data_30375 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Structure of two-domain translational regulator Yih1 reveals a possible mechanism of action ; _BMRB_accession_number 30375 _BMRB_flat_file_name bmr30375.str _Entry_type original _Submission_date 2017-11-27 _Accession_date 2017-11-27 _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 Harjes E. . . 2 Jameson G. B. . 3 Edwards P. J.B. . 4 Goroncy A. K. . 5 Loo T. . . 6 Norris G. E. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 1235 "13C chemical shifts" 921 "15N chemical shifts" 244 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-11-19 original BMRB . stop_ _Original_release_date 2018-01-10 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structure of two-domain translational regulator Yih1 reveals a possible mechanism of action. ; _Citation_status 'in preparation' _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Harjes E. . . 2 Jameson G. B. . 3 Tu J. . . 4 Burr N. . . 5 Loo T. S. . 6 Goroncy A. K. . 7 Edwards P. J.B. . 8 Harjjes S. . . 9 Sattlegger E. . . 10 Norris G. E. . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD 0353 _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Protein IMPACT homolog' _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 entity_1 _Molecular_mass 29047.422 _Mol_thiol_state . _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 258 _Mol_residue_sequence ; MDDDHEQLVEELEAVEAIYP DLLSKKQEDGSIIVVKVPQH EYMTLQISFPTHYPSEEAPN VIEVGVCTSLAKRDLYDTKY LQHLFQEVMDSVFHRGSVCL FDFLTELDGVLYVEPEEETE PVQQSDIPTDPFEGWTASDP ITDRGSTFMAFAAHVTSEEQ AFAMLDLLKTDSKMRKANHV MSAWRIKQDGSAATYQDSDD DGETAAGSRMLHLITIMDVW NVIVVVARWFGGAHIGPDRF KHINSTAREAVVRAGFDS ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ASP 3 ASP 4 ASP 5 HIS 6 GLU 7 GLN 8 LEU 9 VAL 10 GLU 11 GLU 12 LEU 13 GLU 14 ALA 15 VAL 16 GLU 17 ALA 18 ILE 19 TYR 20 PRO 21 ASP 22 LEU 23 LEU 24 SER 25 LYS 26 LYS 27 GLN 28 GLU 29 ASP 30 GLY 31 SER 32 ILE 33 ILE 34 VAL 35 VAL 36 LYS 37 VAL 38 PRO 39 GLN 40 HIS 41 GLU 42 TYR 43 MET 44 THR 45 LEU 46 GLN 47 ILE 48 SER 49 PHE 50 PRO 51 THR 52 HIS 53 TYR 54 PRO 55 SER 56 GLU 57 GLU 58 ALA 59 PRO 60 ASN 61 VAL 62 ILE 63 GLU 64 VAL 65 GLY 66 VAL 67 CYS 68 THR 69 SER 70 LEU 71 ALA 72 LYS 73 ARG 74 ASP 75 LEU 76 TYR 77 ASP 78 THR 79 LYS 80 TYR 81 LEU 82 GLN 83 HIS 84 LEU 85 PHE 86 GLN 87 GLU 88 VAL 89 MET 90 ASP 91 SER 92 VAL 93 PHE 94 HIS 95 ARG 96 GLY 97 SER 98 VAL 99 CYS 100 LEU 101 PHE 102 ASP 103 PHE 104 LEU 105 THR 106 GLU 107 LEU 108 ASP 109 GLY 110 VAL 111 LEU 112 TYR 113 VAL 114 GLU 115 PRO 116 GLU 117 GLU 118 GLU 119 THR 120 GLU 121 PRO 122 VAL 123 GLN 124 GLN 125 SER 126 ASP 127 ILE 128 PRO 129 THR 130 ASP 131 PRO 132 PHE 133 GLU 134 GLY 135 TRP 136 THR 137 ALA 138 SER 139 ASP 140 PRO 141 ILE 142 THR 143 ASP 144 ARG 145 GLY 146 SER 147 THR 148 PHE 149 MET 150 ALA 151 PHE 152 ALA 153 ALA 154 HIS 155 VAL 156 THR 157 SER 158 GLU 159 GLU 160 GLN 161 ALA 162 PHE 163 ALA 164 MET 165 LEU 166 ASP 167 LEU 168 LEU 169 LYS 170 THR 171 ASP 172 SER 173 LYS 174 MET 175 ARG 176 LYS 177 ALA 178 ASN 179 HIS 180 VAL 181 MET 182 SER 183 ALA 184 TRP 185 ARG 186 ILE 187 LYS 188 GLN 189 ASP 190 GLY 191 SER 192 ALA 193 ALA 194 THR 195 TYR 196 GLN 197 ASP 198 SER 199 ASP 200 ASP 201 ASP 202 GLY 203 GLU 204 THR 205 ALA 206 ALA 207 GLY 208 SER 209 ARG 210 MET 211 LEU 212 HIS 213 LEU 214 ILE 215 THR 216 ILE 217 MET 218 ASP 219 VAL 220 TRP 221 ASN 222 VAL 223 ILE 224 VAL 225 VAL 226 VAL 227 ALA 228 ARG 229 TRP 230 PHE 231 GLY 232 GLY 233 ALA 234 HIS 235 ILE 236 GLY 237 PRO 238 ASP 239 ARG 240 PHE 241 LYS 242 HIS 243 ILE 244 ASN 245 SER 246 THR 247 ALA 248 ARG 249 GLU 250 ALA 251 VAL 252 VAL 253 ARG 254 ALA 255 GLY 256 PHE 257 ASP 258 SER 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 _Strain _Gene_mnemonic $entity_1 "Baker's yeast" 559292 Eukaryota Fungi Saccharomyces cerevisiae 'ATCC 204508 / S288c' 'YIH1, YCR059C, YCR59C' 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 $entity_1 'recombinant technology' . Escherichia coli . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '1 mM [U-13C; U-15N] Yih1 (Yeast Impact Homologue), 95% H2O/5% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1 mM '[U-13C; U-15N]' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name 'X-PLOR NIH' _Version . loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task refinement 'structure calculation' stop_ _Details . save_ save_software_2 _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HNCA_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aliphatic_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_7 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _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 'ionic strength' 30 . mM pH 7.2 . pH pressure 1 . atm temperature 298 . 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 . . . 0.25144953 DSS H 1 'methyl protons' ppm 0.000 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.000 internal indirect . . . 0.10132912 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 '3D HNCA' '3D HNCACB' '3D 1H-15N NOESY' '3D H(CCO)NH' '3D HCCH-TOCSY' '3D 1H-13C NOESY aliphatic' '2D 1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 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 1 1 MET H H 8.437 0.020 . 2 1 1 MET HA H 4.477 0.020 . 3 1 1 MET HB2 H 1.946 0.020 . 4 1 1 MET HB3 H 1.946 0.020 . 5 1 1 MET HG2 H 2.464 0.020 . 6 1 1 MET HG3 H 2.464 0.020 . 7 1 1 MET C C 172.986 0.300 . 8 1 1 MET CA C 51.753 0.300 . 9 1 1 MET CB C 30.597 0.300 . 10 1 1 MET CG C 33.539 0.300 . 11 1 1 MET N N 128.267 0.300 . 12 2 2 ASP H H 8.459 0.020 . 13 2 2 ASP HA H 4.607 0.020 . 14 2 2 ASP HB2 H 2.567 0.020 . 15 2 2 ASP HB3 H 2.700 0.020 . 16 2 2 ASP C C 173.191 0.300 . 17 2 2 ASP CA C 51.715 0.300 . 18 2 2 ASP CB C 38.178 0.300 . 19 2 2 ASP N N 121.567 0.300 . 20 3 3 ASP H H 8.230 0.020 . 21 3 3 ASP HA H 4.466 0.020 . 22 3 3 ASP HB2 H 2.605 0.020 . 23 3 3 ASP HB3 H 2.605 0.020 . 24 3 3 ASP C C 174.858 0.300 . 25 3 3 ASP CA C 53.035 0.300 . 26 3 3 ASP CB C 38.568 0.300 . 27 3 3 ASP N N 121.431 0.300 . 28 4 4 ASP H H 8.124 0.020 . 29 4 4 ASP HA H 4.381 0.020 . 30 4 4 ASP HB2 H 3.226 0.020 . 31 4 4 ASP HB3 H 2.598 0.020 . 32 4 4 ASP C C 174.602 0.300 . 33 4 4 ASP CA C 55.676 0.300 . 34 4 4 ASP CB C 37.173 0.300 . 35 4 4 ASP N N 121.841 0.300 . 36 5 5 HIS H H 8.252 0.020 . 37 5 5 HIS HA H 4.200 0.020 . 38 5 5 HIS HB2 H 3.256 0.020 . 39 5 5 HIS HB3 H 3.256 0.020 . 40 5 5 HIS HD2 H 7.268 0.020 . 41 5 5 HIS C C 173.806 0.300 . 42 5 5 HIS CA C 57.199 0.300 . 43 5 5 HIS CB C 25.105 0.300 . 44 5 5 HIS CD2 C 117.257 0.300 . 45 5 5 HIS CE1 C 126.709 0.300 . 46 5 5 HIS N N 116.919 0.300 . 47 6 6 GLU H H 8.018 0.020 . 48 6 6 GLU HA H 3.830 0.020 . 49 6 6 GLU HB2 H 2.017 0.020 . 50 6 6 GLU HB3 H 2.017 0.020 . 51 6 6 GLU HG2 H 2.307 0.020 . 52 6 6 GLU HG3 H 2.253 0.020 . 53 6 6 GLU C C 176.448 0.300 . 54 6 6 GLU CA C 56.488 0.300 . 55 6 6 GLU CB C 25.956 0.300 . 56 6 6 GLU CG C 32.998 0.300 . 57 6 6 GLU N N 117.329 0.300 . 58 7 7 GLN H H 7.755 0.020 . 59 7 7 GLN HA H 3.866 0.020 . 60 7 7 GLN HB2 H 1.863 0.020 . 61 7 7 GLN HB3 H 2.007 0.020 . 62 7 7 GLN HG2 H 2.433 0.020 . 63 7 7 GLN HG3 H 2.212 0.020 . 64 7 7 GLN HE21 H 7.304 0.020 . 65 7 7 GLN HE22 H 6.585 0.020 . 66 7 7 GLN C C 176.136 0.300 . 67 7 7 GLN CA C 56.590 0.300 . 68 7 7 GLN CB C 26.110 0.300 . 69 7 7 GLN CG C 31.983 0.300 . 70 7 7 GLN N N 117.739 0.300 . 71 7 7 GLN NE2 N 112.008 0.300 . 72 8 8 LEU H H 7.851 0.020 . 73 8 8 LEU HA H 4.085 0.020 . 74 8 8 LEU HB2 H 1.299 0.020 . 75 8 8 LEU HB3 H 1.299 0.020 . 76 8 8 LEU HG H 0.892 0.020 . 77 8 8 LEU HD1 H -0.103 0.020 . 78 8 8 LEU HD2 H 0.586 0.020 . 79 8 8 LEU CA C 55.348 0.300 . 80 8 8 LEU CB C 38.303 0.300 . 81 8 8 LEU CG C 24.617 0.300 . 82 8 8 LEU CD1 C 18.158 0.300 . 83 8 8 LEU CD2 C 22.103 0.300 . 84 8 8 LEU N N 122.121 0.300 . 85 9 9 VAL H H 8.062 0.020 . 86 9 9 VAL HA H 3.221 0.020 . 87 9 9 VAL HB H 1.887 0.020 . 88 9 9 VAL HG1 H 0.727 0.020 . 89 9 9 VAL HG2 H 0.727 0.020 . 90 9 9 VAL C C 176.214 0.300 . 91 9 9 VAL CA C 64.309 0.300 . 92 9 9 VAL CB C 28.354 0.300 . 93 9 9 VAL CG1 C 18.322 0.300 . 94 9 9 VAL CG2 C 19.298 0.300 . 95 9 9 VAL N N 117.602 0.300 . 96 10 10 GLU H H 7.632 0.020 . 97 10 10 GLU HA H 3.901 0.020 . 98 10 10 GLU HB2 H 1.960 0.020 . 99 10 10 GLU HB3 H 1.863 0.020 . 100 10 10 GLU HG2 H 2.388 0.020 . 101 10 10 GLU HG3 H 2.388 0.020 . 102 10 10 GLU CA C 56.488 0.300 . 103 10 10 GLU CB C 26.575 0.300 . 104 10 10 GLU CG C 33.062 0.300 . 105 10 10 GLU N N 118.286 0.300 . 106 11 11 GLU H H 7.995 0.020 . 107 11 11 GLU HA H 4.088 0.020 . 108 11 11 GLU HB2 H 2.522 0.020 . 109 11 11 GLU HG2 H 2.110 0.020 . 110 11 11 GLU HG3 H 1.894 0.020 . 111 11 11 GLU C C 175.474 0.300 . 112 11 11 GLU CA C 56.895 0.300 . 113 11 11 GLU CB C 26.961 0.300 . 114 11 11 GLU CG C 34.292 0.300 . 115 11 11 GLU N N 123.618 0.300 . 116 12 12 LEU H H 8.699 0.020 . 117 12 12 LEU HA H 3.783 0.020 . 118 12 12 LEU HB2 H 1.816 0.020 . 119 12 12 LEU HB3 H 1.133 0.020 . 120 12 12 LEU HD1 H 0.688 0.020 . 121 12 12 LEU HD2 H 0.600 0.020 . 122 12 12 LEU C C 177.460 0.300 . 123 12 12 LEU CA C 55.371 0.300 . 124 12 12 LEU CB C 37.784 0.300 . 125 12 12 LEU CD1 C 23.411 0.300 . 126 12 12 LEU CD2 C 19.401 0.300 . 127 12 12 LEU N N 117.739 0.300 . 128 13 13 GLU H H 7.872 0.020 . 129 13 13 GLU HA H 3.929 0.020 . 130 13 13 GLU HB2 H 1.958 0.020 . 131 13 13 GLU HG2 H 2.141 0.020 . 132 13 13 GLU HG3 H 2.380 0.020 . 133 13 13 GLU C C 176.331 0.300 . 134 13 13 GLU CA C 56.692 0.300 . 135 13 13 GLU CB C 26.575 0.300 . 136 13 13 GLU CG C 33.325 0.300 . 137 13 13 GLU N N 118.423 0.300 . 138 14 14 ALA H H 7.895 0.020 . 139 14 14 ALA HA H 4.131 0.020 . 140 14 14 ALA HB H 1.581 0.020 . 141 14 14 ALA C C 178.065 0.300 . 142 14 14 ALA CA C 52.387 0.300 . 143 14 14 ALA CB C 15.074 0.300 . 144 14 14 ALA N N 123.755 0.300 . 145 15 15 VAL H H 8.621 0.020 . 146 15 15 VAL HA H 3.642 0.020 . 147 15 15 VAL HB H 2.022 0.020 . 148 15 15 VAL HG1 H 0.866 0.020 . 149 15 15 VAL C C 174.890 0.300 . 150 15 15 VAL CA C 64.106 0.300 . 151 15 15 VAL CB C 28.728 0.300 . 152 15 15 VAL CG1 C 19.469 0.300 . 153 15 15 VAL N N 119.243 0.300 . 154 16 16 GLU H H 8.101 0.020 . 155 16 16 GLU HA H 3.899 0.020 . 156 16 16 GLU HB2 H 1.922 0.020 . 157 16 16 GLU HB3 H 2.017 0.020 . 158 16 16 GLU HG2 H 2.392 0.020 . 159 16 16 GLU HG3 H 2.319 0.020 . 160 16 16 GLU C C 174.267 0.300 . 161 16 16 GLU CA C 56.184 0.300 . 162 16 16 GLU CB C 26.807 0.300 . 163 16 16 GLU CG C 33.676 0.300 . 164 16 16 GLU N N 119.380 0.300 . 165 17 17 ALA H H 7.369 0.020 . 166 17 17 ALA HA H 4.031 0.020 . 167 17 17 ALA HB H 1.383 0.020 . 168 17 17 ALA C C 176.604 0.300 . 169 17 17 ALA CA C 51.230 0.300 . 170 17 17 ALA CB C 15.460 0.300 . 171 17 17 ALA N N 117.466 0.300 . 172 18 18 ILE H H 7.235 0.020 . 173 18 18 ILE HA H 3.736 0.020 . 174 18 18 ILE HB H 1.525 0.020 . 175 18 18 ILE HG12 H 1.353 0.020 . 176 18 18 ILE HG13 H 1.114 0.020 . 177 18 18 ILE HG2 H 0.100 0.020 . 178 18 18 ILE HD1 H 0.496 0.020 . 179 18 18 ILE C C 172.841 0.300 . 180 18 18 ILE CA C 59.332 0.300 . 181 18 18 ILE CB C 35.935 0.300 . 182 18 18 ILE CG1 C 25.172 0.300 . 183 18 18 ILE CG2 C 13.818 0.300 . 184 18 18 ILE CD1 C 9.124 0.300 . 185 18 18 ILE N N 116.919 0.300 . 186 19 19 TYR H H 8.319 0.020 . 187 19 19 TYR HB2 H 2.959 0.020 . 188 19 19 TYR HB3 H 2.758 0.020 . 189 19 19 TYR HD1 H 7.087 0.020 . 190 19 19 TYR HD2 H 7.087 0.020 . 191 19 19 TYR HE1 H 6.669 0.020 . 192 19 19 TYR HE2 H 6.669 0.020 . 193 19 19 TYR C C 169.866 0.300 . 194 19 19 TYR CA C 51.132 0.300 . 195 19 19 TYR CB C 36.347 0.300 . 196 19 19 TYR CD1 C 130.507 0.300 . 197 19 19 TYR CE1 C 115.229 0.300 . 198 19 19 TYR N N 119.517 0.300 . 199 20 20 PRO HA H 4.482 0.020 . 200 20 20 PRO HB2 H 2.305 0.020 . 201 20 20 PRO HB3 H 1.815 0.020 . 202 20 20 PRO HG2 H 1.913 0.020 . 203 20 20 PRO HD2 H 3.285 0.020 . 204 20 20 PRO HD3 H 3.285 0.020 . 205 20 20 PRO CA C 61.966 0.300 . 206 20 20 PRO CB C 28.766 0.300 . 207 20 20 PRO CG C 24.821 0.300 . 208 20 20 PRO CD C 47.419 0.300 . 209 21 21 ASP H H 8.772 0.020 . 210 21 21 ASP HA H 4.502 0.020 . 211 21 21 ASP HB2 H 2.688 0.020 . 212 21 21 ASP HB3 H 2.688 0.020 . 213 21 21 ASP C C 173.683 0.300 . 214 21 21 ASP CA C 52.426 0.300 . 215 21 21 ASP CB C 37.637 0.300 . 216 21 21 ASP N N 115.415 0.300 . 217 22 22 LEU H H 7.677 0.020 . 218 22 22 LEU HA H 4.177 0.020 . 219 22 22 LEU HB2 H 1.631 0.020 . 220 22 22 LEU HB3 H 1.631 0.020 . 221 22 22 LEU HG H 1.590 0.020 . 222 22 22 LEU HD1 H 0.520 0.020 . 223 22 22 LEU HD2 H 0.531 0.020 . 224 22 22 LEU CA C 53.830 0.300 . 225 22 22 LEU CB C 38.701 0.300 . 226 22 22 LEU CG C 23.991 0.300 . 227 22 22 LEU CD2 C 20.363 0.300 . 228 22 22 LEU N N 118.970 0.300 . 229 23 23 LEU H H 8.148 0.020 . 230 23 23 LEU HA H 5.013 0.020 . 231 23 23 LEU HB2 H 1.690 0.020 . 232 23 23 LEU HB3 H 1.414 0.020 . 233 23 23 LEU HD1 H 0.800 0.020 . 234 23 23 LEU HD2 H 0.800 0.020 . 235 23 23 LEU C C 172.924 0.300 . 236 23 23 LEU CA C 51.855 0.300 . 237 23 23 LEU CB C 42.131 0.300 . 238 23 23 LEU CG C 25.347 0.300 . 239 23 23 LEU CD1 C 23.763 0.300 . 240 23 23 LEU CD2 C 23.155 0.300 . 241 23 23 LEU N N 120.077 0.300 . 242 24 24 SER H H 8.973 0.020 . 243 24 24 SER HA H 4.615 0.020 . 244 24 24 SER HB2 H 3.621 0.020 . 245 24 24 SER HB3 H 3.621 0.020 . 246 24 24 SER C C 170.461 0.300 . 247 24 24 SER CA C 54.457 0.300 . 248 24 24 SER CB C 62.314 0.300 . 249 24 24 SER N N 119.517 0.300 . 250 25 25 LYS H H 8.822 0.020 . 251 25 25 LYS HA H 4.484 0.020 . 252 25 25 LYS HG2 H 1.210 0.020 . 253 25 25 LYS HG3 H 1.423 0.020 . 254 25 25 LYS CA C 54.207 0.300 . 255 25 25 LYS CB C 29.926 0.300 . 256 25 25 LYS CG C 22.772 0.300 . 257 25 25 LYS N N 123.866 0.300 . 258 26 26 LYS H H 8.489 0.020 . 259 26 26 LYS HA H 4.256 0.020 . 260 26 26 LYS HB2 H 1.401 0.020 . 261 26 26 LYS HB3 H 1.674 0.020 . 262 26 26 LYS HG2 H 1.232 0.020 . 263 26 26 LYS HG3 H 1.232 0.020 . 264 26 26 LYS HD2 H 1.402 0.020 . 265 26 26 LYS HD3 H 1.402 0.020 . 266 26 26 LYS HE2 H 2.737 0.020 . 267 26 26 LYS HE3 H 2.737 0.020 . 268 26 26 LYS CA C 52.988 0.300 . 269 26 26 LYS CB C 30.125 0.300 . 270 26 26 LYS CG C 21.824 0.300 . 271 26 26 LYS CD C 25.616 0.300 . 272 26 26 LYS CE C 39.024 0.300 . 273 26 26 LYS N N 124.272 0.300 . 274 27 27 GLN HA H 4.470 0.020 . 275 27 27 GLN HB2 H 1.816 0.020 . 276 27 27 GLN HB3 H 2.180 0.020 . 277 27 27 GLN HG2 H 2.239 0.020 . 278 27 27 GLN HG3 H 2.335 0.020 . 279 27 27 GLN HE22 H 7.509 0.020 . 280 27 27 GLN CA C 52.087 0.300 . 281 27 27 GLN CB C 29.205 0.300 . 282 27 27 GLN CG C 31.169 0.300 . 283 27 27 GLN NE2 N 112.407 0.300 . 284 28 28 GLU H H 9.007 0.020 . 285 28 28 GLU HA H 3.936 0.020 . 286 28 28 GLU HB2 H 2.240 0.020 . 287 28 28 GLU HB3 H 1.993 0.020 . 288 28 28 GLU HG2 H 2.240 0.020 . 289 28 28 GLU HG3 H 2.240 0.020 . 290 28 28 GLU C C 173.566 0.300 . 291 28 28 GLU CA C 56.203 0.300 . 292 28 28 GLU CB C 26.811 0.300 . 293 28 28 GLU CG C 33.104 0.300 . 294 28 28 GLU N N 123.482 0.300 . 295 29 29 ASP H H 7.884 0.020 . 296 29 29 ASP HA H 4.671 0.020 . 297 29 29 ASP HB2 H 2.594 0.020 . 298 29 29 ASP HB3 H 2.841 0.020 . 299 29 29 ASP C C 173.733 0.300 . 300 29 29 ASP CA C 51.004 0.300 . 301 29 29 ASP CB C 37.018 0.300 . 302 29 29 ASP N N 116.509 0.300 . 303 30 30 GLY H H 8.208 0.020 . 304 30 30 GLY HA2 H 3.249 0.020 . 305 30 30 GLY HA3 H 3.910 0.020 . 306 30 30 GLY C C 169.445 0.300 . 307 30 30 GLY CA C 42.675 0.300 . 308 30 30 GLY N N 107.211 0.300 . 309 31 31 SER H H 8.085 0.020 . 310 31 31 SER HA H 4.118 0.020 . 311 31 31 SER HB2 H 3.995 0.020 . 312 31 31 SER HB3 H 3.854 0.020 . 313 31 31 SER CA C 58.723 0.300 . 314 31 31 SER CB C 60.612 0.300 . 315 31 31 SER N N 110.219 0.300 . 316 32 32 ILE H H 6.850 0.020 . 317 32 32 ILE HA H 5.031 0.020 . 318 32 32 ILE HB H 1.337 0.020 . 319 32 32 ILE HG12 H 0.869 0.020 . 320 32 32 ILE HG13 H 1.491 0.020 . 321 32 32 ILE HG2 H 0.666 0.020 . 322 32 32 ILE HD1 H 0.694 0.020 . 323 32 32 ILE C C 173.345 0.300 . 324 32 32 ILE CA C 58.039 0.300 . 325 32 32 ILE CB C 38.700 0.300 . 326 32 32 ILE CG1 C 24.899 0.300 . 327 32 32 ILE CG2 C 15.066 0.300 . 328 32 32 ILE CD1 C 10.501 0.300 . 329 32 32 ILE N N 117.056 0.300 . 330 33 33 ILE H H 8.968 0.020 . 331 33 33 ILE HA H 5.129 0.020 . 332 33 33 ILE HB H 1.858 0.020 . 333 33 33 ILE HG2 H 0.992 0.020 . 334 33 33 ILE HD1 H 0.767 0.020 . 335 33 33 ILE CA C 56.201 0.300 . 336 33 33 ILE CB C 39.670 0.300 . 337 33 33 ILE CG1 C 22.806 0.300 . 338 33 33 ILE CG2 C 15.009 0.300 . 339 33 33 ILE CD1 C 11.290 0.300 . 340 33 33 ILE N N 119.907 0.300 . 341 34 34 VAL H H 8.755 0.020 . 342 34 34 VAL HA H 4.952 0.020 . 343 34 34 VAL HB H 1.746 0.020 . 344 34 34 VAL HG1 H 0.711 0.020 . 345 34 34 VAL C C 172.436 0.300 . 346 34 34 VAL CA C 58.348 0.300 . 347 34 34 VAL CB C 30.907 0.300 . 348 34 34 VAL CG1 C 18.497 0.300 . 349 34 34 VAL CG2 C 19.079 0.300 . 350 34 34 VAL N N 121.294 0.300 . 351 35 35 VAL H H 9.234 0.020 . 352 35 35 VAL HA H 5.188 0.020 . 353 35 35 VAL HB H 1.723 0.020 . 354 35 35 VAL HG1 H 0.709 0.020 . 355 35 35 VAL HG2 H 0.807 0.020 . 356 35 35 VAL C C 171.267 0.300 . 357 35 35 VAL CA C 55.676 0.300 . 358 35 35 VAL CB C 33.150 0.300 . 359 35 35 VAL CG1 C 17.445 0.300 . 360 35 35 VAL CG2 C 18.684 0.300 . 361 35 35 VAL N N 125.677 0.300 . 362 36 36 LYS H H 8.107 0.020 . 363 36 36 LYS HA H 4.789 0.020 . 364 36 36 LYS HB2 H 1.534 0.020 . 365 36 36 LYS HB3 H 1.534 0.020 . 366 36 36 LYS HG2 H 1.392 0.020 . 367 36 36 LYS HG3 H 1.392 0.020 . 368 36 36 LYS C C 171.831 0.300 . 369 36 36 LYS CA C 52.223 0.300 . 370 36 36 LYS CB C 31.371 0.300 . 371 36 36 LYS CG C 22.482 0.300 . 372 36 36 LYS N N 127.720 0.300 . 373 37 37 VAL H H 7.263 0.020 . 374 37 37 VAL HA H 3.370 0.020 . 375 37 37 VAL HB H 1.808 0.020 . 376 37 37 VAL HG1 H 0.497 0.020 . 377 37 37 VAL HG2 H 0.420 0.020 . 378 37 37 VAL C C 171.574 0.300 . 379 37 37 VAL CA C 58.723 0.300 . 380 37 37 VAL CB C 29.050 0.300 . 381 37 37 VAL CG1 C 18.223 0.300 . 382 37 37 VAL CG2 C 20.134 0.300 . 383 37 37 VAL N N 120.474 0.300 . 384 39 39 GLN H H 8.821 0.020 . 385 39 39 GLN HA H 3.675 0.020 . 386 39 39 GLN HG2 H 1.940 0.020 . 387 39 39 GLN HG3 H 1.940 0.020 . 388 39 39 GLN CA C 56.388 0.300 . 389 39 39 GLN CB C 28.702 0.300 . 390 39 39 GLN CG C 31.823 0.300 . 391 39 39 GLN N N 116.519 0.300 . 392 40 40 HIS H H 8.322 0.020 . 393 40 40 HIS HA H 4.319 0.020 . 394 40 40 HIS HB2 H 2.341 0.020 . 395 40 40 HIS HB3 H 2.341 0.020 . 396 40 40 HIS CA C 50.937 0.300 . 397 40 40 HIS CB C 27.095 0.300 . 398 40 40 HIS N N 121.255 0.300 . 399 41 41 GLU H H 8.632 0.020 . 400 41 41 GLU HA H 3.606 0.020 . 401 41 41 GLU HB2 H 1.731 0.020 . 402 41 41 GLU HB3 H 1.978 0.020 . 403 41 41 GLU HG2 H 2.090 0.020 . 404 41 41 GLU HG3 H 2.090 0.020 . 405 41 41 GLU C C 171.735 0.300 . 406 41 41 GLU CA C 57.910 0.300 . 407 41 41 GLU CB C 25.569 0.300 . 408 41 41 GLU CG C 34.163 0.300 . 409 41 41 GLU N N 117.876 0.300 . 410 42 42 TYR H H 6.619 0.020 . 411 42 42 TYR HA H 4.337 0.020 . 412 42 42 TYR HB2 H 3.183 0.020 . 413 42 42 TYR HB3 H 2.898 0.020 . 414 42 42 TYR HD1 H 6.814 0.020 . 415 42 42 TYR HD2 H 6.814 0.020 . 416 42 42 TYR C C 170.995 0.300 . 417 42 42 TYR CA C 53.125 0.300 . 418 42 42 TYR CB C 34.883 0.300 . 419 42 42 TYR CD1 C 130.870 0.300 . 420 42 42 TYR N N 113.085 0.300 . 421 43 43 MET H H 8.375 0.020 . 422 43 43 MET HA H 5.154 0.020 . 423 43 43 MET HB2 H 1.816 0.020 . 424 43 43 MET HB3 H 1.475 0.020 . 425 43 43 MET HG2 H 2.024 0.020 . 426 43 43 MET HG3 H 2.319 0.020 . 427 43 43 MET HE H 1.619 0.020 . 428 43 43 MET C C 170.644 0.300 . 429 43 43 MET CA C 51.117 0.300 . 430 43 43 MET CB C 31.371 0.300 . 431 43 43 MET CG C 28.800 0.300 . 432 43 43 MET CE C 13.568 0.300 . 433 43 43 MET N N 127.994 0.300 . 434 44 44 THR H H 8.750 0.020 . 435 44 44 THR HA H 4.973 0.020 . 436 44 44 THR HB H 3.607 0.020 . 437 44 44 THR HG2 H 0.865 0.020 . 438 44 44 THR C C 171.036 0.300 . 439 44 44 THR CA C 56.955 0.300 . 440 44 44 THR CB C 67.961 0.300 . 441 44 44 THR CG2 C 19.513 0.300 . 442 44 44 THR N N 116.509 0.300 . 443 45 45 LEU H H 9.085 0.020 . 444 45 45 LEU HA H 5.113 0.020 . 445 45 45 LEU HB2 H 1.575 0.020 . 446 45 45 LEU HB3 H 1.267 0.020 . 447 45 45 LEU HG H 1.583 0.020 . 448 45 45 LEU HD1 H 0.776 0.020 . 449 45 45 LEU HD2 H 0.633 0.020 . 450 45 45 LEU C C 172.447 0.300 . 451 45 45 LEU CA C 50.394 0.300 . 452 45 45 LEU CB C 42.293 0.300 . 453 45 45 LEU CG C 25.330 0.300 . 454 45 45 LEU CD1 C 23.888 0.300 . 455 45 45 LEU CD2 C 23.411 0.300 . 456 45 45 LEU N N 122.525 0.300 . 457 46 46 GLN H H 8.383 0.020 . 458 46 46 GLN HA H 5.340 0.020 . 459 46 46 GLN HB2 H 1.779 0.020 . 460 46 46 GLN HB3 H 1.779 0.020 . 461 46 46 GLN HG2 H 1.782 0.020 . 462 46 46 GLN HG3 H 2.144 0.020 . 463 46 46 GLN C C 172.090 0.300 . 464 46 46 GLN CA C 51.721 0.300 . 465 46 46 GLN CB C 28.276 0.300 . 466 46 46 GLN CG C 31.893 0.300 . 467 46 46 GLN N N 121.267 0.300 . 468 47 47 ILE H H 8.671 0.020 . 469 47 47 ILE HA H 4.601 0.020 . 470 47 47 ILE HB H 1.000 0.020 . 471 47 47 ILE HG12 H 0.343 0.020 . 472 47 47 ILE HG13 H 1.157 0.020 . 473 47 47 ILE HG2 H -0.392 0.020 . 474 47 47 ILE HD1 H 0.343 0.020 . 475 47 47 ILE C C 170.035 0.300 . 476 47 47 ILE CA C 56.049 0.300 . 477 47 47 ILE CB C 38.700 0.300 . 478 47 47 ILE CG1 C 24.752 0.300 . 479 47 47 ILE CG2 C 14.560 0.300 . 480 47 47 ILE CD1 C 10.848 0.300 . 481 47 47 ILE N N 127.173 0.300 . 482 48 48 SER H H 8.817 0.020 . 483 48 48 SER HA H 5.230 0.020 . 484 48 48 SER HB2 H 3.583 0.020 . 485 48 48 SER HB3 H 3.406 0.020 . 486 48 48 SER C C 170.343 0.300 . 487 48 48 SER CA C 51.429 0.300 . 488 48 48 SER CB C 62.825 0.300 . 489 48 48 SER N N 119.790 0.300 . 490 49 49 PHE H H 8.878 0.020 . 491 49 49 PHE HA H 4.547 0.020 . 492 49 49 PHE HB2 H 2.735 0.020 . 493 49 49 PHE HB3 H 2.735 0.020 . 494 49 49 PHE HD2 H 6.692 0.020 . 495 49 49 PHE C C 171.215 0.300 . 496 49 49 PHE CA C 52.527 0.300 . 497 49 49 PHE CB C 37.559 0.300 . 498 49 49 PHE CD2 C 130.085 0.300 . 499 49 49 PHE N N 124.712 0.300 . 500 50 50 PRO HA H 4.454 0.020 . 501 50 50 PRO HB2 H 1.877 0.020 . 502 50 50 PRO HB3 H 2.138 0.020 . 503 50 50 PRO HG2 H 1.754 0.020 . 504 50 50 PRO HG3 H 1.649 0.020 . 505 50 50 PRO CA C 59.202 0.300 . 506 50 50 PRO CB C 29.555 0.300 . 507 50 50 PRO CG C 24.646 0.300 . 508 51 51 THR H H 8.409 0.020 . 509 51 51 THR HA H 3.838 0.020 . 510 51 51 THR HB H 3.762 0.020 . 511 51 51 THR HG2 H 0.937 0.020 . 512 51 51 THR CA C 62.662 0.300 . 513 51 51 THR CB C 66.227 0.300 . 514 51 51 THR CG2 C 19.222 0.300 . 515 51 51 THR N N 114.458 0.300 . 516 52 52 HIS H H 7.923 0.020 . 517 52 52 HIS HA H 5.434 0.020 . 518 52 52 HIS HB2 H 2.989 0.020 . 519 52 52 HIS HB3 H 3.378 0.020 . 520 52 52 HIS HD2 H 7.192 0.020 . 521 52 52 HIS C C 171.852 0.300 . 522 52 52 HIS CA C 51.207 0.300 . 523 52 52 HIS CB C 23.944 0.300 . 524 52 52 HIS CD2 C 117.343 0.300 . 525 52 52 HIS N N 113.227 0.300 . 526 53 53 TYR H H 6.900 0.020 . 527 53 53 TYR HA H 5.551 0.020 . 528 53 53 TYR HB2 H 2.981 0.020 . 529 53 53 TYR HB3 H 2.700 0.020 . 530 53 53 TYR HE1 H 7.069 0.020 . 531 53 53 TYR HE2 H 7.069 0.020 . 532 53 53 TYR C C 171.651 0.300 . 533 53 53 TYR CA C 51.613 0.300 . 534 53 53 TYR CB C 35.780 0.300 . 535 53 53 TYR CE1 C 115.726 0.300 . 536 53 53 TYR N N 122.935 0.300 . 537 54 54 PRO HA H 4.451 0.020 . 538 54 54 PRO HB2 H 1.671 0.020 . 539 54 54 PRO HB3 H 1.671 0.020 . 540 54 54 PRO HD2 H 2.755 0.020 . 541 54 54 PRO HD3 H 3.495 0.020 . 542 54 54 PRO CA C 60.927 0.300 . 543 54 54 PRO CB C 31.572 0.300 . 544 54 54 PRO CG C 20.900 0.300 . 545 54 54 PRO CD C 46.104 0.300 . 546 55 55 SER H H 8.227 0.020 . 547 55 55 SER HA H 4.294 0.020 . 548 55 55 SER HB2 H 3.694 0.020 . 549 55 55 SER HB3 H 3.694 0.020 . 550 55 55 SER CA C 60.790 0.300 . 551 55 55 SER CB C 58.291 0.300 . 552 55 55 SER N N 121.161 0.300 . 553 56 56 GLU H H 8.725 0.020 . 554 56 56 GLU HA H 4.758 0.020 . 555 56 56 GLU HB2 H 1.881 0.020 . 556 56 56 GLU HB3 H 2.159 0.020 . 557 56 56 GLU C C 172.859 0.300 . 558 56 56 GLU CA C 54.671 0.300 . 559 56 56 GLU CB C 32.454 0.300 . 560 56 56 GLU N N 115.117 0.300 . 561 57 57 GLU H H 7.658 0.020 . 562 57 57 GLU HA H 4.490 0.020 . 563 57 57 GLU HB2 H 1.823 0.020 . 564 57 57 GLU HG2 H 1.983 0.020 . 565 57 57 GLU HG3 H 2.070 0.020 . 566 57 57 GLU C C 169.287 0.300 . 567 57 57 GLU CA C 52.064 0.300 . 568 57 57 GLU CB C 31.933 0.300 . 569 57 57 GLU CG C 33.312 0.300 . 570 57 57 GLU N N 118.752 0.300 . 571 58 58 ALA H H 7.514 0.020 . 572 58 58 ALA HA H 2.959 0.020 . 573 58 58 ALA HB H 0.724 0.020 . 574 58 58 ALA C C 171.652 0.300 . 575 58 58 ALA CA C 46.839 0.300 . 576 58 58 ALA CB C 14.453 0.300 . 577 58 58 ALA N N 121.638 0.300 . 578 60 60 ASN H H 8.185 0.020 . 579 60 60 ASN HA H 5.191 0.020 . 580 60 60 ASN HB2 H 2.205 0.020 . 581 60 60 ASN HB3 H 2.346 0.020 . 582 60 60 ASN CA C 48.662 0.300 . 583 60 60 ASN CB C 38.410 0.300 . 584 60 60 ASN N N 115.141 0.300 . 585 61 61 VAL H H 9.068 0.020 . 586 61 61 VAL HA H 3.714 0.020 . 587 61 61 VAL HB H 1.981 0.020 . 588 61 61 VAL HG1 H 0.346 0.020 . 589 61 61 VAL HG2 H 0.767 0.020 . 590 61 61 VAL C C 172.267 0.300 . 591 61 61 VAL CA C 59.942 0.300 . 592 61 61 VAL CB C 28.354 0.300 . 593 61 61 VAL CG1 C 17.993 0.300 . 594 61 61 VAL CG2 C 18.995 0.300 . 595 61 61 VAL N N 124.439 0.300 . 596 62 62 ILE H H 8.543 0.020 . 597 62 62 ILE HA H 4.036 0.020 . 598 62 62 ILE HB H 1.581 0.020 . 599 62 62 ILE HG12 H 1.101 0.020 . 600 62 62 ILE HG13 H 0.908 0.020 . 601 62 62 ILE HG2 H 0.658 0.020 . 602 62 62 ILE HD1 H 0.550 0.020 . 603 62 62 ILE C C 173.139 0.300 . 604 62 62 ILE CA C 58.723 0.300 . 605 62 62 ILE CB C 35.393 0.300 . 606 62 62 ILE CG1 C 23.810 0.300 . 607 62 62 ILE CG2 C 14.514 0.300 . 608 62 62 ILE CD1 C 8.922 0.300 . 609 62 62 ILE N N 125.533 0.300 . 610 63 63 GLU H H 7.213 0.020 . 611 63 63 GLU HA H 4.250 0.020 . 612 63 63 GLU HB2 H 1.680 0.020 . 613 63 63 GLU HB3 H 1.864 0.020 . 614 63 63 GLU C C 170.372 0.300 . 615 63 63 GLU CA C 53.543 0.300 . 616 63 63 GLU CB C 30.907 0.300 . 617 63 63 GLU CG C 33.390 0.300 . 618 63 63 GLU N N 116.372 0.300 . 619 64 64 VAL H H 8.498 0.020 . 620 64 64 VAL HA H 4.599 0.020 . 621 64 64 VAL HB H 1.782 0.020 . 622 64 64 VAL HG1 H 0.807 0.020 . 623 64 64 VAL HG2 H 0.559 0.020 . 624 64 64 VAL C C 171.061 0.300 . 625 64 64 VAL CA C 58.297 0.300 . 626 64 64 VAL CB C 31.788 0.300 . 627 64 64 VAL CG1 C 18.957 0.300 . 628 64 64 VAL CG2 C 18.895 0.300 . 629 64 64 VAL N N 124.986 0.300 . 630 65 65 GLY H H 9.074 0.020 . 631 65 65 GLY HA2 H 3.504 0.020 . 632 65 65 GLY HA3 H 4.624 0.020 . 633 65 65 GLY C C 169.214 0.300 . 634 65 65 GLY CA C 41.253 0.300 . 635 65 65 GLY N N 114.321 0.300 . 636 66 66 VAL H H 8.358 0.020 . 637 66 66 VAL HA H 4.991 0.020 . 638 66 66 VAL HB H 1.793 0.020 . 639 66 66 VAL HG1 H 0.716 0.020 . 640 66 66 VAL HG2 H 0.782 0.020 . 641 66 66 VAL C C 172.447 0.300 . 642 66 66 VAL CA C 57.309 0.300 . 643 66 66 VAL CB C 32.500 0.300 . 644 66 66 VAL CG1 C 18.643 0.300 . 645 66 66 VAL CG2 C 19.401 0.300 . 646 66 66 VAL N N 117.964 0.300 . 647 67 67 CYS H H 8.593 0.020 . 648 67 67 CYS HA H 4.415 0.020 . 649 67 67 CYS HB2 H 2.836 0.020 . 650 67 67 CYS HB3 H 3.080 0.020 . 651 67 67 CYS C C 172.778 0.300 . 652 67 67 CYS CA C 56.285 0.300 . 653 67 67 CYS CB C 25.027 0.300 . 654 67 67 CYS N N 126.763 0.300 . 655 68 68 THR H H 8.359 0.020 . 656 68 68 THR HA H 4.104 0.020 . 657 68 68 THR HB H 4.190 0.020 . 658 68 68 THR HG2 H 1.212 0.020 . 659 68 68 THR C C 172.057 0.300 . 660 68 68 THR CA C 60.878 0.300 . 661 68 68 THR CB C 66.390 0.300 . 662 68 68 THR CG2 C 18.814 0.300 . 663 68 68 THR N N 118.431 0.300 . 664 69 69 SER H H 8.326 0.020 . 665 69 69 SER HA H 4.306 0.020 . 666 69 69 SER HB2 H 3.782 0.020 . 667 69 69 SER HB3 H 3.943 0.020 . 668 69 69 SER CA C 55.914 0.300 . 669 69 69 SER CB C 60.460 0.300 . 670 69 69 SER N N 116.639 0.300 . 671 70 70 LEU H H 7.526 0.020 . 672 70 70 LEU HA H 4.315 0.020 . 673 70 70 LEU HG H 1.370 0.020 . 674 70 70 LEU HD1 H 0.623 0.020 . 675 70 70 LEU CA C 53.153 0.300 . 676 70 70 LEU CB C 38.314 0.300 . 677 70 70 LEU CD1 C 22.281 0.300 . 678 70 70 LEU N N 123.447 0.300 . 679 71 71 ALA HA H 4.014 0.020 . 680 71 71 ALA HB H 1.294 0.020 . 681 71 71 ALA CA C 51.473 0.300 . 682 71 71 ALA CB C 15.868 0.300 . 683 72 72 LYS H H 7.688 0.020 . 684 72 72 LYS HA H 4.323 0.020 . 685 72 72 LYS HB2 H 1.676 0.020 . 686 72 72 LYS HB3 H 1.907 0.020 . 687 72 72 LYS HG2 H 1.281 0.020 . 688 72 72 LYS HG3 H 1.281 0.020 . 689 72 72 LYS HD2 H 1.604 0.020 . 690 72 72 LYS HD3 H 1.604 0.020 . 691 72 72 LYS C C 173.566 0.300 . 692 72 72 LYS CA C 52.918 0.300 . 693 72 72 LYS CB C 28.734 0.300 . 694 72 72 LYS CG C 22.174 0.300 . 695 72 72 LYS CD C 26.049 0.300 . 696 72 72 LYS CE C 39.199 0.300 . 697 72 72 LYS N N 115.688 0.300 . 698 73 73 ARG H H 7.492 0.020 . 699 73 73 ARG HA H 3.972 0.020 . 700 73 73 ARG HB2 H 1.840 0.020 . 701 73 73 ARG HB3 H 1.958 0.020 . 702 73 73 ARG HD2 H 3.170 0.020 . 703 73 73 ARG CA C 55.905 0.300 . 704 73 73 ARG CB C 27.426 0.300 . 705 73 73 ARG N N 118.696 0.300 . 706 74 74 ASP H H 8.465 0.020 . 707 74 74 ASP HA H 4.388 0.020 . 708 74 74 ASP HB2 H 2.524 0.020 . 709 74 74 ASP HB3 H 2.641 0.020 . 710 74 74 ASP C C 173.527 0.300 . 711 74 74 ASP CA C 52.629 0.300 . 712 74 74 ASP CB C 37.173 0.300 . 713 74 74 ASP N N 117.466 0.300 . 714 75 75 LEU H H 7.524 0.020 . 715 75 75 LEU HA H 4.074 0.020 . 716 75 75 LEU HB2 H 0.903 0.020 . 717 75 75 LEU HB3 H 1.165 0.020 . 718 75 75 LEU HG H 1.401 0.020 . 719 75 75 LEU HD1 H 0.529 0.020 . 720 75 75 LEU CA C 52.665 0.300 . 721 75 75 LEU CB C 39.577 0.300 . 722 75 75 LEU CG C 23.982 0.300 . 723 75 75 LEU CD1 C 20.281 0.300 . 724 75 75 LEU N N 118.415 0.300 . 725 76 76 TYR H H 7.511 0.020 . 726 76 76 TYR HA H 4.279 0.020 . 727 76 76 TYR HB2 H 2.919 0.020 . 728 76 76 TYR HB3 H 2.482 0.020 . 729 76 76 TYR HD1 H 6.920 0.020 . 730 76 76 TYR HD2 H 6.920 0.020 . 731 76 76 TYR HE1 H 6.618 0.020 . 732 76 76 TYR HE2 H 6.618 0.020 . 733 76 76 TYR CA C 54.438 0.300 . 734 76 76 TYR CB C 36.102 0.300 . 735 76 76 TYR CD1 C 130.329 0.300 . 736 76 76 TYR CE1 C 115.045 0.300 . 737 76 76 TYR N N 117.281 0.300 . 738 77 77 ASP H H 9.152 0.020 . 739 77 77 ASP HA H 4.810 0.020 . 740 77 77 ASP HB2 H 2.729 0.020 . 741 77 77 ASP HB3 H 2.949 0.020 . 742 77 77 ASP C C 174.345 0.300 . 743 77 77 ASP CA C 49.480 0.300 . 744 77 77 ASP CB C 37.637 0.300 . 745 77 77 ASP N N 125.533 0.300 . 746 78 78 THR H H 8.479 0.020 . 747 78 78 THR HA H 3.504 0.020 . 748 78 78 THR HB H 4.431 0.020 . 749 78 78 THR HG2 H 1.175 0.020 . 750 78 78 THR CA C 63.227 0.300 . 751 78 78 THR CB C 64.778 0.300 . 752 78 78 THR CG2 C 20.390 0.300 . 753 78 78 THR N N 116.041 0.300 . 754 79 79 LYS H H 7.939 0.020 . 755 79 79 LYS HA H 4.104 0.020 . 756 79 79 LYS HB2 H 1.896 0.020 . 757 79 79 LYS HB3 H 1.678 0.020 . 758 79 79 LYS HG2 H 1.469 0.020 . 759 79 79 LYS HG3 H 1.373 0.020 . 760 79 79 LYS HD2 H 1.648 0.020 . 761 79 79 LYS HD3 H 1.648 0.020 . 762 79 79 LYS HE2 H 2.939 0.020 . 763 79 79 LYS HE3 H 2.939 0.020 . 764 79 79 LYS C C 176.167 0.300 . 765 79 79 LYS CA C 56.285 0.300 . 766 79 79 LYS CB C 28.741 0.300 . 767 79 79 LYS CG C 22.054 0.300 . 768 79 79 LYS CD C 26.095 0.300 . 769 79 79 LYS CE C 39.199 0.300 . 770 79 79 LYS N N 124.165 0.300 . 771 80 80 TYR H H 7.391 0.020 . 772 80 80 TYR HA H 4.254 0.020 . 773 80 80 TYR HB2 H 2.590 0.020 . 774 80 80 TYR HB3 H 3.088 0.020 . 775 80 80 TYR HD1 H 6.882 0.020 . 776 80 80 TYR HD2 H 6.882 0.020 . 777 80 80 TYR HE1 H 6.632 0.020 . 778 80 80 TYR HE2 H 6.632 0.020 . 779 80 80 TYR C C 175.046 0.300 . 780 80 80 TYR CA C 57.504 0.300 . 781 80 80 TYR CB C 35.703 0.300 . 782 80 80 TYR CE1 C 115.266 0.300 . 783 80 80 TYR N N 121.333 0.300 . 784 81 81 LEU H H 8.643 0.020 . 785 81 81 LEU HA H 3.014 0.020 . 786 81 81 LEU HB2 H 1.180 0.020 . 787 81 81 LEU HB3 H 0.175 0.020 . 788 81 81 LEU HG H 1.901 0.020 . 789 81 81 LEU HD2 H 0.575 0.020 . 790 81 81 LEU C C 174.189 0.300 . 791 81 81 LEU CA C 54.126 0.300 . 792 81 81 LEU CB C 37.275 0.300 . 793 81 81 LEU CG C 23.346 0.300 . 794 81 81 LEU CD1 C 22.637 0.300 . 795 81 81 LEU CD2 C 19.328 0.300 . 796 81 81 LEU N N 116.098 0.300 . 797 82 82 GLN H H 7.012 0.020 . 798 82 82 GLN HA H 3.272 0.020 . 799 82 82 GLN HB2 H 1.840 0.020 . 800 82 82 GLN HB3 H 1.999 0.020 . 801 82 82 GLN HG2 H 2.011 0.020 . 802 82 82 GLN HG3 H 1.928 0.020 . 803 82 82 GLN C C 173.293 0.300 . 804 82 82 GLN CA C 57.740 0.300 . 805 82 82 GLN CB C 24.263 0.300 . 806 82 82 GLN CG C 29.869 0.300 . 807 82 82 GLN N N 117.329 0.300 . 808 83 83 HIS H H 6.649 0.020 . 809 83 83 HIS HA H 4.089 0.020 . 810 83 83 HIS HB2 H 3.058 0.020 . 811 83 83 HIS HB3 H 3.138 0.020 . 812 83 83 HIS HD2 H 6.996 0.020 . 813 83 83 HIS C C 174.656 0.300 . 814 83 83 HIS CA C 55.879 0.300 . 815 83 83 HIS CB C 26.033 0.300 . 816 83 83 HIS CD2 C 117.172 0.300 . 817 83 83 HIS N N 116.645 0.300 . 818 84 84 LEU H H 8.189 0.020 . 819 84 84 LEU HA H 3.794 0.020 . 820 84 84 LEU HB2 H 1.011 0.020 . 821 84 84 LEU HB3 H 1.011 0.020 . 822 84 84 LEU HG H 0.711 0.020 . 823 84 84 LEU HD2 H 0.565 0.020 . 824 84 84 LEU C C 176.090 0.300 . 825 84 84 LEU CA C 54.410 0.300 . 826 84 84 LEU CB C 38.024 0.300 . 827 84 84 LEU CG C 23.189 0.300 . 828 84 84 LEU CD1 C 20.058 0.300 . 829 84 84 LEU CD2 C 18.507 0.300 . 830 84 84 LEU N N 121.270 0.300 . 831 85 85 PHE H H 9.062 0.020 . 832 85 85 PHE HA H 4.308 0.020 . 833 85 85 PHE HB2 H 3.051 0.020 . 834 85 85 PHE HB3 H 3.232 0.020 . 835 85 85 PHE HD1 H 6.461 0.020 . 836 85 85 PHE HD2 H 6.461 0.020 . 837 85 85 PHE C C 175.730 0.300 . 838 85 85 PHE CA C 54.166 0.300 . 839 85 85 PHE CB C 33.632 0.300 . 840 85 85 PHE CD1 C 125.681 0.300 . 841 85 85 PHE N N 115.415 0.300 . 842 86 86 GLN H H 7.867 0.020 . 843 86 86 GLN HA H 3.680 0.020 . 844 86 86 GLN HB2 H 2.103 0.020 . 845 86 86 GLN HB3 H 2.218 0.020 . 846 86 86 GLN HG2 H 2.347 0.020 . 847 86 86 GLN HG3 H 2.130 0.020 . 848 86 86 GLN C C 174.136 0.300 . 849 86 86 GLN CA C 55.867 0.300 . 850 86 86 GLN CB C 25.492 0.300 . 851 86 86 GLN CG C 31.015 0.300 . 852 86 86 GLN N N 121.739 0.300 . 853 87 87 GLU H H 7.668 0.020 . 854 87 87 GLU HA H 3.972 0.020 . 855 87 87 GLU HB2 H 1.733 0.020 . 856 87 87 GLU HB3 H 1.733 0.020 . 857 87 87 GLU HG2 H 2.151 0.020 . 858 87 87 GLU HG3 H 2.151 0.020 . 859 87 87 GLU C C 177.915 0.300 . 860 87 87 GLU CA C 57.101 0.300 . 861 87 87 GLU CB C 26.188 0.300 . 862 87 87 GLU CG C 33.610 0.300 . 863 87 87 GLU N N 118.864 0.300 . 864 88 88 VAL H H 8.395 0.020 . 865 88 88 VAL HA H 3.230 0.020 . 866 88 88 VAL HB H 2.218 0.020 . 867 88 88 VAL HG2 H 0.597 0.020 . 868 88 88 VAL C C 176.193 0.300 . 869 88 88 VAL CA C 63.629 0.300 . 870 88 88 VAL CB C 28.207 0.300 . 871 88 88 VAL CG2 C 18.924 0.300 . 872 88 88 VAL N N 121.264 0.300 . 873 89 89 MET H H 8.509 0.020 . 874 89 89 MET HA H 3.948 0.020 . 875 89 89 MET HB2 H 2.217 0.020 . 876 89 89 MET HB3 H 1.719 0.020 . 877 89 89 MET HG2 H 2.170 0.020 . 878 89 89 MET HG3 H 2.170 0.020 . 879 89 89 MET HE H 0.161 0.020 . 880 89 89 MET C C 174.166 0.300 . 881 89 89 MET CA C 55.371 0.300 . 882 89 89 MET CB C 26.651 0.300 . 883 89 89 MET CG C 28.955 0.300 . 884 89 89 MET CE C 12.648 0.300 . 885 89 89 MET N N 122.935 0.300 . 886 90 90 ASP H H 8.940 0.020 . 887 90 90 ASP HA H 4.101 0.020 . 888 90 90 ASP HB2 H 2.605 0.020 . 889 90 90 ASP HB3 H 2.605 0.020 . 890 90 90 ASP C C 176.058 0.300 . 891 90 90 ASP CA C 54.355 0.300 . 892 90 90 ASP CB C 37.482 0.300 . 893 90 90 ASP N N 118.013 0.300 . 894 91 91 SER H H 7.559 0.020 . 895 91 91 SER HA H 4.148 0.020 . 896 91 91 SER HB2 H 3.114 0.020 . 897 91 91 SER HB3 H 3.748 0.020 . 898 91 91 SER CA C 57.524 0.300 . 899 91 91 SER CB C 60.313 0.300 . 900 91 91 SER N N 113.091 0.300 . 901 92 92 VAL H H 7.425 0.020 . 902 92 92 VAL HA H 4.396 0.020 . 903 92 92 VAL HB H 2.327 0.020 . 904 92 92 VAL HG1 H 0.755 0.020 . 905 92 92 VAL HG2 H 1.055 0.020 . 906 92 92 VAL CA C 58.723 0.300 . 907 92 92 VAL CB C 29.592 0.300 . 908 92 92 VAL CG1 C 18.486 0.300 . 909 92 92 VAL CG2 C 16.562 0.300 . 910 92 92 VAL N N 115.278 0.300 . 911 93 93 PHE H H 7.392 0.020 . 912 93 93 PHE HA H 4.718 0.020 . 913 93 93 PHE HB2 H 2.788 0.020 . 914 93 93 PHE HB3 H 3.314 0.020 . 915 93 93 PHE C C 171.677 0.300 . 916 93 93 PHE CA C 55.066 0.300 . 917 93 93 PHE CB C 36.863 0.300 . 918 93 93 PHE N N 122.935 0.300 . 919 94 94 HIS H H 9.493 0.020 . 920 94 94 HIS HA H 4.184 0.020 . 921 94 94 HIS HB2 H 2.770 0.020 . 922 94 94 HIS HB3 H 2.770 0.020 . 923 94 94 HIS HD2 H 7.089 0.020 . 924 94 94 HIS C C 169.060 0.300 . 925 94 94 HIS CA C 50.293 0.300 . 926 94 94 HIS CB C 27.039 0.300 . 927 94 94 HIS CD2 C 117.343 0.300 . 928 94 94 HIS N N 129.908 0.300 . 929 95 95 ARG H H 7.766 0.020 . 930 95 95 ARG HA H 3.418 0.020 . 931 95 95 ARG HB2 H 1.687 0.020 . 932 95 95 ARG HB3 H 1.581 0.020 . 933 95 95 ARG HD2 H 3.243 0.020 . 934 95 95 ARG HD3 H 3.243 0.020 . 935 95 95 ARG C C 174.501 0.300 . 936 95 95 ARG CA C 55.879 0.300 . 937 95 95 ARG CB C 27.116 0.300 . 938 95 95 ARG CG C 25.035 0.300 . 939 95 95 ARG CD C 41.124 0.300 . 940 95 95 ARG N N 120.200 0.300 . 941 96 96 GLY H H 8.643 0.020 . 942 96 96 GLY HA2 H 4.298 0.020 . 943 96 96 GLY HA3 H 3.389 0.020 . 944 96 96 GLY CA C 41.964 0.300 . 945 96 96 GLY N N 112.544 0.300 . 946 97 97 SER H H 8.118 0.020 . 947 97 97 SER HA H 4.905 0.020 . 948 97 97 SER HB2 H 3.771 0.020 . 949 97 97 SER HB3 H 3.642 0.020 . 950 97 97 SER C C 170.602 0.300 . 951 97 97 SER CA C 54.559 0.300 . 952 97 97 SER CB C 62.546 0.300 . 953 97 97 SER N N 116.919 0.300 . 954 98 98 VAL H H 7.884 0.020 . 955 98 98 VAL HA H 4.249 0.020 . 956 98 98 VAL HB H 3.164 0.020 . 957 98 98 VAL HG1 H 0.643 0.020 . 958 98 98 VAL HG2 H 0.816 0.020 . 959 98 98 VAL C C 174.812 0.300 . 960 98 98 VAL CA C 59.739 0.300 . 961 98 98 VAL CB C 26.729 0.300 . 962 98 98 VAL CG1 C 19.199 0.300 . 963 98 98 VAL CG2 C 14.891 0.300 . 964 98 98 VAL N N 117.876 0.300 . 965 99 99 CYS H H 9.247 0.020 . 966 99 99 CYS HA H 5.632 0.020 . 967 99 99 CYS HB2 H 3.302 0.020 . 968 99 99 CYS HB3 H 3.446 0.020 . 969 99 99 CYS C C 172.421 0.300 . 970 99 99 CYS CA C 55.473 0.300 . 971 99 99 CYS CB C 30.056 0.300 . 972 99 99 CYS N N 116.098 0.300 . 973 100 100 LEU H H 10.595 0.020 . 974 100 100 LEU HA H 3.983 0.020 . 975 100 100 LEU HB2 H 1.613 0.020 . 976 100 100 LEU HB3 H 1.483 0.020 . 977 100 100 LEU HD1 H 0.697 0.020 . 978 100 100 LEU HD2 H 0.749 0.020 . 979 100 100 LEU C C 176.552 0.300 . 980 100 100 LEU CA C 56.895 0.300 . 981 100 100 LEU CB C 38.959 0.300 . 982 100 100 LEU CG C 23.790 0.300 . 983 100 100 LEU CD1 C 21.734 0.300 . 984 100 100 LEU CD2 C 21.193 0.300 . 985 100 100 LEU N N 128.874 0.300 . 986 101 101 PHE H H 9.208 0.020 . 987 101 101 PHE HA H 4.133 0.020 . 988 101 101 PHE HB2 H 3.095 0.020 . 989 101 101 PHE HB3 H 3.020 0.020 . 990 101 101 PHE HD1 H 7.361 0.020 . 991 101 101 PHE HD2 H 7.361 0.020 . 992 101 101 PHE HE1 H 7.255 0.020 . 993 101 101 PHE HE2 H 7.255 0.020 . 994 101 101 PHE C C 176.038 0.300 . 995 101 101 PHE CA C 60.450 0.300 . 996 101 101 PHE CB C 35.316 0.300 . 997 101 101 PHE CD1 C 128.574 0.300 . 998 101 101 PHE CE1 C 128.588 0.300 . 999 101 101 PHE N N 117.739 0.300 . 1000 102 102 ASP H H 8.443 0.020 . 1001 102 102 ASP HA H 4.255 0.020 . 1002 102 102 ASP HB2 H 2.634 0.020 . 1003 102 102 ASP HB3 H 2.514 0.020 . 1004 102 102 ASP CA C 54.755 0.300 . 1005 102 102 ASP CB C 36.708 0.300 . 1006 102 102 ASP N N 121.342 0.300 . 1007 103 103 PHE H H 8.630 0.020 . 1008 103 103 PHE HA H 3.830 0.020 . 1009 103 103 PHE HB2 H 3.147 0.020 . 1010 103 103 PHE HB3 H 3.147 0.020 . 1011 103 103 PHE HD1 H 6.677 0.020 . 1012 103 103 PHE HD2 H 6.677 0.020 . 1013 103 103 PHE CA C 58.589 0.300 . 1014 103 103 PHE CB C 36.090 0.300 . 1015 103 103 PHE CD1 C 129.319 0.300 . 1016 103 103 PHE N N 121.022 0.300 . 1017 104 104 LEU H H 8.565 0.020 . 1018 104 104 LEU HA H 3.233 0.020 . 1019 104 104 LEU HB2 H 1.864 0.020 . 1020 104 104 LEU HB3 H 1.864 0.020 . 1021 104 104 LEU HG H 0.698 0.020 . 1022 104 104 LEU HD1 H 0.547 0.020 . 1023 104 104 LEU HD2 H 0.587 0.020 . 1024 104 104 LEU C C 176.721 0.300 . 1025 104 104 LEU CA C 55.066 0.300 . 1026 104 104 LEU CB C 38.294 0.300 . 1027 104 104 LEU CG C 23.418 0.300 . 1028 104 104 LEU CD1 C 18.678 0.300 . 1029 104 104 LEU CD2 C 22.191 0.300 . 1030 104 104 LEU N N 117.739 0.300 . 1031 105 105 THR H H 8.018 0.020 . 1032 105 105 THR HA H 3.783 0.020 . 1033 105 105 THR HB H 4.113 0.020 . 1034 105 105 THR HG2 H 1.088 0.020 . 1035 105 105 THR CA C 63.293 0.300 . 1036 105 105 THR CB C 65.563 0.300 . 1037 105 105 THR CG2 C 18.784 0.300 . 1038 105 105 THR N N 114.321 0.300 . 1039 106 106 GLU H H 7.632 0.020 . 1040 106 106 GLU HA H 3.889 0.020 . 1041 106 106 GLU HB2 H 1.559 0.020 . 1042 106 106 GLU HB3 H 1.893 0.020 . 1043 106 106 GLU HG2 H 1.936 0.020 . 1044 106 106 GLU HG3 H 1.936 0.020 . 1045 106 106 GLU C C 175.705 0.300 . 1046 106 106 GLU CA C 55.371 0.300 . 1047 106 106 GLU CB C 26.159 0.300 . 1048 106 106 GLU CG C 32.067 0.300 . 1049 106 106 GLU N N 124.302 0.300 . 1050 107 107 LEU H H 7.310 0.020 . 1051 107 107 LEU HA H 3.270 0.020 . 1052 107 107 LEU HB2 H 1.098 0.020 . 1053 107 107 LEU HB3 H 0.638 0.020 . 1054 107 107 LEU HG H 0.731 0.020 . 1055 107 107 LEU HD1 H -0.468 0.020 . 1056 107 107 LEU HD2 H -0.371 0.020 . 1057 107 107 LEU CA C 53.919 0.300 . 1058 107 107 LEU CB C 38.101 0.300 . 1059 107 107 LEU CG C 22.490 0.300 . 1060 107 107 LEU CD1 C 19.491 0.300 . 1061 107 107 LEU CD2 C 22.491 0.300 . 1062 107 107 LEU N N 115.381 0.300 . 1063 108 108 ASP H H 6.922 0.020 . 1064 108 108 ASP HA H 4.011 0.020 . 1065 108 108 ASP HB2 H 3.009 0.020 . 1066 108 108 ASP HB3 H 2.542 0.020 . 1067 108 108 ASP C C 175.298 0.300 . 1068 108 108 ASP CA C 55.066 0.300 . 1069 108 108 ASP CB C 38.720 0.300 . 1070 108 108 ASP N N 116.919 0.300 . 1071 109 109 GLY H H 7.358 0.020 . 1072 109 109 GLY HA2 H 3.771 0.020 . 1073 109 109 GLY HA3 H 3.771 0.020 . 1074 109 109 GLY C C 173.215 0.300 . 1075 109 109 GLY CA C 44.044 0.300 . 1076 109 109 GLY N N 129.541 0.300 . 1077 110 110 VAL H H 7.090 0.020 . 1078 110 110 VAL HA H 3.669 0.020 . 1079 110 110 VAL HB H 1.875 0.020 . 1080 110 110 VAL HG1 H 0.572 0.020 . 1081 110 110 VAL HG2 H 0.706 0.020 . 1082 110 110 VAL C C 174.659 0.300 . 1083 110 110 VAL CA C 62.481 0.300 . 1084 110 110 VAL CB C 28.663 0.300 . 1085 110 110 VAL CG1 C 20.050 0.300 . 1086 110 110 VAL CG2 C 18.945 0.300 . 1087 110 110 VAL N N 120.063 0.300 . 1088 111 111 LEU H H 7.677 0.020 . 1089 111 111 LEU HA H 4.153 0.020 . 1090 111 111 LEU HB2 H 1.224 0.020 . 1091 111 111 LEU HB3 H 0.820 0.020 . 1092 111 111 LEU HD1 H 0.919 0.020 . 1093 111 111 LEU HD2 H 0.360 0.020 . 1094 111 111 LEU CA C 51.386 0.300 . 1095 111 111 LEU CB C 37.800 0.300 . 1096 111 111 LEU CD1 C 19.343 0.300 . 1097 111 111 LEU CD2 C 23.553 0.300 . 1098 111 111 LEU N N 118.404 0.300 . 1099 112 112 TYR H H 6.939 0.020 . 1100 112 112 TYR HA H 4.335 0.020 . 1101 112 112 TYR HB2 H 2.796 0.020 . 1102 112 112 TYR HB3 H 3.303 0.020 . 1103 112 112 TYR C C 172.439 0.300 . 1104 112 112 TYR CA C 56.895 0.300 . 1105 112 112 TYR CB C 36.554 0.300 . 1106 112 112 TYR N N 121.431 0.300 . 1107 113 113 VAL H H 7.807 0.020 . 1108 113 113 VAL HA H 4.006 0.020 . 1109 113 113 VAL HB H 2.139 0.020 . 1110 113 113 VAL C C 171.159 0.300 . 1111 113 113 VAL CA C 56.730 0.300 . 1112 113 113 VAL CB C 28.192 0.300 . 1113 113 113 VAL CG1 C 26.288 0.300 . 1114 113 113 VAL N N 123.368 0.300 . 1115 116 116 GLU H H 8.248 0.020 . 1116 116 116 GLU HA H 4.290 0.020 . 1117 116 116 GLU HB2 H 1.976 0.020 . 1118 116 116 GLU HB3 H 1.800 0.020 . 1119 116 116 GLU HG2 H 2.211 0.020 . 1120 116 116 GLU HG3 H 2.211 0.020 . 1121 116 116 GLU CA C 51.924 0.300 . 1122 116 116 GLU CB C 27.101 0.300 . 1123 116 116 GLU CG C 30.695 0.300 . 1124 116 116 GLU N N 124.008 0.300 . 1125 117 117 GLU H H 8.571 0.020 . 1126 117 117 GLU HA H 3.869 0.020 . 1127 117 117 GLU HB2 H 1.857 0.020 . 1128 117 117 GLU HB3 H 2.185 0.020 . 1129 117 117 GLU HG2 H 2.229 0.020 . 1130 117 117 GLU HG3 H 2.229 0.020 . 1131 117 117 GLU CA C 54.863 0.300 . 1132 117 117 GLU CB C 25.976 0.300 . 1133 117 117 GLU CG C 30.871 0.300 . 1134 117 117 GLU N N 122.661 0.300 . 1135 118 118 GLU H H 8.336 0.020 . 1136 118 118 GLU HA H 4.216 0.020 . 1137 118 118 GLU HB2 H 1.897 0.020 . 1138 118 118 GLU HB3 H 1.765 0.020 . 1139 118 118 GLU CA C 54.124 0.300 . 1140 118 118 GLU CB C 26.884 0.300 . 1141 118 118 GLU CG C 33.596 0.300 . 1142 118 118 GLU N N 124.507 0.300 . 1143 119 119 THR H H 7.951 0.020 . 1144 119 119 THR HA H 4.354 0.020 . 1145 119 119 THR HB H 3.999 0.020 . 1146 119 119 THR HG1 H 2.017 0.020 . 1147 119 119 THR HG2 H 0.975 0.020 . 1148 119 119 THR C C 171.010 0.300 . 1149 119 119 THR CA C 58.059 0.300 . 1150 119 119 THR CB C 67.910 0.300 . 1151 119 119 THR CG2 C 18.040 0.300 . 1152 119 119 THR N N 116.783 0.300 . 1153 120 120 GLU H H 8.252 0.020 . 1154 120 120 GLU HA H 4.476 0.020 . 1155 120 120 GLU HB2 H 1.932 0.020 . 1156 120 120 GLU HB3 H 2.006 0.020 . 1157 120 120 GLU HG2 H 2.455 0.020 . 1158 120 120 GLU HG3 H 2.509 0.020 . 1159 120 120 GLU C C 171.549 0.300 . 1160 120 120 GLU CA C 51.476 0.300 . 1161 120 120 GLU CB C 28.957 0.300 . 1162 120 120 GLU CG C 30.960 0.300 . 1163 120 120 GLU N N 123.909 0.300 . 1164 121 121 PRO HA H 4.336 0.020 . 1165 121 121 PRO HB2 H 2.089 0.020 . 1166 121 121 PRO HB3 H 1.694 0.020 . 1167 121 121 PRO HG2 H 1.844 0.020 . 1168 121 121 PRO HG3 H 1.844 0.020 . 1169 121 121 PRO HD2 H 3.719 0.020 . 1170 121 121 PRO HD3 H 3.541 0.020 . 1171 121 121 PRO CA C 59.954 0.300 . 1172 121 121 PRO CB C 29.189 0.300 . 1173 121 121 PRO CG C 24.802 0.300 . 1174 121 121 PRO CD C 47.755 0.300 . 1175 122 122 VAL H H 8.252 0.020 . 1176 122 122 VAL HA H 3.862 0.020 . 1177 122 122 VAL HB H 1.876 0.020 . 1178 122 122 VAL HG1 H 0.822 0.020 . 1179 122 122 VAL HG2 H 0.822 0.020 . 1180 122 122 VAL C C 173.488 0.300 . 1181 122 122 VAL CA C 59.539 0.300 . 1182 122 122 VAL CB C 29.897 0.300 . 1183 122 122 VAL CG1 C 18.351 0.300 . 1184 122 122 VAL CG2 C 18.226 0.300 . 1185 122 122 VAL N N 122.251 0.300 . 1186 123 123 GLN H H 8.395 0.020 . 1187 123 123 GLN HA H 4.206 0.020 . 1188 123 123 GLN HB2 H 1.792 0.020 . 1189 123 123 GLN HB3 H 1.792 0.020 . 1190 123 123 GLN CA C 53.829 0.300 . 1191 123 123 GLN CB C 27.634 0.300 . 1192 123 123 GLN CG C 33.501 0.300 . 1193 123 123 GLN N N 124.863 0.300 . 1194 124 124 GLN H H 8.347 0.020 . 1195 124 124 GLN C C 173.894 0.300 . 1196 124 124 GLN CA C 51.608 0.300 . 1197 124 124 GLN N N 124.878 0.300 . 1198 125 125 SER H H 7.905 0.020 . 1199 125 125 SER HA H 4.674 0.020 . 1200 125 125 SER HB2 H 4.261 0.020 . 1201 125 125 SER HB3 H 4.440 0.020 . 1202 125 125 SER CA C 51.426 0.300 . 1203 125 125 SER CB C 67.442 0.300 . 1204 125 125 SER N N 116.533 0.300 . 1205 126 126 ASP H H 7.889 0.020 . 1206 126 126 ASP HA H 4.466 0.020 . 1207 126 126 ASP HB2 H 2.496 0.020 . 1208 126 126 ASP HB3 H 2.568 0.020 . 1209 126 126 ASP CA C 51.591 0.300 . 1210 126 126 ASP CB C 38.024 0.300 . 1211 126 126 ASP N N 122.205 0.300 . 1212 127 127 ILE H H 6.934 0.020 . 1213 127 127 ILE HA H 3.606 0.020 . 1214 127 127 ILE HB H 1.536 0.020 . 1215 127 127 ILE HG12 H 0.688 0.020 . 1216 127 127 ILE HG13 H 0.688 0.020 . 1217 127 127 ILE HG2 H 0.112 0.020 . 1218 127 127 ILE HD1 H -0.361 0.020 . 1219 127 127 ILE CA C 53.848 0.300 . 1220 127 127 ILE CB C 34.222 0.300 . 1221 127 127 ILE CG1 C 23.124 0.300 . 1222 127 127 ILE CG2 C 13.880 0.300 . 1223 127 127 ILE CD1 C 6.794 0.300 . 1224 127 127 ILE N N 119.243 0.300 . 1225 128 128 PRO HA H 4.234 0.020 . 1226 128 128 PRO HB2 H 2.029 0.020 . 1227 128 128 PRO HG2 H 2.169 0.020 . 1228 128 128 PRO HG3 H 2.516 0.020 . 1229 128 128 PRO HD2 H 3.734 0.020 . 1230 128 128 PRO HD3 H 3.587 0.020 . 1231 128 128 PRO CA C 60.998 0.300 . 1232 128 128 PRO CB C 29.292 0.300 . 1233 128 128 PRO CG C 25.084 0.300 . 1234 128 128 PRO CD C 48.929 0.300 . 1235 129 129 THR H H 8.208 0.020 . 1236 129 129 THR HA H 4.229 0.020 . 1237 129 129 THR HB H 4.180 0.020 . 1238 129 129 THR HG2 H 1.011 0.020 . 1239 129 129 THR C C 171.813 0.300 . 1240 129 129 THR CA C 58.543 0.300 . 1241 129 129 THR CB C 66.929 0.300 . 1242 129 129 THR CG2 C 18.830 0.300 . 1243 129 129 THR N N 112.133 0.300 . 1244 130 130 ASP H H 7.571 0.020 . 1245 130 130 ASP HA H 4.919 0.020 . 1246 130 130 ASP HB2 H 2.188 0.020 . 1247 130 130 ASP HB3 H 2.481 0.020 . 1248 130 130 ASP C C 171.010 0.300 . 1249 130 130 ASP CA C 49.383 0.300 . 1250 130 130 ASP CB C 38.178 0.300 . 1251 130 130 ASP N N 123.345 0.300 . 1252 131 131 PRO HA H 4.420 0.020 . 1253 131 131 PRO HB2 H 1.859 0.020 . 1254 131 131 PRO HB3 H 2.352 0.020 . 1255 131 131 PRO HG2 H 1.915 0.020 . 1256 131 131 PRO HG3 H 1.991 0.020 . 1257 131 131 PRO HD2 H 3.755 0.020 . 1258 131 131 PRO HD3 H 3.550 0.020 . 1259 131 131 PRO CA C 60.198 0.300 . 1260 131 131 PRO CB C 29.555 0.300 . 1261 131 131 PRO CG C 24.383 0.300 . 1262 131 131 PRO CD C 47.742 0.300 . 1263 132 132 PHE H H 9.213 0.020 . 1264 132 132 PHE HA H 4.332 0.020 . 1265 132 132 PHE HB2 H 3.010 0.020 . 1266 132 132 PHE HB3 H 3.250 0.020 . 1267 132 132 PHE HD1 H 7.022 0.020 . 1268 132 132 PHE HD2 H 7.022 0.020 . 1269 132 132 PHE CA C 53.949 0.300 . 1270 132 132 PHE CB C 37.946 0.300 . 1271 132 132 PHE CD1 C 130.018 0.300 . 1272 132 132 PHE N N 122.388 0.300 . 1273 133 133 GLU H H 8.839 0.020 . 1274 133 133 GLU HA H 4.048 0.020 . 1275 133 133 GLU HB2 H 1.947 0.020 . 1276 133 133 GLU HG2 H 2.232 0.020 . 1277 133 133 GLU HG3 H 2.232 0.020 . 1278 133 133 GLU C C 174.471 0.300 . 1279 133 133 GLU CA C 56.066 0.300 . 1280 133 133 GLU CB C 26.685 0.300 . 1281 133 133 GLU CG C 33.334 0.300 . 1282 133 133 GLU N N 125.560 0.300 . 1283 134 134 GLY H H 8.710 0.020 . 1284 134 134 GLY HA2 H 3.556 0.020 . 1285 134 134 GLY HA3 H 4.107 0.020 . 1286 134 134 GLY C C 170.420 0.300 . 1287 134 134 GLY CA C 42.472 0.300 . 1288 134 134 GLY N N 114.458 0.300 . 1289 135 135 TRP H H 8.269 0.020 . 1290 135 135 TRP HA H 5.210 0.020 . 1291 135 135 TRP HB2 H 3.313 0.020 . 1292 135 135 TRP HB3 H 2.963 0.020 . 1293 135 135 TRP HD1 H 6.914 0.020 . 1294 135 135 TRP HE1 H 10.314 0.020 . 1295 135 135 TRP HZ2 H 6.724 0.020 . 1296 135 135 TRP C C 174.140 0.300 . 1297 135 135 TRP CA C 53.340 0.300 . 1298 135 135 TRP CB C 29.978 0.300 . 1299 135 135 TRP CD1 C 125.341 0.300 . 1300 135 135 TRP CZ2 C 110.103 0.300 . 1301 135 135 TRP N N 119.106 0.300 . 1302 135 135 TRP NE1 N 129.575 0.300 . 1303 136 136 THR H H 9.476 0.020 . 1304 136 136 THR HA H 4.665 0.020 . 1305 136 136 THR HB H 3.983 0.020 . 1306 136 136 THR HG2 H 1.163 0.020 . 1307 136 136 THR C C 170.963 0.300 . 1308 136 136 THR CA C 60.242 0.300 . 1309 136 136 THR CB C 67.806 0.300 . 1310 136 136 THR CG2 C 20.400 0.300 . 1311 136 136 THR N N 119.243 0.300 . 1312 137 137 ALA H H 8.705 0.020 . 1313 137 137 ALA HA H 5.437 0.020 . 1314 137 137 ALA HB H 1.416 0.020 . 1315 137 137 ALA C C 176.805 0.300 . 1316 137 137 ALA CA C 47.979 0.300 . 1317 137 137 ALA CB C 20.224 0.300 . 1318 137 137 ALA N N 128.404 0.300 . 1319 138 138 SER H H 8.817 0.020 . 1320 138 138 SER HA H 4.257 0.020 . 1321 138 138 SER HB2 H 4.156 0.020 . 1322 138 138 SER HB3 H 3.895 0.020 . 1323 138 138 SER C C 171.010 0.300 . 1324 138 138 SER CA C 55.777 0.300 . 1325 138 138 SER CB C 63.476 0.300 . 1326 138 138 SER N N 116.372 0.300 . 1327 139 139 ASP H H 8.962 0.020 . 1328 139 139 ASP HA H 4.890 0.020 . 1329 139 139 ASP HB2 H 2.653 0.020 . 1330 139 139 ASP HB3 H 2.653 0.020 . 1331 139 139 ASP C C 173.838 0.300 . 1332 139 139 ASP CA C 50.788 0.300 . 1333 139 139 ASP CB C 35.490 0.300 . 1334 139 139 ASP N N 120.170 0.300 . 1335 140 140 PRO HA H 5.140 0.020 . 1336 140 140 PRO HB2 H 1.669 0.020 . 1337 140 140 PRO HB3 H 1.947 0.020 . 1338 140 140 PRO HG2 H 2.000 0.020 . 1339 140 140 PRO HG3 H 2.000 0.020 . 1340 140 140 PRO CA C 59.700 0.300 . 1341 140 140 PRO CB C 28.854 0.300 . 1342 140 140 PRO CG C 24.032 0.300 . 1343 141 141 ILE H H 8.839 0.020 . 1344 141 141 ILE HA H 4.360 0.020 . 1345 141 141 ILE HB H 1.468 0.020 . 1346 141 141 ILE HG12 H 0.972 0.020 . 1347 141 141 ILE HG13 H 1.252 0.020 . 1348 141 141 ILE HG2 H 0.483 0.020 . 1349 141 141 ILE HD1 H 0.757 0.020 . 1350 141 141 ILE C C 171.624 0.300 . 1351 141 141 ILE CA C 56.793 0.300 . 1352 141 141 ILE CB C 38.816 0.300 . 1353 141 141 ILE CG1 C 24.355 0.300 . 1354 141 141 ILE CG2 C 14.087 0.300 . 1355 141 141 ILE CD1 C 10.475 0.300 . 1356 141 141 ILE N N 121.157 0.300 . 1357 142 142 THR H H 8.448 0.020 . 1358 142 142 THR HA H 5.428 0.020 . 1359 142 142 THR HB H 3.675 0.020 . 1360 142 142 THR HG2 H 0.919 0.020 . 1361 142 142 THR C C 170.780 0.300 . 1362 142 142 THR CA C 57.915 0.300 . 1363 142 142 THR CB C 67.574 0.300 . 1364 142 142 THR CG2 C 18.220 0.300 . 1365 142 142 THR N N 122.525 0.300 . 1366 143 143 ASP H H 8.923 0.020 . 1367 143 143 ASP HA H 4.588 0.020 . 1368 143 143 ASP HB2 H 2.155 0.020 . 1369 143 143 ASP HB3 H 2.424 0.020 . 1370 143 143 ASP C C 172.558 0.300 . 1371 143 143 ASP CA C 50.367 0.300 . 1372 143 143 ASP CB C 40.035 0.300 . 1373 143 143 ASP N N 126.079 0.300 . 1374 144 144 ARG H H 9.141 0.020 . 1375 144 144 ARG HA H 3.638 0.020 . 1376 144 144 ARG HB2 H 1.624 0.020 . 1377 144 144 ARG HB3 H 1.624 0.020 . 1378 144 144 ARG C C 173.949 0.300 . 1379 144 144 ARG CA C 54.559 0.300 . 1380 144 144 ARG CB C 25.337 0.300 . 1381 144 144 ARG N N 124.439 0.300 . 1382 145 145 GLY H H 8.320 0.020 . 1383 145 145 GLY HA2 H 4.107 0.020 . 1384 145 145 GLY HA3 H 4.166 0.020 . 1385 145 145 GLY C C 172.011 0.300 . 1386 145 145 GLY CA C 42.713 0.300 . 1387 145 145 GLY N N 129.708 0.300 . 1388 146 146 SER H H 8.121 0.020 . 1389 146 146 SER HA H 5.315 0.020 . 1390 146 146 SER HB2 H 3.460 0.020 . 1391 146 146 SER HB3 H 3.460 0.020 . 1392 146 146 SER CA C 56.141 0.300 . 1393 146 146 SER CB C 63.585 0.300 . 1394 146 146 SER N N 118.624 0.300 . 1395 147 147 THR H H 8.839 0.020 . 1396 147 147 THR HA H 5.503 0.020 . 1397 147 147 THR HB H 3.762 0.020 . 1398 147 147 THR HG2 H 0.949 0.020 . 1399 147 147 THR CA C 58.962 0.300 . 1400 147 147 THR CB C 67.962 0.300 . 1401 147 147 THR CG2 C 19.316 0.300 . 1402 147 147 THR N N 120.724 0.300 . 1403 148 148 PHE H H 9.504 0.020 . 1404 148 148 PHE HA H 5.834 0.020 . 1405 148 148 PHE HB2 H 2.749 0.020 . 1406 148 148 PHE HB3 H 2.675 0.020 . 1407 148 148 PHE HD1 H 6.955 0.020 . 1408 148 148 PHE C C 171.857 0.300 . 1409 148 148 PHE CA C 52.921 0.300 . 1410 148 148 PHE CB C 40.205 0.300 . 1411 148 148 PHE CD1 C 129.599 0.300 . 1412 148 148 PHE N N 124.849 0.300 . 1413 149 149 MET H H 8.928 0.020 . 1414 149 149 MET HA H 4.094 0.020 . 1415 149 149 MET HB2 H 1.810 0.020 . 1416 149 149 MET HB3 H 2.022 0.020 . 1417 149 149 MET HG2 H 1.980 0.020 . 1418 149 149 MET HG3 H 1.980 0.020 . 1419 149 149 MET HE H 2.029 0.020 . 1420 149 149 MET C C 168.288 0.300 . 1421 149 149 MET CA C 54.660 0.300 . 1422 149 149 MET CB C 35.283 0.300 . 1423 149 149 MET CG C 28.748 0.300 . 1424 149 149 MET CE C 14.821 0.300 . 1425 149 149 MET N N 121.157 0.300 . 1426 150 150 ALA H H 8.090 0.020 . 1427 150 150 ALA HA H 5.864 0.020 . 1428 150 150 ALA HB H 1.327 0.020 . 1429 150 150 ALA C C 172.171 0.300 . 1430 150 150 ALA CA C 46.535 0.300 . 1431 150 150 ALA CB C 20.897 0.300 . 1432 150 150 ALA N N 126.079 0.300 . 1433 151 151 PHE H H 9.275 0.020 . 1434 151 151 PHE HA H 5.487 0.020 . 1435 151 151 PHE HB2 H 2.232 0.020 . 1436 151 151 PHE HB3 H 2.971 0.020 . 1437 151 151 PHE HD1 H 6.837 0.020 . 1438 151 151 PHE HE1 H 7.182 0.020 . 1439 151 151 PHE CA C 53.340 0.300 . 1440 151 151 PHE CB C 41.850 0.300 . 1441 151 151 PHE CD1 C 128.817 0.300 . 1442 151 151 PHE CE1 C 128.420 0.300 . 1443 151 151 PHE N N 115.005 0.300 . 1444 152 152 ALA H H 9.504 0.020 . 1445 152 152 ALA HA H 6.110 0.020 . 1446 152 152 ALA HB H 1.304 0.020 . 1447 152 152 ALA C C 173.356 0.300 . 1448 152 152 ALA CA C 48.058 0.300 . 1449 152 152 ALA CB C 20.231 0.300 . 1450 152 152 ALA N N 123.482 0.300 . 1451 153 153 ALA H H 8.789 0.020 . 1452 153 153 ALA HA H 4.718 0.020 . 1453 153 153 ALA HB H 0.160 0.020 . 1454 153 153 ALA C C 172.943 0.300 . 1455 153 153 ALA CA C 47.912 0.300 . 1456 153 153 ALA CB C 19.106 0.300 . 1457 153 153 ALA N N 122.251 0.300 . 1458 154 154 HIS H H 8.688 0.020 . 1459 154 154 HIS HA H 5.083 0.020 . 1460 154 154 HIS HB2 H 3.109 0.020 . 1461 154 154 HIS HB3 H 2.992 0.020 . 1462 154 154 HIS HD2 H 7.226 0.020 . 1463 154 154 HIS HE1 H 7.567 0.020 . 1464 154 154 HIS C C 171.580 0.300 . 1465 154 154 HIS CA C 52.426 0.300 . 1466 154 154 HIS CB C 26.188 0.300 . 1467 154 154 HIS CD2 C 117.214 0.300 . 1468 154 154 HIS CE1 C 133.066 0.300 . 1469 154 154 HIS N N 119.380 0.300 . 1470 155 155 VAL H H 7.537 0.020 . 1471 155 155 VAL HA H 4.622 0.020 . 1472 155 155 VAL HB H 1.705 0.020 . 1473 155 155 VAL HG1 H 0.510 0.020 . 1474 155 155 VAL HG2 H 0.507 0.020 . 1475 155 155 VAL CA C 56.049 0.300 . 1476 155 155 VAL CB C 33.736 0.300 . 1477 155 155 VAL CG1 C 21.209 0.300 . 1478 155 155 VAL CG2 C 15.322 0.300 . 1479 155 155 VAL N N 116.509 0.300 . 1480 156 156 THR H H 8.273 0.020 . 1481 156 156 THR HA H 4.475 0.020 . 1482 156 156 THR HB H 4.454 0.020 . 1483 156 156 THR HG2 H 1.038 0.020 . 1484 156 156 THR CA C 57.616 0.300 . 1485 156 156 THR CB C 66.966 0.300 . 1486 156 156 THR CG2 C 18.947 0.300 . 1487 156 156 THR N N 131.017 0.300 . 1488 157 157 SER H H 7.277 0.020 . 1489 157 157 SER HA H 4.372 0.020 . 1490 157 157 SER HB2 H 3.826 0.020 . 1491 157 157 SER HB3 H 3.960 0.020 . 1492 157 157 SER C C 170.879 0.300 . 1493 157 157 SER CA C 54.403 0.300 . 1494 157 157 SER CB C 62.942 0.300 . 1495 157 157 SER N N 111.926 0.300 . 1496 158 158 GLU H H 8.794 0.020 . 1497 158 158 GLU HA H 2.818 0.020 . 1498 158 158 GLU HB2 H 1.298 0.020 . 1499 158 158 GLU HB3 H 1.298 0.020 . 1500 158 158 GLU HG2 H 1.330 0.020 . 1501 158 158 GLU HG3 H 1.498 0.020 . 1502 158 158 GLU C C 173.576 0.300 . 1503 158 158 GLU CA C 56.692 0.300 . 1504 158 158 GLU CB C 26.652 0.300 . 1505 158 158 GLU CG C 34.550 0.300 . 1506 158 158 GLU N N 123.482 0.300 . 1507 159 159 GLU H H 8.398 0.020 . 1508 159 159 GLU HA H 3.650 0.020 . 1509 159 159 GLU HB2 H 1.843 0.020 . 1510 159 159 GLU HB3 H 1.735 0.020 . 1511 159 159 GLU HG2 H 2.133 0.020 . 1512 159 159 GLU HG3 H 2.133 0.020 . 1513 159 159 GLU C C 176.487 0.300 . 1514 159 159 GLU CA C 57.301 0.300 . 1515 159 159 GLU CB C 25.956 0.300 . 1516 159 159 GLU CG C 33.305 0.300 . 1517 159 159 GLU N N 117.056 0.300 . 1518 160 160 GLN H H 7.615 0.020 . 1519 160 160 GLN HA H 3.901 0.020 . 1520 160 160 GLN HB2 H 1.783 0.020 . 1521 160 160 GLN HB3 H 2.013 0.020 . 1522 160 160 GLN HG2 H 1.954 0.020 . 1523 160 160 GLN HG3 H 1.954 0.020 . 1524 160 160 GLN C C 174.773 0.300 . 1525 160 160 GLN CA C 55.676 0.300 . 1526 160 160 GLN CB C 26.188 0.300 . 1527 160 160 GLN CG C 30.523 0.300 . 1528 160 160 GLN N N 120.200 0.300 . 1529 161 161 ALA H H 7.500 0.020 . 1530 161 161 ALA HA H 3.573 0.020 . 1531 161 161 ALA HB H 0.691 0.020 . 1532 161 161 ALA C C 175.628 0.300 . 1533 161 161 ALA CA C 52.707 0.300 . 1534 161 161 ALA CB C 14.217 0.300 . 1535 161 161 ALA N N 121.477 0.300 . 1536 162 162 PHE H H 8.169 0.020 . 1537 162 162 PHE HA H 4.148 0.020 . 1538 162 162 PHE HB2 H 2.782 0.020 . 1539 162 162 PHE HB3 H 3.075 0.020 . 1540 162 162 PHE HD1 H 6.639 0.020 . 1541 162 162 PHE HD2 H 6.639 0.020 . 1542 162 162 PHE HE1 H 6.381 0.020 . 1543 162 162 PHE HE2 H 6.381 0.020 . 1544 162 162 PHE CA C 55.408 0.300 . 1545 162 162 PHE CB C 33.692 0.300 . 1546 162 162 PHE CD1 C 126.923 0.300 . 1547 162 162 PHE CE1 C 127.462 0.300 . 1548 162 162 PHE N N 115.099 0.300 . 1549 163 163 ALA H H 7.795 0.020 . 1550 163 163 ALA HA H 4.118 0.020 . 1551 163 163 ALA HB H 1.384 0.020 . 1552 163 163 ALA C C 178.630 0.300 . 1553 163 163 ALA CA C 52.426 0.300 . 1554 163 163 ALA CB C 15.179 0.300 . 1555 163 163 ALA N N 123.153 0.300 . 1556 164 164 MET H H 8.321 0.020 . 1557 164 164 MET HA H 4.051 0.020 . 1558 164 164 MET HB2 H 1.969 0.020 . 1559 164 164 MET HB3 H 2.451 0.020 . 1560 164 164 MET HE H 1.274 0.020 . 1561 164 164 MET C C 176.876 0.300 . 1562 164 164 MET CA C 56.692 0.300 . 1563 164 164 MET CB C 29.669 0.300 . 1564 164 164 MET CE C 12.953 0.300 . 1565 164 164 MET N N 117.876 0.300 . 1566 165 165 LEU H H 8.554 0.020 . 1567 165 165 LEU HA H 4.034 0.020 . 1568 165 165 LEU HB2 H 1.497 0.020 . 1569 165 165 LEU HB3 H 1.497 0.020 . 1570 165 165 LEU HD2 H 0.815 0.020 . 1571 165 165 LEU C C 174.576 0.300 . 1572 165 165 LEU CA C 55.209 0.300 . 1573 165 165 LEU CB C 39.715 0.300 . 1574 165 165 LEU CD1 C 21.167 0.300 . 1575 165 165 LEU CD2 C 23.073 0.300 . 1576 165 165 LEU N N 123.391 0.300 . 1577 166 166 ASP H H 8.100 0.020 . 1578 166 166 ASP HA H 4.133 0.020 . 1579 166 166 ASP HB2 H 2.466 0.020 . 1580 166 166 ASP HB3 H 2.619 0.020 . 1581 166 166 ASP C C 176.092 0.300 . 1582 166 166 ASP CA C 54.762 0.300 . 1583 166 166 ASP CB C 38.182 0.300 . 1584 166 166 ASP N N 118.388 0.300 . 1585 167 167 LEU H H 7.403 0.020 . 1586 167 167 LEU HA H 3.987 0.020 . 1587 167 167 LEU HB2 H 1.662 0.020 . 1588 167 167 LEU HB3 H 1.662 0.020 . 1589 167 167 LEU HG H 1.662 0.020 . 1590 167 167 LEU HD1 H 0.877 0.020 . 1591 167 167 LEU HD2 H 0.877 0.020 . 1592 167 167 LEU C C 177.227 0.300 . 1593 167 167 LEU CA C 54.965 0.300 . 1594 167 167 LEU CB C 39.416 0.300 . 1595 167 167 LEU CG C 24.032 0.300 . 1596 167 167 LEU CD2 C 21.617 0.300 . 1597 167 167 LEU N N 118.696 0.300 . 1598 168 168 LEU H H 7.761 0.020 . 1599 168 168 LEU HA H 3.475 0.020 . 1600 168 168 LEU HB2 H 1.382 0.020 . 1601 168 168 LEU HB3 H 0.870 0.020 . 1602 168 168 LEU HG H 0.283 0.020 . 1603 168 168 LEU HD1 H -1.258 0.020 . 1604 168 168 LEU HD2 H -0.906 0.020 . 1605 168 168 LEU C C 175.808 0.300 . 1606 168 168 LEU CA C 55.530 0.300 . 1607 168 168 LEU CB C 38.677 0.300 . 1608 168 168 LEU CG C 23.315 0.300 . 1609 168 168 LEU CD1 C 18.140 0.300 . 1610 168 168 LEU CD2 C 21.300 0.300 . 1611 168 168 LEU N N 123.256 0.300 . 1612 169 169 LYS H H 7.867 0.020 . 1613 169 169 LYS HA H 3.379 0.020 . 1614 169 169 LYS HB2 H 1.669 0.020 . 1615 169 169 LYS HB3 H 1.669 0.020 . 1616 169 169 LYS HG2 H 1.405 0.020 . 1617 169 169 LYS HG3 H 1.405 0.020 . 1618 169 169 LYS CA C 56.573 0.300 . 1619 169 169 LYS CB C 30.299 0.300 . 1620 169 169 LYS CG C 24.383 0.300 . 1621 169 169 LYS CD C 27.188 0.300 . 1622 169 169 LYS N N 112.977 0.300 . 1623 170 170 THR H H 7.252 0.020 . 1624 170 170 THR HA H 4.048 0.020 . 1625 170 170 THR HB H 4.259 0.020 . 1626 170 170 THR HG2 H 1.216 0.020 . 1627 170 170 THR C C 172.242 0.300 . 1628 170 170 THR CA C 59.637 0.300 . 1629 170 170 THR CB C 67.444 0.300 . 1630 170 170 THR CG2 C 18.677 0.300 . 1631 170 170 THR N N 106.391 0.300 . 1632 171 171 ASP H H 7.129 0.020 . 1633 171 171 ASP HA H 4.367 0.020 . 1634 171 171 ASP HB2 H 2.466 0.020 . 1635 171 171 ASP HB3 H 2.817 0.020 . 1636 171 171 ASP C C 174.730 0.300 . 1637 171 171 ASP CA C 52.730 0.300 . 1638 171 171 ASP CB C 41.118 0.300 . 1639 171 171 ASP N N 124.165 0.300 . 1640 172 172 SER H H 8.740 0.020 . 1641 172 172 SER HA H 4.292 0.020 . 1642 172 172 SER HB2 H 3.882 0.020 . 1643 172 172 SER HB3 H 3.882 0.020 . 1644 172 172 SER CA C 59.823 0.300 . 1645 172 172 SER CB C 60.032 0.300 . 1646 172 172 SER N N 121.138 0.300 . 1647 173 173 LYS H H 8.650 0.020 . 1648 173 173 LYS HA H 4.273 0.020 . 1649 173 173 LYS HB3 H 1.910 0.020 . 1650 173 173 LYS HG2 H 1.457 0.020 . 1651 173 173 LYS HG3 H 1.282 0.020 . 1652 173 173 LYS CA C 56.466 0.300 . 1653 173 173 LYS CB C 25.963 0.300 . 1654 173 173 LYS CG C 23.411 0.300 . 1655 173 173 LYS N N 121.167 0.300 . 1656 174 174 MET H H 8.152 0.020 . 1657 174 174 MET HA H 4.537 0.020 . 1658 174 174 MET HB2 H 2.027 0.020 . 1659 174 174 MET HB3 H 1.639 0.020 . 1660 174 174 MET HG2 H 2.280 0.020 . 1661 174 174 MET HE H 1.258 0.020 . 1662 174 174 MET CA C 52.685 0.300 . 1663 174 174 MET CB C 27.812 0.300 . 1664 174 174 MET CG C 29.002 0.300 . 1665 174 174 MET CE C 12.938 0.300 . 1666 174 174 MET N N 120.094 0.300 . 1667 175 175 ARG H H 8.101 0.020 . 1668 175 175 ARG HA H 4.024 0.020 . 1669 175 175 ARG HB2 H 1.780 0.020 . 1670 175 175 ARG HB3 H 1.780 0.020 . 1671 175 175 ARG HG2 H 1.619 0.020 . 1672 175 175 ARG HG3 H 1.619 0.020 . 1673 175 175 ARG HD2 H 3.091 0.020 . 1674 175 175 ARG HD3 H 3.033 0.020 . 1675 175 175 ARG CA C 55.476 0.300 . 1676 175 175 ARG CB C 27.789 0.300 . 1677 175 175 ARG CG C 24.456 0.300 . 1678 175 175 ARG CD C 40.804 0.300 . 1679 175 175 ARG N N 117.967 0.300 . 1680 176 176 LYS H H 7.381 0.020 . 1681 176 176 LYS HA H 4.212 0.020 . 1682 176 176 LYS HB2 H 1.991 0.020 . 1683 176 176 LYS HB3 H 2.111 0.020 . 1684 176 176 LYS HG2 H 1.420 0.020 . 1685 176 176 LYS HG3 H 1.630 0.020 . 1686 176 176 LYS HD2 H 1.660 0.020 . 1687 176 176 LYS HD3 H 1.554 0.020 . 1688 176 176 LYS HE2 H 2.989 0.020 . 1689 176 176 LYS HE3 H 2.989 0.020 . 1690 176 176 LYS C C 173.791 0.300 . 1691 176 176 LYS CA C 52.832 0.300 . 1692 176 176 LYS CB C 29.526 0.300 . 1693 176 176 LYS CG C 22.477 0.300 . 1694 176 176 LYS CD C 26.496 0.300 . 1695 176 176 LYS CE C 39.540 0.300 . 1696 176 176 LYS N N 115.415 0.300 . 1697 177 177 ALA H H 7.146 0.020 . 1698 177 177 ALA HA H 2.939 0.020 . 1699 177 177 ALA HB H 0.226 0.020 . 1700 177 177 ALA CA C 49.988 0.300 . 1701 177 177 ALA CB C 14.314 0.300 . 1702 177 177 ALA N N 123.755 0.300 . 1703 178 178 ASN H H 8.259 0.020 . 1704 178 178 ASN HA H 4.149 0.020 . 1705 178 178 ASN HB2 H 2.064 0.020 . 1706 178 178 ASN HB3 H 1.853 0.020 . 1707 178 178 ASN CA C 53.438 0.300 . 1708 178 178 ASN CB C 36.832 0.300 . 1709 178 178 ASN N N 120.403 0.300 . 1710 179 179 HIS H H 7.168 0.020 . 1711 179 179 HIS HA H 5.061 0.020 . 1712 179 179 HIS HB2 H 2.714 0.020 . 1713 179 179 HIS HB3 H 3.065 0.020 . 1714 179 179 HIS HD2 H 7.212 0.020 . 1715 179 179 HIS C C 169.932 0.300 . 1716 179 179 HIS CA C 50.323 0.300 . 1717 179 179 HIS CB C 31.290 0.300 . 1718 179 179 HIS CD2 C 118.959 0.300 . 1719 179 179 HIS N N 111.812 0.300 . 1720 180 180 VAL H H 11.387 0.020 . 1721 180 180 VAL HA H 4.313 0.020 . 1722 180 180 VAL HB H 1.808 0.020 . 1723 180 180 VAL HG1 H 0.482 0.020 . 1724 180 180 VAL HG2 H 0.400 0.020 . 1725 180 180 VAL C C 170.625 0.300 . 1726 180 180 VAL CA C 59.580 0.300 . 1727 180 180 VAL CB C 28.623 0.300 . 1728 180 180 VAL CG1 C 18.453 0.300 . 1729 180 180 VAL CG2 C 20.015 0.300 . 1730 180 180 VAL N N 129.634 0.300 . 1731 181 181 MET H H 8.688 0.020 . 1732 181 181 MET HA H 4.384 0.020 . 1733 181 181 MET HB2 H 2.299 0.020 . 1734 181 181 MET HB3 H 2.146 0.020 . 1735 181 181 MET HG2 H 2.397 0.020 . 1736 181 181 MET HG3 H 2.397 0.020 . 1737 181 181 MET HE H 1.904 0.020 . 1738 181 181 MET C C 172.806 0.300 . 1739 181 181 MET CA C 52.324 0.300 . 1740 181 181 MET CB C 33.692 0.300 . 1741 181 181 MET CG C 28.129 0.300 . 1742 181 181 MET CE C 15.605 0.300 . 1743 181 181 MET N N 126.079 0.300 . 1744 182 182 SER H H 9.102 0.020 . 1745 182 182 SER HA H 5.779 0.020 . 1746 182 182 SER HB2 H 3.813 0.020 . 1747 182 182 SER HB3 H 3.963 0.020 . 1748 182 182 SER C C 170.702 0.300 . 1749 182 182 SER CA C 54.965 0.300 . 1750 182 182 SER CB C 64.971 0.300 . 1751 182 182 SER N N 112.407 0.300 . 1752 183 183 ALA H H 8.973 0.020 . 1753 183 183 ALA HA H 4.619 0.020 . 1754 183 183 ALA HB H 1.135 0.020 . 1755 183 183 ALA C C 172.036 0.300 . 1756 183 183 ALA CA C 49.490 0.300 . 1757 183 183 ALA CB C 20.072 0.300 . 1758 183 183 ALA N N 118.560 0.300 . 1759 184 184 TRP H H 8.122 0.020 . 1760 184 184 TRP HA H 5.390 0.020 . 1761 184 184 TRP HB2 H 3.337 0.020 . 1762 184 184 TRP HB3 H 2.941 0.020 . 1763 184 184 TRP C C 170.651 0.300 . 1764 184 184 TRP CA C 53.426 0.300 . 1765 184 184 TRP CB C 29.282 0.300 . 1766 184 184 TRP N N 116.822 0.300 . 1767 185 185 ARG H H 7.812 0.020 . 1768 185 185 ARG HA H 5.203 0.020 . 1769 185 185 ARG HB2 H 1.536 0.020 . 1770 185 185 ARG HG2 H 1.100 0.020 . 1771 185 185 ARG HG3 H 1.229 0.020 . 1772 185 185 ARG C C 173.499 0.300 . 1773 185 185 ARG CA C 53.578 0.300 . 1774 185 185 ARG CB C 31.572 0.300 . 1775 185 185 ARG CG C 24.909 0.300 . 1776 185 185 ARG CD C 41.128 0.300 . 1777 185 185 ARG N N 115.409 0.300 . 1778 186 186 ILE H H 9.906 0.020 . 1779 186 186 ILE HA H 4.867 0.020 . 1780 186 186 ILE HB H 1.941 0.020 . 1781 186 186 ILE HG2 H 0.784 0.020 . 1782 186 186 ILE HD1 H 0.358 0.020 . 1783 186 186 ILE CA C 57.910 0.300 . 1784 186 186 ILE CB C 40.499 0.300 . 1785 186 186 ILE CG1 C 24.635 0.300 . 1786 186 186 ILE CG2 C 14.283 0.300 . 1787 186 186 ILE CD1 C 11.156 0.300 . 1788 186 186 ILE N N 127.720 0.300 . 1789 187 187 LYS H H 9.257 0.020 . 1790 187 187 LYS HA H 4.557 0.020 . 1791 187 187 LYS HB2 H 1.296 0.020 . 1792 187 187 LYS HB3 H 1.366 0.020 . 1793 187 187 LYS HD2 H 0.857 0.020 . 1794 187 187 LYS HD3 H 0.598 0.020 . 1795 187 187 LYS C C 172.216 0.300 . 1796 187 187 LYS CA C 53.222 0.300 . 1797 187 187 LYS CB C 31.680 0.300 . 1798 187 187 LYS CG C 21.121 0.300 . 1799 187 187 LYS CD C 26.042 0.300 . 1800 187 187 LYS CE C 38.516 0.300 . 1801 187 187 LYS N N 127.344 0.300 . 1802 188 188 GLN H H 8.811 0.020 . 1803 188 188 GLN HA H 4.419 0.020 . 1804 188 188 GLN HB2 H 2.030 0.020 . 1805 188 188 GLN HB3 H 1.931 0.020 . 1806 188 188 GLN HG2 H 2.330 0.020 . 1807 188 188 GLN HG3 H 2.330 0.020 . 1808 188 188 GLN C C 173.037 0.300 . 1809 188 188 GLN CA C 52.683 0.300 . 1810 188 188 GLN CB C 27.580 0.300 . 1811 188 188 GLN CG C 31.321 0.300 . 1812 188 188 GLN N N 125.669 0.300 . 1813 189 189 ASP H H 8.582 0.020 . 1814 189 189 ASP HA H 4.326 0.020 . 1815 189 189 ASP HB2 H 2.558 0.020 . 1816 189 189 ASP HB3 H 2.558 0.020 . 1817 189 189 ASP C C 174.653 0.300 . 1818 189 189 ASP CA C 52.934 0.300 . 1819 189 189 ASP CB C 38.256 0.300 . 1820 189 189 ASP N N 124.302 0.300 . 1821 190 190 GLY H H 8.588 0.020 . 1822 190 190 GLY HA2 H 3.642 0.020 . 1823 190 190 GLY HA3 H 4.019 0.020 . 1824 190 190 GLY C C 171.268 0.300 . 1825 190 190 GLY CA C 43.081 0.300 . 1826 190 190 GLY N N 111.176 0.300 . 1827 191 191 SER H H 7.800 0.020 . 1828 191 191 SER HA H 4.498 0.020 . 1829 191 191 SER HB2 H 3.813 0.020 . 1830 191 191 SER HB3 H 3.736 0.020 . 1831 191 191 SER CA C 54.355 0.300 . 1832 191 191 SER CB C 61.231 0.300 . 1833 191 191 SER N N 114.731 0.300 . 1834 192 192 ALA H H 8.249 0.020 . 1835 192 192 ALA HA H 4.231 0.020 . 1836 192 192 ALA HB H 1.322 0.020 . 1837 192 192 ALA C C 174.345 0.300 . 1838 192 192 ALA CA C 49.550 0.300 . 1839 192 192 ALA CB C 16.131 0.300 . 1840 192 192 ALA N N 124.855 0.300 . 1841 193 193 ALA H H 7.895 0.020 . 1842 193 193 ALA HA H 4.207 0.020 . 1843 193 193 ALA HB H 1.149 0.020 . 1844 193 193 ALA C C 173.832 0.300 . 1845 193 193 ALA CA C 49.683 0.300 . 1846 193 193 ALA CB C 16.675 0.300 . 1847 193 193 ALA N N 122.266 0.300 . 1848 194 194 THR H H 7.839 0.020 . 1849 194 194 THR HA H 4.776 0.020 . 1850 194 194 THR HB H 4.180 0.020 . 1851 194 194 THR HG2 H 1.004 0.020 . 1852 194 194 THR C C 170.567 0.300 . 1853 194 194 THR CA C 57.606 0.300 . 1854 194 194 THR CB C 69.002 0.300 . 1855 194 194 THR CG2 C 19.388 0.300 . 1856 194 194 THR N N 112.544 0.300 . 1857 195 195 TYR H H 9.058 0.020 . 1858 195 195 TYR HA H 4.874 0.020 . 1859 195 195 TYR HB2 H 2.866 0.020 . 1860 195 195 TYR HB3 H 3.238 0.020 . 1861 195 195 TYR C C 171.985 0.300 . 1862 195 195 TYR CA C 54.004 0.300 . 1863 195 195 TYR CB C 36.786 0.300 . 1864 195 195 TYR N N 122.254 0.300 . 1865 196 196 GLN H H 8.544 0.020 . 1866 196 196 GLN HB2 H 1.973 0.020 . 1867 196 196 GLN HG2 H 2.202 0.020 . 1868 196 196 GLN HG3 H 2.202 0.020 . 1869 196 196 GLN CA C 52.428 0.300 . 1870 196 196 GLN CB C 33.612 0.300 . 1871 196 196 GLN CG C 38.592 0.300 . 1872 196 196 GLN N N 122.044 0.300 . 1873 197 197 ASP HA H 4.261 0.020 . 1874 197 197 ASP HB2 H 2.538 0.020 . 1875 197 197 ASP HB3 H 2.538 0.020 . 1876 197 197 ASP CA C 49.761 0.300 . 1877 197 197 ASP CB C 41.028 0.300 . 1878 198 198 SER H H 8.529 0.020 . 1879 198 198 SER HA H 4.276 0.020 . 1880 198 198 SER HB2 H 3.336 0.020 . 1881 198 198 SER HB3 H 3.701 0.020 . 1882 198 198 SER C C 169.650 0.300 . 1883 198 198 SER CA C 55.687 0.300 . 1884 198 198 SER CB C 64.712 0.300 . 1885 198 198 SER N N 109.672 0.300 . 1886 199 199 ASP H H 9.186 0.020 . 1887 199 199 ASP HA H 4.831 0.020 . 1888 199 199 ASP HB2 H 2.647 0.020 . 1889 199 199 ASP HB3 H 2.861 0.020 . 1890 199 199 ASP C C 172.344 0.300 . 1891 199 199 ASP CA C 50.865 0.300 . 1892 199 199 ASP CB C 41.195 0.300 . 1893 199 199 ASP N N 118.246 0.300 . 1894 200 200 ASP H H 8.692 0.020 . 1895 200 200 ASP HA H 4.139 0.020 . 1896 200 200 ASP HB2 H 2.422 0.020 . 1897 200 200 ASP HB3 H 2.547 0.020 . 1898 200 200 ASP C C 174.037 0.300 . 1899 200 200 ASP CA C 53.704 0.300 . 1900 200 200 ASP CB C 37.989 0.300 . 1901 200 200 ASP N N 125.164 0.300 . 1902 201 201 ASP H H 8.180 0.020 . 1903 201 201 ASP HA H 4.242 0.020 . 1904 201 201 ASP HB2 H 2.000 0.020 . 1905 201 201 ASP HB3 H 2.000 0.020 . 1906 201 201 ASP C C 173.256 0.300 . 1907 201 201 ASP CA C 52.730 0.300 . 1908 201 201 ASP CB C 38.797 0.300 . 1909 201 201 ASP N N 116.919 0.300 . 1910 202 202 GLY H H 8.008 0.020 . 1911 202 202 GLY HA2 H 3.948 0.020 . 1912 202 202 GLY HA3 H 3.473 0.020 . 1913 202 202 GLY CA C 42.380 0.300 . 1914 202 202 GLY N N 127.771 0.300 . 1915 203 203 GLU H H 7.798 0.020 . 1916 203 203 GLU HA H 3.913 0.020 . 1917 203 203 GLU HB2 H 2.420 0.020 . 1918 203 203 GLU HB3 H 2.420 0.020 . 1919 203 203 GLU HG2 H 2.326 0.020 . 1920 203 203 GLU HG3 H 2.326 0.020 . 1921 203 203 GLU CA C 50.597 0.300 . 1922 203 203 GLU CB C 24.486 0.300 . 1923 203 203 GLU CG C 34.640 0.300 . 1924 203 203 GLU N N 123.323 0.300 . 1925 204 204 THR H H 7.314 0.020 . 1926 204 204 THR HA H 3.396 0.020 . 1927 204 204 THR HB H 3.519 0.020 . 1928 204 204 THR HG2 H 0.992 0.020 . 1929 204 204 THR CA C 63.390 0.300 . 1930 204 204 THR CB C 66.785 0.300 . 1931 204 204 THR CG2 C 19.388 0.300 . 1932 204 204 THR N N 120.320 0.300 . 1933 205 205 ALA H H 8.638 0.020 . 1934 205 205 ALA HA H 4.231 0.020 . 1935 205 205 ALA HB H 1.463 0.020 . 1936 205 205 ALA C C 174.320 0.300 . 1937 205 205 ALA CA C 51.613 0.300 . 1938 205 205 ALA CB C 14.438 0.300 . 1939 205 205 ALA N N 122.798 0.300 . 1940 206 206 ALA H H 8.319 0.020 . 1941 206 206 ALA HA H 4.195 0.020 . 1942 206 206 ALA HB H 1.463 0.020 . 1943 206 206 ALA CA C 53.401 0.300 . 1944 206 206 ALA CB C 19.266 0.300 . 1945 206 206 ALA N N 121.272 0.300 . 1946 207 207 GLY H H 9.420 0.020 . 1947 207 207 GLY HA2 H 3.654 0.020 . 1948 207 207 GLY HA3 H 3.654 0.020 . 1949 207 207 GLY C C 173.627 0.300 . 1950 207 207 GLY CA C 44.910 0.300 . 1951 207 207 GLY N N 107.895 0.300 . 1952 208 208 SER H H 9.079 0.020 . 1953 208 208 SER HA H 3.977 0.020 . 1954 208 208 SER HB2 H 3.842 0.020 . 1955 208 208 SER HB3 H 3.677 0.020 . 1956 208 208 SER C C 175.708 0.300 . 1957 208 208 SER CA C 58.824 0.300 . 1958 208 208 SER CB C 59.529 0.300 . 1959 208 208 SER N N 115.552 0.300 . 1960 209 209 ARG H H 7.213 0.020 . 1961 209 209 ARG HA H 4.021 0.020 . 1962 209 209 ARG HB2 H 1.457 0.020 . 1963 209 209 ARG HB3 H 1.457 0.020 . 1964 209 209 ARG C C 177.577 0.300 . 1965 209 209 ARG CA C 56.387 0.300 . 1966 209 209 ARG CB C 28.276 0.300 . 1967 209 209 ARG CG C 23.879 0.300 . 1968 209 209 ARG N N 121.431 0.300 . 1969 210 210 MET H H 8.294 0.020 . 1970 210 210 MET HA H 3.746 0.020 . 1971 210 210 MET HB2 H 2.409 0.020 . 1972 210 210 MET HB3 H 2.409 0.020 . 1973 210 210 MET HG2 H 2.430 0.020 . 1974 210 210 MET HG3 H 2.430 0.020 . 1975 210 210 MET HE H 1.824 0.020 . 1976 210 210 MET C C 174.614 0.300 . 1977 210 210 MET CA C 56.739 0.300 . 1978 210 210 MET CB C 32.222 0.300 . 1979 210 210 MET CG C 28.940 0.300 . 1980 210 210 MET CE C 13.859 0.300 . 1981 210 210 MET N N 121.903 0.300 . 1982 211 211 LEU H H 8.558 0.020 . 1983 211 211 LEU HA H 3.790 0.020 . 1984 211 211 LEU HB2 H 1.181 0.020 . 1985 211 211 LEU HB3 H 1.654 0.020 . 1986 211 211 LEU HD1 H 0.520 0.020 . 1987 211 211 LEU HD2 H 0.593 0.020 . 1988 211 211 LEU C C 176.762 0.300 . 1989 211 211 LEU CA C 54.370 0.300 . 1990 211 211 LEU CB C 38.586 0.300 . 1991 211 211 LEU CG C 24.032 0.300 . 1992 211 211 LEU CD1 C 22.351 0.300 . 1993 211 211 LEU CD2 C 20.396 0.300 . 1994 211 211 LEU N N 119.238 0.300 . 1995 212 212 HIS H H 7.900 0.020 . 1996 212 212 HIS HA H 4.197 0.020 . 1997 212 212 HIS HB2 H 3.171 0.020 . 1998 212 212 HIS HB3 H 3.035 0.020 . 1999 212 212 HIS C C 173.216 0.300 . 2000 212 212 HIS CA C 57.301 0.300 . 2001 212 212 HIS CB C 27.193 0.300 . 2002 212 212 HIS N N 121.021 0.300 . 2003 213 213 LEU H H 7.464 0.020 . 2004 213 213 LEU HA H 3.846 0.020 . 2005 213 213 LEU HB2 H 1.574 0.020 . 2006 213 213 LEU HB3 H 2.027 0.020 . 2007 213 213 LEU HD1 H 0.770 0.020 . 2008 213 213 LEU HD2 H 0.800 0.020 . 2009 213 213 LEU CA C 55.676 0.300 . 2010 213 213 LEU CB C 38.348 0.300 . 2011 213 213 LEU CD1 C 24.064 0.300 . 2012 213 213 LEU CD2 C 20.765 0.300 . 2013 213 213 LEU N N 119.653 0.300 . 2014 214 214 ILE H H 7.506 0.020 . 2015 214 214 ILE HA H 3.589 0.020 . 2016 214 214 ILE HB H 1.626 0.020 . 2017 214 214 ILE HG12 H 1.233 0.020 . 2018 214 214 ILE HG13 H 1.233 0.020 . 2019 214 214 ILE HG2 H 0.591 0.020 . 2020 214 214 ILE HD1 H 0.464 0.020 . 2021 214 214 ILE CA C 62.626 0.300 . 2022 214 214 ILE CB C 34.811 0.300 . 2023 214 214 ILE CG1 C 23.594 0.300 . 2024 214 214 ILE CG2 C 16.102 0.300 . 2025 214 214 ILE CD1 C 11.073 0.300 . 2026 214 214 ILE N N 111.571 0.300 . 2027 215 215 THR H H 7.597 0.020 . 2028 215 215 THR HA H 4.190 0.020 . 2029 215 215 THR HB H 3.521 0.020 . 2030 215 215 THR HG2 H 0.984 0.020 . 2031 215 215 THR CA C 65.004 0.300 . 2032 215 215 THR CB C 64.206 0.300 . 2033 215 215 THR CG2 C 17.669 0.300 . 2034 215 215 THR N N 117.739 0.300 . 2035 216 216 ILE H H 8.373 0.020 . 2036 216 216 ILE HA H 3.839 0.020 . 2037 216 216 ILE HB H 1.779 0.020 . 2038 216 216 ILE HG12 H 1.073 0.020 . 2039 216 216 ILE HG13 H 1.073 0.020 . 2040 216 216 ILE HG2 H 0.538 0.020 . 2041 216 216 ILE HD1 H 0.566 0.020 . 2042 216 216 ILE CA C 61.178 0.300 . 2043 216 216 ILE CB C 33.924 0.300 . 2044 216 216 ILE CG1 C 23.681 0.300 . 2045 216 216 ILE CG2 C 15.121 0.300 . 2046 216 216 ILE CD1 C 9.688 0.300 . 2047 216 216 ILE N N 121.984 0.300 . 2048 217 217 MET H H 7.850 0.020 . 2049 217 217 MET HA H 3.842 0.020 . 2050 217 217 MET HB2 H 2.094 0.020 . 2051 217 217 MET HB3 H 1.601 0.020 . 2052 217 217 MET HE H 1.871 0.020 . 2053 217 217 MET CA C 55.270 0.300 . 2054 217 217 MET CB C 32.067 0.300 . 2055 217 217 MET CG C 30.026 0.300 . 2056 217 217 MET CE C 14.112 0.300 . 2057 217 217 MET N N 119.790 0.300 . 2058 218 218 ASP H H 7.543 0.020 . 2059 218 218 ASP HA H 4.031 0.020 . 2060 218 218 ASP HB2 H 2.115 0.020 . 2061 218 218 ASP HB3 H 3.153 0.020 . 2062 218 218 ASP C C 170.956 0.300 . 2063 218 218 ASP CA C 51.410 0.300 . 2064 218 218 ASP CB C 36.237 0.300 . 2065 218 218 ASP N N 118.833 0.300 . 2066 219 219 VAL H H 7.029 0.020 . 2067 219 219 VAL HA H 4.308 0.020 . 2068 219 219 VAL HB H 1.492 0.020 . 2069 219 219 VAL HG1 H 0.536 0.020 . 2070 219 219 VAL HG2 H 0.412 0.020 . 2071 219 219 VAL C C 171.813 0.300 . 2072 219 219 VAL CA C 57.478 0.300 . 2073 219 219 VAL CB C 30.442 0.300 . 2074 219 219 VAL CG1 C 17.971 0.300 . 2075 219 219 VAL CG2 C 19.881 0.300 . 2076 219 219 VAL N N 112.954 0.300 . 2077 220 220 TRP H H 8.291 0.020 . 2078 220 220 TRP HA H 4.522 0.020 . 2079 220 220 TRP HB2 H 2.872 0.020 . 2080 220 220 TRP HB3 H 3.065 0.020 . 2081 220 220 TRP HD1 H 7.029 0.020 . 2082 220 220 TRP HE1 H 9.805 0.020 . 2083 220 220 TRP HZ2 H 7.410 0.020 . 2084 220 220 TRP HH2 H 7.025 0.020 . 2085 220 220 TRP CA C 53.441 0.300 . 2086 220 220 TRP CB C 31.835 0.300 . 2087 220 220 TRP CD1 C 124.481 0.300 . 2088 220 220 TRP CZ2 C 112.237 0.300 . 2089 220 220 TRP CH2 C 121.548 0.300 . 2090 220 220 TRP N N 122.388 0.300 . 2091 220 220 TRP NE1 N 129.076 0.300 . 2092 221 221 ASN H H 8.716 0.020 . 2093 221 221 ASN HA H 4.810 0.020 . 2094 221 221 ASN HB2 H 3.265 0.020 . 2095 221 221 ASN HB3 H 3.265 0.020 . 2096 221 221 ASN HD21 H 7.627 0.020 . 2097 221 221 ASN HD22 H 6.766 0.020 . 2098 221 221 ASN CA C 52.118 0.300 . 2099 221 221 ASN CB C 32.418 0.300 . 2100 221 221 ASN N N 119.539 0.300 . 2101 221 221 ASN ND2 N 110.742 0.300 . 2102 222 222 VAL H H 7.790 0.020 . 2103 222 222 VAL HA H 5.348 0.020 . 2104 222 222 VAL HB H 1.321 0.020 . 2105 222 222 VAL HG1 H 0.502 0.020 . 2106 222 222 VAL HG2 H 0.402 0.020 . 2107 222 222 VAL C C 169.009 0.300 . 2108 222 222 VAL CA C 55.216 0.300 . 2109 222 222 VAL CB C 33.150 0.300 . 2110 222 222 VAL CG1 C 16.505 0.300 . 2111 222 222 VAL CG2 C 19.514 0.300 . 2112 222 222 VAL N N 117.204 0.300 . 2113 223 223 ILE H H 8.152 0.020 . 2114 223 223 ILE HA H 5.255 0.020 . 2115 223 223 ILE HB H 1.540 0.020 . 2116 223 223 ILE HG12 H 2.178 0.020 . 2117 223 223 ILE HG13 H 1.186 0.020 . 2118 223 223 ILE HG2 H 0.852 0.020 . 2119 223 223 ILE HD1 H 0.902 0.020 . 2120 223 223 ILE C C 169.476 0.300 . 2121 223 223 ILE CA C 56.216 0.300 . 2122 223 223 ILE CB C 39.029 0.300 . 2123 223 223 ILE CG1 C 26.754 0.300 . 2124 223 223 ILE CG2 C 14.039 0.300 . 2125 223 223 ILE CD1 C 12.810 0.300 . 2126 223 223 ILE N N 122.251 0.300 . 2127 224 224 VAL H H 9.392 0.020 . 2128 224 224 VAL HA H 5.469 0.020 . 2129 224 224 VAL HB H 1.683 0.020 . 2130 224 224 VAL HG1 H 0.867 0.020 . 2131 224 224 VAL HG2 H 0.925 0.020 . 2132 224 224 VAL CA C 56.175 0.300 . 2133 224 224 VAL CB C 32.595 0.300 . 2134 224 224 VAL CG1 C 17.298 0.300 . 2135 224 224 VAL CG2 C 19.881 0.300 . 2136 224 224 VAL N N 125.806 0.300 . 2137 225 225 VAL H H 9.487 0.020 . 2138 225 225 VAL HA H 5.230 0.020 . 2139 225 225 VAL HB H 1.712 0.020 . 2140 225 225 VAL HG1 H 0.628 0.020 . 2141 225 225 VAL HG2 H 0.814 0.020 . 2142 225 225 VAL C C 173.379 0.300 . 2143 225 225 VAL CA C 56.285 0.300 . 2144 225 225 VAL CB C 33.321 0.300 . 2145 225 225 VAL CG1 C 18.804 0.300 . 2146 225 225 VAL CG2 C 21.013 0.300 . 2147 225 225 VAL N N 127.310 0.300 . 2148 226 226 VAL H H 8.610 0.020 . 2149 226 226 VAL HA H 4.759 0.020 . 2150 226 226 VAL HB H 2.173 0.020 . 2151 226 226 VAL HG1 H 0.980 0.020 . 2152 226 226 VAL HG2 H 1.054 0.020 . 2153 226 226 VAL C C 170.830 0.300 . 2154 226 226 VAL CA C 59.187 0.300 . 2155 226 226 VAL CB C 31.853 0.300 . 2156 226 226 VAL CG1 C 19.328 0.300 . 2157 226 226 VAL CG2 C 18.983 0.300 . 2158 226 226 VAL N N 124.849 0.300 . 2159 227 227 ALA H H 9.459 0.020 . 2160 227 227 ALA HA H 5.186 0.020 . 2161 227 227 ALA HB H 0.792 0.020 . 2162 227 227 ALA C C 171.805 0.300 . 2163 227 227 ALA CA C 46.535 0.300 . 2164 227 227 ALA CB C 19.981 0.300 . 2165 227 227 ALA N N 129.771 0.300 . 2166 228 228 ARG H H 8.115 0.020 . 2167 228 228 ARG HA H 5.205 0.020 . 2168 228 228 ARG HB2 H 1.135 0.020 . 2169 228 228 ARG HB3 H 1.360 0.020 . 2170 228 228 ARG CA C 50.570 0.300 . 2171 228 228 ARG CB C 32.211 0.300 . 2172 228 228 ARG CG C 24.471 0.300 . 2173 228 228 ARG CD C 39.024 0.300 . 2174 228 228 ARG N N 118.609 0.300 . 2175 229 229 TRP H H 9.309 0.020 . 2176 229 229 TRP HB2 H 3.071 0.020 . 2177 229 229 TRP HB3 H 2.825 0.020 . 2178 229 229 TRP HD1 H 6.840 0.020 . 2179 229 229 TRP HE1 H 9.589 0.020 . 2180 229 229 TRP HZ2 H 7.195 0.020 . 2181 229 229 TRP HH2 H 6.876 0.020 . 2182 229 229 TRP C C 172.809 0.300 . 2183 229 229 TRP CA C 55.790 0.300 . 2184 229 229 TRP CB C 33.824 0.300 . 2185 229 229 TRP CD1 C 128.810 0.300 . 2186 229 229 TRP CZ2 C 111.249 0.300 . 2187 229 229 TRP CH2 C 124.031 0.300 . 2188 229 229 TRP N N 129.692 0.300 . 2189 232 232 GLY H H 7.954 0.020 . 2190 232 232 GLY HA2 H 3.811 0.020 . 2191 232 232 GLY HA3 H 4.022 0.020 . 2192 232 232 GLY CA C 42.588 0.300 . 2193 232 232 GLY N N 110.110 0.300 . 2194 233 233 ALA H H 8.110 0.020 . 2195 233 233 ALA CA C 55.509 0.300 . 2196 233 233 ALA N N 115.987 0.300 . 2197 234 234 HIS HA H 4.660 0.020 . 2198 234 234 HIS HB2 H 2.633 0.020 . 2199 234 234 HIS HB3 H 2.080 0.020 . 2200 234 234 HIS HE1 H 6.108 0.020 . 2201 234 234 HIS CB C 26.096 0.300 . 2202 234 234 HIS CE1 C 115.046 0.300 . 2203 235 235 ILE HA H 4.520 0.020 . 2204 235 235 ILE HB H 2.127 0.020 . 2205 235 235 ILE HG12 H 1.451 0.020 . 2206 235 235 ILE HG13 H 1.254 0.020 . 2207 235 235 ILE HD1 H 0.946 0.020 . 2208 235 235 ILE CG2 C 14.920 0.300 . 2209 235 235 ILE CD1 C 11.032 0.300 . 2210 237 237 PRO HA H 3.840 0.020 . 2211 237 237 PRO CA C 61.700 0.300 . 2212 237 237 PRO CB C 28.065 0.300 . 2213 237 237 PRO CD C 46.442 0.300 . 2214 238 238 ASP H H 7.862 0.020 . 2215 238 238 ASP HA H 4.239 0.020 . 2216 238 238 ASP HB2 H 2.213 0.020 . 2217 238 238 ASP HB3 H 2.213 0.020 . 2218 238 238 ASP CA C 54.365 0.300 . 2219 238 238 ASP CB C 37.446 0.300 . 2220 238 238 ASP N N 120.686 0.300 . 2221 239 239 ARG H H 8.270 0.020 . 2222 239 239 ARG HA H 3.677 0.020 . 2223 239 239 ARG HB2 H 1.135 0.020 . 2224 239 239 ARG HB3 H 1.420 0.020 . 2225 239 239 ARG C C 173.576 0.300 . 2226 239 239 ARG CA C 56.000 0.300 . 2227 239 239 ARG CB C 24.927 0.300 . 2228 239 239 ARG N N 116.231 0.300 . 2229 240 240 PHE H H 7.381 0.020 . 2230 240 240 PHE HA H 3.934 0.020 . 2231 240 240 PHE HB2 H 3.183 0.020 . 2232 240 240 PHE HB3 H 3.022 0.020 . 2233 240 240 PHE CA C 60.199 0.300 . 2234 240 240 PHE CB C 36.322 0.300 . 2235 240 240 PHE N N 116.874 0.300 . 2236 241 241 LYS H H 7.185 0.020 . 2237 241 241 LYS HA H 3.636 0.020 . 2238 241 241 LYS HB2 H 1.170 0.020 . 2239 241 241 LYS HB3 H 0.782 0.020 . 2240 241 241 LYS HG2 H 1.440 0.020 . 2241 241 241 LYS HG3 H 1.440 0.020 . 2242 241 241 LYS HD2 H 1.031 0.020 . 2243 241 241 LYS HD3 H 1.031 0.020 . 2244 241 241 LYS HE2 H 2.076 0.020 . 2245 241 241 LYS HE3 H 2.076 0.020 . 2246 241 241 LYS C C 176.253 0.300 . 2247 241 241 LYS CA C 56.590 0.300 . 2248 241 241 LYS CB C 29.120 0.300 . 2249 241 241 LYS CG C 21.962 0.300 . 2250 241 241 LYS CD C 26.696 0.300 . 2251 241 241 LYS CE C 39.112 0.300 . 2252 241 241 LYS N N 120.884 0.300 . 2253 242 242 HIS H H 5.783 0.020 . 2254 242 242 HIS HA H 4.518 0.020 . 2255 242 242 HIS HB2 H 3.241 0.020 . 2256 242 242 HIS HB3 H 3.159 0.020 . 2257 242 242 HIS CA C 52.832 0.300 . 2258 242 242 HIS CB C 26.901 0.300 . 2259 242 242 HIS N N 117.876 0.300 . 2260 243 243 ILE H H 7.859 0.020 . 2261 243 243 ILE HA H 3.442 0.020 . 2262 243 243 ILE HB H 1.487 0.020 . 2263 243 243 ILE HG2 H 0.888 0.020 . 2264 243 243 ILE HD1 H 0.458 0.020 . 2265 243 243 ILE CA C 63.202 0.300 . 2266 243 243 ILE CB C 37.224 0.300 . 2267 243 243 ILE CG1 C 27.101 0.300 . 2268 243 243 ILE CG2 C 13.557 0.300 . 2269 243 243 ILE N N 122.223 0.300 . 2270 244 244 ASN H H 7.504 0.020 . 2271 244 244 ASN HA H 4.396 0.020 . 2272 244 244 ASN HB2 H 2.612 0.020 . 2273 244 244 ASN HB3 H 2.896 0.020 . 2274 244 244 ASN HD21 H 7.476 0.020 . 2275 244 244 ASN HD22 H 6.120 0.020 . 2276 244 244 ASN C C 175.124 0.300 . 2277 244 244 ASN CA C 53.645 0.300 . 2278 244 244 ASN CB C 36.167 0.300 . 2279 244 244 ASN N N 113.364 0.300 . 2280 244 244 ASN ND2 N 108.944 0.300 . 2281 245 245 SER H H 8.180 0.020 . 2282 245 245 SER HA H 3.872 0.020 . 2283 245 245 SER HB2 H 3.870 0.020 . 2284 245 245 SER HB3 H 3.759 0.020 . 2285 245 245 SER CA C 59.033 0.300 . 2286 245 245 SER CB C 66.212 0.300 . 2287 245 245 SER N N 115.189 0.300 . 2288 246 246 THR H H 7.945 0.020 . 2289 246 246 THR HA H 3.960 0.020 . 2290 246 246 THR HB H 4.172 0.020 . 2291 246 246 THR HG2 H 1.287 0.020 . 2292 246 246 THR CA C 62.887 0.300 . 2293 246 246 THR CB C 64.059 0.300 . 2294 246 246 THR CG2 C 19.873 0.300 . 2295 246 246 THR N N 115.825 0.300 . 2296 247 247 ALA H H 7.599 0.020 . 2297 247 247 ALA HA H 3.627 0.020 . 2298 247 247 ALA HB H 1.253 0.020 . 2299 247 247 ALA C C 175.474 0.300 . 2300 247 247 ALA CA C 53.035 0.300 . 2301 247 247 ALA CB C 15.500 0.300 . 2302 247 247 ALA N N 125.122 0.300 . 2303 248 248 ARG H H 7.844 0.020 . 2304 248 248 ARG HA H 3.539 0.020 . 2305 248 248 ARG HB2 H 1.717 0.020 . 2306 248 248 ARG HB3 H 1.882 0.020 . 2307 248 248 ARG C C 174.072 0.300 . 2308 248 248 ARG CA C 57.403 0.300 . 2309 248 248 ARG CB C 27.952 0.300 . 2310 248 248 ARG N N 115.141 0.300 . 2311 249 249 GLU H H 7.515 0.020 . 2312 249 249 GLU HA H 3.948 0.020 . 2313 249 249 GLU HB2 H 2.130 0.020 . 2314 249 249 GLU HB3 H 2.070 0.020 . 2315 249 249 GLU HG2 H 2.151 0.020 . 2316 249 249 GLU HG3 H 1.695 0.020 . 2317 249 249 GLU C C 175.241 0.300 . 2318 249 249 GLU CA C 57.098 0.300 . 2319 249 249 GLU CB C 28.354 0.300 . 2320 249 249 GLU CG C 35.732 0.300 . 2321 249 249 GLU N N 117.602 0.300 . 2322 250 250 ALA H H 8.386 0.020 . 2323 250 250 ALA HA H 3.592 0.020 . 2324 250 250 ALA HB H 1.364 0.020 . 2325 250 250 ALA C C 175.630 0.300 . 2326 250 250 ALA CA C 53.119 0.300 . 2327 250 250 ALA CB C 15.535 0.300 . 2328 250 250 ALA N N 120.200 0.300 . 2329 251 251 VAL H H 7.744 0.020 . 2330 251 251 VAL HA H 3.289 0.020 . 2331 251 251 VAL HB H 2.040 0.020 . 2332 251 251 VAL HG1 H 0.760 0.020 . 2333 251 251 VAL HG2 H 0.735 0.020 . 2334 251 251 VAL CA C 64.473 0.300 . 2335 251 251 VAL CB C 29.127 0.300 . 2336 251 251 VAL CG1 C 21.032 0.300 . 2337 251 251 VAL CG2 C 19.531 0.300 . 2338 251 251 VAL N N 116.098 0.300 . 2339 252 252 VAL H H 8.560 0.020 . 2340 252 252 VAL HA H 3.685 0.020 . 2341 252 252 VAL HB H 2.122 0.020 . 2342 252 252 VAL HG1 H 0.897 0.020 . 2343 252 252 VAL HG2 H 1.003 0.020 . 2344 252 252 VAL C C 178.629 0.300 . 2345 252 252 VAL CA C 63.903 0.300 . 2346 252 252 VAL CB C 28.909 0.300 . 2347 252 252 VAL CG1 C 18.427 0.300 . 2348 252 252 VAL CG2 C 20.084 0.300 . 2349 252 252 VAL N N 119.790 0.300 . 2350 253 253 ARG H H 8.604 0.020 . 2351 253 253 ARG HA H 3.972 0.020 . 2352 253 253 ARG HB2 H 1.749 0.020 . 2353 253 253 ARG HB3 H 1.749 0.020 . 2354 253 253 ARG C C 175.229 0.300 . 2355 253 253 ARG CA C 56.692 0.300 . 2356 253 253 ARG CB C 28.370 0.300 . 2357 253 253 ARG CG C 25.344 0.300 . 2358 253 253 ARG CD C 38.488 0.300 . 2359 253 253 ARG N N 120.610 0.300 . 2360 254 254 ALA H H 8.029 0.020 . 2361 254 254 ALA HA H 4.300 0.020 . 2362 254 254 ALA HB H 1.495 0.020 . 2363 254 254 ALA C C 175.636 0.300 . 2364 254 254 ALA CA C 50.394 0.300 . 2365 254 254 ALA CB C 16.124 0.300 . 2366 254 254 ALA N N 121.021 0.300 . 2367 255 255 GLY H H 7.766 0.020 . 2368 255 255 GLY HA2 H 3.840 0.020 . 2369 255 255 GLY HA3 H 4.021 0.020 . 2370 255 255 GLY C C 172.047 0.300 . 2371 255 255 GLY CA C 43.691 0.300 . 2372 255 255 GLY N N 106.664 0.300 . 2373 256 256 PHE H H 7.895 0.020 . 2374 256 256 PHE HA H 4.528 0.020 . 2375 256 256 PHE HB2 H 2.758 0.020 . 2376 256 256 PHE HB3 H 3.129 0.020 . 2377 256 256 PHE HD1 H 7.430 0.020 . 2378 256 256 PHE HD2 H 7.430 0.020 . 2379 256 256 PHE HE1 H 7.039 0.020 . 2380 256 256 PHE HE2 H 7.039 0.020 . 2381 256 256 PHE C C 172.558 0.300 . 2382 256 256 PHE CA C 56.082 0.300 . 2383 256 256 PHE CB C 36.476 0.300 . 2384 256 256 PHE CD1 C 129.215 0.300 . 2385 256 256 PHE CE1 C 128.251 0.300 . 2386 256 256 PHE N N 119.517 0.300 . 2387 257 257 ASP H H 8.537 0.020 . 2388 257 257 ASP HA H 4.675 0.020 . 2389 257 257 ASP HB2 H 2.652 0.020 . 2390 257 257 ASP HB3 H 2.652 0.020 . 2391 257 257 ASP CA C 51.319 0.300 . 2392 257 257 ASP CB C 38.829 0.300 . 2393 257 257 ASP N N 120.884 0.300 . 2394 258 258 SER H H 7.811 0.020 . 2395 258 258 SER HA H 4.270 0.020 . 2396 258 258 SER HB2 H 3.822 0.020 . 2397 258 258 SER HB3 H 3.733 0.020 . 2398 258 258 SER CA C 57.301 0.300 . 2399 258 258 SER CB C 61.856 0.300 . 2400 258 258 SER N N 120.884 0.300 . stop_ save_