data_19999 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 15N, 13C resonance assignment of human osteopontin ; _BMRB_accession_number 19999 _BMRB_flat_file_name bmr19999.str _Entry_type original _Submission_date 2014-06-02 _Accession_date 2014-06-02 _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 Platzer Gerald . . 2 Zerko Szymon . . 3 Kozminski Wiktor . . 4 Konrat Robert . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 987 "13C chemical shifts" 902 "15N chemical shifts" 257 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-07-11 original BMRB . stop_ _Original_release_date 2014-06-02 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; 1H, 15N, 13C resonance assignment of human osteopontin ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 25616494 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Platzer Gerald . . 2 Zerko Szymon . . 3 Saxena Saurabh . . 4 Kozminski Wiktor . . 5 Konrat Robert . . stop_ _Journal_abbreviation 'Biomol. NMR Assign.' _Journal_name_full 'Biomolecular NMR assignments' _Journal_volume 9 _Journal_issue 2 _Journal_ISSN 1874-270X _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 289 _Page_last 292 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'osteopontin monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label osteopontin $osteopontin stop_ _System_molecular_weight . _System_physical_state 'intrinsically disordered' _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_osteopontin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common osteopontin _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 302 _Mol_residue_sequence ; GAMGIPVKQADSGSSEEKQL YNKYPDAVATWLNPDPSQKQ NLLAPQNAVSSEETNDFKQE TLPSKSNESHDHMDDMDDED DDDHVDSQDSIDSNDSDDVD DTDDSHQSDESHHSDESDEL VTDFPTDLPATEVFTPVVPT VDTYDGRGDSVVYGLRSKSK KFRRPDIQYPDATDEDITSH MESEELNGAYKAIPVAQDLN APSDWDSRGKDSYETSQLDD QSAETHSHKQSRLYKRKAND ESNEHSDVIDSQELSKVSRE FHSHEFHSHEDMLVVDPKSK EEDKHLKFRISHELDSASSE VN ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -4 GLY 2 -3 ALA 3 -2 MET 4 -1 GLY 5 1 ILE 6 2 PRO 7 3 VAL 8 4 LYS 9 5 GLN 10 6 ALA 11 7 ASP 12 8 SER 13 9 GLY 14 10 SER 15 11 SER 16 12 GLU 17 13 GLU 18 14 LYS 19 15 GLN 20 16 LEU 21 17 TYR 22 18 ASN 23 19 LYS 24 20 TYR 25 21 PRO 26 22 ASP 27 23 ALA 28 24 VAL 29 25 ALA 30 26 THR 31 27 TRP 32 28 LEU 33 29 ASN 34 30 PRO 35 31 ASP 36 32 PRO 37 33 SER 38 34 GLN 39 35 LYS 40 36 GLN 41 37 ASN 42 38 LEU 43 39 LEU 44 40 ALA 45 41 PRO 46 42 GLN 47 43 ASN 48 44 ALA 49 45 VAL 50 46 SER 51 47 SER 52 48 GLU 53 49 GLU 54 50 THR 55 51 ASN 56 52 ASP 57 53 PHE 58 54 LYS 59 55 GLN 60 56 GLU 61 57 THR 62 58 LEU 63 59 PRO 64 60 SER 65 61 LYS 66 62 SER 67 63 ASN 68 64 GLU 69 65 SER 70 66 HIS 71 67 ASP 72 68 HIS 73 69 MET 74 70 ASP 75 71 ASP 76 72 MET 77 73 ASP 78 74 ASP 79 75 GLU 80 76 ASP 81 77 ASP 82 78 ASP 83 79 ASP 84 80 HIS 85 81 VAL 86 82 ASP 87 83 SER 88 84 GLN 89 85 ASP 90 86 SER 91 87 ILE 92 88 ASP 93 89 SER 94 90 ASN 95 91 ASP 96 92 SER 97 93 ASP 98 94 ASP 99 95 VAL 100 96 ASP 101 97 ASP 102 98 THR 103 99 ASP 104 100 ASP 105 101 SER 106 102 HIS 107 103 GLN 108 104 SER 109 105 ASP 110 106 GLU 111 107 SER 112 108 HIS 113 109 HIS 114 110 SER 115 111 ASP 116 112 GLU 117 113 SER 118 114 ASP 119 115 GLU 120 116 LEU 121 117 VAL 122 118 THR 123 119 ASP 124 120 PHE 125 121 PRO 126 122 THR 127 123 ASP 128 124 LEU 129 125 PRO 130 126 ALA 131 127 THR 132 128 GLU 133 129 VAL 134 130 PHE 135 131 THR 136 132 PRO 137 133 VAL 138 134 VAL 139 135 PRO 140 136 THR 141 137 VAL 142 138 ASP 143 139 THR 144 140 TYR 145 141 ASP 146 142 GLY 147 143 ARG 148 144 GLY 149 145 ASP 150 146 SER 151 147 VAL 152 148 VAL 153 149 TYR 154 150 GLY 155 151 LEU 156 152 ARG 157 153 SER 158 154 LYS 159 155 SER 160 156 LYS 161 157 LYS 162 158 PHE 163 159 ARG 164 160 ARG 165 161 PRO 166 162 ASP 167 163 ILE 168 164 GLN 169 165 TYR 170 166 PRO 171 167 ASP 172 168 ALA 173 169 THR 174 170 ASP 175 171 GLU 176 172 ASP 177 173 ILE 178 174 THR 179 175 SER 180 176 HIS 181 177 MET 182 178 GLU 183 179 SER 184 180 GLU 185 181 GLU 186 182 LEU 187 183 ASN 188 184 GLY 189 185 ALA 190 186 TYR 191 187 LYS 192 188 ALA 193 189 ILE 194 190 PRO 195 191 VAL 196 192 ALA 197 193 GLN 198 194 ASP 199 195 LEU 200 196 ASN 201 197 ALA 202 198 PRO 203 199 SER 204 200 ASP 205 201 TRP 206 202 ASP 207 203 SER 208 204 ARG 209 205 GLY 210 206 LYS 211 207 ASP 212 208 SER 213 209 TYR 214 210 GLU 215 211 THR 216 212 SER 217 213 GLN 218 214 LEU 219 215 ASP 220 216 ASP 221 217 GLN 222 218 SER 223 219 ALA 224 220 GLU 225 221 THR 226 222 HIS 227 223 SER 228 224 HIS 229 225 LYS 230 226 GLN 231 227 SER 232 228 ARG 233 229 LEU 234 230 TYR 235 231 LYS 236 232 ARG 237 233 LYS 238 234 ALA 239 235 ASN 240 236 ASP 241 237 GLU 242 238 SER 243 239 ASN 244 240 GLU 245 241 HIS 246 242 SER 247 243 ASP 248 244 VAL 249 245 ILE 250 246 ASP 251 247 SER 252 248 GLN 253 249 GLU 254 250 LEU 255 251 SER 256 252 LYS 257 253 VAL 258 254 SER 259 255 ARG 260 256 GLU 261 257 PHE 262 258 HIS 263 259 SER 264 260 HIS 265 261 GLU 266 262 PHE 267 263 HIS 268 264 SER 269 265 HIS 270 266 GLU 271 267 ASP 272 268 MET 273 269 LEU 274 270 VAL 275 271 VAL 276 272 ASP 277 273 PRO 278 274 LYS 279 275 SER 280 276 LYS 281 277 GLU 282 278 GLU 283 279 ASP 284 280 LYS 285 281 HIS 286 282 LEU 287 283 LYS 288 284 PHE 289 285 ARG 290 286 ILE 291 287 SER 292 288 HIS 293 289 GLU 294 290 LEU 295 291 ASP 296 292 SER 297 293 ALA 298 294 SER 299 295 SER 300 296 GLU 301 297 VAL 302 298 ASN 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 $osteopontin human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $osteopontin 'recombinant technology' . Escherichia coli . pet-m11 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_nmr_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling 'sodium phosphate' 50 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' $osteopontin 0.5 mM '[U-95% 13C; U-95% 15N]' H2O 90 % 'natural abundance' D2O 10 % '[U-100% 2H]' stop_ save_ ############################ # Computer software used # ############################ save_VNMRJ _Saveframe_category software _Name VNMRJ _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Agilent _Model 'Direct Drive' _Field_strength 700 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HNCO_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $nmr_sample save_ save_4D_HN(CA)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '4D HN(CA)NH' _Sample_label $nmr_sample save_ save_5D_HN(CA)CONH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '5D HN(CA)CONH' _Sample_label $nmr_sample save_ save_5D_(HACA)CON(CA)CONH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '5D (HACA)CON(CA)CONH' _Sample_label $nmr_sample save_ save_5D_(H)NCO(NCA)CONH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '5D (H)NCO(NCA)CONH' _Sample_label $nmr_sample save_ save_5D_HNCOCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '5D HNCOCACB' _Sample_label $nmr_sample save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 . pH pressure 1 . atm temperature 273 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D HNCO' '4D HN(CA)NH' '5D HN(CA)CONH' '5D (HACA)CON(CA)CONH' '5D HNCOCACB' stop_ loop_ _Sample_label $nmr_sample stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name osteopontin _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 -2 3 MET H H 8.5 0.02 1 2 -2 3 MET CA C 55.37 0.30 1 3 -2 3 MET CB C 33.73 0.30 1 4 -2 3 MET N N 119.8 0.30 1 5 -1 4 GLY H H 8.38 0.02 1 6 -1 4 GLY CA C 45.02 0.30 1 7 -1 4 GLY N N 110.2 0.30 1 8 1 5 ILE H H 7.88 0.02 1 9 1 5 ILE N N 121.55 0.30 1 10 2 6 PRO HA H 4.42 0.02 1 11 2 6 PRO HB2 H 2.24 0.02 2 12 2 6 PRO HB3 H 2.24 0.02 2 13 2 6 PRO HG2 H 1.97 0.02 2 14 2 6 PRO HG3 H 1.97 0.02 2 15 2 6 PRO C C 176.72 0.30 1 16 2 6 PRO CA C 63.15 0.30 1 17 2 6 PRO CB C 32.09 0.30 1 18 2 6 PRO CG C 27.38 0.30 1 19 3 7 VAL H H 8.18 0.02 1 20 3 7 VAL C C 176.13 0.30 1 21 3 7 VAL CA C 62.24 0.30 1 22 3 7 VAL CB C 32.94 0.30 1 23 3 7 VAL N N 120.87 0.30 1 24 4 8 LYS H H 8.36 0.02 1 25 4 8 LYS HA H 4.30 0.02 1 26 4 8 LYS HB2 H 1.75 0.02 2 27 4 8 LYS HB3 H 1.75 0.02 2 28 4 8 LYS HG2 H 1.39 0.02 2 29 4 8 LYS HG3 H 1.39 0.02 2 30 4 8 LYS HE2 H 2.97 0.02 2 31 4 8 LYS HE3 H 2.97 0.02 2 32 4 8 LYS C C 176.30 0.30 1 33 4 8 LYS CA C 56.19 0.30 1 34 4 8 LYS CB C 33.12 0.30 1 35 4 8 LYS CG C 24.64 0.30 1 36 4 8 LYS CE C 42.05 0.30 1 37 4 8 LYS N N 125.44 0.30 1 38 5 9 GLN H H 8.47 0.02 1 39 5 9 GLN HA H 4.29 0.02 1 40 5 9 GLN HB2 H 2.02 0.02 2 41 5 9 GLN HB3 H 2.02 0.02 2 42 5 9 GLN HG2 H 2.36 0.02 2 43 5 9 GLN HG3 H 2.36 0.02 2 44 5 9 GLN C C 175.74 0.30 1 45 5 9 GLN CA C 55.77 0.30 1 46 5 9 GLN CB C 29.65 0.30 1 47 5 9 GLN CG C 33.78 0.30 1 48 5 9 GLN N N 122.97 0.30 1 49 6 10 ALA H H 8.44 0.02 1 50 6 10 ALA HA H 4.27 0.02 1 51 6 10 ALA HB H 1.37 0.02 1 52 6 10 ALA C C 177.44 0.30 1 53 6 10 ALA CA C 52.67 0.30 1 54 6 10 ALA CB C 19.42 0.30 1 55 6 10 ALA N N 125.75 0.30 1 56 7 11 ASP H H 8.35 0.02 1 57 7 11 ASP HB2 H 2.68 0.02 2 58 7 11 ASP HB3 H 2.68 0.02 2 59 7 11 ASP C C 176.53 0.30 1 60 7 11 ASP CA C 54.27 0.30 1 61 7 11 ASP CB C 41.35 0.30 1 62 7 11 ASP N N 119.86 0.30 1 63 8 12 SER H H 8.33 0.02 1 64 8 12 SER HB2 H 3.90 0.02 2 65 8 12 SER HB3 H 3.90 0.02 2 66 8 12 SER C C 175.30 0.30 1 67 8 12 SER CA C 58.82 0.30 1 68 8 12 SER CB C 63.92 0.30 1 69 8 12 SER N N 116.58 0.30 1 70 9 13 GLY H H 8.53 0.02 1 71 9 13 GLY HA2 H 4.00 0.02 2 72 9 13 GLY HA3 H 4.00 0.02 2 73 9 13 GLY C C 174.35 0.30 1 74 9 13 GLY CA C 45.50 0.30 1 75 9 13 GLY N N 111.00 0.30 1 76 10 14 SER H H 8.20 0.02 1 77 10 14 SER HB2 H 3.90 0.02 2 78 10 14 SER HB3 H 3.90 0.02 2 79 10 14 SER C C 174.93 0.30 1 80 10 14 SER CA C 58.25 0.30 1 81 10 14 SER CB C 64.12 0.30 1 82 10 14 SER N N 115.65 0.30 1 83 11 15 SER H H 8.47 0.02 1 84 11 15 SER HB2 H 3.90 0.02 2 85 11 15 SER HB3 H 3.90 0.02 2 86 11 15 SER C C 174.91 0.30 1 87 11 15 SER CA C 58.88 0.30 1 88 11 15 SER CB C 63.69 0.30 1 89 11 15 SER N N 118.08 0.30 1 90 12 16 GLU H H 8.46 0.02 1 91 12 16 GLU HA H 4.24 0.02 1 92 12 16 GLU HB2 H 2.02 0.02 2 93 12 16 GLU HB3 H 1.96 0.02 2 94 12 16 GLU HG2 H 2.25 0.02 2 95 12 16 GLU HG3 H 2.25 0.02 2 96 12 16 GLU C C 176.86 0.30 1 97 12 16 GLU CA C 57.13 0.30 1 98 12 16 GLU CB C 30.17 0.30 1 99 12 16 GLU CG C 36.31 0.30 1 100 12 16 GLU N N 122.55 0.30 1 101 13 17 GLU H H 8.32 0.02 1 102 13 17 GLU HA H 4.20 0.02 1 103 13 17 GLU HB2 H 2.00 0.02 2 104 13 17 GLU HB3 H 2.00 0.02 2 105 13 17 GLU HG2 H 2.25 0.02 2 106 13 17 GLU HG3 H 2.25 0.02 2 107 13 17 GLU C C 176.80 0.30 1 108 13 17 GLU CA C 57.11 0.30 1 109 13 17 GLU CB C 30.03 0.30 1 110 13 17 GLU CG C 36.32 0.30 1 111 13 17 GLU N N 121.68 0.30 1 112 14 18 LYS H H 8.21 0.02 1 113 14 18 LYS HA H 4.24 0.02 1 114 14 18 LYS HB2 H 1.77 0.02 2 115 14 18 LYS HB3 H 1.77 0.02 2 116 14 18 LYS HG2 H 1.40 0.02 2 117 14 18 LYS HG3 H 1.40 0.02 2 118 14 18 LYS C C 176.76 0.30 1 119 14 18 LYS CA C 56.66 0.30 1 120 14 18 LYS CB C 32.88 0.30 1 121 14 18 LYS CG C 24.89 0.30 1 122 14 18 LYS N N 121.67 0.30 1 123 15 19 GLN H H 8.26 0.02 1 124 15 19 GLN HA H 4.24 0.02 1 125 15 19 GLN HB2 H 1.96 0.02 2 126 15 19 GLN HB3 H 1.96 0.02 2 127 15 19 GLN HG2 H 2.30 0.02 2 128 15 19 GLN HG3 H 2.30 0.02 2 129 15 19 GLN C C 175.97 0.30 1 130 15 19 GLN CA C 55.96 0.30 1 131 15 19 GLN CB C 29.10 0.30 1 132 15 19 GLN CG C 33.77 0.30 1 133 15 19 GLN N N 120.51 0.30 1 134 16 20 LEU H H 8.11 0.02 1 135 16 20 LEU HA H 4.21 0.02 1 136 16 20 LEU HB2 H 1.50 0.02 2 137 16 20 LEU HB3 H 1.40 0.02 2 138 16 20 LEU HD1 H 0.87 0.02 2 139 16 20 LEU HD2 H 0.87 0.02 2 140 16 20 LEU C C 177.11 0.30 1 141 16 20 LEU CA C 55.47 0.30 1 142 16 20 LEU CB C 42.37 0.30 1 143 16 20 LEU CD1 C 24.82 0.30 2 144 16 20 LEU CD2 C 24.82 0.30 2 145 16 20 LEU N N 122.60 0.30 1 146 17 21 TYR H H 7.97 0.02 1 147 17 21 TYR HB2 H 3.02 0.02 2 148 17 21 TYR HB3 H 2.91 0.02 2 149 17 21 TYR C C 175.44 0.30 1 150 17 21 TYR CA C 57.67 0.30 1 151 17 21 TYR CB C 38.64 0.30 1 152 17 21 TYR N N 119.38 0.30 1 153 18 22 ASN H H 8.17 0.02 1 154 18 22 ASN HB2 H 2.66 0.02 2 155 18 22 ASN HB3 H 2.66 0.02 2 156 18 22 ASN C C 174.62 0.30 1 157 18 22 ASN CA C 53.00 0.30 1 158 18 22 ASN CB C 38.79 0.30 1 159 18 22 ASN N N 119.99 0.30 1 160 19 23 LYS H H 7.98 0.02 1 161 19 23 LYS CA C 56.45 0.30 1 162 19 23 LYS CB C 32.88 0.30 1 163 19 23 LYS N N 121.32 0.30 1 164 21 25 PRO HA H 4.37 0.02 1 165 21 25 PRO HB2 H 2.24 0.02 2 166 21 25 PRO HB3 H 2.24 0.02 2 167 21 25 PRO C C 176.75 0.30 1 168 21 25 PRO CA C 63.56 0.30 1 169 21 25 PRO CB C 32.04 0.30 1 170 22 26 ASP H H 8.29 0.02 1 171 22 26 ASP HB2 H 2.63 0.02 2 172 22 26 ASP HB3 H 2.63 0.02 2 173 22 26 ASP C C 176.12 0.30 1 174 22 26 ASP CA C 54.48 0.30 1 175 22 26 ASP CB C 41.11 0.30 1 176 22 26 ASP N N 119.63 0.30 1 177 23 27 ALA H H 8.10 0.02 1 178 23 27 ALA HA H 4.29 0.02 1 179 23 27 ALA HB H 1.38 0.02 1 180 23 27 ALA C C 177.73 0.30 1 181 23 27 ALA CA C 52.72 0.30 1 182 23 27 ALA CB C 19.44 0.30 1 183 23 27 ALA N N 123.64 0.30 1 184 24 28 VAL H H 7.95 0.02 1 185 24 28 VAL HA H 3.97 0.02 1 186 24 28 VAL HB H 2.01 0.02 1 187 24 28 VAL HG1 H 0.89 0.02 2 188 24 28 VAL HG2 H 0.89 0.02 2 189 24 28 VAL C C 176.05 0.30 1 190 24 28 VAL CA C 62.43 0.30 1 191 24 28 VAL CB C 32.71 0.30 1 192 24 28 VAL CG2 C 20.68 0.30 2 193 24 28 VAL N N 118.74 0.30 1 194 25 29 ALA H H 8.22 0.02 1 195 25 29 ALA HA H 4.17 0.02 1 196 25 29 ALA HB H 1.18 0.02 1 197 25 29 ALA C C 177.95 0.30 1 198 25 29 ALA CA C 52.56 0.30 1 199 25 29 ALA CB C 18.89 0.30 1 200 25 29 ALA N N 126.85 0.30 1 201 26 30 THR H H 7.91 0.02 1 202 26 30 THR HB H 4.15 0.02 1 203 26 30 THR HG2 H 1.13 0.02 1 204 26 30 THR C C 174.45 0.30 1 205 26 30 THR CA C 62.36 0.30 1 206 26 30 THR CB C 69.70 0.30 1 207 26 30 THR CG2 C 21.61 0.30 1 208 26 30 THR N N 112.99 0.30 1 209 27 31 TRP H H 7.84 0.02 1 210 27 31 TRP HB2 H 3.26 0.02 2 211 27 31 TRP HB3 H 3.26 0.02 2 212 27 31 TRP C C 175.71 0.30 1 213 27 31 TRP CA C 57.30 0.30 1 214 27 31 TRP CB C 29.24 0.30 1 215 27 31 TRP N N 122.05 0.30 1 216 28 32 LEU H H 7.71 0.02 1 217 28 32 LEU CA C 54.62 0.30 1 218 28 32 LEU CB C 42.38 0.30 1 219 28 32 LEU N N 123.49 0.30 1 220 29 33 ASN H H 8.13 0.02 1 221 29 33 ASN CA C 51.00 0.30 1 222 29 33 ASN N N 120.48 0.30 1 223 32 36 PRO HA H 4.41 0.02 1 224 32 36 PRO HB2 H 2.27 0.02 2 225 32 36 PRO HB3 H 1.88 0.02 2 226 32 36 PRO C C 177.55 0.30 1 227 32 36 PRO CA C 64.00 0.30 1 228 32 36 PRO CB C 32.09 0.30 1 229 33 37 SER H H 8.44 0.02 1 230 33 37 SER HB2 H 3.91 0.02 2 231 33 37 SER HB3 H 3.91 0.02 2 232 33 37 SER C C 174.98 0.30 1 233 33 37 SER CA C 59.56 0.30 1 234 33 37 SER CB C 63.54 0.30 1 235 33 37 SER N N 115.10 0.30 1 236 34 38 GLN H H 7.95 0.02 1 237 34 38 GLN HA H 4.32 0.02 1 238 34 38 GLN HG2 H 2.32 0.02 2 239 34 38 GLN HG3 H 2.32 0.02 2 240 34 38 GLN C C 176.06 0.30 1 241 34 38 GLN CA C 55.90 0.30 1 242 34 38 GLN CB C 29.09 0.30 1 243 34 38 GLN CG C 33.81 0.30 1 244 34 38 GLN N N 121.29 0.30 1 245 35 39 LYS H H 8.13 0.02 1 246 35 39 LYS C C 176.73 0.30 1 247 35 39 LYS CA C 56.70 0.30 1 248 35 39 LYS CB C 32.85 0.30 1 249 35 39 LYS N N 121.75 0.30 1 250 36 40 GLN H H 8.36 0.02 1 251 36 40 GLN HA H 4.28 0.02 1 252 36 40 GLN HG2 H 2.33 0.02 2 253 36 40 GLN HG3 H 2.33 0.02 2 254 36 40 GLN C C 175.74 0.30 1 255 36 40 GLN CA C 56.08 0.30 1 256 36 40 GLN CB C 29.51 0.30 1 257 36 40 GLN CG C 33.78 0.30 1 258 36 40 GLN N N 120.63 0.30 1 259 37 41 ASN H H 8.43 0.02 1 260 37 41 ASN HA H 4.66 0.02 1 261 37 41 ASN HB2 H 2.78 0.02 2 262 37 41 ASN HB3 H 2.78 0.02 2 263 37 41 ASN C C 175.12 0.30 1 264 37 41 ASN CA C 53.26 0.30 1 265 37 41 ASN CB C 38.65 0.30 1 266 37 41 ASN N N 119.72 0.30 1 267 38 42 LEU H H 8.17 0.02 1 268 38 42 LEU HB2 H 1.60 0.02 2 269 38 42 LEU HB3 H 1.60 0.02 2 270 38 42 LEU C C 177.15 0.30 1 271 38 42 LEU CA C 55.41 0.30 1 272 38 42 LEU CB C 42.28 0.30 1 273 38 42 LEU N N 122.50 0.30 1 274 39 43 LEU H H 8.08 0.02 1 275 39 43 LEU HA H 4.33 0.02 1 276 39 43 LEU HB2 H 1.59 0.02 2 277 39 43 LEU HB3 H 1.59 0.02 2 278 39 43 LEU HD1 H 0.91 0.02 2 279 39 43 LEU HD2 H 0.84 0.02 2 280 39 43 LEU C C 176.63 0.30 1 281 39 43 LEU CA C 54.79 0.30 1 282 39 43 LEU CB C 42.32 0.30 1 283 39 43 LEU CD1 C 24.94 0.30 2 284 39 43 LEU CD2 C 23.38 0.30 2 285 39 43 LEU N N 122.00 0.30 1 286 40 44 ALA H H 8.05 0.02 1 287 40 44 ALA CA C 50.43 0.30 1 288 40 44 ALA CB C 17.90 0.30 1 289 40 44 ALA N N 125.74 0.30 1 290 41 45 PRO HA H 4.38 0.02 1 291 41 45 PRO C C 177.18 0.30 1 292 41 45 PRO CA C 63.25 0.30 1 293 41 45 PRO CB C 32.05 0.30 1 294 42 46 GLN H H 8.52 0.02 1 295 42 46 GLN HA H 4.26 0.02 1 296 42 46 GLN HG2 H 2.38 0.02 2 297 42 46 GLN HG3 H 2.38 0.02 2 298 42 46 GLN C C 175.84 0.30 1 299 42 46 GLN CA C 55.96 0.30 1 300 42 46 GLN CB C 29.45 0.30 1 301 42 46 GLN CG C 33.80 0.30 1 302 42 46 GLN N N 120.26 0.30 1 303 43 47 ASN H H 8.38 0.02 1 304 43 47 ASN HB2 H 2.77 0.02 2 305 43 47 ASN HB3 H 2.77 0.02 2 306 43 47 ASN C C 174.72 0.30 1 307 43 47 ASN CA C 53.17 0.30 1 308 43 47 ASN CB C 39.06 0.30 1 309 43 47 ASN N N 119.53 0.30 1 310 44 48 ALA H H 8.21 0.02 1 311 44 48 ALA HA H 4.33 0.02 1 312 44 48 ALA HB H 1.36 0.02 1 313 44 48 ALA C C 177.56 0.30 1 314 44 48 ALA CA C 52.57 0.30 1 315 44 48 ALA CB C 19.43 0.30 1 316 44 48 ALA N N 124.41 0.30 1 317 45 49 VAL H H 8.12 0.02 1 318 45 49 VAL HA H 4.15 0.02 1 319 45 49 VAL HB H 2.07 0.02 1 320 45 49 VAL HG1 H 0.93 0.02 2 321 45 49 VAL HG2 H 0.92 0.02 2 322 45 49 VAL C C 176.28 0.30 1 323 45 49 VAL CA C 62.22 0.30 1 324 45 49 VAL CB C 32.89 0.30 1 325 45 49 VAL CG1 C 21.12 0.30 2 326 45 49 VAL CG2 C 20.50 0.30 2 327 45 49 VAL N N 119.29 0.30 1 328 46 50 SER H H 8.42 0.02 1 329 46 50 SER HB2 H 3.88 0.02 2 330 46 50 SER HB3 H 3.88 0.02 2 331 46 50 SER C C 174.70 0.30 1 332 46 50 SER CA C 58.14 0.30 1 333 46 50 SER CB C 64.07 0.30 1 334 46 50 SER N N 119.69 0.30 1 335 47 51 SER H H 8.45 0.02 1 336 47 51 SER HB2 H 3.88 0.02 2 337 47 51 SER HB3 H 3.88 0.02 2 338 47 51 SER C C 174.60 0.30 1 339 47 51 SER CA C 58.57 0.30 1 340 47 51 SER CB C 63.86 0.30 1 341 47 51 SER N N 118.39 0.30 1 342 48 52 GLU H H 8.44 0.02 1 343 48 52 GLU HA H 4.29 0.02 1 344 48 52 GLU HB2 H 2.07 0.02 2 345 48 52 GLU HB3 H 2.07 0.02 2 346 48 52 GLU HG2 H 2.24 0.02 2 347 48 52 GLU HG3 H 2.24 0.02 2 348 48 52 GLU C C 176.58 0.30 1 349 48 52 GLU CA C 56.80 0.30 1 350 48 52 GLU CB C 30.30 0.30 1 351 48 52 GLU CG C 36.25 0.30 1 352 48 52 GLU N N 122.42 0.30 1 353 49 53 GLU H H 8.36 0.02 1 354 49 53 GLU HA H 4.31 0.02 1 355 49 53 GLU HB2 H 2.00 0.02 2 356 49 53 GLU HB3 H 2.00 0.02 2 357 49 53 GLU HG2 H 2.25 0.02 2 358 49 53 GLU HG3 H 2.25 0.02 2 359 49 53 GLU C C 176.72 0.30 1 360 49 53 GLU CA C 56.72 0.30 1 361 49 53 GLU CB C 30.37 0.30 1 362 49 53 GLU CG C 36.29 0.30 1 363 49 53 GLU N N 121.58 0.30 1 364 50 54 THR H H 8.14 0.02 1 365 50 54 THR HA H 4.32 0.02 1 366 50 54 THR HB H 4.22 0.02 1 367 50 54 THR HG2 H 1.17 0.02 1 368 50 54 THR C C 174.36 0.30 1 369 50 54 THR CA C 61.78 0.30 1 370 50 54 THR CB C 69.75 0.30 1 371 50 54 THR CG2 C 21.51 0.30 1 372 50 54 THR N N 114.80 0.30 1 373 51 55 ASN H H 8.43 0.02 1 374 51 55 ASN HA H 4.68 0.02 1 375 51 55 ASN HB2 H 2.71 0.02 2 376 51 55 ASN HB3 H 2.71 0.02 2 377 51 55 ASN C C 174.79 0.30 1 378 51 55 ASN CA C 53.36 0.30 1 379 51 55 ASN CB C 39.15 0.30 1 380 51 55 ASN N N 121.03 0.30 1 381 52 56 ASP H H 8.26 0.02 1 382 52 56 ASP HA H 4.53 0.02 1 383 52 56 ASP HB2 H 2.54 0.02 2 384 52 56 ASP HB3 H 2.54 0.02 2 385 52 56 ASP C C 175.90 0.30 1 386 52 56 ASP CA C 54.39 0.30 1 387 52 56 ASP CB C 41.02 0.30 1 388 52 56 ASP N N 120.78 0.30 1 389 53 57 PHE H H 8.11 0.02 1 390 53 57 PHE HB2 H 3.08 0.02 2 391 53 57 PHE HB3 H 3.08 0.02 2 392 53 57 PHE C C 175.65 0.30 1 393 53 57 PHE CA C 57.92 0.30 1 394 53 57 PHE CB C 39.20 0.30 1 395 53 57 PHE N N 120.39 0.30 1 396 54 58 LYS H H 8.09 0.02 1 397 54 58 LYS HA H 4.24 0.02 1 398 54 58 LYS HB2 H 1.72 0.02 2 399 54 58 LYS HB3 H 1.72 0.02 2 400 54 58 LYS HG2 H 1.34 0.02 2 401 54 58 LYS HG3 H 1.34 0.02 2 402 54 58 LYS HD2 H 1.63 0.02 2 403 54 58 LYS HD3 H 1.63 0.02 2 404 54 58 LYS HE2 H 2.97 0.02 2 405 54 58 LYS HE3 H 2.97 0.02 2 406 54 58 LYS C C 176.05 0.30 1 407 54 58 LYS CA C 56.13 0.30 1 408 54 58 LYS CB C 32.99 0.30 1 409 54 58 LYS CG C 24.65 0.30 1 410 54 58 LYS CD C 29.03 0.30 1 411 54 58 LYS CE C 42.20 0.30 1 412 54 58 LYS N N 123.23 0.30 1 413 55 59 GLN H H 8.31 0.02 1 414 55 59 GLN HA H 4.26 0.02 1 415 55 59 GLN HB2 H 2.02 0.02 2 416 55 59 GLN HB3 H 2.02 0.02 2 417 55 59 GLN HG2 H 2.34 0.02 2 418 55 59 GLN HG3 H 2.34 0.02 2 419 55 59 GLN C C 175.90 0.30 1 420 55 59 GLN CA C 55.87 0.30 1 421 55 59 GLN CB C 29.58 0.30 1 422 55 59 GLN CG C 33.83 0.30 1 423 55 59 GLN N N 121.83 0.30 1 424 56 60 GLU H H 8.53 0.02 1 425 56 60 GLU HA H 4.32 0.02 1 426 56 60 GLU HB2 H 1.99 0.02 2 427 56 60 GLU HB3 H 1.99 0.02 2 428 56 60 GLU HG2 H 2.24 0.02 2 429 56 60 GLU HG3 H 2.24 0.02 2 430 56 60 GLU C C 176.46 0.30 1 431 56 60 GLU CA C 56.65 0.30 1 432 56 60 GLU CB C 30.50 0.30 1 433 56 60 GLU CG C 36.24 0.30 1 434 56 60 GLU N N 122.71 0.30 1 435 57 61 THR H H 8.25 0.02 1 436 57 61 THR HA H 4.30 0.02 1 437 57 61 THR HB H 4.12 0.02 1 438 57 61 THR HG2 H 1.17 0.02 1 439 57 61 THR C C 174.20 0.30 1 440 57 61 THR CA C 61.86 0.30 1 441 57 61 THR CB C 69.80 0.30 1 442 57 61 THR CG2 C 21.74 0.30 1 443 57 61 THR N N 116.29 0.30 1 444 58 62 LEU H H 8.38 0.02 1 445 58 62 LEU CA C 52.93 0.30 1 446 58 62 LEU CB C 41.59 0.30 1 447 58 62 LEU N N 126.80 0.30 1 448 59 63 PRO HA H 4.43 0.02 1 449 59 63 PRO HB2 H 2.29 0.02 2 450 59 63 PRO HB3 H 1.90 0.02 2 451 59 63 PRO HG2 H 2.00 0.02 2 452 59 63 PRO HG3 H 2.00 0.02 2 453 59 63 PRO C C 177.00 0.30 1 454 59 63 PRO CA C 63.17 0.30 1 455 59 63 PRO CB C 32.08 0.30 1 456 59 63 PRO CG C 27.47 0.30 1 457 60 64 SER H H 8.37 0.02 1 458 60 64 SER HB2 H 3.86 0.02 2 459 60 64 SER HB3 H 3.86 0.02 2 460 60 64 SER C C 174.75 0.30 1 461 60 64 SER CA C 58.32 0.30 1 462 60 64 SER CB C 63.97 0.30 1 463 60 64 SER N N 116.19 0.30 1 464 61 65 LYS H H 8.39 0.02 1 465 61 65 LYS C C 176.70 0.30 1 466 61 65 LYS CA C 56.33 0.30 1 467 61 65 LYS CB C 33.04 0.30 1 468 61 65 LYS N N 123.39 0.30 1 469 62 66 SER H H 8.38 0.02 1 470 62 66 SER HB2 H 3.85 0.02 2 471 62 66 SER HB3 H 3.85 0.02 2 472 62 66 SER C C 174.48 0.30 1 473 62 66 SER CA C 58.46 0.30 1 474 62 66 SER CB C 63.88 0.30 1 475 62 66 SER N N 117.02 0.30 1 476 63 67 ASN H H 8.51 0.02 1 477 63 67 ASN HA H 4.72 0.02 1 478 63 67 ASN HB2 H 2.79 0.02 2 479 63 67 ASN HB3 H 2.79 0.02 2 480 63 67 ASN C C 175.22 0.30 1 481 63 67 ASN CA C 53.40 0.30 1 482 63 67 ASN CB C 38.92 0.30 1 483 63 67 ASN N N 120.90 0.30 1 484 64 68 GLU H H 8.31 0.02 1 485 64 68 GLU HA H 4.27 0.02 1 486 64 68 GLU HB2 H 2.03 0.02 2 487 64 68 GLU HB3 H 1.89 0.02 2 488 64 68 GLU HG2 H 2.23 0.02 2 489 64 68 GLU HG3 H 2.23 0.02 2 490 64 68 GLU C C 176.36 0.30 1 491 64 68 GLU CA C 56.69 0.30 1 492 64 68 GLU CB C 30.37 0.30 1 493 64 68 GLU CG C 36.22 0.30 1 494 64 68 GLU N N 120.97 0.30 1 495 67 71 ASP H H 8.34 0.02 1 496 67 71 ASP HB2 H 2.58 0.02 2 497 67 71 ASP HB3 H 2.58 0.02 2 498 67 71 ASP C C 175.92 0.30 1 499 67 71 ASP CA C 54.57 0.30 1 500 67 71 ASP CB C 41.22 0.30 1 501 67 71 ASP N N 121.00 0.30 1 502 68 72 HIS H H 8.46 0.02 1 503 68 72 HIS HA H 4.64 0.02 1 504 68 72 HIS HB2 H 3.21 0.02 2 505 68 72 HIS HB3 H 3.21 0.02 2 506 68 72 HIS C C 174.66 0.30 1 507 68 72 HIS CA C 55.84 0.30 1 508 68 72 HIS CB C 29.03 0.30 1 509 68 72 HIS N N 118.57 0.30 1 510 69 73 MET H H 8.40 0.02 1 511 69 73 MET HA H 4.45 0.02 1 512 69 73 MET HG2 H 2.52 0.02 2 513 69 73 MET HG3 H 2.52 0.02 2 514 69 73 MET C C 176.00 0.30 1 515 69 73 MET CA C 55.72 0.30 1 516 69 73 MET CB C 32.87 0.30 1 517 69 73 MET CG C 32.01 0.30 1 518 69 73 MET N N 121.78 0.30 1 519 70 74 ASP H H 8.39 0.02 1 520 70 74 ASP HA H 4.60 0.02 1 521 70 74 ASP HB2 H 2.68 0.02 2 522 70 74 ASP HB3 H 2.64 0.02 2 523 70 74 ASP C C 175.90 0.30 1 524 70 74 ASP CA C 54.62 0.30 1 525 70 74 ASP CB C 41.26 0.30 1 526 70 74 ASP N N 120.98 0.30 1 527 71 75 ASP H H 8.22 0.02 1 528 71 75 ASP HA H 4.56 0.02 1 529 71 75 ASP HB2 H 2.67 0.02 2 530 71 75 ASP HB3 H 2.67 0.02 2 531 71 75 ASP C C 176.16 0.30 1 532 71 75 ASP CA C 54.52 0.30 1 533 71 75 ASP CB C 40.97 0.30 1 534 71 75 ASP N N 119.98 0.30 1 535 72 76 MET H H 8.23 0.02 1 536 72 76 MET HA H 4.47 0.02 1 537 72 76 MET HG2 H 2.54 0.02 2 538 72 76 MET HG3 H 2.54 0.02 2 539 72 76 MET C C 175.98 0.30 1 540 72 76 MET CA C 55.45 0.30 1 541 72 76 MET CB C 33.07 0.30 1 542 72 76 MET CG C 32.03 0.30 1 543 72 76 MET N N 120.10 0.30 1 544 73 77 ASP H H 8.36 0.02 1 545 73 77 ASP HA H 4.33 0.02 1 546 73 77 ASP HB2 H 2.65 0.02 2 547 73 77 ASP HB3 H 2.65 0.02 2 548 73 77 ASP C C 175.89 0.30 1 549 73 77 ASP CA C 54.42 0.30 1 550 73 77 ASP CB C 41.34 0.30 1 551 73 77 ASP N N 121.80 0.30 1 552 74 78 ASP H H 8.30 0.02 1 553 74 78 ASP HB2 H 2.64 0.02 2 554 74 78 ASP HB3 H 2.64 0.02 2 555 74 78 ASP C C 176.25 0.30 1 556 74 78 ASP CA C 54.32 0.30 1 557 74 78 ASP CB C 41.34 0.30 1 558 74 78 ASP N N 121.06 0.30 1 559 75 79 GLU H H 8.35 0.02 1 560 75 79 GLU HA H 4.26 0.02 1 561 75 79 GLU HB2 H 1.92 0.02 2 562 75 79 GLU HB3 H 1.92 0.02 2 563 75 79 GLU HG2 H 2.24 0.02 2 564 75 79 GLU HG3 H 2.24 0.02 2 565 75 79 GLU C C 176.19 0.30 1 566 75 79 GLU CA C 56.51 0.30 1 567 75 79 GLU CB C 30.46 0.30 1 568 75 79 GLU CG C 36.19 0.30 1 569 75 79 GLU N N 121.20 0.30 1 570 76 80 ASP H H 8.39 0.02 1 571 76 80 ASP HB2 H 2.67 0.02 2 572 76 80 ASP HB3 H 2.67 0.02 2 573 76 80 ASP C C 175.94 0.30 1 574 76 80 ASP CA C 54.28 0.30 1 575 76 80 ASP CB C 41.45 0.30 1 576 76 80 ASP N N 121.77 0.30 1 577 77 81 ASP H H 8.30 0.02 1 578 77 81 ASP HB2 H 2.66 0.02 2 579 77 81 ASP HB3 H 2.66 0.02 2 580 77 81 ASP C C 176.12 0.30 1 581 77 81 ASP CA C 54.25 0.30 1 582 77 81 ASP CB C 41.38 0.30 1 583 77 81 ASP N N 121.47 0.30 1 584 78 82 ASP H H 8.30 0.02 1 585 78 82 ASP HA H 4.57 0.02 1 586 78 82 ASP HB2 H 2.62 0.02 2 587 78 82 ASP HB3 H 2.62 0.02 2 588 78 82 ASP C C 176.03 0.30 1 589 78 82 ASP CA C 54.53 0.30 1 590 78 82 ASP CB C 41.34 0.30 1 591 78 82 ASP N N 121.09 0.30 1 592 79 83 ASP H H 8.26 0.02 1 593 79 83 ASP HA H 4.55 0.02 1 594 79 83 ASP HB2 H 2.62 0.02 2 595 79 83 ASP HB3 H 2.62 0.02 2 596 79 83 ASP C C 176.18 0.30 1 597 79 83 ASP CA C 54.32 0.30 1 598 79 83 ASP CB C 40.98 0.30 1 599 79 83 ASP N N 120.56 0.30 1 600 80 84 HIS H H 8.32 0.02 1 601 80 84 HIS HA H 4.62 0.02 1 602 80 84 HIS HB2 H 3.22 0.02 2 603 80 84 HIS HB3 H 3.22 0.02 2 604 80 84 HIS C C 174.52 0.30 1 605 80 84 HIS CA C 55.78 0.30 1 606 80 84 HIS CB C 28.78 0.30 1 607 80 84 HIS N N 118.80 0.30 1 608 81 85 VAL H H 8.13 0.02 1 609 81 85 VAL HA H 4.08 0.02 1 610 81 85 VAL HB H 2.03 0.02 1 611 81 85 VAL HG1 H 0.89 0.02 2 612 81 85 VAL HG2 H 0.89 0.02 2 613 81 85 VAL C C 175.84 0.30 1 614 81 85 VAL CA C 62.34 0.30 1 615 81 85 VAL CB C 32.93 0.30 1 616 81 85 VAL CG1 C 21.03 0.30 2 617 81 85 VAL CG2 C 20.67 0.30 2 618 81 85 VAL N N 121.80 0.30 1 619 82 86 ASP H H 8.53 0.02 1 620 82 86 ASP HA H 4.66 0.02 1 621 82 86 ASP HB2 H 2.71 0.02 2 622 82 86 ASP HB3 H 2.62 0.02 2 623 82 86 ASP C C 176.31 0.30 1 624 82 86 ASP CA C 54.40 0.30 1 625 82 86 ASP CB C 41.39 0.30 1 626 82 86 ASP N N 124.64 0.30 1 627 83 87 SER H H 8.30 0.02 1 628 83 87 SER HB2 H 3.87 0.02 2 629 83 87 SER HB3 H 3.87 0.02 2 630 83 87 SER C C 174.81 0.30 1 631 83 87 SER CA C 58.44 0.30 1 632 83 87 SER CB C 63.85 0.30 1 633 83 87 SER N N 116.74 0.30 1 634 84 88 GLN H H 8.50 0.02 1 635 84 88 GLN HA H 4.34 0.02 1 636 84 88 GLN HB2 H 2.14 0.02 2 637 84 88 GLN HB3 H 1.99 0.02 2 638 84 88 GLN HG2 H 2.35 0.02 2 639 84 88 GLN HG3 H 2.35 0.02 2 640 84 88 GLN C C 175.82 0.30 1 641 84 88 GLN CA C 56.02 0.30 1 642 84 88 GLN CB C 29.41 0.30 1 643 84 88 GLN CG C 33.85 0.30 1 644 84 88 GLN N N 122.24 0.30 1 645 85 89 ASP H H 8.31 0.02 1 646 85 89 ASP HA H 4.61 0.02 1 647 85 89 ASP HB2 H 2.64 0.02 2 648 85 89 ASP HB3 H 2.64 0.02 2 649 85 89 ASP C C 176.27 0.30 1 650 85 89 ASP CA C 54.62 0.30 1 651 85 89 ASP CB C 41.23 0.30 1 652 85 89 ASP N N 121.22 0.30 1 653 86 90 SER H H 8.21 0.02 1 654 86 90 SER HB2 H 3.85 0.02 2 655 86 90 SER HB3 H 3.85 0.02 2 656 86 90 SER C C 174.54 0.30 1 657 86 90 SER CA C 58.23 0.30 1 658 86 90 SER CB C 63.92 0.30 1 659 86 90 SER N N 115.94 0.30 1 660 87 91 ILE H H 8.14 0.02 1 661 87 91 ILE HA H 4.18 0.02 1 662 87 91 ILE HB H 1.87 0.02 1 663 87 91 ILE HG12 H 1.14 0.02 2 664 87 91 ILE HG13 H 1.14 0.02 2 665 87 91 ILE HG2 H 0.88 0.02 1 666 87 91 ILE HD1 H 0.84 0.02 1 667 87 91 ILE C C 176.00 0.30 1 668 87 91 ILE CA C 61.20 0.30 1 669 87 91 ILE CB C 38.88 0.30 1 670 87 91 ILE CG1 C 27.39 0.30 1 671 87 91 ILE CG2 C 17.49 0.30 1 672 87 91 ILE CD1 C 12.99 0.30 1 673 87 91 ILE N N 122.42 0.30 1 674 88 92 ASP H H 8.40 0.02 1 675 88 92 ASP HB2 H 2.69 0.02 2 676 88 92 ASP HB3 H 2.61 0.02 2 677 88 92 ASP C C 176.20 0.30 1 678 88 92 ASP CA C 54.32 0.30 1 679 88 92 ASP CB C 41.36 0.30 1 680 88 92 ASP N N 124.53 0.30 1 681 89 93 SER H H 8.26 0.02 1 682 89 93 SER HB2 H 3.86 0.02 2 683 89 93 SER HB3 H 3.86 0.02 2 684 89 93 SER C C 174.40 0.30 1 685 89 93 SER CA C 58.35 0.30 1 686 89 93 SER CB C 63.92 0.30 1 687 89 93 SER N N 116.74 0.30 1 688 90 94 ASN H H 8.53 0.02 1 689 90 94 ASN HA H 4.74 0.02 1 690 90 94 ASN HB2 H 2.80 0.02 2 691 90 94 ASN HB3 H 2.80 0.02 2 692 90 94 ASN C C 175.02 0.30 1 693 90 94 ASN CA C 53.39 0.30 1 694 90 94 ASN CB C 39.19 0.30 1 695 90 94 ASN N N 121.08 0.30 1 696 91 95 ASP H H 8.33 0.02 1 697 91 95 ASP HA H 4.62 0.02 1 698 91 95 ASP HB2 H 2.65 0.02 2 699 91 95 ASP HB3 H 2.65 0.02 2 700 91 95 ASP C C 176.27 0.30 1 701 91 95 ASP CA C 54.57 0.30 1 702 91 95 ASP CB C 41.20 0.30 1 703 91 95 ASP N N 121.29 0.30 1 704 92 96 SER H H 8.22 0.02 1 705 92 96 SER HB2 H 3.86 0.02 2 706 92 96 SER HB3 H 3.86 0.02 2 707 92 96 SER C C 174.35 0.30 1 708 92 96 SER CA C 58.37 0.30 1 709 92 96 SER CB C 64.08 0.30 1 710 92 96 SER N N 115.80 0.30 1 711 93 97 ASP H H 8.38 0.02 1 712 93 97 ASP HA H 4.63 0.02 1 713 93 97 ASP HB2 H 2.64 0.02 2 714 93 97 ASP HB3 H 2.64 0.02 2 715 93 97 ASP C C 175.92 0.30 1 716 93 97 ASP CA C 54.46 0.30 1 717 93 97 ASP CB C 41.22 0.30 1 718 93 97 ASP N N 122.60 0.30 1 719 94 98 ASP H H 8.26 0.02 1 720 94 98 ASP HA H 4.62 0.02 1 721 94 98 ASP HB2 H 2.64 0.02 2 722 94 98 ASP HB3 H 2.64 0.02 2 723 94 98 ASP C C 176.11 0.30 1 724 94 98 ASP CA C 54.40 0.30 1 725 94 98 ASP CB C 41.13 0.30 1 726 94 98 ASP N N 120.89 0.30 1 727 95 99 VAL H H 8.03 0.02 1 728 95 99 VAL HA H 4.11 0.02 1 729 95 99 VAL HB H 2.07 0.02 1 730 95 99 VAL HG1 H 0.90 0.02 2 731 95 99 VAL HG2 H 0.90 0.02 2 732 95 99 VAL C C 175.81 0.30 1 733 95 99 VAL CA C 62.07 0.30 1 734 95 99 VAL CB C 33.01 0.30 1 735 95 99 VAL CG1 C 21.17 0.30 2 736 95 99 VAL CG2 C 20.31 0.30 2 737 95 99 VAL N N 119.98 0.30 1 738 96 100 ASP H H 8.41 0.02 1 739 96 100 ASP HB2 H 2.71 0.02 2 740 96 100 ASP HB3 H 2.63 0.02 2 741 96 100 ASP C C 175.95 0.30 1 742 96 100 ASP CA C 54.21 0.30 1 743 96 100 ASP CB C 41.40 0.30 1 744 96 100 ASP N N 124.32 0.30 1 745 97 101 ASP H H 8.35 0.02 1 746 97 101 ASP HA H 4.66 0.02 1 747 97 101 ASP HB2 H 2.68 0.02 2 748 97 101 ASP C C 176.59 0.30 1 749 97 101 ASP CA C 54.20 0.30 1 750 97 101 ASP CB C 41.07 0.30 1 751 97 101 ASP N N 122.29 0.30 1 752 98 102 THR H H 8.19 0.02 1 753 98 102 THR HB H 4.24 0.02 1 754 98 102 THR HG2 H 1.19 0.02 1 755 98 102 THR C C 174.65 0.30 1 756 98 102 THR CA C 62.24 0.30 1 757 98 102 THR CB C 69.85 0.30 1 758 98 102 THR CG2 C 21.58 0.30 1 759 98 102 THR N N 114.15 0.30 1 760 99 103 ASP H H 8.35 0.02 1 761 99 103 ASP HA H 4.61 0.02 1 762 99 103 ASP HB2 H 2.70 0.02 2 763 99 103 ASP HB3 H 2.70 0.02 2 764 99 103 ASP C C 176.20 0.30 1 765 99 103 ASP CA C 54.42 0.30 1 766 99 103 ASP CB C 41.26 0.30 1 767 99 103 ASP N N 122.82 0.30 1 768 100 104 ASP H H 8.34 0.02 1 769 100 104 ASP HA H 4.59 0.02 1 770 100 104 ASP HB2 H 2.66 0.02 2 771 100 104 ASP HB3 H 2.66 0.02 2 772 100 104 ASP C C 176.81 0.30 1 773 100 104 ASP CA C 54.51 0.30 1 774 100 104 ASP CB C 40.99 0.30 1 775 100 104 ASP N N 122.08 0.30 1 776 101 105 SER H H 8.29 0.02 1 777 101 105 SER HB2 H 3.85 0.02 2 778 101 105 SER HB3 H 3.85 0.02 2 779 101 105 SER C C 174.92 0.30 1 780 101 105 SER CA C 59.26 0.30 1 781 101 105 SER CB C 63.62 0.30 1 782 101 105 SER N N 116.05 0.30 1 783 102 106 HIS H H 8.36 0.02 1 784 102 106 HIS HA H 4.64 0.02 1 785 102 106 HIS HB2 H 3.29 0.02 2 786 102 106 HIS HB3 H 3.17 0.02 2 787 102 106 HIS C C 174.69 0.30 1 788 102 106 HIS CA C 55.78 0.30 1 789 102 106 HIS CB C 28.81 0.30 1 790 102 106 HIS N N 119.98 0.30 1 791 103 107 GLN H H 8.29 0.02 1 792 103 107 GLN HA H 4.33 0.02 1 793 103 107 GLN HB2 H 2.12 0.02 2 794 103 107 GLN HB3 H 2.12 0.02 2 795 103 107 GLN HG2 H 2.35 0.02 2 796 103 107 GLN HG3 H 2.35 0.02 2 797 103 107 GLN C C 176.13 0.30 1 798 103 107 GLN CA C 56.17 0.30 1 799 103 107 GLN CB C 29.48 0.30 1 800 103 107 GLN CG C 33.79 0.30 1 801 103 107 GLN N N 121.24 0.30 1 802 104 108 SER H H 8.43 0.02 1 803 104 108 SER HB2 H 3.87 0.02 2 804 104 108 SER HB3 H 3.87 0.02 2 805 104 108 SER C C 174.36 0.30 1 806 104 108 SER CA C 58.37 0.30 1 807 104 108 SER CB C 64.05 0.30 1 808 104 108 SER N N 117.01 0.30 1 809 105 109 ASP H H 8.38 0.02 1 810 105 109 ASP HA H 4.62 0.02 1 811 105 109 ASP HB2 H 2.70 0.02 2 812 105 109 ASP HB3 H 2.70 0.02 2 813 105 109 ASP C C 176.55 0.30 1 814 105 109 ASP CA C 54.46 0.30 1 815 105 109 ASP CB C 41.14 0.30 1 816 105 109 ASP N N 122.65 0.30 1 817 106 110 GLU H H 8.46 0.02 1 818 106 110 GLU CA C 56.61 0.30 1 819 106 110 GLU CB C 29.83 0.30 1 820 106 110 GLU N N 121.59 0.30 1 821 107 111 SER H H 8.32 0.02 1 822 107 111 SER CA C 58.94 0.30 1 823 107 111 SER CB C 63.8 0.30 1 824 107 111 SER N N 116.39 0.30 1 825 108 112 HIS H H 8.35 0.02 1 826 108 112 HIS CA C 55.6 0.30 1 827 108 112 HIS N N 120.39 0.30 1 828 110 114 SER H H 8.46 0.02 1 829 110 114 SER HB2 H 3.84 0.02 2 830 110 114 SER HB3 H 3.84 0.02 2 831 110 114 SER C C 174.13 0.30 1 832 110 114 SER CA C 58.30 0.30 1 833 110 114 SER CB C 64.03 0.30 1 834 110 114 SER N N 118.06 0.30 1 835 111 115 ASP H H 8.53 0.02 1 836 111 115 ASP HA H 4.63 0.02 1 837 111 115 ASP HB2 H 2.69 0.02 2 838 111 115 ASP HB3 H 2.69 0.02 2 839 111 115 ASP C C 176.37 0.30 1 840 111 115 ASP CA C 54.55 0.30 1 841 111 115 ASP CB C 41.25 0.30 1 842 111 115 ASP N N 122.78 0.30 1 843 112 116 GLU H H 8.38 0.02 1 844 112 116 GLU HA H 4.30 0.02 1 845 112 116 GLU HB2 H 2.06 0.02 2 846 112 116 GLU HB3 H 1.94 0.02 2 847 112 116 GLU HG2 H 2.27 0.02 2 848 112 116 GLU HG3 H 2.27 0.02 2 849 112 116 GLU C C 176.64 0.30 1 850 112 116 GLU CA C 56.83 0.30 1 851 112 116 GLU CB C 30.15 0.30 1 852 112 116 GLU CG C 36.22 0.30 1 853 112 116 GLU N N 121.00 0.30 1 854 113 117 SER H H 8.33 0.02 1 855 113 117 SER HB2 H 3.86 0.02 2 856 113 117 SER HB3 H 3.86 0.02 2 857 113 117 SER C C 174.47 0.30 1 858 113 117 SER CA C 58.56 0.30 1 859 113 117 SER CB C 64.06 0.30 1 860 113 117 SER N N 116.45 0.30 1 861 114 118 ASP H H 8.34 0.02 1 862 114 118 ASP HA H 4.61 0.02 1 863 114 118 ASP HB2 H 2.66 0.02 2 864 114 118 ASP HB3 H 2.66 0.02 2 865 114 118 ASP C C 176.26 0.30 1 866 114 118 ASP CA C 54.55 0.30 1 867 114 118 ASP CB C 41.18 0.30 1 868 114 118 ASP N N 122.80 0.30 1 869 115 119 GLU H H 8.25 0.02 1 870 115 119 GLU HA H 4.23 0.02 1 871 115 119 GLU HB2 H 1.96 0.02 2 872 115 119 GLU HB3 H 1.96 0.02 2 873 115 119 GLU HG2 H 2.23 0.02 2 874 115 119 GLU HG3 H 2.23 0.02 2 875 115 119 GLU C C 176.25 0.30 1 876 115 119 GLU CA C 56.60 0.30 1 877 115 119 GLU CB C 30.36 0.30 1 878 115 119 GLU CG C 36.13 0.30 1 879 115 119 GLU N N 120.81 0.30 1 880 116 120 LEU H H 8.23 0.02 1 881 116 120 LEU HA H 4.36 0.02 1 882 116 120 LEU HB2 H 1.59 0.02 2 883 116 120 LEU HB3 H 1.59 0.02 2 884 116 120 LEU HD1 H 0.90 0.02 2 885 116 120 LEU HD2 H 0.85 0.02 2 886 116 120 LEU C C 177.17 0.30 1 887 116 120 LEU CA C 55.16 0.30 1 888 116 120 LEU CB C 42.27 0.30 1 889 116 120 LEU CD1 C 24.77 0.30 2 890 116 120 LEU CD2 C 23.68 0.30 2 891 116 120 LEU N N 123.38 0.30 1 892 117 121 VAL H H 8.17 0.02 1 893 117 121 VAL HA H 4.15 0.02 1 894 117 121 VAL HB H 2.05 0.02 1 895 117 121 VAL HG1 H 0.91 0.02 2 896 117 121 VAL HG2 H 0.89 0.02 2 897 117 121 VAL C C 176.22 0.30 1 898 117 121 VAL CA C 62.37 0.30 1 899 117 121 VAL CB C 32.72 0.30 1 900 117 121 VAL CG1 C 20.71 0.30 2 901 117 121 VAL CG2 C 21.19 0.30 2 902 117 121 VAL N N 122.46 0.30 1 903 118 122 THR H H 8.19 0.02 1 904 118 122 THR HA H 4.32 0.02 1 905 118 122 THR HB H 4.12 0.02 1 906 118 122 THR HG2 H 1.09 0.02 1 907 118 122 THR C C 173.78 0.30 1 908 118 122 THR CA C 61.38 0.30 1 909 118 122 THR CB C 69.84 0.30 1 910 118 122 THR CG2 C 21.29 0.30 1 911 118 122 THR N N 117.85 0.30 1 912 119 123 ASP H H 8.13 0.02 1 913 119 123 ASP HB2 H 2.50 0.02 2 914 119 123 ASP HB3 H 2.50 0.02 2 915 119 123 ASP C C 175.16 0.30 1 916 119 123 ASP CA C 54.12 0.30 1 917 119 123 ASP CB C 41.39 0.30 1 918 119 123 ASP N N 122.71 0.30 1 919 120 124 PHE H H 8.16 0.02 1 920 120 124 PHE CA C 55.66 0.30 1 921 120 124 PHE CB C 38.92 0.30 1 922 120 124 PHE N N 121.5 0.30 1 923 121 125 PRO HA H 4.49 0.02 1 924 121 125 PRO HB2 H 2.28 0.02 2 925 121 125 PRO HB3 H 2.28 0.02 2 926 121 125 PRO C C 177.06 0.30 1 927 121 125 PRO CA C 63.24 0.30 1 928 121 125 PRO CB C 32.11 0.30 1 929 122 126 THR H H 8.24 0.02 1 930 122 126 THR HA H 4.34 0.02 1 931 122 126 THR HB H 4.24 0.02 1 932 122 126 THR HG2 H 1.23 0.02 1 933 122 126 THR C C 174.27 0.30 1 934 122 126 THR CA C 61.78 0.30 1 935 122 126 THR CB C 69.87 0.30 1 936 122 126 THR CG2 C 21.50 0.30 1 937 122 126 THR N N 113.97 0.30 1 938 123 127 ASP H H 8.31 0.02 1 939 123 127 ASP HB2 H 2.62 0.02 2 940 123 127 ASP HB3 H 2.62 0.02 2 941 123 127 ASP C C 175.64 0.30 1 942 123 127 ASP CA C 54.09 0.30 1 943 123 127 ASP CB C 41.15 0.30 1 944 123 127 ASP N N 122.35 0.30 1 945 124 128 LEU H H 8.12 0.02 1 946 124 128 LEU N N 123.59 0.30 1 947 125 129 PRO HA H 4.39 0.02 1 948 125 129 PRO HB2 H 2.28 0.02 2 949 125 129 PRO HB3 H 2.28 0.02 2 950 125 129 PRO HG2 H 1.99 0.02 2 951 125 129 PRO HG3 H 1.99 0.02 2 952 125 129 PRO C C 176.72 0.30 1 953 125 129 PRO CA C 62.97 0.30 1 954 125 129 PRO CB C 32.11 0.30 1 955 125 129 PRO CG C 27.42 0.30 1 956 126 130 ALA H H 8.42 0.02 1 957 126 130 ALA HA H 4.33 0.02 1 958 126 130 ALA HB H 1.39 0.02 1 959 126 130 ALA C C 178.05 0.30 1 960 126 130 ALA CA C 52.60 0.30 1 961 126 130 ALA CB C 19.29 0.30 1 962 126 130 ALA N N 124.56 0.30 1 963 127 131 THR H H 8.04 0.02 1 964 127 131 THR HB H 4.19 0.02 1 965 127 131 THR HG2 H 1.16 0.02 1 966 127 131 THR C C 174.49 0.30 1 967 127 131 THR CA C 61.93 0.30 1 968 127 131 THR CB C 69.77 0.30 1 969 127 131 THR CG2 C 21.73 0.30 1 970 127 131 THR N N 112.93 0.30 1 971 128 132 GLU H H 8.33 0.02 1 972 128 132 GLU HA H 4.29 0.02 1 973 128 132 GLU HB2 H 1.88 0.02 2 974 128 132 GLU HB3 H 1.88 0.02 2 975 128 132 GLU HG2 H 2.14 0.02 2 976 128 132 GLU HG3 H 2.14 0.02 2 977 128 132 GLU C C 175.92 0.30 1 978 128 132 GLU CA C 56.43 0.30 1 979 128 132 GLU CB C 30.50 0.30 1 980 128 132 GLU CG C 36.22 0.30 1 981 128 132 GLU N N 123.36 0.30 1 982 129 133 VAL H H 8.07 0.02 1 983 129 133 VAL HA H 4.05 0.02 1 984 129 133 VAL HB H 1.97 0.02 1 985 129 133 VAL HG1 H 0.84 0.02 2 986 129 133 VAL HG2 H 0.84 0.02 2 987 129 133 VAL C C 175.60 0.30 1 988 129 133 VAL CA C 62.14 0.30 1 989 129 133 VAL CB C 32.94 0.30 1 990 129 133 VAL CG2 C 21.05 0.30 2 991 129 133 VAL N N 121.30 0.30 1 992 130 134 PHE H H 8.37 0.02 1 993 130 134 PHE HB2 H 3.03 0.02 2 994 130 134 PHE HB3 H 3.03 0.02 2 995 130 134 PHE C C 175.21 0.30 1 996 130 134 PHE CA C 57.52 0.30 1 997 130 134 PHE CB C 39.90 0.30 1 998 130 134 PHE N N 124.98 0.30 1 999 131 135 THR H H 8.07 0.02 1 1000 131 135 THR CB C 70.13 0.30 1 1001 131 135 THR N N 120.61 0.30 1 1002 132 136 PRO HA H 4.33 0.02 1 1003 132 136 PRO HG2 H 1.97 0.02 2 1004 132 136 PRO HG3 H 1.97 0.02 2 1005 132 136 PRO C C 176.57 0.30 1 1006 132 136 PRO CA C 62.90 0.30 1 1007 132 136 PRO CB C 32.17 0.30 1 1008 132 136 PRO CG C 27.19 0.30 1 1009 133 137 VAL H H 8.24 0.02 1 1010 133 137 VAL HA H 4.03 0.02 1 1011 133 137 VAL HB H 1.99 0.02 1 1012 133 137 VAL HG1 H 0.94 0.02 2 1013 133 137 VAL HG2 H 0.94 0.02 2 1014 133 137 VAL C C 176.14 0.30 1 1015 133 137 VAL CA C 62.42 0.30 1 1016 133 137 VAL CB C 32.72 0.30 1 1017 133 137 VAL CG2 C 20.91 0.30 2 1018 133 137 VAL N N 121.22 0.30 1 1019 134 138 VAL H H 8.29 0.02 1 1020 134 138 VAL CA C 59.55 0.30 1 1021 134 138 VAL CB C 32.38 0.30 1 1022 134 138 VAL N N 126.43 0.30 1 1023 135 139 PRO HA H 4.46 0.02 1 1024 135 139 PRO HB2 H 2.28 0.02 2 1025 135 139 PRO HB3 H 2.28 0.02 2 1026 135 139 PRO HG2 H 1.96 0.02 2 1027 135 139 PRO HG3 H 1.96 0.02 2 1028 135 139 PRO C C 176.90 0.30 1 1029 135 139 PRO CA C 63.15 0.30 1 1030 135 139 PRO CB C 32.23 0.30 1 1031 135 139 PRO CG C 27.36 0.30 1 1032 136 140 THR H H 8.23 0.02 1 1033 136 140 THR HB H 4.19 0.02 1 1034 136 140 THR HG2 H 1.21 0.02 1 1035 136 140 THR C C 174.66 0.30 1 1036 136 140 THR CA C 61.82 0.30 1 1037 136 140 THR CB C 69.93 0.30 1 1038 136 140 THR CG2 C 21.81 0.30 1 1039 136 140 THR N N 115.16 0.30 1 1040 137 141 VAL H H 8.15 0.02 1 1041 137 141 VAL HA H 4.15 0.02 1 1042 137 141 VAL HB H 2.07 0.02 1 1043 137 141 VAL HG1 H 0.91 0.02 2 1044 137 141 VAL HG2 H 0.90 0.02 2 1045 137 141 VAL C C 175.63 0.30 1 1046 137 141 VAL CA C 62.10 0.30 1 1047 137 141 VAL CB C 33.00 0.30 1 1048 137 141 VAL CG1 C 21.09 0.30 2 1049 137 141 VAL CG2 C 20.28 0.30 2 1050 137 141 VAL N N 121.80 0.30 1 1051 138 142 ASP H H 8.40 0.02 1 1052 138 142 ASP HB2 H 2.62 0.02 2 1053 138 142 ASP HB3 H 2.62 0.02 2 1054 138 142 ASP C C 176.24 0.30 1 1055 138 142 ASP CA C 54.41 0.30 1 1056 138 142 ASP CB C 41.39 0.30 1 1057 138 142 ASP N N 124.01 0.30 1 1058 139 143 THR H H 7.99 0.02 1 1059 139 143 THR HB H 4.17 0.02 1 1060 139 143 THR HG2 H 1.09 0.02 1 1061 139 143 THR C C 174.36 0.30 1 1062 139 143 THR CA C 61.76 0.30 1 1063 139 143 THR CB C 69.77 0.30 1 1064 139 143 THR CG2 C 21.51 0.30 1 1065 139 143 THR N N 114.01 0.30 1 1066 140 144 TYR H H 8.29 0.02 1 1067 140 144 TYR HB2 H 3.00 0.02 2 1068 140 144 TYR HB3 H 3.00 0.02 2 1069 140 144 TYR C C 175.62 0.30 1 1070 140 144 TYR CA C 58.18 0.30 1 1071 140 144 TYR CB C 38.61 0.30 1 1072 140 144 TYR N N 122.61 0.30 1 1073 141 145 ASP H H 8.21 0.02 1 1074 141 145 ASP HB2 H 2.64 0.02 2 1075 141 145 ASP HB3 H 2.64 0.02 2 1076 141 145 ASP C C 176.65 0.30 1 1077 141 145 ASP CA C 54.05 0.30 1 1078 141 145 ASP CB C 41.20 0.30 1 1079 141 145 ASP N N 122.83 0.30 1 1080 142 146 GLY H H 7.82 0.02 1 1081 142 146 GLY HA2 H 3.87 0.02 2 1082 142 146 GLY HA3 H 3.87 0.02 2 1083 142 146 GLY C C 174.66 0.30 1 1084 142 146 GLY CA C 45.77 0.30 1 1085 142 146 GLY N N 108.92 0.30 1 1086 143 147 ARG H H 8.08 0.02 1 1087 143 147 ARG HA H 4.30 0.02 1 1088 143 147 ARG HB2 H 1.83 0.02 2 1089 143 147 ARG HB3 H 1.83 0.02 2 1090 143 147 ARG HG2 H 1.59 0.02 2 1091 143 147 ARG HG3 H 1.59 0.02 2 1092 143 147 ARG C C 177.11 0.30 1 1093 143 147 ARG CA C 56.58 0.30 1 1094 143 147 ARG CB C 30.63 0.30 1 1095 143 147 ARG CG C 27.03 0.30 1 1096 143 147 ARG N N 119.94 0.30 1 1097 144 148 GLY H H 8.42 0.02 1 1098 144 148 GLY HA2 H 3.95 0.02 2 1099 144 148 GLY HA3 H 3.95 0.02 2 1100 144 148 GLY C C 174.04 0.30 1 1101 144 148 GLY CA C 45.48 0.30 1 1102 144 148 GLY N N 109.34 0.30 1 1103 145 149 ASP H H 8.24 0.02 1 1104 145 149 ASP HB2 H 2.67 0.02 2 1105 145 149 ASP HB3 H 2.67 0.02 2 1106 145 149 ASP C C 176.53 0.30 1 1107 145 149 ASP CA C 54.47 0.30 1 1108 145 149 ASP CB C 41.25 0.30 1 1109 145 149 ASP N N 120.42 0.30 1 1110 146 150 SER H H 8.25 0.02 1 1111 146 150 SER HB2 H 3.85 0.02 2 1112 146 150 SER HB3 H 3.85 0.02 2 1113 146 150 SER C C 174.84 0.30 1 1114 146 150 SER CA C 58.84 0.30 1 1115 146 150 SER CB C 63.68 0.30 1 1116 146 150 SER N N 115.77 0.30 1 1117 147 151 VAL H H 8.04 0.02 1 1118 147 151 VAL HA H 4.02 0.02 1 1119 147 151 VAL HG1 H 0.84 0.02 2 1120 147 151 VAL HG2 H 0.84 0.02 2 1121 147 151 VAL C C 176.19 0.30 1 1122 147 151 VAL CA C 62.95 0.30 1 1123 147 151 VAL CB C 32.47 0.30 1 1124 147 151 VAL CG2 C 20.92 0.30 2 1125 147 151 VAL N N 122.11 0.30 1 1126 148 152 VAL H H 7.98 0.02 1 1127 148 152 VAL HA H 3.97 0.02 1 1128 148 152 VAL HB H 1.91 0.02 1 1129 148 152 VAL HG2 H 0.81 0.02 2 1130 148 152 VAL C C 176.10 0.30 1 1131 148 152 VAL CA C 62.71 0.30 1 1132 148 152 VAL CB C 32.66 0.30 1 1133 148 152 VAL CG2 C 20.93 0.30 2 1134 148 152 VAL N N 122.70 0.30 1 1135 149 153 TYR H H 8.18 0.02 1 1136 149 153 TYR HB2 H 3.02 0.02 2 1137 149 153 TYR HB3 H 2.91 0.02 2 1138 149 153 TYR C C 176.63 0.30 1 1139 149 153 TYR CA C 58.51 0.30 1 1140 149 153 TYR CB C 38.84 0.30 1 1141 149 153 TYR N N 123.28 0.30 1 1142 150 154 GLY H H 8.22 0.02 1 1143 150 154 GLY HA2 H 3.88 0.02 2 1144 150 154 GLY HA3 H 3.88 0.02 2 1145 150 154 GLY C C 174.18 0.30 1 1146 150 154 GLY CA C 45.48 0.30 1 1147 150 154 GLY N N 109.74 0.30 1 1148 151 155 LEU H H 8.05 0.02 1 1149 151 155 LEU CA C 55.51 0.30 1 1150 151 155 LEU CB C 42.24 0.30 1 1151 151 155 LEU N N 121.49 0.30 1 1152 161 165 PRO HA H 4.42 0.02 1 1153 161 165 PRO C C 176.43 0.30 1 1154 161 165 PRO CA C 63.48 0.30 1 1155 161 165 PRO CB C 32.09 0.30 1 1156 162 166 ASP H H 8.49 0.02 1 1157 162 166 ASP HB2 H 2.64 0.02 2 1158 162 166 ASP HB3 H 2.64 0.02 2 1159 162 166 ASP C C 175.81 0.30 1 1160 162 166 ASP CA C 54.26 0.30 1 1161 162 166 ASP CB C 40.78 0.30 1 1162 162 166 ASP N N 119.14 0.30 1 1163 163 167 ILE H H 7.71 0.02 1 1164 163 167 ILE HG2 H 0.66 0.02 1 1165 163 167 ILE C C 175.37 0.30 1 1166 163 167 ILE CA C 60.79 0.30 1 1167 163 167 ILE CB C 39.08 0.30 1 1168 163 167 ILE CG2 C 17.29 0.30 1 1169 163 167 ILE N N 120.09 0.30 1 1170 164 168 GLN H H 8.25 0.02 1 1171 164 168 GLN C C 175.15 0.30 1 1172 164 168 GLN CA C 55.58 0.30 1 1173 164 168 GLN CB C 29.62 0.30 1 1174 164 168 GLN N N 123.65 0.30 1 1175 165 169 TYR H H 8.30 0.02 1 1176 165 169 TYR CB C 38.07 0.30 1 1177 165 169 TYR N N 122.25 0.30 1 1178 166 170 PRO HA H 4.42 0.02 1 1179 166 170 PRO C C 176.58 0.30 1 1180 166 170 PRO CA C 63.48 0.30 1 1181 166 170 PRO CB C 32.05 0.30 1 1182 167 171 ASP H H 8.36 0.02 1 1183 167 171 ASP HB2 H 2.66 0.02 2 1184 167 171 ASP HB3 H 2.66 0.02 2 1185 167 171 ASP C C 175.99 0.30 1 1186 167 171 ASP CA C 54.26 0.30 1 1187 167 171 ASP CB C 41.25 0.30 1 1188 167 171 ASP N N 119.84 0.30 1 1189 168 172 ALA H H 8.17 0.02 1 1190 168 172 ALA HA H 4.39 0.02 1 1191 168 172 ALA HB H 1.41 0.02 1 1192 168 172 ALA C C 177.88 0.30 1 1193 168 172 ALA CA C 52.67 0.30 1 1194 168 172 ALA CB C 19.38 0.30 1 1195 168 172 ALA N N 124.30 0.30 1 1196 169 173 THR H H 8.26 0.02 1 1197 169 173 THR HB H 4.26 0.02 1 1198 169 173 THR C C 174.52 0.30 1 1199 169 173 THR CA C 61.81 0.30 1 1200 169 173 THR CB C 70.05 0.30 1 1201 169 173 THR N N 113.02 0.30 1 1202 170 174 ASP H H 8.33 0.02 1 1203 170 174 ASP HA H 4.59 0.02 1 1204 170 174 ASP HB2 H 2.67 0.02 2 1205 170 174 ASP HB3 H 2.67 0.02 2 1206 170 174 ASP C C 176.39 0.30 1 1207 170 174 ASP CA C 54.67 0.30 1 1208 170 174 ASP CB C 41.19 0.30 1 1209 170 174 ASP N N 122.35 0.30 1 1210 171 175 GLU H H 8.29 0.02 1 1211 171 175 GLU HA H 4.21 0.02 1 1212 171 175 GLU HG2 H 2.23 0.02 2 1213 171 175 GLU HG3 H 2.23 0.02 2 1214 171 175 GLU C C 176.32 0.30 1 1215 171 175 GLU CA C 56.95 0.30 1 1216 171 175 GLU CB C 30.47 0.30 1 1217 171 175 GLU CG C 36.25 0.30 1 1218 171 175 GLU N N 120.96 0.30 1 1219 172 176 ASP H H 8.37 0.02 1 1220 172 176 ASP HA H 4.61 0.02 1 1221 172 176 ASP HB2 H 2.69 0.02 2 1222 172 176 ASP HB3 H 2.69 0.02 2 1223 172 176 ASP C C 176.82 0.30 1 1224 172 176 ASP CA C 54.49 0.30 1 1225 172 176 ASP CB C 41.07 0.30 1 1226 172 176 ASP N N 121.36 0.30 1 1227 173 177 ILE H H 8.11 0.02 1 1228 173 177 ILE HA H 4.17 0.02 1 1229 173 177 ILE HB H 1.96 0.02 1 1230 173 177 ILE HG2 H 0.90 0.02 1 1231 173 177 ILE HD1 H 0.84 0.02 1 1232 173 177 ILE C C 177.01 0.30 1 1233 173 177 ILE CA C 61.96 0.30 1 1234 173 177 ILE CB C 38.48 0.30 1 1235 173 177 ILE CG2 C 17.76 0.30 1 1236 173 177 ILE CD1 C 13.21 0.30 1 1237 173 177 ILE N N 120.93 0.30 1 1238 174 178 THR H H 8.20 0.02 1 1239 174 178 THR HA H 4.25 0.02 1 1240 174 178 THR HB H 4.20 0.02 1 1241 174 178 THR HG2 H 1.17 0.02 1 1242 174 178 THR C C 175.08 0.30 1 1243 174 178 THR CA C 62.81 0.30 1 1244 174 178 THR CB C 69.65 0.30 1 1245 174 178 THR CG2 C 21.77 0.30 1 1246 174 178 THR N N 116.39 0.30 1 1247 175 179 SER H H 8.15 0.02 1 1248 175 179 SER HB2 H 3.83 0.02 2 1249 175 179 SER HB3 H 3.83 0.02 2 1250 175 179 SER C C 174.51 0.30 1 1251 175 179 SER CA C 58.83 0.30 1 1252 175 179 SER CB C 63.70 0.30 1 1253 175 179 SER N N 117.56 0.30 1 1254 176 180 HIS H H 8.31 0.02 1 1255 176 180 HIS HB2 H 3.21 0.02 2 1256 176 180 HIS HB3 H 3.15 0.02 2 1257 176 180 HIS C C 174.68 0.30 1 1258 176 180 HIS CA C 55.80 0.30 1 1259 176 180 HIS CB C 29.23 0.30 1 1260 176 180 HIS N N 120.47 0.30 1 1261 177 181 MET H H 8.28 0.02 1 1262 177 181 MET HA H 4.43 0.02 1 1263 177 181 MET HG2 H 2.53 0.02 2 1264 177 181 MET HG3 H 2.53 0.02 2 1265 177 181 MET C C 176.33 0.30 1 1266 177 181 MET CA C 55.80 0.30 1 1267 177 181 MET CB C 33.09 0.30 1 1268 177 181 MET CG C 31.97 0.30 1 1269 177 181 MET N N 121.45 0.30 1 1270 178 182 GLU H H 8.56 0.02 1 1271 178 182 GLU HA H 4.27 0.02 1 1272 178 182 GLU HB2 H 2.04 0.02 2 1273 178 182 GLU HB3 H 1.95 0.02 2 1274 178 182 GLU HG2 H 2.27 0.02 2 1275 178 182 GLU HG3 H 2.27 0.02 2 1276 178 182 GLU C C 176.70 0.30 1 1277 178 182 GLU CA C 56.89 0.30 1 1278 178 182 GLU CB C 30.10 0.30 1 1279 178 182 GLU CG C 36.20 0.30 1 1280 178 182 GLU N N 122.13 0.30 1 1281 179 183 SER H H 8.28 0.02 1 1282 179 183 SER HB2 H 3.87 0.02 2 1283 179 183 SER HB3 H 3.87 0.02 2 1284 179 183 SER C C 174.92 0.30 1 1285 179 183 SER CA C 58.66 0.30 1 1286 179 183 SER CB C 63.86 0.30 1 1287 179 183 SER N N 116.15 0.30 1 1288 180 184 GLU H H 8.47 0.02 1 1289 180 184 GLU HA H 4.25 0.02 1 1290 180 184 GLU HG2 H 2.24 0.02 2 1291 180 184 GLU HG3 H 2.24 0.02 2 1292 180 184 GLU C C 176.84 0.30 1 1293 180 184 GLU CA C 57.15 0.30 1 1294 180 184 GLU CB C 30.27 0.30 1 1295 180 184 GLU CG C 36.35 0.30 1 1296 180 184 GLU N N 122.98 0.30 1 1297 181 185 GLU H H 8.35 0.02 1 1298 181 185 GLU HA H 4.21 0.02 1 1299 181 185 GLU HB2 H 1.99 0.02 2 1300 181 185 GLU HB3 H 1.99 0.02 2 1301 181 185 GLU HG2 H 2.24 0.02 2 1302 181 185 GLU HG3 H 2.24 0.02 2 1303 181 185 GLU C C 176.86 0.30 1 1304 181 185 GLU CA C 56.97 0.30 1 1305 181 185 GLU CB C 30.09 0.30 1 1306 181 185 GLU CG C 36.27 0.30 1 1307 181 185 GLU N N 121.15 0.30 1 1308 182 186 LEU H H 8.16 0.02 1 1309 182 186 LEU HB2 H 1.65 0.02 2 1310 182 186 LEU HB3 H 1.65 0.02 2 1311 182 186 LEU HD1 H 0.82 0.02 2 1312 182 186 LEU HD2 H 0.82 0.02 2 1313 182 186 LEU C C 177.46 0.30 1 1314 182 186 LEU CA C 55.52 0.30 1 1315 182 186 LEU CB C 42.19 0.30 1 1316 182 186 LEU CD1 C 23.42 0.30 2 1317 182 186 LEU CD2 C 23.42 0.30 2 1318 182 186 LEU N N 122.49 0.30 1 1319 183 187 ASN H H 8.36 0.02 1 1320 183 187 ASN HB2 H 2.82 0.02 2 1321 183 187 ASN HB3 H 2.82 0.02 2 1322 183 187 ASN C C 175.94 0.30 1 1323 183 187 ASN CA C 53.60 0.30 1 1324 183 187 ASN CB C 38.94 0.30 1 1325 183 187 ASN N N 118.78 0.30 1 1326 184 188 GLY H H 8.31 0.02 1 1327 184 188 GLY HA2 H 3.90 0.02 2 1328 184 188 GLY HA3 H 3.90 0.02 2 1329 184 188 GLY C C 174.09 0.30 1 1330 184 188 GLY CA C 45.71 0.30 1 1331 184 188 GLY N N 109.18 0.30 1 1332 185 189 ALA H H 8.04 0.02 1 1333 185 189 ALA HA H 4.25 0.02 1 1334 185 189 ALA HB H 1.28 0.02 1 1335 185 189 ALA C C 177.52 0.30 1 1336 185 189 ALA CA C 52.64 0.30 1 1337 185 189 ALA CB C 19.23 0.30 1 1338 185 189 ALA N N 123.37 0.30 1 1339 186 190 TYR H H 8.04 0.02 1 1340 186 190 TYR HB2 H 2.98 0.02 2 1341 186 190 TYR HB3 H 2.98 0.02 2 1342 186 190 TYR C C 175.56 0.30 1 1343 186 190 TYR CA C 58.00 0.30 1 1344 186 190 TYR CB C 38.60 0.30 1 1345 186 190 TYR N N 119.04 0.30 1 1346 187 191 LYS H H 7.92 0.02 1 1347 187 191 LYS HA H 4.22 0.02 1 1348 187 191 LYS HB2 H 1.68 0.02 2 1349 187 191 LYS HB3 H 1.68 0.02 2 1350 187 191 LYS HG2 H 1.31 0.02 2 1351 187 191 LYS HG3 H 1.31 0.02 2 1352 187 191 LYS HD2 H 1.63 0.02 2 1353 187 191 LYS HD3 H 1.63 0.02 2 1354 187 191 LYS HE2 H 2.95 0.02 2 1355 187 191 LYS HE3 H 2.95 0.02 2 1356 187 191 LYS C C 175.32 0.30 1 1357 187 191 LYS CA C 55.78 0.30 1 1358 187 191 LYS CB C 33.37 0.30 1 1359 187 191 LYS CG C 24.57 0.30 1 1360 187 191 LYS CD C 29.14 0.30 1 1361 187 191 LYS CE C 42.20 0.30 1 1362 187 191 LYS N N 123.78 0.30 1 1363 188 192 ALA H H 8.11 0.02 1 1364 188 192 ALA HA H 4.24 0.02 1 1365 188 192 ALA HB H 1.33 0.02 1 1366 188 192 ALA C C 177.26 0.30 1 1367 188 192 ALA CA C 52.15 0.30 1 1368 188 192 ALA CB C 19.30 0.30 1 1369 188 192 ALA N N 125.43 0.30 1 1370 189 193 ILE H H 8.13 0.02 1 1371 189 193 ILE CA C 58.67 0.30 1 1372 189 193 ILE CB C 38.38 0.30 1 1373 189 193 ILE N N 122.34 0.30 1 1374 190 194 PRO HA H 4.42 0.02 1 1375 190 194 PRO HB2 H 2.24 0.02 2 1376 190 194 PRO HB3 H 1.85 0.02 2 1377 190 194 PRO HG2 H 1.97 0.02 2 1378 190 194 PRO HG3 H 1.97 0.02 2 1379 190 194 PRO C C 176.72 0.30 1 1380 190 194 PRO CA C 63.12 0.30 1 1381 190 194 PRO CB C 32.12 0.30 1 1382 190 194 PRO CG C 27.39 0.30 1 1383 191 195 VAL H H 8.16 0.02 1 1384 191 195 VAL HA H 4.05 0.02 1 1385 191 195 VAL HB H 2.04 0.02 1 1386 191 195 VAL HG1 H 0.93 0.02 2 1387 191 195 VAL HG2 H 0.94 0.02 2 1388 191 195 VAL C C 176.02 0.30 1 1389 191 195 VAL CA C 62.15 0.30 1 1390 191 195 VAL CB C 32.93 0.30 1 1391 191 195 VAL CG1 C 21.22 0.30 2 1392 191 195 VAL CG2 C 20.56 0.30 2 1393 191 195 VAL N N 120.53 0.30 1 1394 192 196 ALA H H 8.37 0.02 1 1395 192 196 ALA HA H 4.28 0.02 1 1396 192 196 ALA HB H 1.37 0.02 1 1397 192 196 ALA C C 177.54 0.30 1 1398 192 196 ALA CA C 52.53 0.30 1 1399 192 196 ALA CB C 19.39 0.30 1 1400 192 196 ALA N N 127.86 0.30 1 1401 193 197 GLN H H 8.33 0.02 1 1402 193 197 GLN HA H 4.26 0.02 1 1403 193 197 GLN HB2 H 2.01 0.02 2 1404 193 197 GLN HB3 H 2.01 0.02 2 1405 193 197 GLN HG2 H 2.31 0.02 2 1406 193 197 GLN HG3 H 2.31 0.02 2 1407 193 197 GLN C C 175.50 0.30 1 1408 193 197 GLN CA C 55.91 0.30 1 1409 193 197 GLN CB C 29.75 0.30 1 1410 193 197 GLN CG C 33.85 0.30 1 1411 193 197 GLN N N 119.83 0.30 1 1412 194 198 ASP H H 8.36 0.02 1 1413 194 198 ASP HB2 H 2.69 0.02 2 1414 194 198 ASP HB3 H 2.61 0.02 2 1415 194 198 ASP C C 176.39 0.30 1 1416 194 198 ASP CA C 54.14 0.30 1 1417 194 198 ASP CB C 41.11 0.30 1 1418 194 198 ASP N N 121.56 0.30 1 1419 195 199 LEU H H 8.25 0.02 1 1420 195 199 LEU HA H 4.27 0.02 1 1421 195 199 LEU HB2 H 1.60 0.02 2 1422 195 199 LEU HB3 H 1.60 0.02 2 1423 195 199 LEU HG H 1.61 0.02 1 1424 195 199 LEU HD1 H 0.91 0.02 2 1425 195 199 LEU HD2 H 0.83 0.02 2 1426 195 199 LEU C C 177.28 0.30 1 1427 195 199 LEU CA C 55.58 0.30 1 1428 195 199 LEU CB C 42.10 0.30 1 1429 195 199 LEU CG C 27.00 0.30 1 1430 195 199 LEU CD1 C 24.96 0.30 2 1431 195 199 LEU CD2 C 23.24 0.30 2 1432 195 199 LEU N N 123.21 0.30 1 1433 196 200 ASN H H 8.40 0.02 1 1434 196 200 ASN HA H 4.67 0.02 1 1435 196 200 ASN HB2 H 2.75 0.02 2 1436 196 200 ASN HB3 H 2.75 0.02 2 1437 196 200 ASN C C 174.44 0.30 1 1438 196 200 ASN CA C 53.14 0.30 1 1439 196 200 ASN CB C 39.11 0.30 1 1440 196 200 ASN N N 118.43 0.30 1 1441 197 201 ALA H H 8.00 0.02 1 1442 197 201 ALA CA C 50.55 0.30 1 1443 197 201 ALA CB C 18.01 0.30 1 1444 197 201 ALA N N 125.14 0.30 1 1445 198 202 PRO HA H 4.38 0.02 1 1446 198 202 PRO HG2 H 1.96 0.02 2 1447 198 202 PRO HG3 H 1.96 0.02 2 1448 198 202 PRO C C 177.20 0.30 1 1449 198 202 PRO CA C 63.18 0.30 1 1450 198 202 PRO CB C 32.10 0.30 1 1451 198 202 PRO CG C 27.44 0.30 1 1452 199 203 SER H H 8.44 0.02 1 1453 199 203 SER HB2 H 3.78 0.02 2 1454 199 203 SER HB3 H 3.78 0.02 2 1455 199 203 SER C C 174.60 0.30 1 1456 199 203 SER CA C 58.50 0.30 1 1457 199 203 SER CB C 63.94 0.30 1 1458 199 203 SER N N 116.01 0.30 1 1459 200 204 ASP H H 8.33 0.02 1 1460 200 204 ASP HA H 4.58 0.02 1 1461 200 204 ASP HB2 H 2.61 0.02 2 1462 200 204 ASP HB3 H 2.61 0.02 2 1463 200 204 ASP C C 176.43 0.30 1 1464 200 204 ASP CA C 54.42 0.30 1 1465 200 204 ASP CB C 40.89 0.30 1 1466 200 204 ASP N N 121.84 0.30 1 1467 201 205 TRP H H 7.99 0.02 1 1468 201 205 TRP HB2 H 3.26 0.02 2 1469 201 205 TRP HB3 H 3.26 0.02 2 1470 201 205 TRP C C 176.38 0.30 1 1471 201 205 TRP CA C 58.01 0.30 1 1472 201 205 TRP CB C 29.47 0.30 1 1473 201 205 TRP N N 120.81 0.30 1 1474 202 206 ASP H H 8.07 0.02 1 1475 202 206 ASP HA H 4.48 0.02 1 1476 202 206 ASP HB2 H 2.48 0.02 2 1477 202 206 ASP HB3 H 2.48 0.02 2 1478 202 206 ASP C C 176.49 0.30 1 1479 202 206 ASP CA C 54.53 0.30 1 1480 202 206 ASP CB C 40.95 0.30 1 1481 202 206 ASP N N 121.24 0.30 1 1482 203 207 SER H H 8.04 0.02 1 1483 203 207 SER HB2 H 3.85 0.02 2 1484 203 207 SER C C 175.02 0.30 1 1485 203 207 SER CA C 58.86 0.30 1 1486 203 207 SER CB C 63.51 0.30 1 1487 203 207 SER N N 116.27 0.30 1 1488 204 208 ARG H H 8.09 0.02 1 1489 204 208 ARG HA H 4.24 0.02 1 1490 204 208 ARG HB2 H 1.78 0.02 2 1491 204 208 ARG HB3 H 1.78 0.02 2 1492 204 208 ARG HG2 H 1.58 0.02 2 1493 204 208 ARG HG3 H 1.58 0.02 2 1494 204 208 ARG C C 177.07 0.30 1 1495 204 208 ARG CA C 56.75 0.30 1 1496 204 208 ARG CB C 30.44 0.30 1 1497 204 208 ARG CG C 26.86 0.30 1 1498 204 208 ARG N N 122.04 0.30 1 1499 205 209 GLY H H 8.32 0.02 1 1500 205 209 GLY HA2 H 3.91 0.02 2 1501 205 209 GLY HA3 H 3.91 0.02 2 1502 205 209 GLY C C 174.38 0.30 1 1503 205 209 GLY CA C 45.42 0.30 1 1504 205 209 GLY N N 109.23 0.30 1 1505 206 210 LYS H H 8.10 0.02 1 1506 206 210 LYS HA H 4.26 0.02 1 1507 206 210 LYS HB2 H 1.73 0.02 2 1508 206 210 LYS HB3 H 1.73 0.02 2 1509 206 210 LYS HG2 H 1.35 0.02 2 1510 206 210 LYS HG3 H 1.35 0.02 2 1511 206 210 LYS HD2 H 1.60 0.02 2 1512 206 210 LYS HD3 H 1.60 0.02 2 1513 206 210 LYS C C 176.54 0.30 1 1514 206 210 LYS CA C 56.54 0.30 1 1515 206 210 LYS CB C 32.98 0.30 1 1516 206 210 LYS CG C 24.56 0.30 1 1517 206 210 LYS CD C 29.01 0.30 1 1518 206 210 LYS N N 120.71 0.30 1 1519 207 211 ASP H H 8.36 0.02 1 1520 207 211 ASP HA H 4.59 0.02 1 1521 207 211 ASP HB2 H 2.63 0.02 2 1522 207 211 ASP HB3 H 2.63 0.02 2 1523 207 211 ASP C C 176.26 0.30 1 1524 207 211 ASP CA C 54.59 0.30 1 1525 207 211 ASP CB C 41.15 0.30 1 1526 207 211 ASP N N 120.77 0.30 1 1527 208 212 SER H H 8.08 0.02 1 1528 208 212 SER HB2 H 3.78 0.02 2 1529 208 212 SER HB3 H 3.78 0.02 2 1530 208 212 SER C C 174.35 0.30 1 1531 208 212 SER CA C 58.50 0.30 1 1532 208 212 SER CB C 63.91 0.30 1 1533 208 212 SER N N 115.41 0.30 1 1534 209 213 TYR H H 8.17 0.02 1 1535 209 213 TYR HB2 H 2.99 0.02 2 1536 209 213 TYR HB3 H 2.99 0.02 2 1537 209 213 TYR C C 175.98 0.30 1 1538 209 213 TYR CA C 58.23 0.30 1 1539 209 213 TYR CB C 38.67 0.30 1 1540 209 213 TYR N N 121.96 0.30 1 1541 210 214 GLU H H 8.32 0.02 1 1542 210 214 GLU HA H 4.30 0.02 1 1543 210 214 GLU HB2 H 1.99 0.02 2 1544 210 214 GLU HB3 H 1.99 0.02 2 1545 210 214 GLU HG2 H 2.24 0.02 2 1546 210 214 GLU HG3 H 2.24 0.02 2 1547 210 214 GLU C C 176.76 0.30 1 1548 210 214 GLU CA C 56.75 0.30 1 1549 210 214 GLU CB C 30.39 0.30 1 1550 210 214 GLU CG C 36.29 0.30 1 1551 210 214 GLU N N 121.90 0.30 1 1552 211 215 THR H H 8.15 0.02 1 1553 211 215 THR HB H 4.25 0.02 1 1554 211 215 THR HG2 H 1.20 0.02 1 1555 211 215 THR C C 174.83 0.30 1 1556 211 215 THR CA C 62.16 0.30 1 1557 211 215 THR CB C 69.70 0.30 1 1558 211 215 THR CG2 C 21.59 0.30 1 1559 211 215 THR N N 114.70 0.30 1 1560 212 216 SER H H 8.31 0.02 1 1561 212 216 SER HB2 H 3.87 0.02 2 1562 212 216 SER HB3 H 3.87 0.02 2 1563 212 216 SER C C 174.57 0.30 1 1564 212 216 SER CA C 58.70 0.30 1 1565 212 216 SER CB C 63.90 0.30 1 1566 212 216 SER N N 118.09 0.30 1 1567 213 217 GLN H H 8.37 0.02 1 1568 213 217 GLN HA H 4.33 0.02 1 1569 213 217 GLN HB2 H 2.12 0.02 2 1570 213 217 GLN HB3 H 1.92 0.02 2 1571 213 217 GLN HG2 H 2.31 0.02 2 1572 213 217 GLN HG3 H 2.31 0.02 2 1573 213 217 GLN C C 175.94 0.30 1 1574 213 217 GLN CA C 55.94 0.30 1 1575 213 217 GLN CB C 29.29 0.30 1 1576 213 217 GLN CG C 33.83 0.30 1 1577 213 217 GLN N N 122.04 0.30 1 1578 214 218 LEU H H 8.15 0.02 1 1579 214 218 LEU HA H 4.30 0.02 1 1580 214 218 LEU HB2 H 1.58 0.02 2 1581 214 218 LEU HB3 H 1.58 0.02 2 1582 214 218 LEU HG H 1.58 0.02 1 1583 214 218 LEU HD1 H 0.88 0.02 2 1584 214 218 LEU HD2 H 0.83 0.02 2 1585 214 218 LEU C C 177.19 0.30 1 1586 214 218 LEU CA C 55.34 0.30 1 1587 214 218 LEU CB C 42.40 0.30 1 1588 214 218 LEU CG C 26.91 0.30 1 1589 214 218 LEU CD1 C 24.98 0.30 2 1590 214 218 LEU CD2 C 23.37 0.30 2 1591 214 218 LEU N N 122.70 0.30 1 1592 215 219 ASP H H 8.25 0.02 1 1593 215 219 ASP HB2 H 2.66 0.02 2 1594 215 219 ASP HB3 H 2.66 0.02 2 1595 215 219 ASP C C 176.08 0.30 1 1596 215 219 ASP CA C 54.40 0.30 1 1597 215 219 ASP CB C 41.24 0.30 1 1598 215 219 ASP N N 120.95 0.30 1 1599 216 220 ASP H H 8.23 0.02 1 1600 216 220 ASP HA H 4.55 0.02 1 1601 216 220 ASP HB2 H 2.69 0.02 2 1602 216 220 ASP HB3 H 2.69 0.02 2 1603 216 220 ASP C C 176.81 0.30 1 1604 216 220 ASP CA C 54.59 0.30 1 1605 216 220 ASP CB C 41.04 0.30 1 1606 216 220 ASP N N 120.82 0.30 1 1607 217 221 GLN H H 8.41 0.02 1 1608 217 221 GLN HA H 4.29 0.02 1 1609 217 221 GLN HG2 H 2.36 0.02 2 1610 217 221 GLN HG3 H 2.36 0.02 2 1611 217 221 GLN C C 176.56 0.30 1 1612 217 221 GLN CA C 56.31 0.30 1 1613 217 221 GLN CB C 28.97 0.30 1 1614 217 221 GLN CG C 33.98 0.30 1 1615 217 221 GLN N N 120.55 0.30 1 1616 218 222 SER H H 8.28 0.02 1 1617 218 222 SER HB2 H 3.91 0.02 2 1618 218 222 SER HB3 H 3.91 0.02 2 1619 218 222 SER C C 174.76 0.30 1 1620 218 222 SER CA C 59.00 0.30 1 1621 218 222 SER CB C 63.78 0.30 1 1622 218 222 SER N N 116.25 0.30 1 1623 219 223 ALA H H 8.25 0.02 1 1624 219 223 ALA HA H 4.26 0.02 1 1625 219 223 ALA HB H 1.40 0.02 1 1626 219 223 ALA C C 178.15 0.30 1 1627 219 223 ALA CA C 53.04 0.30 1 1628 219 223 ALA CB C 19.24 0.30 1 1629 219 223 ALA N N 125.56 0.30 1 1630 220 224 GLU H H 8.29 0.02 1 1631 220 224 GLU HA H 4.24 0.02 1 1632 220 224 GLU HB2 H 1.98 0.02 2 1633 220 224 GLU HB3 H 1.98 0.02 2 1634 220 224 GLU HG2 H 2.25 0.02 2 1635 220 224 GLU HG3 H 2.25 0.02 2 1636 220 224 GLU C C 177.07 0.30 1 1637 220 224 GLU CA C 57.01 0.30 1 1638 220 224 GLU CB C 30.07 0.30 1 1639 220 224 GLU CG C 36.22 0.30 1 1640 220 224 GLU N N 119.33 0.30 1 1641 221 225 THR H H 8.07 0.02 1 1642 221 225 THR CA C 62.49 0.30 1 1643 221 225 THR CB C 69.69 0.30 1 1644 221 225 THR N N 114.27 0.30 1 1645 227 231 SER H H 8.04 0.02 1 1646 227 231 SER HB2 H 3.86 0.02 2 1647 227 231 SER HB3 H 3.86 0.02 2 1648 227 231 SER C C 174.85 0.30 1 1649 227 231 SER CA C 58.77 0.30 1 1650 227 231 SER CB C 63.77 0.30 1 1651 227 231 SER N N 114.18 0.30 1 1652 228 232 ARG H H 8.34 0.02 1 1653 228 232 ARG C C 176.11 0.30 1 1654 228 232 ARG CA C 56.51 0.30 1 1655 228 232 ARG CB C 30.56 0.30 1 1656 228 232 ARG N N 122.76 0.30 1 1657 229 233 LEU H H 8.07 0.02 1 1658 229 233 LEU HA H 4.23 0.02 1 1659 229 233 LEU HB2 H 1.42 0.02 2 1660 229 233 LEU HB3 H 1.42 0.02 2 1661 229 233 LEU HG H 1.51 0.02 1 1662 229 233 LEU HD1 H 0.86 0.02 2 1663 229 233 LEU HD2 H 0.79 0.02 2 1664 229 233 LEU C C 176.93 0.30 1 1665 229 233 LEU CA C 55.29 0.30 1 1666 229 233 LEU CB C 42.36 0.30 1 1667 229 233 LEU CG C 26.62 0.30 1 1668 229 233 LEU CD1 C 24.85 0.30 2 1669 229 233 LEU CD2 C 23.47 0.30 2 1670 229 233 LEU N N 121.90 0.30 1 1671 230 234 TYR H H 8.01 0.02 1 1672 230 234 TYR HB2 H 2.94 0.02 2 1673 230 234 TYR HB3 H 2.94 0.02 2 1674 230 234 TYR C C 175.41 0.30 1 1675 230 234 TYR CA C 57.78 0.30 1 1676 230 234 TYR CB C 38.87 0.30 1 1677 230 234 TYR N N 120.65 0.30 1 1678 231 235 LYS H H 8.09 0.02 1 1679 231 235 LYS C C 175.89 0.30 1 1680 231 235 LYS CA C 56.04 0.30 1 1681 231 235 LYS CB C 33.22 0.30 1 1682 231 235 LYS N N 123.38 0.30 1 1683 232 236 ARG H H 8.26 0.02 1 1684 232 236 ARG C C 176.19 0.30 1 1685 232 236 ARG CA C 56.12 0.30 1 1686 232 236 ARG CB C 31.05 0.30 1 1687 232 236 ARG N N 122.90 0.30 1 1688 233 237 LYS H H 8.43 0.02 1 1689 233 237 LYS C C 176.30 0.30 1 1690 233 237 LYS CA C 56.27 0.30 1 1691 233 237 LYS CB C 33.26 0.30 1 1692 233 237 LYS N N 123.49 0.30 1 1693 234 238 ALA H H 8.42 0.02 1 1694 234 238 ALA HA H 4.27 0.02 1 1695 234 238 ALA HB H 1.37 0.02 1 1696 234 238 ALA C C 177.56 0.30 1 1697 234 238 ALA CA C 52.72 0.30 1 1698 234 238 ALA CB C 19.43 0.30 1 1699 234 238 ALA N N 125.49 0.30 1 1700 235 239 ASN H H 8.41 0.02 1 1701 235 239 ASN HA H 4.65 0.02 1 1702 235 239 ASN HB2 H 2.79 0.02 2 1703 235 239 ASN HB3 H 2.79 0.02 2 1704 235 239 ASN C C 174.98 0.30 1 1705 235 239 ASN CA C 53.42 0.30 1 1706 235 239 ASN CB C 38.75 0.30 1 1707 235 239 ASN N N 117.41 0.30 1 1708 236 240 ASP H H 8.22 0.02 1 1709 236 240 ASP HB2 H 2.68 0.02 2 1710 236 240 ASP HB3 H 2.68 0.02 2 1711 236 240 ASP C C 176.45 0.30 1 1712 236 240 ASP CA C 54.47 0.30 1 1713 236 240 ASP CB C 41.24 0.30 1 1714 236 240 ASP N N 120.38 0.30 1 1715 237 241 GLU H H 8.39 0.02 1 1716 237 241 GLU HA H 4.29 0.02 1 1717 237 241 GLU HB2 H 2.10 0.02 2 1718 237 241 GLU HB3 H 1.93 0.02 2 1719 237 241 GLU HG2 H 2.26 0.02 2 1720 237 241 GLU HG3 H 2.26 0.02 2 1721 237 241 GLU C C 176.76 0.30 1 1722 237 241 GLU CA C 56.90 0.30 1 1723 237 241 GLU CB C 30.06 0.30 1 1724 237 241 GLU CG C 36.32 0.30 1 1725 237 241 GLU N N 121.22 0.30 1 1726 238 242 SER H H 8.34 0.02 1 1727 238 242 SER HB2 H 3.87 0.02 2 1728 238 242 SER HB3 H 3.87 0.02 2 1729 238 242 SER C C 174.53 0.30 1 1730 238 242 SER CA C 58.75 0.30 1 1731 238 242 SER CB C 63.80 0.30 1 1732 238 242 SER N N 116.30 0.30 1 1733 239 243 ASN H H 8.39 0.02 1 1734 239 243 ASN HA H 4.72 0.02 1 1735 239 243 ASN HB2 H 2.78 0.02 2 1736 239 243 ASN HB3 H 2.78 0.02 2 1737 239 243 ASN C C 175.21 0.30 1 1738 239 243 ASN CA C 53.35 0.30 1 1739 239 243 ASN CB C 39.03 0.30 1 1740 239 243 ASN N N 120.69 0.30 1 1741 240 244 GLU H H 8.32 0.02 1 1742 240 244 GLU HA H 4.20 0.02 1 1743 240 244 GLU HG2 H 2.17 0.02 2 1744 240 244 GLU HG3 H 2.17 0.02 2 1745 240 244 GLU C C 176.24 0.30 1 1746 240 244 GLU CA C 56.90 0.30 1 1747 240 244 GLU CB C 30.18 0.30 1 1748 240 244 GLU CG C 36.15 0.30 1 1749 240 244 GLU N N 120.84 0.30 1 1750 241 245 HIS H H 8.44 0.02 1 1751 241 245 HIS HB2 H 3.18 0.02 2 1752 241 245 HIS HB3 H 3.18 0.02 2 1753 241 245 HIS C C 174.66 0.30 1 1754 241 245 HIS CA C 55.46 0.30 1 1755 241 245 HIS CB C 29.52 0.30 1 1756 241 245 HIS N N 119.26 0.30 1 1757 242 246 SER H H 8.28 0.02 1 1758 242 246 SER HB2 H 3.84 0.02 2 1759 242 246 SER HB3 H 3.84 0.02 2 1760 242 246 SER C C 174.15 0.30 1 1761 242 246 SER CA C 58.39 0.30 1 1762 242 246 SER CB C 64.05 0.30 1 1763 242 246 SER N N 117.19 0.30 1 1764 243 247 ASP H H 8.58 0.02 1 1765 243 247 ASP N N 122.78 0.30 1 1766 244 248 VAL H H 8.06 0.02 1 1767 244 248 VAL HA H 4.08 0.02 1 1768 244 248 VAL HB H 2.03 0.02 1 1769 244 248 VAL HG1 H 0.92 0.02 2 1770 244 248 VAL HG2 H 0.88 0.02 2 1771 244 248 VAL C C 176.21 0.30 1 1772 244 248 VAL CA C 62.54 0.30 1 1773 244 248 VAL CB C 32.71 0.30 1 1774 244 248 VAL CG1 C 20.64 0.30 2 1775 244 248 VAL CG2 C 21.22 0.30 2 1776 244 248 VAL N N 120.23 0.30 1 1777 245 249 ILE H H 8.17 0.02 1 1778 245 249 ILE HA H 4.18 0.02 1 1779 245 249 ILE HB H 1.86 0.02 1 1780 245 249 ILE HG2 H 0.88 0.02 1 1781 245 249 ILE HD1 H 0.83 0.02 1 1782 245 249 ILE C C 175.98 0.30 1 1783 245 249 ILE CA C 61.18 0.30 1 1784 245 249 ILE CB C 38.85 0.30 1 1785 245 249 ILE CG2 C 17.49 0.30 1 1786 245 249 ILE CD1 C 12.92 0.30 1 1787 245 249 ILE N N 124.69 0.30 1 1788 246 250 ASP H H 8.40 0.02 1 1789 246 250 ASP HB2 H 2.68 0.02 2 1790 246 250 ASP HB3 H 2.68 0.02 2 1791 246 250 ASP C C 176.51 0.30 1 1792 246 250 ASP CA C 54.42 0.30 1 1793 246 250 ASP CB C 41.38 0.30 1 1794 246 250 ASP N N 124.65 0.30 1 1795 247 251 SER H H 8.29 0.02 1 1796 247 251 SER HB2 H 3.89 0.02 2 1797 247 251 SER HB3 H 3.89 0.02 2 1798 247 251 SER C C 175.30 0.30 1 1799 247 251 SER CA C 59.12 0.30 1 1800 247 251 SER CB C 63.53 0.30 1 1801 247 251 SER N N 116.87 0.30 1 1802 248 252 GLN H H 8.47 0.02 1 1803 248 252 GLN HA H 4.27 0.02 1 1804 248 252 GLN HG2 H 2.36 0.02 2 1805 248 252 GLN HG3 H 2.36 0.02 2 1806 248 252 GLN C C 176.60 0.30 1 1807 248 252 GLN CA C 56.66 0.30 1 1808 248 252 GLN CB C 29.06 0.30 1 1809 248 252 GLN CG C 34.05 0.30 1 1810 248 252 GLN N N 122.03 0.30 1 1811 249 253 GLU H H 8.27 0.02 1 1812 249 253 GLU HA H 4.21 0.02 1 1813 249 253 GLU HG2 H 2.25 0.02 2 1814 249 253 GLU HG3 H 2.25 0.02 2 1815 249 253 GLU C C 177.12 0.30 1 1816 249 253 GLU CA C 57.16 0.30 1 1817 249 253 GLU CB C 29.90 0.30 1 1818 249 253 GLU CG C 36.18 0.30 1 1819 249 253 GLU N N 121.13 0.30 1 1820 250 254 LEU H H 8.14 0.02 1 1821 250 254 LEU HA H 4.27 0.02 1 1822 250 254 LEU HB2 H 1.62 0.02 2 1823 250 254 LEU HB3 H 1.62 0.02 2 1824 250 254 LEU HG H 1.62 0.02 1 1825 250 254 LEU HD1 H 0.91 0.02 2 1826 250 254 LEU HD2 H 0.86 0.02 2 1827 250 254 LEU C C 177.97 0.30 1 1828 250 254 LEU CA C 55.87 0.30 1 1829 250 254 LEU CB C 42.14 0.30 1 1830 250 254 LEU CG C 27.02 0.30 1 1831 250 254 LEU CD1 C 24.93 0.30 2 1832 250 254 LEU CD2 C 23.31 0.30 2 1833 250 254 LEU N N 122.07 0.30 1 1834 251 255 SER H H 8.16 0.02 1 1835 251 255 SER HB2 H 3.89 0.02 2 1836 251 255 SER HB3 H 3.89 0.02 2 1837 251 255 SER C C 174.90 0.30 1 1838 251 255 SER CA C 58.92 0.30 1 1839 251 255 SER CB C 63.48 0.30 1 1840 251 255 SER N N 115.45 0.30 1 1841 252 256 LYS H H 8.13 0.02 1 1842 252 256 LYS HA H 4.28 0.02 1 1843 252 256 LYS HB2 H 1.83 0.02 2 1844 252 256 LYS HB3 H 1.83 0.02 2 1845 252 256 LYS HG2 H 1.41 0.02 2 1846 252 256 LYS HG3 H 1.41 0.02 2 1847 252 256 LYS C C 176.88 0.30 1 1848 252 256 LYS CA C 56.92 0.30 1 1849 252 256 LYS CB C 32.89 0.30 1 1850 252 256 LYS CG C 24.88 0.30 1 1851 252 256 LYS N N 122.73 0.30 1 1852 253 257 VAL H H 7.94 0.02 1 1853 253 257 VAL HA H 4.10 0.02 1 1854 253 257 VAL HB H 2.08 0.02 1 1855 253 257 VAL HG1 H 0.93 0.02 2 1856 253 257 VAL HG2 H 0.92 0.02 2 1857 253 257 VAL C C 176.42 0.30 1 1858 253 257 VAL CA C 62.64 0.30 1 1859 253 257 VAL CB C 32.72 0.30 1 1860 253 257 VAL CG1 C 20.78 0.30 2 1861 253 257 VAL CG2 C 21.05 0.30 2 1862 253 257 VAL N N 119.53 0.30 1 1863 254 258 SER H H 8.28 0.02 1 1864 254 258 SER HB2 H 3.87 0.02 2 1865 254 258 SER HB3 H 3.87 0.02 2 1866 254 258 SER C C 174.84 0.30 1 1867 254 258 SER CA C 58.56 0.30 1 1868 254 258 SER CB C 63.76 0.30 1 1869 254 258 SER N N 118.98 0.30 1 1870 255 259 ARG H H 8.35 0.02 1 1871 255 259 ARG HA H 4.28 0.02 1 1872 255 259 ARG HG2 H 1.60 0.02 2 1873 255 259 ARG HG3 H 1.60 0.02 2 1874 255 259 ARG C C 176.31 0.30 1 1875 255 259 ARG CA C 56.50 0.30 1 1876 255 259 ARG CB C 30.67 0.30 1 1877 255 259 ARG CG C 27.17 0.30 1 1878 255 259 ARG N N 123.14 0.30 1 1879 256 260 GLU H H 8.28 0.02 1 1880 256 260 GLU HA H 4.18 0.02 1 1881 256 260 GLU HG2 H 2.13 0.02 2 1882 256 260 GLU HG3 H 2.13 0.02 2 1883 256 260 GLU C C 176.16 0.30 1 1884 256 260 GLU CA C 56.68 0.30 1 1885 256 260 GLU CB C 30.24 0.30 1 1886 256 260 GLU CG C 36.16 0.30 1 1887 256 260 GLU N N 120.94 0.30 1 1888 257 261 PHE H H 8.17 0.02 1 1889 257 261 PHE N N 121.12 0.30 1 1890 266 270 GLU H H 8.42 0.02 1 1891 266 270 GLU HA H 4.21 0.02 1 1892 266 270 GLU HG2 H 2.20 0.02 2 1893 266 270 GLU HG3 H 2.20 0.02 2 1894 266 270 GLU C C 176.25 0.30 1 1895 266 270 GLU CA C 57.02 0.30 1 1896 266 270 GLU CB C 30.22 0.30 1 1897 266 270 GLU CG C 36.30 0.30 1 1898 266 270 GLU N N 121.46 0.30 1 1899 267 271 ASP H H 8.36 0.02 1 1900 267 271 ASP HB2 H 2.65 0.02 2 1901 267 271 ASP HB3 H 2.65 0.02 2 1902 267 271 ASP C C 176.23 0.30 1 1903 267 271 ASP CA C 54.67 0.30 1 1904 267 271 ASP CB C 41.07 0.30 1 1905 267 271 ASP N N 121.00 0.30 1 1906 268 272 MET H H 8.15 0.02 1 1907 268 272 MET HA H 4.39 0.02 1 1908 268 272 MET HG2 H 2.52 0.02 2 1909 268 272 MET HG3 H 2.52 0.02 2 1910 268 272 MET C C 175.94 0.30 1 1911 268 272 MET CA C 55.61 0.30 1 1912 268 272 MET CG C 32.90 0.30 1 1913 268 272 MET N N 120.08 0.30 1 1914 269 273 LEU H H 8.14 0.02 1 1915 269 273 LEU HA H 4.31 0.02 1 1916 269 273 LEU HB2 H 1.57 0.02 2 1917 269 273 LEU HB3 H 1.57 0.02 2 1918 269 273 LEU HD1 H 0.88 0.02 2 1919 269 273 LEU HD2 H 0.84 0.02 2 1920 269 273 LEU C C 176.98 0.30 1 1921 269 273 LEU CA C 55.31 0.30 1 1922 269 273 LEU CB C 42.26 0.30 1 1923 269 273 LEU CD1 C 24.83 0.30 2 1924 269 273 LEU CD2 C 23.67 0.30 2 1925 269 273 LEU N N 123.05 0.30 1 1926 270 274 VAL H H 8.06 0.02 1 1927 270 274 VAL HA H 4.08 0.02 1 1928 270 274 VAL HB H 2.02 0.02 1 1929 270 274 VAL HG1 H 0.89 0.02 2 1930 270 274 VAL HG2 H 0.88 0.02 2 1931 270 274 VAL C C 175.87 0.30 1 1932 270 274 VAL CA C 62.31 0.30 1 1933 270 274 VAL CB C 32.76 0.30 1 1934 270 274 VAL CG1 C 20.81 0.30 2 1935 270 274 VAL CG2 C 21.09 0.30 2 1936 270 274 VAL N N 122.10 0.30 1 1937 271 275 VAL H H 8.17 0.02 1 1938 271 275 VAL HA H 4.07 0.02 1 1939 271 275 VAL HB H 1.99 0.02 1 1940 271 275 VAL HG2 H 0.86 0.02 2 1941 271 275 VAL C C 175.39 0.30 1 1942 271 275 VAL CA C 61.93 0.30 1 1943 271 275 VAL CB C 33.00 0.30 1 1944 271 275 VAL CG2 C 20.67 0.30 2 1945 271 275 VAL N N 124.56 0.30 1 1946 272 276 ASP H H 8.46 0.02 1 1947 272 276 ASP N N 125.77 0.30 1 1948 273 277 PRO HA H 4.37 0.02 1 1949 273 277 PRO C C 177.59 0.30 1 1950 273 277 PRO CA C 63.85 0.30 1 1951 273 277 PRO CB C 32.17 0.30 1 1952 274 278 LYS H H 8.38 0.02 1 1953 274 278 LYS HA H 4.25 0.02 1 1954 274 278 LYS HB2 H 1.84 0.02 2 1955 274 278 LYS HB3 H 1.84 0.02 2 1956 274 278 LYS C C 177.26 0.30 1 1957 274 278 LYS CA C 56.79 0.30 1 1958 274 278 LYS CB C 32.24 0.30 1 1959 274 278 LYS N N 119.55 0.30 1 1960 275 279 SER H H 8.05 0.02 1 1961 275 279 SER HB2 H 3.90 0.02 2 1962 275 279 SER HB3 H 3.90 0.02 2 1963 275 279 SER C C 174.81 0.30 1 1964 275 279 SER CA C 58.85 0.30 1 1965 275 279 SER CB C 63.86 0.30 1 1966 275 279 SER N N 115.99 0.30 1 1967 276 280 LYS H H 8.22 0.02 1 1968 276 280 LYS HA H 4.31 0.02 1 1969 276 280 LYS HB2 H 1.81 0.02 2 1970 276 280 LYS HB3 H 1.81 0.02 2 1971 276 280 LYS HG2 H 1.43 0.02 2 1972 276 280 LYS HG3 H 1.43 0.02 2 1973 276 280 LYS HD2 H 1.67 0.02 2 1974 276 280 LYS HD3 H 1.67 0.02 2 1975 276 280 LYS C C 176.91 0.30 1 1976 276 280 LYS CA C 56.59 0.30 1 1977 276 280 LYS CB C 32.87 0.30 1 1978 276 280 LYS CG C 24.66 0.30 1 1979 276 280 LYS CD C 29.20 0.30 1 1980 276 280 LYS N N 122.88 0.30 1 1981 277 281 GLU H H 8.30 0.02 1 1982 277 281 GLU HA H 4.20 0.02 1 1983 277 281 GLU HB2 H 1.97 0.02 2 1984 277 281 GLU HB3 H 1.97 0.02 2 1985 277 281 GLU HG2 H 2.26 0.02 2 1986 277 281 GLU HG3 H 2.26 0.02 2 1987 277 281 GLU C C 176.92 0.30 1 1988 277 281 GLU CA C 57.03 0.30 1 1989 277 281 GLU CB C 30.15 0.30 1 1990 277 281 GLU CG C 36.22 0.30 1 1991 277 281 GLU N N 121.61 0.30 1 1992 278 282 GLU H H 8.43 0.02 1 1993 278 282 GLU HA H 4.19 0.02 1 1994 278 282 GLU HB2 H 2.00 0.02 2 1995 278 282 GLU HB3 H 2.00 0.02 2 1996 278 282 GLU HG2 H 2.25 0.02 2 1997 278 282 GLU HG3 H 2.25 0.02 2 1998 278 282 GLU C C 176.53 0.30 1 1999 278 282 GLU CA C 57.07 0.30 1 2000 278 282 GLU CB C 30.32 0.30 1 2001 278 282 GLU CG C 36.29 0.30 1 2002 278 282 GLU N N 121.39 0.30 1 2003 279 283 ASP H H 8.29 0.02 1 2004 279 283 ASP HB2 H 2.67 0.02 2 2005 279 283 ASP HB3 H 2.67 0.02 2 2006 279 283 ASP C C 176.97 0.30 1 2007 279 283 ASP CA C 54.73 0.30 1 2008 279 283 ASP CB C 41.07 0.30 1 2009 279 283 ASP N N 121.36 0.30 1 2010 280 284 LYS H H 8.21 0.02 1 2011 280 284 LYS C C 177.07 0.30 1 2012 280 284 LYS CA C 57.27 0.30 1 2013 280 284 LYS CB C 32.54 0.30 1 2014 280 284 LYS N N 121.80 0.30 1 2015 281 285 HIS H H 8.34 0.02 1 2016 281 285 HIS HB2 H 3.19 0.02 2 2017 281 285 HIS HB3 H 3.19 0.02 2 2018 281 285 HIS C C 175.40 0.30 1 2019 281 285 HIS CA C 56.43 0.30 1 2020 281 285 HIS CB C 29.26 0.30 1 2021 281 285 HIS N N 118.11 0.30 1 2022 282 286 LEU H H 7.97 0.02 1 2023 282 286 LEU C C 177.49 0.30 1 2024 282 286 LEU CA C 55.81 0.30 1 2025 282 286 LEU CB C 42.15 0.30 1 2026 282 286 LEU N N 121.90 0.30 1 2027 283 287 LYS H H 8.13 0.02 1 2028 283 287 LYS HA H 4.17 0.02 1 2029 283 287 LYS HB2 H 1.67 0.02 2 2030 283 287 LYS HB3 H 1.67 0.02 2 2031 283 287 LYS HG2 H 1.25 0.02 2 2032 283 287 LYS HG3 H 1.25 0.02 2 2033 283 287 LYS C C 176.46 0.30 1 2034 283 287 LYS CA C 56.77 0.30 1 2035 283 287 LYS CB C 32.85 0.30 1 2036 283 287 LYS CG C 24.83 0.30 1 2037 283 287 LYS N N 120.67 0.30 1 2038 284 288 PHE H H 8.01 0.02 1 2039 284 288 PHE HB2 H 3.03 0.02 2 2040 284 288 PHE HB3 H 3.03 0.02 2 2041 284 288 PHE C C 175.53 0.30 1 2042 284 288 PHE CA C 57.78 0.30 1 2043 284 288 PHE CB C 39.60 0.30 1 2044 284 288 PHE N N 120.10 0.30 1 2045 285 289 ARG H H 8.13 0.02 1 2046 285 289 ARG C C 176.01 0.30 1 2047 285 289 ARG CA C 56.23 0.30 1 2048 285 289 ARG CB C 31.03 0.30 1 2049 285 289 ARG N N 122.48 0.30 1 2050 286 290 ILE H H 8.19 0.02 1 2051 286 290 ILE C C 176.23 0.30 1 2052 286 290 ILE CA C 61.33 0.30 1 2053 286 290 ILE CB C 38.81 0.30 1 2054 286 290 ILE N N 121.95 0.30 1 2055 288 292 HIS H H 8.29 0.02 1 2056 288 292 HIS HB2 H 3.06 0.02 2 2057 288 292 HIS HB3 H 3.25 0.02 2 2058 288 292 HIS C C 174.87 0.30 1 2059 288 292 HIS CA C 56.04 0.30 1 2060 288 292 HIS CB C 29.63 0.30 1 2061 288 292 HIS N N 119.10 0.30 1 2062 289 293 GLU H H 8.43 0.02 1 2063 289 293 GLU HA H 4.21 0.02 1 2064 289 293 GLU HB2 H 2.06 0.02 2 2065 289 293 GLU HB3 H 2.06 0.02 2 2066 289 293 GLU HG2 H 2.23 0.02 2 2067 289 293 GLU HG3 H 2.23 0.02 2 2068 289 293 GLU C C 176.60 0.30 1 2069 289 293 GLU CA C 57.09 0.30 1 2070 289 293 GLU CB C 30.09 0.30 1 2071 289 293 GLU CG C 36.19 0.30 1 2072 289 293 GLU N N 121.62 0.30 1 2073 290 294 LEU H H 8.29 0.02 1 2074 290 294 LEU HA H 4.32 0.02 1 2075 290 294 LEU HB2 H 1.61 0.02 2 2076 290 294 LEU HB3 H 1.61 0.02 2 2077 290 294 LEU HD1 H 0.90 0.02 2 2078 290 294 LEU HD2 H 0.86 0.02 2 2079 290 294 LEU C C 177.30 0.30 1 2080 290 294 LEU CA C 55.29 0.30 1 2081 290 294 LEU CB C 42.32 0.30 1 2082 290 294 LEU CD1 C 24.98 0.30 2 2083 290 294 LEU CD2 C 23.36 0.30 2 2084 290 294 LEU N N 122.15 0.30 1 2085 291 295 ASP H H 8.26 0.02 1 2086 291 295 ASP HA H 4.60 0.02 1 2087 291 295 ASP HB2 H 2.69 0.02 2 2088 291 295 ASP HB3 H 2.69 0.02 2 2089 291 295 ASP C C 176.56 0.30 1 2090 291 295 ASP CA C 54.51 0.30 1 2091 291 295 ASP CB C 41.17 0.30 1 2092 291 295 ASP N N 121.18 0.30 1 2093 292 296 SER H H 8.22 0.02 1 2094 292 296 SER HB2 H 3.87 0.02 2 2095 292 296 SER HB3 H 3.87 0.02 2 2096 292 296 SER C C 174.61 0.30 1 2097 292 296 SER CA C 58.67 0.30 1 2098 292 296 SER CB C 63.79 0.30 1 2099 292 296 SER N N 116.29 0.30 1 2100 293 297 ALA H H 8.30 0.02 1 2101 293 297 ALA HA H 4.36 0.02 1 2102 293 297 ALA HB H 1.41 0.02 1 2103 293 297 ALA C C 178.00 0.30 1 2104 293 297 ALA CA C 52.82 0.30 1 2105 293 297 ALA CB C 19.30 0.30 1 2106 293 297 ALA N N 125.66 0.30 1 2107 294 298 SER H H 8.19 0.02 1 2108 294 298 SER HB2 H 3.89 0.02 2 2109 294 298 SER HB3 H 3.89 0.02 2 2110 294 298 SER C C 174.73 0.30 1 2111 294 298 SER CA C 58.43 0.30 1 2112 294 298 SER CB C 63.90 0.30 1 2113 294 298 SER N N 114.69 0.30 1 2114 295 299 SER H H 8.29 0.02 1 2115 295 299 SER HB2 H 3.87 0.02 2 2116 295 299 SER HB3 H 3.87 0.02 2 2117 295 299 SER C C 174.40 0.30 1 2118 295 299 SER CA C 58.47 0.30 1 2119 295 299 SER CB C 64.02 0.30 1 2120 295 299 SER N N 117.74 0.30 1 2121 296 300 GLU H H 8.36 0.02 1 2122 296 300 GLU HA H 4.33 0.02 1 2123 296 300 GLU HB2 H 2.03 0.02 2 2124 296 300 GLU HB3 H 1.96 0.02 2 2125 296 300 GLU HG2 H 2.24 0.02 2 2126 296 300 GLU HG3 H 2.24 0.02 2 2127 296 300 GLU C C 176.21 0.30 1 2128 296 300 GLU CA C 56.58 0.30 1 2129 296 300 GLU CB C 30.38 0.30 1 2130 296 300 GLU CG C 36.26 0.30 1 2131 296 300 GLU N N 122.67 0.30 1 2132 297 301 VAL H H 8.10 0.02 1 2133 297 301 VAL HA H 4.15 0.02 1 2134 297 301 VAL HB H 2.08 0.02 1 2135 297 301 VAL HG1 H 0.92 0.02 2 2136 297 301 VAL HG2 H 0.90 0.02 2 2137 297 301 VAL C C 175.07 0.30 1 2138 297 301 VAL CA C 62.22 0.30 1 2139 297 301 VAL CB C 32.86 0.30 1 2140 297 301 VAL CG1 C 21.23 0.30 2 2141 297 301 VAL CG2 C 20.20 0.30 2 2142 297 301 VAL N N 120.71 0.30 1 2143 298 302 ASN H H 8.07 0.02 1 2144 298 302 ASN CA C 54.82 0.30 1 2145 298 302 ASN CB C 40.43 0.30 1 2146 298 302 ASN N N 127.9 0.30 1 stop_ save_