data_26834 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; N-terminal domain of chicken (gallus gallus) PARP-3 ; _BMRB_accession_number 26834 _BMRB_flat_file_name bmr26834.str _Entry_type original _Submission_date 2016-06-23 _Accession_date 2016-06-23 _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 Polo Luis M. . 2 Xu Yingqi J. . 3 Matthews Stephen J. . 4 Pearl Laurence H. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 140 "13C chemical shifts" 556 "15N chemical shifts" 141 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-08-31 original BMRB . stop_ _Original_release_date 2016-08-31 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; PARP3 is a sensor of nicked nucleosomes and monoribosylates histone H2B(Glu2) ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 27530147 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Grundy Gabrielle . . 2 Polo Luis M. . 3 Zeng Zhihong . . 4 Rulten Stuart . . 5 Hoch Nicolas . . 6 Paomephan Pathompong . . 7 Xu Yingqi . . 8 Sweet Steve . . 9 Thorne Alan . . 10 Oliver Antony W. . 11 Matthews Stephen . . 12 Pearl Laurence H. . 13 Caldecott Keith . . stop_ _Journal_abbreviation 'Nat. commun.' _Journal_volume 7 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 12404 _Page_last 12404 _Year 2016 _Details . loop_ _Keyword ADP-ribose Cancer DNA-repair NHEJ PARP Polymerase SSB 'Single Strand Break' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'PARP3 NTD' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'PARP3 NTD' $PARP3_NTD stop_ _System_molecular_weight 18811 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_PARP3_NTD _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common PARP3_NTD _Molecular_mass . _Mol_thiol_state 'all free' loop_ _Biological_function 'Involved in both single and double strand break DNA-repair. PARP3 is a sensor of nicked nucleosomes.' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 200 _Mol_residue_sequence ; MHHHHHHSSGVDLGTWSHPQ FEKENLYFQSMAPKRRAPPA SQPADGGKKAKGGQEEEEDA WSSALNALKTAPREKPPATI DGQCPLSAGPDAKVYEDYDC TLNQTNISANNNKFYIIQLI EHGGTYSTWNRWGRVGEVGQ SKLLPFTSLEAAKKDFEKKF WEKTKNRWAARDNFVAQPGK YTLIEVQPGAGQEVALRVDG ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -29 MET 2 -28 HIS 3 -27 HIS 4 -26 HIS 5 -25 HIS 6 -24 HIS 7 -23 HIS 8 -22 SER 9 -21 SER 10 -20 GLY 11 -19 VAL 12 -18 ASP 13 -17 LEU 14 -16 GLY 15 -15 THR 16 -14 TRP 17 -13 SER 18 -12 HIS 19 -11 PRO 20 -10 GLN 21 -9 PHE 22 -8 GLU 23 -7 LYS 24 -6 GLU 25 -5 ASN 26 -4 LEU 27 -3 TYR 28 -2 PHE 29 -1 GLN 30 0 SER 31 1 MET 32 2 ALA 33 3 PRO 34 4 LYS 35 5 ARG 36 6 ARG 37 7 ALA 38 8 PRO 39 9 PRO 40 10 ALA 41 11 SER 42 12 GLN 43 13 PRO 44 14 ALA 45 15 ASP 46 16 GLY 47 17 GLY 48 18 LYS 49 19 LYS 50 20 ALA 51 21 LYS 52 22 GLY 53 23 GLY 54 24 GLN 55 25 GLU 56 26 GLU 57 27 GLU 58 28 GLU 59 29 ASP 60 30 ALA 61 31 TRP 62 32 SER 63 33 SER 64 34 ALA 65 35 LEU 66 36 ASN 67 37 ALA 68 38 LEU 69 39 LYS 70 40 THR 71 41 ALA 72 42 PRO 73 43 ARG 74 44 GLU 75 45 LYS 76 46 PRO 77 47 PRO 78 48 ALA 79 49 THR 80 50 ILE 81 51 ASP 82 52 GLY 83 53 GLN 84 54 CYS 85 55 PRO 86 56 LEU 87 57 SER 88 58 ALA 89 59 GLY 90 60 PRO 91 61 ASP 92 62 ALA 93 63 LYS 94 64 VAL 95 65 TYR 96 66 GLU 97 67 ASP 98 68 TYR 99 69 ASP 100 70 CYS 101 71 THR 102 72 LEU 103 73 ASN 104 74 GLN 105 75 THR 106 76 ASN 107 77 ILE 108 78 SER 109 79 ALA 110 80 ASN 111 81 ASN 112 82 ASN 113 83 LYS 114 84 PHE 115 85 TYR 116 86 ILE 117 87 ILE 118 88 GLN 119 89 LEU 120 90 ILE 121 91 GLU 122 92 HIS 123 93 GLY 124 94 GLY 125 95 THR 126 96 TYR 127 97 SER 128 98 THR 129 99 TRP 130 100 ASN 131 101 ARG 132 102 TRP 133 103 GLY 134 104 ARG 135 105 VAL 136 106 GLY 137 107 GLU 138 108 VAL 139 109 GLY 140 110 GLN 141 111 SER 142 112 LYS 143 113 LEU 144 114 LEU 145 115 PRO 146 116 PHE 147 117 THR 148 118 SER 149 119 LEU 150 120 GLU 151 121 ALA 152 122 ALA 153 123 LYS 154 124 LYS 155 125 ASP 156 126 PHE 157 127 GLU 158 128 LYS 159 129 LYS 160 130 PHE 161 131 TRP 162 132 GLU 163 133 LYS 164 134 THR 165 135 LYS 166 136 ASN 167 137 ARG 168 138 TRP 169 139 ALA 170 140 ALA 171 141 ARG 172 142 ASP 173 143 ASN 174 144 PHE 175 145 VAL 176 146 ALA 177 147 GLN 178 148 PRO 179 149 GLY 180 150 LYS 181 151 TYR 182 152 THR 183 153 LEU 184 154 ILE 185 155 GLU 186 156 VAL 187 157 GLN 188 158 PRO 189 159 GLY 190 160 ALA 191 161 GLY 192 162 GLN 193 163 GLU 194 164 VAL 195 165 ALA 196 166 LEU 197 167 ARG 198 168 VAL 199 169 ASP 200 170 GLY 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 UNP E1BSI0 PARP3 . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $PARP3_NTD chicken 9031 Eukaryota Metazoa Gallus gallus 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 $PARP3_NTD 'recombinant technology' . Escherichia coli . pNIC28-BSA1 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 $PARP3_NTD 0.3 mM '[U-100% 13C; U-100% 15N]' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CCPN _Saveframe_category software _Name CCPN _Version 2.4.1 loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Ascend _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ save_3D_HN(CA)CO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.1 . M pH 7.5 . 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 internal indirect . . . 0.25144953 water H 1 protons ppm 4.772 internal direct . . . 1 DSS N 15 'methyl protons' ppm 0 internal indirect . . . 0.101329112 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_ _Software_label $CCPN stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCO' '3D HNCACB' '3D CBCA(CO)NH' '3D C(CO)NH' '3D HN(CA)CO' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'PARP3 NTD' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 31 MET C C 175.505 . . 2 1 31 MET CA C 55.305 . . 3 1 31 MET CB C 33.165 . . 4 2 32 ALA H H 8.446 . . 5 2 32 ALA CA C 50.779 . . 6 2 32 ALA CB C 18.147 . . 7 2 32 ALA N N 127.362 . . 8 5 35 ARG C C 176.051 . . 9 5 35 ARG CA C 55.944 . . 10 5 35 ARG CB C 31.062 . . 11 5 35 ARG CG C 27.085 . . 12 5 35 ARG CD C 43.518 . . 13 6 36 ARG H H 8.465 . . 14 6 36 ARG C C 175.549 . . 15 6 36 ARG CA C 55.944 . . 16 6 36 ARG CG C 27.033 . . 17 6 36 ARG CD C 43.475 . . 18 6 36 ARG N N 123.501 . . 19 7 37 ALA H H 8.403 . . 20 7 37 ALA C C 174.898 . . 21 7 37 ALA CA C 50.589 . . 22 7 37 ALA CB C 18.161 . . 23 7 37 ALA N N 127.314 . . 24 9 39 PRO C C 176.716 . . 25 9 39 PRO CA C 62.978 . . 26 9 39 PRO CB C 32.007 . . 27 9 39 PRO CG C 27.427 . . 28 9 39 PRO CD C 50.553 . . 29 10 40 ALA H H 8.441 . . 30 10 40 ALA C C 177.822 . . 31 10 40 ALA CA C 52.606 . . 32 10 40 ALA CB C 19.211 . . 33 10 40 ALA N N 124.188 . . 34 11 41 SER H H 8.255 . . 35 11 41 SER C C 174.046 . . 36 11 41 SER CA C 58.273 . . 37 11 41 SER CB C 63.996 . . 38 11 41 SER N N 114.775 . . 39 12 42 GLN CA C 53.729 . . 40 12 42 GLN CB C 29.113 . . 41 12 42 GLN N N 122.783 . . 42 13 43 PRO C C 176.993 . . 43 13 43 PRO CA C 63.214 . . 44 13 43 PRO CB C 32.140 . . 45 13 43 PRO CG C 27.507 . . 46 14 44 ALA H H 8.550 . . 47 14 44 ALA C C 177.737 . . 48 14 44 ALA CA C 52.766 . . 49 14 44 ALA CB C 19.083 . . 50 14 44 ALA N N 124.703 . . 51 15 45 ASP H H 8.303 . . 52 15 45 ASP C C 177.041 . . 53 15 45 ASP CA C 54.296 . . 54 15 45 ASP CB C 41.299 . . 55 15 45 ASP N N 119.070 . . 56 16 46 GLY H H 8.369 . . 57 16 46 GLY C C 175.024 . . 58 16 46 GLY CA C 45.728 . . 59 16 46 GLY N N 109.403 . . 60 17 47 GLY H H 8.404 . . 61 17 47 GLY C C 174.258 . . 62 17 47 GLY CA C 45.377 . . 63 17 47 GLY N N 108.696 . . 64 18 48 LYS H H 8.122 . . 65 18 48 LYS C C 176.729 . . 66 18 48 LYS CA C 56.493 . . 67 18 48 LYS CB C 33.029 . . 68 18 48 LYS N N 120.813 . . 69 19 49 LYS H H 8.367 . . 70 19 49 LYS CA C 56.304 . . 71 19 49 LYS N N 122.677 . . 72 20 50 ALA H H 8.355 . . 73 20 50 ALA C C 177.759 . . 74 20 50 ALA CA C 52.542 . . 75 20 50 ALA CB C 19.313 . . 76 20 50 ALA N N 125.638 . . 77 21 51 LYS H H 8.385 . . 78 21 51 LYS C C 177.216 . . 79 21 51 LYS CA C 56.551 . . 80 21 51 LYS CB C 33.080 . . 81 21 51 LYS CG C 24.715 . . 82 21 51 LYS CD C 29.055 . . 83 21 51 LYS CE C 42.230 . . 84 21 51 LYS N N 120.955 . . 85 22 52 GLY H H 8.502 . . 86 22 52 GLY C C 174.687 . . 87 22 52 GLY CA C 45.431 . . 88 22 52 GLY N N 110.337 . . 89 23 53 GLY H H 8.408 . . 90 23 53 GLY C C 174.351 . . 91 23 53 GLY CA C 45.351 . . 92 23 53 GLY N N 109.016 . . 93 24 54 GLN H H 8.376 . . 94 24 54 GLN C C 176.185 . . 95 24 54 GLN CA C 56.150 . . 96 24 54 GLN CB C 29.422 . . 97 24 54 GLN CG C 33.944 . . 98 24 54 GLN N N 119.930 . . 99 25 55 GLU H H 8.636 . . 100 25 55 GLU C C 176.670 . . 101 25 55 GLU CA C 57.121 . . 102 25 55 GLU CB C 30.033 . . 103 25 55 GLU CG C 36.412 . . 104 25 55 GLU N N 121.721 . . 105 26 56 GLU H H 8.435 . . 106 26 56 GLU CA C 56.487 . . 107 26 56 GLU CB C 30.316 . . 108 26 56 GLU N N 121.217 . . 109 27 57 GLU C C 176.682 . . 110 27 57 GLU CA C 56.653 . . 111 27 57 GLU CB C 30.420 . . 112 27 57 GLU CG C 36.361 . . 113 28 58 GLU H H 8.426 . . 114 28 58 GLU C C 176.479 . . 115 28 58 GLU CA C 56.863 . . 116 28 58 GLU CB C 30.415 . . 117 28 58 GLU CG C 36.283 . . 118 28 58 GLU N N 121.901 . . 119 29 59 ASP H H 8.404 . . 120 29 59 ASP C C 176.527 . . 121 29 59 ASP CA C 54.538 . . 122 29 59 ASP CB C 41.171 . . 123 29 59 ASP N N 121.377 . . 124 30 60 ALA H H 8.192 . . 125 30 60 ALA C C 178.329 . . 126 30 60 ALA CA C 53.478 . . 127 30 60 ALA CB C 18.807 . . 128 30 60 ALA N N 124.169 . . 129 31 61 TRP H H 8.088 . . 130 31 61 TRP C C 176.970 . . 131 31 61 TRP CA C 58.097 . . 132 31 61 TRP CB C 29.278 . . 133 31 61 TRP N N 119.004 . . 134 32 62 SER H H 7.936 . . 135 32 62 SER C C 175.280 . . 136 32 62 SER CA C 59.113 . . 137 32 62 SER CB C 63.611 . . 138 32 62 SER N N 116.494 . . 139 33 63 SER H H 8.268 . . 140 33 63 SER C C 175.243 . . 141 33 63 SER CA C 59.457 . . 142 33 63 SER CB C 63.624 . . 143 33 63 SER N N 117.928 . . 144 34 64 ALA H H 8.131 . . 145 34 64 ALA C C 178.557 . . 146 34 64 ALA CA C 53.417 . . 147 34 64 ALA CB C 18.801 . . 148 34 64 ALA N N 125.341 . . 149 35 65 LEU H H 7.939 . . 150 35 65 LEU C C 177.983 . . 151 35 65 LEU CA C 56.095 . . 152 35 65 LEU CB C 42.018 . . 153 35 65 LEU N N 119.492 . . 154 36 66 ASN H H 8.157 . . 155 36 66 ASN C C 175.506 . . 156 36 66 ASN CA C 53.893 . . 157 36 66 ASN CB C 38.751 . . 158 36 66 ASN N N 118.230 . . 159 37 67 ALA H H 8.007 . . 160 37 67 ALA C C 177.839 . . 161 37 67 ALA CA C 53.066 . . 162 37 67 ALA CB C 18.998 . . 163 37 67 ALA N N 123.367 . . 164 38 68 LEU H H 8.295 . . 165 38 68 LEU C C 174.778 . . 166 38 68 LEU CA C 54.100 . . 167 38 68 LEU CB C 37.886 . . 168 38 68 LEU N N 115.479 . . 169 39 69 LYS C C 176.708 . . 170 39 69 LYS CA C 56.493 . . 171 39 69 LYS CB C 32.950 . . 172 40 70 THR H H 8.012 . . 173 40 70 THR C C 173.889 . . 174 40 70 THR CA C 61.586 . . 175 40 70 THR CB C 70.031 . . 176 40 70 THR N N 114.589 . . 177 41 71 ALA H H 8.268 . . 178 41 71 ALA C C 175.377 . . 179 41 71 ALA CA C 50.748 . . 180 41 71 ALA CB C 18.220 . . 181 41 71 ALA N N 127.895 . . 182 47 77 PRO C C 176.581 . . 183 47 77 PRO CA C 62.796 . . 184 47 77 PRO CB C 31.991 . . 185 47 77 PRO CG C 27.389 . . 186 47 77 PRO CD C 50.531 . . 187 48 78 ALA H H 8.574 . . 188 48 78 ALA C C 177.208 . . 189 48 78 ALA CA C 52.278 . . 190 48 78 ALA CB C 19.576 . . 191 48 78 ALA N N 125.305 . . 192 49 79 THR H H 8.401 . . 193 49 79 THR C C 174.595 . . 194 49 79 THR CA C 60.680 . . 195 49 79 THR CB C 70.882 . . 196 49 79 THR CG2 C 21.709 . . 197 49 79 THR N N 115.565 . . 198 50 80 ILE H H 8.670 . . 199 50 80 ILE C C 175.360 . . 200 50 80 ILE CA C 62.471 . . 201 50 80 ILE CB C 38.544 . . 202 50 80 ILE CG1 C 29.319 . . 203 50 80 ILE CG2 C 16.706 . . 204 50 80 ILE CD1 C 14.423 . . 205 50 80 ILE N N 126.480 . . 206 51 81 ASP H H 9.682 . . 207 51 81 ASP C C 178.392 . . 208 51 81 ASP CA C 54.987 . . 209 51 81 ASP CB C 41.527 . . 210 51 81 ASP N N 130.015 . . 211 52 82 GLY H H 8.648 . . 212 52 82 GLY C C 175.132 . . 213 52 82 GLY CA C 47.049 . . 214 52 82 GLY N N 116.504 . . 215 53 83 GLN H H 7.354 . . 216 53 83 GLN C C 175.837 . . 217 53 83 GLN CA C 55.337 . . 218 53 83 GLN CB C 28.645 . . 219 53 83 GLN CG C 33.081 . . 220 53 83 GLN N N 114.359 . . 221 54 84 CYS H H 7.865 . . 222 54 84 CYS C C 175.214 . . 223 54 84 CYS CA C 55.631 . . 224 54 84 CYS CB C 26.651 . . 225 54 84 CYS N N 120.740 . . 226 55 85 PRO C C 177.766 . . 227 55 85 PRO CA C 64.828 . . 228 55 85 PRO CB C 32.140 . . 229 55 85 PRO CG C 27.605 . . 230 55 85 PRO CD C 52.507 . . 231 56 86 LEU H H 6.945 . . 232 56 86 LEU C C 177.437 . . 233 56 86 LEU CA C 55.470 . . 234 56 86 LEU CB C 41.198 . . 235 56 86 LEU CG C 25.517 . . 236 56 86 LEU N N 114.905 . . 237 57 87 SER H H 7.945 . . 238 57 87 SER C C 174.465 . . 239 57 87 SER CA C 60.449 . . 240 57 87 SER CB C 63.125 . . 241 57 87 SER N N 113.147 . . 242 58 88 ALA H H 7.181 . . 243 58 88 ALA C C 177.682 . . 244 58 88 ALA CA C 52.530 . . 245 58 88 ALA CB C 19.196 . . 246 58 88 ALA N N 122.588 . . 247 59 89 GLY H H 7.687 . . 248 59 89 GLY C C 172.962 . . 249 59 89 GLY CA C 44.344 . . 250 59 89 GLY N N 107.667 . . 251 60 90 PRO C C 177.216 . . 252 60 90 PRO CA C 64.088 . . 253 60 90 PRO CB C 32.241 . . 254 60 90 PRO CG C 26.966 . . 255 60 90 PRO CD C 50.336 . . 256 61 91 ASP H H 8.481 . . 257 61 91 ASP C C 175.363 . . 258 61 91 ASP CA C 54.140 . . 259 61 91 ASP CB C 41.042 . . 260 61 91 ASP N N 117.129 . . 261 62 92 ALA H H 7.443 . . 262 62 92 ALA C C 176.503 . . 263 62 92 ALA CA C 51.647 . . 264 62 92 ALA CB C 20.717 . . 265 62 92 ALA N N 122.858 . . 266 63 93 LYS H H 8.869 . . 267 63 93 LYS C C 174.864 . . 268 63 93 LYS CA C 54.935 . . 269 63 93 LYS CB C 35.581 . . 270 63 93 LYS CG C 23.216 . . 271 63 93 LYS CD C 29.301 . . 272 63 93 LYS N N 119.075 . . 273 64 94 VAL H H 8.746 . . 274 64 94 VAL C C 176.060 . . 275 64 94 VAL CA C 64.094 . . 276 64 94 VAL CB C 32.114 . . 277 64 94 VAL CG1 C 22.878 . . 278 64 94 VAL CG2 C 21.714 . . 279 64 94 VAL N N 122.759 . . 280 65 95 TYR H H 9.320 . . 281 65 95 TYR C C 172.765 . . 282 65 95 TYR CA C 58.600 . . 283 65 95 TYR CB C 40.461 . . 284 65 95 TYR N N 130.809 . . 285 66 96 GLU H H 8.498 . . 286 66 96 GLU C C 173.881 . . 287 66 96 GLU CA C 58.606 . . 288 66 96 GLU CB C 28.464 . . 289 66 96 GLU N N 125.204 . . 290 69 99 ASP C C 175.073 . . 291 69 99 ASP CA C 53.874 . . 292 69 99 ASP CB C 45.840 . . 293 70 100 CYS H H 9.229 . . 294 70 100 CYS C C 172.319 . . 295 70 100 CYS CA C 57.964 . . 296 70 100 CYS CB C 31.070 . . 297 70 100 CYS N N 120.879 . . 298 71 101 THR H H 8.893 . . 299 71 101 THR C C 172.405 . . 300 71 101 THR CA C 63.281 . . 301 71 101 THR CB C 70.185 . . 302 71 101 THR N N 120.924 . . 303 72 102 LEU H H 9.622 . . 304 72 102 LEU C C 177.994 . . 305 72 102 LEU CA C 52.025 . . 306 72 102 LEU CB C 44.899 . . 307 72 102 LEU N N 124.539 . . 308 73 103 ASN H H 9.401 . . 309 73 103 ASN C C 173.278 . . 310 73 103 ASN CA C 52.345 . . 311 73 103 ASN CB C 44.414 . . 312 73 103 ASN N N 120.131 . . 313 74 104 GLN H H 8.902 . . 314 74 104 GLN C C 174.724 . . 315 74 104 GLN CA C 55.445 . . 316 74 104 GLN CB C 30.866 . . 317 74 104 GLN CG C 34.342 . . 318 74 104 GLN N N 124.161 . . 319 75 105 THR H H 8.574 . . 320 75 105 THR C C 173.617 . . 321 75 105 THR CA C 61.682 . . 322 75 105 THR CB C 70.193 . . 323 75 105 THR N N 121.710 . . 324 76 106 ASN H H 8.571 . . 325 76 106 ASN C C 174.971 . . 326 76 106 ASN CA C 52.608 . . 327 76 106 ASN CB C 40.810 . . 328 76 106 ASN N N 123.252 . . 329 77 107 ILE C C 177.303 . . 330 77 107 ILE CA C 63.588 . . 331 77 107 ILE CB C 37.973 . . 332 78 108 SER H H 8.295 . . 333 78 108 SER C C 174.733 . . 334 78 108 SER CA C 58.515 . . 335 78 108 SER CB C 63.436 . . 336 78 108 SER N N 116.218 . . 337 79 109 ALA H H 8.205 . . 338 79 109 ALA C C 177.804 . . 339 79 109 ALA CA C 53.105 . . 340 79 109 ALA CB C 18.964 . . 341 79 109 ALA N N 125.295 . . 342 80 110 ASN H H 8.092 . . 343 80 110 ASN C C 176.668 . . 344 80 110 ASN CA C 53.675 . . 345 80 110 ASN N N 119.275 . . 346 81 111 ASN H H 8.074 . . 347 81 111 ASN C C 174.195 . . 348 81 111 ASN CA C 52.516 . . 349 81 111 ASN CB C 39.772 . . 350 81 111 ASN N N 116.646 . . 351 82 112 ASN H H 8.246 . . 352 82 112 ASN C C 175.150 . . 353 82 112 ASN CA C 53.635 . . 354 82 112 ASN CB C 39.107 . . 355 82 112 ASN N N 121.084 . . 356 83 113 LYS H H 8.729 . . 357 83 113 LYS C C 175.695 . . 358 83 113 LYS CA C 55.282 . . 359 83 113 LYS CB C 37.027 . . 360 83 113 LYS CG C 25.269 . . 361 83 113 LYS CD C 29.170 . . 362 83 113 LYS CE C 41.911 . . 363 83 113 LYS N N 121.044 . . 364 84 114 PHE H H 9.325 . . 365 84 114 PHE C C 174.581 . . 366 84 114 PHE CA C 55.312 . . 367 84 114 PHE CB C 44.104 . . 368 84 114 PHE N N 116.960 . . 369 85 115 TYR H H 8.981 . . 370 85 115 TYR C C 173.762 . . 371 85 115 TYR CA C 58.781 . . 372 85 115 TYR CB C 44.010 . . 373 85 115 TYR N N 125.849 . . 374 86 116 ILE H H 9.915 . . 375 86 116 ILE C C 175.006 . . 376 86 116 ILE CA C 61.066 . . 377 86 116 ILE CB C 42.276 . . 378 86 116 ILE CG1 C 29.316 . . 379 86 116 ILE CG2 C 16.450 . . 380 86 116 ILE N N 131.704 . . 381 87 117 ILE H H 8.727 . . 382 87 117 ILE C C 174.885 . . 383 87 117 ILE CA C 59.984 . . 384 87 117 ILE CB C 40.328 . . 385 87 117 ILE CG1 C 27.375 . . 386 87 117 ILE CG2 C 16.450 . . 387 87 117 ILE CD1 C 13.759 . . 388 87 117 ILE N N 124.809 . . 389 88 118 GLN H H 9.296 . . 390 88 118 GLN C C 174.359 . . 391 88 118 GLN CA C 55.090 . . 392 88 118 GLN CB C 35.505 . . 393 88 118 GLN N N 120.690 . . 394 89 119 LEU H H 8.867 . . 395 89 119 LEU C C 174.861 . . 396 89 119 LEU CA C 55.903 . . 397 89 119 LEU CB C 45.471 . . 398 89 119 LEU CG C 30.046 . . 399 89 119 LEU CD1 C 26.810 . . 400 89 119 LEU CD2 C 23.594 . . 401 89 119 LEU N N 128.022 . . 402 90 120 ILE H H 9.481 . . 403 90 120 ILE C C 174.277 . . 404 90 120 ILE CA C 59.464 . . 405 90 120 ILE CB C 40.926 . . 406 90 120 ILE CG1 C 28.229 . . 407 90 120 ILE CG2 C 18.696 . . 408 90 120 ILE CD1 C 14.883 . . 409 90 120 ILE N N 126.975 . . 410 91 121 GLU H H 9.337 . . 411 91 121 GLU C C 175.201 . . 412 91 121 GLU CA C 54.477 . . 413 91 121 GLU CB C 32.917 . . 414 91 121 GLU CG C 36.416 . . 415 91 121 GLU N N 128.498 . . 416 92 122 HIS H H 8.764 . . 417 92 122 HIS C C 175.285 . . 418 92 122 HIS CA C 54.054 . . 419 92 122 HIS CB C 29.793 . . 420 92 122 HIS N N 123.571 . . 421 93 123 GLY H H 9.038 . . 422 93 123 GLY C C 175.627 . . 423 93 123 GLY CA C 47.510 . . 424 93 123 GLY N N 116.409 . . 425 94 124 GLY H H 8.707 . . 426 94 124 GLY C C 173.276 . . 427 94 124 GLY CA C 45.077 . . 428 94 124 GLY N N 106.764 . . 429 95 125 THR H H 7.480 . . 430 95 125 THR C C 171.284 . . 431 95 125 THR CA C 60.074 . . 432 95 125 THR CB C 70.618 . . 433 95 125 THR N N 114.446 . . 434 96 126 TYR H H 8.400 . . 435 96 126 TYR C C 175.301 . . 436 96 126 TYR CA C 57.501 . . 437 96 126 TYR CB C 41.376 . . 438 96 126 TYR N N 119.219 . . 439 97 127 SER H H 9.321 . . 440 97 127 SER C C 175.028 . . 441 97 127 SER CA C 58.410 . . 442 97 127 SER CB C 68.092 . . 443 97 127 SER N N 117.157 . . 444 98 128 THR H H 9.717 . . 445 98 128 THR C C 173.514 . . 446 98 128 THR CA C 60.051 . . 447 98 128 THR CB C 71.587 . . 448 98 128 THR CG2 C 23.879 . . 449 98 128 THR N N 111.516 . . 450 99 129 TRP H H 9.795 . . 451 99 129 TRP C C 174.121 . . 452 99 129 TRP CA C 54.830 . . 453 99 129 TRP CB C 34.286 . . 454 99 129 TRP N N 125.153 . . 455 100 130 ASN H H 7.834 . . 456 100 130 ASN C C 172.132 . . 457 100 130 ASN CA C 50.072 . . 458 100 130 ASN CB C 43.607 . . 459 100 130 ASN N N 125.146 . . 460 101 131 ARG H H 8.208 . . 461 101 131 ARG C C 172.919 . . 462 101 131 ARG CA C 55.421 . . 463 101 131 ARG CB C 34.091 . . 464 101 131 ARG CG C 28.629 . . 465 101 131 ARG CD C 44.280 . . 466 101 131 ARG N N 123.097 . . 467 102 132 TRP H H 8.741 . . 468 102 132 TRP C C 172.857 . . 469 102 132 TRP CA C 56.654 . . 470 102 132 TRP CB C 33.035 . . 471 102 132 TRP N N 125.609 . . 472 103 133 GLY H H 6.585 . . 473 103 133 GLY C C 170.981 . . 474 103 133 GLY CA C 45.193 . . 475 103 133 GLY N N 105.570 . . 476 104 134 ARG H H 8.993 . . 477 104 134 ARG C C 176.586 . . 478 104 134 ARG CA C 55.573 . . 479 104 134 ARG CB C 31.443 . . 480 104 134 ARG N N 122.424 . . 481 105 135 VAL C C 177.036 . . 482 105 135 VAL CA C 66.092 . . 483 105 135 VAL CB C 31.586 . . 484 105 135 VAL CG1 C 20.944 . . 485 105 135 VAL CG2 C 22.431 . . 486 106 136 GLY H H 8.835 . . 487 106 136 GLY C C 174.231 . . 488 106 136 GLY CA C 44.774 . . 489 106 136 GLY N N 115.877 . . 490 107 137 GLU H H 8.480 . . 491 107 137 GLU C C 176.184 . . 492 107 137 GLU CA C 54.239 . . 493 107 137 GLU CB C 31.613 . . 494 107 137 GLU CG C 35.931 . . 495 107 137 GLU N N 120.319 . . 496 108 138 VAL H H 8.510 . . 497 108 138 VAL C C 177.447 . . 498 108 138 VAL CA C 65.700 . . 499 108 138 VAL CB C 31.914 . . 500 108 138 VAL CG1 C 21.353 . . 501 108 138 VAL CG2 C 22.445 . . 502 108 138 VAL N N 120.973 . . 503 109 139 GLY H H 7.922 . . 504 109 139 GLY C C 174.532 . . 505 109 139 GLY CA C 44.254 . . 506 109 139 GLY N N 103.582 . . 507 110 140 GLN H H 7.837 . . 508 110 140 GLN C C 172.827 . . 509 110 140 GLN CA C 54.033 . . 510 110 140 GLN CB C 31.874 . . 511 110 140 GLN CG C 34.514 . . 512 110 140 GLN N N 119.271 . . 513 111 141 SER H H 7.845 . . 514 111 141 SER C C 174.381 . . 515 111 141 SER CA C 56.910 . . 516 111 141 SER CB C 67.837 . . 517 111 141 SER N N 109.758 . . 518 112 142 LYS H H 8.356 . . 519 112 142 LYS C C 173.771 . . 520 112 142 LYS CA C 56.609 . . 521 112 142 LYS CB C 36.655 . . 522 112 142 LYS CG C 24.771 . . 523 112 142 LYS CD C 29.087 . . 524 112 142 LYS CE C 42.206 . . 525 112 142 LYS N N 118.124 . . 526 113 143 LEU H H 9.132 . . 527 113 143 LEU C C 175.239 . . 528 113 143 LEU CA C 53.664 . . 529 113 143 LEU CB C 44.343 . . 530 113 143 LEU CG C 26.432 . . 531 113 143 LEU CD1 C 24.152 . . 532 113 143 LEU N N 131.622 . . 533 114 144 LEU H H 9.499 . . 534 114 144 LEU C C 173.134 . . 535 114 144 LEU CA C 51.337 . . 536 114 144 LEU CB C 44.595 . . 537 114 144 LEU N N 130.641 . . 538 117 147 THR C C 174.432 . . 539 117 147 THR CA C 62.572 . . 540 117 147 THR CB C 69.353 . . 541 117 147 THR CG2 C 22.098 . . 542 118 148 SER H H 7.589 . . 543 118 148 SER C C 173.345 . . 544 118 148 SER CA C 56.541 . . 545 118 148 SER CB C 66.167 . . 546 118 148 SER N N 112.841 . . 547 119 149 LEU H H 8.674 . . 548 119 149 LEU C C 177.896 . . 549 119 149 LEU CA C 57.206 . . 550 119 149 LEU CB C 40.164 . . 551 119 149 LEU CG C 25.352 . . 552 119 149 LEU CD1 C 20.552 . . 553 119 149 LEU N N 125.021 . . 554 120 150 GLU H H 8.380 . . 555 120 150 GLU C C 178.548 . . 556 120 150 GLU CA C 60.078 . . 557 120 150 GLU CB C 28.933 . . 558 120 150 GLU CG C 36.447 . . 559 120 150 GLU N N 117.247 . . 560 121 151 ALA H H 7.680 . . 561 121 151 ALA C C 179.385 . . 562 121 151 ALA CA C 54.800 . . 563 121 151 ALA CB C 18.809 . . 564 121 151 ALA N N 120.905 . . 565 122 152 ALA H H 7.224 . . 566 122 152 ALA C C 178.632 . . 567 122 152 ALA CA C 54.367 . . 568 122 152 ALA CB C 18.179 . . 569 122 152 ALA N N 122.928 . . 570 123 153 LYS H H 8.484 . . 571 123 153 LYS C C 178.597 . . 572 123 153 LYS CA C 60.303 . . 573 123 153 LYS CB C 32.855 . . 574 123 153 LYS CG C 25.538 . . 575 123 153 LYS CD C 30.476 . . 576 123 153 LYS CE C 41.658 . . 577 123 153 LYS N N 117.908 . . 578 124 154 LYS H H 7.680 . . 579 124 154 LYS HZ H 6.579 . . 580 124 154 LYS C C 179.338 . . 581 124 154 LYS CA C 59.764 . . 582 124 154 LYS CB C 32.121 . . 583 124 154 LYS CG C 25.524 . . 584 124 154 LYS CD C 29.224 . . 585 124 154 LYS CE C 42.297 . . 586 124 154 LYS N N 117.087 . . 587 124 154 LYS NZ N 117.271 . . 588 125 155 ASP H H 7.347 . . 589 125 155 ASP C C 177.742 . . 590 125 155 ASP CA C 58.643 . . 591 125 155 ASP CB C 44.720 . . 592 125 155 ASP N N 120.189 . . 593 126 156 PHE H H 8.199 . . 594 126 156 PHE C C 177.228 . . 595 126 156 PHE CA C 61.790 . . 596 126 156 PHE CB C 40.144 . . 597 126 156 PHE N N 119.763 . . 598 127 157 GLU H H 9.181 . . 599 127 157 GLU C C 180.227 . . 600 127 157 GLU CA C 60.679 . . 601 127 157 GLU CB C 29.667 . . 602 127 157 GLU CG C 38.274 . . 603 127 157 GLU N N 117.203 . . 604 128 158 LYS H H 8.548 . . 605 128 158 LYS C C 178.454 . . 606 128 158 LYS CA C 60.133 . . 607 128 158 LYS CB C 32.297 . . 608 128 158 LYS CG C 24.851 . . 609 128 158 LYS CD C 29.578 . . 610 128 158 LYS CE C 42.041 . . 611 128 158 LYS N N 122.998 . . 612 129 159 LYS H H 7.843 . . 613 129 159 LYS C C 178.105 . . 614 129 159 LYS CA C 58.588 . . 615 129 159 LYS CB C 30.915 . . 616 129 159 LYS CG C 25.419 . . 617 129 159 LYS CD C 27.516 . . 618 129 159 LYS N N 120.996 . . 619 130 160 PHE H H 8.422 . . 620 130 160 PHE C C 179.038 . . 621 130 160 PHE CA C 63.379 . . 622 130 160 PHE CB C 40.069 . . 623 130 160 PHE N N 118.501 . . 624 131 161 TRP C C 179.074 . . 625 131 161 TRP CA C 60.223 . . 626 131 161 TRP CB C 29.021 . . 627 132 162 GLU H H 8.994 . . 628 132 162 GLU C C 178.915 . . 629 132 162 GLU CA C 59.486 . . 630 132 162 GLU CB C 29.548 . . 631 132 162 GLU CG C 36.705 . . 632 132 162 GLU N N 120.810 . . 633 133 163 LYS H H 7.676 . . 634 133 163 LYS C C 177.700 . . 635 133 163 LYS CA C 55.738 . . 636 133 163 LYS CB C 31.915 . . 637 133 163 LYS CG C 23.012 . . 638 133 163 LYS CD C 26.793 . . 639 133 163 LYS N N 111.406 . . 640 134 164 THR H H 7.755 . . 641 134 164 THR C C 176.215 . . 642 134 164 THR CA C 62.272 . . 643 134 164 THR CB C 72.420 . . 644 134 164 THR CG2 C 21.305 . . 645 134 164 THR N N 106.268 . . 646 135 165 LYS H H 9.028 . . 647 135 165 LYS C C 173.687 . . 648 135 165 LYS CA C 57.183 . . 649 135 165 LYS CB C 31.272 . . 650 135 165 LYS N N 124.032 . . 651 136 166 ASN H H 8.235 . . 652 136 166 ASN C C 173.399 . . 653 136 166 ASN CA C 52.461 . . 654 136 166 ASN CB C 42.939 . . 655 136 166 ASN N N 114.844 . . 656 137 167 ARG H H 9.122 . . 657 137 167 ARG C C 179.030 . . 658 137 167 ARG CA C 54.958 . . 659 137 167 ARG CB C 30.058 . . 660 137 167 ARG CG C 27.320 . . 661 137 167 ARG CD C 43.123 . . 662 137 167 ARG N N 118.709 . . 663 138 168 TRP H H 9.944 . . 664 138 168 TRP C C 178.953 . . 665 138 168 TRP CA C 60.179 . . 666 138 168 TRP CB C 30.299 . . 667 138 168 TRP N N 127.491 . . 668 139 169 ALA C C 177.607 . . 669 139 169 ALA CA C 54.010 . . 670 139 169 ALA CB C 18.583 . . 671 140 170 ALA H H 7.737 . . 672 140 170 ALA C C 178.884 . . 673 140 170 ALA CA C 51.228 . . 674 140 170 ALA CB C 19.186 . . 675 140 170 ALA N N 120.071 . . 676 141 171 ARG H H 7.406 . . 677 141 171 ARG C C 175.986 . . 678 141 171 ARG CA C 59.353 . . 679 141 171 ARG CB C 28.492 . . 680 141 171 ARG CG C 24.835 . . 681 141 171 ARG CD C 41.928 . . 682 141 171 ARG N N 119.096 . . 683 142 172 ASP H H 8.612 . . 684 142 172 ASP C C 176.074 . . 685 142 172 ASP CA C 55.837 . . 686 142 172 ASP CB C 39.756 . . 687 142 172 ASP N N 120.091 . . 688 143 173 ASN H H 8.187 . . 689 143 173 ASN C C 173.299 . . 690 143 173 ASN CA C 51.920 . . 691 143 173 ASN CB C 39.343 . . 692 143 173 ASN N N 120.870 . . 693 144 174 PHE H H 7.446 . . 694 144 174 PHE C C 175.645 . . 695 144 174 PHE CA C 59.522 . . 696 144 174 PHE CB C 40.355 . . 697 144 174 PHE N N 121.122 . . 698 145 175 VAL H H 8.340 . . 699 145 175 VAL C C 175.186 . . 700 145 175 VAL CA C 61.441 . . 701 145 175 VAL CB C 34.137 . . 702 145 175 VAL CG1 C 20.841 . . 703 145 175 VAL N N 129.990 . . 704 146 176 ALA H H 8.900 . . 705 146 176 ALA C C 177.619 . . 706 146 176 ALA CA C 52.801 . . 707 146 176 ALA CB C 18.487 . . 708 146 176 ALA N N 132.387 . . 709 147 177 GLN H H 9.318 . . 710 147 177 GLN C C 174.589 . . 711 147 177 GLN CA C 51.710 . . 712 147 177 GLN CB C 28.628 . . 713 147 177 GLN N N 123.078 . . 714 148 178 PRO C C 178.094 . . 715 148 178 PRO CA C 64.054 . . 716 148 178 PRO CB C 31.701 . . 717 148 178 PRO CG C 27.646 . . 718 149 179 GLY H H 8.963 . . 719 149 179 GLY C C 174.217 . . 720 149 179 GLY CA C 45.698 . . 721 149 179 GLY N N 112.270 . . 722 150 180 LYS H H 7.553 . . 723 150 180 LYS C C 176.533 . . 724 150 180 LYS CA C 52.688 . . 725 150 180 LYS CB C 31.732 . . 726 150 180 LYS CG C 24.095 . . 727 150 180 LYS CD C 27.053 . . 728 150 180 LYS N N 118.103 . . 729 151 181 TYR H H 8.479 . . 730 151 181 TYR C C 176.071 . . 731 151 181 TYR CA C 58.701 . . 732 151 181 TYR CB C 39.810 . . 733 151 181 TYR N N 118.334 . . 734 152 182 THR H H 9.675 . . 735 152 182 THR C C 173.057 . . 736 152 182 THR CA C 60.124 . . 737 152 182 THR CB C 70.896 . . 738 152 182 THR N N 112.620 . . 739 153 183 LEU H H 6.042 . . 740 153 183 LEU C C 176.248 . . 741 153 183 LEU CA C 54.936 . . 742 153 183 LEU CB C 43.367 . . 743 153 183 LEU N N 124.737 . . 744 154 184 ILE H H 8.402 . . 745 154 184 ILE C C 175.475 . . 746 154 184 ILE CA C 60.613 . . 747 154 184 ILE CB C 38.444 . . 748 154 184 ILE CG1 C 27.068 . . 749 154 184 ILE CG2 C 17.510 . . 750 154 184 ILE CD1 C 12.544 . . 751 154 184 ILE N N 124.201 . . 752 155 185 GLU H H 8.557 . . 753 155 185 GLU C C 176.083 . . 754 155 185 GLU CA C 56.338 . . 755 155 185 GLU CB C 30.824 . . 756 155 185 GLU CG C 36.526 . . 757 155 185 GLU N N 125.460 . . 758 156 186 VAL H H 8.325 . . 759 156 186 VAL C C 175.832 . . 760 156 186 VAL CA C 62.299 . . 761 156 186 VAL CB C 32.887 . . 762 156 186 VAL CG1 C 21.076 . . 763 156 186 VAL CG2 C 20.704 . . 764 156 186 VAL N N 122.531 . . 765 157 187 GLN H H 8.573 . . 766 157 187 GLN C C 174.025 . . 767 157 187 GLN CA C 53.537 . . 768 157 187 GLN CB C 28.940 . . 769 157 187 GLN N N 125.682 . . 770 158 188 PRO C C 177.575 . . 771 158 188 PRO CA C 63.464 . . 772 158 188 PRO CB C 32.125 . . 773 158 188 PRO CG C 27.536 . . 774 158 188 PRO CD C 50.824 . . 775 159 189 GLY H H 8.556 . . 776 159 189 GLY C C 174.070 . . 777 159 189 GLY CA C 45.296 . . 778 159 189 GLY N N 109.743 . . 779 160 190 ALA H H 8.203 . . 780 160 190 ALA C C 178.446 . . 781 160 190 ALA CA C 52.789 . . 782 160 190 ALA CB C 19.329 . . 783 160 190 ALA N N 123.754 . . 784 161 191 GLY H H 8.557 . . 785 161 191 GLY C C 174.317 . . 786 161 191 GLY CA C 45.466 . . 787 161 191 GLY N N 108.550 . . 788 162 192 GLN H H 8.214 . . 789 162 192 GLN C C 176.003 . . 790 162 192 GLN CA C 55.879 . . 791 162 192 GLN CB C 29.611 . . 792 162 192 GLN CG C 33.878 . . 793 162 192 GLN N N 119.532 . . 794 163 193 GLU H H 8.606 . . 795 163 193 GLU C C 176.563 . . 796 163 193 GLU CA C 56.876 . . 797 163 193 GLU CB C 30.041 . . 798 163 193 GLU CG C 33.878 . . 799 163 193 GLU N N 122.282 . . 800 164 194 VAL H H 8.162 . . 801 164 194 VAL C C 175.743 . . 802 164 194 VAL CA C 62.359 . . 803 164 194 VAL CB C 32.805 . . 804 164 194 VAL CG1 C 20.674 . . 805 164 194 VAL CG2 C 21.023 . . 806 164 194 VAL N N 121.317 . . 807 165 195 ALA H H 8.327 . . 808 165 195 ALA C C 177.317 . . 809 165 195 ALA CA C 52.375 . . 810 165 195 ALA CB C 19.275 . . 811 165 195 ALA N N 127.605 . . 812 166 196 LEU H H 8.156 . . 813 166 196 LEU C C 176.943 . . 814 166 196 LEU CA C 55.018 . . 815 166 196 LEU CB C 42.549 . . 816 166 196 LEU CG C 27.088 . . 817 166 196 LEU CD1 C 23.784 . . 818 166 196 LEU N N 121.873 . . 819 167 197 ARG H H 8.298 . . 820 167 197 ARG C C 175.937 . . 821 167 197 ARG CA C 55.975 . . 822 167 197 ARG CB C 31.043 . . 823 167 197 ARG CG C 27.182 . . 824 167 197 ARG CD C 43.401 . . 825 167 197 ARG N N 123.053 . . 826 168 198 VAL H H 8.341 . . 827 168 198 VAL C C 174.916 . . 828 168 198 VAL CA C 61.994 . . 829 168 198 VAL CB C 32.976 . . 830 168 198 VAL CG1 C 19.944 . . 831 168 198 VAL CG2 C 21.323 . . 832 168 198 VAL N N 121.959 . . 833 169 199 ASP H H 8.017 . . 834 169 199 ASP C C 180.758 . . 835 169 199 ASP CA C 55.907 . . 836 169 199 ASP CB C 42.386 . . 837 169 199 ASP N N 129.264 . . stop_ save_