data_27445 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone Assignment of GII.4 Saga Norovirus Protruding Domain ; _BMRB_accession_number 27445 _BMRB_flat_file_name bmr27445.str _Entry_type original _Submission_date 2018-04-10 _Accession_date 2018-04-10 _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 Creutznacher Robert . . 2 Mallagaray Alvaro . . 3 Grimm Lena . . 4 Peters Thomas . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 249 "13C chemical shifts" 767 "15N chemical shifts" 249 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-09-18 original BMRB . stop_ _Original_release_date 2018-04-10 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Fucose-Functionalized Precision Glycomacromolecules Targeting Human Norovirus Capsid Protein. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 30071731 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Bucher 'Katharina Susanne' S. . 2 Yan Hao . . 3 Creutznacher Robert . . 4 Ruoff Kerstin . . 5 Mallagaray Alvaro . . 6 Grafmuller Andrea . . 7 Dirks 'Jan Sebastian' S. . 8 Kilic Turgay . . 9 Weickert Sabrina . . 10 Rubailo Anna . . 11 Drescher Malte . . 12 Schmidt Stephan . . 13 Hansman Grant . . 14 Peters Thomas . . 15 Uetrecht Charlotte . . 16 Hartmann Laura . . stop_ _Journal_abbreviation Biomacromolecules _Journal_name_full Biomacromolecules _Journal_volume 19 _Journal_issue 9 _Journal_ISSN 1526-4602 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 3714 _Page_last 3724 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'GII.4 Saga Norovirus Protruding Domain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'GII.4 Saga Norovirus Protruding Domain, chain 1' $Molecule_1 'GII.4 Saga Norovirus Protruding Domain, chain 2' $Molecule_1 stop_ _System_molecular_weight 34068.2246 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details ; Norovirus protruding domain proteins exist as stable homodimers in solution without measurable exchange of monomer units. The 68 kDa homodimer was studied here. ; save_ ######################## # Monomeric polymers # ######################## save_Molecule_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'GII.4 Saga Norovirus Protruding Domain' _Molecular_mass 34068.2246 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 310 _Mol_residue_sequence ; GPGSKPFTVPILTVEEMTNS RFPIPLEKLFTGPSGAFVVQ PQNGRCTTDGVLLGTTQLSP VNICTFRGDVTHIAGSRNYT MNLASLNWNNYDPTEEIPAP LGTPDFVGKIQGLLTQTTKG DGSTRGHKATVYTGSAPFTP KLGSVQFSTDTENDFETHQN TKFTPVGVIQDGSTTHRNEP QQWVLPSYSGRNVHNVHLAP AVAPTFPGEQLLFFRSTMPG CSGYPNMDLDCLLPQEWVQH FYQEAAPAQSDVALLRFVNP DTGRVLFECKLHKSGYVTVA HTGQHDLVIPPNGYFRFDSW VNQFYTLAPM ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 PRO 3 GLY 4 SER 5 LYS 6 PRO 7 PHE 8 THR 9 VAL 10 PRO 11 ILE 12 LEU 13 THR 14 VAL 15 GLU 16 GLU 17 MET 18 THR 19 ASN 20 SER 21 ARG 22 PHE 23 PRO 24 ILE 25 PRO 26 LEU 27 GLU 28 LYS 29 LEU 30 PHE 31 THR 32 GLY 33 PRO 34 SER 35 GLY 36 ALA 37 PHE 38 VAL 39 VAL 40 GLN 41 PRO 42 GLN 43 ASN 44 GLY 45 ARG 46 CYS 47 THR 48 THR 49 ASP 50 GLY 51 VAL 52 LEU 53 LEU 54 GLY 55 THR 56 THR 57 GLN 58 LEU 59 SER 60 PRO 61 VAL 62 ASN 63 ILE 64 CYS 65 THR 66 PHE 67 ARG 68 GLY 69 ASP 70 VAL 71 THR 72 HIS 73 ILE 74 ALA 75 GLY 76 SER 77 ARG 78 ASN 79 TYR 80 THR 81 MET 82 ASN 83 LEU 84 ALA 85 SER 86 LEU 87 ASN 88 TRP 89 ASN 90 ASN 91 TYR 92 ASP 93 PRO 94 THR 95 GLU 96 GLU 97 ILE 98 PRO 99 ALA 100 PRO 101 LEU 102 GLY 103 THR 104 PRO 105 ASP 106 PHE 107 VAL 108 GLY 109 LYS 110 ILE 111 GLN 112 GLY 113 LEU 114 LEU 115 THR 116 GLN 117 THR 118 THR 119 LYS 120 GLY 121 ASP 122 GLY 123 SER 124 THR 125 ARG 126 GLY 127 HIS 128 LYS 129 ALA 130 THR 131 VAL 132 TYR 133 THR 134 GLY 135 SER 136 ALA 137 PRO 138 PHE 139 THR 140 PRO 141 LYS 142 LEU 143 GLY 144 SER 145 VAL 146 GLN 147 PHE 148 SER 149 THR 150 ASP 151 THR 152 GLU 153 ASN 154 ASP 155 PHE 156 GLU 157 THR 158 HIS 159 GLN 160 ASN 161 THR 162 LYS 163 PHE 164 THR 165 PRO 166 VAL 167 GLY 168 VAL 169 ILE 170 GLN 171 ASP 172 GLY 173 SER 174 THR 175 THR 176 HIS 177 ARG 178 ASN 179 GLU 180 PRO 181 GLN 182 GLN 183 TRP 184 VAL 185 LEU 186 PRO 187 SER 188 TYR 189 SER 190 GLY 191 ARG 192 ASN 193 VAL 194 HIS 195 ASN 196 VAL 197 HIS 198 LEU 199 ALA 200 PRO 201 ALA 202 VAL 203 ALA 204 PRO 205 THR 206 PHE 207 PRO 208 GLY 209 GLU 210 GLN 211 LEU 212 LEU 213 PHE 214 PHE 215 ARG 216 SER 217 THR 218 MET 219 PRO 220 GLY 221 CYS 222 SER 223 GLY 224 TYR 225 PRO 226 ASN 227 MET 228 ASP 229 LEU 230 ASP 231 CYS 232 LEU 233 LEU 234 PRO 235 GLN 236 GLU 237 TRP 238 VAL 239 GLN 240 HIS 241 PHE 242 TYR 243 GLN 244 GLU 245 ALA 246 ALA 247 PRO 248 ALA 249 GLN 250 SER 251 ASP 252 VAL 253 ALA 254 LEU 255 LEU 256 ARG 257 PHE 258 VAL 259 ASN 260 PRO 261 ASP 262 THR 263 GLY 264 ARG 265 VAL 266 LEU 267 PHE 268 GLU 269 CYS 270 LYS 271 LEU 272 HIS 273 LYS 274 SER 275 GLY 276 TYR 277 VAL 278 THR 279 VAL 280 ALA 281 HIS 282 THR 283 GLY 284 GLN 285 HIS 286 ASP 287 LEU 288 VAL 289 ILE 290 PRO 291 PRO 292 ASN 293 GLY 294 TYR 295 PHE 296 ARG 297 PHE 298 ASP 299 SER 300 TRP 301 VAL 302 ASN 303 GLN 304 PHE 305 TYR 306 THR 307 LEU 308 ALA 309 PRO 310 MET stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value GenBank AB447457 AB447457 . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Strain _Variant $Molecule_1 Norovirus 142786 Viruses . Norovirus . GII.4 'Saga 2006' 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 $Molecule_1 'recombinant technology' 'Escherichia coli' Escherichia coli . - stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Sample_1 _Saveframe_category sample _Sample_type solution _Details '0.15 mM NoV protruding domain (homodimer concentration) in 20 mM sodium phosphate buffer, 0.2 mM DSS-d6' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Molecule_1 0.15 mM '[U-13C; U-15N; U-2H]' 'sodium phosphate buffer' 20 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Saveframe_category software _Name CcpNmr_Analysis _Version 2.4 loop_ _Vendor _Address _Electronic_address CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk stop_ loop_ _Task Assignment stop_ _Details 'The CCPN NMR assignment and data analysis application' save_ save_TopSpin _Saveframe_category software _Name TopSpin _Version 3.5 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task 'Data Processing' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 500 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HN(CO)CACB_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CACB' _Sample_label $Sample_1 save_ save_3D_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $Sample_1 save_ save_3D_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $Sample_1 save_ save_3D_HN(CO)CA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $Sample_1 save_ save_3D_HN(CA)CO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $Sample_1 save_ save_3D_HNCO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $Sample_1 save_ save_3D_HNCACB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $Sample_1 save_ save_3D_HNCA_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $Sample_1 save_ save_3D_HN(CO)CA_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $Sample_1 save_ ####################### # Sample conditions # ####################### save_CondSet1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.300 . pH temperature 298.000 . 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 _Saveframe_category assigned_chemical_shifts _Details ; The chemical shifts reported in the deposition were not corrected for deuterium isotope effects. HN and 15N chemical shifts are reported for the TROSY component of each HN multiplet. ; loop_ _Software_label $CcpNmr_Analysis stop_ loop_ _Experiment_label '3D HN(CO)CACB' '3D HNCACB' '3D HNCO' '3D HN(CO)CA' '3D HN(CA)CO' '3D HNCA' stop_ loop_ _Sample_label $Sample_1 stop_ _Sample_conditions_label $CondSet1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'GII.4 Saga Norovirus Protruding Domain, chain 1' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 2 PRO C C 177.54 0.3 1 2 2 2 PRO CA C 62.795 0.3 1 3 3 3 GLY H H 8.475 0.01 1 4 3 3 GLY C C 174.063 0.3 1 5 3 3 GLY CA C 44.57 0.3 1 6 3 3 GLY N N 110.543 0.08 1 7 4 4 SER H H 8.076 0.01 1 8 4 4 SER C C 174.066 0.3 1 9 4 4 SER CA C 57.54 0.3 1 10 4 4 SER CB C 63.318 0.3 1 11 4 4 SER N N 116.256 0.08 1 12 5 5 LYS H H 8.249 0.01 1 13 5 5 LYS CA C 54.145 0.3 1 14 5 5 LYS CB C 32.061 0.3 1 15 5 5 LYS N N 126.701 0.08 1 16 10 10 PRO C C 175.513 0.3 1 17 10 10 PRO CA C 62.565 0.3 1 18 10 10 PRO CB C 30.836 0.3 1 19 11 11 ILE H H 7.85 0.01 1 20 11 11 ILE C C 174.365 0.3 1 21 11 11 ILE CA C 60.342 0.3 1 22 11 11 ILE CB C 36.633 0.3 1 23 11 11 ILE N N 115.851 0.08 1 24 12 12 LEU H H 6.055 0.01 1 25 12 12 LEU C C 176.504 0.3 1 26 12 12 LEU CA C 54.127 0.3 1 27 12 12 LEU CB C 40.682 0.3 1 28 12 12 LEU N N 118.392 0.08 1 29 13 13 THR H H 8.447 0.01 1 30 13 13 THR C C 176.147 0.3 1 31 13 13 THR CA C 60.225 0.3 1 32 13 13 THR CB C 69.981 0.3 1 33 13 13 THR N N 114.529 0.08 1 34 14 14 VAL H H 9.229 0.01 1 35 14 14 VAL C C 177.215 0.3 1 36 14 14 VAL CA C 68.363 0.3 1 37 14 14 VAL CB C 30.623 0.3 1 38 14 14 VAL N N 120.696 0.08 1 39 15 15 GLU H H 7.99 0.01 1 40 15 15 GLU C C 177.86 0.3 1 41 15 15 GLU CA C 57.043 0.3 1 42 15 15 GLU CB C 28.644 0.3 1 43 15 15 GLU N N 111.328 0.08 1 44 16 16 GLU H H 7.363 0.01 1 45 16 16 GLU C C 175.26 0.3 1 46 16 16 GLU CA C 55.656 0.3 1 47 16 16 GLU CB C 29.082 0.3 1 48 16 16 GLU N N 118.958 0.08 1 49 17 17 MET H H 7.293 0.01 1 50 17 17 MET C C 175.677 0.3 1 51 17 17 MET CA C 55.507 0.3 1 52 17 17 MET CB C 37.327 0.3 1 53 17 17 MET N N 116.814 0.08 1 54 18 18 THR H H 11.094 0.01 1 55 18 18 THR C C 174.465 0.3 1 56 18 18 THR CA C 63.039 0.3 1 57 18 18 THR CB C 69.007 0.3 1 58 18 18 THR N N 122.535 0.08 1 59 19 19 ASN H H 9.026 0.01 1 60 19 19 ASN C C 172.718 0.3 1 61 19 19 ASN CA C 54.579 0.3 1 62 19 19 ASN CB C 37.842 0.3 1 63 19 19 ASN N N 128.985 0.08 1 64 20 20 SER H H 7.551 0.01 1 65 20 20 SER C C 176.411 0.3 1 66 20 20 SER CA C 56.695 0.3 1 67 20 20 SER CB C 62.747 0.3 1 68 20 20 SER N N 115.297 0.08 1 69 21 21 ARG H H 9.7 0.01 1 70 21 21 ARG C C 174.942 0.3 1 71 21 21 ARG CA C 55.508 0.3 1 72 21 21 ARG CB C 32.04 0.3 1 73 21 21 ARG N N 120.105 0.08 1 74 22 22 PHE H H 7.351 0.01 1 75 22 22 PHE C C 173.656 0.3 1 76 22 22 PHE CA C 57.373 0.3 1 77 22 22 PHE CB C 42.191 0.3 1 78 22 22 PHE N N 121.663 0.08 1 79 28 28 LYS H H 8.163 0.01 1 80 28 28 LYS C C 173.082 0.3 1 81 28 28 LYS CA C 54.245 0.3 1 82 28 28 LYS CB C 34.46 0.3 1 83 28 28 LYS N N 115.507 0.08 1 84 29 29 LEU H H 9.222 0.01 1 85 29 29 LEU C C 175.145 0.3 1 86 29 29 LEU CA C 52.446 0.3 1 87 29 29 LEU CB C 42.698 0.3 1 88 29 29 LEU N N 119.427 0.08 1 89 30 30 PHE H H 8.797 0.01 1 90 30 30 PHE C C 172.74 0.3 1 91 30 30 PHE CA C 55.762 0.3 1 92 30 30 PHE CB C 43.515 0.3 1 93 30 30 PHE N N 124.942 0.08 1 94 31 31 THR H H 7.538 0.01 1 95 31 31 THR C C 168.991 0.3 1 96 31 31 THR CA C 58.412 0.3 1 97 31 31 THR CB C 70.138 0.3 1 98 31 31 THR N N 121.724 0.08 1 99 32 32 GLY H H 6.74 0.01 1 100 32 32 GLY C C 169.904 0.3 1 101 32 32 GLY CA C 44.407 0.3 1 102 32 32 GLY N N 110.096 0.08 1 103 33 33 PRO C C 177.566 0.3 1 104 33 33 PRO CA C 61.985 0.3 1 105 33 33 PRO CB C 31.453 0.3 1 106 34 34 SER H H 8.934 0.01 1 107 34 34 SER C C 174.372 0.3 1 108 34 34 SER CA C 57.39 0.3 1 109 34 34 SER CB C 63.111 0.3 1 110 34 34 SER N N 117.854 0.08 1 111 35 35 GLY H H 7.84 0.01 1 112 35 35 GLY C C 174.672 0.3 1 113 35 35 GLY CA C 45.903 0.3 1 114 35 35 GLY N N 109.5 0.08 1 115 36 36 ALA H H 8.011 0.01 1 116 36 36 ALA C C 176.502 0.3 1 117 36 36 ALA CA C 51.625 0.3 1 118 36 36 ALA CB C 17.883 0.3 1 119 36 36 ALA N N 122.806 0.08 1 120 37 37 PHE H H 7.398 0.01 1 121 37 37 PHE C C 173.501 0.3 1 122 37 37 PHE CA C 54.727 0.3 1 123 37 37 PHE CB C 39.604 0.3 1 124 37 37 PHE N N 117.206 0.08 1 125 38 38 VAL H H 8.757 0.01 1 126 38 38 VAL C C 174.545 0.3 1 127 38 38 VAL CA C 61.916 0.3 1 128 38 38 VAL CB C 31.702 0.3 1 129 38 38 VAL N N 123.111 0.08 1 130 39 39 VAL H H 8.553 0.01 1 131 39 39 VAL C C 173.326 0.3 1 132 39 39 VAL CA C 60.745 0.3 1 133 39 39 VAL CB C 28.763 0.3 1 134 39 39 VAL N N 128.771 0.08 1 135 40 40 GLN H H 9.558 0.01 1 136 40 40 GLN C C 172.986 0.3 1 137 40 40 GLN CA C 53.731 0.3 1 138 40 40 GLN N N 129.613 0.08 1 139 42 42 GLN C C 177.128 0.3 1 140 43 43 ASN H H 8.519 0.01 1 141 43 43 ASN C C 175.327 0.3 1 142 43 43 ASN CA C 52.244 0.3 1 143 43 43 ASN CB C 39.766 0.3 1 144 43 43 ASN N N 120.081 0.08 1 145 44 44 GLY H H 7.567 0.01 1 146 44 44 GLY C C 174.383 0.3 1 147 44 44 GLY CA C 45.719 0.3 1 148 44 44 GLY N N 112.14 0.08 1 149 45 45 ARG H H 9.013 0.01 1 150 45 45 ARG C C 173.785 0.3 1 151 45 45 ARG CA C 50.574 0.3 1 152 45 45 ARG CB C 28.22 0.3 1 153 45 45 ARG N N 119.476 0.08 1 154 46 46 CYS H H 7.899 0.01 1 155 46 46 CYS C C 172.211 0.3 1 156 46 46 CYS CA C 56.45 0.3 1 157 46 46 CYS CB C 29.562 0.3 1 158 46 46 CYS N N 125.947 0.08 1 159 47 47 THR H H 8.721 0.01 1 160 47 47 THR C C 178.761 0.3 1 161 47 47 THR CA C 61.225 0.3 1 162 47 47 THR CB C 70.123 0.3 1 163 47 47 THR N N 116.757 0.08 1 164 48 48 THR H H 9.321 0.01 1 165 48 48 THR C C 174.642 0.3 1 166 48 48 THR CA C 64.74 0.3 1 167 48 48 THR CB C 66.529 0.3 1 168 48 48 THR N N 112.891 0.08 1 169 49 49 ASP H H 7.855 0.01 1 170 49 49 ASP C C 176.138 0.3 1 171 49 49 ASP CA C 51.79 0.3 1 172 49 49 ASP CB C 39.001 0.3 1 173 49 49 ASP N N 115.253 0.08 1 174 50 50 GLY H H 7.811 0.01 1 175 50 50 GLY C C 173.383 0.3 1 176 50 50 GLY CA C 46.447 0.3 1 177 50 50 GLY N N 107.179 0.08 1 178 51 51 VAL H H 8.102 0.01 1 179 51 51 VAL C C 175.214 0.3 1 180 51 51 VAL CA C 62.138 0.3 1 181 51 51 VAL CB C 30.131 0.3 1 182 51 51 VAL N N 123.1 0.08 1 183 52 52 LEU H H 8.185 0.01 1 184 52 52 LEU C C 177.031 0.3 1 185 52 52 LEU CA C 55.136 0.3 1 186 52 52 LEU CB C 40.909 0.3 1 187 52 52 LEU N N 127.513 0.08 1 188 53 53 LEU H H 7.873 0.01 1 189 53 53 LEU C C 177.854 0.3 1 190 53 53 LEU CA C 52.222 0.3 1 191 53 53 LEU CB C 45.654 0.3 1 192 53 53 LEU N N 120.105 0.08 1 193 54 54 GLY H H 9.007 0.01 1 194 54 54 GLY C C 175.505 0.3 1 195 54 54 GLY CA C 47.381 0.3 1 196 54 54 GLY N N 109.409 0.08 1 197 55 55 THR H H 8.315 0.01 1 198 55 55 THR C C 174.512 0.3 1 199 55 55 THR CA C 60.229 0.3 1 200 55 55 THR CB C 67.608 0.3 1 201 55 55 THR N N 116.579 0.08 1 202 56 56 THR C C 171.411 0.3 1 203 56 56 THR CA C 66.111 0.3 1 204 56 56 THR CB C 69.064 0.3 1 205 57 57 GLN H H 8.451 0.01 1 206 57 57 GLN C C 174.958 0.3 1 207 57 57 GLN CA C 52.105 0.3 1 208 57 57 GLN CB C 29.109 0.3 1 209 57 57 GLN N N 121.835 0.08 1 210 58 58 LEU H H 8.117 0.01 1 211 58 58 LEU C C 178.357 0.3 1 212 58 58 LEU CA C 57.13 0.3 1 213 58 58 LEU CB C 42.341 0.3 1 214 58 58 LEU N N 117.213 0.08 1 215 59 59 SER H H 7.741 0.01 1 216 59 59 SER C C 176.385 0.3 1 217 59 59 SER CA C 54.388 0.3 1 218 59 59 SER CB C 62.462 0.3 1 219 59 59 SER N N 114.807 0.08 1 220 60 60 PRO C C 175.548 0.3 1 221 60 60 PRO CA C 62.955 0.3 1 222 61 61 VAL H H 6.532 0.01 1 223 61 61 VAL C C 176.228 0.3 1 224 61 61 VAL CA C 60.131 0.3 1 225 61 61 VAL CB C 29.645 0.3 1 226 61 61 VAL N N 102.516 0.08 1 227 62 62 ASN H H 6.767 0.01 1 228 62 62 ASN C C 176.736 0.3 1 229 62 62 ASN CA C 51.272 0.3 1 230 62 62 ASN CB C 38.714 0.3 1 231 62 62 ASN N N 117.722 0.08 1 232 63 63 ILE H H 6.589 0.01 1 233 63 63 ILE C C 174.508 0.3 1 234 63 63 ILE CA C 63.86 0.3 1 235 63 63 ILE CB C 37.752 0.3 1 236 63 63 ILE N N 124.067 0.08 1 237 64 64 CYS H H 8.98 0.01 1 238 64 64 CYS C C 171.438 0.3 1 239 64 64 CYS CA C 62.439 0.3 1 240 64 64 CYS CB C 23.023 0.3 1 241 64 64 CYS N N 114.668 0.08 1 242 65 65 THR H H 6.783 0.01 1 243 65 65 THR C C 173.358 0.3 1 244 65 65 THR CA C 59.882 0.3 1 245 65 65 THR CB C 71.954 0.3 1 246 65 65 THR N N 103.445 0.08 1 247 66 66 PHE H H 7.43 0.01 1 248 66 66 PHE C C 173.791 0.3 1 249 66 66 PHE CA C 56.221 0.3 1 250 66 66 PHE CB C 43.862 0.3 1 251 66 66 PHE N N 113.577 0.08 1 252 67 67 ARG H H 8.685 0.01 1 253 67 67 ARG C C 174.589 0.3 1 254 67 67 ARG CA C 54.132 0.3 1 255 67 67 ARG CB C 32.383 0.3 1 256 67 67 ARG N N 122.986 0.08 1 257 68 68 GLY H H 8.689 0.01 1 258 68 68 GLY C C 171.4 0.3 1 259 68 68 GLY CA C 45.702 0.3 1 260 68 68 GLY N N 107.21 0.08 1 261 69 69 ASP H H 8.213 0.01 1 262 69 69 ASP C C 175.373 0.3 1 263 69 69 ASP CA C 51.972 0.3 1 264 69 69 ASP CB C 42.186 0.3 1 265 69 69 ASP N N 121.282 0.08 1 266 70 70 VAL H H 9.711 0.01 1 267 70 70 VAL C C 176.94 0.3 1 268 70 70 VAL CA C 58.182 0.3 1 269 70 70 VAL CB C 35.675 0.3 1 270 70 70 VAL N N 112.77 0.08 1 271 71 71 THR H H 8.857 0.01 1 272 71 71 THR C C 173.223 0.3 1 273 71 71 THR CA C 60.647 0.3 1 274 71 71 THR CB C 70.976 0.3 1 275 71 71 THR N N 116.925 0.08 1 276 72 72 HIS H H 9.066 0.01 1 277 72 72 HIS C C 174.397 0.3 1 278 72 72 HIS CA C 55.444 0.3 1 279 72 72 HIS CB C 30.482 0.3 1 280 72 72 HIS N N 125.673 0.08 1 281 73 73 ILE H H 7.492 0.01 1 282 73 73 ILE C C 174.651 0.3 1 283 73 73 ILE CA C 60.427 0.3 1 284 73 73 ILE CB C 35.442 0.3 1 285 73 73 ILE N N 130.977 0.08 1 286 74 74 ALA H H 8.144 0.01 1 287 74 74 ALA C C 178.201 0.3 1 288 74 74 ALA CA C 53.289 0.3 1 289 74 74 ALA CB C 17.335 0.3 1 290 74 74 ALA N N 131.75 0.08 1 291 75 75 GLY H H 8.824 0.01 1 292 75 75 GLY C C 173.699 0.3 1 293 75 75 GLY CA C 44.879 0.3 1 294 75 75 GLY N N 110.722 0.08 1 295 76 76 SER H H 7.826 0.01 1 296 76 76 SER CA C 56.882 0.3 1 297 76 76 SER CB C 67.507 0.3 1 298 76 76 SER N N 116.135 0.08 1 299 77 77 ARG C C 175.755 0.3 1 300 78 78 ASN H H 8.734 0.01 1 301 78 78 ASN C C 174.084 0.3 1 302 78 78 ASN CA C 51.552 0.3 1 303 78 78 ASN N N 120.012 0.08 1 304 79 79 TYR H H 8.951 0.01 1 305 79 79 TYR C C 175.377 0.3 1 306 79 79 TYR CA C 56.511 0.3 1 307 79 79 TYR CB C 41.677 0.3 1 308 79 79 TYR N N 118.319 0.08 1 309 80 80 THR H H 9.05 0.01 1 310 80 80 THR C C 173.509 0.3 1 311 80 80 THR CA C 61.933 0.3 1 312 80 80 THR CB C 69.101 0.3 1 313 80 80 THR N N 121.754 0.08 1 314 81 81 MET H H 9.559 0.01 1 315 81 81 MET C C 173.959 0.3 1 316 81 81 MET CA C 53.059 0.3 1 317 81 81 MET CB C 36.806 0.3 1 318 81 81 MET N N 128.457 0.08 1 319 82 82 ASN H H 8.83 0.01 1 320 82 82 ASN C C 175.452 0.3 1 321 82 82 ASN CA C 51.869 0.3 1 322 82 82 ASN CB C 38.226 0.3 1 323 82 82 ASN N N 128.206 0.08 1 324 83 83 LEU H H 8.301 0.01 1 325 83 83 LEU C C 176.492 0.3 1 326 83 83 LEU CA C 55.638 0.3 1 327 83 83 LEU CB C 41.304 0.3 1 328 83 83 LEU N N 125.213 0.08 1 329 84 84 ALA H H 9.185 0.01 1 330 84 84 ALA C C 176.709 0.3 1 331 84 84 ALA CA C 49.689 0.3 1 332 84 84 ALA CB C 21.051 0.3 1 333 84 84 ALA N N 125.831 0.08 1 334 85 85 SER H H 8.447 0.01 1 335 85 85 SER C C 174.548 0.3 1 336 85 85 SER CA C 57.138 0.3 1 337 85 85 SER CB C 63.622 0.3 1 338 85 85 SER N N 113.868 0.08 1 339 86 86 LEU H H 7.899 0.01 1 340 86 86 LEU C C 176.317 0.3 1 341 86 86 LEU CA C 56.815 0.3 1 342 86 86 LEU CB C 40.46 0.3 1 343 86 86 LEU N N 118.752 0.08 1 344 88 88 TRP C C 175.592 0.3 1 345 88 88 TRP CA C 59.451 0.3 1 346 88 88 TRP CB C 24.54 0.3 1 347 89 89 ASN H H 7.787 0.01 1 348 89 89 ASN C C 174.663 0.3 1 349 89 89 ASN CA C 52.272 0.3 1 350 89 89 ASN CB C 38.607 0.3 1 351 89 89 ASN N N 119.727 0.08 1 352 90 90 ASN H H 8.574 0.01 1 353 90 90 ASN C C 175.591 0.3 1 354 90 90 ASN CA C 54.119 0.3 1 355 90 90 ASN CB C 38.056 0.3 1 356 90 90 ASN N N 118.694 0.08 1 357 91 91 TYR H H 8.861 0.01 1 358 91 91 TYR C C 173.588 0.3 1 359 91 91 TYR CA C 56.653 0.3 1 360 91 91 TYR CB C 38.18 0.3 1 361 91 91 TYR N N 125.177 0.08 1 362 92 92 ASP H H 7.948 0.01 1 363 92 92 ASP C C 174.451 0.3 1 364 92 92 ASP CA C 49.039 0.3 1 365 92 92 ASP CB C 41.23 0.3 1 366 92 92 ASP N N 129.931 0.08 1 367 93 93 PRO CA C 63.437 0.3 1 368 93 93 PRO CB C 31.774 0.3 1 369 94 94 THR H H 8.207 0.01 1 370 94 94 THR C C 175.942 0.3 1 371 94 94 THR CA C 61.912 0.3 1 372 94 94 THR CB C 68.88 0.3 1 373 94 94 THR N N 110.198 0.08 1 374 95 95 GLU H H 6.814 0.01 1 375 95 95 GLU C C 177.146 0.3 1 376 95 95 GLU CA C 56.766 0.3 1 377 95 95 GLU CB C 29.33 0.3 1 378 95 95 GLU N N 124.409 0.08 1 379 96 96 GLU H H 8.552 0.01 1 380 96 96 GLU C C 174.722 0.3 1 381 96 96 GLU CA C 55.508 0.3 1 382 96 96 GLU CB C 25.709 0.3 1 383 96 96 GLU N N 126.609 0.08 1 384 97 97 ILE H H 8.057 0.01 1 385 97 97 ILE CA C 58.292 0.3 1 386 97 97 ILE CB C 39.316 0.3 1 387 97 97 ILE N N 117.523 0.08 1 388 100 100 PRO C C 177.682 0.3 1 389 100 100 PRO CA C 62.156 0.3 1 390 100 100 PRO CB C 29.167 0.3 1 391 101 101 LEU H H 8.63 0.01 1 392 101 101 LEU C C 178.087 0.3 1 393 101 101 LEU CA C 55.725 0.3 1 394 101 101 LEU CB C 39.369 0.3 1 395 101 101 LEU N N 124.483 0.08 1 396 102 102 GLY H H 9.245 0.01 1 397 102 102 GLY C C 172.939 0.3 1 398 102 102 GLY CA C 44.316 0.3 1 399 102 102 GLY N N 107.575 0.08 1 400 103 103 THR H H 7.529 0.01 1 401 103 103 THR C C 176.671 0.3 1 402 103 103 THR CA C 62.986 0.3 1 403 103 103 THR CB C 69.532 0.3 1 404 103 103 THR N N 118.661 0.08 1 405 104 104 PRO C C 175.336 0.3 1 406 104 104 PRO CA C 64.093 0.3 1 407 104 104 PRO CB C 31.699 0.3 1 408 105 105 ASP H H 7.437 0.01 1 409 105 105 ASP C C 173.555 0.3 1 410 105 105 ASP CA C 51.166 0.3 1 411 105 105 ASP CB C 40.883 0.3 1 412 105 105 ASP N N 118.483 0.08 1 413 106 106 PHE H H 6.438 0.01 1 414 106 106 PHE C C 174.833 0.3 1 415 106 106 PHE CA C 53.276 0.3 1 416 106 106 PHE CB C 41.18 0.3 1 417 106 106 PHE N N 109.619 0.08 1 418 107 107 VAL H H 7.459 0.01 1 419 107 107 VAL C C 174.488 0.3 1 420 107 107 VAL CA C 62.033 0.3 1 421 107 107 VAL CB C 31.475 0.3 1 422 107 107 VAL N N 123.233 0.08 1 423 108 108 GLY H H 8.463 0.01 1 424 108 108 GLY C C 170.219 0.3 1 425 108 108 GLY CA C 44.409 0.3 1 426 108 108 GLY N N 115.829 0.08 1 427 109 109 LYS H H 9.753 0.01 1 428 109 109 LYS C C 174.682 0.3 1 429 109 109 LYS CA C 54.806 0.3 1 430 109 109 LYS CB C 32.278 0.3 1 431 109 109 LYS N N 125.784 0.08 1 432 110 110 ILE H H 8.623 0.01 1 433 110 110 ILE C C 174.428 0.3 1 434 110 110 ILE CA C 60.061 0.3 1 435 110 110 ILE CB C 39.34 0.3 1 436 110 110 ILE N N 123.994 0.08 1 437 111 111 GLN H H 9.602 0.01 1 438 111 111 GLN C C 175.4 0.3 1 439 111 111 GLN CA C 53.347 0.3 1 440 111 111 GLN CB C 33.292 0.3 1 441 111 111 GLN N N 129.456 0.08 1 442 112 112 GLY H H 9.109 0.01 1 443 112 112 GLY C C 171.697 0.3 1 444 112 112 GLY CA C 45.515 0.3 1 445 112 112 GLY N N 116.489 0.08 1 446 113 113 LEU H H 7.704 0.01 1 447 113 113 LEU C C 175.375 0.3 1 448 113 113 LEU CA C 53.078 0.3 1 449 113 113 LEU CB C 44.612 0.3 1 450 113 113 LEU N N 121.668 0.08 1 451 114 114 LEU H H 8.982 0.01 1 452 114 114 LEU C C 175.849 0.3 1 453 114 114 LEU CA C 52.44 0.3 1 454 114 114 LEU CB C 44.367 0.3 1 455 114 114 LEU N N 127.033 0.08 1 456 115 115 THR H H 9.476 0.01 1 457 115 115 THR C C 173.143 0.3 1 458 115 115 THR CA C 58.929 0.3 1 459 115 115 THR CB C 70.552 0.3 1 460 115 115 THR N N 115.665 0.08 1 461 116 116 GLN H H 8.946 0.01 1 462 116 116 GLN C C 172.993 0.3 1 463 116 116 GLN CA C 54.622 0.3 1 464 116 116 GLN CB C 35.491 0.3 1 465 116 116 GLN N N 121.903 0.08 1 466 117 117 THR H H 7.133 0.01 1 467 117 117 THR C C 173.793 0.3 1 468 117 117 THR CA C 59.328 0.3 1 469 117 117 THR CB C 71.21 0.3 1 470 117 117 THR N N 122.961 0.08 1 471 118 118 THR H H 9.455 0.01 1 472 118 118 THR C C 174.744 0.3 1 473 118 118 THR CA C 62.401 0.3 1 474 118 118 THR CB C 67.668 0.3 1 475 118 118 THR N N 126.876 0.08 1 476 119 119 LYS H H 8.426 0.01 1 477 119 119 LYS C C 178.975 0.3 1 478 119 119 LYS CA C 58.412 0.3 1 479 119 119 LYS CB C 31.326 0.3 1 480 119 119 LYS N N 130.301 0.08 1 481 120 120 GLY H H 8.646 0.01 1 482 120 120 GLY C C 174.678 0.3 1 483 120 120 GLY CA C 46.542 0.3 1 484 120 120 GLY N N 107.413 0.08 1 485 121 121 ASP H H 7.19 0.01 1 486 121 121 ASP C C 177.431 0.3 1 487 121 121 ASP CA C 52.556 0.3 1 488 121 121 ASP CB C 41.44 0.3 1 489 121 121 ASP N N 115.973 0.08 1 490 122 122 GLY H H 8.225 0.01 1 491 122 122 GLY C C 173.529 0.3 1 492 122 122 GLY CA C 45.57 0.3 1 493 122 122 GLY N N 110.406 0.08 1 494 123 123 SER H H 7.902 0.01 1 495 123 123 SER C C 174.448 0.3 1 496 123 123 SER CA C 57.337 0.3 1 497 123 123 SER CB C 62.359 0.3 1 498 123 123 SER N N 115.63 0.08 1 499 124 124 THR H H 7.502 0.01 1 500 124 124 THR C C 173.771 0.3 1 501 124 124 THR CA C 59.388 0.3 1 502 124 124 THR CB C 73.184 0.3 1 503 124 124 THR N N 109.976 0.08 1 504 125 125 ARG H H 7.933 0.01 1 505 125 125 ARG C C 174.037 0.3 1 506 125 125 ARG CA C 54.765 0.3 1 507 125 125 ARG CB C 29.638 0.3 1 508 125 125 ARG N N 113.796 0.08 1 509 126 126 GLY H H 7.361 0.01 1 510 126 126 GLY C C 171.469 0.3 1 511 126 126 GLY CA C 45.088 0.3 1 512 126 126 GLY N N 107.626 0.08 1 513 127 127 HIS H H 8.88 0.01 1 514 127 127 HIS C C 174.252 0.3 1 515 127 127 HIS CA C 54.503 0.3 1 516 127 127 HIS CB C 34.464 0.3 1 517 127 127 HIS N N 119.929 0.08 1 518 128 128 LYS H H 9.096 0.01 1 519 128 128 LYS C C 175.197 0.3 1 520 128 128 LYS CA C 57.772 0.3 1 521 128 128 LYS CB C 31.698 0.3 1 522 128 128 LYS N N 126.638 0.08 1 523 129 129 ALA H H 8.603 0.01 1 524 129 129 ALA C C 175.418 0.3 1 525 129 129 ALA CA C 50.382 0.3 1 526 129 129 ALA CB C 24.54 0.3 1 527 129 129 ALA N N 126.924 0.08 1 528 130 130 THR H H 9.027 0.01 1 529 130 130 THR C C 173.166 0.3 1 530 130 130 THR CA C 60.825 0.3 1 531 130 130 THR CB C 70.856 0.3 1 532 130 130 THR N N 117.466 0.08 1 533 131 131 VAL H H 9.225 0.01 1 534 131 131 VAL C C 172.137 0.3 1 535 131 131 VAL CA C 57.477 0.3 1 536 131 131 VAL CB C 32.98 0.3 1 537 131 131 VAL N N 125.732 0.08 1 538 132 132 TYR H H 9.091 0.01 1 539 132 132 TYR C C 177.562 0.3 1 540 132 132 TYR CA C 52.509 0.3 1 541 132 132 TYR CB C 35.224 0.3 1 542 132 132 TYR N N 129.153 0.08 1 543 140 140 PRO C C 178.448 0.3 1 544 140 140 PRO CA C 64.833 0.3 1 545 141 141 LYS H H 8.239 0.01 1 546 141 141 LYS C C 178.742 0.3 1 547 141 141 LYS CA C 57.229 0.3 1 548 141 141 LYS CB C 29.806 0.3 1 549 141 141 LYS N N 118.797 0.08 1 550 142 142 LEU H H 7.194 0.01 1 551 142 142 LEU C C 178.145 0.3 1 552 142 142 LEU CA C 54.384 0.3 1 553 142 142 LEU CB C 40.054 0.3 1 554 142 142 LEU N N 115.526 0.08 1 555 143 143 GLY H H 7.78 0.01 1 556 143 143 GLY C C 173.228 0.3 1 557 143 143 GLY CA C 44.781 0.3 1 558 143 143 GLY N N 106.034 0.08 1 559 144 144 SER H H 7.236 0.01 1 560 144 144 SER C C 172.822 0.3 1 561 144 144 SER CA C 56.786 0.3 1 562 144 144 SER CB C 64.99 0.3 1 563 144 144 SER N N 115.063 0.08 1 564 145 145 VAL H H 7.854 0.01 1 565 145 145 VAL C C 172.413 0.3 1 566 145 145 VAL CA C 58.912 0.3 1 567 145 145 VAL CB C 35.209 0.3 1 568 145 145 VAL N N 114.456 0.08 1 569 146 146 GLN H H 7.558 0.01 1 570 146 146 GLN C C 174.979 0.3 1 571 146 146 GLN CA C 53.619 0.3 1 572 146 146 GLN CB C 32.731 0.3 1 573 146 146 GLN N N 121.091 0.08 1 574 147 147 PHE H H 9.231 0.01 1 575 147 147 PHE C C 175.703 0.3 1 576 147 147 PHE CA C 56.555 0.3 1 577 147 147 PHE CB C 43.157 0.3 1 578 147 147 PHE N N 123.398 0.08 1 579 148 148 SER H H 9.119 0.01 1 580 148 148 SER C C 175.63 0.3 1 581 148 148 SER CA C 56.898 0.3 1 582 148 148 SER CB C 64.291 0.3 1 583 148 148 SER N N 117.759 0.08 1 584 149 149 THR H H 8.44 0.01 1 585 149 149 THR C C 173.765 0.3 1 586 149 149 THR CA C 60.356 0.3 1 587 149 149 THR CB C 71.694 0.3 1 588 149 149 THR N N 117.695 0.08 1 589 150 150 ASP H H 8.714 0.01 1 590 150 150 ASP N N 118.879 0.08 1 591 151 151 THR H H 7.527 0.01 1 592 151 151 THR N N 111.008 0.08 1 593 152 152 GLU H H 8.179 0.01 1 594 152 152 GLU N N 122.05 0.08 1 595 153 153 ASN H H 8.406 0.01 1 596 153 153 ASN N N 125.423 0.08 1 597 154 154 ASP H H 8.161 0.01 1 598 154 154 ASP N N 126 0.08 1 599 155 155 PHE H H 7.233 0.01 1 600 155 155 PHE C C 176.097 0.3 1 601 155 155 PHE CA C 58.723 0.3 1 602 155 155 PHE CB C 40.086 0.3 1 603 155 155 PHE N N 117.136 0.08 1 604 156 156 GLU H H 9.092 0.01 1 605 156 156 GLU C C 178.301 0.3 1 606 156 156 GLU CA C 54.59 0.3 1 607 156 156 GLU CB C 31.206 0.3 1 608 156 156 GLU N N 124.359 0.08 1 609 157 157 THR H H 8.615 0.01 1 610 157 157 THR C C 174.814 0.3 1 611 157 157 THR CA C 60.573 0.3 1 612 157 157 THR CB C 69.765 0.3 1 613 157 157 THR N N 114.303 0.08 1 614 158 158 HIS H H 9.582 0.01 1 615 158 158 HIS C C 173.931 0.3 1 616 158 158 HIS CA C 56.832 0.3 1 617 158 158 HIS CB C 26.438 0.3 1 618 158 158 HIS N N 115.509 0.08 1 619 159 159 GLN H H 7.889 0.01 1 620 159 159 GLN C C 176.795 0.3 1 621 159 159 GLN CA C 53.239 0.3 1 622 159 159 GLN CB C 29.069 0.3 1 623 159 159 GLN N N 113.139 0.08 1 624 160 160 ASN C C 175.446 0.3 1 625 160 160 ASN CA C 54.619 0.3 1 626 160 160 ASN CB C 36.121 0.3 1 627 161 161 THR H H 9.546 0.01 1 628 161 161 THR C C 170.899 0.3 1 629 161 161 THR CA C 61.332 0.3 1 630 161 161 THR CB C 70.898 0.3 1 631 161 161 THR N N 125.163 0.08 1 632 162 162 LYS H H 9.392 0.01 1 633 162 162 LYS C C 174.57 0.3 1 634 162 162 LYS CA C 53.939 0.3 1 635 162 162 LYS CB C 36.674 0.3 1 636 162 162 LYS N N 127.775 0.08 1 637 163 163 PHE H H 9.467 0.01 1 638 163 163 PHE C C 173.976 0.3 1 639 163 163 PHE CA C 55.821 0.3 1 640 163 163 PHE CB C 41.602 0.3 1 641 163 163 PHE N N 127.444 0.08 1 642 164 164 THR H H 7.836 0.01 1 643 164 164 THR C C 171.471 0.3 1 644 164 164 THR CA C 58.425 0.3 1 645 164 164 THR CB C 69.46 0.3 1 646 164 164 THR N N 125.496 0.08 1 647 166 166 VAL C C 175.047 0.3 1 648 167 167 GLY H H 8.031 0.01 1 649 167 167 GLY C C 172.067 0.3 1 650 167 167 GLY CA C 46.222 0.3 1 651 167 167 GLY N N 103.668 0.08 1 652 168 168 VAL H H 8.863 0.01 1 653 168 168 VAL C C 175.813 0.3 1 654 168 168 VAL CA C 58.213 0.3 1 655 168 168 VAL CB C 35.563 0.3 1 656 168 168 VAL N N 112.469 0.08 1 657 169 169 ILE H H 7.869 0.01 1 658 169 169 ILE C C 173.082 0.3 1 659 169 169 ILE CA C 58.263 0.3 1 660 169 169 ILE CB C 41.5 0.3 1 661 169 169 ILE N N 113.892 0.08 1 662 170 170 GLN H H 7.539 0.01 1 663 170 170 GLN C C 173.354 0.3 1 664 170 170 GLN CA C 53.786 0.3 1 665 170 170 GLN CB C 29.292 0.3 1 666 170 170 GLN N N 122.461 0.08 1 667 171 171 ASP H H 7.968 0.01 1 668 171 171 ASP C C 175.093 0.3 1 669 171 171 ASP CA C 53.071 0.3 1 670 171 171 ASP CB C 41.137 0.3 1 671 171 171 ASP N N 123.348 0.08 1 672 172 172 GLY H H 8.287 0.01 1 673 172 172 GLY C C 174.697 0.3 1 674 172 172 GLY CA C 45.761 0.3 1 675 172 172 GLY N N 109.082 0.08 1 676 175 175 THR C C 173.784 0.3 1 677 176 176 HIS H H 8.195 0.01 1 678 176 176 HIS C C 175.698 0.3 1 679 176 176 HIS CA C 55.316 0.3 1 680 176 176 HIS CB C 29.676 0.3 1 681 176 176 HIS N N 123.173 0.08 1 682 177 177 ARG H H 8.935 0.01 1 683 177 177 ARG C C 175.023 0.3 1 684 177 177 ARG CA C 58.151 0.3 1 685 177 177 ARG CB C 26.117 0.3 1 686 177 177 ARG N N 114.63 0.08 1 687 178 178 ASN H H 8.466 0.01 1 688 178 178 ASN C C 173.748 0.3 1 689 178 178 ASN CA C 53.655 0.3 1 690 178 178 ASN CB C 37.616 0.3 1 691 178 178 ASN N N 116.776 0.08 1 692 179 179 GLU H H 7.459 0.01 1 693 179 179 GLU CA C 53.289 0.3 1 694 179 179 GLU CB C 29.506 0.3 1 695 179 179 GLU N N 115.632 0.08 1 696 180 180 PRO C C 174.941 0.3 1 697 180 180 PRO CA C 62.146 0.3 1 698 180 180 PRO CB C 35.359 0.3 1 699 181 181 GLN H H 8.616 0.01 1 700 181 181 GLN C C 176.118 0.3 1 701 181 181 GLN CA C 54.216 0.3 1 702 181 181 GLN CB C 28.531 0.3 1 703 181 181 GLN N N 122.914 0.08 1 704 182 182 GLN H H 8.764 0.01 1 705 182 182 GLN C C 175.943 0.3 1 706 182 182 GLN CA C 57.843 0.3 1 707 182 182 GLN CB C 25.26 0.3 1 708 182 182 GLN N N 120.903 0.08 1 709 183 183 TRP H H 8.563 0.01 1 710 183 183 TRP C C 175.658 0.3 1 711 183 183 TRP CA C 54.133 0.3 1 712 183 183 TRP CB C 28.612 0.3 1 713 183 183 TRP N N 121.616 0.08 1 714 184 184 VAL H H 7.455 0.01 1 715 184 184 VAL C C 174.542 0.3 1 716 184 184 VAL CA C 61.096 0.3 1 717 184 184 VAL CB C 31.749 0.3 1 718 184 184 VAL N N 125.08 0.08 1 719 185 185 LEU H H 8.045 0.01 1 720 185 185 LEU C C 176.625 0.3 1 721 185 185 LEU CA C 52.448 0.3 1 722 185 185 LEU CB C 41.337 0.3 1 723 185 185 LEU N N 126.682 0.08 1 724 186 186 PRO C C 173.497 0.3 1 725 186 186 PRO CA C 61.085 0.3 1 726 186 186 PRO CB C 31.325 0.3 1 727 187 187 SER H H 8.8 0.01 1 728 187 187 SER C C 176.345 0.3 1 729 187 187 SER CA C 56.002 0.3 1 730 187 187 SER CB C 61.824 0.3 1 731 187 187 SER N N 116.674 0.08 1 732 188 188 TYR H H 8.441 0.01 1 733 188 188 TYR C C 177.5 0.3 1 734 188 188 TYR CA C 61.29 0.3 1 735 188 188 TYR CB C 38.122 0.3 1 736 188 188 TYR N N 123.963 0.08 1 737 189 189 SER H H 9.688 0.01 1 738 189 189 SER C C 172.667 0.3 1 739 189 189 SER CA C 56.95 0.3 1 740 189 189 SER CB C 62.633 0.3 1 741 189 189 SER N N 115.112 0.08 1 742 190 190 GLY H H 7.761 0.01 1 743 190 190 GLY C C 173.963 0.3 1 744 190 190 GLY CA C 43.515 0.3 1 745 190 190 GLY N N 109.081 0.08 1 746 191 191 ARG H H 8.37 0.01 1 747 191 191 ARG C C 177.562 0.3 1 748 191 191 ARG CA C 56.818 0.3 1 749 191 191 ARG CB C 29.022 0.3 1 750 191 191 ARG N N 117.237 0.08 1 751 192 192 ASN H H 8.675 0.01 1 752 192 192 ASN C C 173.86 0.3 1 753 192 192 ASN CA C 53.589 0.3 1 754 192 192 ASN CB C 37.247 0.3 1 755 192 192 ASN N N 115.243 0.08 1 756 193 193 VAL H H 7.254 0.01 1 757 193 193 VAL C C 176.38 0.3 1 758 193 193 VAL CA C 60.863 0.3 1 759 193 193 VAL CB C 32.842 0.3 1 760 193 193 VAL N N 121.056 0.08 1 761 194 194 HIS H H 8.461 0.01 1 762 194 194 HIS C C 176.44 0.3 1 763 194 194 HIS CA C 55.949 0.3 1 764 194 194 HIS CB C 30.023 0.3 1 765 194 194 HIS N N 128.126 0.08 1 766 195 195 ASN H H 8.821 0.01 1 767 195 195 ASN C C 175.508 0.3 1 768 195 195 ASN CA C 52.471 0.3 1 769 195 195 ASN CB C 39.151 0.3 1 770 195 195 ASN N N 121.518 0.08 1 771 196 196 VAL H H 8.811 0.01 1 772 196 196 VAL C C 173.712 0.3 1 773 196 196 VAL CA C 59.095 0.3 1 774 196 196 VAL CB C 34.543 0.3 1 775 196 196 VAL N N 116.099 0.08 1 776 197 197 HIS H H 8 0.01 1 777 197 197 HIS C C 174.883 0.3 1 778 197 197 HIS CA C 55.773 0.3 1 779 197 197 HIS CB C 26.107 0.3 1 780 197 197 HIS N N 111.328 0.08 1 781 198 198 LEU H H 7.76 0.01 1 782 198 198 LEU C C 180.233 0.3 1 783 198 198 LEU CA C 54.45 0.3 1 784 198 198 LEU CB C 41.17 0.3 1 785 198 198 LEU N N 115.989 0.08 1 786 199 199 ALA H H 10.719 0.01 1 787 199 199 ALA C C 177.049 0.3 1 788 199 199 ALA CA C 50.056 0.3 1 789 199 199 ALA CB C 15.308 0.3 1 790 199 199 ALA N N 129.629 0.08 1 791 200 200 PRO C C 177.039 0.3 1 792 200 200 PRO CA C 62.52 0.3 1 793 200 200 PRO CB C 31.887 0.3 1 794 201 201 ALA H H 8.665 0.01 1 795 201 201 ALA C C 177.703 0.3 1 796 201 201 ALA CA C 51.445 0.3 1 797 201 201 ALA CB C 18.27 0.3 1 798 201 201 ALA N N 125.754 0.08 1 799 202 202 VAL H H 8.56 0.01 1 800 202 202 VAL C C 174.399 0.3 1 801 202 202 VAL CA C 59.165 0.3 1 802 202 202 VAL CB C 32.937 0.3 1 803 202 202 VAL N N 116.981 0.08 1 804 203 203 ALA H H 7.665 0.01 1 805 203 203 ALA C C 173.672 0.3 1 806 203 203 ALA CA C 49.56 0.3 1 807 203 203 ALA CB C 19.429 0.3 1 808 203 203 ALA N N 124.152 0.08 1 809 207 207 PRO C C 176.959 0.3 1 810 207 207 PRO CA C 63.558 0.3 1 811 207 207 PRO CB C 30.635 0.3 1 812 208 208 GLY H H 8.538 0.01 1 813 208 208 GLY C C 174.387 0.3 1 814 208 208 GLY CA C 44.558 0.3 1 815 208 208 GLY N N 111.541 0.08 1 816 209 209 GLU H H 7.521 0.01 1 817 209 209 GLU C C 176.654 0.3 1 818 209 209 GLU CA C 54.549 0.3 1 819 209 209 GLU CB C 31.379 0.3 1 820 209 209 GLU N N 117.21 0.08 1 821 210 210 GLN H H 9.22 0.01 1 822 210 210 GLN C C 175.777 0.3 1 823 210 210 GLN CA C 53.18 0.3 1 824 210 210 GLN CB C 33.545 0.3 1 825 210 210 GLN N N 118.142 0.08 1 826 211 211 LEU H H 9.099 0.01 1 827 211 211 LEU C C 175.802 0.3 1 828 211 211 LEU CA C 55.372 0.3 1 829 211 211 LEU CB C 41.088 0.3 1 830 211 211 LEU N N 120.392 0.08 1 831 212 212 LEU H H 8.28 0.01 1 832 212 212 LEU C C 172.364 0.3 1 833 212 212 LEU CA C 52.71 0.3 1 834 212 212 LEU CB C 42.649 0.3 1 835 212 212 LEU N N 126.076 0.08 1 836 213 213 PHE H H 9.241 0.01 1 837 213 213 PHE C C 174.36 0.3 1 838 213 213 PHE CA C 55.306 0.3 1 839 213 213 PHE CB C 40.97 0.3 1 840 213 213 PHE N N 122.134 0.08 1 841 214 214 PHE H H 8.58 0.01 1 842 214 214 PHE C C 174.516 0.3 1 843 214 214 PHE CA C 56.689 0.3 1 844 214 214 PHE CB C 37.577 0.3 1 845 214 214 PHE N N 121.942 0.08 1 846 215 215 ARG H H 9.187 0.01 1 847 215 215 ARG C C 176.005 0.3 1 848 215 215 ARG CA C 55.977 0.3 1 849 215 215 ARG CB C 33.278 0.3 1 850 215 215 ARG N N 129.131 0.08 1 851 216 216 SER H H 8.719 0.01 1 852 216 216 SER C C 169.482 0.3 1 853 216 216 SER CA C 57.302 0.3 1 854 216 216 SER CB C 66.263 0.3 1 855 216 216 SER N N 122.093 0.08 1 856 217 217 THR H H 8.546 0.01 1 857 217 217 THR C C 174.782 0.3 1 858 217 217 THR CA C 60.29 0.3 1 859 217 217 THR CB C 67.28 0.3 1 860 217 217 THR N N 120.267 0.08 1 861 218 218 MET H H 9.543 0.01 1 862 218 218 MET C C 172.922 0.3 1 863 218 218 MET CA C 54.452 0.3 1 864 218 218 MET CB C 32.74 0.3 1 865 218 218 MET N N 128.743 0.08 1 866 221 221 CYS C C 173.956 0.3 1 867 221 221 CYS CA C 56.733 0.3 1 868 221 221 CYS CB C 28.792 0.3 1 869 222 222 SER H H 7.111 0.01 1 870 222 222 SER C C 174.537 0.3 1 871 222 222 SER CA C 61.163 0.3 1 872 222 222 SER CB C 63.154 0.3 1 873 222 222 SER N N 116.723 0.08 1 874 223 223 GLY H H 7.769 0.01 1 875 223 223 GLY C C 174.133 0.3 1 876 223 223 GLY CA C 44.553 0.3 1 877 223 223 GLY N N 112.019 0.08 1 878 224 224 TYR H H 9.004 0.01 1 879 224 224 TYR C C 172.25 0.3 1 880 224 224 TYR CA C 53.976 0.3 1 881 224 224 TYR CB C 37.012 0.3 1 882 224 224 TYR N N 121.413 0.08 1 883 225 225 PRO C C 176.4 0.3 1 884 225 225 PRO CA C 61.942 0.3 1 885 226 226 ASN H H 8.301 0.01 1 886 226 226 ASN C C 175.797 0.3 1 887 226 226 ASN CA C 52.053 0.3 1 888 226 226 ASN CB C 36.206 0.3 1 889 226 226 ASN N N 118.891 0.08 1 890 227 227 MET H H 8.25 0.01 1 891 227 227 MET C C 175.201 0.3 1 892 227 227 MET CA C 55.954 0.3 1 893 227 227 MET CB C 32.84 0.3 1 894 227 227 MET N N 125.848 0.08 1 895 228 228 ASP H H 7.199 0.01 1 896 228 228 ASP C C 174.762 0.3 1 897 228 228 ASP CA C 55.787 0.3 1 898 228 228 ASP CB C 39.662 0.3 1 899 228 228 ASP N N 121.546 0.08 1 900 229 229 LEU H H 8.078 0.01 1 901 229 229 LEU C C 174.355 0.3 1 902 229 229 LEU CA C 53.292 0.3 1 903 229 229 LEU CB C 43.328 0.3 1 904 229 229 LEU N N 122.114 0.08 1 905 230 230 ASP H H 9.392 0.01 1 906 230 230 ASP C C 175.192 0.3 1 907 230 230 ASP CA C 53.824 0.3 1 908 230 230 ASP CB C 44.462 0.3 1 909 230 230 ASP N N 131.659 0.08 1 910 231 231 CYS H H 9.736 0.01 1 911 231 231 CYS C C 173.609 0.3 1 912 231 231 CYS CA C 54.316 0.3 1 913 231 231 CYS CB C 32.91 0.3 1 914 231 231 CYS N N 117.403 0.08 1 915 232 232 LEU H H 8.879 0.01 1 916 232 232 LEU C C 176.996 0.3 1 917 232 232 LEU CA C 55.304 0.3 1 918 232 232 LEU CB C 41.331 0.3 1 919 232 232 LEU N N 118.124 0.08 1 920 233 233 LEU H H 6.47 0.01 1 921 233 233 LEU C C 173.175 0.3 1 922 233 233 LEU CA C 50.285 0.3 1 923 233 233 LEU CB C 46.474 0.3 1 924 233 233 LEU N N 110.733 0.08 1 925 234 234 PRO C C 177.866 0.3 1 926 234 234 PRO CA C 60.814 0.3 1 927 234 234 PRO CB C 33.001 0.3 1 928 235 235 GLN H H 9.066 0.01 1 929 235 235 GLN C C 178.302 0.3 1 930 235 235 GLN CA C 57.699 0.3 1 931 235 235 GLN CB C 24.956 0.3 1 932 235 235 GLN N N 126.693 0.08 1 933 236 236 GLU H H 10.001 0.01 1 934 236 236 GLU C C 180.841 0.3 1 935 236 236 GLU CA C 60.563 0.3 1 936 236 236 GLU CB C 26.99 0.3 1 937 236 236 GLU N N 118.769 0.08 1 938 237 237 TRP H H 7.479 0.01 1 939 237 237 TRP C C 175.26 0.3 1 940 237 237 TRP CA C 59.761 0.3 1 941 237 237 TRP CB C 26.623 0.3 1 942 237 237 TRP N N 120.059 0.08 1 943 238 238 VAL H H 6.914 0.01 1 944 238 238 VAL C C 177.266 0.3 1 945 238 238 VAL CA C 65.832 0.3 1 946 238 238 VAL CB C 29.889 0.3 1 947 238 238 VAL N N 120.146 0.08 1 948 239 239 GLN H H 7.965 0.01 1 949 239 239 GLN C C 178.714 0.3 1 950 239 239 GLN CA C 58.795 0.3 1 951 239 239 GLN CB C 28.779 0.3 1 952 239 239 GLN N N 112.969 0.08 1 953 240 240 HIS H H 7.64 0.01 1 954 240 240 HIS C C 176.575 0.3 1 955 240 240 HIS CA C 59.305 0.3 1 956 240 240 HIS CB C 30.754 0.3 1 957 240 240 HIS N N 120.117 0.08 1 958 241 241 PHE H H 8.817 0.01 1 959 241 241 PHE C C 179.268 0.3 1 960 241 241 PHE CA C 56.144 0.3 1 961 241 241 PHE CB C 35.933 0.3 1 962 241 241 PHE N N 119.183 0.08 1 963 242 242 TYR H H 8.222 0.01 1 964 242 242 TYR C C 176.755 0.3 1 965 242 242 TYR CA C 60.909 0.3 1 966 242 242 TYR CB C 38.55 0.3 1 967 242 242 TYR N N 117.898 0.08 1 968 243 243 GLN H H 7.251 0.01 1 969 243 243 GLN C C 177.573 0.3 1 970 243 243 GLN CA C 58.174 0.3 1 971 243 243 GLN CB C 31.203 0.3 1 972 243 243 GLN N N 114.716 0.08 1 973 244 244 GLU H H 8.312 0.01 1 974 244 244 GLU C C 176.284 0.3 1 975 244 244 GLU CA C 57.711 0.3 1 976 244 244 GLU CB C 29.474 0.3 1 977 244 244 GLU N N 119.066 0.08 1 978 245 245 ALA H H 8.255 0.01 1 979 245 245 ALA C C 176.981 0.3 1 980 245 245 ALA CA C 51.303 0.3 1 981 245 245 ALA CB C 16.416 0.3 1 982 245 245 ALA N N 122.865 0.08 1 983 246 246 ALA H H 9.474 0.01 1 984 246 246 ALA C C 175.219 0.3 1 985 246 246 ALA CA C 49.618 0.3 1 986 246 246 ALA CB C 17.727 0.3 1 987 246 246 ALA N N 126.485 0.08 1 988 247 247 PRO C C 176.777 0.3 1 989 247 247 PRO CA C 61.819 0.3 1 990 247 247 PRO CB C 30.89 0.3 1 991 248 248 ALA H H 8.561 0.01 1 992 248 248 ALA C C 178.131 0.3 1 993 248 248 ALA CA C 50.136 0.3 1 994 248 248 ALA CB C 17.162 0.3 1 995 248 248 ALA N N 126.782 0.08 1 996 249 249 GLN H H 3.556 0.01 1 997 249 249 GLN C C 174.893 0.3 1 998 249 249 GLN CA C 54.895 0.3 1 999 249 249 GLN CB C 26.419 0.3 1 1000 249 249 GLN N N 119.463 0.08 1 1001 250 250 SER H H 6.578 0.01 1 1002 250 250 SER C C 172.19 0.3 1 1003 250 250 SER CA C 55.949 0.3 1 1004 250 250 SER CB C 63.29 0.3 1 1005 250 250 SER N N 114.462 0.08 1 1006 251 251 ASP H H 8.25 0.01 1 1007 251 251 ASP C C 176.57 0.3 1 1008 251 251 ASP CA C 55.598 0.3 1 1009 251 251 ASP CB C 41.054 0.3 1 1010 251 251 ASP N N 114.298 0.08 1 1011 252 252 VAL H H 8.195 0.01 1 1012 252 252 VAL C C 171.869 0.3 1 1013 252 252 VAL CA C 61.046 0.3 1 1014 252 252 VAL CB C 34.475 0.3 1 1015 252 252 VAL N N 119.183 0.08 1 1016 253 253 ALA H H 9.041 0.01 1 1017 253 253 ALA C C 175 0.3 1 1018 253 253 ALA CA C 49.443 0.3 1 1019 253 253 ALA CB C 18.313 0.3 1 1020 253 253 ALA N N 131.087 0.08 1 1021 254 254 LEU H H 9.025 0.01 1 1022 254 254 LEU C C 175.144 0.3 1 1023 254 254 LEU CA C 54.003 0.3 1 1024 254 254 LEU CB C 42.237 0.3 1 1025 254 254 LEU N N 126.447 0.08 1 1026 255 255 LEU H H 8.92 0.01 1 1027 255 255 LEU C C 175.626 0.3 1 1028 255 255 LEU CA C 51.582 0.3 1 1029 255 255 LEU CB C 42.84 0.3 1 1030 255 255 LEU N N 126.323 0.08 1 1031 256 256 ARG H H 9 0.01 1 1032 256 256 ARG C C 173.643 0.3 1 1033 256 256 ARG CA C 54.444 0.3 1 1034 256 256 ARG CB C 31.987 0.3 1 1035 256 256 ARG N N 122.404 0.08 1 1036 257 257 PHE H H 8.412 0.01 1 1037 257 257 PHE C C 174.451 0.3 1 1038 257 257 PHE CA C 56.064 0.3 1 1039 257 257 PHE CB C 38.664 0.3 1 1040 257 257 PHE N N 126.164 0.08 1 1041 258 258 VAL H H 8.101 0.01 1 1042 258 258 VAL C C 173.618 0.3 1 1043 258 258 VAL CA C 59.295 0.3 1 1044 258 258 VAL CB C 34.185 0.3 1 1045 258 258 VAL N N 127.244 0.08 1 1046 259 259 ASN H H 7.853 0.01 1 1047 259 259 ASN C C 174.792 0.3 1 1048 259 259 ASN CA C 48.412 0.3 1 1049 259 259 ASN CB C 38.684 0.3 1 1050 259 259 ASN N N 120.07 0.08 1 1051 260 260 PRO C C 177.566 0.3 1 1052 260 260 PRO CA C 63.516 0.3 1 1053 260 260 PRO CB C 31.22 0.3 1 1054 261 261 ASP H H 8.014 0.01 1 1055 261 261 ASP C C 177.562 0.3 1 1056 261 261 ASP CA C 56.336 0.3 1 1057 261 261 ASP CB C 40.074 0.3 1 1058 261 261 ASP N N 119.835 0.08 1 1059 262 262 THR H H 6.878 0.01 1 1060 262 262 THR C C 176.305 0.3 1 1061 262 262 THR CA C 60.143 0.3 1 1062 262 262 THR CB C 70.341 0.3 1 1063 262 262 THR N N 105.321 0.08 1 1064 263 263 GLY H H 8.509 0.01 1 1065 263 263 GLY C C 173.724 0.3 1 1066 263 263 GLY CA C 44.946 0.3 1 1067 263 263 GLY N N 112.997 0.08 1 1068 264 264 ARG H H 7.487 0.01 1 1069 264 264 ARG C C 175.473 0.3 1 1070 264 264 ARG CA C 55.352 0.3 1 1071 264 264 ARG CB C 30.544 0.3 1 1072 264 264 ARG N N 120.177 0.08 1 1073 265 265 VAL H H 8.405 0.01 1 1074 265 265 VAL C C 176.778 0.3 1 1075 265 265 VAL CA C 62.026 0.3 1 1076 265 265 VAL CB C 31.135 0.3 1 1077 265 265 VAL N N 124.256 0.08 1 1078 266 266 LEU H H 9.452 0.01 1 1079 266 266 LEU C C 177.473 0.3 1 1080 266 266 LEU CA C 56.02 0.3 1 1081 266 266 LEU CB C 41.418 0.3 1 1082 266 266 LEU N N 131.484 0.08 1 1083 267 267 PHE H H 7.245 0.01 1 1084 267 267 PHE C C 171.316 0.3 1 1085 267 267 PHE CA C 56.102 0.3 1 1086 267 267 PHE CB C 39.125 0.3 1 1087 267 267 PHE N N 111.763 0.08 1 1088 268 268 GLU H H 9.009 0.01 1 1089 268 268 GLU C C 173.923 0.3 1 1090 268 268 GLU CA C 52.458 0.3 1 1091 268 268 GLU CB C 32.67 0.3 1 1092 268 268 GLU N N 117.46 0.08 1 1093 269 269 CYS H H 9.37 0.01 1 1094 269 269 CYS C C 171.166 0.3 1 1095 269 269 CYS CA C 55.539 0.3 1 1096 269 269 CYS CB C 31.445 0.3 1 1097 269 269 CYS N N 115.002 0.08 1 1098 270 270 LYS H H 8.792 0.01 1 1099 270 270 LYS C C 174.31 0.3 1 1100 270 270 LYS CA C 54.668 0.3 1 1101 270 270 LYS CB C 34.332 0.3 1 1102 270 270 LYS N N 120.725 0.08 1 1103 271 271 LEU H H 9.337 0.01 1 1104 271 271 LEU C C 174.271 0.3 1 1105 271 271 LEU CA C 52.694 0.3 1 1106 271 271 LEU CB C 41.086 0.3 1 1107 271 271 LEU N N 125.456 0.08 1 1108 272 272 HIS H H 9.031 0.01 1 1109 272 272 HIS C C 178.207 0.3 1 1110 272 272 HIS CA C 56.882 0.3 1 1111 272 272 HIS CB C 29.838 0.3 1 1112 272 272 HIS N N 129.75 0.08 1 1113 273 273 LYS H H 8.333 0.01 1 1114 273 273 LYS C C 176.786 0.3 1 1115 273 273 LYS CA C 58.17 0.3 1 1116 273 273 LYS CB C 31.238 0.3 1 1117 273 273 LYS N N 125.162 0.08 1 1118 277 277 VAL C C 176.808 0.3 1 1119 277 277 VAL CA C 59.934 0.3 1 1120 277 277 VAL CB C 32.906 0.3 1 1121 278 278 THR H H 9.313 0.01 1 1122 278 278 THR C C 173.722 0.3 1 1123 278 278 THR CA C 58.872 0.3 1 1124 278 278 THR CB C 72.558 0.3 1 1125 278 278 THR N N 114.146 0.08 1 1126 279 279 VAL H H 8.969 0.01 1 1127 279 279 VAL C C 173.782 0.3 1 1128 279 279 VAL CA C 58.744 0.3 1 1129 279 279 VAL CB C 35.901 0.3 1 1130 279 279 VAL N N 112.528 0.08 1 1131 280 280 ALA H H 9.113 0.01 1 1132 280 280 ALA C C 174.463 0.3 1 1133 280 280 ALA CA C 50.666 0.3 1 1134 280 280 ALA CB C 17.25 0.3 1 1135 280 280 ALA N N 127.235 0.08 1 1136 281 281 HIS H H 7.508 0.01 1 1137 281 281 HIS C C 172.122 0.3 1 1138 281 281 HIS CA C 55.372 0.3 1 1139 281 281 HIS CB C 31.896 0.3 1 1140 281 281 HIS N N 122.487 0.08 1 1141 282 282 THR H H 7.478 0.01 1 1142 282 282 THR C C 173.592 0.3 1 1143 282 282 THR CA C 60.548 0.3 1 1144 282 282 THR CB C 69.852 0.3 1 1145 282 282 THR N N 119.507 0.08 1 1146 283 283 GLY H H 8.904 0.01 1 1147 283 283 GLY C C 174.139 0.3 1 1148 283 283 GLY CA C 42.553 0.3 1 1149 283 283 GLY N N 114.587 0.08 1 1150 284 284 GLN H H 8.588 0.01 1 1151 284 284 GLN C C 176.433 0.3 1 1152 284 284 GLN CA C 55.479 0.3 1 1153 284 284 GLN CB C 28.624 0.3 1 1154 284 284 GLN N N 121.624 0.08 1 1155 285 285 HIS H H 8.746 0.01 1 1156 285 285 HIS C C 172.477 0.3 1 1157 285 285 HIS CA C 55.918 0.3 1 1158 285 285 HIS CB C 32.426 0.3 1 1159 285 285 HIS N N 126.026 0.08 1 1160 286 286 ASP H H 7.975 0.01 1 1161 286 286 ASP C C 175.124 0.3 1 1162 286 286 ASP CA C 52.893 0.3 1 1163 286 286 ASP CB C 40.215 0.3 1 1164 286 286 ASP N N 127.411 0.08 1 1165 287 287 LEU H H 7.922 0.01 1 1166 287 287 LEU C C 176.946 0.3 1 1167 287 287 LEU CA C 56.732 0.3 1 1168 287 287 LEU CB C 40.166 0.3 1 1169 287 287 LEU N N 124.819 0.08 1 1170 288 288 VAL H H 8.454 0.01 1 1171 288 288 VAL C C 175.981 0.3 1 1172 288 288 VAL CA C 61.949 0.3 1 1173 288 288 VAL CB C 30.253 0.3 1 1174 288 288 VAL N N 126.32 0.08 1 1175 289 289 ILE H H 8.176 0.01 1 1176 289 289 ILE CA C 56.856 0.3 1 1177 289 289 ILE CB C 38.754 0.3 1 1178 289 289 ILE N N 121.794 0.08 1 1179 291 291 PRO C C 176.931 0.3 1 1180 291 291 PRO CA C 63.991 0.3 1 1181 291 291 PRO CB C 30.821 0.3 1 1182 292 292 ASN H H 8.192 0.01 1 1183 292 292 ASN C C 175.607 0.3 1 1184 292 292 ASN CA C 51.697 0.3 1 1185 292 292 ASN CB C 36.484 0.3 1 1186 292 292 ASN N N 112.722 0.08 1 1187 293 293 GLY H H 7.663 0.01 1 1188 293 293 GLY C C 171.243 0.3 1 1189 293 293 GLY CA C 45.403 0.3 1 1190 293 293 GLY N N 106.873 0.08 1 1191 294 294 TYR H H 6.972 0.01 1 1192 294 294 TYR C C 172.543 0.3 1 1193 294 294 TYR CA C 55.283 0.3 1 1194 294 294 TYR CB C 39.844 0.3 1 1195 294 294 TYR N N 115.426 0.08 1 1196 295 295 PHE H H 8.667 0.01 1 1197 295 295 PHE C C 174.57 0.3 1 1198 295 295 PHE CA C 57.72 0.3 1 1199 295 295 PHE CB C 41.526 0.3 1 1200 295 295 PHE N N 117.061 0.08 1 1201 296 296 ARG H H 9.087 0.01 1 1202 296 296 ARG C C 175.222 0.3 1 1203 296 296 ARG CA C 54.301 0.3 1 1204 296 296 ARG CB C 33.708 0.3 1 1205 296 296 ARG N N 120.215 0.08 1 1206 297 297 PHE H H 8.789 0.01 1 1207 297 297 PHE C C 173.493 0.3 1 1208 297 297 PHE CA C 58.114 0.3 1 1209 297 297 PHE CB C 38.085 0.3 1 1210 297 297 PHE N N 126.023 0.08 1 1211 298 298 ASP H H 8.135 0.01 1 1212 298 298 ASP C C 174.754 0.3 1 1213 298 298 ASP CA C 54.673 0.3 1 1214 298 298 ASP CB C 43.187 0.3 1 1215 298 298 ASP N N 129.283 0.08 1 1216 299 299 SER H H 6.209 0.01 1 1217 299 299 SER C C 172.386 0.3 1 1218 299 299 SER CA C 57.401 0.3 1 1219 299 299 SER CB C 63.892 0.3 1 1220 299 299 SER N N 109.367 0.08 1 1221 300 300 TRP H H 8.678 0.01 1 1222 300 300 TRP C C 177.136 0.3 1 1223 300 300 TRP CA C 56.964 0.3 1 1224 300 300 TRP CB C 28.101 0.3 1 1225 300 300 TRP N N 124.772 0.08 1 1226 301 301 VAL H H 8.866 0.01 1 1227 301 301 VAL C C 174.914 0.3 1 1228 301 301 VAL CA C 58.535 0.3 1 1229 301 301 VAL CB C 33.506 0.3 1 1230 301 301 VAL N N 118.198 0.08 1 1231 302 302 ASN H H 7.877 0.01 1 1232 302 302 ASN C C 175.635 0.3 1 1233 302 302 ASN CA C 51.521 0.3 1 1234 302 302 ASN CB C 39.17 0.3 1 1235 302 302 ASN N N 117.586 0.08 1 1236 303 303 GLN H H 8.84 0.01 1 1237 303 303 GLN C C 175.838 0.3 1 1238 303 303 GLN CA C 57.405 0.3 1 1239 303 303 GLN CB C 27.424 0.3 1 1240 303 303 GLN N N 115.98 0.08 1 1241 304 304 PHE H H 7.78 0.01 1 1242 304 304 PHE C C 174.582 0.3 1 1243 304 304 PHE CA C 55.932 0.3 1 1244 304 304 PHE CB C 37.316 0.3 1 1245 304 304 PHE N N 117.925 0.08 1 1246 305 305 TYR H H 7.133 0.01 1 1247 305 305 TYR C C 174.63 0.3 1 1248 305 305 TYR CA C 59.241 0.3 1 1249 305 305 TYR CB C 38.519 0.3 1 1250 305 305 TYR N N 122.859 0.08 1 1251 306 306 THR H H 7.425 0.01 1 1252 306 306 THR C C 173.468 0.3 1 1253 306 306 THR CA C 60.67 0.3 1 1254 306 306 THR CB C 68.777 0.3 1 1255 306 306 THR N N 125.035 0.08 1 1256 307 307 LEU H H 9.328 0.01 1 1257 307 307 LEU C C 177.335 0.3 1 1258 307 307 LEU CA C 53.407 0.3 1 1259 307 307 LEU CB C 42.634 0.3 1 1260 307 307 LEU N N 129.19 0.08 1 1261 308 308 ALA H H 9.033 0.01 1 1262 308 308 ALA C C 176.29 0.3 1 1263 308 308 ALA CA C 49.48 0.3 1 1264 308 308 ALA CB C 16.111 0.3 1 1265 308 308 ALA N N 126.628 0.08 1 stop_ save_