data_36117 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; SOLUTION STRUCTURE OF HUMAN MOG1 ; _BMRB_accession_number 36117 _BMRB_flat_file_name bmr36117.str _Entry_type original _Submission_date 2017-09-21 _Accession_date 2017-10-20 _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 Hu Q. . . 2 Liu Y. . . 3 Bao X. . . 4 Liu H. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 737 "13C chemical shifts" 569 "15N chemical shifts" 160 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-03-08 update BMRB 'update entry citation' 2018-02-06 original author 'original release' stop_ _Original_release_date 2017-10-20 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Mitosis-specific acetylation tunes Ran effector binding for chromosome segregation ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29040603 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Bao X. . . 2 Liu H. . . 3 Liu X. . . 4 Ruan K. . . 5 Zhang Y. . . 6 Zhang Z. . . 7 Hu Q. . . 8 Liu Y. . . 9 Akram S. . . 10 Zhang J. . . 11 Gong Q. . . 12 Wang W. . . 13 Yuan X. . . 14 Dou Z. . . 15 Tian R. . . 16 Yao X. . . 17 Wu J. . . 18 Shi Y. . . stop_ _Journal_abbreviation 'J. Mol. Cell. Biol.' _Journal_volume 10 _Journal_issue 1 _Journal_CSD 0353 _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 18 _Page_last 32 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Ran guanine nucleotide release factor' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label entity_1 $entity_1 stop_ _System_molecular_weight . _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Ran guanine nucleotide release factor' _Molecular_mass 21523.146 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 194 _Mol_residue_sequence ; MEPTRDCPLFGGAFSAILPM GAIDVSDLRPVPDNQEVFCH PVTDQSLIVELLELQAHVRG EAAARYHFEDVGGVQGARAV HVESVQPLSLENLALRGRCQ EAWVLSGKQQIAKENQQVAK DVTLHQALLRLPQYQTDLLL TFNQPPPDNRSSLGPENLSP APWSLGDFEQLVTSLTLHDP NIFGPQVEHHHHHH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 MET 2 2 GLU 3 3 PRO 4 4 THR 5 5 ARG 6 6 ASP 7 7 CYS 8 8 PRO 9 9 LEU 10 10 PHE 11 11 GLY 12 12 GLY 13 13 ALA 14 14 PHE 15 15 SER 16 16 ALA 17 17 ILE 18 18 LEU 19 19 PRO 20 20 MET 21 21 GLY 22 22 ALA 23 23 ILE 24 24 ASP 25 25 VAL 26 26 SER 27 27 ASP 28 28 LEU 29 29 ARG 30 30 PRO 31 31 VAL 32 32 PRO 33 33 ASP 34 34 ASN 35 35 GLN 36 36 GLU 37 37 VAL 38 38 PHE 39 39 CYS 40 40 HIS 41 41 PRO 42 42 VAL 43 43 THR 44 44 ASP 45 45 GLN 46 46 SER 47 47 LEU 48 48 ILE 49 49 VAL 50 50 GLU 51 51 LEU 52 52 LEU 53 53 GLU 54 54 LEU 55 55 GLN 56 56 ALA 57 57 HIS 58 58 VAL 59 59 ARG 60 60 GLY 61 61 GLU 62 62 ALA 63 63 ALA 64 64 ALA 65 65 ARG 66 66 TYR 67 67 HIS 68 68 PHE 69 69 GLU 70 70 ASP 71 71 VAL 72 72 GLY 73 73 GLY 74 74 VAL 75 75 GLN 76 76 GLY 77 77 ALA 78 78 ARG 79 79 ALA 80 80 VAL 81 81 HIS 82 82 VAL 83 83 GLU 84 84 SER 85 85 VAL 86 86 GLN 87 87 PRO 88 88 LEU 89 89 SER 90 90 LEU 91 91 GLU 92 92 ASN 93 93 LEU 94 94 ALA 95 95 LEU 96 96 ARG 97 97 GLY 98 98 ARG 99 99 CYS 100 100 GLN 101 101 GLU 102 102 ALA 103 103 TRP 104 104 VAL 105 105 LEU 106 106 SER 107 107 GLY 108 108 LYS 109 109 GLN 110 110 GLN 111 111 ILE 112 112 ALA 113 113 LYS 114 114 GLU 115 115 ASN 116 116 GLN 117 117 GLN 118 118 VAL 119 119 ALA 120 120 LYS 121 121 ASP 122 122 VAL 123 123 THR 124 124 LEU 125 125 HIS 126 126 GLN 127 127 ALA 128 128 LEU 129 129 LEU 130 130 ARG 131 131 LEU 132 132 PRO 133 133 GLN 134 134 TYR 135 135 GLN 136 136 THR 137 137 ASP 138 138 LEU 139 139 LEU 140 140 LEU 141 141 THR 142 142 PHE 143 143 ASN 144 144 GLN 145 145 PRO 146 146 PRO 147 147 PRO 148 148 ASP 149 149 ASN 150 150 ARG 151 151 SER 152 152 SER 153 153 LEU 154 154 GLY 155 155 PRO 156 156 GLU 157 157 ASN 158 158 LEU 159 159 SER 160 160 PRO 161 161 ALA 162 162 PRO 163 163 TRP 164 164 SER 165 165 LEU 166 166 GLY 167 167 ASP 168 168 PHE 169 169 GLU 170 170 GLN 171 171 LEU 172 172 VAL 173 173 THR 174 174 SER 175 175 LEU 176 176 THR 177 177 LEU 178 178 HIS 179 179 ASP 180 180 PRO 181 181 ASN 182 182 ILE 183 183 PHE 184 184 GLY 185 185 PRO 186 186 GLN 187 187 VAL 188 188 GLU 189 189 HIS 190 190 HIS 191 191 HIS 192 192 HIS 193 193 HIS 194 194 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 _Gene_mnemonic $entity_1 Human 9606 Eukaryota Metazoa Homo sapiens 'RANGRF, MOG1, RANGNRF, HSPC165, HSPC236, MDS5' stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $entity_1 'recombinant technology' . . . BL21(DE3) PLASMID PET22B+ stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_2 _Saveframe_category sample _Sample_type solution _Details '0.9 mM [U-13C] Mog1, 90% H2O/10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 0.9 mM [U-13C] H2O 90 % 'natural abundance' D2O 10 % [U-2H] stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details '0.9 mM [U-99% 13C; U-99% 15N] Mog1, 100% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 0.9 mM '[U-99% 13C; U-99% 15N]' D2O 100 % [U-2H] stop_ save_ save_sample_1 _Saveframe_category sample _Sample_type solution _Details '0.9 mM [U-99% 15N] Mog1, 90% H2O/10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 0.9 mM '[U-99% 15N]' H2O 90 % 'natural abundance' D2O 10 % [U-2H] stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name CNS _Version . loop_ _Vendor _Address _Electronic_address 'BRUNGER, ADAMS, CLORE, GROS, NILGES, READ' . . stop_ loop_ _Task refinement stop_ _Details . save_ save_software_2 _Saveframe_category software _Name Molmol _Version . loop_ _Vendor _Address _Electronic_address 'Koradi, Billeter and Wuthrich' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_3 _Saveframe_category software _Name NMRDraw _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_4 _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_5 _Saveframe_category software _Name Procheck _Version . loop_ _Vendor _Address _Electronic_address 'Laskowski, MacArthur, Smith, Jones, Hutchinson, Morris, Moss and Thornton' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_6 _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_7 _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 600 _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_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_2 save_ save_2D_1H-1H_TOCSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $sample_3 save_ save_2D_1H-1H_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_3 save_ save_3D_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_3 save_ save_3D_CBCA(CO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_3 save_ save_3D_CBCANH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCANH' _Sample_label $sample_3 save_ save_3D_HNCA_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_3 save_ save_3D_HN(CO)CA_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_3 save_ save_3D_HCCH-TOCSY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_3 save_ save_3D_HCCH-COSY_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $sample_3 save_ save_3D_C(CO)NH-TOCSY_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH-TOCSY' _Sample_label $sample_3 save_ save_3D_HC(CO)NH-TOCSY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HC(CO)NH-TOCSY' _Sample_label $sample_3 save_ save_3D_HBHA(CO)NH_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_3 save_ save_3D_1H-15N_NOESY_15 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_3 save_ save_3D_1H-13C_NOESY_16 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_3 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 150 . mM pH 6.8 . pH pressure 1 . atm temperature 303 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_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 0.000 internal indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.000 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.000 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_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '2D 1H-13C HSQC' '2D 1H-1H TOCSY' '2D 1H-1H NOESY' '3D HNCO' '3D CBCA(CO)NH' '3D CBCANH' '3D HNCA' '3D HN(CO)CA' '3D HCCH-TOCSY' '3D HCCH-COSY' '3D C(CO)NH-TOCSY' '3D HC(CO)NH-TOCSY' '3D HBHA(CO)NH' '3D 1H-15N NOESY' '3D 1H-13C NOESY' stop_ loop_ _Sample_label $sample_1 $sample_2 $sample_3 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name entity_1 _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 PRO HA H 4.454 0.008 . 2 3 3 PRO HB2 H 1.891 0.000 . 3 3 3 PRO HB3 H 2.269 0.004 . 4 3 3 PRO HG2 H 1.936 0.000 . 5 3 3 PRO HG3 H 1.936 0.000 . 6 3 3 PRO HD2 H 3.728 0.000 . 7 3 3 PRO HD3 H 3.728 0.000 . 8 3 3 PRO C C 176.829 0.000 . 9 3 3 PRO CA C 63.157 0.075 . 10 3 3 PRO CB C 32.200 0.107 . 11 3 3 PRO CG C 27.907 0.000 . 12 3 3 PRO CD C 51.116 0.000 . 13 4 4 THR H H 8.107 0.003 . 14 4 4 THR HA H 4.303 0.004 . 15 4 4 THR HB H 4.137 0.003 . 16 4 4 THR HG2 H 1.143 0.001 . 17 4 4 THR C C 174.299 0.000 . 18 4 4 THR CA C 61.595 0.088 . 19 4 4 THR CB C 69.978 0.164 . 20 4 4 THR CG2 C 21.909 0.000 . 21 4 4 THR N N 114.154 0.022 . 22 5 5 ARG H H 8.448 0.003 . 23 5 5 ARG HA H 4.347 0.001 . 24 5 5 ARG HB2 H 1.661 0.000 . 25 5 5 ARG HB3 H 1.889 0.006 . 26 5 5 ARG HG2 H 1.565 0.006 . 27 5 5 ARG HG3 H 1.565 0.006 . 28 5 5 ARG HD2 H 3.149 0.004 . 29 5 5 ARG HD3 H 3.149 0.004 . 30 5 5 ARG C C 174.902 0.000 . 31 5 5 ARG CA C 55.832 0.111 . 32 5 5 ARG CB C 31.108 0.023 . 33 5 5 ARG CD C 43.362 0.000 . 34 5 5 ARG N N 121.950 0.037 . 35 6 6 ASP H H 8.149 0.003 . 36 6 6 ASP HA H 4.382 0.004 . 37 6 6 ASP HB2 H 2.382 0.010 . 38 6 6 ASP HB3 H 2.382 0.010 . 39 6 6 ASP C C 175.177 0.000 . 40 6 6 ASP CA C 53.807 0.050 . 41 6 6 ASP CB C 41.136 0.000 . 42 6 6 ASP N N 120.706 0.022 . 43 7 7 CYS H H 8.842 0.008 . 44 7 7 CYS HB3 H 2.818 0.000 . 45 7 7 CYS CA C 56.077 0.066 . 46 7 7 CYS CB C 29.423 0.000 . 47 7 7 CYS N N 123.566 0.038 . 48 8 8 PRO HA H 4.648 0.000 . 49 8 8 PRO HB3 H 2.184 0.012 . 50 8 8 PRO HD2 H 3.756 0.000 . 51 8 8 PRO HD3 H 3.756 0.000 . 52 8 8 PRO CA C 62.512 0.000 . 53 9 9 LEU H H 8.591 0.004 . 54 9 9 LEU HD1 H 0.661 0.005 . 55 9 9 LEU HD2 H 0.661 0.005 . 56 9 9 LEU N N 120.631 0.020 . 57 10 10 PHE HA H 3.983 0.000 . 58 10 10 PHE HB2 H 3.126 0.002 . 59 10 10 PHE HB3 H 3.126 0.002 . 60 10 10 PHE C C 178.334 0.000 . 61 10 10 PHE CA C 59.219 0.007 . 62 11 11 GLY H H 9.026 0.002 . 63 11 11 GLY HA2 H 4.008 0.002 . 64 11 11 GLY HA3 H 3.805 0.000 . 65 11 11 GLY C C 174.763 0.000 . 66 11 11 GLY CA C 46.244 0.085 . 67 11 11 GLY N N 107.003 0.035 . 68 12 12 GLY H H 7.611 0.008 . 69 12 12 GLY HA2 H 4.545 0.014 . 70 12 12 GLY HA3 H 3.547 0.007 . 71 12 12 GLY C C 174.605 0.000 . 72 12 12 GLY CA C 44.474 0.105 . 73 12 12 GLY N N 104.795 0.061 . 74 13 13 ALA H H 7.703 0.004 . 75 13 13 ALA HA H 4.121 0.015 . 76 13 13 ALA HB H 1.638 0.018 . 77 13 13 ALA C C 177.777 0.000 . 78 13 13 ALA CA C 55.073 0.077 . 79 13 13 ALA CB C 19.465 0.100 . 80 13 13 ALA N N 123.011 0.063 . 81 14 14 PHE H H 8.396 0.006 . 82 14 14 PHE HA H 5.912 0.018 . 83 14 14 PHE HB2 H 2.766 0.012 . 84 14 14 PHE HB3 H 3.111 0.007 . 85 14 14 PHE C C 175.569 0.000 . 86 14 14 PHE CA C 55.337 0.070 . 87 14 14 PHE CB C 46.052 0.019 . 88 14 14 PHE N N 112.380 0.028 . 89 15 15 SER H H 8.956 0.004 . 90 15 15 SER HA H 5.278 0.004 . 91 15 15 SER HB3 H 3.763 0.014 . 92 15 15 SER C C 171.994 0.000 . 93 15 15 SER CA C 58.646 0.034 . 94 15 15 SER CB C 66.115 0.014 . 95 15 15 SER N N 113.070 0.065 . 96 16 16 ALA H H 8.543 0.006 . 97 16 16 ALA HA H 4.440 0.000 . 98 16 16 ALA HB H 1.178 0.018 . 99 16 16 ALA C C 174.897 0.000 . 100 16 16 ALA CA C 51.722 0.089 . 101 16 16 ALA CB C 24.128 0.150 . 102 16 16 ALA N N 119.326 0.019 . 103 17 17 ILE H H 8.657 0.006 . 104 17 17 ILE HA H 4.065 0.007 . 105 17 17 ILE HB H 1.350 0.003 . 106 17 17 ILE HG12 H 1.490 0.000 . 107 17 17 ILE HG13 H 1.490 0.000 . 108 17 17 ILE HG2 H 0.568 0.006 . 109 17 17 ILE C C 174.985 0.000 . 110 17 17 ILE CA C 61.463 0.073 . 111 17 17 ILE CB C 37.718 0.098 . 112 17 17 ILE CG2 C 37.256 0.016 . 113 17 17 ILE CD1 C 32.919 0.063 . 114 17 17 ILE N N 119.775 0.058 . 115 18 18 LEU H H 7.624 0.004 . 116 18 18 LEU HA H 4.322 0.000 . 117 18 18 LEU HB2 H 0.694 0.007 . 118 18 18 LEU HB3 H 1.378 0.002 . 119 18 18 LEU HG H 0.963 0.003 . 120 18 18 LEU HD1 H 0.084 0.004 . 121 18 18 LEU HD2 H -0.022 0.004 . 122 18 18 LEU CA C 50.710 0.083 . 123 18 18 LEU CB C 42.109 0.000 . 124 18 18 LEU CD1 C 22.709 0.014 . 125 18 18 LEU CD2 C 24.738 0.008 . 126 18 18 LEU N N 128.687 0.059 . 127 19 19 PRO HA H 4.121 0.007 . 128 19 19 PRO C C 176.763 0.000 . 129 20 20 MET H H 8.510 0.002 . 130 20 20 MET HA H 4.062 0.020 . 131 20 20 MET HB2 H 2.015 0.007 . 132 20 20 MET HB3 H 2.570 0.010 . 133 20 20 MET C C 177.567 0.000 . 134 20 20 MET N N 121.887 0.026 . 135 21 21 GLY H H 8.936 0.007 . 136 21 21 GLY HA2 H 3.937 0.000 . 137 21 21 GLY HA3 H 3.706 0.002 . 138 21 21 GLY C C 173.645 0.000 . 139 21 21 GLY CA C 45.185 0.103 . 140 21 21 GLY N N 112.414 0.055 . 141 22 22 ALA H H 7.255 0.006 . 142 22 22 ALA HA H 4.414 0.014 . 143 22 22 ALA HB H 1.353 0.016 . 144 22 22 ALA C C 176.838 0.000 . 145 22 22 ALA CA C 53.605 0.068 . 146 22 22 ALA CB C 19.430 0.185 . 147 22 22 ALA N N 119.189 0.033 . 148 23 23 ILE H H 9.296 0.009 . 149 23 23 ILE HA H 4.303 0.003 . 150 23 23 ILE HB H 2.171 0.003 . 151 23 23 ILE HG2 H 0.764 0.000 . 152 23 23 ILE C C 175.726 0.000 . 153 23 23 ILE CA C 60.204 0.103 . 154 23 23 ILE CB C 39.246 0.047 . 155 23 23 ILE N N 125.237 0.064 . 156 24 24 ASP H H 8.719 0.005 . 157 24 24 ASP HA H 4.384 0.006 . 158 24 24 ASP HB2 H 2.629 0.015 . 159 24 24 ASP HB3 H 3.042 0.003 . 160 24 24 ASP C C 177.367 0.000 . 161 24 24 ASP CA C 53.170 0.071 . 162 24 24 ASP CB C 40.071 0.148 . 163 24 24 ASP N N 126.566 0.050 . 164 25 25 VAL H H 8.643 0.006 . 165 25 25 VAL HA H 3.623 0.012 . 166 25 25 VAL HB H 1.887 0.007 . 167 25 25 VAL HG1 H 0.997 0.002 . 168 25 25 VAL HG2 H 0.875 0.005 . 169 25 25 VAL C C 177.243 0.000 . 170 25 25 VAL CA C 65.028 0.074 . 171 25 25 VAL CB C 31.527 0.076 . 172 25 25 VAL CG1 C 24.195 0.004 . 173 25 25 VAL CG2 C 21.780 0.037 . 174 25 25 VAL N N 128.639 0.061 . 175 26 26 SER H H 8.696 0.003 . 176 26 26 SER HA H 4.721 0.013 . 177 26 26 SER HB2 H 3.776 0.003 . 178 26 26 SER HB3 H 3.865 0.000 . 179 26 26 SER C C 175.965 0.000 . 180 26 26 SER CA C 61.236 0.116 . 181 26 26 SER CB C 62.743 0.001 . 182 26 26 SER N N 116.804 0.044 . 183 27 27 ASP H H 7.546 0.002 . 184 27 27 ASP HA H 4.625 0.013 . 185 27 27 ASP HB2 H 2.689 0.004 . 186 27 27 ASP HB3 H 2.689 0.004 . 187 27 27 ASP C C 176.518 0.000 . 188 27 27 ASP CA C 55.844 0.053 . 189 27 27 ASP CB C 40.873 0.011 . 190 27 27 ASP N N 119.921 0.048 . 191 28 28 LEU H H 8.079 0.005 . 192 28 28 LEU HA H 4.359 0.004 . 193 28 28 LEU HB2 H 1.553 0.014 . 194 28 28 LEU HB3 H 1.900 0.002 . 195 28 28 LEU HD1 H 0.817 0.002 . 196 28 28 LEU HD2 H 0.817 0.002 . 197 28 28 LEU C C 176.774 0.000 . 198 28 28 LEU CA C 55.712 0.065 . 199 28 28 LEU CB C 43.913 0.053 . 200 28 28 LEU N N 119.272 0.036 . 201 29 29 ARG H H 8.329 0.004 . 202 29 29 ARG CA C 53.706 0.065 . 203 29 29 ARG CB C 29.760 0.000 . 204 29 29 ARG N N 118.178 0.056 . 205 30 30 PRO HA H 4.408 0.000 . 206 30 30 PRO HB2 H 2.164 0.006 . 207 30 30 PRO HB3 H 1.759 0.000 . 208 30 30 PRO HD2 H 3.639 0.000 . 209 30 30 PRO HD3 H 3.639 0.000 . 210 30 30 PRO C C 176.895 0.000 . 211 30 30 PRO CA C 63.422 0.036 . 212 30 30 PRO CB C 31.506 0.032 . 213 31 31 VAL H H 8.386 0.002 . 214 31 31 VAL HA H 4.408 0.000 . 215 31 31 VAL HB H 1.683 0.000 . 216 31 31 VAL HG1 H 1.014 0.000 . 217 31 31 VAL HG2 H 0.748 0.000 . 218 31 31 VAL CA C 59.237 0.034 . 219 31 31 VAL CB C 35.497 0.000 . 220 31 31 VAL N N 126.758 0.034 . 221 32 32 PRO HB2 H 1.953 0.004 . 222 32 32 PRO HB3 H 2.418 0.012 . 223 32 32 PRO HD2 H 3.679 0.001 . 224 32 32 PRO HD3 H 3.679 0.001 . 225 32 32 PRO C C 177.199 0.000 . 226 32 32 PRO CA C 63.321 0.125 . 227 32 32 PRO CB C 33.179 0.050 . 228 33 33 ASP H H 8.650 0.003 . 229 33 33 ASP HA H 4.478 0.011 . 230 33 33 ASP HB3 H 2.838 0.001 . 231 33 33 ASP C C 176.356 0.000 . 232 33 33 ASP CA C 56.740 0.042 . 233 33 33 ASP CB C 40.912 0.034 . 234 33 33 ASP N N 119.438 0.043 . 235 34 34 ASN H H 8.258 0.010 . 236 34 34 ASN HA H 4.803 0.002 . 237 34 34 ASN HB2 H 2.765 0.002 . 238 34 34 ASN HB3 H 3.620 0.012 . 239 34 34 ASN C C 173.143 0.000 . 240 34 34 ASN CA C 53.279 0.060 . 241 34 34 ASN CB C 37.639 0.057 . 242 34 34 ASN N N 114.769 0.040 . 243 35 35 GLN H H 7.999 0.007 . 244 35 35 GLN HA H 5.783 0.003 . 245 35 35 GLN HB2 H 1.893 0.015 . 246 35 35 GLN HB3 H 2.184 0.000 . 247 35 35 GLN C C 174.720 0.000 . 248 35 35 GLN CA C 54.617 0.067 . 249 35 35 GLN CB C 33.894 0.013 . 250 35 35 GLN N N 118.629 0.044 . 251 36 36 GLU H H 8.720 0.007 . 252 36 36 GLU HA H 4.502 0.002 . 253 36 36 GLU HB2 H 1.183 0.000 . 254 36 36 GLU C C 174.620 0.000 . 255 36 36 GLU CA C 55.494 0.052 . 256 36 36 GLU CB C 32.219 0.117 . 257 36 36 GLU N N 120.097 0.095 . 258 37 37 VAL H H 9.217 0.008 . 259 37 37 VAL HA H 4.818 0.000 . 260 37 37 VAL HB H 1.701 0.000 . 261 37 37 VAL C C 173.105 0.000 . 262 37 37 VAL CA C 61.312 0.062 . 263 37 37 VAL CB C 34.982 0.137 . 264 37 37 VAL CG1 C 22.589 0.000 . 265 37 37 VAL CG2 C 22.589 0.000 . 266 37 37 VAL N N 122.591 0.053 . 267 38 38 PHE H H 9.165 0.006 . 268 38 38 PHE HA H 5.885 0.019 . 269 38 38 PHE HB2 H 2.835 0.004 . 270 38 38 PHE HB3 H 2.835 0.004 . 271 38 38 PHE CA C 55.540 0.097 . 272 38 38 PHE CB C 43.463 0.000 . 273 38 38 PHE N N 123.231 0.018 . 274 39 39 CYS H H 9.748 0.007 . 275 39 39 CYS HA H 5.729 0.000 . 276 39 39 CYS HB2 H 2.769 0.000 . 277 39 39 CYS HB3 H 3.079 0.000 . 278 39 39 CYS C C 172.120 0.000 . 279 39 39 CYS CA C 56.156 0.049 . 280 39 39 CYS CB C 32.293 0.000 . 281 39 39 CYS N N 118.301 0.035 . 282 40 40 HIS H H 7.939 0.003 . 283 40 40 HIS CA C 54.616 0.000 . 284 40 40 HIS N N 125.493 0.022 . 285 42 42 VAL C C 176.910 0.000 . 286 43 43 THR H H 8.003 0.002 . 287 43 43 THR HA H 4.175 0.008 . 288 43 43 THR HB H 4.138 0.000 . 289 43 43 THR HG2 H 0.478 0.000 . 290 43 43 THR C C 174.462 0.000 . 291 43 43 THR CA C 61.838 0.000 . 292 43 43 THR CB C 69.740 0.000 . 293 43 43 THR CG2 C 22.123 0.000 . 294 43 43 THR N N 112.098 0.045 . 295 44 44 ASP H H 8.103 0.010 . 296 44 44 ASP HA H 4.626 0.007 . 297 44 44 ASP HB2 H 2.540 0.015 . 298 44 44 ASP HB3 H 2.857 0.025 . 299 44 44 ASP C C 175.772 0.000 . 300 44 44 ASP CA C 55.066 0.071 . 301 44 44 ASP CB C 40.340 0.000 . 302 44 44 ASP N N 115.746 0.078 . 303 45 45 GLN H H 7.544 0.003 . 304 45 45 GLN HA H 4.580 0.006 . 305 45 45 GLN HB2 H 2.249 0.003 . 306 45 45 GLN C C 175.246 0.000 . 307 45 45 GLN CA C 56.286 0.034 . 308 45 45 GLN CB C 32.960 0.054 . 309 45 45 GLN N N 116.778 0.035 . 310 46 46 SER H H 8.683 0.005 . 311 46 46 SER HA H 5.823 0.011 . 312 46 46 SER HB2 H 3.933 0.001 . 313 46 46 SER HB3 H 4.014 0.005 . 314 46 46 SER C C 172.862 0.000 . 315 46 46 SER CA C 57.711 0.090 . 316 46 46 SER CB C 66.960 0.215 . 317 46 46 SER N N 112.042 0.054 . 318 47 47 LEU H H 9.505 0.007 . 319 47 47 LEU HA H 5.801 0.000 . 320 47 47 LEU HB2 H 1.344 0.000 . 321 47 47 LEU HB3 H 1.762 0.000 . 322 47 47 LEU HD1 H 0.869 0.002 . 323 47 47 LEU HD2 H 0.129 0.007 . 324 47 47 LEU C C 174.706 0.000 . 325 47 47 LEU CA C 53.468 0.057 . 326 47 47 LEU CB C 46.285 0.022 . 327 47 47 LEU CD2 C 26.118 0.020 . 328 47 47 LEU N N 122.931 0.056 . 329 48 48 ILE H H 9.224 0.007 . 330 48 48 ILE HA H 5.277 0.008 . 331 48 48 ILE HB H 1.855 0.012 . 332 48 48 ILE HG12 H 1.255 0.007 . 333 48 48 ILE HG2 H 0.981 0.002 . 334 48 48 ILE HD1 H 0.875 0.000 . 335 48 48 ILE C C 175.597 0.000 . 336 48 48 ILE CA C 60.361 0.079 . 337 48 48 ILE CB C 41.944 0.113 . 338 48 48 ILE CG2 C 18.668 0.017 . 339 48 48 ILE CD1 C 14.732 0.002 . 340 48 48 ILE N N 121.571 0.042 . 341 49 49 VAL H H 9.319 0.008 . 342 49 49 VAL HA H 4.793 0.020 . 343 49 49 VAL HB H 1.977 0.000 . 344 49 49 VAL C C 174.514 0.000 . 345 49 49 VAL CA C 61.506 0.127 . 346 49 49 VAL CB C 33.679 0.190 . 347 49 49 VAL N N 127.063 0.063 . 348 50 50 GLU H H 9.279 0.004 . 349 50 50 GLU HA H 5.529 0.006 . 350 50 50 GLU HB2 H 2.101 0.000 . 351 50 50 GLU HB3 H 2.101 0.000 . 352 50 50 GLU C C 173.959 0.000 . 353 50 50 GLU CA C 54.990 0.098 . 354 50 50 GLU CB C 34.469 0.009 . 355 50 50 GLU N N 125.909 0.031 . 356 51 51 LEU H H 8.451 0.005 . 357 51 51 LEU HA H 4.492 0.006 . 358 51 51 LEU HB2 H 1.241 0.000 . 359 51 51 LEU HG H 1.094 0.000 . 360 51 51 LEU HD1 H 0.426 0.004 . 361 51 51 LEU HD2 H 0.027 0.000 . 362 51 51 LEU C C 175.800 0.000 . 363 51 51 LEU CA C 54.003 0.050 . 364 51 51 LEU CB C 42.069 0.088 . 365 51 51 LEU CG C 27.780 0.037 . 366 51 51 LEU CD1 C 24.964 0.045 . 367 51 51 LEU CD2 C 25.912 0.087 . 368 51 51 LEU N N 122.786 0.032 . 369 52 52 LEU H H 8.603 0.008 . 370 52 52 LEU HA H 4.894 0.012 . 371 52 52 LEU HB2 H 1.655 0.000 . 372 52 52 LEU HB3 H 1.924 0.001 . 373 52 52 LEU HD1 H 0.881 0.000 . 374 52 52 LEU HD2 H 0.881 0.000 . 375 52 52 LEU C C 176.811 0.000 . 376 52 52 LEU CA C 53.147 0.132 . 377 52 52 LEU CB C 44.798 0.097 . 378 52 52 LEU N N 125.583 0.092 . 379 53 53 GLU H H 8.660 0.003 . 380 53 53 GLU HA H 4.292 0.008 . 381 53 53 GLU HB2 H 1.948 0.005 . 382 53 53 GLU HB3 H 1.948 0.005 . 383 53 53 GLU HG2 H 2.341 0.007 . 384 53 53 GLU HG3 H 2.341 0.007 . 385 53 53 GLU C C 176.630 0.000 . 386 53 53 GLU CA C 57.223 0.125 . 387 53 53 GLU CB C 29.815 0.136 . 388 53 53 GLU CG C 36.214 0.000 . 389 53 53 GLU N N 122.632 0.038 . 390 54 54 LEU H H 7.482 0.004 . 391 54 54 LEU HA H 3.806 0.008 . 392 54 54 LEU HB2 H 1.258 0.011 . 393 54 54 LEU HB3 H 1.379 0.000 . 394 54 54 LEU HD1 H 0.655 0.006 . 395 54 54 LEU HD2 H 0.655 0.006 . 396 54 54 LEU C C 177.119 0.000 . 397 54 54 LEU CA C 56.583 0.138 . 398 54 54 LEU CB C 41.587 0.084 . 399 54 54 LEU N N 126.558 0.046 . 400 55 55 GLN H H 7.760 0.009 . 401 55 55 GLN HA H 4.316 0.005 . 402 55 55 GLN HB2 H 1.439 0.001 . 403 55 55 GLN HB3 H 1.622 0.000 . 404 55 55 GLN HG2 H 1.966 0.004 . 405 55 55 GLN C C 175.051 0.000 . 406 55 55 GLN CA C 54.104 0.110 . 407 55 55 GLN CB C 26.753 0.064 . 408 55 55 GLN CG C 33.175 0.000 . 409 55 55 GLN N N 127.253 0.043 . 410 56 56 ALA H H 8.120 0.003 . 411 56 56 ALA HA H 3.835 0.021 . 412 56 56 ALA HB H 1.276 0.003 . 413 56 56 ALA C C 177.391 0.000 . 414 56 56 ALA CA C 54.011 0.063 . 415 56 56 ALA CB C 19.081 0.148 . 416 56 56 ALA N N 128.088 0.016 . 417 57 57 HIS H H 8.205 0.004 . 418 57 57 HIS HA H 4.381 0.011 . 419 57 57 HIS HB2 H 3.048 0.002 . 420 57 57 HIS HB3 H 3.122 0.000 . 421 57 57 HIS C C 174.015 0.000 . 422 57 57 HIS CA C 56.726 0.038 . 423 57 57 HIS CB C 29.975 0.083 . 424 57 57 HIS N N 113.617 0.052 . 425 58 58 VAL H H 6.885 0.007 . 426 58 58 VAL HA H 4.381 0.002 . 427 58 58 VAL HB H 1.252 0.006 . 428 58 58 VAL HG1 H 0.374 0.015 . 429 58 58 VAL HG2 H 0.113 0.002 . 430 58 58 VAL C C 174.166 0.000 . 431 58 58 VAL CA C 58.928 0.084 . 432 58 58 VAL CB C 33.869 0.000 . 433 58 58 VAL CG1 C 22.254 0.014 . 434 58 58 VAL CG2 C 18.040 0.009 . 435 58 58 VAL N N 114.522 0.040 . 436 59 59 ARG H H 8.295 0.003 . 437 59 59 ARG HA H 4.360 0.005 . 438 59 59 ARG HB2 H 1.643 0.000 . 439 59 59 ARG HB3 H 1.801 0.018 . 440 59 59 ARG HD2 H 3.106 0.004 . 441 59 59 ARG HD3 H 3.106 0.004 . 442 59 59 ARG C C 176.269 0.000 . 443 59 59 ARG CA C 54.473 0.018 . 444 59 59 ARG CB C 33.253 0.063 . 445 59 59 ARG CD C 43.228 0.000 . 446 59 59 ARG N N 121.096 0.037 . 447 60 60 GLY H H 8.908 0.007 . 448 60 60 GLY HA2 H 3.931 0.000 . 449 60 60 GLY HA3 H 3.779 0.015 . 450 60 60 GLY C C 174.061 0.000 . 451 60 60 GLY CA C 46.698 0.117 . 452 60 60 GLY N N 111.051 0.026 . 453 61 61 GLU H H 8.406 0.009 . 454 61 61 GLU HA H 2.263 0.005 . 455 61 61 GLU HB2 H 1.450 0.000 . 456 61 61 GLU HB3 H 1.679 0.003 . 457 61 61 GLU HG2 H 1.880 0.002 . 458 61 61 GLU HG3 H 1.880 0.002 . 459 61 61 GLU C C 177.378 0.000 . 460 61 61 GLU CA C 58.686 0.083 . 461 61 61 GLU CB C 28.851 0.125 . 462 61 61 GLU CG C 36.351 0.000 . 463 61 61 GLU N N 126.097 0.051 . 464 62 62 ALA H H 7.498 0.006 . 465 62 62 ALA HA H 3.818 0.007 . 466 62 62 ALA HB H 1.396 0.009 . 467 62 62 ALA C C 180.526 0.000 . 468 62 62 ALA CA C 54.430 0.083 . 469 62 62 ALA CB C 18.003 0.218 . 470 62 62 ALA N N 118.646 0.044 . 471 63 63 ALA H H 7.334 0.007 . 472 63 63 ALA HA H 3.744 0.012 . 473 63 63 ALA HB H 1.087 0.042 . 474 63 63 ALA C C 178.086 0.000 . 475 63 63 ALA CA C 54.272 0.081 . 476 63 63 ALA CB C 17.720 0.130 . 477 63 63 ALA N N 122.637 0.041 . 478 64 64 ALA H H 6.837 0.005 . 479 64 64 ALA HA H 3.907 0.021 . 480 64 64 ALA HB H 1.188 0.000 . 481 64 64 ALA C C 180.236 0.000 . 482 64 64 ALA CA C 54.823 0.043 . 483 64 64 ALA CB C 17.650 0.199 . 484 64 64 ALA N N 120.524 0.041 . 485 65 65 ARG H H 7.940 0.004 . 486 65 65 ARG HA H 3.681 0.021 . 487 65 65 ARG HB2 H 1.892 0.017 . 488 65 65 ARG HB3 H 1.892 0.017 . 489 65 65 ARG HD2 H 3.077 0.000 . 490 65 65 ARG HD3 H 3.077 0.000 . 491 65 65 ARG C C 177.148 0.000 . 492 65 65 ARG CA C 60.346 0.021 . 493 65 65 ARG N N 116.264 0.016 . 494 66 66 TYR H H 7.930 0.004 . 495 66 66 TYR HA H 3.986 0.006 . 496 66 66 TYR HB2 H 2.856 0.000 . 497 66 66 TYR HB3 H 2.979 0.000 . 498 66 66 TYR C C 177.763 0.000 . 499 66 66 TYR CA C 61.459 0.028 . 500 66 66 TYR CB C 38.594 0.000 . 501 66 66 TYR N N 119.530 0.068 . 502 67 67 HIS H H 7.789 0.005 . 503 67 67 HIS HA H 4.197 0.000 . 504 67 67 HIS HB2 H 3.051 0.010 . 505 67 67 HIS HB3 H 3.051 0.010 . 506 67 67 HIS C C 177.073 0.000 . 507 67 67 HIS CA C 59.874 0.068 . 508 67 67 HIS CB C 30.984 0.117 . 509 67 67 HIS N N 116.482 0.043 . 510 68 68 PHE H H 7.659 0.003 . 511 68 68 PHE HA H 4.313 0.000 . 512 68 68 PHE HB2 H 1.918 0.004 . 513 68 68 PHE HB3 H 1.918 0.004 . 514 68 68 PHE C C 176.575 0.000 . 515 68 68 PHE CA C 60.771 0.107 . 516 68 68 PHE CB C 40.409 0.053 . 517 68 68 PHE N N 120.590 0.052 . 518 69 69 GLU H H 8.072 0.005 . 519 69 69 GLU HA H 3.654 0.006 . 520 69 69 GLU HB2 H 1.908 0.006 . 521 69 69 GLU HB3 H 1.908 0.006 . 522 69 69 GLU HG2 H 2.085 0.006 . 523 69 69 GLU C C 177.656 0.000 . 524 69 69 GLU CA C 58.224 0.080 . 525 69 69 GLU CB C 29.754 0.019 . 526 69 69 GLU CG C 37.299 0.000 . 527 69 69 GLU N N 115.828 0.029 . 528 70 70 ASP H H 7.729 0.005 . 529 70 70 ASP HA H 4.334 0.005 . 530 70 70 ASP HB2 H 2.168 0.014 . 531 70 70 ASP HB3 H 2.598 0.005 . 532 70 70 ASP C C 177.282 0.000 . 533 70 70 ASP CA C 55.613 0.032 . 534 70 70 ASP CB C 40.979 0.063 . 535 70 70 ASP N N 120.241 0.053 . 536 71 71 VAL H H 7.742 0.004 . 537 71 71 VAL HA H 3.826 0.000 . 538 71 71 VAL HB H 1.960 0.015 . 539 71 71 VAL HG1 H 0.865 0.007 . 540 71 71 VAL HG2 H 0.779 0.005 . 541 71 71 VAL C C 177.444 0.000 . 542 71 71 VAL CA C 63.943 0.037 . 543 71 71 VAL CB C 31.633 0.000 . 544 71 71 VAL CG1 C 21.435 0.006 . 545 71 71 VAL CG2 C 21.170 0.005 . 546 71 71 VAL N N 118.579 0.054 . 547 72 72 GLY H H 8.062 0.009 . 548 72 72 GLY HA2 H 3.769 0.012 . 549 72 72 GLY HA3 H 3.578 0.000 . 550 72 72 GLY C C 175.155 0.000 . 551 72 72 GLY CA C 46.249 0.077 . 552 72 72 GLY N N 109.088 0.110 . 553 73 73 GLY H H 8.044 0.004 . 554 73 73 GLY HA2 H 3.881 0.013 . 555 73 73 GLY HA3 H 3.881 0.013 . 556 73 73 GLY C C 175.642 0.000 . 557 73 73 GLY CA C 45.930 0.089 . 558 73 73 GLY N N 108.832 0.054 . 559 74 74 VAL H H 7.931 0.006 . 560 74 74 VAL HB H 2.063 0.000 . 561 74 74 VAL CA C 63.796 0.034 . 562 74 74 VAL CB C 31.902 0.000 . 563 74 74 VAL CG1 C 41.210 0.030 . 564 74 74 VAL CG2 C 41.210 0.030 . 565 74 74 VAL N N 121.003 0.036 . 566 75 75 GLN H H 8.327 0.005 . 567 75 75 GLN HA H 4.166 0.000 . 568 75 75 GLN HB2 H 1.946 0.000 . 569 75 75 GLN HB3 H 2.111 0.002 . 570 75 75 GLN HG2 H 2.347 0.000 . 571 75 75 GLN HG3 H 2.347 0.000 . 572 75 75 GLN C C 176.420 0.000 . 573 75 75 GLN CA C 56.370 0.026 . 574 75 75 GLN CB C 28.687 0.007 . 575 75 75 GLN CG C 33.578 0.000 . 576 75 75 GLN N N 120.703 0.045 . 577 76 76 GLY H H 8.076 0.003 . 578 76 76 GLY HA2 H 4.010 0.003 . 579 76 76 GLY HA3 H 3.784 0.001 . 580 76 76 GLY CA C 45.631 0.106 . 581 76 76 GLY N N 109.231 0.076 . 582 77 77 ALA H H 8.082 0.003 . 583 77 77 ALA HA H 4.311 0.000 . 584 77 77 ALA HB H 1.169 0.016 . 585 77 77 ALA C C 177.604 0.000 . 586 77 77 ALA CA C 52.770 0.087 . 587 77 77 ALA CB C 19.328 0.078 . 588 77 77 ALA N N 122.615 0.021 . 589 78 78 ARG H H 8.562 0.007 . 590 78 78 ARG HA H 4.331 0.000 . 591 78 78 ARG HB2 H 1.584 0.000 . 592 78 78 ARG HB3 H 1.584 0.000 . 593 78 78 ARG C C 175.325 0.000 . 594 78 78 ARG CA C 55.343 0.156 . 595 78 78 ARG CB C 31.380 0.187 . 596 78 78 ARG N N 120.514 0.039 . 597 79 79 ALA H H 7.939 0.010 . 598 79 79 ALA HA H 4.371 0.011 . 599 79 79 ALA HB H 1.272 0.012 . 600 79 79 ALA C C 176.122 0.000 . 601 79 79 ALA CA C 52.054 0.081 . 602 79 79 ALA CB C 20.705 0.000 . 603 79 79 ALA N N 122.293 0.104 . 604 80 80 VAL H H 8.265 0.005 . 605 80 80 VAL HA H 4.819 0.009 . 606 80 80 VAL HB H 1.934 0.017 . 607 80 80 VAL HG1 H 0.706 0.008 . 608 80 80 VAL HG2 H 0.619 0.005 . 609 80 80 VAL CA C 60.462 0.000 . 610 80 80 VAL CB C 34.462 0.038 . 611 80 80 VAL CG1 C 20.063 0.010 . 612 80 80 VAL CG2 C 21.848 0.010 . 613 80 80 VAL N N 116.737 0.033 . 614 81 81 HIS H H 8.792 0.001 . 615 81 81 HIS HA H 4.934 0.001 . 616 81 81 HIS HB2 H 2.995 0.016 . 617 81 81 HIS HB3 H 2.995 0.016 . 618 81 81 HIS C C 173.749 0.000 . 619 81 81 HIS CA C 55.501 0.037 . 620 81 81 HIS CB C 32.758 0.007 . 621 81 81 HIS N N 121.139 0.026 . 622 82 82 VAL H H 8.774 0.005 . 623 82 82 VAL HA H 3.549 0.005 . 624 82 82 VAL HB H 1.840 0.000 . 625 82 82 VAL HG1 H 0.713 0.000 . 626 82 82 VAL HG2 H 0.554 0.006 . 627 82 82 VAL C C 175.086 0.000 . 628 82 82 VAL CA C 63.645 0.067 . 629 82 82 VAL CB C 32.445 0.019 . 630 82 82 VAL CG1 C 23.095 0.025 . 631 82 82 VAL CG2 C 21.450 0.008 . 632 82 82 VAL N N 127.563 0.038 . 633 83 83 GLU H H 9.177 0.008 . 634 83 83 GLU HA H 4.281 0.018 . 635 83 83 GLU HB2 H 1.869 0.012 . 636 83 83 GLU HB3 H 2.133 0.002 . 637 83 83 GLU C C 176.408 0.000 . 638 83 83 GLU CA C 57.534 0.046 . 639 83 83 GLU CB C 30.760 0.084 . 640 83 83 GLU CG C 36.501 0.000 . 641 83 83 GLU N N 128.110 0.066 . 642 84 84 SER H H 7.833 0.004 . 643 84 84 SER HA H 4.629 0.000 . 644 84 84 SER HB2 H 3.772 0.013 . 645 84 84 SER HB3 H 3.772 0.013 . 646 84 84 SER C C 172.130 0.000 . 647 84 84 SER CA C 57.592 0.037 . 648 84 84 SER CB C 65.487 0.073 . 649 84 84 SER N N 111.968 0.047 . 650 85 85 VAL H H 8.395 0.004 . 651 85 85 VAL HA H 4.954 0.003 . 652 85 85 VAL HB H 1.974 0.000 . 653 85 85 VAL HG1 H 0.913 0.000 . 654 85 85 VAL HG2 H 0.943 0.000 . 655 85 85 VAL C C 174.254 0.000 . 656 85 85 VAL CA C 61.630 0.098 . 657 85 85 VAL CB C 33.952 0.000 . 658 85 85 VAL CG1 C 22.142 0.000 . 659 85 85 VAL CG2 C 20.880 0.000 . 660 85 85 VAL N N 121.702 0.071 . 661 86 86 GLN H H 9.192 0.010 . 662 86 86 GLN HA H 5.292 0.000 . 663 86 86 GLN HB2 H 1.939 0.000 . 664 86 86 GLN HB3 H 1.939 0.000 . 665 86 86 GLN HG2 H 2.294 0.000 . 666 86 86 GLN HG3 H 2.294 0.000 . 667 86 86 GLN CA C 53.050 0.090 . 668 86 86 GLN CB C 31.722 0.000 . 669 86 86 GLN CG C 32.541 0.000 . 670 86 86 GLN N N 124.925 0.062 . 671 87 87 PRO HA H 3.791 0.007 . 672 87 87 PRO HB2 H 1.417 0.057 . 673 87 87 PRO HB3 H 1.417 0.057 . 674 87 87 PRO C C 176.027 0.000 . 675 87 87 PRO CA C 62.694 0.121 . 676 87 87 PRO CB C 31.519 0.137 . 677 88 88 LEU H H 7.708 0.004 . 678 88 88 LEU HA H 4.377 0.005 . 679 88 88 LEU HB2 H 1.043 0.009 . 680 88 88 LEU HB3 H 1.289 0.001 . 681 88 88 LEU HD1 H 0.723 0.000 . 682 88 88 LEU HD2 H 0.679 0.000 . 683 88 88 LEU C C 175.525 0.000 . 684 88 88 LEU CA C 52.729 0.054 . 685 88 88 LEU CB C 43.697 0.061 . 686 88 88 LEU CD1 C 24.025 0.015 . 687 88 88 LEU CD2 C 25.218 0.007 . 688 88 88 LEU N N 125.067 0.043 . 689 89 89 SER H H 8.342 0.005 . 690 89 89 SER HA H 4.145 0.005 . 691 89 89 SER HB2 H 3.797 0.012 . 692 89 89 SER HB3 H 3.797 0.012 . 693 89 89 SER C C 175.674 0.000 . 694 89 89 SER CA C 58.422 0.083 . 695 89 89 SER CB C 62.883 0.000 . 696 89 89 SER N N 119.017 0.060 . 697 90 90 LEU H H 8.461 0.005 . 698 90 90 LEU HA H 4.002 0.000 . 699 90 90 LEU HB2 H 1.459 0.001 . 700 90 90 LEU HB3 H 1.711 0.025 . 701 90 90 LEU HD1 H 0.849 0.001 . 702 90 90 LEU HD2 H 0.663 0.005 . 703 90 90 LEU C C 178.813 0.000 . 704 90 90 LEU CA C 56.124 0.087 . 705 90 90 LEU CB C 41.991 0.119 . 706 90 90 LEU CD1 C 25.700 0.000 . 707 90 90 LEU CD2 C 24.161 0.000 . 708 90 90 LEU N N 125.682 0.067 . 709 91 91 GLU H H 8.003 0.007 . 710 91 91 GLU HA H 3.785 0.002 . 711 91 91 GLU HB2 H 1.841 0.013 . 712 91 91 GLU HB3 H 1.841 0.013 . 713 91 91 GLU HG2 H 2.170 0.004 . 714 91 91 GLU HG3 H 2.170 0.004 . 715 91 91 GLU C C 176.887 0.000 . 716 91 91 GLU CA C 59.536 0.085 . 717 91 91 GLU CB C 29.447 0.160 . 718 91 91 GLU CG C 35.767 0.000 . 719 91 91 GLU N N 114.665 0.048 . 720 92 92 ASN H H 7.737 0.004 . 721 92 92 ASN HA H 4.748 0.010 . 722 92 92 ASN HB2 H 2.613 0.003 . 723 92 92 ASN HB3 H 2.828 0.007 . 724 92 92 ASN C C 174.404 0.000 . 725 92 92 ASN CA C 52.442 0.059 . 726 92 92 ASN CB C 38.773 0.030 . 727 92 92 ASN N N 113.546 0.057 . 728 93 93 LEU H H 7.405 0.004 . 729 93 93 LEU HA H 4.428 0.020 . 730 93 93 LEU HB2 H 1.615 0.000 . 731 93 93 LEU HB3 H 1.615 0.000 . 732 93 93 LEU HD1 H 0.661 0.006 . 733 93 93 LEU HD2 H 0.661 0.006 . 734 93 93 LEU C C 178.122 0.000 . 735 93 93 LEU CA C 54.718 0.132 . 736 93 93 LEU CB C 41.647 0.036 . 737 93 93 LEU N N 117.736 0.046 . 738 94 94 ALA H H 8.793 0.004 . 739 94 94 ALA HA H 4.244 0.003 . 740 94 94 ALA HB H 1.368 0.009 . 741 94 94 ALA C C 180.792 0.000 . 742 94 94 ALA CA C 54.782 0.100 . 743 94 94 ALA CB C 17.860 0.130 . 744 94 94 ALA N N 130.745 0.028 . 745 95 95 LEU H H 7.815 0.008 . 746 95 95 LEU C C 176.332 0.000 . 747 95 95 LEU CA C 54.877 0.051 . 748 95 95 LEU CB C 42.340 0.050 . 749 95 95 LEU N N 116.889 0.040 . 750 96 96 ARG H H 7.691 0.008 . 751 96 96 ARG HA H 3.953 0.000 . 752 96 96 ARG HB2 H 2.104 0.000 . 753 96 96 ARG HB3 H 2.104 0.000 . 754 96 96 ARG HG2 H 1.477 0.009 . 755 96 96 ARG HD2 H 3.208 0.000 . 756 96 96 ARG HD3 H 3.208 0.000 . 757 96 96 ARG CA C 59.207 0.000 . 758 96 96 ARG CB C 29.330 0.000 . 759 96 96 ARG CG C 26.380 0.097 . 760 96 96 ARG CD C 23.592 0.005 . 761 96 96 ARG N N 121.833 0.037 . 762 97 97 GLY H H 9.055 0.008 . 763 97 97 GLY HA2 H 4.230 0.000 . 764 97 97 GLY HA3 H 3.771 0.003 . 765 97 97 GLY C C 174.750 0.000 . 766 97 97 GLY CA C 45.631 0.074 . 767 97 97 GLY N N 112.186 0.124 . 768 98 98 ARG H H 7.851 0.002 . 769 98 98 ARG HA H 4.428 0.000 . 770 98 98 ARG HB2 H 1.738 0.011 . 771 98 98 ARG HB3 H 1.738 0.011 . 772 98 98 ARG C C 175.025 0.000 . 773 98 98 ARG CA C 55.582 0.026 . 774 98 98 ARG CB C 31.653 0.000 . 775 98 98 ARG N N 116.637 0.032 . 776 99 99 CYS H H 7.676 0.003 . 777 99 99 CYS HA H 4.758 0.008 . 778 99 99 CYS HB2 H 2.345 0.012 . 779 99 99 CYS HB3 H 2.625 0.002 . 780 99 99 CYS C C 173.227 0.000 . 781 99 99 CYS CA C 57.824 0.057 . 782 99 99 CYS CB C 28.640 0.169 . 783 99 99 CYS N N 117.329 0.049 . 784 100 100 GLN H H 8.599 0.006 . 785 100 100 GLN HA H 4.447 0.000 . 786 100 100 GLN HB2 H 1.903 0.000 . 787 100 100 GLN HB3 H 2.131 0.006 . 788 100 100 GLN HG2 H 2.383 0.006 . 789 100 100 GLN HG3 H 2.383 0.006 . 790 100 100 GLN C C 174.941 0.000 . 791 100 100 GLN CA C 56.468 0.118 . 792 100 100 GLN CB C 30.967 0.080 . 793 100 100 GLN CG C 33.784 0.000 . 794 100 100 GLN N N 125.100 0.034 . 795 101 101 GLU H H 7.697 0.003 . 796 101 101 GLU HA H 4.382 0.019 . 797 101 101 GLU HB2 H 2.160 0.000 . 798 101 101 GLU HB3 H 2.160 0.000 . 799 101 101 GLU C C 172.007 0.000 . 800 101 101 GLU CA C 56.265 0.102 . 801 101 101 GLU CB C 32.713 0.102 . 802 101 101 GLU N N 116.806 0.052 . 803 102 102 ALA H H 8.284 0.010 . 804 102 102 ALA HA H 5.758 0.003 . 805 102 102 ALA HB H 1.293 0.003 . 806 102 102 ALA C C 175.262 0.000 . 807 102 102 ALA CA C 50.956 0.057 . 808 102 102 ALA CB C 24.258 0.091 . 809 102 102 ALA N N 126.327 0.055 . 810 103 103 TRP H H 9.084 0.004 . 811 103 103 TRP HA H 4.906 0.016 . 812 103 103 TRP HB2 H 2.789 0.009 . 813 103 103 TRP HB3 H 3.123 0.015 . 814 103 103 TRP C C 174.275 0.000 . 815 103 103 TRP CA C 56.673 0.090 . 816 103 103 TRP CB C 35.165 0.061 . 817 103 103 TRP N N 122.291 0.055 . 818 104 104 VAL H H 9.496 0.009 . 819 104 104 VAL HA H 5.498 0.002 . 820 104 104 VAL HB H 2.038 0.002 . 821 104 104 VAL HG1 H 1.159 0.002 . 822 104 104 VAL HG2 H 1.046 0.000 . 823 104 104 VAL C C 173.345 0.000 . 824 104 104 VAL CA C 60.173 0.000 . 825 104 104 VAL CB C 35.319 0.027 . 826 104 104 VAL CG1 C 21.278 0.028 . 827 104 104 VAL CG2 C 20.595 0.009 . 828 104 104 VAL N N 117.698 0.054 . 829 105 105 LEU H H 9.501 0.010 . 830 105 105 LEU HA H 5.328 0.014 . 831 105 105 LEU HB2 H 1.524 0.007 . 832 105 105 LEU HB3 H 1.524 0.007 . 833 105 105 LEU HD1 H 0.566 0.000 . 834 105 105 LEU HD2 H 0.027 0.002 . 835 105 105 LEU C C 175.224 0.000 . 836 105 105 LEU CA C 53.986 0.040 . 837 105 105 LEU CB C 46.807 0.000 . 838 105 105 LEU CD1 C 26.379 0.035 . 839 105 105 LEU CD2 C 24.796 0.000 . 840 105 105 LEU N N 131.582 0.045 . 841 106 106 SER H H 8.770 0.005 . 842 106 106 SER HA H 5.228 0.002 . 843 106 106 SER HB2 H 3.540 0.000 . 844 106 106 SER HB3 H 3.662 0.000 . 845 106 106 SER C C 174.342 0.000 . 846 106 106 SER CA C 56.210 0.055 . 847 106 106 SER CB C 65.959 0.067 . 848 106 106 SER N N 117.503 0.054 . 849 107 107 GLY H H 8.779 0.003 . 850 107 107 GLY HA2 H 4.240 0.004 . 851 107 107 GLY HA3 H 4.240 0.004 . 852 107 107 GLY C C 170.768 0.000 . 853 107 107 GLY CA C 46.396 0.145 . 854 107 107 GLY N N 111.132 0.041 . 855 108 108 LYS H H 8.986 0.004 . 856 108 108 LYS HA H 5.525 0.003 . 857 108 108 LYS HB2 H 1.642 0.000 . 858 108 108 LYS HB3 H 1.718 0.000 . 859 108 108 LYS HE2 H 2.830 0.000 . 860 108 108 LYS HE3 H 2.830 0.000 . 861 108 108 LYS C C 175.439 0.000 . 862 108 108 LYS CA C 54.493 0.031 . 863 108 108 LYS CB C 37.182 0.094 . 864 108 108 LYS CE C 41.960 0.000 . 865 108 108 LYS N N 118.871 0.036 . 866 109 109 GLN H H 8.955 0.004 . 867 109 109 GLN HA H 4.917 0.006 . 868 109 109 GLN HB2 H 1.726 0.013 . 869 109 109 GLN HB3 H 1.726 0.013 . 870 109 109 GLN C C 174.176 0.000 . 871 109 109 GLN CA C 54.396 0.063 . 872 109 109 GLN CB C 31.906 0.047 . 873 109 109 GLN N N 119.996 0.032 . 874 110 110 GLN H H 8.512 0.003 . 875 110 110 GLN HA H 4.988 0.005 . 876 110 110 GLN HB2 H 1.890 0.005 . 877 110 110 GLN HB3 H 1.890 0.005 . 878 110 110 GLN C C 175.239 0.000 . 879 110 110 GLN CA C 55.235 0.145 . 880 110 110 GLN CB C 30.542 0.120 . 881 110 110 GLN CG C 34.318 0.000 . 882 110 110 GLN N N 123.336 0.066 . 883 111 111 ILE H H 8.824 0.007 . 884 111 111 ILE HA H 4.332 0.002 . 885 111 111 ILE HB H 1.762 0.009 . 886 111 111 ILE HG12 H 1.029 0.006 . 887 111 111 ILE HG2 H 0.800 0.003 . 888 111 111 ILE C C 175.056 0.000 . 889 111 111 ILE CA C 60.322 0.107 . 890 111 111 ILE CB C 39.725 0.038 . 891 111 111 ILE CG1 C 27.388 0.038 . 892 111 111 ILE CG2 C 17.737 0.000 . 893 111 111 ILE CD1 C 12.958 0.000 . 894 111 111 ILE N N 125.244 0.050 . 895 112 112 ALA H H 8.601 0.003 . 896 112 112 ALA HA H 4.536 0.005 . 897 112 112 ALA HB H 1.267 0.013 . 898 112 112 ALA C C 176.685 0.000 . 899 112 112 ALA CA C 51.554 0.086 . 900 112 112 ALA CB C 20.203 0.161 . 901 112 112 ALA N N 130.268 0.040 . 902 113 113 LYS H H 8.353 0.002 . 903 113 113 LYS HA H 4.296 0.006 . 904 113 113 LYS HB2 H 1.637 0.000 . 905 113 113 LYS HB3 H 1.806 0.000 . 906 113 113 LYS HG2 H 1.410 0.005 . 907 113 113 LYS HG3 H 1.410 0.005 . 908 113 113 LYS HD2 H 1.643 0.006 . 909 113 113 LYS HD3 H 1.643 0.006 . 910 113 113 LYS HE2 H 2.929 0.006 . 911 113 113 LYS HE3 H 2.929 0.006 . 912 113 113 LYS C C 176.440 0.000 . 913 113 113 LYS CA C 56.059 0.070 . 914 113 113 LYS CB C 33.637 0.070 . 915 113 113 LYS CG C 24.940 0.000 . 916 113 113 LYS CD C 28.940 0.000 . 917 113 113 LYS CE C 42.044 0.000 . 918 113 113 LYS N N 121.831 0.036 . 919 114 114 GLU H H 8.540 0.004 . 920 114 114 GLU HA H 4.083 0.001 . 921 114 114 GLU HB2 H 1.947 0.003 . 922 114 114 GLU HB3 H 1.947 0.003 . 923 114 114 GLU HG2 H 2.216 0.004 . 924 114 114 GLU HG3 H 2.216 0.004 . 925 114 114 GLU C C 176.448 0.000 . 926 114 114 GLU CA C 57.592 0.078 . 927 114 114 GLU CB C 29.603 0.147 . 928 114 114 GLU CG C 35.979 0.000 . 929 114 114 GLU N N 120.677 0.019 . 930 115 115 ASN H H 8.525 0.004 . 931 115 115 ASN HA H 4.449 0.018 . 932 115 115 ASN HB2 H 2.885 0.003 . 933 115 115 ASN HB3 H 2.885 0.003 . 934 115 115 ASN C C 174.805 0.000 . 935 115 115 ASN CA C 54.067 0.047 . 936 115 115 ASN CB C 38.001 0.028 . 937 115 115 ASN N N 117.062 0.051 . 938 116 116 GLN H H 8.074 0.005 . 939 116 116 GLN CA C 56.048 0.045 . 940 116 116 GLN CB C 29.296 0.000 . 941 116 116 GLN N N 117.777 0.035 . 942 117 117 GLN HA H 4.198 0.000 . 943 117 117 GLN HB2 H 2.003 0.009 . 944 117 117 GLN HB3 H 2.003 0.009 . 945 117 117 GLN HG2 H 2.293 0.009 . 946 117 117 GLN HG3 H 2.293 0.009 . 947 117 117 GLN C C 175.923 0.000 . 948 117 117 GLN CA C 56.892 0.000 . 949 117 117 GLN CB C 29.477 0.132 . 950 118 118 VAL H H 7.797 0.003 . 951 118 118 VAL HA H 4.085 0.000 . 952 118 118 VAL HB H 1.987 0.000 . 953 118 118 VAL C C 175.016 0.000 . 954 118 118 VAL CA C 61.898 0.115 . 955 118 118 VAL CB C 32.950 0.112 . 956 118 118 VAL N N 118.698 0.023 . 957 119 119 ALA H H 8.396 0.004 . 958 119 119 ALA HA H 4.367 0.019 . 959 119 119 ALA HB H 1.214 0.013 . 960 119 119 ALA C C 176.678 0.000 . 961 119 119 ALA CA C 51.824 0.074 . 962 119 119 ALA CB C 20.090 0.108 . 963 119 119 ALA N N 128.043 0.022 . 964 120 120 LYS H H 8.261 0.003 . 965 120 120 LYS HA H 4.438 0.000 . 966 120 120 LYS HB2 H 1.684 0.004 . 967 120 120 LYS HB3 H 1.684 0.004 . 968 120 120 LYS HE2 H 2.888 0.002 . 969 120 120 LYS HE3 H 2.888 0.002 . 970 120 120 LYS C C 174.815 0.000 . 971 120 120 LYS CA C 55.043 0.170 . 972 120 120 LYS CB C 34.966 0.012 . 973 120 120 LYS CG C 21.397 0.000 . 974 120 120 LYS CD C 25.028 0.000 . 975 120 120 LYS CE C 42.086 0.000 . 976 120 120 LYS N N 120.468 0.025 . 977 121 121 ASP H H 8.305 0.007 . 978 121 121 ASP HA H 4.986 0.006 . 979 121 121 ASP HB2 H 2.439 0.006 . 980 121 121 ASP HB3 H 2.439 0.006 . 981 121 121 ASP C C 175.370 0.000 . 982 121 121 ASP CA C 54.152 0.006 . 983 121 121 ASP CB C 41.595 0.173 . 984 121 121 ASP N N 122.191 0.033 . 985 122 122 VAL H H 8.820 0.010 . 986 122 122 VAL HA H 4.103 0.007 . 987 122 122 VAL HB H 1.992 0.004 . 988 122 122 VAL C C 175.762 0.000 . 989 122 122 VAL CA C 61.995 0.054 . 990 122 122 VAL N N 122.932 0.085 . 991 123 123 THR H H 8.010 0.004 . 992 123 123 THR HA H 4.665 0.009 . 993 123 123 THR HB H 4.061 0.004 . 994 123 123 THR HG2 H 1.151 0.002 . 995 123 123 THR C C 172.519 0.000 . 996 123 123 THR CA C 63.158 0.000 . 997 123 123 THR CB C 29.624 0.028 . 998 123 123 THR CG2 C 21.278 0.012 . 999 123 123 THR N N 122.649 0.058 . 1000 124 124 LEU H H 8.704 0.004 . 1001 124 124 LEU HA H 5.261 0.001 . 1002 124 124 LEU HB2 H 1.429 0.000 . 1003 124 124 LEU HB3 H 1.429 0.000 . 1004 124 124 LEU HG H 1.586 0.004 . 1005 124 124 LEU HD1 H 0.688 0.000 . 1006 124 124 LEU HD2 H 0.688 0.000 . 1007 124 124 LEU C C 175.067 0.000 . 1008 124 124 LEU CA C 54.465 0.085 . 1009 124 124 LEU CB C 46.597 0.147 . 1010 124 124 LEU CG C 28.374 0.089 . 1011 124 124 LEU CD1 C 25.885 0.057 . 1012 124 124 LEU CD2 C 25.885 0.057 . 1013 124 124 LEU N N 126.361 0.018 . 1014 125 125 HIS H H 8.250 0.006 . 1015 125 125 HIS HA H 5.272 0.000 . 1016 125 125 HIS HB2 H 2.342 0.000 . 1017 125 125 HIS HB3 H 2.749 0.000 . 1018 125 125 HIS C C 174.282 0.000 . 1019 125 125 HIS CA C 55.779 0.067 . 1020 125 125 HIS CB C 33.504 0.000 . 1021 125 125 HIS N N 119.684 0.100 . 1022 126 126 GLN H H 9.601 0.010 . 1023 126 126 GLN HB2 H 1.952 0.002 . 1024 126 126 GLN HB3 H 2.305 0.000 . 1025 126 126 GLN CA C 54.150 0.000 . 1026 126 126 GLN N N 121.787 0.065 . 1027 127 127 ALA H H 10.025 0.003 . 1028 127 127 ALA HA H 5.872 0.006 . 1029 127 127 ALA HB H 1.348 0.007 . 1030 127 127 ALA C C 174.095 0.000 . 1031 127 127 ALA CA C 50.352 0.018 . 1032 127 127 ALA CB C 22.224 0.147 . 1033 127 127 ALA N N 127.342 0.086 . 1034 128 128 LEU H H 8.960 0.006 . 1035 128 128 LEU HA H 5.248 0.006 . 1036 128 128 LEU HB3 H 1.847 0.000 . 1037 128 128 LEU C C 174.349 0.000 . 1038 128 128 LEU CA C 53.241 0.033 . 1039 128 128 LEU CB C 44.638 0.083 . 1040 128 128 LEU N N 124.219 0.050 . 1041 129 129 LEU H H 9.534 0.008 . 1042 129 129 LEU HA H 4.877 0.000 . 1043 129 129 LEU CA C 54.322 0.000 . 1044 129 129 LEU N N 128.632 0.037 . 1045 130 130 ARG HA H 5.114 0.000 . 1046 130 130 ARG C C 176.099 0.000 . 1047 130 130 ARG CA C 57.292 0.000 . 1048 131 131 LEU H H 9.026 0.002 . 1049 131 131 LEU N N 125.669 0.047 . 1050 132 132 PRO HA H 4.066 0.000 . 1051 132 132 PRO HB2 H 1.987 0.000 . 1052 132 132 PRO HB3 H 2.257 0.000 . 1053 132 132 PRO HD2 H 3.620 0.000 . 1054 132 132 PRO HD3 H 3.620 0.000 . 1055 132 132 PRO CA C 66.181 0.000 . 1056 133 133 GLN H H 9.761 0.014 . 1057 133 133 GLN HA H 4.034 0.006 . 1058 133 133 GLN C C 175.476 0.000 . 1059 133 133 GLN CA C 57.959 0.098 . 1060 133 133 GLN CB C 27.217 0.000 . 1061 133 133 GLN N N 121.264 0.031 . 1062 134 134 TYR H H 7.062 0.003 . 1063 134 134 TYR HA H 4.872 0.003 . 1064 134 134 TYR HB2 H 1.553 0.000 . 1065 134 134 TYR HB3 H 1.553 0.000 . 1066 134 134 TYR C C 175.720 0.000 . 1067 134 134 TYR CA C 55.187 0.029 . 1068 134 134 TYR CB C 38.653 0.080 . 1069 134 134 TYR N N 117.630 0.022 . 1070 135 135 GLN H H 8.149 0.003 . 1071 135 135 GLN HA H 3.599 0.003 . 1072 135 135 GLN HB2 H 2.134 0.000 . 1073 135 135 GLN HB3 H 2.450 0.000 . 1074 135 135 GLN HG2 H 2.370 0.000 . 1075 135 135 GLN HG3 H 2.370 0.000 . 1076 135 135 GLN C C 175.296 0.000 . 1077 135 135 GLN CA C 57.463 0.060 . 1078 135 135 GLN CB C 27.015 0.092 . 1079 135 135 GLN CG C 34.139 0.000 . 1080 135 135 GLN N N 119.295 0.038 . 1081 136 136 THR H H 7.468 0.006 . 1082 136 136 THR HA H 5.117 0.002 . 1083 136 136 THR HB H 3.406 0.007 . 1084 136 136 THR HG2 H 1.207 0.000 . 1085 136 136 THR C C 171.140 0.000 . 1086 136 136 THR CA C 62.917 0.135 . 1087 136 136 THR CB C 73.940 0.000 . 1088 136 136 THR CG2 C 20.198 0.011 . 1089 136 136 THR N N 115.394 0.031 . 1090 137 137 ASP H H 8.771 0.004 . 1091 137 137 ASP HA H 5.217 0.003 . 1092 137 137 ASP HB2 H 1.955 0.000 . 1093 137 137 ASP HB3 H 2.337 0.012 . 1094 137 137 ASP C C 172.884 0.000 . 1095 137 137 ASP CA C 54.028 0.000 . 1096 137 137 ASP CB C 44.014 0.006 . 1097 137 137 ASP N N 129.458 0.042 . 1098 138 138 LEU H H 8.769 0.005 . 1099 138 138 LEU HA H 4.947 0.000 . 1100 138 138 LEU HB2 H 1.505 0.007 . 1101 138 138 LEU HB3 H 1.837 0.001 . 1102 138 138 LEU HG H 1.581 0.000 . 1103 138 138 LEU HD1 H 0.702 0.000 . 1104 138 138 LEU HD2 H 0.702 0.000 . 1105 138 138 LEU C C 173.949 0.000 . 1106 138 138 LEU CA C 54.020 0.065 . 1107 138 138 LEU CB C 44.172 0.161 . 1108 138 138 LEU CG C 28.022 0.000 . 1109 138 138 LEU N N 126.417 0.062 . 1110 139 139 LEU H H 8.883 0.005 . 1111 139 139 LEU HA H 5.418 0.009 . 1112 139 139 LEU HB2 H 0.920 0.000 . 1113 139 139 LEU HB3 H 1.849 0.004 . 1114 139 139 LEU HD1 H 0.724 0.000 . 1115 139 139 LEU HD2 H 0.724 0.000 . 1116 139 139 LEU C C 176.195 0.000 . 1117 139 139 LEU CA C 52.998 0.099 . 1118 139 139 LEU CB C 47.005 0.000 . 1119 139 139 LEU N N 127.972 0.050 . 1120 140 140 LEU H H 9.582 0.006 . 1121 140 140 LEU HA H 5.867 0.016 . 1122 140 140 LEU HB2 H 1.693 0.000 . 1123 140 140 LEU HB3 H 1.949 0.000 . 1124 140 140 LEU HG H 1.809 0.001 . 1125 140 140 LEU HD1 H 0.856 0.000 . 1126 140 140 LEU HD2 H 0.856 0.000 . 1127 140 140 LEU C C 176.066 0.000 . 1128 140 140 LEU CA C 54.564 0.000 . 1129 140 140 LEU CB C 43.961 0.000 . 1130 140 140 LEU N N 129.080 0.069 . 1131 141 141 THR H H 9.675 0.005 . 1132 141 141 THR HA H 5.297 0.000 . 1133 141 141 THR HB H 4.004 0.003 . 1134 141 141 THR HG2 H 1.220 0.003 . 1135 141 141 THR C C 172.314 0.000 . 1136 141 141 THR CA C 62.793 0.133 . 1137 141 141 THR CB C 68.149 0.049 . 1138 141 141 THR CG2 C 22.300 0.004 . 1139 141 141 THR N N 119.230 0.047 . 1140 142 142 PHE H H 9.311 0.005 . 1141 142 142 PHE HA H 5.844 0.013 . 1142 142 142 PHE HB2 H 2.504 0.000 . 1143 142 142 PHE HB3 H 2.504 0.000 . 1144 142 142 PHE C C 173.570 0.000 . 1145 142 142 PHE CA C 52.963 0.000 . 1146 142 142 PHE CB C 40.083 0.029 . 1147 142 142 PHE N N 127.295 0.076 . 1148 143 143 ASN H H 9.092 0.003 . 1149 143 143 ASN CA C 53.111 0.000 . 1150 143 143 ASN N N 127.471 0.019 . 1151 147 147 PRO HA H 4.384 0.003 . 1152 147 147 PRO HB2 H 1.895 0.019 . 1153 147 147 PRO HB3 H 2.229 0.004 . 1154 147 147 PRO C C 176.606 0.000 . 1155 147 147 PRO CA C 63.108 0.171 . 1156 147 147 PRO CB C 32.060 0.102 . 1157 147 147 PRO CG C 27.631 0.000 . 1158 147 147 PRO CD C 51.098 0.000 . 1159 148 148 ASP H H 8.383 0.004 . 1160 148 148 ASP HA H 4.562 0.000 . 1161 148 148 ASP HB2 H 2.651 0.001 . 1162 148 148 ASP HB3 H 2.651 0.001 . 1163 148 148 ASP C C 176.185 0.000 . 1164 148 148 ASP CA C 53.879 0.080 . 1165 148 148 ASP CB C 41.480 0.034 . 1166 148 148 ASP N N 120.755 0.039 . 1167 149 149 ASN H H 8.378 0.005 . 1168 149 149 ASN HA H 4.631 0.000 . 1169 149 149 ASN HB2 H 2.793 0.000 . 1170 149 149 ASN HB3 H 2.793 0.000 . 1171 149 149 ASN C C 175.704 0.000 . 1172 149 149 ASN CA C 53.733 0.032 . 1173 149 149 ASN CB C 38.603 0.037 . 1174 149 149 ASN N N 119.405 0.015 . 1175 150 150 ARG H H 8.313 0.006 . 1176 150 150 ARG HA H 4.279 0.018 . 1177 150 150 ARG HB2 H 1.840 0.000 . 1178 150 150 ARG HB3 H 1.840 0.000 . 1179 150 150 ARG C C 176.826 0.000 . 1180 150 150 ARG CA C 56.777 0.045 . 1181 150 150 ARG CB C 30.418 0.043 . 1182 150 150 ARG CD C 43.392 0.000 . 1183 150 150 ARG N N 120.547 0.045 . 1184 151 151 SER H H 8.229 0.003 . 1185 151 151 SER HA H 4.389 0.000 . 1186 151 151 SER HB2 H 3.849 0.006 . 1187 151 151 SER HB3 H 3.849 0.006 . 1188 151 151 SER C C 174.820 0.000 . 1189 151 151 SER CA C 58.923 0.060 . 1190 151 151 SER CB C 63.758 0.001 . 1191 151 151 SER N N 115.756 0.063 . 1192 152 152 SER H H 8.209 0.002 . 1193 152 152 SER HA H 4.412 0.006 . 1194 152 152 SER HB2 H 3.855 0.000 . 1195 152 152 SER HB3 H 3.855 0.000 . 1196 152 152 SER C C 174.368 0.000 . 1197 152 152 SER CA C 58.727 0.079 . 1198 152 152 SER CB C 63.822 0.091 . 1199 152 152 SER N N 117.377 0.016 . 1200 153 153 LEU H H 8.056 0.003 . 1201 153 153 LEU HB2 H 1.593 0.000 . 1202 153 153 LEU HB3 H 1.593 0.000 . 1203 153 153 LEU CA C 55.220 0.000 . 1204 153 153 LEU CB C 42.515 0.000 . 1205 153 153 LEU N N 122.934 0.026 . 1206 155 155 PRO HA H 4.331 0.000 . 1207 155 155 PRO HB2 H 1.934 0.001 . 1208 155 155 PRO HB3 H 2.242 0.000 . 1209 155 155 PRO HD2 H 3.628 0.002 . 1210 155 155 PRO HD3 H 3.628 0.002 . 1211 155 155 PRO C C 177.460 0.000 . 1212 155 155 PRO CA C 63.846 0.024 . 1213 155 155 PRO CB C 32.050 0.035 . 1214 155 155 PRO CG C 26.383 0.000 . 1215 155 155 PRO CD C 49.785 0.000 . 1216 156 156 GLU H H 8.790 0.002 . 1217 156 156 GLU HA H 4.189 0.003 . 1218 156 156 GLU HB2 H 1.978 0.004 . 1219 156 156 GLU HB3 H 1.978 0.004 . 1220 156 156 GLU HG2 H 2.231 0.000 . 1221 156 156 GLU HG3 H 2.231 0.000 . 1222 156 156 GLU C C 176.401 0.000 . 1223 156 156 GLU CA C 57.309 0.057 . 1224 156 156 GLU CB C 29.564 0.090 . 1225 156 156 GLU N N 119.803 0.012 . 1226 157 157 ASN H H 8.197 0.002 . 1227 157 157 ASN HA H 4.595 0.000 . 1228 157 157 ASN HB2 H 2.780 0.005 . 1229 157 157 ASN HB3 H 2.780 0.005 . 1230 157 157 ASN C C 174.847 0.000 . 1231 157 157 ASN CA C 53.809 0.056 . 1232 157 157 ASN CB C 38.879 0.033 . 1233 157 157 ASN N N 117.989 0.021 . 1234 158 158 LEU H H 8.092 0.002 . 1235 158 158 LEU HA H 4.348 0.007 . 1236 158 158 LEU HB2 H 1.596 0.008 . 1237 158 158 LEU HB3 H 1.596 0.008 . 1238 158 158 LEU HD1 H 0.856 0.000 . 1239 158 158 LEU HD2 H 0.856 0.000 . 1240 158 158 LEU C C 176.888 0.000 . 1241 158 158 LEU CA C 55.062 0.029 . 1242 158 158 LEU CB C 41.947 0.081 . 1243 158 158 LEU CG C 26.749 0.000 . 1244 158 158 LEU CD1 C 24.612 0.000 . 1245 158 158 LEU CD2 C 23.491 0.000 . 1246 158 158 LEU N N 121.362 0.035 . 1247 159 159 SER H H 8.041 0.003 . 1248 159 159 SER CA C 56.416 0.146 . 1249 159 159 SER CB C 63.806 0.000 . 1250 159 159 SER N N 117.171 0.040 . 1251 160 160 PRO HA H 4.430 0.006 . 1252 160 160 PRO HB2 H 1.792 0.000 . 1253 160 160 PRO HB3 H 2.275 0.012 . 1254 160 160 PRO C C 176.240 0.000 . 1255 160 160 PRO CA C 63.081 0.122 . 1256 160 160 PRO CB C 31.840 0.127 . 1257 161 161 ALA H H 8.468 0.003 . 1258 161 161 ALA CA C 51.075 0.038 . 1259 161 161 ALA CB C 17.612 0.000 . 1260 161 161 ALA N N 125.868 0.055 . 1261 164 164 SER HA H 5.102 0.004 . 1262 164 164 SER HB2 H 3.967 0.000 . 1263 164 164 SER HB3 H 4.341 0.000 . 1264 164 164 SER C C 175.326 0.000 . 1265 164 164 SER CA C 56.389 0.046 . 1266 164 164 SER CB C 68.060 0.098 . 1267 165 165 LEU H H 9.049 0.005 . 1268 165 165 LEU HA H 4.017 0.026 . 1269 165 165 LEU HB2 H 1.614 0.008 . 1270 165 165 LEU HB3 H 1.614 0.008 . 1271 165 165 LEU HD1 H 0.612 0.000 . 1272 165 165 LEU HD2 H 0.550 0.000 . 1273 165 165 LEU C C 179.174 0.000 . 1274 165 165 LEU CA C 57.947 0.102 . 1275 165 165 LEU CB C 41.094 0.000 . 1276 165 165 LEU N N 121.466 0.046 . 1277 166 166 GLY H H 8.371 0.010 . 1278 166 166 GLY HA2 H 3.857 0.010 . 1279 166 166 GLY HA3 H 3.857 0.010 . 1280 166 166 GLY C C 176.821 0.000 . 1281 166 166 GLY CA C 47.018 0.157 . 1282 166 166 GLY N N 107.130 0.054 . 1283 167 167 ASP H H 7.688 0.003 . 1284 167 167 ASP HA H 4.236 0.002 . 1285 167 167 ASP HB2 H 2.774 0.000 . 1286 167 167 ASP HB3 H 2.774 0.000 . 1287 167 167 ASP C C 178.909 0.000 . 1288 167 167 ASP CA C 57.809 0.049 . 1289 167 167 ASP CB C 40.850 0.089 . 1290 167 167 ASP N N 121.904 0.049 . 1291 168 168 PHE H H 7.087 0.011 . 1292 168 168 PHE HA H 3.994 0.010 . 1293 168 168 PHE HB2 H 2.375 0.008 . 1294 168 168 PHE HB3 H 3.068 0.014 . 1295 168 168 PHE C C 175.941 0.000 . 1296 168 168 PHE CA C 60.160 0.105 . 1297 168 168 PHE CB C 38.687 0.082 . 1298 168 168 PHE N N 121.333 0.034 . 1299 169 169 GLU H H 8.725 0.006 . 1300 169 169 GLU HA H 3.452 0.005 . 1301 169 169 GLU HB2 H 2.003 0.004 . 1302 169 169 GLU HB3 H 2.003 0.004 . 1303 169 169 GLU HG2 H 2.334 0.000 . 1304 169 169 GLU HG3 H 2.334 0.000 . 1305 169 169 GLU C C 178.690 0.000 . 1306 169 169 GLU CA C 60.033 0.141 . 1307 169 169 GLU CB C 29.180 0.080 . 1308 169 169 GLU CG C 36.519 0.000 . 1309 169 169 GLU N N 119.372 0.032 . 1310 170 170 GLN H H 7.906 0.004 . 1311 170 170 GLN HA H 4.031 0.014 . 1312 170 170 GLN HB2 H 1.982 0.000 . 1313 170 170 GLN HB3 H 1.982 0.000 . 1314 170 170 GLN HG2 H 2.168 0.008 . 1315 170 170 GLN HG3 H 2.168 0.008 . 1316 170 170 GLN C C 178.337 0.000 . 1317 170 170 GLN CA C 58.294 0.122 . 1318 170 170 GLN CB C 29.182 0.171 . 1319 170 170 GLN CG C 34.159 0.000 . 1320 170 170 GLN N N 117.487 0.042 . 1321 171 171 LEU H H 7.264 0.008 . 1322 171 171 LEU HA H 3.963 0.007 . 1323 171 171 LEU HB2 H 1.265 0.004 . 1324 171 171 LEU HB3 H 2.054 0.005 . 1325 171 171 LEU HD1 H 0.778 0.007 . 1326 171 171 LEU HD2 H 0.592 0.004 . 1327 171 171 LEU C C 175.805 0.000 . 1328 171 171 LEU CA C 58.861 0.100 . 1329 171 171 LEU CB C 41.462 0.013 . 1330 171 171 LEU CG C 26.966 0.000 . 1331 171 171 LEU CD1 C 27.084 0.074 . 1332 171 171 LEU CD2 C 24.150 0.023 . 1333 171 171 LEU N N 124.172 0.036 . 1334 172 172 VAL H H 7.502 0.005 . 1335 172 172 VAL HA H 3.115 0.012 . 1336 172 172 VAL HB H 1.704 0.003 . 1337 172 172 VAL HG1 H 0.623 0.003 . 1338 172 172 VAL HG2 H 0.167 0.001 . 1339 172 172 VAL C C 177.305 0.000 . 1340 172 172 VAL CA C 66.523 0.116 . 1341 172 172 VAL CB C 31.779 0.034 . 1342 172 172 VAL CG1 C 21.543 0.036 . 1343 172 172 VAL CG2 C 22.551 0.002 . 1344 172 172 VAL N N 115.758 0.077 . 1345 173 173 THR H H 8.310 0.004 . 1346 173 173 THR HA H 3.968 0.004 . 1347 173 173 THR HB H 4.308 0.014 . 1348 173 173 THR HG2 H 1.148 0.002 . 1349 173 173 THR C C 176.160 0.000 . 1350 173 173 THR CA C 65.369 0.095 . 1351 173 173 THR CB C 69.418 0.212 . 1352 173 173 THR CG2 C 22.639 0.000 . 1353 173 173 THR N N 107.059 0.034 . 1354 174 174 SER H H 7.623 0.003 . 1355 174 174 SER HA H 4.342 0.003 . 1356 174 174 SER HB2 H 3.931 0.000 . 1357 174 174 SER HB3 H 4.043 0.000 . 1358 174 174 SER HG H 5.548 0.005 . 1359 174 174 SER C C 175.605 0.000 . 1360 174 174 SER CA C 59.230 0.088 . 1361 174 174 SER CB C 64.846 0.181 . 1362 174 174 SER N N 114.402 0.048 . 1363 175 175 LEU H H 7.108 0.006 . 1364 175 175 LEU HA H 4.736 0.011 . 1365 175 175 LEU HB2 H 1.808 0.000 . 1366 175 175 LEU HB3 H 1.808 0.000 . 1367 175 175 LEU HD1 H 0.710 0.000 . 1368 175 175 LEU HD2 H 0.710 0.000 . 1369 175 175 LEU C C 175.111 0.000 . 1370 175 175 LEU CA C 56.797 0.075 . 1371 175 175 LEU CB C 40.969 0.025 . 1372 175 175 LEU N N 127.338 0.059 . 1373 176 176 THR H H 9.295 0.008 . 1374 176 176 THR HA H 4.252 0.008 . 1375 176 176 THR HB H 3.763 0.004 . 1376 176 176 THR HG2 H 0.674 0.014 . 1377 176 176 THR C C 172.351 0.000 . 1378 176 176 THR CA C 62.226 0.167 . 1379 176 176 THR CB C 71.467 0.000 . 1380 176 176 THR CG2 C 19.543 0.000 . 1381 176 176 THR N N 123.377 0.088 . 1382 177 177 LEU H H 8.136 0.006 . 1383 177 177 LEU HA H 3.841 0.016 . 1384 177 177 LEU HB2 H 0.910 0.000 . 1385 177 177 LEU HB3 H 1.580 0.017 . 1386 177 177 LEU HG H 0.692 0.000 . 1387 177 177 LEU HD1 H -0.122 0.002 . 1388 177 177 LEU HD2 H -0.122 0.002 . 1389 177 177 LEU C C 174.309 0.000 . 1390 177 177 LEU CA C 53.886 0.016 . 1391 177 177 LEU CB C 43.511 0.021 . 1392 177 177 LEU CG C 26.781 0.000 . 1393 177 177 LEU CD1 C 21.782 0.008 . 1394 177 177 LEU CD2 C 21.782 0.008 . 1395 177 177 LEU N N 126.731 0.063 . 1396 178 178 HIS H H 8.795 0.005 . 1397 178 178 HIS HA H 4.640 0.013 . 1398 178 178 HIS HB2 H 2.776 0.007 . 1399 178 178 HIS HB3 H 3.050 0.001 . 1400 178 178 HIS CA C 56.795 0.127 . 1401 178 178 HIS CB C 31.584 0.099 . 1402 178 178 HIS N N 124.927 0.047 . 1403 179 179 ASP H H 7.496 0.006 . 1404 179 179 ASP HA H 5.121 0.000 . 1405 179 179 ASP HB2 H 2.461 0.004 . 1406 179 179 ASP HB3 H 2.816 0.000 . 1407 179 179 ASP CA C 50.410 0.036 . 1408 179 179 ASP CB C 42.545 0.000 . 1409 179 179 ASP N N 115.270 0.058 . 1410 180 180 PRO HA H 3.945 0.000 . 1411 180 180 PRO HG2 H 1.964 0.000 . 1412 180 180 PRO HG3 H 1.964 0.000 . 1413 180 180 PRO HD3 H 3.493 0.000 . 1414 180 180 PRO C C 177.032 0.000 . 1415 180 180 PRO CA C 63.291 0.119 . 1416 180 180 PRO CB C 32.145 0.043 . 1417 181 181 ASN H H 8.311 0.003 . 1418 181 181 ASN HA H 4.442 0.004 . 1419 181 181 ASN HB2 H 2.663 0.002 . 1420 181 181 ASN HB3 H 2.978 0.003 . 1421 181 181 ASN C C 176.771 0.000 . 1422 181 181 ASN CA C 55.609 0.071 . 1423 181 181 ASN CB C 37.602 0.137 . 1424 181 181 ASN N N 118.624 0.061 . 1425 182 182 ILE H H 7.052 0.007 . 1426 182 182 ILE HA H 3.974 0.010 . 1427 182 182 ILE HB H 1.485 0.015 . 1428 182 182 ILE HG12 H 0.751 0.001 . 1429 182 182 ILE HG2 H -0.195 0.018 . 1430 182 182 ILE HD1 H 0.726 0.009 . 1431 182 182 ILE C C 174.448 0.000 . 1432 182 182 ILE CA C 60.990 0.092 . 1433 182 182 ILE CB C 37.459 0.019 . 1434 182 182 ILE CG1 C 27.998 0.000 . 1435 182 182 ILE CG2 C 16.591 0.000 . 1436 182 182 ILE CD1 C 14.783 0.000 . 1437 182 182 ILE N N 118.895 0.022 . 1438 183 183 PHE H H 6.921 0.005 . 1439 183 183 PHE HA H 4.647 0.008 . 1440 183 183 PHE HB2 H 2.669 0.002 . 1441 183 183 PHE HB3 H 3.472 0.001 . 1442 183 183 PHE C C 175.971 0.000 . 1443 183 183 PHE CA C 57.563 0.066 . 1444 183 183 PHE CB C 39.039 0.058 . 1445 183 183 PHE N N 118.813 0.046 . 1446 184 184 GLY H H 7.784 0.003 . 1447 184 184 GLY HA2 H 4.156 0.000 . 1448 184 184 GLY HA3 H 4.156 0.000 . 1449 184 184 GLY CA C 45.061 0.076 . 1450 184 184 GLY N N 108.002 0.042 . 1451 185 185 PRO HA H 4.393 0.000 . 1452 185 185 PRO HD2 H 3.633 0.000 . 1453 185 185 PRO HD3 H 3.633 0.000 . 1454 185 185 PRO C C 177.466 0.000 . 1455 185 185 PRO CA C 64.036 0.000 . 1456 185 185 PRO CB C 31.720 0.000 . 1457 186 186 GLN H H 8.458 0.005 . 1458 186 186 GLN HA H 4.338 0.000 . 1459 186 186 GLN HB2 H 1.959 0.000 . 1460 186 186 GLN HB3 H 2.120 0.000 . 1461 186 186 GLN HG2 H 2.367 0.000 . 1462 186 186 GLN HG3 H 2.367 0.000 . 1463 186 186 GLN C C 176.133 0.000 . 1464 186 186 GLN CA C 55.976 0.081 . 1465 186 186 GLN CB C 29.279 0.000 . 1466 186 186 GLN N N 119.812 0.017 . stop_ save_