data_16044 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; N-terminal backbone assignment of the polyoma virus large T antigen ; _BMRB_accession_number 16044 _BMRB_flat_file_name bmr16044.str _Entry_type original _Submission_date 2008-11-27 _Accession_date 2008-11-27 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Knoblich Konstantin . . 2 Jiang Tao . . 3 Schaffhausen Brian . . 4 Gunther Ulrich . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 239 "13C chemical shifts" 406 "15N chemical shifts" 142 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-08-20 update BMRB 'added PubMed ID' 2009-06-05 update BMRB 'completed entry citation' 2009-04-16 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Backbone assignment of the N-terminal polyomavirus large T antigen' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19636961 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Knoblich Konstantin . . 2 Whittaker Sara . . 3 Ludwig Christian . . 4 Michiels Paul . . 5 Jiang Tao . . 6 Schaffhausen Brian . . 7 Gunther Ulrich . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular NMR Assignments' _Journal_volume 3 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 119 _Page_last 123 _Year 2009 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name PyLTNT _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label PyLTNT $PyLTNT stop_ _System_molecular_weight 28000 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_PyLTNT _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common PyLTNT _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 264 _Mol_residue_sequence ; MDRVLSRADKERLLELLKLP RQLWGDFGRMQQAYKQQSLL LHPDKGGSHALMQELNSLWG TFKTEVYNLRMNLGGTGFQG SPPRTAERGTEESGHSPLHD DYWSFSYGSKYFTREWNDFF RKWDPSYQSPPKTAESSEQP DLFCYEEPLLSPNPSSPTDT PAHTAGRRRNPCVAEPDDSI SPDPPRTPVSRKRPRPAGAT GGGGGGVHANGGSVFGHPTG GTSTPAHPPPYHSQGGSESM GGSDSSGFAEGSFRSDGSHH HHHH ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ASP 3 ARG 4 VAL 5 LEU 6 SER 7 ARG 8 ALA 9 ASP 10 LYS 11 GLU 12 ARG 13 LEU 14 LEU 15 GLU 16 LEU 17 LEU 18 LYS 19 LEU 20 PRO 21 ARG 22 GLN 23 LEU 24 TRP 25 GLY 26 ASP 27 PHE 28 GLY 29 ARG 30 MET 31 GLN 32 GLN 33 ALA 34 TYR 35 LYS 36 GLN 37 GLN 38 SER 39 LEU 40 LEU 41 LEU 42 HIS 43 PRO 44 ASP 45 LYS 46 GLY 47 GLY 48 SER 49 HIS 50 ALA 51 LEU 52 MET 53 GLN 54 GLU 55 LEU 56 ASN 57 SER 58 LEU 59 TRP 60 GLY 61 THR 62 PHE 63 LYS 64 THR 65 GLU 66 VAL 67 TYR 68 ASN 69 LEU 70 ARG 71 MET 72 ASN 73 LEU 74 GLY 75 GLY 76 THR 77 GLY 78 PHE 79 GLN 80 GLY 81 SER 82 PRO 83 PRO 84 ARG 85 THR 86 ALA 87 GLU 88 ARG 89 GLY 90 THR 91 GLU 92 GLU 93 SER 94 GLY 95 HIS 96 SER 97 PRO 98 LEU 99 HIS 100 ASP 101 ASP 102 TYR 103 TRP 104 SER 105 PHE 106 SER 107 TYR 108 GLY 109 SER 110 LYS 111 TYR 112 PHE 113 THR 114 ARG 115 GLU 116 TRP 117 ASN 118 ASP 119 PHE 120 PHE 121 ARG 122 LYS 123 TRP 124 ASP 125 PRO 126 SER 127 TYR 128 GLN 129 SER 130 PRO 131 PRO 132 LYS 133 THR 134 ALA 135 GLU 136 SER 137 SER 138 GLU 139 GLN 140 PRO 141 ASP 142 LEU 143 PHE 144 CYS 145 TYR 146 GLU 147 GLU 148 PRO 149 LEU 150 LEU 151 SER 152 PRO 153 ASN 154 PRO 155 SER 156 SER 157 PRO 158 THR 159 ASP 160 THR 161 PRO 162 ALA 163 HIS 164 THR 165 ALA 166 GLY 167 ARG 168 ARG 169 ARG 170 ASN 171 PRO 172 CYS 173 VAL 174 ALA 175 GLU 176 PRO 177 ASP 178 ASP 179 SER 180 ILE 181 SER 182 PRO 183 ASP 184 PRO 185 PRO 186 ARG 187 THR 188 PRO 189 VAL 190 SER 191 ARG 192 LYS 193 ARG 194 PRO 195 ARG 196 PRO 197 ALA 198 GLY 199 ALA 200 THR 201 GLY 202 GLY 203 GLY 204 GLY 205 GLY 206 GLY 207 VAL 208 HIS 209 ALA 210 ASN 211 GLY 212 GLY 213 SER 214 VAL 215 PHE 216 GLY 217 HIS 218 PRO 219 THR 220 GLY 221 GLY 222 THR 223 SER 224 THR 225 PRO 226 ALA 227 HIS 228 PRO 229 PRO 230 PRO 231 TYR 232 HIS 233 SER 234 GLN 235 GLY 236 GLY 237 SER 238 GLU 239 SER 240 MET 241 GLY 242 GLY 243 SER 244 ASP 245 SER 246 SER 247 GLY 248 PHE 249 ALA 250 GLU 251 GLY 252 SER 253 PHE 254 ARG 255 SER 256 ASP 257 GLY 258 SER 259 HIS 260 HIS 261 HIS 262 HIS 263 HIS 264 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-09-30 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 EMBL CAA42510 "large T antigen [Mus musculus]" 96.97 782 99.22 99.22 0.00e+00 GB AAA46872 "large t-antigen [Murine polyomavirus strain A3]" 96.97 782 100.00 100.00 0.00e+00 GB AAA93241 "large t antigen [Murine polyomavirus]" 96.97 782 100.00 100.00 0.00e+00 GB AAA93245 "large t antigen [Murine polyomavirus]" 96.97 782 100.00 100.00 0.00e+00 GB AAB59901 "large t-antigen [Murine polyomavirus strain A2]" 96.97 785 100.00 100.00 0.00e+00 GB AAL35609 "large T antigen [Murine polyomavirus strain BG]" 96.97 782 100.00 100.00 0.00e+00 REF YP_009111413 "large T antigen [Murine polyomavirus strain BG]" 96.97 782 100.00 100.00 0.00e+00 SP P03073 "RecName: Full=Large T antigen; Short=LT; Short=LT-AG" 96.97 785 100.00 100.00 0.00e+00 SP P03074 "RecName: Full=Large T antigen; Short=LT; Short=LT-AG" 96.97 782 100.00 100.00 0.00e+00 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $PyLTNT 'Murine polyomavirus' 10634 Viruses . Polyomavirus 'Murine polyomavirus' 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 $PyLTNT 'recombinant technology' . Escherichia coli . pET-30b 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 $PyLTNT 700 uM '[U-99% 15N]' KCl 150 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PyLTNT 700 uM '[U-99% 13C; U-99% 15N]' KCl 150 mM 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PyLTNT 400 uM '[U-99% 13C; U-99% 15N]' KCl 150 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_Analysis _Saveframe_category software _Name Analysis _Version . loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 900 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _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_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2 save_ save_3D_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_2 save_ save_3D_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_2 save_ save_3D_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_2 save_ save_3D_HNN_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNN' _Sample_label $sample_2 save_ save_3D_HNCN_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCN' _Sample_label $sample_2 save_ save_3D_CBCACON_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCACON' _Sample_label $sample_3 save_ save_3D_CBCANCO_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCANCO' _Sample_label $sample_3 save_ save_2D_CON_10 _Saveframe_category NMR_applied_experiment _Experiment_name '2D CON' _Sample_label $sample_3 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.15 . M pH 7 0.1 pH pressure 1 . atm temperature 298 . 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 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCO' '3D HNCA' '3D HNCACB' '3D HNN' '3D HNCN' '3D CBCACON' '3D CBCANCO' '2D CON' stop_ loop_ _Sample_label $sample_1 $sample_2 $sample_3 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name PyLTNT _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 6 6 SER H H 9.475 0.05 1 2 6 6 SER N N 121.190 0.4 1 3 7 7 ARG H H 8.827 0.05 1 4 7 7 ARG N N 121.691 0.4 1 5 17 17 LEU CA C 55.457 0.2 1 6 18 18 LYS H H 7.762 0.05 1 7 18 18 LYS C C 175.672 0.2 1 8 18 18 LYS CA C 58.786 0.2 1 9 18 18 LYS N N 114.286 0.4 1 10 19 19 LEU H H 7.549 0.05 1 11 19 19 LEU CA C 51.218 0.2 1 12 19 19 LEU N N 117.983 0.4 1 13 22 22 GLN H H 8.827 0.05 1 14 22 22 GLN N N 116.686 0.4 1 15 36 36 GLN CA C 58.486 0.2 1 16 37 37 GLN H H 8.974 0.05 1 17 37 37 GLN CA C 57.582 0.2 1 18 37 37 GLN N N 116.958 0.4 1 19 38 38 SER H H 8.196 0.05 1 20 38 38 SER C C 175.648 0.2 1 21 38 38 SER CA C 62.349 0.2 1 22 38 38 SER N N 114.343 0.4 1 23 39 39 LEU H H 6.704 0.05 1 24 39 39 LEU C C 178.844 0.2 1 25 39 39 LEU CA C 57.150 0.2 1 26 39 39 LEU N N 119.329 0.4 1 27 40 40 LEU H H 7.201 0.05 1 28 40 40 LEU CA C 56.551 0.2 1 29 40 40 LEU N N 117.362 0.4 1 30 41 41 LEU H H 7.931 0.05 1 31 41 41 LEU C C 175.658 0.2 1 32 41 41 LEU CA C 54.728 0.2 1 33 41 41 LEU N N 116.542 0.4 1 34 42 42 HIS H H 7.130 0.05 1 35 42 42 HIS CA C 56.600 0.2 1 36 42 42 HIS N N 120.569 0.4 1 37 43 43 PRO CA C 65.097 0.2 1 38 44 44 ASP H H 11.199 0.05 1 39 44 44 ASP C C 177.540 0.2 1 40 44 44 ASP CA C 56.389 0.2 1 41 44 44 ASP N N 122.420 0.4 1 42 45 45 LYS H H 7.990 0.05 1 43 45 45 LYS C C 176.709 0.2 1 44 45 45 LYS CA C 54.578 0.2 1 45 45 45 LYS N N 118.405 0.4 1 46 46 46 GLY H H 7.894 0.05 1 47 46 46 GLY C C 175.055 0.2 1 48 46 46 GLY CA C 45.216 0.2 1 49 46 46 GLY N N 107.611 0.4 1 50 47 47 GLY H H 7.720 0.05 1 51 47 47 GLY C C 173.352 0.2 1 52 47 47 GLY CA C 43.991 0.2 1 53 47 47 GLY N N 108.510 0.4 1 54 48 48 SER H H 8.082 0.05 1 55 48 48 SER CA C 56.843 0.2 1 56 48 48 SER N N 115.392 0.4 1 57 52 52 MET C C 178.691 0.2 1 58 52 52 MET CA C 58.742 0.2 1 59 53 53 GLN H H 8.327 0.05 1 60 53 53 GLN N N 117.290 0.4 1 61 54 54 GLU CA C 59.802 0.2 1 62 55 55 LEU H H 8.546 0.05 1 63 55 55 LEU CA C 58.687 0.2 1 64 55 55 LEU N N 118.866 0.4 1 65 56 56 ASN H H 8.595 0.05 1 66 56 56 ASN CA C 56.719 0.2 1 67 56 56 ASN N N 116.100 0.4 1 68 57 57 SER H H 8.543 0.05 1 69 57 57 SER CA C 61.765 0.2 1 70 57 57 SER N N 117.656 0.4 1 71 59 59 TRP H H 9.225 0.05 1 72 59 59 TRP CA C 59.560 0.2 1 73 59 59 TRP N N 119.740 0.4 1 74 60 60 GLY H H 8.248 0.05 1 75 60 60 GLY CA C 47.521 0.2 1 76 60 60 GLY N N 104.185 0.4 1 77 64 64 THR H H 7.909 0.05 1 78 64 64 THR CA C 58.731 0.2 1 79 64 64 THR CB C 70.403 0.2 1 80 64 64 THR N N 114.968 0.4 1 81 74 74 GLY C C 174.810 0.2 1 82 74 74 GLY CA C 45.655 0.2 1 83 75 75 GLY H H 8.119 0.05 1 84 75 75 GLY C C 177.203 0.2 1 85 75 75 GLY CA C 45.527 0.2 1 86 75 75 GLY N N 108.386 0.4 1 87 76 76 THR H H 8.046 0.05 1 88 76 76 THR CA C 62.086 0.2 1 89 76 76 THR N N 112.441 0.4 1 90 77 77 GLY H H 8.330 0.05 1 91 77 77 GLY N N 110.499 0.4 1 92 78 78 PHE H H 8.060 0.05 1 93 78 78 PHE N N 120.028 0.4 1 94 79 79 GLN C C 175.883 0.2 1 95 79 79 GLN CA C 55.880 0.2 1 96 79 79 GLN CB C 29.366 0.2 1 97 79 79 GLN CG C 33.766 0.2 1 98 80 80 GLY H H 7.849 0.05 1 99 80 80 GLY C C 173.525 0.2 1 100 80 80 GLY CA C 45.189 0.2 1 101 80 80 GLY N N 109.232 0.4 1 102 81 81 SER H H 8.124 0.05 1 103 81 81 SER CA C 56.573 0.2 1 104 81 81 SER CB C 63.243 0.2 1 105 81 81 SER N N 116.776 0.4 1 106 84 84 ARG C C 176.550 0.2 1 107 84 84 ARG CA C 56.236 0.2 1 108 84 84 ARG CB C 30.835 0.2 1 109 84 84 ARG CD C 43.349 0.2 1 110 84 84 ARG CG C 27.517 0.2 1 111 85 85 THR H H 8.124 0.05 1 112 85 85 THR C C 174.283 0.2 1 113 85 85 THR CA C 61.818 0.2 1 114 85 85 THR CB C 69.884 0.2 1 115 85 85 THR N N 115.083 0.4 1 116 86 86 ALA H H 8.335 0.05 1 117 86 86 ALA HA H 4.305 0.05 1 118 86 86 ALA HB H 1.351 0.05 1 119 86 86 ALA C C 177.615 0.2 1 120 86 86 ALA CA C 52.650 0.2 1 121 86 86 ALA CB C 19.313 0.2 1 122 86 86 ALA N N 125.877 0.4 1 123 87 87 GLU H H 8.352 0.05 1 124 87 87 GLU C C 176.548 0.2 1 125 87 87 GLU CA C 56.704 0.2 1 126 87 87 GLU CB C 30.324 0.2 1 127 87 87 GLU CG C 36.284 0.2 1 128 87 87 GLU N N 120.219 0.4 1 129 88 88 ARG H H 8.388 0.05 1 130 88 88 ARG HA H 4.315 0.05 1 131 88 88 ARG C C 176.823 0.2 1 132 88 88 ARG CA C 56.349 0.2 1 133 88 88 ARG CB C 30.852 0.2 1 134 88 88 ARG CD C 43.327 0.2 1 135 88 88 ARG CG C 27.275 0.2 1 136 88 88 ARG N N 121.933 0.4 1 137 89 89 GLY H H 8.542 0.05 1 138 89 89 GLY HA2 H 4.011 0.05 1 139 89 89 GLY HA3 H 4.011 0.05 1 140 89 89 GLY C C 174.519 0.2 1 141 89 89 GLY CA C 45.408 0.2 1 142 89 89 GLY N N 110.221 0.4 1 143 90 90 THR H H 8.076 0.05 1 144 90 90 THR HA H 4.775 0.05 1 145 90 90 THR HB H 4.321 0.05 1 146 90 90 THR C C 174.992 0.2 1 147 90 90 THR CA C 61.982 0.2 1 148 90 90 THR CB C 69.745 0.2 1 149 90 90 THR N N 112.972 0.4 1 150 91 91 GLU H H 8.621 0.05 1 151 91 91 GLU HA H 4.262 0.05 1 152 91 91 GLU C C 176.809 0.2 1 153 91 91 GLU CA C 57.003 0.2 1 154 91 91 GLU CB C 30.065 0.2 1 155 91 91 GLU CG C 36.303 0.2 1 156 91 91 GLU N N 122.828 0.4 1 157 92 92 GLU H H 8.449 0.05 1 158 92 92 GLU HA H 4.274 0.05 1 159 92 92 GLU C C 176.658 0.2 1 160 92 92 GLU CA C 56.862 0.2 1 161 92 92 GLU CB C 30.291 0.2 1 162 92 92 GLU CG C 36.295 0.2 1 163 92 92 GLU N N 121.626 0.4 1 164 93 93 SER H H 8.311 0.05 1 165 93 93 SER C C 175.111 0.2 1 166 93 93 SER CA C 58.787 0.2 1 167 93 93 SER CB C 63.877 0.2 1 168 93 93 SER N N 116.577 0.4 1 169 94 94 GLY H H 8.372 0.05 1 170 94 94 GLY CA C 45.398 0.2 1 171 94 94 GLY N N 110.367 0.4 1 172 132 132 LYS C C 176.871 0.2 1 173 132 132 LYS CA C 56.355 0.2 1 174 132 132 LYS CB C 33.066 0.2 1 175 132 132 LYS CD C 29.073 0.2 1 176 132 132 LYS CG C 24.678 0.2 1 177 133 133 THR H H 8.143 0.05 1 178 133 133 THR HA H 4.299 0.05 1 179 133 133 THR C C 174.381 0.2 1 180 133 133 THR CA C 61.707 0.2 1 181 133 133 THR CB C 69.927 0.2 1 182 133 133 THR CG2 C 22.207 0.2 1 183 133 133 THR N N 115.197 0.4 1 184 134 134 ALA H H 8.397 0.05 1 185 134 134 ALA HB H 1.379 0.05 1 186 134 134 ALA C C 177.821 0.2 1 187 134 134 ALA CA C 52.778 0.2 1 188 134 134 ALA CB C 19.301 0.2 1 189 134 134 ALA N N 126.064 0.4 1 190 135 135 GLU H H 8.410 0.05 1 191 135 135 GLU HA H 4.281 0.05 1 192 135 135 GLU C C 176.604 0.2 1 193 135 135 GLU CA C 56.871 0.2 1 194 135 135 GLU CB C 30.259 0.2 1 195 135 135 GLU CG C 36.522 0.2 1 196 135 135 GLU N N 119.913 0.4 1 197 136 136 SER H H 8.300 0.05 1 198 136 136 SER C C 174.689 0.2 1 199 136 136 SER CA C 58.469 0.2 1 200 136 136 SER CB C 63.853 0.2 1 201 136 136 SER N N 116.476 0.4 1 202 137 137 SER H H 8.352 0.05 1 203 137 137 SER N N 117.875 0.4 1 204 140 140 PRO C C 176.520 0.2 1 205 140 140 PRO CA C 63.238 0.2 1 206 140 140 PRO CB C 32.025 0.2 1 207 141 141 ASP H H 8.389 0.05 1 208 141 141 ASP HA H 4.535 0.05 1 209 141 141 ASP C C 176.152 0.2 1 210 141 141 ASP CA C 54.351 0.2 1 211 141 141 ASP CB C 41.078 0.2 1 212 141 141 ASP N N 119.908 0.4 1 213 142 142 LEU H H 8.021 0.05 1 214 142 142 LEU HA H 4.228 0.05 1 215 142 142 LEU C C 173.757 0.2 1 216 142 142 LEU CA C 55.182 0.2 1 217 142 142 LEU CB C 42.308 0.2 1 218 142 142 LEU N N 122.150 0.4 1 219 143 143 PHE H H 8.188 0.05 1 220 143 143 PHE HA H 4.372 0.05 1 221 143 143 PHE CA C 54.699 0.2 1 222 143 143 PHE CB C 42.538 0.2 1 223 143 143 PHE N N 123.137 0.4 1 224 154 154 PRO C C 176.979 0.2 1 225 154 154 PRO CA C 63.243 0.2 1 226 154 154 PRO CB C 32.094 0.2 1 227 154 154 PRO CD C 50.626 0.2 1 228 154 154 PRO CG C 27.537 0.2 1 229 155 155 SER H H 8.380 0.05 1 230 155 155 SER HA H 4.442 0.05 1 231 155 155 SER C C 174.203 0.2 1 232 155 155 SER CA C 58.387 0.2 1 233 155 155 SER CB C 63.837 0.2 1 234 155 155 SER N N 115.791 0.4 1 235 156 156 SER H H 8.228 0.05 1 236 156 156 SER CA C 59.793 0.2 1 237 156 156 SER CB C 69.803 0.2 1 238 156 156 SER N N 118.479 0.4 1 239 157 157 PRO C C 177.257 0.2 1 240 157 157 PRO CA C 63.627 0.2 1 241 157 157 PRO CB C 32.203 0.2 1 242 157 157 PRO CD C 50.810 0.2 1 243 157 157 PRO CG C 27.597 0.2 1 244 158 158 THR H H 8.127 0.05 1 245 158 158 THR HA H 4.776 0.05 1 246 158 158 THR HB H 4.299 0.05 1 247 158 158 THR HG2 H 1.155 0.05 1 248 158 158 THR C C 174.366 0.2 1 249 158 158 THR CA C 61.769 0.2 1 250 158 158 THR CB C 69.635 0.2 1 251 158 158 THR N N 112.532 0.4 1 252 159 159 ASP H H 8.200 0.05 1 253 159 159 ASP HA H 4.642 0.05 1 254 159 159 ASP C C 175.910 0.2 1 255 159 159 ASP CA C 54.353 0.2 1 256 159 159 ASP CB C 41.278 0.2 1 257 159 159 ASP N N 122.573 0.4 1 258 160 160 THR H H 8.102 0.05 1 259 160 160 THR HA H 4.574 0.05 1 260 160 160 THR C C 172.894 0.2 1 261 160 160 THR CA C 59.854 0.2 1 262 160 160 THR CB C 69.742 0.2 1 263 160 160 THR N N 116.437 0.4 1 264 161 161 PRO C C 176.824 0.2 1 265 161 161 PRO CA C 63.423 0.2 1 266 161 161 PRO CB C 32.053 0.2 1 267 161 161 PRO N N 138.841 0.4 1 268 162 162 ALA H H 8.362 0.05 1 269 162 162 ALA HA H 4.586 0.05 1 270 162 162 ALA HB H 1.319 0.05 1 271 162 162 ALA C C 177.905 0.2 1 272 162 162 ALA CA C 52.849 0.2 1 273 162 162 ALA CB C 19.132 0.2 1 274 162 162 ALA N N 123.662 0.4 1 275 163 163 HIS H H 8.226 0.05 1 276 163 163 HIS C C 175.724 0.2 1 277 163 163 HIS CA C 56.479 0.2 1 278 163 163 HIS CB C 30.615 0.2 1 279 163 163 HIS N N 118.137 0.4 1 280 164 164 THR H H 8.005 0.05 1 281 164 164 THR C C 174.390 0.2 1 282 164 164 THR CA C 62.034 0.2 1 283 164 164 THR CB C 69.743 0.2 1 284 164 164 THR N N 115.112 0.4 1 285 165 165 ALA H H 8.311 0.05 1 286 165 165 ALA HA H 4.292 0.05 1 287 165 165 ALA HB H 1.381 0.05 1 288 165 165 ALA C C 178.226 0.2 1 289 165 165 ALA CA C 52.933 0.2 1 290 165 165 ALA CB C 19.212 0.2 1 291 165 165 ALA N N 126.216 0.4 1 292 166 166 GLY H H 8.346 0.05 1 293 166 166 GLY HA2 H 3.913 0.05 1 294 166 166 GLY HA3 H 3.913 0.05 1 295 166 166 GLY C C 174.137 0.2 1 296 166 166 GLY CA C 45.337 0.2 1 297 166 166 GLY N N 107.965 0.4 1 298 167 167 ARG H H 8.101 0.05 1 299 167 167 ARG C C 176.337 0.2 1 300 167 167 ARG CA C 56.084 0.2 1 301 167 167 ARG CB C 30.860 0.2 1 302 167 167 ARG CD C 43.389 0.2 1 303 167 167 ARG CG C 27.392 0.2 1 304 167 167 ARG N N 120.502 0.4 1 305 168 168 ARG H H 8.393 0.05 1 306 168 168 ARG HA H 4.288 0.05 1 307 168 168 ARG N N 122.553 0.4 1 308 170 170 ASN C C 173.933 0.2 1 309 170 170 ASN CA C 53.602 0.2 1 310 170 170 ASN CB C 29.121 0.2 1 311 171 171 PRO C C 176.757 0.2 1 312 171 171 PRO CA C 63.512 0.2 1 313 171 171 PRO CB C 32.221 0.2 1 314 171 171 PRO CD C 50.734 0.2 1 315 171 171 PRO CG C 27.503 0.2 1 316 171 171 PRO N N 136.758 0.4 1 317 172 172 CYS H H 8.361 0.05 1 318 172 172 CYS C C 174.495 0.2 1 319 172 172 CYS CA C 58.791 0.2 1 320 172 172 CYS CB C 28.011 0.2 1 321 172 172 CYS N N 118.818 0.4 1 322 173 173 VAL H H 8.019 0.05 1 323 173 173 VAL HA H 4.119 0.05 1 324 173 173 VAL C C 175.370 0.2 1 325 173 173 VAL CA C 62.059 0.2 1 326 173 173 VAL CB C 33.009 0.2 1 327 173 173 VAL CG1 C 20.835 0.2 1 328 173 173 VAL N N 121.746 0.4 1 329 174 174 ALA H H 8.311 0.05 1 330 174 174 ALA HA H 4.315 0.05 1 331 174 174 ALA HB H 1.334 0.05 1 332 174 174 ALA C C 177.239 0.2 1 333 174 174 ALA CA C 52.264 0.2 1 334 174 174 ALA CB C 19.502 0.2 1 335 174 174 ALA N N 127.718 0.4 1 336 175 175 GLU H H 8.356 0.05 1 337 175 175 GLU C C 173.435 0.2 1 338 175 175 GLU CA C 54.353 0.2 1 339 175 175 GLU CB C 29.854 0.2 1 340 175 175 GLU N N 121.765 0.4 1 341 176 176 PRO C C 176.692 0.2 1 342 176 176 PRO CA C 63.346 0.2 1 343 176 176 PRO CB C 32.177 0.2 1 344 176 176 PRO CD C 50.656 0.2 1 345 176 176 PRO CG C 27.574 0.2 1 346 176 176 PRO N N 136.991 0.4 1 347 177 177 ASP H H 8.398 0.05 1 348 177 177 ASP HA H 4.581 0.05 1 349 177 177 ASP C C 176.180 0.2 1 350 177 177 ASP CA C 54.316 0.2 1 351 177 177 ASP CB C 41.257 0.2 1 352 177 177 ASP N N 120.609 0.4 1 353 178 178 ASP H H 8.297 0.05 1 354 178 178 ASP HA H 4.590 0.05 1 355 178 178 ASP C C 176.501 0.2 1 356 178 178 ASP CA C 54.425 0.2 1 357 178 178 ASP CB C 41.055 0.2 1 358 178 178 ASP N N 121.436 0.4 1 359 179 179 SER H H 8.303 0.05 1 360 179 179 SER HA H 4.375 0.05 1 361 179 179 SER C C 174.446 0.2 1 362 179 179 SER CA C 58.947 0.2 1 363 179 179 SER CB C 63.860 0.2 1 364 179 179 SER N N 115.856 0.4 1 365 180 180 ILE H H 7.961 0.05 1 366 180 180 ILE HA H 4.199 0.05 1 367 180 180 ILE C C 176.117 0.2 1 368 180 180 ILE CA C 60.948 0.2 1 369 180 180 ILE CB C 38.766 0.2 1 370 180 180 ILE CD1 C 12.605 0.2 1 371 180 180 ILE CG1 C 27.334 0.2 1 372 180 180 ILE CG2 C 17.609 0.2 1 373 180 180 ILE N N 121.813 0.4 1 374 181 181 SER H H 8.395 0.05 1 375 181 181 SER HA H 3.826 0.05 1 376 181 181 SER C C 172.691 0.2 1 377 181 181 SER CA C 56.171 0.2 1 378 181 181 SER CB C 63.397 0.2 1 379 181 181 SER N N 121.401 0.4 1 380 182 182 PRO C C 176.444 0.2 1 381 182 182 PRO CA C 63.015 0.2 1 382 182 182 PRO CB C 32.136 0.2 1 383 182 182 PRO CD C 50.752 0.2 1 384 182 182 PRO CG C 27.375 0.2 1 385 182 182 PRO N N 137.276 0.4 1 386 183 183 ASP H H 8.285 0.05 1 387 183 183 ASP HA H 4.785 0.05 1 388 183 183 ASP C C 173.666 0.2 1 389 183 183 ASP CA C 52.871 0.2 1 390 183 183 ASP CB C 40.327 0.2 1 391 183 183 ASP N N 121.714 0.4 1 392 184 184 PRO CA C 61.560 0.2 1 393 184 184 PRO CB C 30.808 0.2 1 394 184 184 PRO N N 137.218 0.4 1 395 186 186 ARG H H 8.354 0.05 1 396 186 186 ARG CA C 56.492 0.2 1 397 186 186 ARG CB C 30.408 0.2 1 398 186 186 ARG N N 122.368 0.4 1 399 187 187 THR H H 8.053 0.05 1 400 187 187 THR C C 172.743 0.2 1 401 187 187 THR CA C 59.859 0.2 1 402 187 187 THR CB C 69.833 0.2 1 403 187 187 THR N N 111.799 0.4 1 404 188 188 PRO C C 177.047 0.2 1 405 188 188 PRO CA C 63.322 0.2 1 406 188 188 PRO CB C 32.167 0.2 1 407 188 188 PRO CD C 51.192 0.2 1 408 188 188 PRO CG C 27.682 0.2 1 409 188 188 PRO N N 138.845 0.4 1 410 189 189 VAL H H 8.209 0.05 1 411 189 189 VAL HA H 4.061 0.05 1 412 189 189 VAL HB H 2.046 0.05 1 413 189 189 VAL HG1 H 0.704 0.05 1 414 189 189 VAL HG2 H 0.933 0.05 1 415 189 189 VAL C C 176.366 0.2 1 416 189 189 VAL CA C 62.581 0.2 1 417 189 189 VAL CB C 32.696 0.2 1 418 189 189 VAL CG1 C 20.904 0.2 1 419 189 189 VAL N N 120.187 0.4 1 420 190 190 SER H H 8.327 0.05 1 421 190 190 SER C C 174.610 0.2 1 422 190 190 SER CA C 58.302 0.2 1 423 190 190 SER CB C 63.739 0.2 1 424 190 190 SER N N 119.238 0.4 1 425 191 191 ARG H H 8.385 0.05 1 426 191 191 ARG CA C 56.133 0.2 1 427 191 191 ARG CB C 30.932 0.2 1 428 191 191 ARG N N 123.517 0.4 1 429 194 194 PRO C C 176.280 0.2 1 430 194 194 PRO CA C 56.285 0.2 1 431 194 194 PRO CB C 33.098 0.2 1 432 195 195 ARG H H 8.373 0.05 1 433 195 195 ARG C C 174.130 0.2 1 434 195 195 ARG CA C 43.271 0.2 1 435 195 195 ARG CB C 30.287 0.2 1 436 195 195 ARG N N 123.799 0.4 1 437 196 196 PRO C C 176.658 0.2 1 438 196 196 PRO CA C 63.056 0.2 1 439 196 196 PRO CB C 32.119 0.2 1 440 196 196 PRO CD C 50.691 0.2 1 441 196 196 PRO CG C 27.682 0.2 1 442 196 196 PRO N N 136.864 0.4 1 443 197 197 ALA H H 8.466 0.05 1 444 197 197 ALA HA H 4.262 0.05 1 445 197 197 ALA C C 178.418 0.2 1 446 197 197 ALA CA C 52.794 0.2 1 447 197 197 ALA CB C 19.223 0.2 1 448 197 197 ALA N N 124.774 0.4 1 449 198 198 GLY H H 8.377 0.05 1 450 198 198 GLY HA2 H 3.922 0.05 1 451 198 198 GLY HA3 H 3.922 0.05 1 452 198 198 GLY C C 174.007 0.2 1 453 198 198 GLY CA C 45.179 0.2 1 454 198 198 GLY N N 108.148 0.4 1 455 199 199 ALA H H 8.174 0.05 1 456 199 199 ALA HA H 4.371 0.05 1 457 199 199 ALA HB H 1.380 0.05 1 458 199 199 ALA C C 178.249 0.2 1 459 199 199 ALA CA C 52.589 0.2 1 460 199 199 ALA CB C 19.396 0.2 1 461 199 199 ALA N N 123.772 0.4 1 462 200 200 THR H H 8.209 0.05 1 463 200 200 THR HA H 4.774 0.05 1 464 200 200 THR HB H 4.342 0.05 1 465 200 200 THR C C 175.312 0.2 1 466 200 200 THR CA C 61.942 0.2 1 467 200 200 THR CB C 69.868 0.2 1 468 200 200 THR N N 112.868 0.4 1 469 201 201 GLY H H 8.425 0.05 1 470 201 201 GLY C C 174.756 0.2 1 471 201 201 GLY CA C 45.374 0.2 1 472 201 201 GLY N N 111.072 0.4 1 473 202 202 GLY H H 8.352 0.05 1 474 202 202 GLY HA2 H 3.946 0.05 1 475 202 202 GLY HA3 H 3.946 0.05 1 476 202 202 GLY N N 108.811 0.4 1 477 205 205 GLY H H 8.405 0.05 1 478 205 205 GLY HA2 H 3.911 0.05 1 479 205 205 GLY HA3 H 3.911 0.05 1 480 205 205 GLY C C 174.688 0.2 1 481 205 205 GLY CA C 45.730 0.2 1 482 205 205 GLY N N 114.303 0.4 1 483 206 206 GLY H H 8.307 0.05 1 484 206 206 GLY HA2 H 3.955 0.05 1 485 206 206 GLY HA3 H 3.955 0.05 1 486 206 206 GLY C C 174.277 0.2 1 487 206 206 GLY CA C 45.160 0.2 1 488 206 206 GLY N N 108.810 0.4 1 489 207 207 VAL H H 8.000 0.05 1 490 207 207 VAL HA H 4.042 0.05 1 491 207 207 VAL C C 176.161 0.2 1 492 207 207 VAL CA C 62.546 0.2 1 493 207 207 VAL CB C 32.577 0.2 1 494 207 207 VAL N N 119.036 0.4 1 495 208 208 HIS H H 8.372 0.05 1 496 208 208 HIS C C 175.176 0.2 1 497 208 208 HIS CA C 56.005 0.2 1 498 208 208 HIS CB C 30.694 0.2 1 499 208 208 HIS N N 122.750 0.4 1 500 209 209 ALA H H 8.239 0.05 1 501 209 209 ALA C C 177.539 0.2 1 502 209 209 ALA CA C 52.745 0.2 1 503 209 209 ALA CB C 19.229 0.2 1 504 209 209 ALA N N 125.310 0.4 1 505 210 210 ASN H H 8.562 0.05 1 506 210 210 ASN C C 175.867 0.2 1 507 210 210 ASN CA C 53.341 0.2 1 508 210 210 ASN CB C 38.970 0.2 1 509 210 210 ASN N N 117.952 0.4 1 510 211 211 GLY H H 8.381 0.05 1 511 211 211 GLY C C 174.694 0.2 1 512 211 211 GLY CA C 45.635 0.2 1 513 211 211 GLY N N 109.264 0.4 1 514 212 212 GLY H H 8.260 0.05 1 515 212 212 GLY HA2 H 3.890 0.05 1 516 212 212 GLY HA3 H 3.890 0.05 1 517 212 212 GLY C C 174.134 0.2 1 518 212 212 GLY CA C 45.214 0.2 1 519 212 212 GLY N N 108.530 0.4 1 520 213 213 SER H H 8.195 0.05 1 521 213 213 SER C C 174.634 0.2 1 522 213 213 SER CA C 58.243 0.2 1 523 213 213 SER CB C 63.965 0.2 1 524 213 213 SER N N 115.564 0.4 1 525 214 214 VAL H H 8.105 0.05 1 526 214 214 VAL HA H 4.039 0.05 1 527 214 214 VAL C C 175.867 0.2 1 528 214 214 VAL CA C 62.420 0.2 1 529 214 214 VAL CB C 32.577 0.2 1 530 214 214 VAL N N 121.392 0.4 1 531 215 215 PHE H H 8.257 0.05 1 532 215 215 PHE HA H 4.581 0.05 1 533 215 215 PHE C C 176.124 0.2 1 534 215 215 PHE CA C 57.890 0.2 1 535 215 215 PHE CB C 39.606 0.2 1 536 215 215 PHE N N 123.239 0.4 1 537 216 216 GLY H H 8.173 0.05 1 538 216 216 GLY HA2 H 3.813 0.05 1 539 216 216 GLY HA3 H 3.813 0.05 1 540 216 216 GLY C C 173.260 0.2 1 541 216 216 GLY CA C 45.078 0.2 1 542 216 216 GLY N N 110.271 0.4 1 543 217 217 HIS H H 8.101 0.05 1 544 217 217 HIS HA H 4.309 0.05 1 545 217 217 HIS C C 173.518 0.2 1 546 217 217 HIS CA C 51.089 0.2 1 547 217 217 HIS CB C 38.779 0.2 1 548 217 217 HIS N N 120.359 0.4 1 549 218 218 PRO C C 177.418 0.2 1 550 218 218 PRO CA C 63.517 0.2 1 551 218 218 PRO CB C 32.145 0.2 1 552 218 218 PRO N N 136.208 0.4 1 553 219 219 THR H H 8.433 0.05 1 554 219 219 THR HA H 4.772 0.05 1 555 219 219 THR HB H 4.382 0.05 1 556 219 219 THR C C 175.362 0.2 1 557 219 219 THR CA C 61.970 0.2 1 558 219 219 THR CB C 69.909 0.2 1 559 219 219 THR N N 114.050 0.4 1 560 220 220 GLY H H 8.451 0.05 1 561 220 220 GLY HA2 H 3.991 0.05 1 562 220 220 GLY HA3 H 3.991 0.05 1 563 220 220 GLY C C 174.659 0.2 1 564 220 220 GLY CA C 45.390 0.2 1 565 220 220 GLY N N 111.111 0.4 1 566 221 221 GLY H H 8.308 0.05 1 567 221 221 GLY HA2 H 3.965 0.05 1 568 221 221 GLY HA3 H 3.965 0.05 1 569 221 221 GLY C C 174.360 0.2 1 570 221 221 GLY CA C 45.251 0.2 1 571 221 221 GLY N N 108.856 0.4 1 572 222 222 THR H H 8.133 0.05 1 573 222 222 THR HA H 4.775 0.05 1 574 222 222 THR HB H 4.418 0.05 1 575 222 222 THR C C 174.671 0.2 1 576 222 222 THR CA C 61.727 0.2 1 577 222 222 THR CB C 69.862 0.2 1 578 222 222 THR N N 113.320 0.4 1 579 223 223 SER H H 8.397 0.05 1 580 223 223 SER C C 174.398 0.2 1 581 223 223 SER CA C 58.309 0.2 1 582 223 223 SER CB C 63.844 0.2 1 583 223 223 SER N N 118.330 0.4 1 584 224 224 THR H H 8.123 0.05 1 585 224 224 THR HA H 4.599 0.05 1 586 224 224 THR C C 172.723 0.2 1 587 224 224 THR CA C 59.878 0.2 1 588 224 224 THR CB C 69.831 0.2 1 589 224 224 THR N N 118.141 0.4 1 590 225 225 PRO C C 176.415 0.2 1 591 225 225 PRO CA C 63.134 0.2 1 592 225 225 PRO CB C 32.158 0.2 1 593 225 225 PRO N N 139.075 0.4 1 594 226 226 ALA H H 8.342 0.05 1 595 226 226 ALA HA H 4.193 0.05 1 596 226 226 ALA HB H 1.274 0.05 1 597 226 226 ALA C C 177.187 0.2 1 598 226 226 ALA CA C 52.496 0.2 1 599 226 226 ALA CB C 19.316 0.2 1 600 226 226 ALA N N 124.150 0.4 1 601 227 227 HIS H H 8.137 0.05 1 602 227 227 HIS CA C 53.670 0.2 1 603 227 227 HIS CB C 29.956 0.2 1 604 227 227 HIS N N 118.714 0.4 1 605 228 228 PRO C C 174.188 0.2 1 606 228 228 PRO CA C 61.506 0.2 1 607 228 228 PRO CB C 30.726 0.2 1 608 229 229 PRO C C 174.786 0.2 1 609 229 229 PRO CA C 61.309 0.2 1 610 229 229 PRO CB C 30.760 0.2 1 611 229 229 PRO N N 136.494 0.4 1 612 230 230 PRO C C 176.565 0.2 1 613 230 230 PRO CA C 63.026 0.2 1 614 230 230 PRO CB C 31.850 0.2 1 615 230 230 PRO N N 134.461 0.4 1 616 231 231 TYR H H 8.036 0.05 1 617 231 231 TYR HA H 4.466 0.05 1 618 231 231 TYR C C 175.564 0.2 1 619 231 231 TYR CA C 57.847 0.2 1 620 231 231 TYR CB C 38.664 0.2 1 621 231 231 TYR N N 119.805 0.4 1 622 232 232 HIS H H 8.050 0.05 1 623 232 232 HIS C C 174.819 0.2 1 624 232 232 HIS CA C 55.906 0.2 1 625 232 232 HIS CB C 30.835 0.2 1 626 232 232 HIS N N 121.619 0.4 1 627 233 233 SER H H 8.191 0.05 1 628 233 233 SER HA H 4.719 0.05 1 629 233 233 SER C C 174.593 0.2 1 630 233 233 SER CA C 58.386 0.2 1 631 233 233 SER CB C 63.814 0.2 1 632 233 233 SER N N 117.479 0.4 1 633 234 234 GLN H H 8.517 0.05 1 634 234 234 GLN C C 176.467 0.2 1 635 234 234 GLN CA C 56.060 0.2 1 636 234 234 GLN CB C 29.452 0.2 1 637 234 234 GLN N N 122.331 0.4 1 638 235 235 GLY H H 8.436 0.05 1 639 235 235 GLY HA2 H 3.958 0.05 1 640 235 235 GLY HA3 H 3.958 0.05 1 641 235 235 GLY C C 174.630 0.2 1 642 235 235 GLY CA C 45.374 0.2 1 643 235 235 GLY N N 109.951 0.4 1 644 236 236 GLY H H 8.315 0.05 1 645 236 236 GLY HA2 H 3.976 0.05 1 646 236 236 GLY HA3 H 3.976 0.05 1 647 236 236 GLY C C 174.543 0.2 1 648 236 236 GLY CA C 45.295 0.2 1 649 236 236 GLY N N 108.956 0.4 1 650 237 237 SER H H 8.317 0.05 1 651 237 237 SER C C 174.965 0.2 1 652 237 237 SER CA C 58.682 0.2 1 653 237 237 SER CB C 63.818 0.2 1 654 237 237 SER N N 115.769 0.4 1 655 238 238 GLU H H 8.647 0.05 1 656 238 238 GLU HA H 4.291 0.05 1 657 238 238 GLU C C 176.723 0.2 1 658 238 238 GLU CA C 57.008 0.2 1 659 238 238 GLU CB C 29.997 0.2 1 660 238 238 GLU N N 122.651 0.4 1 661 239 239 SER H H 8.266 0.05 1 662 239 239 SER HA H 4.420 0.05 1 663 239 239 SER HB2 H 3.848 0.05 1 664 239 239 SER HB3 H 3.848 0.05 1 665 239 239 SER C C 174.761 0.2 1 666 239 239 SER CA C 58.478 0.2 1 667 239 239 SER CB C 63.794 0.2 1 668 239 239 SER N N 116.171 0.4 1 669 240 240 MET H H 8.354 0.05 1 670 240 240 MET HA H 4.289 0.05 1 671 240 240 MET C C 176.793 0.2 1 672 240 240 MET CA C 55.675 0.2 1 673 240 240 MET CB C 32.723 0.2 1 674 240 240 MET N N 122.202 0.4 1 675 241 241 GLY H H 8.393 0.05 1 676 241 241 GLY HA2 H 3.948 0.05 1 677 241 241 GLY HA3 H 3.948 0.05 1 678 241 241 GLY C C 174.624 0.2 1 679 241 241 GLY CA C 45.428 0.2 1 680 241 241 GLY N N 109.739 0.4 1 681 242 242 GLY H H 8.267 0.05 1 682 242 242 GLY HA2 H 3.980 0.05 1 683 242 242 GLY HA3 H 3.980 0.05 1 684 242 242 GLY C C 174.423 0.2 1 685 242 242 GLY CA C 45.272 0.2 1 686 242 242 GLY N N 108.765 0.4 1 687 243 243 SER H H 8.299 0.05 1 688 243 243 SER HA H 4.340 0.05 1 689 243 243 SER C C 174.440 0.2 1 690 243 243 SER CA C 58.498 0.2 1 691 243 243 SER CB C 63.943 0.2 1 692 243 243 SER N N 115.597 0.4 1 693 244 244 ASP H H 8.457 0.05 1 694 244 244 ASP HA H 4.623 0.05 1 695 244 244 ASP C C 176.655 0.2 1 696 244 244 ASP CA C 54.441 0.2 1 697 244 244 ASP CB C 41.222 0.2 1 698 244 244 ASP N N 122.146 0.4 1 699 245 245 SER H H 8.306 0.05 1 700 245 245 SER HA H 4.438 0.05 1 701 245 245 SER C C 174.983 0.2 1 702 245 245 SER CA C 58.578 0.2 1 703 245 245 SER CB C 63.725 0.2 1 704 245 245 SER N N 116.468 0.4 1 705 246 246 SER H H 8.373 0.05 1 706 246 246 SER HA H 4.386 0.05 1 707 246 246 SER C C 175.059 0.2 1 708 246 246 SER CA C 59.129 0.2 1 709 246 246 SER CB C 63.781 0.2 1 710 246 246 SER N N 117.911 0.4 1 711 247 247 GLY H H 8.305 0.05 1 712 247 247 GLY HA2 H 3.860 0.05 1 713 247 247 GLY HA3 H 3.860 0.05 1 714 247 247 GLY C C 173.857 0.2 1 715 247 247 GLY CA C 45.336 0.2 1 716 247 247 GLY N N 110.258 0.4 1 717 248 248 PHE H H 8.021 0.05 1 718 248 248 PHE HA H 4.568 0.05 1 719 248 248 PHE C C 175.591 0.2 1 720 248 248 PHE CA C 57.667 0.2 1 721 248 248 PHE CB C 39.661 0.2 1 722 248 248 PHE N N 119.970 0.4 1 723 249 249 ALA H H 8.262 0.05 1 724 249 249 ALA HA H 4.266 0.05 1 725 249 249 ALA HB H 1.319 0.05 1 726 249 249 ALA C C 177.493 0.2 1 727 249 249 ALA CA C 52.423 0.2 1 728 249 249 ALA CB C 19.347 0.2 1 729 249 249 ALA N N 125.593 0.4 1 730 250 250 GLU H H 8.369 0.05 1 731 250 250 GLU HA H 4.188 0.05 1 732 250 250 GLU C C 177.111 0.2 1 733 250 250 GLU CA C 57.091 0.2 1 734 250 250 GLU CB C 30.101 0.2 1 735 250 250 GLU N N 120.554 0.4 1 736 251 251 GLY H H 8.412 0.05 1 737 251 251 GLY HA2 H 3.959 0.05 1 738 251 251 GLY HA3 H 3.959 0.05 1 739 251 251 GLY C C 174.277 0.2 1 740 251 251 GLY CA C 45.431 0.2 1 741 251 251 GLY N N 109.956 0.4 1 742 252 252 SER H H 8.073 0.05 1 743 252 252 SER HA H 4.373 0.05 1 744 252 252 SER C C 174.103 0.2 1 745 252 252 SER CA C 58.521 0.2 1 746 252 252 SER CB C 63.858 0.2 1 747 252 252 SER N N 115.428 0.4 1 748 253 253 PHE H H 8.194 0.05 1 749 253 253 PHE HA H 4.561 0.05 1 750 253 253 PHE C C 175.509 0.2 1 751 253 253 PHE CA C 57.844 0.2 1 752 253 253 PHE CB C 39.553 0.2 1 753 253 253 PHE N N 121.666 0.4 1 754 254 254 ARG H H 8.151 0.05 1 755 254 254 ARG HA H 4.302 0.05 1 756 254 254 ARG C C 176.160 0.2 1 757 254 254 ARG CA C 55.775 0.2 1 758 254 254 ARG CB C 31.115 0.2 1 759 254 254 ARG N N 122.757 0.4 1 760 255 255 SER H H 8.409 0.05 1 761 255 255 SER C C 176.112 0.2 1 762 255 255 SER CA C 58.499 0.2 1 763 255 255 SER CB C 63.710 0.2 1 764 255 255 SER N N 117.362 0.4 1 765 256 256 ASP H H 8.342 0.05 1 766 256 256 ASP HA H 4.583 0.05 1 767 256 256 ASP C C 176.961 0.2 1 768 256 256 ASP CA C 54.201 0.2 1 769 256 256 ASP CB C 41.086 0.2 1 770 256 256 ASP N N 121.974 0.4 1 771 257 257 GLY H H 8.358 0.05 1 772 257 257 GLY HA2 H 3.955 0.05 1 773 257 257 GLY HA3 H 3.955 0.05 1 774 257 257 GLY C C 174.562 0.2 1 775 257 257 GLY CA C 45.497 0.2 1 776 257 257 GLY N N 109.229 0.4 1 777 258 258 SER H H 8.220 0.05 1 778 258 258 SER HA H 4.317 0.05 1 779 258 258 SER C C 174.045 0.2 1 780 258 258 SER CA C 58.319 0.2 1 781 258 258 SER CB C 63.846 0.2 1 782 258 258 SER N N 115.693 0.4 1 783 259 259 HIS H H 8.084 0.05 1 784 259 259 HIS HA H 4.033 0.05 1 785 259 259 HIS CA C 62.390 0.2 1 786 259 259 HIS CB C 32.573 0.2 1 787 259 259 HIS N N 121.327 0.4 1 stop_ save_