data_19344 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; alpha synuclein mutant S87N in PBS - human/mouse chimera ; _BMRB_accession_number 19344 _BMRB_flat_file_name bmr19344.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" 128 "13C chemical shifts" 397 "15N chemical shifts" 128 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' 19345 'aSyn A53T&S87N monomer' 19346 'aSyn mouse monomer' 19347 'aSyn mouse_T53A monomer' 19348 'aSyn mouse_N87S monomer' 19349 'aSyn mouse_N87S monomer' 19350 'acetylated aSyn monomer' 19351 'acetylated aSyn A53T monomer' stop_ _Original_release_date 2013-09-25 save_ ############################# # Citation for this entry # ############################# save_asyn_S87N_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 aSyn_S87N _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label aSyn_S87N $aSyn_S87N 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_aSyn_S87N _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common aSyn_S87N _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 140 _Mol_residue_sequence ; MDVFMKGLSKAKEGVVAAAE KTKQGVAEAAGKTKEGVLYV GSKTKEGVVHGVATVAEKTK EQVTNVGGAVVTGVTAVAQK TVEGAGNIAAATGFVKKDQL 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 ALA 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 ASN 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 99.29 100.00 4.43e-89 BMRB 16302 alpha-synuclein 100.00 140 99.29 100.00 4.43e-89 BMRB 16342 human_a-synuclein 100.00 140 99.29 100.00 4.43e-89 BMRB 16543 "monomer alpha-synuclein" 100.00 140 99.29 100.00 4.43e-89 BMRB 16546 A30P_alpha-synuclein 100.00 140 98.57 99.29 4.53e-88 BMRB 16547 E46K_alpha-synuclein 100.00 140 98.57 100.00 2.21e-88 BMRB 16548 A53T_alpha-synuclein 100.00 140 98.57 99.29 2.00e-88 BMRB 16904 alpha-synuclein 100.00 140 99.29 100.00 4.43e-89 BMRB 16939 WT_alpha-synuclein_fibrils 100.00 140 98.57 99.29 7.91e-88 BMRB 17214 A30P_alpha-synuclein 100.00 140 98.57 99.29 4.53e-88 BMRB 17498 alpha-synuclein 100.00 140 99.29 100.00 4.43e-89 BMRB 17648 A30P_alpha-synuclein 100.00 140 97.86 98.57 6.65e-87 BMRB 17649 A53T_alpha-synuclein_fibrils 100.00 140 97.86 98.57 3.42e-87 BMRB 17654 E46K_alpha-synuclein_fibrils 100.00 140 97.86 99.29 3.34e-87 BMRB 17665 aSyn 100.00 150 99.29 100.00 1.80e-88 BMRB 17910 wild-type_alpha-synuclein_formed_in_phospholipid_vesicles 100.00 140 98.57 99.29 7.91e-88 BMRB 18207 A53T_alpha-synuclein_fibrils 100.00 140 97.86 98.57 3.42e-87 BMRB 18208 E46K_alpha-synuclein_fibrils 100.00 140 97.86 99.29 3.34e-87 BMRB 18243 alpha-synuclein_fibrils 100.00 140 98.57 99.29 7.91e-88 BMRB 18857 alpha_synuclein 100.00 140 99.29 100.00 4.43e-89 BMRB 18860 a-synuclein 100.00 140 99.29 100.00 4.43e-89 BMRB 19257 Alpha-synuclein 100.00 140 99.29 100.00 4.43e-89 BMRB 19337 aSyn 100.00 140 99.29 100.00 4.43e-89 BMRB 19338 aSyn_A53T 100.00 140 98.57 99.29 2.00e-88 BMRB 19345 aSyn_A53T&S87N 100.00 140 99.29 99.29 3.23e-89 BMRB 19350 acet_aSyn 100.00 140 99.29 100.00 4.43e-89 BMRB 19351 acet_aSyn_A53T 100.00 140 98.57 99.29 2.00e-88 BMRB 25227 aSyn-WT 100.00 140 99.29 100.00 4.43e-89 BMRB 25228 H50Q 100.00 140 98.57 99.29 6.22e-88 PDB 1XQ8 "Human Micelle-Bound Alpha-Synuclein" 100.00 140 99.29 100.00 4.43e-89 PDB 2KKW "Slas-Micelle Bound Alpha-Synuclein" 100.00 140 99.29 100.00 4.43e-89 DBJ BAB29375 "unnamed protein product [Mus musculus]" 72.86 122 98.04 99.02 3.02e-57 DBJ BAF82858 "unnamed protein product [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 DBJ BAG73790 "synuclein, alpha [synthetic construct]" 100.00 140 99.29 100.00 4.43e-89 EMBL CAG33339 "SNCA [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 EMBL CAG46454 "SNCA [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 GB AAA16117 "AD amyloid [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 GB AAC02114 "NACP/alpha-synuclein [Homo sapiens]" 100.00 140 97.86 98.57 1.98e-87 GB AAG30302 "SNCA isoform NACP140 [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 GB AAH13293 "Synuclein, alpha (non A4 component of amyloid precursor) [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 GB AAI08276 "Synuclein, alpha (non A4 component of amyloid precursor) [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 REF NP_000336 "alpha-synuclein isoform NACP140 [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-89 REF NP_001009158 "alpha-synuclein [Pan troglodytes]" 100.00 140 99.29 100.00 4.43e-89 REF NP_001032222 "alpha-synuclein [Sus scrofa]" 100.00 140 97.14 97.86 7.34e-86 REF NP_001129014 "alpha-synuclein [Pongo abelii]" 100.00 140 98.57 99.29 6.79e-88 REF NP_001139526 "alpha-synuclein isoform NACP140 [Homo sapiens]" 100.00 140 99.29 100.00 4.43e-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 99.29 100.00 4.43e-89 SP P61139 "RecName: Full=Alpha-synuclein" 100.00 140 98.57 100.00 1.16e-88 SP P61140 "RecName: Full=Alpha-synuclein" 100.00 140 99.29 100.00 4.43e-89 SP P61142 "RecName: Full=Alpha-synuclein" 100.00 140 97.86 100.00 1.59e-88 SP P61143 "RecName: Full=Alpha-synuclein" 100.00 140 97.86 100.00 1.59e-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 $aSyn_S87N human 9606 Eukaryota Metazoa Homo sapiens 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 $aSyn_S87N 'recombinant technology' . Escherichia coli . p7-T7 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 $aSyn_S87N 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 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCO' '3D HNCACB' '3D HNN' '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 aSyn_S87N _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 2 ASP C C 176.022 0.1 1 2 2 2 ASP CA C 54.303 0.1 1 3 2 2 ASP CB C 41.546 0.1 1 4 3 3 VAL H H 8.254 0.02 1 5 3 3 VAL C C 175.977 0.1 1 6 3 3 VAL CA C 62.555 0.1 1 7 3 3 VAL CB C 32.641 0.1 1 8 3 3 VAL N N 120.353 0.07 1 9 4 4 PHE H H 8.363 0.02 1 10 4 4 PHE C C 175.897 0.1 1 11 4 4 PHE CA C 58.094 0.1 1 12 4 4 PHE CB C 39.417 0.1 1 13 4 4 PHE N N 123.489 0.07 1 14 5 5 MET H H 8.241 0.02 1 15 5 5 MET C C 175.989 0.1 1 16 5 5 MET CA C 55.340 0.1 1 17 5 5 MET CB C 32.753 0.1 1 18 5 5 MET N N 122.276 0.07 1 19 6 6 LYS H H 8.298 0.02 1 20 6 6 LYS C C 177.165 0.1 1 21 6 6 LYS CA C 56.971 0.1 1 22 6 6 LYS CB C 32.715 0.1 1 23 6 6 LYS N N 122.666 0.07 1 24 7 7 GLY C C 174.208 0.1 1 25 7 7 GLY CA C 45.223 0.1 1 26 8 8 LEU H H 8.082 0.02 1 27 8 8 LEU C C 177.659 0.1 1 28 8 8 LEU CA C 55.077 0.1 1 29 8 8 LEU CB C 42.550 0.1 1 30 8 8 LEU N N 121.604 0.07 1 31 9 9 SER H H 8.347 0.02 1 32 9 9 SER C C 174.580 0.1 1 33 9 9 SER CA C 58.300 0.1 1 34 9 9 SER CB C 63.791 0.1 1 35 9 9 SER N N 116.740 0.07 1 36 10 10 LYS C C 176.469 0.1 1 37 10 10 LYS CA C 56.279 0.1 1 38 10 10 LYS CB C 32.812 0.1 1 39 11 11 ALA H H 8.319 0.02 1 40 11 11 ALA C C 177.911 0.1 1 41 11 11 ALA CA C 52.548 0.1 1 42 11 11 ALA CB C 19.192 0.1 1 43 11 11 ALA N N 125.267 0.07 1 44 12 12 LYS H H 8.365 0.02 1 45 12 12 LYS C C 176.688 0.1 1 46 12 12 LYS CA C 56.479 0.1 1 47 12 12 LYS CB C 32.974 0.1 1 48 12 12 LYS N N 120.923 0.07 1 49 13 13 GLU H H 8.454 0.02 1 50 13 13 GLU CA C 56.762 0.1 1 51 13 13 GLU CB C 30.483 0.1 1 52 13 13 GLU N N 122.195 0.07 1 53 14 14 GLY H H 8.491 0.02 1 54 14 14 GLY C C 174.045 0.1 1 55 14 14 GLY CA C 45.304 0.1 1 56 14 14 GLY N N 110.146 0.07 1 57 15 15 VAL H H 8.005 0.02 1 58 15 15 VAL C C 176.464 0.1 1 59 15 15 VAL CA C 62.551 0.1 1 60 15 15 VAL CB C 32.876 0.1 1 61 15 15 VAL N N 120.187 0.07 1 62 16 16 VAL H H 8.333 0.02 1 63 16 16 VAL C C 176.001 0.1 1 64 16 16 VAL CA C 62.497 0.1 1 65 16 16 VAL CB C 32.762 0.1 1 66 16 16 VAL N N 125.263 0.07 1 67 17 17 ALA H H 8.474 0.02 1 68 17 17 ALA C C 177.664 0.1 1 69 17 17 ALA CA C 52.534 0.1 1 70 17 17 ALA CB C 19.260 0.1 1 71 17 17 ALA N N 128.531 0.07 1 72 18 18 ALA H H 8.340 0.02 1 73 18 18 ALA C C 177.908 0.1 1 74 18 18 ALA CA C 52.674 0.1 1 75 18 18 ALA CB C 19.177 0.1 1 76 18 18 ALA N N 123.765 0.07 1 77 19 19 ALA H H 8.305 0.02 1 78 19 19 ALA C C 178.198 0.1 1 79 19 19 ALA CA C 52.691 0.1 1 80 19 19 ALA CB C 19.177 0.1 1 81 19 19 ALA N N 123.156 0.07 1 82 20 20 GLU H H 8.359 0.02 1 83 20 20 GLU C C 176.935 0.1 1 84 20 20 GLU CA C 56.824 0.1 1 85 20 20 GLU CB C 30.250 0.1 1 86 20 20 GLU N N 120.149 0.07 1 87 21 21 LYS H H 8.366 0.02 1 88 21 21 LYS C C 177.152 0.1 1 89 21 21 LYS CA C 56.736 0.1 1 90 21 21 LYS CB C 32.880 0.1 1 91 21 21 LYS N N 122.324 0.07 1 92 22 22 THR H H 8.163 0.02 1 93 22 22 THR C C 174.694 0.1 1 94 22 22 THR CA C 62.211 0.1 1 95 22 22 THR CB C 69.711 0.1 1 96 22 22 THR N N 115.304 0.07 1 97 23 23 LYS H H 8.377 0.02 1 98 23 23 LYS C C 176.685 0.1 1 99 23 23 LYS CA C 56.539 0.1 1 100 23 23 LYS CB C 32.879 0.1 1 101 23 23 LYS N N 123.821 0.07 1 102 24 24 GLN H H 8.454 0.02 1 103 24 24 GLN C C 176.597 0.1 1 104 24 24 GLN CA C 56.360 0.1 1 105 24 24 GLN CB C 29.589 0.1 1 106 24 24 GLN N N 121.819 0.07 1 107 25 25 GLY H H 8.514 0.02 1 108 25 25 GLY C C 174.250 0.1 1 109 25 25 GLY CA C 45.319 0.1 1 110 25 25 GLY N N 110.587 0.07 1 111 26 26 VAL H H 8.043 0.02 1 112 26 26 VAL C C 176.376 0.1 1 113 26 26 VAL CA C 62.659 0.1 1 114 26 26 VAL CB C 32.801 0.1 1 115 26 26 VAL N N 119.800 0.07 1 116 27 27 ALA H H 8.456 0.02 1 117 27 27 ALA C C 178.130 0.1 1 118 27 27 ALA CA C 52.815 0.1 1 119 27 27 ALA CB C 19.066 0.1 1 120 27 27 ALA N N 127.466 0.07 1 121 28 28 GLU H H 8.431 0.02 1 122 28 28 GLU C C 176.657 0.1 1 123 28 28 GLU CA C 56.847 0.1 1 124 28 28 GLU CB C 30.236 0.1 1 125 28 28 GLU N N 120.639 0.07 1 126 29 29 ALA H H 8.329 0.02 1 127 29 29 ALA C C 177.748 0.1 1 128 29 29 ALA CA C 52.634 0.1 1 129 29 29 ALA CB C 19.217 0.1 1 130 29 29 ALA N N 125.064 0.07 1 131 30 30 ALA H H 8.269 0.02 1 132 30 30 ALA C C 178.471 0.1 1 133 30 30 ALA CA C 52.815 0.1 1 134 30 30 ALA CB C 19.083 0.1 1 135 30 30 ALA N N 123.171 0.07 1 136 31 31 GLY H H 8.345 0.02 1 137 31 31 GLY C C 174.219 0.1 1 138 31 31 GLY CA C 45.242 0.1 1 139 31 31 GLY N N 107.839 0.07 1 140 32 32 LYS H H 8.142 0.02 1 141 32 32 LYS C C 177.016 0.1 1 142 32 32 LYS CA C 56.225 0.1 1 143 32 32 LYS CB C 33.186 0.1 1 144 32 32 LYS N N 120.763 0.07 1 145 33 33 THR H H 8.259 0.02 1 146 33 33 THR C C 174.666 0.1 1 147 33 33 THR CA C 61.916 0.1 1 148 33 33 THR CB C 69.925 0.1 1 149 33 33 THR N N 115.649 0.07 1 150 34 34 LYS H H 8.497 0.02 1 151 34 34 LYS C C 176.486 0.1 1 152 34 34 LYS CA C 56.685 0.1 1 153 34 34 LYS CB C 33.016 0.1 1 154 34 34 LYS N N 123.895 0.07 1 155 35 35 GLU H H 8.479 0.02 1 156 35 35 GLU C C 176.964 0.1 1 157 35 35 GLU CA C 56.971 0.1 1 158 35 35 GLU CB C 30.227 0.1 1 159 35 35 GLU N N 122.091 0.07 1 160 36 36 GLY H H 8.445 0.02 1 161 36 36 GLY C C 174.028 0.1 1 162 36 36 GLY CA C 45.443 0.1 1 163 36 36 GLY N N 110.013 0.07 1 164 37 37 VAL H H 7.934 0.02 1 165 37 37 VAL C C 175.927 0.1 1 166 37 37 VAL CA C 62.275 0.1 1 167 37 37 VAL CB C 32.801 0.1 1 168 37 37 VAL N N 119.602 0.07 1 169 38 38 LEU H H 8.311 0.02 1 170 38 38 LEU C C 176.659 0.1 1 171 38 38 LEU CA C 54.917 0.1 1 172 38 38 LEU CB C 42.504 0.1 1 173 38 38 LEU N N 125.874 0.07 1 174 39 39 TYR H H 8.298 0.02 1 175 39 39 TYR C C 175.591 0.1 1 176 39 39 TYR CA C 57.958 0.1 1 177 39 39 TYR CB C 38.800 0.1 1 178 39 39 TYR N N 122.512 0.07 1 179 40 40 VAL H H 8.111 0.02 1 180 40 40 VAL C C 176.165 0.1 1 181 40 40 VAL CA C 62.160 0.1 1 182 40 40 VAL CB C 32.974 0.1 1 183 40 40 VAL N N 123.374 0.07 1 184 41 41 GLY H H 8.079 0.02 1 185 41 41 GLY C C 173.950 0.1 1 186 41 41 GLY CA C 45.155 0.1 1 187 41 41 GLY N N 112.213 0.07 1 188 42 42 SER H H 8.289 0.02 1 189 42 42 SER C C 174.734 0.1 1 190 42 42 SER CA C 58.411 0.1 1 191 42 42 SER CB C 63.888 0.1 1 192 42 42 SER N N 115.672 0.07 1 193 43 43 LYS H H 8.511 0.02 1 194 43 43 LYS C C 176.879 0.1 1 195 43 43 LYS CA C 56.471 0.1 1 196 43 43 LYS CB C 33.050 0.1 1 197 43 43 LYS N N 123.496 0.07 1 198 44 44 THR H H 8.212 0.02 1 199 44 44 THR C C 174.603 0.1 1 200 44 44 THR CA C 61.829 0.1 1 201 44 44 THR CB C 69.838 0.1 1 202 44 44 THR N N 115.532 0.07 1 203 45 45 LYS H H 8.463 0.02 1 204 45 45 LYS C C 176.501 0.1 1 205 45 45 LYS CA C 56.472 0.1 1 206 45 45 LYS CB C 33.092 0.1 1 207 45 45 LYS N N 123.893 0.07 1 208 46 46 GLU C C 176.964 0.1 1 209 46 46 GLU CA C 56.780 0.1 1 210 46 46 GLU CB C 30.229 0.1 1 211 47 47 GLY H H 8.456 0.02 1 212 47 47 GLY C C 173.865 0.1 1 213 47 47 GLY CA C 45.297 0.1 1 214 47 47 GLY N N 110.060 0.07 1 215 48 48 VAL H H 7.939 0.02 1 216 48 48 VAL C C 176.007 0.1 1 217 48 48 VAL CA C 62.228 0.1 1 218 48 48 VAL CB C 32.821 0.1 1 219 48 48 VAL N N 120.007 0.07 1 220 49 49 VAL H H 8.324 0.02 1 221 49 49 VAL C C 175.862 0.1 1 222 49 49 VAL CA C 62.250 0.1 1 223 49 49 VAL CB C 32.730 0.1 1 224 49 49 VAL N N 125.190 0.07 1 225 50 50 HIS H H 8.517 0.02 1 226 50 50 HIS C C 175.829 0.1 1 227 50 50 HIS CA C 56.208 0.1 1 228 50 50 HIS CB C 31.059 0.1 1 229 50 50 HIS N N 124.798 0.07 1 230 51 51 GLY H H 8.436 0.02 1 231 51 51 GLY C C 173.800 0.1 1 232 51 51 GLY CA C 45.115 0.1 1 233 51 51 GLY N N 110.631 0.07 1 234 52 52 VAL H H 8.060 0.02 1 235 52 52 VAL C C 175.936 0.1 1 236 52 52 VAL CA C 62.003 0.1 1 237 52 52 VAL CB C 33.014 0.1 1 238 52 52 VAL N N 119.610 0.07 1 239 53 53 ALA H H 8.518 0.02 1 240 53 53 ALA C C 177.841 0.1 1 241 53 53 ALA CA C 52.427 0.1 1 242 53 53 ALA CB C 19.351 0.1 1 243 53 53 ALA N N 128.229 0.07 1 244 54 54 THR H H 8.248 0.02 1 245 54 54 THR C C 174.543 0.1 1 246 54 54 THR CA C 61.848 0.1 1 247 54 54 THR CB C 70.007 0.1 1 248 54 54 THR N N 114.899 0.07 1 249 55 55 VAL H H 8.265 0.02 1 250 55 55 VAL C C 175.855 0.1 1 251 55 55 VAL CA C 62.154 0.1 1 252 55 55 VAL CB C 32.880 0.1 1 253 55 55 VAL N N 123.110 0.07 1 254 56 56 ALA H H 8.452 0.02 1 255 56 56 ALA C C 177.776 0.1 1 256 56 56 ALA CA C 52.502 0.1 1 257 56 56 ALA CB C 19.228 0.1 1 258 56 56 ALA N N 128.152 0.07 1 259 57 57 GLU H H 8.404 0.02 1 260 57 57 GLU C C 176.703 0.1 1 261 57 57 GLU CA C 56.668 0.1 1 262 57 57 GLU CB C 30.462 0.1 1 263 57 57 GLU N N 120.953 0.07 1 264 58 58 LYS H H 8.459 0.02 1 265 58 58 LYS C C 176.967 0.1 1 266 58 58 LYS CA C 56.449 0.1 1 267 58 58 LYS CB C 33.149 0.1 1 268 58 58 LYS N N 122.867 0.07 1 269 59 59 THR H H 8.241 0.02 1 270 59 59 THR C C 174.648 0.1 1 271 59 59 THR CA C 62.053 0.1 1 272 59 59 THR CB C 69.747 0.1 1 273 59 59 THR N N 115.990 0.07 1 274 60 60 LYS H H 8.414 0.02 1 275 60 60 LYS C C 176.686 0.1 1 276 60 60 LYS CA C 56.608 0.1 1 277 60 60 LYS CB C 32.938 0.1 1 278 60 60 LYS N N 123.745 0.07 1 279 61 61 GLU C C 176.442 0.1 1 280 61 61 GLU CA C 56.691 0.1 1 281 61 61 GLU CB C 30.467 0.1 1 282 62 62 GLN H H 8.454 0.02 1 283 62 62 GLN C C 175.973 0.1 1 284 62 62 GLN CA C 55.842 0.1 1 285 62 62 GLN CB C 29.540 0.1 1 286 62 62 GLN N N 121.819 0.07 1 287 63 63 VAL H H 8.316 0.02 1 288 63 63 VAL C C 176.362 0.1 1 289 63 63 VAL CA C 62.509 0.1 1 290 63 63 VAL CB C 32.816 0.1 1 291 63 63 VAL N N 122.003 0.07 1 292 64 64 THR H H 8.330 0.02 1 293 64 64 THR C C 174.054 0.1 1 294 64 64 THR CA C 61.821 0.1 1 295 64 64 THR CB C 69.936 0.1 1 296 64 64 THR N N 118.143 0.07 1 297 65 65 ASN H H 8.551 0.02 1 298 65 65 ASN C C 175.249 0.1 1 299 65 65 ASN CA C 53.080 0.1 1 300 65 65 ASN CB C 38.911 0.1 1 301 65 65 ASN N N 121.903 0.07 1 302 66 66 VAL H H 8.269 0.02 1 303 66 66 VAL C C 176.863 0.1 1 304 66 66 VAL CA C 62.733 0.1 1 305 66 66 VAL CB C 32.498 0.1 1 306 66 66 VAL N N 120.784 0.07 1 307 67 67 GLY H H 8.583 0.02 1 308 67 67 GLY C C 174.672 0.1 1 309 67 67 GLY CA C 45.356 0.1 1 310 67 67 GLY N N 112.678 0.07 1 311 68 68 GLY H H 8.262 0.02 1 312 68 68 GLY C C 173.741 0.1 1 313 68 68 GLY CA C 45.128 0.1 1 314 68 68 GLY N N 108.881 0.07 1 315 69 69 ALA H H 8.193 0.02 1 316 69 69 ALA C C 177.649 0.1 1 317 69 69 ALA CA C 52.296 0.1 1 318 69 69 ALA CB C 19.344 0.1 1 319 69 69 ALA N N 123.825 0.07 1 320 70 70 VAL H H 8.243 0.02 1 321 70 70 VAL C C 176.334 0.1 1 322 70 70 VAL CA C 62.571 0.1 1 323 70 70 VAL CB C 32.644 0.1 1 324 70 70 VAL N N 120.554 0.07 1 325 71 71 VAL H H 8.418 0.02 1 326 71 71 VAL C C 176.297 0.1 1 327 71 71 VAL CA C 62.144 0.1 1 328 71 71 VAL CB C 32.799 0.1 1 329 71 71 VAL N N 125.449 0.07 1 330 72 72 THR H H 8.336 0.02 1 331 72 72 THR C C 174.917 0.1 1 332 72 72 THR CA C 61.920 0.1 1 333 72 72 THR CB C 69.973 0.1 1 334 72 72 THR N N 118.688 0.07 1 335 73 73 GLY H H 8.466 0.02 1 336 73 73 GLY C C 174.020 0.1 1 337 73 73 GLY CA C 45.266 0.1 1 338 73 73 GLY N N 111.404 0.07 1 339 74 74 VAL H H 8.111 0.02 1 340 74 74 VAL C C 176.555 0.1 1 341 74 74 VAL CA C 62.392 0.1 1 342 74 74 VAL CB C 32.868 0.1 1 343 74 74 VAL N N 119.572 0.07 1 344 75 75 THR H H 8.327 0.02 1 345 75 75 THR C C 174.080 0.1 1 346 75 75 THR CA C 62.051 0.1 1 347 75 75 THR CB C 69.859 0.1 1 348 75 75 THR N N 118.982 0.07 1 349 76 76 ALA H H 8.397 0.02 1 350 76 76 ALA C C 177.573 0.1 1 351 76 76 ALA CA C 52.498 0.1 1 352 76 76 ALA CB C 19.305 0.1 1 353 76 76 ALA N N 127.455 0.07 1 354 77 77 VAL H H 8.170 0.02 1 355 77 77 VAL C C 176.014 0.1 1 356 77 77 VAL CA C 62.191 0.1 1 357 77 77 VAL CB C 32.874 0.1 1 358 77 77 VAL N N 120.119 0.07 1 359 78 78 ALA H H 8.436 0.02 1 360 78 78 ALA C C 177.643 0.1 1 361 78 78 ALA CA C 52.790 0.1 1 362 78 78 ALA CB C 19.081 0.1 1 363 78 78 ALA N N 128.195 0.07 1 364 79 79 GLN H H 8.416 0.02 1 365 79 79 GLN C C 175.958 0.1 1 366 79 79 GLN CA C 55.785 0.1 1 367 79 79 GLN CB C 29.580 0.1 1 368 79 79 GLN N N 120.380 0.07 1 369 80 80 LYS H H 8.461 0.02 1 370 80 80 LYS C C 176.699 0.1 1 371 80 80 LYS CA C 56.382 0.1 1 372 80 80 LYS CB C 33.106 0.1 1 373 80 80 LYS N N 123.316 0.07 1 374 81 81 THR H H 8.319 0.02 1 375 81 81 THR C C 174.445 0.1 1 376 81 81 THR CA C 61.853 0.1 1 377 81 81 THR CB C 69.972 0.1 1 378 81 81 THR N N 116.958 0.07 1 379 82 82 VAL H H 8.330 0.02 1 380 82 82 VAL C C 176.165 0.1 1 381 82 82 VAL CA C 62.367 0.1 1 382 82 82 VAL CB C 32.832 0.1 1 383 82 82 VAL N N 123.108 0.07 1 384 83 83 GLU H H 8.608 0.02 1 385 83 83 GLU C C 177.073 0.1 1 386 83 83 GLU CA C 56.822 0.1 1 387 83 83 GLU CB C 30.237 0.1 1 388 83 83 GLU N N 125.406 0.07 1 389 84 84 GLY H H 8.543 0.02 1 390 84 84 GLY C C 174.088 0.1 1 391 84 84 GLY CA C 45.242 0.1 1 392 84 84 GLY N N 110.873 0.07 1 393 85 85 ALA H H 8.258 0.02 1 394 85 85 ALA C C 178.396 0.1 1 395 85 85 ALA CA C 52.999 0.1 1 396 85 85 ALA CB C 19.369 0.1 1 397 85 85 ALA N N 123.830 0.07 1 398 86 86 GLY H H 8.483 0.02 1 399 86 86 GLY C C 173.988 0.1 1 400 86 86 GLY CA C 45.296 0.1 1 401 86 86 GLY N N 107.771 0.07 1 402 87 87 ASN H H 8.296 0.02 1 403 87 87 ASN C C 175.346 0.1 1 404 87 87 ASN CA C 53.177 0.1 1 405 87 87 ASN CB C 38.858 0.1 1 406 87 87 ASN N N 118.808 0.07 1 407 88 88 ILE H H 8.155 0.02 1 408 88 88 ILE C C 176.173 0.1 1 409 88 88 ILE CA C 61.302 0.1 1 410 88 88 ILE CB C 38.735 0.1 1 411 88 88 ILE N N 121.646 0.07 1 412 89 89 ALA H H 8.402 0.02 1 413 89 89 ALA C C 177.540 0.1 1 414 89 89 ALA CA C 52.544 0.1 1 415 89 89 ALA CB C 19.050 0.1 1 416 89 89 ALA N N 128.111 0.07 1 417 90 90 ALA H H 8.212 0.02 1 418 90 90 ALA C C 177.717 0.1 1 419 90 90 ALA CA C 52.449 0.1 1 420 90 90 ALA CB C 19.079 0.1 1 421 90 90 ALA N N 123.364 0.07 1 422 91 91 ALA H H 8.322 0.02 1 423 91 91 ALA C C 178.124 0.1 1 424 91 91 ALA CA C 52.683 0.1 1 425 91 91 ALA CB C 19.140 0.1 1 426 91 91 ALA N N 123.486 0.07 1 427 92 92 THR H H 8.125 0.02 1 428 92 92 THR C C 175.160 0.1 1 429 92 92 THR CA C 61.950 0.1 1 430 92 92 THR CB C 69.764 0.1 1 431 92 92 THR N N 112.711 0.07 1 432 93 93 GLY H H 8.343 0.02 1 433 93 93 GLY C C 173.618 0.1 1 434 93 93 GLY CA C 45.247 0.1 1 435 93 93 GLY N N 110.766 0.07 1 436 94 94 PHE H H 8.123 0.02 1 437 94 94 PHE C C 175.470 0.1 1 438 94 94 PHE CA C 57.858 0.1 1 439 94 94 PHE CB C 39.722 0.1 1 440 94 94 PHE N N 120.401 0.07 1 441 95 95 VAL H H 8.084 0.02 1 442 95 95 VAL C C 175.410 0.1 1 443 95 95 VAL CA C 62.040 0.1 1 444 95 95 VAL CB C 33.251 0.1 1 445 95 95 VAL N N 123.824 0.07 1 446 96 96 LYS H H 8.424 0.02 1 447 96 96 LYS C C 176.477 0.1 1 448 96 96 LYS CA C 56.381 0.1 1 449 96 96 LYS CB C 33.090 0.1 1 450 96 96 LYS N N 126.491 0.07 1 451 97 97 LYS H H 8.501 0.02 1 452 97 97 LYS C C 176.377 0.1 1 453 97 97 LYS CA C 56.525 0.1 1 454 97 97 LYS CB C 33.181 0.1 1 455 97 97 LYS N N 123.865 0.07 1 456 98 98 ASP H H 8.434 0.02 1 457 98 98 ASP C C 176.217 0.1 1 458 98 98 ASP CA C 54.424 0.1 1 459 98 98 ASP CB C 41.074 0.1 1 460 98 98 ASP N N 121.280 0.07 1 461 99 99 GLN H H 8.373 0.02 1 462 99 99 GLN C C 176.029 0.1 1 463 99 99 GLN CA C 55.968 0.1 1 464 99 99 GLN CB C 29.442 0.1 1 465 99 99 GLN N N 120.274 0.07 1 466 100 100 LEU H H 8.323 0.02 1 467 100 100 LEU C C 178.003 0.1 1 468 100 100 LEU CA C 55.521 0.1 1 469 100 100 LEU CB C 42.249 0.1 1 470 100 100 LEU N N 122.921 0.07 1 471 101 101 GLY H H 8.509 0.02 1 472 101 101 GLY C C 174.093 0.1 1 473 101 101 GLY CA C 45.304 0.1 1 474 101 101 GLY N N 109.875 0.07 1 475 102 102 LYS H H 8.237 0.02 1 476 102 102 LYS C C 176.464 0.1 1 477 102 102 LYS CA C 56.206 0.1 1 478 102 102 LYS CB C 32.966 0.1 1 479 102 102 LYS N N 120.814 0.07 1 480 103 103 ASN H H 8.650 0.02 1 481 103 103 ASN C C 175.297 0.1 1 482 103 103 ASN CA C 53.315 0.1 1 483 103 103 ASN CB C 38.809 0.1 1 484 103 103 ASN N N 120.078 0.07 1 485 104 104 GLU H H 8.508 0.02 1 486 104 104 GLU C C 176.561 0.1 1 487 104 104 GLU CA C 56.700 0.1 1 488 104 104 GLU CB C 30.180 0.1 1 489 104 104 GLU N N 121.494 0.07 1 490 105 105 GLU H H 8.498 0.02 1 491 105 105 GLU C C 176.993 0.1 1 492 105 105 GLU CA C 56.780 0.1 1 493 105 105 GLU CB C 30.316 0.1 1 494 105 105 GLU N N 122.038 0.07 1 495 106 106 GLY H H 8.461 0.02 1 496 106 106 GLY C C 173.441 0.1 1 497 106 106 GLY CA C 45.033 0.1 1 498 106 106 GLY N N 110.270 0.07 1 499 107 107 ALA H H 8.155 0.02 1 500 107 107 ALA C C 175.569 0.1 1 501 107 107 ALA CA C 50.493 0.1 1 502 107 107 ALA CB C 18.240 0.1 1 503 107 107 ALA N N 125.011 0.07 1 504 108 108 PRO C C 177.065 0.1 1 505 108 108 PRO CA C 63.149 0.1 1 506 108 108 PRO CB C 32.051 0.1 1 507 109 109 GLN H H 8.619 0.02 1 508 109 109 GLN C C 175.995 0.1 1 509 109 109 GLN CA C 55.699 0.1 1 510 109 109 GLN CB C 29.669 0.1 1 511 109 109 GLN N N 121.267 0.07 1 512 110 110 GLU H H 8.556 0.02 1 513 110 110 GLU C C 176.850 0.1 1 514 110 110 GLU CA C 56.653 0.1 1 515 110 110 GLU CB C 30.427 0.1 1 516 110 110 GLU N N 122.620 0.07 1 517 111 111 GLY H H 8.516 0.02 1 518 111 111 GLY C C 173.761 0.1 1 519 111 111 GLY CA C 45.166 0.1 1 520 111 111 GLY N N 110.316 0.07 1 521 112 112 ILE H H 8.029 0.02 1 522 112 112 ILE C C 176.246 0.1 1 523 112 112 ILE CA C 60.880 0.1 1 524 112 112 ILE CB C 38.672 0.1 1 525 112 112 ILE N N 120.225 0.07 1 526 113 113 LEU H H 8.439 0.02 1 527 113 113 LEU C C 177.143 0.1 1 528 113 113 LEU CA C 54.975 0.1 1 529 113 113 LEU CB C 42.393 0.1 1 530 113 113 LEU N N 127.133 0.07 1 531 114 114 GLU H H 8.456 0.02 1 532 114 114 GLU C C 175.872 0.1 1 533 114 114 GLU CA C 56.517 0.1 1 534 114 114 GLU CB C 30.603 0.1 1 535 114 114 GLU N N 122.302 0.07 1 536 115 115 ASP H H 8.390 0.02 1 537 115 115 ASP C C 175.787 0.1 1 538 115 115 ASP CA C 54.288 0.1 1 539 115 115 ASP CB C 41.166 0.1 1 540 115 115 ASP N N 121.518 0.07 1 541 116 116 MET H H 8.287 0.02 1 542 116 116 MET C C 174.073 0.1 1 543 116 116 MET CA C 53.228 0.1 1 544 116 116 MET CB C 32.532 0.1 1 545 116 116 MET N N 122.082 0.07 1 546 117 117 PRO C C 176.724 0.1 1 547 117 117 PRO CA C 62.900 0.1 1 548 117 117 PRO CB C 32.134 0.1 1 549 118 118 VAL H H 8.330 0.02 1 550 118 118 VAL C C 175.764 0.1 1 551 118 118 VAL CA C 62.007 0.1 1 552 118 118 VAL CB C 33.086 0.1 1 553 118 118 VAL N N 120.918 0.07 1 554 119 119 ASP H H 8.549 0.02 1 555 119 119 ASP C C 174.713 0.1 1 556 119 119 ASP CA C 52.110 0.1 1 557 119 119 ASP CB C 41.130 0.1 1 558 119 119 ASP N N 126.061 0.07 1 559 120 120 PRO C C 176.927 0.1 1 560 120 120 PRO CA C 63.532 0.1 1 561 120 120 PRO CB C 32.205 0.1 1 562 121 121 ASP H H 8.411 0.02 1 563 121 121 ASP C C 176.186 0.1 1 564 121 121 ASP CA C 54.559 0.1 1 565 121 121 ASP CB C 40.956 0.1 1 566 121 121 ASP N N 119.395 0.07 1 567 122 122 ASN H H 8.146 0.02 1 568 122 122 ASN C C 175.393 0.1 1 569 122 122 ASN CA C 53.493 0.1 1 570 122 122 ASN CB C 39.344 0.1 1 571 122 122 ASN N N 119.192 0.07 1 572 123 123 GLU H H 8.413 0.02 1 573 123 123 GLU C C 176.087 0.1 1 574 123 123 GLU CA C 56.899 0.1 1 575 123 123 GLU CB C 30.113 0.1 1 576 123 123 GLU N N 121.864 0.07 1 577 124 124 ALA H H 8.257 0.02 1 578 124 124 ALA C C 177.204 0.1 1 579 124 124 ALA CA C 52.299 0.1 1 580 124 124 ALA CB C 19.193 0.1 1 581 124 124 ALA N N 124.509 0.07 1 582 125 125 TYR H H 8.060 0.02 1 583 125 125 TYR C C 175.342 0.1 1 584 125 125 TYR CA C 57.801 0.1 1 585 125 125 TYR CB C 39.004 0.1 1 586 125 125 TYR N N 120.109 0.07 1 587 126 126 GLU H H 8.166 0.02 1 588 126 126 GLU C C 175.436 0.1 1 589 126 126 GLU CA C 55.641 0.1 1 590 126 126 GLU CB C 30.789 0.1 1 591 126 126 GLU N N 123.941 0.07 1 592 127 127 MET H H 8.450 0.02 1 593 127 127 MET C C 174.247 0.1 1 594 127 127 MET CA C 53.280 0.1 1 595 127 127 MET CB C 32.626 0.1 1 596 127 127 MET N N 123.991 0.07 1 597 128 128 PRO C C 176.893 0.1 1 598 128 128 PRO CA C 63.099 0.1 1 599 128 128 PRO CB C 32.200 0.1 1 600 129 129 SER H H 8.519 0.02 1 601 129 129 SER C C 174.799 0.1 1 602 129 129 SER CA C 58.297 0.1 1 603 129 129 SER CB C 63.924 0.1 1 604 129 129 SER N N 116.863 0.07 1 605 130 130 GLU H H 8.609 0.02 1 606 130 130 GLU C C 176.524 0.1 1 607 130 130 GLU CA C 56.484 0.1 1 608 130 130 GLU CB C 30.327 0.1 1 609 130 130 GLU N N 123.287 0.07 1 610 131 131 GLU C C 176.974 0.1 1 611 131 131 GLU CA C 56.837 0.1 1 612 131 131 GLU CB C 30.253 0.1 1 613 132 132 GLY H H 8.467 0.02 1 614 132 132 GLY C C 173.839 0.1 1 615 132 132 GLY CA C 45.176 0.1 1 616 132 132 GLY N N 110.088 0.07 1 617 133 133 TYR H H 8.095 0.02 1 618 133 133 TYR C C 175.741 0.1 1 619 133 133 TYR CA C 58.215 0.1 1 620 133 133 TYR CB C 38.767 0.1 1 621 133 133 TYR N N 120.373 0.07 1 622 134 134 GLN H H 8.254 0.02 1 623 134 134 GLN C C 174.872 0.1 1 624 134 134 GLN CA C 55.472 0.1 1 625 134 134 GLN CB C 29.859 0.1 1 626 134 134 GLN N N 122.823 0.07 1 627 135 135 ASP H H 8.264 0.02 1 628 135 135 ASP C C 175.521 0.1 1 629 135 135 ASP CA C 54.266 0.1 1 630 135 135 ASP CB C 41.193 0.1 1 631 135 135 ASP N N 121.781 0.07 1 632 136 136 TYR H H 8.067 0.02 1 633 136 136 TYR C C 175.073 0.1 1 634 136 136 TYR CA C 57.607 0.1 1 635 136 136 TYR CB C 39.113 0.1 1 636 136 136 TYR N N 120.560 0.07 1 637 137 137 GLU H H 8.283 0.02 1 638 137 137 GLU C C 173.714 0.1 1 639 137 137 GLU CA C 53.647 0.1 1 640 137 137 GLU CB C 30.301 0.1 1 641 137 137 GLU N N 125.505 0.07 1 642 138 138 PRO C C 176.874 0.1 1 643 138 138 PRO CA C 63.008 0.1 1 644 138 138 PRO CB C 32.287 0.1 1 645 139 139 GLU H H 8.552 0.02 1 646 139 139 GLU C C 175.407 0.1 1 647 139 139 GLU CA C 56.635 0.1 1 648 139 139 GLU CB C 30.324 0.1 1 649 139 139 GLU N N 121.670 0.07 1 650 140 140 ALA H H 8.023 0.02 1 651 140 140 ALA CA C 53.819 0.1 1 652 140 140 ALA CB C 20.248 0.1 1 653 140 140 ALA N N 130.996 0.07 1 stop_ save_