data_27352 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N assignments of the extracellular region of human Fc receptor IIIb ; _BMRB_accession_number 27352 _BMRB_flat_file_name bmr27352.str _Entry_type original _Submission_date 2018-01-04 _Accession_date 2018-01-04 _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 Yogo Rina . . 2 Yanaka Saeko . . 3 Kato Koichi . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 167 "13C chemical shifts" 501 "15N chemical shifts" 167 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-05-24 update BMRB 'update entry citation' 2018-02-20 original author 'original release' stop_ _Original_release_date 2018-01-04 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Backbone 1H, 13C, and 15N assignments of the extracellular region of human Fcgammaa receptor IIIb ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29453714 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Yogo Rina . . 2 Yanaka Saeko . . 3 Kato Koichi . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume 12 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 201 _Page_last 204 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Fc receptor IIIb' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Fc receptor IIIb' $Fc_receptor_IIIb stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Fc_receptor_IIIb _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Fc_receptor_IIIb _Molecular_mass . _Mol_thiol_state 'all disulfide bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 187 _Mol_residue_sequence ; MARTEDLPKAVVFLEPQWYS VLEKDSVTLKCQGAYSPEDN STQWFHNESLISSQASSYFI DAATVNDSGEYRCQTNLSTL SDPVQLEVHIGWLLLQAPRW VFKEEDPIHLRCHSWKNTAL HKVTYLQNGKDRKYFHHNSD FHIPKATLKDSGSYFCRGLV GSKNVSSETVNITITQAAAL EHHHHHH ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 ARG 4 THR 5 GLU 6 ASP 7 LEU 8 PRO 9 LYS 10 ALA 11 VAL 12 VAL 13 PHE 14 LEU 15 GLU 16 PRO 17 GLN 18 TRP 19 TYR 20 SER 21 VAL 22 LEU 23 GLU 24 LYS 25 ASP 26 SER 27 VAL 28 THR 29 LEU 30 LYS 31 CYS 32 GLN 33 GLY 34 ALA 35 TYR 36 SER 37 PRO 38 GLU 39 ASP 40 ASN 41 SER 42 THR 43 GLN 44 TRP 45 PHE 46 HIS 47 ASN 48 GLU 49 SER 50 LEU 51 ILE 52 SER 53 SER 54 GLN 55 ALA 56 SER 57 SER 58 TYR 59 PHE 60 ILE 61 ASP 62 ALA 63 ALA 64 THR 65 VAL 66 ASN 67 ASP 68 SER 69 GLY 70 GLU 71 TYR 72 ARG 73 CYS 74 GLN 75 THR 76 ASN 77 LEU 78 SER 79 THR 80 LEU 81 SER 82 ASP 83 PRO 84 VAL 85 GLN 86 LEU 87 GLU 88 VAL 89 HIS 90 ILE 91 GLY 92 TRP 93 LEU 94 LEU 95 LEU 96 GLN 97 ALA 98 PRO 99 ARG 100 TRP 101 VAL 102 PHE 103 LYS 104 GLU 105 GLU 106 ASP 107 PRO 108 ILE 109 HIS 110 LEU 111 ARG 112 CYS 113 HIS 114 SER 115 TRP 116 LYS 117 ASN 118 THR 119 ALA 120 LEU 121 HIS 122 LYS 123 VAL 124 THR 125 TYR 126 LEU 127 GLN 128 ASN 129 GLY 130 LYS 131 ASP 132 ARG 133 LYS 134 TYR 135 PHE 136 HIS 137 HIS 138 ASN 139 SER 140 ASP 141 PHE 142 HIS 143 ILE 144 PRO 145 LYS 146 ALA 147 THR 148 LEU 149 LYS 150 ASP 151 SER 152 GLY 153 SER 154 TYR 155 PHE 156 CYS 157 ARG 158 GLY 159 LEU 160 VAL 161 GLY 162 SER 163 LYS 164 ASN 165 VAL 166 SER 167 SER 168 GLU 169 THR 170 VAL 171 ASN 172 ILE 173 THR 174 ILE 175 THR 176 GLN 177 ALA 178 ALA 179 ALA 180 LEU 181 GLU 182 HIS 183 HIS 184 HIS 185 HIS 186 HIS 187 HIS 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 $Fc_receptor_IIIb 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 $Fc_receptor_IIIb 'recombinant technology' . Escherichia coli . pet28b 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 $Fc_receptor_IIIb 0.2 mM '[U-100% 13C; U-100% 15N] partially deuterated' 'sodium chloride' 50 mM 'natural abundance' 'sodium phosphate' 5 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ 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_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 950 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_trHSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N trHSQC' _Sample_label $sample_1 save_ save_3D_trCBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trCBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_trHNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCACB' _Sample_label $sample_1 save_ save_3D_trHN(CO)CA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHN(CO)CA' _Sample_label $sample_1 save_ save_3D_trHNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCA' _Sample_label $sample_1 save_ save_3D_trHNCO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCO' _Sample_label $sample_1 save_ save_3D_trHCACO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHCACO' _Sample_label $sample_1 save_ save_3D_trHNCANNH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCANNH' _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 6.0 . 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 DSS C 13 'methyl protons' ppm -0.0577 external direct . . . 0.101329118 DSS H 1 'methyl protons' ppm -0.0577 external direct . . . 1.0 DSS N 15 'methyl protons' ppm -0.0577 external direct . . . 0.25144953 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 trHSQC' '3D trCBCA(CO)NH' '3D trHNCACB' '3D trHN(CO)CA' '3D trHNCO' '3D trHCACO' 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 'Fc receptor IIIb' _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 3 3 ARG C C 179.159 0.3 1 2 3 3 ARG CA C 57.769 0.3 1 3 4 4 THR H H 8.3414 0.03 1 4 4 4 THR C C 175.758 0.3 1 5 4 4 THR CA C 64.278 0.3 1 6 4 4 THR CB C 71.112 0.3 1 7 4 4 THR N N 117.421 0.3 1 8 5 5 GLU H H 8.5634 0.03 1 9 5 5 GLU C C 178.279 0.3 1 10 5 5 GLU CA C 58.326 0.3 1 11 5 5 GLU CB C 31.049 0.3 1 12 5 5 GLU N N 122.47 0.3 1 13 6 6 ASP H H 8.2114 0.03 1 14 6 6 ASP C C 177.869 0.3 1 15 6 6 ASP CA C 56.011 0.3 1 16 6 6 ASP CB C 42.46 0.3 1 17 6 6 ASP N N 121.398 0.3 1 18 7 7 LEU H H 7.9844 0.03 1 19 7 7 LEU CA C 54.427 0.3 1 20 7 7 LEU CB C 42.46 0.3 1 21 7 7 LEU N N 123.219 0.3 1 22 8 8 PRO C C 178.396 0.3 1 23 8 8 PRO CA C 64.22 0.3 1 24 9 9 LYS H H 8.1074 0.03 1 25 9 9 LYS C C 181.387 0.3 1 26 9 9 LYS CA C 58.092 0.3 1 27 9 9 LYS CB C 34.908 0.3 1 28 9 9 LYS N N 121.506 0.3 1 29 10 10 ALA H H 8.5734 0.03 1 30 10 10 ALA C C 177.194 0.3 1 31 10 10 ALA CA C 53.724 0.3 1 32 10 10 ALA CB C 20.705 0.3 1 33 10 10 ALA N N 128.554 0.3 1 34 11 11 VAL H H 8.1494 0.03 1 35 11 11 VAL C C 174.937 0.3 1 36 11 11 VAL CA C 63.487 0.3 1 37 11 11 VAL CB C 37.042 0.3 1 38 11 11 VAL N N 118.663 0.3 1 39 12 12 VAL H H 8.2884 0.03 1 40 12 12 VAL CA C 62.783 0.3 1 41 12 12 VAL CB C 33.923 0.3 1 42 12 12 VAL N N 126.263 0.3 1 43 13 13 PHE H H 9.3434 0.03 1 44 13 13 PHE C C 174.937 0.3 1 45 13 13 PHE CA C 56.919 0.3 1 46 13 13 PHE CB C 33.102 0.3 1 47 13 13 PHE N N 125.735 0.3 1 48 14 14 LEU H H 8.2524 0.03 1 49 14 14 LEU CA C 56.069 0.3 1 50 14 14 LEU CB C 43.528 0.3 1 51 14 14 LEU N N 123.917 0.3 1 52 16 16 PRO C C 179.569 0.3 1 53 16 16 PRO CA C 65.451 0.3 1 54 17 17 GLN H H 7.8584 0.03 1 55 17 17 GLN C C 174.585 0.3 1 56 17 17 GLN CA C 58.767 0.3 1 57 17 17 GLN CB C 29.818 0.3 1 58 17 17 GLN N N 115.169 0.3 1 59 18 18 TRP H H 6.2054 0.03 1 60 18 18 TRP C C 177.282 0.3 1 61 18 18 TRP CA C 56.362 0.3 1 62 18 18 TRP CB C 32.281 0.3 1 63 18 18 TRP N N 120.566 0.3 1 64 19 19 TYR H H 7.5674 0.03 1 65 19 19 TYR C C 173.119 0.3 1 66 19 19 TYR CA C 60.144 0.3 1 67 19 19 TYR CB C 38.93 0.3 1 68 19 19 TYR N N 120.625 0.3 1 69 20 20 SER H H 7.4554 0.03 1 70 20 20 SER C C 174.057 0.3 1 71 20 20 SER CA C 56.215 0.3 1 72 20 20 SER CB C 66.597 0.3 1 73 20 20 SER N N 116.434 0.3 1 74 21 21 VAL H H 8.7904 0.03 1 75 21 21 VAL C C 176.755 0.3 1 76 21 21 VAL CA C 60.614 0.3 1 77 21 21 VAL CB C 35.647 0.3 1 78 21 21 VAL N N 116.427 0.3 1 79 22 22 LEU H H 8.5944 0.03 1 80 22 22 LEU C C 180.566 0.3 1 81 22 22 LEU CA C 54.456 0.3 1 82 22 22 LEU CB C 46.729 0.3 1 83 22 22 LEU N N 121.42 0.3 1 84 23 23 GLU H H 7.7574 0.03 1 85 23 23 GLU C C 179.804 0.3 1 86 23 23 GLU CA C 60.056 0.3 1 87 23 23 GLU CB C 31.049 0.3 1 88 23 23 GLU N N 119.139 0.3 1 89 24 24 LYS H H 9.4794 0.03 1 90 24 24 LYS C C 179.1 0.3 1 91 24 24 LYS CA C 60.877 0.3 1 92 24 24 LYS CB C 31.049 0.3 1 93 24 24 LYS N N 114.759 0.3 1 94 25 25 ASP H H 8.3764 0.03 1 95 25 25 ASP C C 177.634 0.3 1 96 25 25 ASP CA C 56.861 0.3 1 97 25 25 ASP CB C 42.378 0.3 1 98 25 25 ASP N N 122.078 0.3 1 99 26 26 SER H H 8.3444 0.03 1 100 26 26 SER C C 177.165 0.3 1 101 26 26 SER CA C 58.063 0.3 1 102 26 26 SER CB C 66.432 0.3 1 103 26 26 SER N N 114.756 0.3 1 104 27 27 VAL H H 8.6144 0.03 1 105 27 27 VAL C C 172.415 0.3 1 106 27 27 VAL CA C 63.546 0.3 1 107 27 27 VAL CB C 36.221 0.3 1 108 27 27 VAL N N 123.949 0.3 1 109 28 28 THR H H 8.4454 0.03 1 110 28 28 THR C C 171.711 0.3 1 111 28 28 THR CA C 63.809 0.3 1 112 28 28 THR CB C 71.851 0.3 1 113 28 28 THR N N 122.804 0.3 1 114 29 29 LEU H H 8.9084 0.03 1 115 29 29 LEU C C 176.109 0.3 1 116 29 29 LEU CA C 56.127 0.3 1 117 29 29 LEU CB C 43.61 0.3 1 118 29 29 LEU N N 128.573 0.3 1 119 30 30 LYS H H 9.3654 0.03 1 120 30 30 LYS C C 178.221 0.3 1 121 30 30 LYS CA C 56.713 0.3 1 122 30 30 LYS CB C 36.057 0.3 1 123 30 30 LYS N N 122.73 0.3 1 124 31 31 CYS H H 8.8974 0.03 1 125 31 31 CYS C C 175.699 0.3 1 126 31 31 CYS CA C 56.391 0.3 1 127 31 31 CYS CB C 44.677 0.3 1 128 31 31 CYS N N 123.147 0.3 1 129 32 32 GLN H H 9.7634 0.03 1 130 32 32 GLN C C 175.816 0.3 1 131 32 32 GLN CA C 56.421 0.3 1 132 32 32 GLN CB C 30.967 0.3 1 133 32 32 GLN N N 132.11 0.3 1 134 33 33 GLY H H 7.8064 0.03 1 135 33 33 GLY C C 170.539 0.3 1 136 33 33 GLY CA C 45.719 0.3 1 137 33 33 GLY N N 113.507 0.3 1 138 34 34 ALA H H 8.0474 0.03 1 139 34 34 ALA C C 179.511 0.3 1 140 34 34 ALA CA C 53.313 0.3 1 141 34 34 ALA CB C 21.116 0.3 1 142 34 34 ALA N N 123.267 0.3 1 143 35 35 TYR H H 8.4484 0.03 1 144 35 35 TYR C C 177.4 0.3 1 145 35 35 TYR CA C 58.62 0.3 1 146 35 35 TYR CB C 41.557 0.3 1 147 35 35 TYR N N 121.061 0.3 1 148 36 36 SER H H 8.4074 0.03 1 149 36 36 SER CA C 57.476 0.3 1 150 36 36 SER CB C 65.529 0.3 1 151 36 36 SER N N 118.921 0.3 1 152 37 37 PRO C C 180.507 0.3 1 153 37 37 PRO CA C 66.507 0.3 1 154 38 38 GLU H H 8.1694 0.03 1 155 38 38 GLU C C 178.103 0.3 1 156 38 38 GLU CA C 58.59 0.3 1 157 38 38 GLU CB C 30.639 0.3 1 158 38 38 GLU N N 115.305 0.3 1 159 39 39 ASP H H 7.7394 0.03 1 160 39 39 ASP C C 175.67 0.3 1 161 39 39 ASP CA C 56.01 0.3 1 162 39 39 ASP CB C 42.953 0.3 1 163 39 39 ASP N N 120.348 0.3 1 164 40 40 ASN H H 8.6594 0.03 1 165 40 40 ASN C C 179.159 0.3 1 166 40 40 ASN CA C 58.063 0.3 1 167 40 40 ASN CB C 31.131 0.3 1 168 40 40 ASN N N 123.59 0.3 1 169 41 41 SER H H 7.5214 0.03 1 170 41 41 SER C C 174.174 0.3 1 171 41 41 SER CA C 61.405 0.3 1 172 41 41 SER CB C 66.022 0.3 1 173 41 41 SER N N 117.192 0.3 1 174 42 42 THR H H 8.1384 0.03 1 175 42 42 THR C C 173.002 0.3 1 176 42 42 THR CA C 64.337 0.3 1 177 42 42 THR CB C 72.59 0.3 1 178 42 42 THR N N 121.484 0.3 1 179 43 43 GLN H H 8.4914 0.03 1 180 43 43 GLN C C 173.823 0.3 1 181 43 43 GLN CA C 56.215 0.3 1 182 43 43 GLN CB C 32.116 0.3 1 183 43 43 GLN N N 123.162 0.3 1 184 44 44 TRP H H 8.7784 0.03 1 185 44 44 TRP C C 175.875 0.3 1 186 44 44 TRP CA C 58.063 0.3 1 187 44 44 TRP CB C 35.072 0.3 1 188 44 44 TRP N N 122.791 0.3 1 189 45 45 PHE H H 9.1254 0.03 1 190 45 45 PHE C C 176.813 0.3 1 191 45 45 PHE CA C 57.652 0.3 1 192 45 45 PHE CB C 44.267 0.3 1 193 45 45 PHE N N 118.044 0.3 1 194 46 46 HIS H H 9.0614 0.03 1 195 46 46 HIS C C 175.992 0.3 1 196 46 46 HIS CA C 52.522 0.3 1 197 46 46 HIS CB C 32.445 0.3 1 198 46 46 HIS N N 120.346 0.3 1 199 47 47 ASN H H 9.9474 0.03 1 200 47 47 ASN CA C 56.245 0.3 1 201 47 47 ASN CB C 37.124 0.3 1 202 47 47 ASN N N 129.662 0.3 1 203 48 48 GLU C C 177.751 0.3 1 204 48 48 GLU CA C 59.529 0.3 1 205 49 49 SER H H 7.9414 0.03 1 206 49 49 SER C C 174.057 0.3 1 207 49 49 SER CA C 59.705 0.3 1 208 49 49 SER CB C 66.432 0.3 1 209 49 49 SER N N 116.924 0.3 1 210 50 50 LEU H H 8.7004 0.03 1 211 50 50 LEU C C 181.856 0.3 1 212 50 50 LEU CA C 57.359 0.3 1 213 50 50 LEU CB C 43.692 0.3 1 214 50 50 LEU N N 129.067 0.3 1 215 51 51 ILE H H 8.5744 0.03 1 216 51 51 ILE C C 179.745 0.3 1 217 51 51 ILE CA C 62.343 0.3 1 218 51 51 ILE CB C 40.162 0.3 1 219 51 51 ILE N N 125.601 0.3 1 220 52 52 SER H H 8.3264 0.03 1 221 52 52 SER C C 176.168 0.3 1 222 52 52 SER CA C 61.17 0.3 1 223 52 52 SER CB C 64.544 0.3 1 224 52 52 SER N N 118.343 0.3 1 225 53 53 SER H H 7.6974 0.03 1 226 53 53 SER C C 175.758 0.3 1 227 53 53 SER CA C 60.82 0.3 1 228 53 53 SER CB C 65.283 0.3 1 229 53 53 SER N N 117.354 0.3 1 230 54 54 GLN H H 8.7224 0.03 1 231 54 54 GLN C C 178.338 0.3 1 232 54 54 GLN CA C 57.212 0.3 1 233 54 54 GLN CB C 31.213 0.3 1 234 54 54 GLN N N 123.929 0.3 1 235 55 55 ALA H H 8.0064 0.03 1 236 55 55 ALA C C 178.455 0.3 1 237 55 55 ALA CA C 53.606 0.3 1 238 55 55 ALA CB C 21.526 0.3 1 239 55 55 ALA N N 124.773 0.3 1 240 56 56 SER H H 8.6654 0.03 1 241 56 56 SER C C 175.289 0.3 1 242 56 56 SER CA C 62.49 0.3 1 243 56 56 SER CB C 65.283 0.3 1 244 56 56 SER N N 114.894 0.3 1 245 57 57 SER H H 7.4864 0.03 1 246 57 57 SER C C 172.708 0.3 1 247 57 57 SER CA C 58.356 0.3 1 248 57 57 SER CB C 67.171 0.3 1 249 57 57 SER N N 114.295 0.3 1 250 58 58 TYR H H 9.2814 0.03 1 251 58 58 TYR C C 172.181 0.3 1 252 58 58 TYR CA C 58.004 0.3 1 253 58 58 TYR CB C 39.095 0.3 1 254 58 58 TYR N N 127.103 0.3 1 255 59 59 PHE H H 7.7774 0.03 1 256 59 59 PHE C C 176.109 0.3 1 257 59 59 PHE CA C 57.886 0.3 1 258 59 59 PHE CB C 41.968 0.3 1 259 59 59 PHE N N 127.732 0.3 1 260 60 60 ILE H H 8.4284 0.03 1 261 60 60 ILE C C 171.594 0.3 1 262 60 60 ILE CA C 61.874 0.3 1 263 60 60 ILE CB C 39.012 0.3 1 264 60 60 ILE N N 128.9 0.3 1 265 61 61 ASP H H 7.8364 0.03 1 266 61 61 ASP CA C 57.828 0.3 1 267 61 61 ASP CB C 42.378 0.3 1 268 61 61 ASP N N 126.144 0.3 1 269 62 62 ALA H H 7.7674 0.03 1 270 62 62 ALA C C 177.048 0.3 1 271 62 62 ALA CA C 52.316 0.3 1 272 62 62 ALA CB C 20.048 0.3 1 273 62 62 ALA N N 122.318 0.3 1 274 63 63 ALA H H 9.0954 0.03 1 275 63 63 ALA C C 181.358 0.3 1 276 63 63 ALA CA C 54.984 0.3 1 277 63 63 ALA CB C 19.679 0.3 1 278 63 63 ALA N N 126.755 0.3 1 279 64 64 THR H H 9.6894 0.03 1 280 64 64 THR C C 179.745 0.3 1 281 64 64 THR CA C 61.258 0.3 1 282 64 64 THR CB C 74.888 0.3 1 283 64 64 THR N N 114.661 0.3 1 284 65 65 VAL H H 9.2594 0.03 1 285 65 65 VAL C C 182.853 0.3 1 286 65 65 VAL CA C 67.826 0.3 1 287 65 65 VAL CB C 32.198 0.3 1 288 65 65 VAL N N 119.42 0.3 1 289 66 66 ASN H H 7.8914 0.03 1 290 66 66 ASN C C 176.227 0.3 1 291 66 66 ASN CA C 56.508 0.3 1 292 66 66 ASN CB C 39.505 0.3 1 293 66 66 ASN N N 118.28 0.3 1 294 67 67 ASP H H 8.4914 0.03 1 295 67 67 ASP C C 176.755 0.3 1 296 67 67 ASP CA C 54.222 0.3 1 297 67 67 ASP CB C 39.998 0.3 1 298 67 67 ASP N N 123.162 0.3 1 299 68 68 SER H H 8.3174 0.03 1 300 68 68 SER C C 176.051 0.3 1 301 68 68 SER CA C 61.698 0.3 1 302 68 68 SER CB C 65.776 0.3 1 303 68 68 SER N N 116.563 0.3 1 304 69 69 GLY H H 9.7874 0.03 1 305 69 69 GLY C C 170.246 0.3 1 306 69 69 GLY CA C 46.334 0.3 1 307 69 69 GLY N N 114.755 0.3 1 308 70 70 GLU H H 8.2624 0.03 1 309 70 70 GLU C C 180.214 0.3 1 310 70 70 GLU CA C 56.656 0.3 1 311 70 70 GLU CB C 34.005 0.3 1 312 70 70 GLU N N 118.555 0.3 1 313 71 71 TYR H H 9.5004 0.03 1 314 71 71 TYR C C 177.341 0.3 1 315 71 71 TYR CA C 58.942 0.3 1 316 71 71 TYR CB C 44.02 0.3 1 317 71 71 TYR N N 124.071 0.3 1 318 72 72 ARG H H 8.7674 0.03 1 319 72 72 ARG C C 173.529 0.3 1 320 72 72 ARG CA C 56.069 0.3 1 321 72 72 ARG CB C 35.318 0.3 1 322 72 72 ARG N N 117.06 0.3 1 323 73 73 CYS H H 8.6684 0.03 1 324 73 73 CYS C C 177.986 0.3 1 325 73 73 CYS CA C 56.714 0.3 1 326 73 73 CYS CB C 40.408 0.3 1 327 73 73 CYS N N 130.29 0.3 1 328 74 74 GLN H H 8.2954 0.03 1 329 74 74 GLN C C 173.002 0.3 1 330 74 74 GLN CA C 57.623 0.3 1 331 74 74 GLN CB C 43.199 0.3 1 332 74 74 GLN N N 116.855 0.3 1 333 75 75 THR H H 7.8244 0.03 1 334 75 75 THR CA C 61.933 0.3 1 335 75 75 THR CB C 72.672 0.3 1 336 75 75 THR N N 113.855 0.3 1 337 76 76 ASN C C 177.869 0.3 1 338 76 76 ASN CA C 58.004 0.3 1 339 77 77 LEU H H 7.5884 0.03 1 340 77 77 LEU C C 176.344 0.3 1 341 77 77 LEU CA C 55.014 0.3 1 342 77 77 LEU CB C 49.028 0.3 1 343 77 77 LEU N N 117.419 0.3 1 344 78 78 SER H H 7.4974 0.03 1 345 78 78 SER C C 173.705 0.3 1 346 78 78 SER CA C 59.382 0.3 1 347 78 78 SER CB C 67.828 0.3 1 348 78 78 SER N N 115.464 0.3 1 349 79 79 THR H H 8.5154 0.03 1 350 79 79 THR C C 174.995 0.3 1 351 79 79 THR CA C 62.989 0.3 1 352 79 79 THR CB C 71.522 0.3 1 353 79 79 THR N N 112.882 0.3 1 354 80 80 LEU H H 7.7394 0.03 1 355 80 80 LEU C C 180.156 0.3 1 356 80 80 LEU CA C 58.063 0.3 1 357 80 80 LEU CB C 43.856 0.3 1 358 80 80 LEU N N 121.359 0.3 1 359 81 81 SER H H 9.0044 0.03 1 360 81 81 SER C C 176.637 0.3 1 361 81 81 SER CA C 60.936 0.3 1 362 81 81 SER CB C 67.746 0.3 1 363 81 81 SER N N 122.868 0.3 1 364 82 82 ASP H H 8.9954 0.03 1 365 82 82 ASP C C 177.927 0.3 1 366 82 82 ASP CA C 55.834 0.3 1 367 82 82 ASP CB C 39.751 0.3 1 368 82 82 ASP N N 121.452 0.3 1 369 83 83 PRO C C 180.683 0.3 1 370 83 83 PRO CA C 64.923 0.3 1 371 84 84 VAL H H 8.8604 0.03 1 372 84 84 VAL C C 175.758 0.3 1 373 84 84 VAL CA C 62.783 0.3 1 374 84 84 VAL CB C 35.975 0.3 1 375 84 84 VAL N N 119.429 0.3 1 376 85 85 GLN H H 8.2514 0.03 1 377 85 85 GLN C C 175.113 0.3 1 378 85 85 GLN CA C 56.509 0.3 1 379 85 85 GLN CB C 30.803 0.3 1 380 85 85 GLN N N 125.082 0.3 1 381 86 86 LEU H H 9.1174 0.03 1 382 86 86 LEU C C 180.097 0.3 1 383 86 86 LEU CA C 54.984 0.3 1 384 86 86 LEU CB C 47.058 0.3 1 385 86 86 LEU N N 125.577 0.3 1 386 87 87 GLU H H 9.6004 0.03 1 387 87 87 GLU C C 174.937 0.3 1 388 87 87 GLU CA C 56.656 0.3 1 389 87 87 GLU CB C 33.512 0.3 1 390 87 87 GLU N N 127.745 0.3 1 391 88 88 VAL H H 8.1404 0.03 1 392 88 88 VAL C C 176.872 0.3 1 393 88 88 VAL CA C 62.784 0.3 1 394 88 88 VAL CB C 33.676 0.3 1 395 88 88 VAL N N 124.532 0.3 1 396 89 89 HIS H H 9.3434 0.03 1 397 89 89 HIS C C 173.295 0.3 1 398 89 89 HIS CA C 56.919 0.3 1 399 89 89 HIS CB C 33.512 0.3 1 400 89 89 HIS N N 125.209 0.3 1 401 90 90 ILE H H 8.3834 0.03 1 402 90 90 ILE C C 177.927 0.3 1 403 90 90 ILE CA C 61.787 0.3 1 404 90 90 ILE CB C 39.669 0.3 1 405 90 90 ILE N N 119.332 0.3 1 406 91 91 GLY H H 8.1214 0.03 1 407 91 91 GLY C C 169.982 0.3 1 408 91 91 GLY CA C 45.865 0.3 1 409 91 91 GLY N N 113.808 0.3 1 410 92 92 TRP H H 8.1054 0.03 1 411 92 92 TRP C C 178.572 0.3 1 412 92 92 TRP CA C 61.142 0.3 1 413 92 92 TRP CB C 33.019 0.3 1 414 92 92 TRP N N 115.751 0.3 1 415 93 93 LEU H H 7.5824 0.03 1 416 93 93 LEU C C 176.051 0.3 1 417 93 93 LEU CA C 55.122 0.3 1 418 93 93 LEU CB C 49.028 0.3 1 419 93 93 LEU N N 117.345 0.3 1 420 94 94 LEU H H 9.0114 0.03 1 421 94 94 LEU C C 173.823 0.3 1 422 94 94 LEU CA C 55.717 0.3 1 423 94 94 LEU CB C 49.028 0.3 1 424 94 94 LEU N N 126.878 0.3 1 425 95 95 LEU H H 9.0964 0.03 1 426 95 95 LEU C C 175.64 0.3 1 427 95 95 LEU CA C 55.453 0.3 1 428 95 95 LEU CB C 41.557 0.3 1 429 95 95 LEU N N 131.39 0.3 1 430 96 96 GLN H H 9.3204 0.03 1 431 96 96 GLN C C 173.998 0.3 1 432 96 96 GLN CA C 56.802 0.3 1 433 96 96 GLN CB C 33.266 0.3 1 434 96 96 GLN N N 126.362 0.3 1 435 97 97 ALA H H 8.0904 0.03 1 436 97 97 ALA CA C 51.554 0.3 1 437 97 97 ALA CB C 20.377 0.3 1 438 97 97 ALA N N 121.363 0.3 1 439 98 98 PRO CA C 65.92 0.3 1 440 99 99 ARG H H 7.6404 0.03 1 441 99 99 ARG C C 171.829 0.3 1 442 99 99 ARG CA C 55.688 0.3 1 443 99 99 ARG N N 110.049 0.3 1 444 100 100 TRP H H 7.6104 0.03 1 445 100 100 TRP C C 175.406 0.3 1 446 100 100 TRP CA C 58.796 0.3 1 447 100 100 TRP CB C 31.378 0.3 1 448 100 100 TRP N N 112.643 0.3 1 449 101 101 VAL H H 6.5304 0.03 1 450 101 101 VAL C C 174.409 0.3 1 451 101 101 VAL CA C 62.226 0.3 1 452 101 101 VAL CB C 34.661 0.3 1 453 101 101 VAL N N 120.56 0.3 1 454 102 102 PHE H H 8.8174 0.03 1 455 102 102 PHE C C 175.113 0.3 1 456 102 102 PHE CA C 57.711 0.3 1 457 102 102 PHE CB C 44.267 0.3 1 458 102 102 PHE N N 125.079 0.3 1 459 103 103 LYS H H 8.7974 0.03 1 460 103 103 LYS C C 179.745 0.3 1 461 103 103 LYS CA C 56.279 0.3 1 462 103 103 LYS CB C 35.072 0.3 1 463 103 103 LYS N N 121.878 0.3 1 464 104 104 GLU H H 7.9494 0.03 1 465 104 104 GLU C C 179.159 0.3 1 466 104 104 GLU CA C 60.701 0.3 1 467 104 104 GLU CB C 31.87 0.3 1 468 104 104 GLU N N 120.62 0.3 1 469 105 105 GLU H H 9.2924 0.03 1 470 105 105 GLU C C 177.165 0.3 1 471 105 105 GLU CA C 61.523 0.3 1 472 105 105 GLU CB C 29.079 0.3 1 473 105 105 GLU N N 115.722 0.3 1 474 106 106 ASP H H 8.3834 0.03 1 475 106 106 ASP CA C 56.479 0.3 1 476 106 106 ASP CB C 42.05 0.3 1 477 106 106 ASP N N 122.764 0.3 1 478 107 107 PRO C C 181.328 0.3 1 479 107 107 PRO CA C 63.868 0.3 1 480 108 108 ILE H H 8.6794 0.03 1 481 108 108 ILE C C 174.643 0.3 1 482 108 108 ILE CA C 62.959 0.3 1 483 108 108 ILE CB C 40.819 0.3 1 484 108 108 ILE N N 121.24 0.3 1 485 109 109 HIS H H 7.4404 0.03 1 486 109 109 HIS C C 171.418 0.3 1 487 109 109 HIS CA C 54.544 0.3 1 488 109 109 HIS CB C 34.005 0.3 1 489 109 109 HIS N N 131.036 0.3 1 490 110 110 LEU H H 8.7244 0.03 1 491 110 110 LEU C C 177.517 0.3 1 492 110 110 LEU CA C 54.418 0.3 1 493 110 110 LEU CB C 46.073 0.3 1 494 110 110 LEU N N 122.62 0.3 1 495 111 111 ARG H H 8.4934 0.03 1 496 111 111 ARG C C 174.526 0.3 1 497 111 111 ARG CA C 55.981 0.3 1 498 111 111 ARG CB C 35.072 0.3 1 499 111 111 ARG N N 121.926 0.3 1 500 112 112 CYS H H 8.3694 0.03 1 501 112 112 CYS C C 171.77 0.3 1 502 112 112 CYS CA C 56.098 0.3 1 503 112 112 CYS CB C 52.558 0.3 1 504 112 112 CYS N N 115.031 0.3 1 505 113 113 HIS H H 9.0524 0.03 1 506 113 113 HIS C C 172.181 0.3 1 507 113 113 HIS CA C 54.778 0.3 1 508 113 113 HIS N N 125.585 0.3 1 509 114 114 SER H H 7.9204 0.03 1 510 114 114 SER C C 174.878 0.3 1 511 114 114 SER CA C 56.48 0.3 1 512 114 114 SER CB C 67.253 0.3 1 513 114 114 SER N N 120.22 0.3 1 514 115 115 TRP H H 8.0474 0.03 1 515 115 115 TRP C C 180.038 0.3 1 516 115 115 TRP CA C 60.115 0.3 1 517 115 115 TRP CB C 30.31 0.3 1 518 115 115 TRP N N 123.267 0.3 1 519 116 116 LYS H H 9.5804 0.03 1 520 116 116 LYS C C 181.915 0.3 1 521 116 116 LYS CA C 58.884 0.3 1 522 116 116 LYS CB C 30.31 0.3 1 523 116 116 LYS N N 126.238 0.3 1 524 117 117 ASN H H 8.5054 0.03 1 525 117 117 ASN C C 177.634 0.3 1 526 117 117 ASN CA C 56.069 0.3 1 527 117 117 ASN CB C 38.766 0.3 1 528 117 117 ASN N N 114.276 0.3 1 529 118 118 THR H H 7.4914 0.03 1 530 118 118 THR C C 176.52 0.3 1 531 118 118 THR CA C 65.598 0.3 1 532 118 118 THR CB C 71.604 0.3 1 533 118 118 THR N N 116.198 0.3 1 534 119 119 ALA H H 8.5854 0.03 1 535 119 119 ALA C C 177.282 0.3 1 536 119 119 ALA CA C 55.658 0.3 1 537 119 119 ALA CB C 19.72 0.3 1 538 119 119 ALA N N 129.557 0.3 1 539 120 120 LEU H H 7.8134 0.03 1 540 120 120 LEU C C 177.048 0.3 1 541 120 120 LEU CA C 54.984 0.3 1 542 120 120 LEU CB C 46.319 0.3 1 543 120 120 LEU N N 125.284 0.3 1 544 121 121 HIS H H 8.7594 0.03 1 545 121 121 HIS C C 172.474 0.3 1 546 121 121 HIS CA C 56.098 0.3 1 547 121 121 HIS CB C 35.236 0.3 1 548 121 121 HIS N N 123.557 0.3 1 549 122 122 LYS H H 8.6664 0.03 1 550 122 122 LYS C C 177.341 0.3 1 551 122 122 LYS CA C 59.47 0.3 1 552 122 122 LYS CB C 30.721 0.3 1 553 122 122 LYS N N 118.706 0.3 1 554 123 123 VAL H H 7.8804 0.03 1 555 123 123 VAL C C 176.696 0.3 1 556 123 123 VAL CA C 63.105 0.3 1 557 123 123 VAL CB C 35.154 0.3 1 558 123 123 VAL N N 121.737 0.3 1 559 124 124 THR H H 8.8294 0.03 1 560 124 124 THR C C 174.819 0.3 1 561 124 124 THR CA C 62.813 0.3 1 562 124 124 THR CB C 72.59 0.3 1 563 124 124 THR N N 120.653 0.3 1 564 125 125 TYR H H 9.0494 0.03 1 565 125 125 TYR C C 175.992 0.3 1 566 125 125 TYR CA C 59.382 0.3 1 567 125 125 TYR CB C 40.901 0.3 1 568 125 125 TYR N N 123.74 0.3 1 569 126 126 LEU H H 8.9154 0.03 1 570 126 126 LEU CA C 58.473 0.3 1 571 126 126 LEU CB C 45.088 0.3 1 572 126 126 LEU N N 125.463 0.3 1 573 127 127 GLN C C 178.69 0.3 1 574 127 127 GLN CA C 54.72 0.3 1 575 128 128 ASN H H 10.0624 0.03 1 576 128 128 ASN C C 177.4 0.3 1 577 128 128 ASN CA C 55.834 0.3 1 578 128 128 ASN CB C 38.356 0.3 1 579 128 128 ASN N N 129.519 0.3 1 580 129 129 GLY H H 9.2664 0.03 1 581 129 129 GLY C C 173.588 0.3 1 582 129 129 GLY CA C 47.097 0.3 1 583 129 129 GLY N N 102.700 0.3 1 584 130 130 LYS H H 7.8444 0.03 1 585 130 130 LYS CA C 56.069 0.3 1 586 130 130 LYS CB C 35.647 0.3 1 587 130 130 LYS N N 121.551 0.3 1 588 131 131 ASP C C 178.045 0.3 1 589 131 131 ASP CA C 57.887 0.3 1 590 132 132 ARG H H 9.1874 0.03 1 591 132 132 ARG C C 177.458 0.3 1 592 132 132 ARG CA C 57.359 0.3 1 593 132 132 ARG CB C 31.87 0.3 1 594 132 132 ARG N N 124.182 0.3 1 595 133 133 LYS H H 7.6054 0.03 1 596 133 133 LYS C C 171.829 0.3 1 597 133 133 LYS CA C 56.743 0.3 1 598 133 133 LYS CB C 36.706 0.3 1 599 133 133 LYS N N 118.722 0.3 1 600 134 134 TYR H H 7.9554 0.03 1 601 134 134 TYR C C 174.233 0.3 1 602 134 134 TYR CA C 57.77 0.3 1 603 134 134 TYR CB C 42.543 0.3 1 604 134 134 TYR N N 127.558 0.3 1 605 135 135 PHE H H 8.8454 0.03 1 606 135 135 PHE CA C 57.769 0.3 1 607 135 135 PHE CB C 45.416 0.3 1 608 135 135 PHE N N 125.361 0.3 1 609 136 136 HIS C C 180.566 0.3 1 610 136 136 HIS CA C 61.405 0.3 1 611 137 137 HIS H H 8.2324 0.03 1 612 137 137 HIS C C 170.715 0.3 1 613 137 137 HIS CA C 56.127 0.3 1 614 137 137 HIS CB C 32.691 0.3 1 615 137 137 HIS N N 117.19 0.3 1 616 138 138 ASN H H 8.4734 0.03 1 617 138 138 ASN C C 176.755 0.3 1 618 138 138 ASN CA C 57.154 0.3 1 619 138 138 ASN CB C 34.826 0.3 1 620 138 138 ASN N N 118.28 0.3 1 621 139 139 SER H H 7.3734 0.03 1 622 139 139 SER C C 172.415 0.3 1 623 139 139 SER CA C 58.473 0.3 1 624 139 139 SER CB C 66.515 0.3 1 625 139 139 SER N N 119.84 0.3 1 626 140 140 ASP H H 8.6714 0.03 1 627 140 140 ASP C C 174.409 0.3 1 628 140 140 ASP CA C 56.508 0.3 1 629 140 140 ASP CB C 41.311 0.3 1 630 140 140 ASP N N 127.554 0.3 1 631 141 141 PHE H H 8.4174 0.03 1 632 141 141 PHE C C 171.829 0.3 1 633 141 141 PHE CA C 56.215 0.3 1 634 141 141 PHE CB C 40.49 0.3 1 635 141 141 PHE N N 122.809 0.3 1 636 142 142 HIS H H 8.4604 0.03 1 637 142 142 HIS C C 175.523 0.3 1 638 142 142 HIS CA C 56.274 0.3 1 639 142 142 HIS CB C 33.84 0.3 1 640 142 142 HIS N N 126.212 0.3 1 641 143 143 ILE H H 8.6584 0.03 1 642 143 143 ILE CA C 60.174 0.3 1 643 143 143 ILE CB C 40.983 0.3 1 644 143 143 ILE N N 126.414 0.3 1 645 144 144 PRO C C 178.572 0.3 1 646 144 144 PRO CA C 66.917 0.3 1 647 145 145 LYS H H 7.0924 0.03 1 648 145 145 LYS C C 175.992 0.3 1 649 145 145 LYS CA C 56.362 0.3 1 650 145 145 LYS CB C 36.221 0.3 1 651 145 145 LYS N N 114.619 0.3 1 652 146 146 ALA H H 8.7474 0.03 1 653 146 146 ALA C C 182.794 0.3 1 654 146 146 ALA CA C 54.602 0.3 1 655 146 146 ALA CB C 20.418 0.3 1 656 146 146 ALA N N 127.698 0.3 1 657 147 147 THR H H 9.7114 0.03 1 658 147 147 THR C C 178.455 0.3 1 659 147 147 THR CA C 61.171 0.3 1 660 147 147 THR CB C 74.806 0.3 1 661 147 147 THR N N 115.381 0.3 1 662 148 148 LEU H H 9.0504 0.03 1 663 148 148 LEU CA C 59.998 0.3 1 664 148 148 LEU CB C 41.886 0.3 1 665 148 148 LEU N N 121.34 0.3 1 666 149 149 LYS H H 7.7654 0.03 1 667 149 149 LYS C C 179.862 0.3 1 668 149 149 LYS CA C 59.06 0.3 1 669 149 149 LYS CB C 32.527 0.3 1 670 149 149 LYS N N 117.036 0.3 1 671 150 150 ASP H H 8.1384 0.03 1 672 150 150 ASP C C 175.875 0.3 1 673 150 150 ASP CA C 58.063 0.3 1 674 150 150 ASP CB C 42.707 0.3 1 675 150 150 ASP N N 117.618 0.3 1 676 151 151 SER H H 7.8094 0.03 1 677 151 151 SER C C 175.582 0.3 1 678 151 151 SER CA C 61.463 0.3 1 679 151 151 SER CB C 66.186 0.3 1 680 151 151 SER N N 116.693 0.3 1 681 152 152 GLY H H 9.3524 0.03 1 682 152 152 GLY C C 170.949 0.3 1 683 152 152 GLY CA C 46.834 0.3 1 684 152 152 GLY N N 111.215 0.3 1 685 153 153 SER H H 8.2184 0.03 1 686 153 153 SER C C 175.288 0.3 1 687 153 153 SER CA C 58.59 0.3 1 688 153 153 SER CB C 65.447 0.3 1 689 153 153 SER N N 115.629 0.3 1 690 154 154 TYR H H 9.9184 0.03 1 691 154 154 TYR C C 177.575 0.3 1 692 154 154 TYR CA C 58.355 0.3 1 693 154 154 TYR CB C 44.184 0.3 1 694 154 154 TYR N N 129.023 0.3 1 695 155 155 PHE H H 8.5154 0.03 1 696 155 155 PHE C C 171.418 0.3 1 697 155 155 PHE CA C 58.561 0.3 1 698 155 155 PHE CB C 41.64 0.3 1 699 155 155 PHE N N 113.802 0.3 1 700 156 156 CYS H H 8.6924 0.03 1 701 156 156 CYS CA C 55.688 0.3 1 702 156 156 CYS CB C 54.282 0.3 1 703 156 156 CYS N N 114.603 0.3 1 704 157 157 ARG H H 8.4954 0.03 1 705 157 157 ARG C C 174.526 0.3 1 706 157 157 ARG CA C 56.069 0.3 1 707 157 157 ARG CB C 34.826 0.3 1 708 157 157 ARG N N 118.36 0.3 1 709 158 158 GLY H H 8.4384 0.03 1 710 158 158 GLY C C 168.721 0.3 1 711 158 158 GLY CA C 47.889 0.3 1 712 158 158 GLY N N 106.217 0.3 1 713 159 159 LEU H H 8.7154 0.03 1 714 159 159 LEU C C 178.866 0.3 1 715 159 159 LEU CA C 55.688 0.3 1 716 159 159 LEU CB C 45.005 0.3 1 717 159 159 LEU N N 121.773 0.3 1 718 160 160 VAL H H 8.7034 0.03 1 719 160 160 VAL C C 179.862 0.3 1 720 160 160 VAL CA C 62.285 0.3 1 721 160 160 VAL CB C 33.019 0.3 1 722 160 160 VAL N N 125.547 0.3 1 723 161 161 GLY H H 9.0484 0.03 1 724 161 161 GLY C C 175.523 0.3 1 725 161 161 GLY CA C 48.886 0.3 1 726 161 161 GLY N N 118.93 0.3 1 727 162 162 SER H H 8.7974 0.03 1 728 162 162 SER C C 174.057 0.3 1 729 162 162 SER CA C 59.851 0.3 1 730 162 162 SER CB C 65.283 0.3 1 731 162 162 SER N N 121.878 0.3 1 732 163 163 LYS H H 8.0734 0.03 1 733 163 163 LYS C C 176.051 0.3 1 734 163 163 LYS CA C 56.861 0.3 1 735 163 163 LYS CB C 35.154 0.3 1 736 163 163 LYS N N 124.207 0.3 1 737 164 164 ASN H H 8.5644 0.03 1 738 164 164 ASN C C 176.637 0.3 1 739 164 164 ASN CA C 55.511 0.3 1 740 164 164 ASN CB C 40.162 0.3 1 741 164 164 ASN N N 124.582 0.3 1 742 165 165 VAL H H 8.8334 0.03 1 743 165 165 VAL C C 174.526 0.3 1 744 165 165 VAL CA C 61.787 0.3 1 745 165 165 VAL CB C 36.632 0.3 1 746 165 165 VAL N N 121.547 0.3 1 747 166 166 SER H H 8.3894 0.03 1 748 166 166 SER C C 174.819 0.3 1 749 166 166 SER CA C 58.796 0.3 1 750 166 166 SER CB C 67.664 0.3 1 751 166 166 SER N N 115.306 0.3 1 752 167 167 SER H H 9.6344 0.03 1 753 167 167 SER C C 174.643 0.3 1 754 167 167 SER CA C 60.027 0.3 1 755 167 167 SER CB C 68.156 0.3 1 756 167 167 SER N N 121.225 0.3 1 757 168 168 GLU H H 8.5934 0.03 1 758 168 168 GLU C C 182.794 0.3 1 759 168 168 GLU CA C 58.209 0.3 1 760 168 168 GLU CB C 31.788 0.3 1 761 168 168 GLU N N 119.113 0.3 1 762 169 169 THR H H 8.6954 0.03 1 763 169 169 THR C C 176.461 0.3 1 764 169 169 THR CA C 63.78 0.3 1 765 169 169 THR CB C 71.851 0.3 1 766 169 169 THR N N 118.324 0.3 1 767 170 170 VAL H H 9.5264 0.03 1 768 170 170 VAL C C 175.875 0.3 1 769 170 170 VAL CA C 62.461 0.3 1 770 170 170 VAL CB C 36.221 0.3 1 771 170 170 VAL N N 123.5 0.3 1 772 171 171 ASN H H 8.3974 0.03 1 773 171 171 ASN C C 178.016 0.3 1 774 171 171 ASN CA C 54.925 0.3 1 775 171 171 ASN CB C 41.065 0.3 1 776 171 171 ASN N N 124.822 0.3 1 777 172 172 ILE H H 9.3934 0.03 1 778 172 172 ILE C C 182.707 0.3 1 779 172 172 ILE CA C 61.874 0.3 1 780 172 172 ILE CB C 40.408 0.3 1 781 172 172 ILE N N 126.069 0.3 1 782 173 173 THR H H 9.0254 0.03 1 783 173 173 THR C C 171.184 0.3 1 784 173 173 THR CA C 63.927 0.3 1 785 173 173 THR CB C 73.164 0.3 1 786 173 173 THR N N 125.592 0.3 1 787 174 174 ILE H H 8.2184 0.03 1 788 174 174 ILE C C 177.927 0.3 1 789 174 174 ILE CA C 59.206 0.3 1 790 174 174 ILE CB C 38.188 0.3 1 791 174 174 ILE N N 127.311 0.3 1 792 175 175 THR H H 9.1144 0.03 1 793 175 175 THR C C 174.409 0.3 1 794 175 175 THR CA C 61.992 0.3 1 795 175 175 THR CB C 72.097 0.3 1 796 175 175 THR N N 120.194 0.3 1 797 176 176 GLN H H 8.5524 0.03 1 798 176 176 GLN C C 179.217 0.3 1 799 176 176 GLN CA C 57.682 0.3 1 800 176 176 GLN CB C 31.049 0.3 1 801 176 176 GLN N N 121.586 0.3 1 802 177 177 ALA H H 9.1644 0.03 1 803 177 177 ALA C C 181.27 0.3 1 804 177 177 ALA CA C 54.486 0.3 1 805 177 177 ALA CB C 20.623 0.3 1 806 177 177 ALA N N 127.576 0.3 1 807 178 178 ALA H H 8.3804 0.03 1 808 178 178 ALA C C 180.977 0.3 1 809 178 178 ALA CA C 54.133 0.3 1 810 178 178 ALA CB C 20.295 0.3 1 811 178 178 ALA N N 123.475 0.3 1 812 179 179 ALA H H 8.1694 0.03 1 813 179 179 ALA C C 181.27 0.3 1 814 179 179 ALA CA C 54.163 0.3 1 815 179 179 ALA CB C 20.295 0.3 1 816 179 179 ALA N N 123.386 0.3 1 817 180 180 LEU H H 8.0904 0.03 1 818 180 180 LEU C C 179.686 0.3 1 819 180 180 LEU CA C 56.743 0.3 1 820 180 180 LEU CB C 42.625 0.3 1 821 180 180 LEU N N 121.363 0.3 1 822 181 181 GLU H H 8.2114 0.03 1 823 181 181 GLU C C 178.807 0.3 1 824 181 181 GLU CA C 58.15 0.3 1 825 181 181 GLU CB C 31.295 0.3 1 826 181 181 GLU N N 121.398 0.3 1 827 182 182 HIS H H 8.3284 0.03 1 828 182 182 HIS C C 175.201 0.3 1 829 182 182 HIS CA C 57.329 0.3 1 830 182 182 HIS CB C 31.295 0.3 1 831 182 182 HIS N N 120.024 0.3 1 832 183 183 HIS H H 8.1994 0.03 1 833 183 183 HIS CA C 59.06 0.3 1 834 183 183 HIS CB C 31.295 0.3 1 835 183 183 HIS N N 125.799 0.3 1 stop_ save_