data_27080 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone resonance assignment of the Human Uracil DNA Glycosylase-2 ; _BMRB_accession_number 27080 _BMRB_flat_file_name bmr27080.str _Entry_type original _Submission_date 2017-04-20 _Accession_date 2017-04-20 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'NMR structural study of the UNG2 protein' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kara Hesna . . 2 Ponchon Luc . . 3 Bouaziz Serge . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 231 "13C chemical shifts" 692 "15N chemical shifts" 231 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-04-10 update BMRB 'update entry citation' 2017-10-04 original author 'original release' stop_ _Original_release_date 2017-04-20 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Backbone resonance assignment of the Human Uracil DNA Glycosylase-2 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 28940147 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kara Hesna . . 2 Ponchon Luc . . 3 Bouaziz Serge . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume 12 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 37 _Page_last 42 _Year 2018 _Details . loop_ _Keyword 'Base excision repair' HIV-1 UNG2 Vpr stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name UNG2 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label UNG2 $UNG2 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_UNG2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common UNG2 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 248 _Mol_residue_sequence ; MGSSHHHHHHSSGLVPRGSH MENLYFQGFGESWKKHLSGE FGKPYFIKLMGFVAEERKHY TVYPPPHQVFTWTQMCDIKD VKVVILGQDPYHGPNQAHGL CFSVQRPVPPPPSLENIYKE LSTDIEDFVHPGHGDLSGWA KQGVLLLNAVLTVRAHQANS HKERGWEQFTDAVVSWLNQN SNGLVFLLWGSYAQKKGSAI DRKRHHVLQTAHPSPLSVYR GFFGCRHFSKTNELLQKSGK KPIDWKEL ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 66 MET 2 67 GLY 3 68 SER 4 69 SER 5 70 HIS 6 71 HIS 7 72 HIS 8 73 HIS 9 74 HIS 10 75 HIS 11 76 SER 12 77 SER 13 78 GLY 14 79 LEU 15 80 VAL 16 81 PRO 17 82 ARG 18 83 GLY 19 84 SER 20 85 HIS 21 86 MET 22 87 GLU 23 88 ASN 24 89 LEU 25 90 TYR 26 91 PHE 27 92 GLN 28 93 GLY 29 94 PHE 30 95 GLY 31 96 GLU 32 97 SER 33 98 TRP 34 99 LYS 35 100 LYS 36 101 HIS 37 102 LEU 38 103 SER 39 104 GLY 40 105 GLU 41 106 PHE 42 107 GLY 43 108 LYS 44 109 PRO 45 110 TYR 46 111 PHE 47 112 ILE 48 113 LYS 49 114 LEU 50 115 MET 51 116 GLY 52 117 PHE 53 118 VAL 54 119 ALA 55 120 GLU 56 121 GLU 57 122 ARG 58 123 LYS 59 124 HIS 60 125 TYR 61 126 THR 62 127 VAL 63 128 TYR 64 129 PRO 65 130 PRO 66 131 PRO 67 132 HIS 68 133 GLN 69 134 VAL 70 135 PHE 71 136 THR 72 137 TRP 73 138 THR 74 139 GLN 75 140 MET 76 141 CYS 77 142 ASP 78 143 ILE 79 144 LYS 80 145 ASP 81 146 VAL 82 147 LYS 83 148 VAL 84 149 VAL 85 150 ILE 86 151 LEU 87 152 GLY 88 153 GLN 89 154 ASP 90 155 PRO 91 156 TYR 92 157 HIS 93 158 GLY 94 159 PRO 95 160 ASN 96 161 GLN 97 162 ALA 98 163 HIS 99 164 GLY 100 165 LEU 101 166 CYS 102 167 PHE 103 168 SER 104 169 VAL 105 170 GLN 106 171 ARG 107 172 PRO 108 173 VAL 109 174 PRO 110 175 PRO 111 176 PRO 112 177 PRO 113 178 SER 114 179 LEU 115 180 GLU 116 181 ASN 117 182 ILE 118 183 TYR 119 184 LYS 120 185 GLU 121 186 LEU 122 187 SER 123 188 THR 124 189 ASP 125 190 ILE 126 191 GLU 127 192 ASP 128 193 PHE 129 194 VAL 130 195 HIS 131 196 PRO 132 197 GLY 133 198 HIS 134 199 GLY 135 200 ASP 136 201 LEU 137 202 SER 138 203 GLY 139 204 TRP 140 205 ALA 141 206 LYS 142 207 GLN 143 208 GLY 144 209 VAL 145 210 LEU 146 211 LEU 147 212 LEU 148 213 ASN 149 214 ALA 150 215 VAL 151 216 LEU 152 217 THR 153 218 VAL 154 219 ARG 155 220 ALA 156 221 HIS 157 222 GLN 158 223 ALA 159 224 ASN 160 225 SER 161 226 HIS 162 227 LYS 163 228 GLU 164 229 ARG 165 230 GLY 166 231 TRP 167 232 GLU 168 233 GLN 169 234 PHE 170 235 THR 171 236 ASP 172 237 ALA 173 238 VAL 174 239 VAL 175 240 SER 176 241 TRP 177 242 LEU 178 243 ASN 179 244 GLN 180 245 ASN 181 246 SER 182 247 ASN 183 248 GLY 184 249 LEU 185 250 VAL 186 251 PHE 187 252 LEU 188 253 LEU 189 254 TRP 190 255 GLY 191 256 SER 192 257 TYR 193 258 ALA 194 259 GLN 195 260 LYS 196 261 LYS 197 262 GLY 198 263 SER 199 264 ALA 200 265 ILE 201 266 ASP 202 267 ARG 203 268 LYS 204 269 ARG 205 270 HIS 206 271 HIS 207 272 VAL 208 273 LEU 209 274 GLN 210 275 THR 211 276 ALA 212 277 HIS 213 278 PRO 214 279 SER 215 280 PRO 216 281 LEU 217 282 SER 218 283 VAL 219 284 TYR 220 285 ARG 221 286 GLY 222 287 PHE 223 288 PHE 224 289 GLY 225 290 CYS 226 291 ARG 227 292 HIS 228 293 PHE 229 294 SER 230 295 LYS 231 296 THR 232 297 ASN 233 298 GLU 234 299 LEU 235 300 LEU 236 301 GLN 237 302 LYS 238 303 SER 239 304 GLY 240 305 LYS 241 306 LYS 242 307 PRO 243 308 ILE 244 309 ASP 245 310 TRP 246 311 LYS 247 312 GLU 248 313 LEU 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 $UNG2 'E. coli' 562 Bacteria . Escherichia coli 'BL21 (DE3)' 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 $UNG2 'recombinant technology' . Escherichia coli . pet28a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $UNG2 0.4 mM '[U-100% 13C; U-100% 15N]' 'potassium phosphate' 40 mM 'natural abundance' DTT 5 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 3.5 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task acquisition processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details 'Equipped with cryprobe' save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _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' 50 . mM pH 6.5 . pH pressure 1 . atm temperature 303 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _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 TRIS C 13 'methyl carbon' ppm 57.5 internal direct . . . 1 water H 1 protons ppm 4.828 internal direct . . . 1 TRIS N 15 nitrogen ppm 124.4 internal direct . . . 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name UNG2 _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 66 1 MET C C 178.675 0.000 1 2 66 1 MET CA C 56.686 0.000 1 3 66 1 MET CB C 31.690 0.000 1 4 67 2 GLY H H 8.533 0.014 1 5 67 2 GLY C C 175.513 0.000 1 6 67 2 GLY CA C 43.171 0.000 1 7 67 2 GLY N N 111.182 0.000 1 8 68 3 SER H H 8.527 0.004 1 9 68 3 SER C C 177.238 0.000 1 10 68 3 SER CA C 57.546 0.000 1 11 68 3 SER CB C 55.688 0.000 1 12 68 3 SER N N 120.872 0.040 1 13 69 4 SER H H 8.343 0.001 1 14 69 4 SER C C 175.736 0.000 1 15 69 4 SER CA C 55.872 0.000 1 16 69 4 SER CB C 74.773 0.000 1 17 69 4 SER N N 118.701 0.000 1 18 70 5 HIS H H 7.893 0.010 1 19 70 5 HIS C C 174.068 0.000 1 20 70 5 HIS CA C 53.805 0.000 1 21 70 5 HIS CB C 28.798 0.000 1 22 70 5 HIS N N 126.657 0.016 1 23 71 6 HIS H H 6.866 0.024 1 24 71 6 HIS C C 172.809 0.000 1 25 71 6 HIS CA C 57.787 0.000 1 26 71 6 HIS CB C 35.889 0.000 1 27 71 6 HIS N N 113.063 0.000 1 28 72 7 HIS H H 9.087 0.002 1 29 72 7 HIS C C 174.814 0.000 1 30 72 7 HIS CA C 56.871 0.000 1 31 72 7 HIS CB C 32.423 0.000 1 32 72 7 HIS N N 128.276 0.000 1 33 73 8 HIS H H 8.207 0.006 1 34 73 8 HIS C C 174.810 0.000 1 35 73 8 HIS CA C 51.078 0.000 1 36 73 8 HIS CB C 27.887 0.000 1 37 73 8 HIS N N 122.473 0.000 1 38 74 9 HIS H H 8.022 0.011 1 39 74 9 HIS C C 174.021 0.000 1 40 74 9 HIS CA C 58.440 0.000 1 41 74 9 HIS CB C 31.230 0.000 1 42 74 9 HIS N N 127.425 0.000 1 43 75 10 HIS H H 7.647 0.016 1 44 75 10 HIS C C 179.004 0.000 1 45 75 10 HIS CA C 57.630 0.000 1 46 75 10 HIS CB C 34.250 0.000 1 47 75 10 HIS N N 120.436 0.002 1 48 76 11 SER H H 6.808 0.015 1 49 76 11 SER C C 175.908 0.000 1 50 76 11 SER N N 111.291 0.349 1 51 77 12 SER H H 9.026 0.001 1 52 77 12 SER C C 178.994 0.000 1 53 77 12 SER CB C 62.900 0.000 1 54 77 12 SER N N 122.288 0.000 1 55 78 13 GLY H H 8.009 0.006 1 56 78 13 GLY C C 171.182 0.000 1 57 78 13 GLY CA C 45.123 0.027 1 58 78 13 GLY N N 118.723 0.051 1 59 79 14 LEU H H 10.922 0.039 1 60 79 14 LEU C C 178.913 0.000 1 61 79 14 LEU CA C 52.412 0.073 1 62 79 14 LEU CB C 42.151 0.027 1 63 79 14 LEU N N 127.947 0.011 1 64 80 15 VAL H H 7.330 0.001 1 65 80 15 VAL CA C 63.729 0.000 1 66 80 15 VAL CB C 35.952 0.000 1 67 80 15 VAL N N 132.212 0.000 1 68 81 16 PRO C C 174.817 0.000 1 69 81 16 PRO CA C 66.809 0.000 1 70 81 16 PRO CB C 21.843 0.000 1 71 82 17 ARG H H 7.108 0.006 1 72 82 17 ARG C C 174.731 0.000 1 73 82 17 ARG CA C 53.940 0.000 1 74 82 17 ARG CB C 36.366 0.000 1 75 82 17 ARG N N 121.090 0.025 1 76 83 18 GLY H H 7.938 0.007 1 77 83 18 GLY C C 175.389 0.000 1 78 83 18 GLY CA C 44.231 0.000 1 79 83 18 GLY N N 118.352 0.011 1 80 84 19 SER H H 7.808 0.018 1 81 84 19 SER C C 171.444 0.000 1 82 84 19 SER CA C 60.510 0.000 1 83 84 19 SER CB C 63.382 0.000 1 84 84 19 SER N N 122.529 0.070 1 85 85 20 HIS H H 5.929 0.016 1 86 85 20 HIS C C 177.716 0.000 1 87 85 20 HIS CA C 52.019 0.000 1 88 85 20 HIS CB C 30.623 0.000 1 89 85 20 HIS N N 123.686 0.000 1 90 86 21 MET H H 7.523 0.003 1 91 86 21 MET C C 178.312 0.000 1 92 86 21 MET CA C 54.094 0.000 1 93 86 21 MET CB C 36.552 0.000 1 94 86 21 MET N N 115.756 0.005 1 95 87 22 GLU H H 8.149 0.013 1 96 87 22 GLU C C 176.252 0.000 1 97 87 22 GLU CA C 57.872 0.099 1 98 87 22 GLU CB C 28.871 0.000 1 99 87 22 GLU N N 116.535 0.064 1 100 88 23 ASN H H 8.244 0.006 1 101 88 23 ASN C C 177.917 0.000 1 102 88 23 ASN CA C 52.231 0.000 1 103 88 23 ASN CB C 38.745 0.000 1 104 88 23 ASN N N 117.453 0.000 1 105 89 24 LEU H H 10.141 0.015 1 106 89 24 LEU C C 176.529 0.000 1 107 89 24 LEU CA C 60.271 0.000 1 108 89 24 LEU CB C 40.223 0.000 1 109 89 24 LEU N N 123.336 0.000 1 110 90 25 TYR H H 7.753 0.013 1 111 90 25 TYR C C 177.134 0.000 1 112 90 25 TYR CA C 56.900 0.000 1 113 90 25 TYR CB C 35.983 0.000 1 114 90 25 TYR N N 119.796 0.055 1 115 91 26 PHE H H 8.091 0.003 1 116 91 26 PHE C C 175.699 0.000 1 117 91 26 PHE CA C 31.862 0.000 1 118 91 26 PHE CB C 55.807 0.000 1 119 91 26 PHE N N 117.636 0.015 1 120 92 27 GLN H H 8.089 0.010 1 121 92 27 GLN C C 175.861 0.000 1 122 92 27 GLN CA C 53.772 0.009 1 123 92 27 GLN CB C 26.590 0.008 1 124 92 27 GLN N N 121.909 0.003 1 125 93 28 GLY H H 7.357 0.006 1 126 93 28 GLY C C 175.304 0.000 1 127 93 28 GLY CA C 44.139 0.000 1 128 93 28 GLY N N 107.250 0.075 1 129 94 29 PHE H H 7.372 0.018 1 130 94 29 PHE C C 173.681 0.000 1 131 94 29 PHE CA C 51.121 0.000 1 132 94 29 PHE CB C 37.992 0.000 1 133 94 29 PHE N N 127.986 0.044 1 134 95 30 GLY H H 8.565 0.001 1 135 95 30 GLY C C 173.792 0.000 1 136 95 30 GLY CA C 45.298 0.084 1 137 95 30 GLY N N 115.103 0.030 1 138 96 31 GLU H H 6.045 0.011 1 139 96 31 GLU C C 172.893 0.000 1 140 96 31 GLU CA C 50.736 0.000 1 141 96 31 GLU CB C 26.394 0.000 1 142 96 31 GLU N N 116.710 0.010 1 143 97 32 SER H H 7.829 0.010 1 144 97 32 SER C C 176.276 0.000 1 145 97 32 SER CA C 56.281 0.000 1 146 97 32 SER CB C 62.428 0.000 1 147 97 32 SER N N 113.340 0.000 1 148 98 33 TRP H H 8.301 0.005 1 149 98 33 TRP C C 177.559 0.000 1 150 98 33 TRP CA C 61.468 0.000 1 151 98 33 TRP CB C 28.619 0.000 1 152 98 33 TRP N N 123.136 0.000 1 153 99 34 LYS H H 8.010 0.001 1 154 99 34 LYS C C 179.561 0.000 1 155 99 34 LYS CA C 54.008 0.000 1 156 99 34 LYS CB C 31.643 0.000 1 157 99 34 LYS N N 124.166 0.122 1 158 100 35 LYS H H 7.788 0.005 1 159 100 35 LYS C C 175.074 0.000 1 160 100 35 LYS CA C 57.516 0.016 1 161 100 35 LYS CB C 30.891 0.000 1 162 100 35 LYS N N 123.586 0.003 1 163 101 36 HIS H H 6.682 0.005 1 164 101 36 HIS C C 175.734 0.000 1 165 101 36 HIS CA C 56.677 0.011 1 166 101 36 HIS CB C 29.768 0.000 1 167 101 36 HIS N N 115.546 0.006 1 168 102 37 LEU H H 7.672 0.004 1 169 102 37 LEU C C 175.906 0.000 1 170 102 37 LEU CA C 53.109 0.026 1 171 102 37 LEU CB C 41.193 0.022 1 172 102 37 LEU N N 119.367 0.011 1 173 103 38 SER H H 7.328 0.002 1 174 103 38 SER C C 175.620 0.000 1 175 103 38 SER CA C 59.253 0.083 1 176 103 38 SER CB C 61.430 0.060 1 177 103 38 SER N N 115.077 0.005 1 178 104 39 GLY H H 8.562 0.015 1 179 104 39 GLY C C 176.074 0.000 1 180 104 39 GLY CA C 44.745 0.000 1 181 104 39 GLY N N 113.204 0.004 1 182 105 40 GLU H H 7.816 0.006 1 183 105 40 GLU C C 179.199 0.000 1 184 105 40 GLU CA C 56.431 0.037 1 185 105 40 GLU CB C 28.583 0.000 1 186 105 40 GLU N N 118.071 0.016 1 187 106 41 PHE H H 6.549 0.008 1 188 106 41 PHE C C 175.673 0.000 1 189 106 41 PHE CA C 54.978 0.016 1 190 106 41 PHE CB C 35.472 0.000 1 191 106 41 PHE N N 113.502 0.001 1 192 107 42 GLY H H 7.251 0.002 1 193 107 42 GLY C C 174.699 0.000 1 194 107 42 GLY CA C 42.708 0.026 1 195 107 42 GLY N N 102.786 0.029 1 196 108 43 LYS H H 7.395 0.003 1 197 108 43 LYS CA C 53.910 0.000 1 198 108 43 LYS CB C 31.404 0.000 1 199 108 43 LYS N N 123.501 0.049 1 200 109 44 PRO C C 174.828 0.000 1 201 109 44 PRO CA C 63.303 0.000 1 202 109 44 PRO CB C 28.867 0.000 1 203 110 45 TYR H H 7.590 0.012 1 204 110 45 TYR C C 172.443 0.000 1 205 110 45 TYR CA C 59.358 0.076 1 206 110 45 TYR CB C 34.406 0.000 1 207 110 45 TYR N N 118.339 0.047 1 208 111 46 PHE H H 6.549 0.027 1 209 111 46 PHE C C 177.428 0.000 1 210 111 46 PHE CA C 59.282 0.000 1 211 111 46 PHE CB C 39.170 0.000 1 212 111 46 PHE N N 130.122 0.007 1 213 112 47 ILE H H 7.467 0.003 1 214 112 47 ILE C C 179.505 0.000 1 215 112 47 ILE CA C 63.463 0.008 1 216 112 47 ILE CB C 37.347 0.055 1 217 112 47 ILE N N 122.244 0.027 1 218 113 48 LYS H H 7.858 0.010 1 219 113 48 LYS C C 178.798 0.004 1 220 113 48 LYS CA C 58.236 0.002 1 221 113 48 LYS CB C 31.174 0.004 1 222 113 48 LYS N N 121.622 0.000 1 223 114 49 LEU H H 7.651 0.005 1 224 114 49 LEU C C 177.183 0.000 1 225 114 49 LEU CA C 57.082 0.000 1 226 114 49 LEU CB C 40.543 0.092 1 227 114 49 LEU N N 125.120 0.103 1 228 115 50 MET H H 8.099 0.002 1 229 115 50 MET C C 179.716 0.000 1 230 115 50 MET CA C 55.831 0.000 1 231 115 50 MET CB C 32.444 0.000 1 232 115 50 MET N N 117.642 0.000 1 233 116 51 GLY H H 7.816 0.003 1 234 116 51 GLY C C 175.295 0.000 1 235 116 51 GLY CA C 45.597 0.005 1 236 116 51 GLY N N 108.823 0.029 1 237 117 52 PHE H H 8.028 0.001 1 238 117 52 PHE C C 176.112 0.013 1 239 117 52 PHE CA C 59.898 0.000 1 240 117 52 PHE CB C 37.655 0.000 1 241 117 52 PHE N N 126.127 0.000 1 242 118 53 VAL H H 8.531 0.014 1 243 118 53 VAL C C 176.946 0.000 1 244 118 53 VAL CA C 66.210 0.013 1 245 118 53 VAL CB C 30.756 0.024 1 246 118 53 VAL N N 120.912 0.056 1 247 119 54 ALA H H 7.808 0.006 1 248 119 54 ALA C C 180.201 0.000 1 249 119 54 ALA CA C 54.017 0.074 1 250 119 54 ALA CB C 16.620 0.096 1 251 119 54 ALA N N 121.596 0.090 1 252 120 55 GLU H H 7.701 0.006 1 253 120 55 GLU C C 179.235 0.000 1 254 120 55 GLU CA C 57.841 0.000 1 255 120 55 GLU CB C 28.025 0.001 1 256 120 55 GLU N N 121.014 0.000 1 257 121 56 GLU H H 8.236 0.005 1 258 121 56 GLU C C 177.988 0.000 1 259 121 56 GLU CA C 59.060 0.000 1 260 121 56 GLU CB C 28.875 0.000 1 261 121 56 GLU N N 122.127 0.061 1 262 122 57 ARG H H 10.173 0.001 1 263 122 57 ARG C C 177.204 0.000 1 264 122 57 ARG CA C 55.847 0.000 1 265 122 57 ARG CB C 28.477 0.000 1 266 122 57 ARG N N 122.732 0.000 1 267 123 58 LYS H H 7.371 0.007 1 268 123 58 LYS C C 177.328 0.000 1 269 123 58 LYS CA C 56.055 0.000 1 270 123 58 LYS CB C 31.169 0.000 1 271 123 58 LYS N N 118.456 0.000 1 272 124 59 HIS H H 7.259 0.004 1 273 124 59 HIS C C 175.428 0.000 1 274 124 59 HIS CA C 55.313 0.020 1 275 124 59 HIS CB C 31.248 0.020 1 276 124 59 HIS N N 116.406 0.000 1 277 125 60 TYR H H 8.318 0.005 1 278 125 60 TYR C C 174.479 0.000 1 279 125 60 TYR CA C 55.650 0.000 1 280 125 60 TYR CB C 34.721 0.000 1 281 125 60 TYR N N 119.789 0.186 1 282 126 61 THR H H 8.673 0.010 1 283 126 61 THR C C 171.961 0.000 1 284 126 61 THR CA C 62.138 0.156 1 285 126 61 THR CB C 67.102 0.047 1 286 126 61 THR N N 119.520 0.127 1 287 127 62 VAL H H 8.069 0.005 1 288 127 62 VAL C C 173.297 0.014 1 289 127 62 VAL CA C 58.809 0.004 1 290 127 62 VAL CB C 33.818 0.013 1 291 127 62 VAL N N 130.144 0.001 1 292 128 63 TYR H H 8.982 0.028 1 293 128 63 TYR CA C 51.477 0.044 1 294 128 63 TYR CB C 39.419 0.000 1 295 128 63 TYR N N 128.172 0.148 1 296 131 66 PRO C C 178.562 0.000 1 297 131 66 PRO CA C 61.198 0.000 1 298 131 66 PRO CB C 31.283 0.000 1 299 132 67 HIS H H 7.890 0.006 1 300 132 67 HIS C C 175.892 0.000 1 301 132 67 HIS CA C 56.048 0.040 1 302 132 67 HIS CB C 25.247 0.023 1 303 132 67 HIS N N 117.714 0.000 1 304 133 68 GLN H H 8.742 0.005 1 305 133 68 GLN C C 177.157 0.000 1 306 133 68 GLN CA C 52.092 0.000 1 307 133 68 GLN CB C 29.894 0.000 1 308 133 68 GLN N N 117.323 0.003 1 309 134 69 VAL H H 7.509 0.002 1 310 134 69 VAL C C 175.436 0.000 1 311 134 69 VAL CA C 65.987 0.000 1 312 134 69 VAL CB C 35.292 0.000 1 313 134 69 VAL N N 125.898 0.000 1 314 135 70 PHE H H 8.339 0.006 1 315 135 70 PHE C C 177.787 0.000 1 316 135 70 PHE CA C 55.969 0.000 1 317 135 70 PHE CB C 35.204 0.000 1 318 135 70 PHE N N 119.003 0.224 1 319 136 71 THR H H 7.311 0.001 1 320 136 71 THR C C 174.047 0.000 1 321 136 71 THR CA C 64.951 0.000 1 322 136 71 THR CB C 68.027 0.000 1 323 136 71 THR N N 120.416 0.004 1 324 137 72 TRP H H 6.910 0.004 1 325 137 72 TRP C C 175.177 0.000 1 326 137 72 TRP CA C 54.730 0.026 1 327 137 72 TRP CB C 25.240 0.000 1 328 137 72 TRP N N 116.942 0.009 1 329 138 73 THR H H 6.785 0.000 1 330 138 73 THR C C 174.053 0.000 1 331 138 73 THR CA C 60.258 0.019 1 332 138 73 THR CB C 68.757 0.084 1 333 138 73 THR N N 110.979 0.049 1 334 139 74 GLN H H 7.404 0.004 1 335 139 74 GLN C C 176.846 0.000 1 336 139 74 GLN CA C 56.077 0.000 1 337 139 74 GLN CB C 28.723 0.069 1 338 139 74 GLN N N 119.398 0.028 1 339 140 75 MET H H 7.101 0.004 1 340 140 75 MET C C 174.694 0.000 1 341 140 75 MET CA C 54.613 0.061 1 342 140 75 MET CB C 32.452 0.061 1 343 140 75 MET N N 116.309 0.002 1 344 141 76 CYS H H 7.507 0.003 1 345 141 76 CYS C C 171.820 0.000 1 346 141 76 CYS CA C 54.495 0.000 1 347 141 76 CYS CB C 28.946 0.000 1 348 141 76 CYS N N 112.480 0.000 1 349 142 77 ASP H H 9.089 0.006 1 350 142 77 ASP C C 176.088 0.000 1 351 142 77 ASP CA C 52.975 0.019 1 352 142 77 ASP CB C 41.595 0.048 1 353 142 77 ASP N N 126.002 0.102 1 354 143 78 ILE H H 7.321 0.001 1 355 143 78 ILE C C 170.389 0.000 1 356 143 78 ILE CA C 63.627 0.000 1 357 143 78 ILE CB C 35.903 0.000 1 358 143 78 ILE N N 132.235 0.004 1 359 144 79 LYS H H 8.696 0.002 1 360 144 79 LYS C C 175.427 0.000 1 361 144 79 LYS CA C 56.293 0.000 1 362 144 79 LYS CB C 30.517 0.000 1 363 144 79 LYS N N 121.016 0.000 1 364 145 80 ASP H H 7.843 0.002 1 365 145 80 ASP C C 175.934 0.000 1 366 145 80 ASP CA C 54.073 0.002 1 367 145 80 ASP CB C 41.781 0.000 1 368 145 80 ASP N N 122.480 0.000 1 369 146 81 VAL H H 7.358 0.001 1 370 146 81 VAL C C 175.709 0.000 1 371 146 81 VAL CA C 60.201 0.000 1 372 146 81 VAL CB C 31.488 0.000 1 373 146 81 VAL N N 119.246 0.000 1 374 147 82 LYS H H 8.075 0.001 1 375 147 82 LYS C C 176.087 0.000 1 376 147 82 LYS CA C 57.893 0.000 1 377 147 82 LYS CB C 34.028 0.000 1 378 147 82 LYS N N 130.255 0.000 1 379 148 83 VAL H H 8.760 0.003 1 380 148 83 VAL C C 179.259 0.000 1 381 148 83 VAL CA C 60.245 0.000 1 382 148 83 VAL CB C 30.644 0.012 1 383 148 83 VAL N N 124.543 0.000 1 384 149 84 VAL H H 8.599 0.002 1 385 149 84 VAL C C 174.079 0.000 1 386 149 84 VAL CA C 58.796 0.000 1 387 149 84 VAL CB C 34.224 0.000 1 388 149 84 VAL N N 115.508 0.000 1 389 150 85 ILE H H 7.470 0.002 1 390 150 85 ILE C C 175.614 0.000 1 391 150 85 ILE CA C 64.024 0.027 1 392 150 85 ILE CB C 37.304 0.000 1 393 150 85 ILE N N 122.444 0.022 1 394 151 86 LEU H H 8.985 0.001 1 395 151 86 LEU C C 173.486 0.000 1 396 151 86 LEU CA C 52.894 0.082 1 397 151 86 LEU CB C 40.249 0.000 1 398 151 86 LEU N N 129.871 0.008 1 399 152 87 GLY H H 8.042 0.001 1 400 152 87 GLY C C 174.458 0.000 1 401 152 87 GLY CA C 45.397 0.094 1 402 152 87 GLY N N 114.754 0.000 1 403 153 88 GLN H H 7.726 0.001 1 404 153 88 GLN C C 171.305 0.000 1 405 153 88 GLN CA C 55.997 0.105 1 406 153 88 GLN CB C 27.658 0.032 1 407 153 88 GLN N N 121.895 0.000 1 408 154 89 ASP H H 7.541 0.001 1 409 154 89 ASP CA C 49.963 0.000 1 410 154 89 ASP CB C 42.236 0.000 1 411 154 89 ASP N N 121.962 0.002 1 412 155 90 PRO C C 175.013 0.000 1 413 155 90 PRO CA C 60.015 0.000 1 414 155 90 PRO CB C 29.286 0.000 1 415 156 91 TYR H H 6.861 0.003 1 416 156 91 TYR C C 174.485 0.000 1 417 156 91 TYR CA C 56.974 0.000 1 418 156 91 TYR CB C 39.162 0.000 1 419 156 91 TYR N N 119.237 0.045 1 420 157 92 HIS H H 7.859 0.011 1 421 157 92 HIS C C 174.616 0.000 1 422 157 92 HIS CA C 53.552 0.000 1 423 157 92 HIS CB C 54.006 0.000 1 424 157 92 HIS N N 117.168 0.074 1 425 158 93 GLY H H 7.296 0.003 1 426 158 93 GLY CA C 42.051 0.000 1 427 158 93 GLY N N 110.403 0.000 1 428 159 94 PRO C C 176.807 0.000 1 429 159 94 PRO CA C 64.618 0.000 1 430 159 94 PRO CB C 31.036 0.000 1 431 160 95 ASN H H 8.316 0.008 1 432 160 95 ASN C C 172.998 0.000 1 433 160 95 ASN CA C 53.781 0.033 1 434 160 95 ASN CB C 36.282 0.053 1 435 160 95 ASN N N 113.526 0.000 1 436 161 96 GLN H H 6.498 0.009 1 437 161 96 GLN C C 174.905 0.000 1 438 161 96 GLN CA C 57.129 0.055 1 439 161 96 GLN CB C 28.717 0.065 1 440 161 96 GLN N N 116.154 0.017 1 441 162 97 ALA H H 9.103 0.003 1 442 162 97 ALA C C 179.254 0.000 1 443 162 97 ALA CA C 50.874 0.085 1 444 162 97 ALA CB C 18.649 0.065 1 445 162 97 ALA N N 121.135 0.023 1 446 163 98 HIS H H 9.124 0.002 1 447 163 98 HIS C C 173.652 0.000 1 448 163 98 HIS CA C 54.078 0.042 1 449 163 98 HIS CB C 27.519 0.145 1 450 163 98 HIS N N 117.961 0.064 1 451 164 99 GLY H H 8.296 0.004 1 452 164 99 GLY C C 175.086 0.000 1 453 164 99 GLY CA C 45.622 0.007 1 454 164 99 GLY N N 110.377 0.100 1 455 165 100 LEU H H 10.488 0.001 1 456 165 100 LEU C C 176.970 0.000 1 457 165 100 LEU CA C 53.895 0.000 1 458 165 100 LEU CB C 40.961 0.000 1 459 165 100 LEU N N 124.381 0.000 1 460 166 101 CYS H H 8.078 0.004 1 461 166 101 CYS C C 173.976 0.000 1 462 166 101 CYS CA C 57.883 0.000 1 463 166 101 CYS CB C 27.506 0.000 1 464 166 101 CYS N N 119.692 0.000 1 465 167 102 PHE H H 8.168 0.003 1 466 167 102 PHE C C 176.115 0.000 1 467 167 102 PHE CA C 52.511 0.000 1 468 167 102 PHE CB C 39.793 0.000 1 469 167 102 PHE N N 123.376 0.000 1 470 168 103 SER H H 7.448 0.004 1 471 168 103 SER C C 174.206 0.000 1 472 168 103 SER CA C 57.267 0.000 1 473 168 103 SER CB C 62.874 0.000 1 474 168 103 SER N N 113.516 0.000 1 475 169 104 VAL H H 8.888 0.002 1 476 169 104 VAL C C 175.714 0.000 1 477 169 104 VAL CA C 56.488 0.119 1 478 169 104 VAL CB C 34.859 0.061 1 479 169 104 VAL N N 121.988 0.056 1 480 170 105 GLN H H 8.484 0.003 1 481 170 105 GLN C C 177.197 0.000 1 482 170 105 GLN CA C 55.688 0.000 1 483 170 105 GLN CB C 28.719 0.000 1 484 170 105 GLN N N 127.272 0.034 1 485 171 106 ARG H H 7.351 0.005 1 486 171 106 ARG CA C 55.760 0.000 1 487 171 106 ARG CB C 31.849 0.000 1 488 171 106 ARG N N 118.284 0.045 1 489 172 107 PRO C C 174.767 0.000 1 490 172 107 PRO CA C 62.380 0.000 1 491 172 107 PRO CB C 30.862 0.000 1 492 173 108 VAL H H 8.790 0.016 1 493 173 108 VAL CA C 60.822 0.000 1 494 173 108 VAL CB C 30.527 0.000 1 495 173 108 VAL N N 131.371 0.001 1 496 177 112 PRO C C 175.223 0.000 1 497 177 112 PRO CA C 66.101 0.000 1 498 177 112 PRO CB C 30.505 0.000 1 499 178 113 SER H H 7.856 0.001 1 500 178 113 SER C C 174.996 0.000 1 501 178 113 SER CA C 66.952 0.000 1 502 178 113 SER CB C 68.147 0.000 1 503 178 113 SER N N 120.351 0.000 1 504 179 114 LEU H H 7.396 0.002 1 505 179 114 LEU C C 175.756 0.000 1 506 179 114 LEU CA C 56.763 0.000 1 507 179 114 LEU CB C 46.556 0.000 1 508 179 114 LEU N N 112.791 0.022 1 509 180 115 GLU H H 7.663 0.002 1 510 180 115 GLU C C 179.831 0.000 1 511 180 115 GLU CA C 56.551 0.000 1 512 180 115 GLU CB C 24.613 0.000 1 513 180 115 GLU N N 125.183 0.000 1 514 181 116 ASN H H 7.643 0.001 1 515 181 116 ASN C C 177.664 0.000 1 516 181 116 ASN CA C 53.686 0.054 1 517 181 116 ASN CB C 35.849 0.000 1 518 181 116 ASN N N 119.710 0.017 1 519 182 117 ILE H H 7.370 0.001 1 520 182 117 ILE C C 172.920 0.000 1 521 182 117 ILE CA C 66.954 0.000 1 522 182 117 ILE CB C 30.401 0.000 1 523 182 117 ILE N N 114.449 0.000 1 524 183 118 TYR H H 9.009 0.006 1 525 183 118 TYR C C 173.274 0.000 1 526 183 118 TYR CA C 57.688 0.000 1 527 183 118 TYR CB C 38.103 0.000 1 528 183 118 TYR N N 128.736 0.040 1 529 184 119 LYS H H 8.480 0.002 1 530 184 119 LYS C C 179.036 0.000 1 531 184 119 LYS CA C 58.440 0.022 1 532 184 119 LYS CB C 31.113 0.068 1 533 184 119 LYS N N 124.441 0.042 1 534 185 120 GLU H H 8.210 0.003 1 535 185 120 GLU C C 178.498 0.000 1 536 185 120 GLU CA C 57.426 0.000 1 537 185 120 GLU CB C 28.768 0.000 1 538 185 120 GLU N N 124.559 0.045 1 539 186 121 LEU H H 8.166 0.003 1 540 186 121 LEU C C 177.550 0.000 1 541 186 121 LEU CA C 58.190 0.040 1 542 186 121 LEU CB C 39.919 0.039 1 543 186 121 LEU N N 122.920 0.107 1 544 187 122 SER H H 7.788 0.004 1 545 187 122 SER C C 175.488 0.000 1 546 187 122 SER CA C 60.179 0.000 1 547 187 122 SER CB C 62.102 0.015 1 548 187 122 SER N N 112.132 0.000 1 549 188 123 THR H H 7.398 0.002 1 550 188 123 THR C C 174.462 0.000 1 551 188 123 THR CA C 60.607 0.000 1 552 188 123 THR CB C 68.104 0.000 1 553 188 123 THR N N 112.773 0.021 1 554 189 124 ASP H H 8.244 0.001 1 555 189 124 ASP C C 174.757 0.000 1 556 189 124 ASP CA C 55.221 0.000 1 557 189 124 ASP CB C 44.412 0.000 1 558 189 124 ASP N N 125.273 0.000 1 559 190 125 ILE H H 9.013 0.002 1 560 190 125 ILE C C 175.443 0.000 1 561 190 125 ILE CA C 65.810 0.000 1 562 190 125 ILE CB C 38.734 0.000 1 563 190 125 ILE N N 127.066 0.000 1 564 191 126 GLU H H 7.049 0.002 1 565 191 126 GLU C C 177.324 0.000 1 566 191 126 GLU CA C 58.501 0.000 1 567 191 126 GLU CB C 27.446 0.000 1 568 191 126 GLU N N 123.692 0.000 1 569 192 127 ASP H H 7.667 0.008 1 570 192 127 ASP C C 174.624 0.000 1 571 192 127 ASP CA C 52.704 0.000 1 572 192 127 ASP CB C 40.947 0.000 1 573 192 127 ASP N N 119.146 0.012 1 574 193 128 PHE H H 7.845 0.003 1 575 193 128 PHE C C 170.877 0.000 1 576 193 128 PHE CA C 59.827 0.000 1 577 193 128 PHE CB C 38.758 0.031 1 578 193 128 PHE N N 121.327 0.014 1 579 194 129 VAL H H 6.158 0.002 1 580 194 129 VAL C C 172.736 0.000 1 581 194 129 VAL CA C 58.669 0.027 1 582 194 129 VAL CB C 33.539 0.031 1 583 194 129 VAL N N 127.990 0.000 1 584 195 130 HIS H H 8.262 0.001 1 585 195 130 HIS CA C 52.990 0.000 1 586 195 130 HIS CB C 29.690 0.000 1 587 195 130 HIS N N 128.982 0.000 1 588 196 131 PRO C C 177.715 0.000 1 589 196 131 PRO CA C 62.337 0.000 1 590 196 131 PRO CB C 30.254 0.000 1 591 197 132 GLY H H 10.956 0.020 1 592 197 132 GLY C C 172.512 0.000 1 593 197 132 GLY CA C 43.611 0.000 1 594 197 132 GLY N N 115.466 0.033 1 595 198 133 HIS H H 7.125 0.003 1 596 198 133 HIS C C 172.897 0.000 1 597 198 133 HIS CA C 53.450 0.045 1 598 198 133 HIS CB C 31.284 0.023 1 599 198 133 HIS N N 115.693 0.028 1 600 199 134 GLY H H 10.003 0.001 1 601 199 134 GLY C C 178.669 0.000 1 602 199 134 GLY CA C 44.455 0.026 1 603 199 134 GLY N N 113.137 0.000 1 604 200 135 ASP H H 7.949 0.002 1 605 200 135 ASP C C 173.675 0.000 1 606 200 135 ASP CA C 53.037 0.022 1 607 200 135 ASP CB C 41.475 0.000 1 608 200 135 ASP N N 121.491 0.004 1 609 201 136 LEU H H 8.689 0.001 1 610 201 136 LEU C C 178.810 0.000 1 611 201 136 LEU CA C 52.858 0.061 1 612 201 136 LEU CB C 40.481 0.000 1 613 201 136 LEU N N 134.664 0.000 1 614 202 137 SER H H 9.212 0.002 1 615 202 137 SER C C 175.472 0.045 1 616 202 137 SER CA C 63.346 0.088 1 617 202 137 SER CB C 61.126 0.014 1 618 202 137 SER N N 122.085 0.000 1 619 203 138 GLY H H 9.633 0.004 1 620 203 138 GLY C C 177.754 0.000 1 621 203 138 GLY CA C 45.650 0.071 1 622 203 138 GLY N N 108.547 0.009 1 623 204 139 TRP H H 7.727 0.002 1 624 204 139 TRP C C 178.541 0.000 1 625 204 139 TRP CA C 56.106 0.084 1 626 204 139 TRP CB C 27.620 0.000 1 627 204 139 TRP N N 121.954 0.123 1 628 205 140 ALA H H 7.777 0.002 1 629 205 140 ALA C C 181.059 0.000 1 630 205 140 ALA CA C 53.496 0.024 1 631 205 140 ALA CB C 18.292 0.051 1 632 205 140 ALA N N 127.464 0.004 1 633 206 141 LYS H H 8.469 0.005 1 634 206 141 LYS C C 177.367 0.000 1 635 206 141 LYS CA C 57.198 0.077 1 636 206 141 LYS CB C 32.178 0.085 1 637 206 141 LYS N N 117.238 0.050 1 638 207 142 GLN H H 8.164 0.000 1 639 207 142 GLN C C 174.681 0.000 1 640 207 142 GLN CA C 55.511 0.000 1 641 207 142 GLN CB C 30.954 0.008 1 642 207 142 GLN N N 113.611 0.000 1 643 208 143 GLY H H 7.722 0.004 1 644 208 143 GLY C C 174.165 0.000 1 645 208 143 GLY CA C 44.394 0.017 1 646 208 143 GLY N N 104.416 0.000 1 647 209 144 VAL H H 7.467 0.001 1 648 209 144 VAL C C 174.095 0.000 1 649 209 144 VAL CA C 60.183 0.000 1 650 209 144 VAL CB C 29.543 0.000 1 651 209 144 VAL N N 122.964 0.000 1 652 210 145 LEU H H 9.642 0.004 1 653 210 145 LEU C C 174.777 0.000 1 654 210 145 LEU CA C 52.623 0.000 1 655 210 145 LEU CB C 41.664 0.000 1 656 210 145 LEU N N 131.917 0.002 1 657 211 146 LEU H H 7.158 0.023 1 658 211 146 LEU C C 174.153 0.000 1 659 211 146 LEU CA C 55.276 0.000 1 660 211 146 LEU CB C 38.538 0.000 1 661 211 146 LEU N N 112.493 0.017 1 662 212 147 LEU H H 9.909 0.010 1 663 212 147 LEU C C 172.999 0.000 1 664 212 147 LEU CA C 55.497 0.000 1 665 212 147 LEU CB C 34.166 0.000 1 666 212 147 LEU N N 131.399 0.000 1 667 213 148 ASN H H 8.544 0.002 1 668 213 148 ASN C C 178.214 0.000 1 669 213 148 ASN CA C 54.332 0.000 1 670 213 148 ASN CB C 40.802 0.000 1 671 213 148 ASN N N 119.832 0.000 1 672 214 149 ALA H H 7.691 0.003 1 673 214 149 ALA C C 174.288 0.000 1 674 214 149 ALA CA C 54.148 0.083 1 675 214 149 ALA CB C 15.315 0.049 1 676 214 149 ALA N N 126.575 0.007 1 677 215 150 VAL H H 7.576 0.005 1 678 215 150 VAL C C 174.542 0.000 1 679 215 150 VAL CA C 65.797 0.000 1 680 215 150 VAL CB C 31.165 0.081 1 681 215 150 VAL N N 121.465 0.101 1 682 216 151 LEU H H 9.298 0.004 1 683 216 151 LEU C C 174.847 0.000 1 684 216 151 LEU CA C 54.844 0.000 1 685 216 151 LEU CB C 40.048 0.000 1 686 216 151 LEU N N 127.433 0.012 1 687 217 152 THR H H 6.622 0.007 1 688 217 152 THR C C 172.403 0.000 1 689 217 152 THR CA C 58.512 0.023 1 690 217 152 THR CB C 71.356 0.024 1 691 217 152 THR N N 107.228 0.018 1 692 218 153 VAL H H 8.619 0.013 1 693 218 153 VAL C C 171.388 0.000 1 694 218 153 VAL CA C 59.292 0.041 1 695 218 153 VAL CB C 34.288 0.039 1 696 218 153 VAL N N 119.685 0.009 1 697 219 154 ARG H H 7.210 0.002 1 698 219 154 ARG C C 175.284 0.000 1 699 219 154 ARG CA C 55.441 0.084 1 700 219 154 ARG CB C 30.438 0.038 1 701 219 154 ARG N N 126.221 0.042 1 702 220 155 ALA H H 8.122 0.007 1 703 220 155 ALA C C 177.522 0.000 1 704 220 155 ALA CA C 51.723 0.053 1 705 220 155 ALA CB C 18.138 0.007 1 706 220 155 ALA N N 126.249 0.023 1 707 221 156 HIS H H 8.891 0.005 1 708 221 156 HIS C C 173.924 0.000 1 709 221 156 HIS CA C 56.819 0.001 1 710 221 156 HIS CB C 28.017 0.019 1 711 221 156 HIS N N 113.024 0.051 1 712 222 157 GLN H H 7.829 0.006 1 713 222 157 GLN C C 173.160 0.000 1 714 222 157 GLN CA C 52.374 0.000 1 715 222 157 GLN CB C 28.760 0.000 1 716 222 157 GLN N N 121.062 0.001 1 717 223 158 ALA H H 8.298 0.006 1 718 223 158 ALA C C 177.943 0.000 1 719 223 158 ALA CA C 52.558 0.090 1 720 223 158 ALA CB C 17.321 0.095 1 721 223 158 ALA N N 129.890 0.022 1 722 224 159 ASN H H 10.041 0.008 1 723 224 159 ASN C C 176.083 0.000 1 724 224 159 ASN CA C 52.932 0.011 1 725 224 159 ASN CB C 37.069 0.000 1 726 224 159 ASN N N 118.772 0.000 1 727 225 160 SER H H 7.735 0.005 1 728 225 160 SER C C 176.915 0.000 1 729 225 160 SER CA C 58.990 0.026 1 730 225 160 SER CB C 61.250 0.011 1 731 225 160 SER N N 113.322 0.004 1 732 226 161 HIS H H 9.684 0.004 1 733 226 161 HIS C C 177.171 0.000 1 734 226 161 HIS CA C 52.626 0.011 1 735 226 161 HIS CB C 29.586 0.002 1 736 226 161 HIS N N 123.402 0.008 1 737 227 162 LYS H H 7.167 0.004 1 738 227 162 LYS C C 175.918 0.000 1 739 227 162 LYS CA C 55.646 0.043 1 740 227 162 LYS CB C 31.062 0.062 1 741 227 162 LYS N N 119.285 0.045 1 742 228 163 GLU H H 7.435 0.003 1 743 228 163 GLU C C 175.722 0.000 1 744 228 163 GLU CA C 55.007 0.000 1 745 228 163 GLU CB C 26.881 0.000 1 746 228 163 GLU N N 125.804 0.018 1 747 229 164 ARG H H 8.040 0.006 1 748 229 164 ARG C C 173.787 0.000 1 749 229 164 ARG CA C 54.662 0.000 1 750 229 164 ARG CB C 30.538 0.093 1 751 229 164 ARG N N 122.183 0.047 1 752 230 165 GLY H H 7.843 0.004 1 753 230 165 GLY C C 174.539 0.000 1 754 230 165 GLY CA C 44.851 0.000 1 755 230 165 GLY N N 110.169 0.014 1 756 231 166 TRP H H 8.816 0.020 1 757 231 166 TRP C C 174.095 0.000 1 758 231 166 TRP CA C 59.211 0.000 1 759 231 166 TRP CB C 30.056 0.039 1 760 231 166 TRP N N 123.027 0.057 1 761 232 167 GLU H H 10.984 0.014 1 762 232 167 GLU C C 177.987 0.000 1 763 232 167 GLU CA C 60.296 0.056 1 764 232 167 GLU CB C 26.549 0.002 1 765 232 167 GLU N N 120.219 0.000 1 766 233 168 GLN H H 7.499 0.003 1 767 233 168 GLN C C 177.606 0.007 1 768 233 168 GLN CA C 58.198 0.029 1 769 233 168 GLN CB C 26.428 0.044 1 770 233 168 GLN N N 119.277 0.004 1 771 234 169 PHE H H 8.083 0.002 1 772 234 169 PHE C C 177.454 0.000 1 773 234 169 PHE CA C 60.832 0.014 1 774 234 169 PHE CB C 38.104 0.037 1 775 234 169 PHE N N 124.270 0.071 1 776 235 170 THR H H 10.069 0.007 1 777 235 170 THR C C 172.905 0.000 1 778 235 170 THR CA C 66.062 0.000 1 779 235 170 THR CB C 68.671 0.000 1 780 235 170 THR N N 112.487 0.004 1 781 236 171 ASP H H 8.672 0.006 1 782 236 171 ASP C C 177.795 0.000 1 783 236 171 ASP CA C 56.483 0.000 1 784 236 171 ASP CB C 37.949 0.085 1 785 236 171 ASP N N 125.142 0.003 1 786 237 172 ALA H H 7.692 0.002 1 787 237 172 ALA C C 176.459 0.000 1 788 237 172 ALA CA C 51.562 0.000 1 789 237 172 ALA CB C 20.156 0.014 1 790 237 172 ALA N N 121.571 0.000 1 791 238 173 VAL H H 7.634 0.003 1 792 238 173 VAL C C 177.863 0.000 1 793 238 173 VAL CA C 60.087 0.000 1 794 238 173 VAL CB C 33.187 0.000 1 795 238 173 VAL N N 117.885 0.011 1 796 239 174 VAL H H 7.662 0.002 1 797 239 174 VAL C C 177.010 0.000 1 798 239 174 VAL CA C 50.240 0.000 1 799 239 174 VAL CB C 51.724 0.000 1 800 239 174 VAL N N 121.909 0.000 1 801 240 175 SER H H 8.747 0.005 1 802 240 175 SER C C 176.196 0.000 1 803 240 175 SER CA C 59.600 0.042 1 804 240 175 SER CB C 62.122 0.138 1 805 240 175 SER N N 115.353 0.000 1 806 241 176 TRP H H 8.241 0.002 1 807 241 176 TRP C C 179.768 0.000 1 808 241 176 TRP CA C 62.199 0.005 1 809 241 176 TRP CB C 27.597 0.008 1 810 241 176 TRP N N 123.494 0.024 1 811 242 177 LEU H H 8.165 0.002 1 812 242 177 LEU C C 177.711 0.000 1 813 242 177 LEU CA C 56.700 0.002 1 814 242 177 LEU CB C 40.360 0.056 1 815 242 177 LEU N N 121.497 0.044 1 816 243 178 ASN H H 8.688 0.008 1 817 243 178 ASN C C 176.580 0.000 1 818 243 178 ASN CA C 54.658 0.014 1 819 243 178 ASN CB C 38.855 0.010 1 820 243 178 ASN N N 116.284 0.011 1 821 244 179 GLN H H 7.814 0.011 1 822 244 179 GLN C C 177.633 0.000 1 823 244 179 GLN CA C 56.362 0.034 1 824 244 179 GLN CB C 28.879 0.037 1 825 244 179 GLN N N 114.857 0.047 1 826 245 180 ASN H H 7.838 0.006 1 827 245 180 ASN C C 173.784 0.000 1 828 245 180 ASN CA C 52.802 0.167 1 829 245 180 ASN CB C 38.312 0.233 1 830 245 180 ASN N N 114.900 0.061 1 831 246 181 SER H H 7.515 0.001 1 832 246 181 SER C C 171.511 0.000 1 833 246 181 SER CA C 56.228 0.000 1 834 246 181 SER CB C 62.968 0.001 1 835 246 181 SER N N 117.307 0.015 1 836 247 182 ASN H H 8.554 0.003 1 837 247 182 ASN C C 176.545 0.000 1 838 247 182 ASN CA C 52.088 0.078 1 839 247 182 ASN CB C 41.527 0.072 1 840 247 182 ASN N N 118.693 0.045 1 841 248 183 GLY H H 8.486 0.003 1 842 248 183 GLY C C 171.855 0.000 1 843 248 183 GLY CA C 43.607 0.036 1 844 248 183 GLY N N 112.213 0.009 1 845 249 184 LEU H H 7.945 0.005 1 846 249 184 LEU C C 175.469 0.000 1 847 249 184 LEU CA C 54.069 0.000 1 848 249 184 LEU CB C 41.728 0.000 1 849 249 184 LEU N N 123.371 0.009 1 850 250 185 VAL H H 6.729 0.010 1 851 250 185 VAL C C 175.353 0.000 1 852 250 185 VAL CA C 63.371 0.087 1 853 250 185 VAL CB C 30.538 0.005 1 854 250 185 VAL N N 120.969 0.016 1 855 251 186 PHE H H 9.548 0.007 1 856 251 186 PHE C C 175.376 0.000 1 857 251 186 PHE CA C 55.904 0.000 1 858 251 186 PHE CB C 36.226 0.000 1 859 251 186 PHE N N 127.037 0.010 1 860 252 187 LEU H H 7.854 0.005 1 861 252 187 LEU C C 175.089 0.000 1 862 252 187 LEU CA C 54.435 0.000 1 863 252 187 LEU CB C 41.198 0.000 1 864 252 187 LEU N N 122.568 0.000 1 865 253 188 LEU H H 8.631 0.005 1 866 253 188 LEU C C 173.904 0.000 1 867 253 188 LEU CA C 56.955 0.000 1 868 253 188 LEU CB C 39.806 0.000 1 869 253 188 LEU N N 121.863 0.000 1 870 254 189 TRP H H 9.640 0.005 1 871 254 189 TRP C C 176.691 0.000 1 872 254 189 TRP CA C 126.320 0.000 1 873 254 189 TRP CB C 27.982 0.000 1 874 254 189 TRP N N 130.771 0.009 1 875 255 190 GLY H H 9.154 0.001 1 876 255 190 GLY C C 174.112 0.000 1 877 255 190 GLY CA C 43.214 0.043 1 878 255 190 GLY N N 114.122 0.000 1 879 256 191 SER H H 7.341 0.001 1 880 256 191 SER C C 175.400 0.000 1 881 256 191 SER CA C 59.341 0.000 1 882 256 191 SER CB C 62.012 0.072 1 883 256 191 SER N N 118.149 0.000 1 884 257 192 TYR H H 6.922 0.002 1 885 257 192 TYR C C 178.444 0.000 1 886 257 192 TYR CA C 54.929 0.000 1 887 257 192 TYR CB C 40.319 0.000 1 888 257 192 TYR N N 123.376 0.000 1 889 258 193 ALA H H 9.108 0.001 1 890 258 193 ALA C C 178.948 0.000 1 891 258 193 ALA CA C 53.621 0.086 1 892 258 193 ALA CB C 17.915 0.000 1 893 258 193 ALA N N 125.156 0.017 1 894 259 194 GLN H H 7.809 0.001 1 895 259 194 GLN C C 176.066 0.000 1 896 259 194 GLN CA C 57.828 0.000 1 897 259 194 GLN CB C 25.967 0.000 1 898 259 194 GLN N N 116.379 0.007 1 899 260 195 LYS H H 7.044 0.002 1 900 260 195 LYS C C 177.119 0.000 1 901 260 195 LYS CA C 58.414 0.000 1 902 260 195 LYS CB C 30.575 0.000 1 903 260 195 LYS N N 113.717 0.000 1 904 261 196 LYS H H 7.709 0.002 1 905 261 196 LYS C C 178.278 0.000 1 906 261 196 LYS CA C 57.326 0.000 1 907 261 196 LYS CB C 31.360 0.000 1 908 261 196 LYS N N 116.987 0.000 1 909 262 197 GLY H H 7.829 0.003 1 910 262 197 GLY C C 177.237 0.000 1 911 262 197 GLY CA C 42.953 0.052 1 912 262 197 GLY N N 105.392 0.001 1 913 263 198 SER H H 7.329 0.012 1 914 263 198 SER C C 179.049 0.000 1 915 263 198 SER CA C 59.626 0.000 1 916 263 198 SER CB C 62.318 0.000 1 917 263 198 SER N N 118.152 0.004 1 918 264 199 ALA H H 8.191 0.002 1 919 264 199 ALA C C 176.608 0.000 1 920 264 199 ALA CA C 49.921 0.034 1 921 264 199 ALA CB C 17.568 0.015 1 922 264 199 ALA N N 124.155 0.017 1 923 265 200 ILE H H 6.694 0.003 1 924 265 200 ILE C C 176.571 0.000 1 925 265 200 ILE CA C 59.893 0.047 1 926 265 200 ILE CB C 36.989 0.022 1 927 265 200 ILE N N 121.312 0.000 1 928 266 201 ASP H H 8.962 0.006 1 929 266 201 ASP C C 175.950 0.000 1 930 266 201 ASP CA C 53.227 0.025 1 931 266 201 ASP CB C 40.135 0.022 1 932 266 201 ASP N N 129.863 0.035 1 933 267 202 ARG H H 8.476 0.005 1 934 267 202 ARG C C 178.732 0.000 1 935 267 202 ARG CA C 56.718 0.000 1 936 267 202 ARG CB C 28.391 0.067 1 937 267 202 ARG N N 128.888 0.005 1 938 268 203 LYS H H 7.927 0.002 1 939 268 203 LYS C C 176.818 0.000 1 940 268 203 LYS CA C 56.519 0.000 1 941 268 203 LYS CB C 39.798 0.000 1 942 268 203 LYS N N 121.712 0.000 1 943 269 204 ARG H H 7.776 0.005 1 944 269 204 ARG C C 175.932 0.000 1 945 269 204 ARG CA C 52.731 0.000 1 946 269 204 ARG CB C 18.131 0.000 1 947 269 204 ARG N N 127.390 0.039 1 948 270 205 HIS H H 7.884 0.005 1 949 270 205 HIS C C 176.623 0.000 1 950 270 205 HIS CA C 57.291 0.000 1 951 270 205 HIS CB C 30.661 0.000 1 952 270 205 HIS N N 117.998 0.000 1 953 271 206 HIS H H 7.794 0.003 1 954 271 206 HIS C C 174.708 0.000 1 955 271 206 HIS CA C 55.033 0.000 1 956 271 206 HIS CB C 31.015 0.048 1 957 271 206 HIS N N 119.927 0.000 1 958 272 207 VAL H H 7.357 0.010 1 959 272 207 VAL C C 174.337 0.000 1 960 272 207 VAL CA C 60.516 0.026 1 961 272 207 VAL CB C 35.016 0.000 1 962 272 207 VAL N N 124.544 0.134 1 963 273 208 LEU H H 8.979 0.001 1 964 273 208 LEU C C 174.535 0.000 1 965 273 208 LEU CA C 52.430 0.059 1 966 273 208 LEU CB C 41.050 0.000 1 967 273 208 LEU N N 131.977 0.008 1 968 274 209 GLN H H 8.622 0.003 1 969 274 209 GLN C C 175.126 0.000 1 970 274 209 GLN CA C 56.915 0.000 1 971 274 209 GLN CB C 31.546 0.013 1 972 274 209 GLN N N 120.013 0.009 1 973 275 210 THR H H 8.378 0.002 1 974 275 210 THR C C 171.990 0.000 1 975 275 210 THR CA C 59.277 0.083 1 976 275 210 THR CB C 66.714 0.044 1 977 275 210 THR N N 116.828 0.018 1 978 276 211 ALA H H 7.751 0.005 1 979 276 211 ALA C C 176.217 0.000 1 980 276 211 ALA CA C 49.966 0.012 1 981 276 211 ALA CB C 19.116 0.013 1 982 276 211 ALA N N 125.777 0.018 1 983 277 212 HIS H H 8.153 0.002 1 984 277 212 HIS CA C 55.000 0.000 1 985 277 212 HIS CB C 30.745 0.000 1 986 277 212 HIS N N 118.968 0.025 1 987 278 213 PRO C C 175.236 0.000 1 988 278 213 PRO CA C 63.907 0.000 1 989 278 213 PRO CB C 32.280 0.000 1 990 279 214 SER H H 7.847 0.001 1 991 279 214 SER CA C 62.578 0.000 1 992 279 214 SER CB C 64.342 0.000 1 993 279 214 SER N N 120.701 0.027 1 994 280 215 PRO C C 176.799 0.000 1 995 280 215 PRO CA C 64.386 0.000 1 996 280 215 PRO CB C 31.232 0.000 1 997 281 216 LEU H H 7.747 0.006 1 998 281 216 LEU C C 177.280 0.000 1 999 281 216 LEU CA C 55.732 0.033 1 1000 281 216 LEU CB C 40.609 0.038 1 1001 281 216 LEU N N 115.564 0.000 1 1002 282 217 SER H H 7.922 0.002 1 1003 282 217 SER C C 176.594 0.000 1 1004 282 217 SER CA C 57.095 0.044 1 1005 282 217 SER CB C 64.579 0.000 1 1006 282 217 SER N N 111.570 0.010 1 1007 283 218 VAL H H 7.958 0.008 1 1008 283 218 VAL C C 175.841 0.000 1 1009 283 218 VAL CA C 50.774 0.000 1 1010 283 218 VAL CB C 31.241 0.004 1 1011 283 218 VAL N N 124.097 0.071 1 1012 284 219 TYR H H 8.539 0.001 1 1013 284 219 TYR C C 174.415 0.000 1 1014 284 219 TYR CA C 54.658 0.000 1 1015 284 219 TYR CB C 40.284 0.000 1 1016 284 219 TYR N N 120.343 0.000 1 1017 285 220 ARG H H 7.801 0.004 1 1018 285 220 ARG C C 175.766 0.000 1 1019 285 220 ARG CA C 53.161 0.000 1 1020 285 220 ARG CB C 29.263 0.000 1 1021 285 220 ARG N N 121.929 0.033 1 1022 286 221 GLY H H 7.863 0.003 1 1023 286 221 GLY C C 173.208 0.000 1 1024 286 221 GLY CA C 44.527 0.092 1 1025 286 221 GLY N N 109.781 0.078 1 1026 287 222 PHE H H 6.944 0.007 1 1027 287 222 PHE C C 174.045 0.000 1 1028 287 222 PHE CA C 60.543 0.054 1 1029 287 222 PHE CB C 35.927 0.067 1 1030 287 222 PHE N N 122.872 0.041 1 1031 288 223 PHE H H 7.110 0.001 1 1032 288 223 PHE C C 177.777 0.000 1 1033 288 223 PHE CA C 53.927 0.000 1 1034 288 223 PHE CB C 35.215 0.004 1 1035 288 223 PHE N N 118.107 0.000 1 1036 289 224 GLY H H 11.028 0.008 1 1037 289 224 GLY C C 174.949 0.000 1 1038 289 224 GLY CA C 43.288 0.053 1 1039 289 224 GLY N N 118.771 0.000 1 1040 290 225 CYS H H 7.762 0.002 1 1041 290 225 CYS C C 174.642 0.002 1 1042 290 225 CYS CA C 58.347 0.090 1 1043 290 225 CYS CB C 25.940 0.047 1 1044 290 225 CYS N N 120.968 0.003 1 1045 291 226 ARG H H 9.015 0.003 1 1046 291 226 ARG C C 175.724 0.000 1 1047 291 226 ARG CA C 56.153 0.000 1 1048 291 226 ARG CB C 32.314 0.000 1 1049 291 226 ARG N N 120.077 0.095 1 1050 292 227 HIS H H 8.057 0.002 1 1051 292 227 HIS C C 176.048 0.000 1 1052 292 227 HIS CA C 53.755 0.000 1 1053 292 227 HIS CB C 26.601 0.000 1 1054 292 227 HIS N N 121.918 0.000 1 1055 293 228 PHE H H 8.934 0.001 1 1056 293 228 PHE C C 177.818 0.000 1 1057 293 228 PHE CA C 55.830 0.000 1 1058 293 228 PHE CB C 39.802 0.000 1 1059 293 228 PHE N N 124.607 0.000 1 1060 294 229 SER H H 9.597 0.006 1 1061 294 229 SER C C 180.055 0.000 1 1062 294 229 SER CA C 58.216 0.000 1 1063 294 229 SER CB C 59.684 0.000 1 1064 294 229 SER N N 127.846 0.043 1 1065 295 230 LYS H H 8.026 0.003 1 1066 295 230 LYS C C 178.667 0.000 1 1067 295 230 LYS CA C 55.833 0.000 1 1068 295 230 LYS CB C 31.303 0.017 1 1069 295 230 LYS N N 122.321 0.000 1 1070 296 231 THR H H 7.950 0.002 1 1071 296 231 THR C C 175.108 0.000 1 1072 296 231 THR CA C 63.447 0.000 1 1073 296 231 THR CB C 68.093 0.000 1 1074 296 231 THR N N 118.153 0.000 1 1075 297 232 ASN H H 8.522 0.001 1 1076 297 232 ASN C C 177.579 0.000 1 1077 297 232 ASN CA C 54.809 0.000 1 1078 297 232 ASN CB C 40.775 0.000 1 1079 297 232 ASN N N 119.664 0.000 1 1080 298 233 GLU H H 8.081 0.000 1 1081 298 233 GLU C C 174.824 0.000 1 1082 298 233 GLU CA C 52.896 0.000 1 1083 298 233 GLU CB C 28.407 0.000 1 1084 298 233 GLU N N 124.583 0.000 1 1085 299 234 LEU H H 8.646 0.001 1 1086 299 234 LEU C C 177.407 0.000 1 1087 299 234 LEU CA C 53.758 0.000 1 1088 299 234 LEU CB C 42.211 0.000 1 1089 299 234 LEU N N 123.440 0.000 1 1090 300 235 LEU H H 7.616 0.001 1 1091 300 235 LEU C C 176.568 0.000 1 1092 300 235 LEU CA C 51.802 0.000 1 1093 300 235 LEU CB C 41.804 0.000 1 1094 300 235 LEU N N 128.413 0.000 1 1095 301 236 GLN H H 6.737 0.004 1 1096 301 236 GLN C C 180.081 0.000 1 1097 301 236 GLN CA C 57.690 0.000 1 1098 301 236 GLN CB C 25.667 0.000 1 1099 301 236 GLN N N 114.719 0.000 1 1100 302 237 LYS H H 7.925 0.002 1 1101 302 237 LYS C C 177.528 0.000 1 1102 302 237 LYS CA C 58.018 0.010 1 1103 302 237 LYS CB C 30.951 0.085 1 1104 302 237 LYS N N 122.286 0.002 1 1105 303 238 SER H H 7.502 0.001 1 1106 303 238 SER C C 173.801 0.000 1 1107 303 238 SER CA C 57.025 0.012 1 1108 303 238 SER CB C 62.633 0.074 1 1109 303 238 SER N N 114.084 0.038 1 1110 304 239 GLY H H 7.850 0.002 1 1111 304 239 GLY C C 173.897 0.000 1 1112 304 239 GLY CA C 44.541 0.061 1 1113 304 239 GLY N N 110.830 0.000 1 1114 305 240 LYS H H 7.944 0.002 1 1115 305 240 LYS C C 174.011 0.000 1 1116 305 240 LYS CA C 53.141 0.004 1 1117 305 240 LYS CB C 34.417 0.083 1 1118 305 240 LYS N N 121.181 0.003 1 1119 306 241 LYS H H 8.158 0.005 1 1120 306 241 LYS CA C 51.669 0.000 1 1121 306 241 LYS CB C 32.040 0.000 1 1122 306 241 LYS N N 124.072 0.001 1 1123 307 242 PRO C C 176.057 0.000 1 1124 307 242 PRO CA C 60.886 0.000 1 1125 307 242 PRO CB C 30.865 0.000 1 1126 308 243 ILE H H 8.272 0.008 1 1127 308 243 ILE C C 175.760 0.000 1 1128 308 243 ILE CA C 56.761 0.000 1 1129 308 243 ILE CB C 34.143 0.019 1 1130 308 243 ILE N N 122.166 0.048 1 1131 309 244 ASP H H 9.198 0.003 1 1132 309 244 ASP C C 178.505 0.000 1 1133 309 244 ASP CA C 51.194 0.035 1 1134 309 244 ASP CB C 38.121 0.075 1 1135 309 244 ASP N N 128.144 0.031 1 1136 310 245 TRP H H 7.749 0.004 1 1137 310 245 TRP C C 176.941 0.000 1 1138 310 245 TRP CA C 56.739 0.000 1 1139 310 245 TRP CB C 28.791 0.000 1 1140 310 245 TRP N N 127.783 0.000 1 1141 311 246 LYS H H 7.011 0.014 1 1142 311 246 LYS C C 174.402 0.000 1 1143 311 246 LYS CA C 55.638 0.000 1 1144 311 246 LYS CB C 33.026 0.000 1 1145 311 246 LYS N N 115.611 0.030 1 1146 312 247 GLU H H 11.154 0.025 1 1147 312 247 GLU C C 171.530 0.000 1 1148 312 247 GLU CA C 56.923 0.000 1 1149 312 247 GLU CB C 24.677 0.000 1 1150 312 247 GLU N N 121.621 0.000 1 1151 313 248 LEU H H 7.158 0.002 1 1152 313 248 LEU CA C 54.049 0.000 1 1153 313 248 LEU CB C 46.864 0.000 1 1154 313 248 LEU N N 131.851 0.000 1 stop_ save_