . . 1184 188 188 CYS C C 174.374 . . 1185 188 188 CYS CA C 63.423 . . 1186 188 188 CYS CB C 27.900 . . 1187 188 188 CYS N N 116.264 . . 1188 189 189 LEU H H 7.587 . . 1189 189 189 LEU HA H 4.061 . . 1190 189 189 LEU HB2 H 1.273 . . 1191 189 189 LEU HB3 H 2.196 . . 1192 189 189 LEU C C 178.589 . . 1193 189 189 LEU CA C 55.635 . . 1194 189 189 LEU CB C 41.470 . . 1195 189 189 LEU N N 114.041 . . 1196 190 190 THR H H 7.722 . . 1197 190 190 THR HA H 4.593 . . 1198 190 190 THR HB H 4.471 . . 1199 190 190 THR C C 173.124 . . 1200 190 190 THR CA C 61.079 . . 1201 190 190 THR CB C 70.083 . . 1202 190 190 THR CG2 C 21.267 . . 1203 190 190 THR N N 106.343 . . 1204 191 191 THR H H 7.212 . . 1205 191 191 THR HA H 4.820 . . 1206 191 191 THR HB H 4.178 . . 1207 191 191 THR C C 171.701 . . 1208 191 191 THR CA C 58.105 . . 1209 191 191 THR CB C 69.185 . . 1210 191 191 THR N N 114.713 . . 1211 192 192 ASP H H 8.317 . . 1212 192 192 ASP HA H 4.809 . . 1213 192 192 ASP HB2 H 2.678 . . 1214 192 192 ASP HB3 H 2.870 . . 1215 192 192 ASP C C 176.936 . . 1216 192 192 ASP CA C 53.052 . . 1217 192 192 ASP CB C 41.287 . . 1218 192 192 ASP N N 125.061 . . 1219 193 193 GLU H H 8.356 . . 1220 193 193 GLU C C 175.906 . . 1221 193 193 GLU CA C 58.857 . . 1222 193 193 GLU CB C 29.789 . . 1223 193 193 GLU N N 121.866 . . 1224 194 194 TYR H H 8.268 . . 1225 194 194 TYR HA H 4.615 . . 1226 194 194 TYR HB2 H 3.167 . . 1227 194 194 TYR HB3 H 3.167 . . 1228 194 194 TYR C C 175.322 . . 1229 194 194 TYR CA C 55.719 . . 1230 194 194 TYR CB C 38.634 . . 1231 194 194 TYR N N 115.934 . . 1232 195 195 ASP H H 7.458 . . 1233 195 195 ASP HA H 3.990 . . 1234 195 195 ASP HB2 H 2.810 . . 1235 195 195 ASP HB3 H 2.422 . . 1236 195 195 ASP C C 177.990 . . 1237 195 195 ASP CA C 56.035 . . 1238 195 195 ASP CB C 38.768 . . 1239 195 195 ASP N N 122.940 . . 1240 196 196 GLY H H 8.450 . . 1241 196 196 GLY HA2 H 4.087 . . 1242 196 196 GLY HA3 H 3.919 . . 1243 196 196 GLY C C 174.124 . . 1244 196 196 GLY CA C 45.755 . . 1245 196 196 GLY N N 110.858 . . 1246 197 197 HIS H H 8.312 . . 1247 197 197 HIS HA H 5.096 . . 1248 197 197 HIS C C 174.822 . . 1249 197 197 HIS CA C 54.544 . . 1250 197 197 HIS CB C 31.124 . . 1251 197 197 HIS N N 116.234 . . 1252 198 198 SER H H 8.853 . . 1253 198 198 SER HA H 5.637 . . 1254 198 198 SER HB2 H 4.063 . . 1255 198 198 SER HB3 H 4.026 . . 1256 198 198 SER C C 174.540 . . 1257 198 198 SER CA C 57.330 . . 1258 198 198 SER CB C 64.746 . . 1259 198 198 SER N N 116.557 . . 1260 204 204 GLN HA H 4.495 . . 1261 204 204 GLN HB2 H 1.748 . . 1262 204 204 GLN HB3 H 1.748 . . 1263 204 204 GLN C C 173.831 . . 1264 204 204 GLN CA C 54.086 . . 1265 204 204 GLN CB C 29.397 . . 1266 204 204 GLN CG C 32.931 . . 1267 205 205 TYR H H 8.346 . . 1268 205 205 TYR HA H 4.174 . . 1269 205 205 TYR HB2 H 3.242 . . 1270 205 205 TYR HB3 H 2.720 . . 1271 205 205 TYR C C 175.226 . . 1272 205 205 TYR CA C 58.697 . . 1273 205 205 TYR CB C 39.114 . . 1274 205 205 TYR N N 123.344 . . 1275 206 206 GLN H H 8.145 . . 1276 206 206 GLN C C 180.607 . . 1277 206 206 GLN CA C 57.175 . . 1278 206 206 GLN CB C 29.849 . . 1279 206 206 GLN N N 125.734 . . stop_ save_