data_19351 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Acetylated alpha synuclein A53T familiar mutant in PBS ; _BMRB_accession_number 19351 _BMRB_flat_file_name bmr19351.str _Entry_type original _Submission_date 2013-07-09 _Accession_date 2013-07-09 _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 Baum Jean . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 133 "13C chemical shifts" 400 "15N chemical shifts" 133 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-09-25 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 19337 'aSyn monomer' 19338 'aSyn A53T monomer' 19344 'aSyn S87N monomer' 19345 'aSyn A53T&S87N monomer' 19346 'aSyn mouse monomer' 19347 'aSyn mouse_T53A monomer' 19348 'aSyn mouse_N87S monomer' 19349 'aSyn mouse_T53A&N87S monomer' 19350 'acetylated aSyn monomer' stop_ _Original_release_date 2013-09-25 save_ ############################# # Citation for this entry # ############################# save_acet_asyn_A53T_PBS _Saveframe_category entry_citation _Citation_full . _Citation_title 'Mechanistic Insight into the Relationship between N-Terminal Acetylation of -Synuclein and Fibril Formation Rates by NMR and Fluorescence.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 24058647 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kang Lijuan . . 2 Janowska Maria K. . 3 Moriarty Gina M. . 4 Baum Jean . . stop_ _Journal_abbreviation 'PLoS ONE' _Journal_name_full 'PloS one' _Journal_volume 8 _Journal_issue 9 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first e75018 _Page_last e75018 _Year 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'acetylated aSyn A53T monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'acetylated aSyn A53T monomer' $acet_aSyn_A53T stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_acet_aSyn_A53T _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common acet_aSyn_A53T _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 140 _Mol_residue_sequence ; MDVFMKGLSKAKEGVVAAAE KTKQGVAEAAGKTKEGVLYV GSKTKEGVVHGVTTVAEKTK EQVTNVGGAVVTGVTAVAQK TVEGAGSIAAATGFVKKDQL GKNEEGAPQEGILEDMPVDP DNEAYEMPSEEGYQDYEPEA ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ASP 3 VAL 4 PHE 5 MET 6 LYS 7 GLY 8 LEU 9 SER 10 LYS 11 ALA 12 LYS 13 GLU 14 GLY 15 VAL 16 VAL 17 ALA 18 ALA 19 ALA 20 GLU 21 LYS 22 THR 23 LYS 24 GLN 25 GLY 26 VAL 27 ALA 28 GLU 29 ALA 30 ALA 31 GLY 32 LYS 33 THR 34 LYS 35 GLU 36 GLY 37 VAL 38 LEU 39 TYR 40 VAL 41 GLY 42 SER 43 LYS 44 THR 45 LYS 46 GLU 47 GLY 48 VAL 49 VAL 50 HIS 51 GLY 52 VAL 53 THR 54 THR 55 VAL 56 ALA 57 GLU 58 LYS 59 THR 60 LYS 61 GLU 62 GLN 63 VAL 64 THR 65 ASN 66 VAL 67 GLY 68 GLY 69 ALA 70 VAL 71 VAL 72 THR 73 GLY 74 VAL 75 THR 76 ALA 77 VAL 78 ALA 79 GLN 80 LYS 81 THR 82 VAL 83 GLU 84 GLY 85 ALA 86 GLY 87 SER 88 ILE 89 ALA 90 ALA 91 ALA 92 THR 93 GLY 94 PHE 95 VAL 96 LYS 97 LYS 98 ASP 99 GLN 100 LEU 101 GLY 102 LYS 103 ASN 104 GLU 105 GLU 106 GLY 107 ALA 108 PRO 109 GLN 110 GLU 111 GLY 112 ILE 113 LEU 114 GLU 115 ASP 116 MET 117 PRO 118 VAL 119 ASP 120 PRO 121 ASP 122 ASN 123 GLU 124 ALA 125 TYR 126 GLU 127 MET 128 PRO 129 SER 130 GLU 131 GLU 132 GLY 133 TYR 134 GLN 135 ASP 136 TYR 137 GLU 138 PRO 139 GLU 140 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-04 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 BMRB 16300 alpha-synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 16302 alpha-synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 16342 human_a-synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 16543 "monomer alpha-synuclein" 100.00 140 99.29 99.29 4.06e-89 BMRB 16546 A30P_alpha-synuclein 100.00 140 98.57 98.57 3.30e-88 BMRB 16547 E46K_alpha-synuclein 100.00 140 98.57 99.29 2.02e-88 BMRB 16548 A53T_alpha-synuclein 100.00 140 100.00 100.00 7.56e-90 BMRB 16904 alpha-synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 16939 WT_alpha-synuclein_fibrils 100.00 140 98.57 98.57 7.49e-88 BMRB 17214 A30P_alpha-synuclein 100.00 140 98.57 98.57 3.30e-88 BMRB 17498 alpha-synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 17648 A30P_alpha-synuclein 100.00 140 97.86 97.86 7.50e-87 BMRB 17649 A53T_alpha-synuclein_fibrils 100.00 140 99.29 99.29 1.35e-88 BMRB 17654 E46K_alpha-synuclein_fibrils 100.00 140 97.86 98.57 3.17e-87 BMRB 17665 aSyn 100.00 150 99.29 99.29 2.26e-88 BMRB 17910 wild-type_alpha-synuclein_formed_in_phospholipid_vesicles 100.00 140 98.57 98.57 7.49e-88 BMRB 18207 A53T_alpha-synuclein_fibrils 100.00 140 99.29 99.29 1.35e-88 BMRB 18208 E46K_alpha-synuclein_fibrils 100.00 140 97.86 98.57 3.17e-87 BMRB 18243 alpha-synuclein_fibrils 100.00 140 98.57 98.57 7.49e-88 BMRB 18857 alpha_synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 18860 a-synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 19257 Alpha-synuclein 100.00 140 99.29 99.29 4.06e-89 BMRB 19337 aSyn 100.00 140 99.29 99.29 4.06e-89 BMRB 19338 aSyn_A53T 100.00 140 100.00 100.00 7.56e-90 BMRB 19344 aSyn_S87N 100.00 140 98.57 99.29 2.00e-88 BMRB 19345 aSyn_A53T&S87N 100.00 140 99.29 100.00 2.77e-89 BMRB 19350 acet_aSyn 100.00 140 99.29 99.29 4.06e-89 BMRB 25227 aSyn-WT 100.00 140 99.29 99.29 4.06e-89 BMRB 25228 H50Q 100.00 140 98.57 98.57 7.49e-88 PDB 1XQ8 "Human Micelle-Bound Alpha-Synuclein" 100.00 140 99.29 99.29 4.06e-89 PDB 2KKW "Slas-Micelle Bound Alpha-Synuclein" 100.00 140 99.29 99.29 4.06e-89 DBJ BAB29375 "unnamed protein product [Mus musculus]" 72.86 122 98.04 100.00 4.98e-57 DBJ BAF82858 "unnamed protein product [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 DBJ BAG73790 "synuclein, alpha [synthetic construct]" 100.00 140 99.29 99.29 4.06e-89 EMBL CAG33339 "SNCA [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 EMBL CAG46454 "SNCA [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 GB AAA16117 "AD amyloid [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 GB AAC02114 "NACP/alpha-synuclein [Homo sapiens]" 100.00 140 97.86 97.86 2.52e-87 GB AAG30302 "SNCA isoform NACP140 [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 GB AAH13293 "Synuclein, alpha (non A4 component of amyloid precursor) [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 GB AAI08276 "Synuclein, alpha (non A4 component of amyloid precursor) [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 REF NP_000336 "alpha-synuclein isoform NACP140 [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 REF NP_001009158 "alpha-synuclein [Pan troglodytes]" 100.00 140 99.29 99.29 4.06e-89 REF NP_001032222 "alpha-synuclein [Sus scrofa]" 100.00 140 98.57 98.57 2.81e-87 REF NP_001129014 "alpha-synuclein [Pongo abelii]" 100.00 140 98.57 98.57 8.83e-88 REF NP_001139526 "alpha-synuclein isoform NACP140 [Homo sapiens]" 100.00 140 99.29 99.29 4.06e-89 SP P37840 "RecName: Full=Alpha-synuclein; AltName: Full=Non-A beta component of AD amyloid; AltName: Full=Non-A4 component of amyloid prec" 100.00 140 99.29 99.29 4.06e-89 SP P61139 "RecName: Full=Alpha-synuclein" 100.00 140 98.57 99.29 1.06e-88 SP P61140 "RecName: Full=Alpha-synuclein" 100.00 140 99.29 99.29 4.06e-89 SP P61142 "RecName: Full=Alpha-synuclein" 100.00 140 97.86 99.29 1.49e-88 SP P61143 "RecName: Full=Alpha-synuclein" 100.00 140 97.86 99.29 1.49e-88 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Details $acet_aSyn_A53T Human 9606 Eukaryota Metazoa Homo sapiens 'acetylated alpha synuclein A53T familiar mutant' 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 _Details $acet_aSyn_A53T 'recombinant technology' . Escherichia coli . p7-T7 'coexpressed with NatB plasmid expressing acetylotransferase - resulting in N-terminally acetylated protein' 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 $acet_aSyn_A53T 350 uM '[U-100% 13C; U-100% 15N]' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' Phosphate 10 mM 'natural abundance' NaCl 138 mM 'natural abundance' KCl 2 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _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_1 save_ save_3D_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNN_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNN' _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_ save_NMR_spectrometer_expt _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . 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' 150 . mM pH 7.4 . pH pressure 1 . atm temperature 273 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 . 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 HNCACB' '3D HN(CA)CO' '3D HNN' 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 'acetylated aSyn A53T monomer' _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 1 MET H H 8.456 0.02 1 2 1 1 MET C C 176.561 0.1 1 3 1 1 MET CA C 55.921 0.1 1 4 1 1 MET CB C 32.908 0.1 1 5 1 1 MET N N 125.874 0.07 1 6 2 2 ASP H H 8.535 0.02 1 7 2 2 ASP C C 176.684 0.1 1 8 2 2 ASP CA C 54.596 0.1 1 9 2 2 ASP CB C 40.827 0.1 1 10 2 2 ASP N N 120.943 0.07 1 11 3 3 VAL H H 7.919 0.02 1 12 3 3 VAL C C 176.492 0.1 1 13 3 3 VAL CA C 63.166 0.1 1 14 3 3 VAL CB C 32.343 0.1 1 15 3 3 VAL N N 119.459 0.07 1 16 4 4 PHE H H 8.216 0.02 1 17 4 4 PHE C C 176.308 0.1 1 18 4 4 PHE CA C 58.497 0.1 1 19 4 4 PHE CB C 39.166 0.1 1 20 4 4 PHE N N 122.609 0.07 1 21 5 5 MET H H 8.227 0.02 1 22 5 5 MET C C 176.423 0.1 1 23 5 5 MET CA C 55.769 0.1 1 24 5 5 MET CB C 32.199 0.1 1 25 5 5 MET N N 121.125 0.07 1 26 6 6 LYS H H 8.227 0.02 1 27 6 6 LYS C C 177.374 0.1 1 28 6 6 LYS CA C 57.169 0.1 1 29 6 6 LYS CB C 32.737 0.1 1 30 6 6 LYS N N 121.967 0.07 1 31 7 7 GLY H H 8.364 0.02 1 32 7 7 GLY C C 174.366 0.1 1 33 7 7 GLY CA C 45.484 0.1 1 34 7 7 GLY N N 109.460 0.07 1 35 8 8 LEU H H 8.013 0.02 1 36 8 8 LEU C C 177.729 0.1 1 37 8 8 LEU CA C 55.272 0.1 1 38 8 8 LEU CB C 42.488 0.1 1 39 8 8 LEU N N 121.508 0.07 1 40 9 9 SER H H 8.307 0.02 1 41 9 9 SER C C 174.666 0.1 1 42 9 9 SER CA C 58.475 0.1 1 43 9 9 SER CB C 63.677 0.1 1 44 9 9 SER N N 116.514 0.07 1 45 10 10 LYS C C 176.501 0.1 1 46 10 10 LYS CA C 56.323 0.1 1 47 10 10 LYS CB C 32.986 0.1 1 48 11 11 ALA H H 8.314 0.02 1 49 11 11 ALA C C 177.962 0.1 1 50 11 11 ALA CA C 52.776 0.1 1 51 11 11 ALA CB C 19.150 0.1 1 52 11 11 ALA N N 125.227 0.07 1 53 12 12 LYS H H 8.343 0.02 1 54 12 12 LYS C C 176.700 0.1 1 55 12 12 LYS CA C 56.427 0.1 1 56 12 12 LYS CB C 32.967 0.1 1 57 12 12 LYS N N 120.876 0.07 1 58 13 13 GLU H H 8.448 0.02 1 59 13 13 GLU C C 176.633 0.1 1 60 13 13 GLU CA C 56.706 0.1 1 61 13 13 GLU CB C 30.449 0.1 1 62 13 13 GLU N N 122.150 0.07 1 63 14 14 GLY H H 8.489 0.02 1 64 14 14 GLY C C 173.765 0.1 1 65 14 14 GLY CA C 45.348 0.1 1 66 14 14 GLY N N 110.029 0.07 1 67 15 15 VAL H H 8.000 0.02 1 68 15 15 VAL C C 176.490 0.1 1 69 15 15 VAL CA C 62.622 0.1 1 70 15 15 VAL CB C 32.745 0.1 1 71 15 15 VAL N N 120.198 0.07 1 72 16 16 VAL H H 8.333 0.02 1 73 16 16 VAL C C 175.994 0.1 1 74 16 16 VAL CA C 62.532 0.1 1 75 16 16 VAL CB C 32.772 0.1 1 76 16 16 VAL N N 125.187 0.07 1 77 17 17 ALA H H 8.471 0.02 1 78 17 17 ALA C C 177.679 0.1 1 79 17 17 ALA CA C 52.549 0.1 1 80 17 17 ALA CB C 19.147 0.1 1 81 17 17 ALA N N 128.488 0.07 1 82 18 18 ALA H H 8.341 0.02 1 83 18 18 ALA C C 177.903 0.1 1 84 18 18 ALA CA C 52.668 0.1 1 85 18 18 ALA CB C 19.176 0.1 1 86 18 18 ALA N N 123.760 0.07 1 87 19 19 ALA H H 8.295 0.02 1 88 19 19 ALA C C 178.220 0.1 1 89 19 19 ALA CA C 52.749 0.1 1 90 19 19 ALA CB C 19.172 0.1 1 91 19 19 ALA N N 123.207 0.07 1 92 20 20 GLU H H 8.357 0.02 1 93 20 20 GLU C C 176.960 0.1 1 94 20 20 GLU CA C 56.874 0.1 1 95 20 20 GLU CB C 30.284 0.1 1 96 20 20 GLU N N 120.138 0.07 1 97 21 21 LYS H H 8.363 0.02 1 98 21 21 LYS C C 177.148 0.1 1 99 21 21 LYS CA C 56.803 0.1 1 100 21 21 LYS CB C 32.874 0.1 1 101 21 21 LYS N N 122.313 0.07 1 102 22 22 THR H H 8.162 0.02 1 103 22 22 THR C C 174.650 0.1 1 104 22 22 THR CA C 62.246 0.1 1 105 22 22 THR CB C 69.737 0.1 1 106 22 22 THR N N 115.300 0.07 1 107 23 23 LYS H H 8.377 0.02 1 108 23 23 LYS C C 176.715 0.1 1 109 23 23 LYS CA C 56.654 0.1 1 110 23 23 LYS CB C 32.958 0.1 1 111 23 23 LYS N N 123.817 0.07 1 112 24 24 GLN H H 8.454 0.02 1 113 24 24 GLN C C 177.032 0.1 1 114 24 24 GLN CA C 56.360 0.1 1 115 24 24 GLN CB C 29.480 0.1 1 116 24 24 GLN N N 121.838 0.07 1 117 25 25 GLY H H 8.516 0.02 1 118 25 25 GLY C C 174.252 0.1 1 119 25 25 GLY CA C 45.342 0.1 1 120 25 25 GLY N N 110.585 0.07 1 121 26 26 VAL H H 8.042 0.02 1 122 26 26 VAL C C 176.368 0.1 1 123 26 26 VAL CA C 62.472 0.1 1 124 26 26 VAL CB C 32.794 0.1 1 125 26 26 VAL N N 119.798 0.07 1 126 27 27 ALA H H 8.454 0.02 1 127 27 27 ALA C C 178.144 0.1 1 128 27 27 ALA CA C 52.844 0.1 1 129 27 27 ALA CB C 19.097 0.1 1 130 27 27 ALA N N 127.459 0.07 1 131 28 28 GLU H H 8.431 0.02 1 132 28 28 GLU C C 176.654 0.1 1 133 28 28 GLU CA C 56.887 0.1 1 134 28 28 GLU CB C 30.231 0.1 1 135 28 28 GLU N N 120.637 0.07 1 136 29 29 ALA H H 8.329 0.02 1 137 29 29 ALA C C 177.755 0.1 1 138 29 29 ALA CA C 52.704 0.1 1 139 29 29 ALA CB C 19.184 0.1 1 140 29 29 ALA N N 124.989 0.07 1 141 30 30 ALA H H 8.267 0.02 1 142 30 30 ALA C C 178.477 0.1 1 143 30 30 ALA CA C 52.834 0.1 1 144 30 30 ALA CB C 19.077 0.1 1 145 30 30 ALA N N 123.121 0.07 1 146 31 31 GLY H H 8.343 0.02 1 147 31 31 GLY C C 174.210 0.1 1 148 31 31 GLY CA C 45.366 0.1 1 149 31 31 GLY N N 107.837 0.07 1 150 32 32 LYS H H 8.142 0.02 1 151 32 32 LYS C C 176.999 0.1 1 152 32 32 LYS CA C 56.276 0.1 1 153 32 32 LYS CB C 33.299 0.1 1 154 32 32 LYS N N 120.760 0.07 1 155 33 33 THR H H 8.254 0.02 1 156 33 33 THR C C 174.667 0.1 1 157 33 33 THR CA C 61.903 0.1 1 158 33 33 THR CB C 69.906 0.1 1 159 33 33 THR N N 115.656 0.07 1 160 34 34 LYS H H 8.476 0.02 1 161 34 34 LYS C C 176.716 0.1 1 162 34 34 LYS CA C 56.444 0.1 1 163 34 34 LYS CB C 33.129 0.1 1 164 34 34 LYS N N 123.861 0.07 1 165 35 35 GLU H H 8.474 0.02 1 166 35 35 GLU C C 177.007 0.1 1 167 35 35 GLU CA C 56.873 0.1 1 168 35 35 GLU CB C 30.294 0.1 1 169 35 35 GLU N N 122.095 0.07 1 170 36 36 GLY H H 8.477 0.02 1 171 36 36 GLY C C 174.011 0.1 1 172 36 36 GLY CA C 45.368 0.1 1 173 36 36 GLY N N 110.083 0.07 1 174 37 37 VAL H H 7.934 0.02 1 175 37 37 VAL C C 175.939 0.1 1 176 37 37 VAL CA C 62.402 0.1 1 177 37 37 VAL CB C 32.872 0.1 1 178 37 37 VAL N N 119.601 0.07 1 179 38 38 LEU H H 8.311 0.02 1 180 38 38 LEU C C 176.658 0.1 1 181 38 38 LEU CA C 54.958 0.1 1 182 38 38 LEU CB C 42.505 0.1 1 183 38 38 LEU N N 125.872 0.07 1 184 39 39 TYR H H 8.298 0.02 1 185 39 39 TYR C C 175.579 0.1 1 186 39 39 TYR CA C 57.928 0.1 1 187 39 39 TYR CB C 38.844 0.1 1 188 39 39 TYR N N 122.491 0.07 1 189 40 40 VAL H H 8.110 0.02 1 190 40 40 VAL C C 176.152 0.1 1 191 40 40 VAL CA C 62.202 0.1 1 192 40 40 VAL CB C 32.854 0.1 1 193 40 40 VAL N N 123.378 0.07 1 194 41 41 GLY H H 8.077 0.02 1 195 41 41 GLY C C 173.978 0.1 1 196 41 41 GLY CA C 45.213 0.1 1 197 41 41 GLY N N 112.211 0.07 1 198 42 42 SER H H 8.265 0.02 1 199 42 42 SER C C 174.658 0.1 1 200 42 42 SER N N 115.651 0.07 1 201 43 43 LYS C C 177.176 0.1 1 202 43 43 LYS CA C 56.552 0.1 1 203 43 43 LYS CB C 33.034 0.1 1 204 44 44 THR H H 8.213 0.02 1 205 44 44 THR C C 175.451 0.1 1 206 44 44 THR CA C 61.842 0.1 1 207 44 44 THR CB C 69.834 0.1 1 208 44 44 THR N N 115.540 0.07 1 209 45 45 LYS H H 8.458 0.02 1 210 45 45 LYS C C 176.697 0.1 1 211 45 45 LYS CA C 56.678 0.1 1 212 45 45 LYS CB C 32.989 0.1 1 213 45 45 LYS N N 124.001 0.07 1 214 46 46 GLU H H 8.467 0.02 1 215 46 46 GLU C C 177.024 0.1 1 216 46 46 GLU CA C 56.940 0.1 1 217 46 46 GLU CB C 30.287 0.1 1 218 46 46 GLU N N 122.193 0.07 1 219 47 47 GLY H H 8.472 0.02 1 220 47 47 GLY C C 173.854 0.1 1 221 47 47 GLY CA C 45.276 0.1 1 222 47 47 GLY N N 110.073 0.07 1 223 48 48 VAL H H 7.939 0.02 1 224 48 48 VAL C C 175.998 0.1 1 225 48 48 VAL CA C 62.315 0.1 1 226 48 48 VAL CB C 32.859 0.1 1 227 48 48 VAL N N 120.038 0.07 1 228 49 49 VAL H H 8.315 0.02 1 229 49 49 VAL C C 175.865 0.1 1 230 49 49 VAL CA C 62.127 0.1 1 231 49 49 VAL CB C 32.766 0.1 1 232 49 49 VAL N N 125.266 0.07 1 233 50 50 HIS H H 8.493 0.02 1 234 50 50 HIS C C 175.922 0.1 1 235 50 50 HIS CA C 56.576 0.1 1 236 50 50 HIS CB C 31.261 0.1 1 237 50 50 HIS N N 124.979 0.07 1 238 51 51 GLY H H 8.417 0.02 1 239 51 51 GLY C C 173.857 0.1 1 240 51 51 GLY CA C 45.388 0.1 1 241 51 51 GLY N N 110.626 0.07 1 242 52 52 VAL H H 8.125 0.02 1 243 52 52 VAL C C 176.531 0.1 1 244 52 52 VAL CA C 62.286 0.1 1 245 52 52 VAL CB C 32.966 0.1 1 246 52 52 VAL N N 119.611 0.07 1 247 53 53 THR H H 8.433 0.02 1 248 53 53 THR C C 174.549 0.1 1 249 53 53 THR CA C 61.945 0.1 1 250 53 53 THR CB C 69.891 0.1 1 251 53 53 THR N N 118.914 0.07 1 252 54 54 THR H H 8.297 0.02 1 253 54 54 THR C C 174.363 0.1 1 254 54 54 THR CA C 61.812 0.1 1 255 54 54 THR CB C 70.021 0.1 1 256 54 54 THR N N 117.913 0.07 1 257 55 55 VAL H H 8.293 0.02 1 258 55 55 VAL C C 175.876 0.1 1 259 55 55 VAL CA C 62.425 0.1 1 260 55 55 VAL CB C 32.638 0.1 1 261 55 55 VAL N N 123.201 0.07 1 262 56 56 ALA H H 8.453 0.02 1 263 56 56 ALA C C 177.762 0.1 1 264 56 56 ALA CA C 52.645 0.1 1 265 56 56 ALA CB C 19.218 0.1 1 266 56 56 ALA N N 128.265 0.07 1 267 57 57 GLU H H 8.409 0.02 1 268 57 57 GLU C C 176.692 0.1 1 269 57 57 GLU CA C 56.632 0.1 1 270 57 57 GLU CB C 30.529 0.1 1 271 57 57 GLU N N 120.956 0.07 1 272 58 58 LYS H H 8.457 0.02 1 273 58 58 LYS C C 176.957 0.1 1 274 58 58 LYS CA C 56.506 0.1 1 275 58 58 LYS CB C 33.006 0.1 1 276 58 58 LYS N N 122.896 0.07 1 277 59 59 THR H H 8.243 0.02 1 278 59 59 THR C C 174.702 0.1 1 279 59 59 THR CA C 62.126 0.1 1 280 59 59 THR CB C 69.749 0.1 1 281 59 59 THR N N 116.000 0.07 1 282 60 60 LYS H H 8.420 0.02 1 283 60 60 LYS C C 176.692 0.1 1 284 60 60 LYS CA C 56.657 0.1 1 285 60 60 LYS CB C 33.032 0.1 1 286 60 60 LYS N N 123.764 0.07 1 287 61 61 GLU H H 8.464 0.02 1 288 61 61 GLU C C 176.982 0.1 1 289 61 61 GLU CA C 56.678 0.1 1 290 61 61 GLU CB C 30.269 0.1 1 291 61 61 GLU N N 122.169 0.07 1 292 62 62 GLN H H 8.453 0.02 1 293 62 62 GLN C C 176.009 0.1 1 294 62 62 GLN CA C 55.815 0.1 1 295 62 62 GLN CB C 29.490 0.1 1 296 62 62 GLN N N 121.909 0.07 1 297 63 63 VAL H H 8.317 0.02 1 298 63 63 VAL C C 176.335 0.1 1 299 63 63 VAL CA C 62.473 0.1 1 300 63 63 VAL CB C 32.786 0.1 1 301 63 63 VAL N N 122.009 0.07 1 302 64 64 THR H H 8.330 0.02 1 303 64 64 THR C C 174.036 0.1 1 304 64 64 THR CA C 61.878 0.1 1 305 64 64 THR CB C 69.828 0.1 1 306 64 64 THR N N 118.149 0.07 1 307 65 65 ASN H H 8.553 0.02 1 308 65 65 ASN C C 175.243 0.1 1 309 65 65 ASN CA C 53.136 0.1 1 310 65 65 ASN CB C 38.901 0.1 1 311 65 65 ASN N N 121.904 0.07 1 312 66 66 VAL H H 8.268 0.02 1 313 66 66 VAL C C 176.849 0.1 1 314 66 66 VAL CA C 62.743 0.1 1 315 66 66 VAL CB C 32.529 0.1 1 316 66 66 VAL N N 120.787 0.07 1 317 67 67 GLY H H 8.583 0.02 1 318 67 67 GLY C C 174.677 0.1 1 319 67 67 GLY CA C 45.365 0.1 1 320 67 67 GLY N N 112.681 0.07 1 321 68 68 GLY H H 8.262 0.02 1 322 68 68 GLY C C 173.747 0.1 1 323 68 68 GLY CA C 45.131 0.1 1 324 68 68 GLY N N 108.878 0.07 1 325 69 69 ALA H H 8.193 0.02 1 326 69 69 ALA C C 177.646 0.1 1 327 69 69 ALA CA C 52.326 0.1 1 328 69 69 ALA CB C 19.420 0.1 1 329 69 69 ALA N N 123.826 0.07 1 330 70 70 VAL H H 8.243 0.02 1 331 70 70 VAL C C 176.418 0.1 1 332 70 70 VAL CA C 62.523 0.1 1 333 70 70 VAL CB C 32.674 0.1 1 334 70 70 VAL N N 120.551 0.07 1 335 71 71 VAL H H 8.419 0.02 1 336 71 71 VAL C C 176.299 0.1 1 337 71 71 VAL CA C 62.210 0.1 1 338 71 71 VAL CB C 32.729 0.1 1 339 71 71 VAL N N 125.453 0.07 1 340 72 72 THR H H 8.336 0.02 1 341 72 72 THR C C 174.922 0.1 1 342 72 72 THR CA C 61.949 0.1 1 343 72 72 THR CB C 69.962 0.1 1 344 72 72 THR N N 118.692 0.07 1 345 73 73 GLY H H 8.465 0.02 1 346 73 73 GLY C C 174.030 0.1 1 347 73 73 GLY CA C 45.268 0.1 1 348 73 73 GLY N N 111.405 0.07 1 349 74 74 VAL H H 8.111 0.02 1 350 74 74 VAL C C 176.568 0.1 1 351 74 74 VAL CA C 62.389 0.1 1 352 74 74 VAL CB C 32.932 0.1 1 353 74 74 VAL N N 119.604 0.07 1 354 75 75 THR H H 8.327 0.02 1 355 75 75 THR C C 174.080 0.1 1 356 75 75 THR CA C 62.042 0.1 1 357 75 75 THR CB C 69.771 0.1 1 358 75 75 THR N N 118.988 0.07 1 359 76 76 ALA H H 8.397 0.02 1 360 76 76 ALA C C 177.563 0.1 1 361 76 76 ALA CA C 52.469 0.1 1 362 76 76 ALA CB C 19.359 0.1 1 363 76 76 ALA N N 127.460 0.07 1 364 77 77 VAL H H 8.170 0.02 1 365 77 77 VAL C C 176.029 0.1 1 366 77 77 VAL CA C 62.211 0.1 1 367 77 77 VAL CB C 32.820 0.1 1 368 77 77 VAL N N 120.125 0.07 1 369 78 78 ALA H H 8.431 0.02 1 370 78 78 ALA C C 177.654 0.1 1 371 78 78 ALA CA C 52.504 0.1 1 372 78 78 ALA CB C 19.214 0.1 1 373 78 78 ALA N N 128.202 0.07 1 374 79 79 GLN H H 8.417 0.02 1 375 79 79 GLN C C 175.970 0.1 1 376 79 79 GLN CA C 55.738 0.1 1 377 79 79 GLN CB C 29.650 0.1 1 378 79 79 GLN N N 120.382 0.07 1 379 80 80 LYS H H 8.461 0.02 1 380 80 80 LYS C C 176.667 0.1 1 381 80 80 LYS CA C 56.384 0.1 1 382 80 80 LYS CB C 33.116 0.1 1 383 80 80 LYS N N 123.329 0.07 1 384 81 81 THR H H 8.320 0.02 1 385 81 81 THR C C 174.452 0.1 1 386 81 81 THR CA C 61.981 0.1 1 387 81 81 THR CB C 69.871 0.1 1 388 81 81 THR N N 116.972 0.07 1 389 82 82 VAL H H 8.332 0.02 1 390 82 82 VAL C C 176.144 0.1 1 391 82 82 VAL CA C 62.395 0.1 1 392 82 82 VAL CB C 32.793 0.1 1 393 82 82 VAL N N 123.093 0.07 1 394 83 83 GLU H H 8.603 0.02 1 395 83 83 GLU C C 177.065 0.1 1 396 83 83 GLU CA C 56.833 0.1 1 397 83 83 GLU CB C 30.261 0.1 1 398 83 83 GLU N N 125.390 0.07 1 399 84 84 GLY H H 8.545 0.02 1 400 84 84 GLY C C 174.155 0.1 1 401 84 84 GLY CA C 45.318 0.1 1 402 84 84 GLY N N 110.775 0.07 1 403 85 85 ALA H H 8.291 0.02 1 404 85 85 ALA C C 178.512 0.1 1 405 85 85 ALA CA C 52.927 0.1 1 406 85 85 ALA CB C 19.187 0.1 1 407 85 85 ALA N N 124.004 0.07 1 408 86 86 GLY H H 8.523 0.02 1 409 86 86 GLY C C 174.318 0.1 1 410 86 86 GLY CA C 45.300 0.1 1 411 86 86 GLY N N 108.234 0.07 1 412 87 87 SER H H 8.182 0.02 1 413 87 87 SER C C 174.736 0.1 1 414 87 87 SER CA C 58.380 0.1 1 415 87 87 SER CB C 63.838 0.1 1 416 87 87 SER N N 115.743 0.07 1 417 88 88 ILE H H 8.221 0.02 1 418 88 88 ILE C C 176.260 0.1 1 419 88 88 ILE CA C 61.384 0.1 1 420 88 88 ILE CB C 38.695 0.1 1 421 88 88 ILE N N 122.828 0.07 1 422 89 89 ALA H H 8.377 0.02 1 423 89 89 ALA C C 177.555 0.1 1 424 89 89 ALA CA C 52.574 0.1 1 425 89 89 ALA CB C 19.118 0.1 1 426 89 89 ALA N N 128.122 0.07 1 427 90 90 ALA H H 8.239 0.02 1 428 90 90 ALA C C 177.704 0.1 1 429 90 90 ALA CA C 52.519 0.1 1 430 90 90 ALA CB C 19.159 0.1 1 431 90 90 ALA N N 123.416 0.07 1 432 91 91 ALA H H 8.322 0.02 1 433 91 91 ALA C C 178.141 0.1 1 434 91 91 ALA CA C 52.673 0.1 1 435 91 91 ALA CB C 19.128 0.1 1 436 91 91 ALA N N 123.479 0.07 1 437 92 92 THR H H 8.122 0.02 1 438 92 92 THR C C 175.167 0.1 1 439 92 92 THR CA C 62.017 0.1 1 440 92 92 THR CB C 69.854 0.1 1 441 92 92 THR N N 112.687 0.07 1 442 93 93 GLY H H 8.336 0.02 1 443 93 93 GLY C C 173.623 0.1 1 444 93 93 GLY CA C 45.195 0.1 1 445 93 93 GLY N N 110.761 0.07 1 446 94 94 PHE H H 8.126 0.02 1 447 94 94 PHE C C 175.463 0.1 1 448 94 94 PHE CA C 57.784 0.1 1 449 94 94 PHE CB C 39.735 0.1 1 450 94 94 PHE N N 120.413 0.07 1 451 95 95 VAL H H 8.083 0.02 1 452 95 95 VAL C C 175.422 0.1 1 453 95 95 VAL CA C 62.016 0.1 1 454 95 95 VAL CB C 33.112 0.1 1 455 95 95 VAL N N 123.813 0.07 1 456 96 96 LYS H H 8.424 0.02 1 457 96 96 LYS C C 176.495 0.1 1 458 96 96 LYS CA C 56.368 0.1 1 459 96 96 LYS CB C 33.091 0.1 1 460 96 96 LYS N N 126.488 0.07 1 461 97 97 LYS H H 8.499 0.02 1 462 97 97 LYS C C 176.370 0.1 1 463 97 97 LYS CA C 56.516 0.1 1 464 97 97 LYS CB C 33.178 0.1 1 465 97 97 LYS N N 123.869 0.07 1 466 98 98 ASP H H 8.433 0.02 1 467 98 98 ASP C C 176.221 0.1 1 468 98 98 ASP CA C 54.485 0.1 1 469 98 98 ASP CB C 41.053 0.1 1 470 98 98 ASP N N 121.283 0.07 1 471 99 99 GLN H H 8.372 0.02 1 472 99 99 GLN C C 176.039 0.1 1 473 99 99 GLN CA C 55.918 0.1 1 474 99 99 GLN CB C 29.429 0.1 1 475 99 99 GLN N N 120.271 0.07 1 476 100 100 LEU H H 8.326 0.02 1 477 100 100 LEU C C 178.004 0.1 1 478 100 100 LEU CA C 55.431 0.1 1 479 100 100 LEU CB C 42.218 0.1 1 480 100 100 LEU N N 122.934 0.07 1 481 101 101 GLY H H 8.510 0.02 1 482 101 101 GLY C C 174.101 0.1 1 483 101 101 GLY CA C 45.313 0.1 1 484 101 101 GLY N N 109.866 0.07 1 485 102 102 LYS H H 8.236 0.02 1 486 102 102 LYS C C 176.451 0.1 1 487 102 102 LYS CA C 56.263 0.1 1 488 102 102 LYS CB C 33.121 0.1 1 489 102 102 LYS N N 120.820 0.07 1 490 103 103 ASN H H 8.649 0.02 1 491 103 103 ASN C C 175.289 0.1 1 492 103 103 ASN CA C 53.362 0.1 1 493 103 103 ASN CB C 38.827 0.1 1 494 103 103 ASN N N 120.083 0.07 1 495 104 104 GLU H H 8.508 0.02 1 496 104 104 GLU C C 176.559 0.1 1 497 104 104 GLU CA C 56.759 0.1 1 498 104 104 GLU CB C 30.172 0.1 1 499 104 104 GLU N N 121.499 0.07 1 500 105 105 GLU H H 8.498 0.02 1 501 105 105 GLU C C 177.048 0.1 1 502 105 105 GLU CA C 56.868 0.1 1 503 105 105 GLU CB C 30.332 0.1 1 504 105 105 GLU N N 122.030 0.07 1 505 106 106 GLY H H 8.461 0.02 1 506 106 106 GLY C C 173.441 0.1 1 507 106 106 GLY CA C 45.022 0.1 1 508 106 106 GLY N N 110.274 0.07 1 509 107 107 ALA H H 8.156 0.02 1 510 107 107 ALA C C 175.546 0.1 1 511 107 107 ALA CA C 50.507 0.1 1 512 107 107 ALA CB C 18.213 0.1 1 513 107 107 ALA N N 125.013 0.07 1 514 108 108 PRO C C 177.049 0.1 1 515 108 108 PRO CA C 63.146 0.1 1 516 108 108 PRO CB C 32.049 0.1 1 517 109 109 GLN H H 8.620 0.02 1 518 109 109 GLN C C 176.003 0.1 1 519 109 109 GLN CA C 55.707 0.1 1 520 109 109 GLN CB C 29.677 0.1 1 521 109 109 GLN N N 121.271 0.07 1 522 110 110 GLU H H 8.556 0.02 1 523 110 110 GLU C C 176.874 0.1 1 524 110 110 GLU CA C 56.605 0.1 1 525 110 110 GLU CB C 30.477 0.1 1 526 110 110 GLU N N 122.626 0.07 1 527 111 111 GLY H H 8.514 0.02 1 528 111 111 GLY C C 173.806 0.1 1 529 111 111 GLY CA C 45.304 0.1 1 530 111 111 GLY N N 110.332 0.07 1 531 112 112 ILE H H 8.029 0.02 1 532 112 112 ILE C C 176.271 0.1 1 533 112 112 ILE CA C 60.951 0.1 1 534 112 112 ILE CB C 38.677 0.1 1 535 112 112 ILE N N 120.228 0.07 1 536 113 113 LEU H H 8.443 0.02 1 537 113 113 LEU C C 177.158 0.1 1 538 113 113 LEU CA C 54.980 0.1 1 539 113 113 LEU CB C 42.386 0.1 1 540 113 113 LEU N N 127.138 0.07 1 541 114 114 GLU H H 8.454 0.02 1 542 114 114 GLU C C 175.888 0.1 1 543 114 114 GLU CA C 56.451 0.1 1 544 114 114 GLU CB C 30.626 0.1 1 545 114 114 GLU N N 122.380 0.07 1 546 115 115 ASP H H 8.390 0.02 1 547 115 115 ASP C C 175.787 0.1 1 548 115 115 ASP CA C 54.250 0.1 1 549 115 115 ASP CB C 41.162 0.1 1 550 115 115 ASP N N 121.523 0.07 1 551 116 116 MET H H 8.288 0.02 1 552 116 116 MET C C 174.061 0.1 1 553 116 116 MET CA C 53.216 0.1 1 554 116 116 MET CB C 32.526 0.1 1 555 116 116 MET N N 122.088 0.07 1 556 117 117 PRO C C 176.708 0.1 1 557 117 117 PRO CA C 62.940 0.1 1 558 117 117 PRO CB C 32.112 0.1 1 559 118 118 VAL H H 8.331 0.02 1 560 118 118 VAL C C 175.762 0.1 1 561 118 118 VAL CA C 61.984 0.1 1 562 118 118 VAL CB C 33.051 0.1 1 563 118 118 VAL N N 120.938 0.07 1 564 119 119 ASP H H 8.550 0.02 1 565 119 119 ASP C C 174.691 0.1 1 566 119 119 ASP CA C 52.107 0.1 1 567 119 119 ASP CB C 41.136 0.1 1 568 119 119 ASP N N 126.067 0.07 1 569 120 120 PRO C C 176.914 0.1 1 570 120 120 PRO CA C 63.503 0.1 1 571 120 120 PRO CB C 32.179 0.1 1 572 121 121 ASP H H 8.411 0.02 1 573 121 121 ASP C C 176.193 0.1 1 574 121 121 ASP CA C 54.556 0.1 1 575 121 121 ASP CB C 40.960 0.1 1 576 121 121 ASP N N 119.397 0.07 1 577 122 122 ASN H H 8.146 0.02 1 578 122 122 ASN C C 175.380 0.1 1 579 122 122 ASN CA C 53.487 0.1 1 580 122 122 ASN CB C 39.351 0.1 1 581 122 122 ASN N N 119.194 0.07 1 582 123 123 GLU H H 8.414 0.02 1 583 123 123 GLU C C 176.069 0.1 1 584 123 123 GLU CA C 56.921 0.1 1 585 123 123 GLU CB C 30.116 0.1 1 586 123 123 GLU N N 121.867 0.07 1 587 124 124 ALA H H 8.258 0.02 1 588 124 124 ALA C C 177.207 0.1 1 589 124 124 ALA CA C 52.332 0.1 1 590 124 124 ALA CB C 19.178 0.1 1 591 124 124 ALA N N 124.519 0.07 1 592 125 125 TYR H H 8.061 0.02 1 593 125 125 TYR C C 175.350 0.1 1 594 125 125 TYR CA C 57.807 0.1 1 595 125 125 TYR CB C 38.997 0.1 1 596 125 125 TYR N N 120.121 0.07 1 597 126 126 GLU H H 8.167 0.02 1 598 126 126 GLU C C 175.449 0.1 1 599 126 126 GLU CA C 55.683 0.1 1 600 126 126 GLU CB C 30.776 0.1 1 601 126 126 GLU N N 123.954 0.07 1 602 127 127 MET H H 8.446 0.02 1 603 127 127 MET C C 174.227 0.1 1 604 127 127 MET CA C 53.284 0.1 1 605 127 127 MET CB C 32.410 0.1 1 606 127 127 MET N N 124.005 0.07 1 607 128 128 PRO C C 176.906 0.1 1 608 128 128 PRO CA C 63.097 0.1 1 609 128 128 PRO CB C 32.182 0.1 1 610 129 129 SER H H 8.520 0.02 1 611 129 129 SER C C 174.809 0.1 1 612 129 129 SER CA C 58.267 0.1 1 613 129 129 SER CB C 63.897 0.1 1 614 129 129 SER N N 116.875 0.07 1 615 130 130 GLU H H 8.610 0.02 1 616 130 130 GLU C C 176.509 0.1 1 617 130 130 GLU CA C 56.553 0.1 1 618 130 130 GLU CB C 30.349 0.1 1 619 130 130 GLU N N 123.294 0.07 1 620 131 131 GLU H H 8.498 0.02 1 621 131 131 GLU C C 176.992 0.1 1 622 131 131 GLU CA C 56.885 0.1 1 623 131 131 GLU CB C 30.190 0.1 1 624 131 131 GLU N N 122.030 0.07 1 625 132 132 GLY H H 8.440 0.02 1 626 132 132 GLY C C 173.854 0.1 1 627 132 132 GLY CA C 45.189 0.1 1 628 132 132 GLY N N 110.033 0.07 1 629 133 133 TYR H H 8.096 0.02 1 630 133 133 TYR C C 175.756 0.1 1 631 133 133 TYR CA C 58.174 0.1 1 632 133 133 TYR CB C 38.801 0.1 1 633 133 133 TYR N N 120.376 0.07 1 634 134 134 GLN H H 8.254 0.02 1 635 134 134 GLN C C 174.879 0.1 1 636 134 134 GLN CA C 55.390 0.1 1 637 134 134 GLN CB C 29.847 0.1 1 638 134 134 GLN N N 122.826 0.07 1 639 135 135 ASP H H 8.265 0.02 1 640 135 135 ASP C C 175.524 0.1 1 641 135 135 ASP CA C 54.275 0.1 1 642 135 135 ASP CB C 41.161 0.1 1 643 135 135 ASP N N 121.787 0.07 1 644 136 136 TYR H H 8.067 0.02 1 645 136 136 TYR C C 175.076 0.1 1 646 136 136 TYR CA C 57.611 0.1 1 647 136 136 TYR CB C 39.136 0.1 1 648 136 136 TYR N N 120.556 0.07 1 649 137 137 GLU H H 8.284 0.02 1 650 137 137 GLU C C 173.679 0.1 1 651 137 137 GLU CA C 53.563 0.1 1 652 137 137 GLU CB C 30.325 0.1 1 653 137 137 GLU N N 125.509 0.07 1 654 138 138 PRO C C 176.885 0.1 1 655 138 138 PRO CA C 62.930 0.1 1 656 138 138 PRO CB C 32.271 0.1 1 657 139 139 GLU H H 8.552 0.02 1 658 139 139 GLU C C 175.389 0.1 1 659 139 139 GLU CA C 56.634 0.1 1 660 139 139 GLU CB C 30.343 0.1 1 661 139 139 GLU N N 121.672 0.07 1 662 140 140 ALA H H 8.024 0.02 1 663 140 140 ALA C C 176.574 0.1 1 664 140 140 ALA CA C 53.808 0.1 1 665 140 140 ALA CB C 20.246 0.1 1 666 140 140 ALA N N 130.999 0.07 1 stop_ save_