data_19221 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; solution structure of a proteasome related subunit C terminal domain ; _BMRB_accession_number 19221 _BMRB_flat_file_name bmr19221.str _Entry_type original _Submission_date 2013-05-03 _Accession_date 2013-05-03 _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 Wu Yujie . . 2 Hu Yunfei . . 3 Jin Changwen . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 998 "13C chemical shifts" 785 "15N chemical shifts" 187 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2015-02-02 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 19220 'proteasome related subunit N terminal domain' stop_ _Original_release_date 2015-02-02 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution Structure of Yeast Rpn9: Insights for Proteasome Lid Assembly' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 25631053 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Wu Yujie . . 2 Hu Yunfei . . 3 Jin Changwen . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'proteasome related subunit C terminal domain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'proteasome related subunit C terminal domain' $entity 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_entity _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity _Molecular_mass 20247.520 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 176 _Mol_residue_sequence ; FKNDFNSFYYTSLLYLSTLE PSTSITLAERQQLAYDLSIS ALLGDKIYNFGELLHHPIME TIVNDSNYDWLFQLLNALTV GDFDKFDSLIKVQISKIPIL AQHESFLRQKICLMTLIETV FVKNIRMLSFEDISKATHLP KDNVEHLVMRAISLGLLKGS IDQVNELVTISWVQPR ; loop_ _Residue_seq_code _Residue_label 1 PHE 2 LYS 3 ASN 4 ASP 5 PHE 6 ASN 7 SER 8 PHE 9 TYR 10 TYR 11 THR 12 SER 13 LEU 14 LEU 15 TYR 16 LEU 17 SER 18 THR 19 LEU 20 GLU 21 PRO 22 SER 23 THR 24 SER 25 ILE 26 THR 27 LEU 28 ALA 29 GLU 30 ARG 31 GLN 32 GLN 33 LEU 34 ALA 35 TYR 36 ASP 37 LEU 38 SER 39 ILE 40 SER 41 ALA 42 LEU 43 LEU 44 GLY 45 ASP 46 LYS 47 ILE 48 TYR 49 ASN 50 PHE 51 GLY 52 GLU 53 LEU 54 LEU 55 HIS 56 HIS 57 PRO 58 ILE 59 MET 60 GLU 61 THR 62 ILE 63 VAL 64 ASN 65 ASP 66 SER 67 ASN 68 TYR 69 ASP 70 TRP 71 LEU 72 PHE 73 GLN 74 LEU 75 LEU 76 ASN 77 ALA 78 LEU 79 THR 80 VAL 81 GLY 82 ASP 83 PHE 84 ASP 85 LYS 86 PHE 87 ASP 88 SER 89 LEU 90 ILE 91 LYS 92 VAL 93 GLN 94 ILE 95 SER 96 LYS 97 ILE 98 PRO 99 ILE 100 LEU 101 ALA 102 GLN 103 HIS 104 GLU 105 SER 106 PHE 107 LEU 108 ARG 109 GLN 110 LYS 111 ILE 112 CYS 113 LEU 114 MET 115 THR 116 LEU 117 ILE 118 GLU 119 THR 120 VAL 121 PHE 122 VAL 123 LYS 124 ASN 125 ILE 126 ARG 127 MET 128 LEU 129 SER 130 PHE 131 GLU 132 ASP 133 ILE 134 SER 135 LYS 136 ALA 137 THR 138 HIS 139 LEU 140 PRO 141 LYS 142 ASP 143 ASN 144 VAL 145 GLU 146 HIS 147 LEU 148 VAL 149 MET 150 ARG 151 ALA 152 ILE 153 SER 154 LEU 155 GLY 156 LEU 157 LEU 158 LYS 159 GLY 160 SER 161 ILE 162 ASP 163 GLN 164 VAL 165 ASN 166 GLU 167 LEU 168 VAL 169 THR 170 ILE 171 SER 172 TRP 173 VAL 174 GLN 175 PRO 176 ARG 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 19219 a_proteasome_subunit 100.00 401 100.00 100.00 1.19e-120 PDB 2MR3 "A Subunit Of 26s Proteasome Lid Complex" 100.00 356 100.00 100.00 1.64e-121 PDB 2MRI "Solution Structure Of A Proteasome Related Subunit C Terminal Domain" 100.00 176 100.00 100.00 7.33e-124 PDB 4CR2 "Deep Classification Of A Large Cryo-em Dataset Defines The Conformational Landscape Of The 26s Proteasome" 100.00 393 100.00 100.00 4.45e-121 PDB 4CR3 "Deep Classification Of A Large Cryo-em Dataset Defines The Conformational Landscape Of The 26s Proteasome" 100.00 393 100.00 100.00 4.45e-121 PDB 4CR4 "Deep Classification Of A Large Cryo-em Dataset Defines The Conformational Landscape Of The 26s Proteasome" 100.00 393 100.00 100.00 4.45e-121 PDB 5A5B "Structure Of The 26s Proteasome-ubp6 Complex" 100.00 393 100.00 100.00 4.45e-121 DBJ GAA22644 "K7_Rpn9p [Saccharomyces cerevisiae Kyokai no. 7]" 100.00 393 100.00 100.00 4.55e-121 EMBL CAY78927 "Rpn9p [Saccharomyces cerevisiae EC1118]" 100.00 393 100.00 100.00 4.55e-121 GB AAB64853 "Ydr427wp [Saccharomyces cerevisiae]" 100.00 393 100.00 100.00 4.45e-121 GB AHY75380 "Rpn9p [Saccharomyces cerevisiae YJM993]" 100.00 393 100.00 100.00 4.45e-121 GB AJP38106 "Rpn9p [Saccharomyces cerevisiae YJM1078]" 100.00 393 100.00 100.00 4.75e-121 GB AJU58228 "Rpn9p [Saccharomyces cerevisiae YJM189]" 100.00 393 100.00 100.00 4.45e-121 GB AJU58921 "Rpn9p [Saccharomyces cerevisiae YJM193]" 100.00 393 100.00 100.00 4.96e-121 REF NP_010715 "proteasome regulatory particle lid subunit RPN9 [Saccharomyces cerevisiae S288c]" 100.00 393 100.00 100.00 4.45e-121 SP Q04062 "RecName: Full=26S proteasome regulatory subunit RPN9; AltName: Full=Proteasome non-ATPase subunit 7" 100.00 393 100.00 100.00 4.45e-121 TPG DAA12266 "TPA: proteasome regulatory particle lid subunit RPN9 [Saccharomyces cerevisiae S288c]" 100.00 393 100.00 100.00 4.45e-121 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity 'baker's yeast' 4932 Eukaryota Fungi Saccharomyces cerevisiae 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 $entity 'recombinant technology' . Escherichia coli . pET21a 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 $entity 0.5 mM '[U-100% 13C; U-100% 15N]' TRIS 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' DTT 10 mM 'natural abundance' DSS 0.03 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 500 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _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_2D_1H-13C_HSQC_aliphatic_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aliphatic' _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_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HCCH-COSY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aliphatic_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _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' 0.07 . 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 0.00 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 '3D 1H-13C NOESY aliphatic' '3D 1H-15N NOESY' 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 'proteasome related subunit C terminal domain' _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 PHE HA H 3.870 0.02 1 2 1 1 PHE HB2 H 2.970 0.02 2 3 1 1 PHE HD1 H 7.161 0.02 3 4 1 1 PHE CA C 58.040 0.2 1 5 1 1 PHE CB C 41.616 0.2 1 6 1 1 PHE CD1 C 132.570 0.2 3 7 2 2 LYS HA H 4.140 0.02 1 8 2 2 LYS HB2 H 1.573 0.02 2 9 2 2 LYS HB3 H 1.673 0.02 2 10 2 2 LYS HG2 H 1.194 0.02 2 11 2 2 LYS HG3 H 1.245 0.02 2 12 2 2 LYS HD2 H 1.608 0.02 2 13 2 2 LYS HE2 H 2.884 0.02 2 14 2 2 LYS CA C 56.090 0.2 1 15 2 2 LYS CB C 32.930 0.2 1 16 2 2 LYS CG C 24.530 0.2 1 17 2 2 LYS CD C 29.150 0.2 1 18 2 2 LYS CE C 42.170 0.2 1 19 4 4 ASP C C 176.140 0.2 1 20 4 4 ASP CA C 55.530 0.2 1 21 4 4 ASP CB C 41.980 0.2 1 22 5 5 PHE H H 7.853 0.02 1 23 5 5 PHE HA H 4.179 0.02 1 24 5 5 PHE HB2 H 2.548 0.02 2 25 5 5 PHE HB3 H 3.471 0.02 2 26 5 5 PHE HD1 H 6.995 0.02 3 27 5 5 PHE C C 177.706 0.2 1 28 5 5 PHE CA C 61.880 0.2 1 29 5 5 PHE CB C 38.900 0.2 1 30 5 5 PHE CD1 C 132.920 0.2 3 31 5 5 PHE N N 122.270 0.2 1 32 6 6 ASN H H 8.051 0.02 1 33 6 6 ASN HA H 4.401 0.02 1 34 6 6 ASN HB2 H 2.729 0.02 2 35 6 6 ASN HB3 H 3.033 0.02 2 36 6 6 ASN HD22 H 7.716 0.02 2 37 6 6 ASN C C 176.990 0.2 1 38 6 6 ASN CA C 56.470 0.2 1 39 6 6 ASN CB C 39.223 0.2 1 40 6 6 ASN N N 114.920 0.2 1 41 6 6 ASN ND2 N 116.705 0.2 1 42 7 7 SER H H 8.041 0.02 1 43 7 7 SER HA H 4.435 0.02 1 44 7 7 SER HB2 H 3.939 0.02 2 45 7 7 SER C C 177.780 0.2 1 46 7 7 SER CA C 61.440 0.2 1 47 7 7 SER CB C 62.770 0.2 1 48 7 7 SER N N 112.970 0.2 1 49 8 8 PHE H H 8.364 0.02 1 50 8 8 PHE HA H 4.067 0.02 1 51 8 8 PHE HB2 H 3.220 0.02 2 52 8 8 PHE HD1 H 7.236 0.02 3 53 8 8 PHE C C 177.959 0.2 1 54 8 8 PHE CA C 62.110 0.2 1 55 8 8 PHE CB C 38.966 0.2 1 56 8 8 PHE N N 123.560 0.2 1 57 9 9 TYR H H 8.230 0.02 1 58 9 9 TYR HA H 4.000 0.02 1 59 9 9 TYR HB2 H 3.004 0.02 2 60 9 9 TYR HB3 H 3.078 0.02 2 61 9 9 TYR HD1 H 6.376 0.02 3 62 9 9 TYR HE1 H 6.502 0.02 3 63 9 9 TYR C C 176.360 0.2 1 64 9 9 TYR CA C 62.010 0.2 1 65 9 9 TYR CB C 38.200 0.2 1 66 9 9 TYR CD1 C 133.200 0.2 3 67 9 9 TYR CE1 C 118.010 0.2 3 68 9 9 TYR N N 122.550 0.2 1 69 10 10 TYR H H 7.958 0.02 1 70 10 10 TYR HA H 4.106 0.02 1 71 10 10 TYR HB2 H 3.206 0.02 2 72 10 10 TYR HB3 H 2.962 0.02 2 73 10 10 TYR HD1 H 7.374 0.02 3 74 10 10 TYR HE1 H 6.897 0.02 3 75 10 10 TYR C C 180.280 0.2 1 76 10 10 TYR CA C 62.520 0.2 1 77 10 10 TYR CB C 37.930 0.2 1 78 10 10 TYR CD2 C 133.652 0.2 3 79 10 10 TYR CE2 C 118.040 0.2 3 80 10 10 TYR N N 115.490 0.2 1 81 11 11 THR H H 8.806 0.02 1 82 11 11 THR HA H 3.934 0.02 1 83 11 11 THR HB H 4.133 0.02 1 84 11 11 THR HG2 H 1.221 0.02 1 85 11 11 THR CA C 66.560 0.2 1 86 11 11 THR CB C 68.750 0.2 1 87 11 11 THR CG2 C 21.671 0.2 1 88 11 11 THR N N 115.140 0.2 1 89 12 12 SER H H 8.151 0.02 1 90 12 12 SER HA H 3.346 0.02 1 91 12 12 SER HB2 H 4.515 0.02 2 92 12 12 SER HB3 H 4.331 0.02 2 93 12 12 SER C C 175.891 0.2 1 94 12 12 SER CA C 62.740 0.2 1 95 12 12 SER CB C 62.580 0.2 1 96 12 12 SER N N 120.384 0.2 1 97 13 13 LEU H H 7.893 0.02 1 98 13 13 LEU HA H 3.801 0.02 1 99 13 13 LEU HB2 H 1.343 0.02 2 100 13 13 LEU HB3 H 1.603 0.02 2 101 13 13 LEU HG H 1.247 0.02 1 102 13 13 LEU HD1 H 0.390 0.02 2 103 13 13 LEU HD2 H 0.487 0.02 2 104 13 13 LEU C C 180.374 0.2 1 105 13 13 LEU CA C 58.350 0.2 1 106 13 13 LEU CB C 41.410 0.2 1 107 13 13 LEU CG C 26.340 0.2 1 108 13 13 LEU CD1 C 25.290 0.2 2 109 13 13 LEU CD2 C 23.160 0.2 2 110 13 13 LEU N N 121.640 0.2 1 111 14 14 LEU H H 7.528 0.02 1 112 14 14 LEU HA H 4.161 0.02 1 113 14 14 LEU HB2 H 1.754 0.02 2 114 14 14 LEU HG H 1.652 0.02 1 115 14 14 LEU HD1 H 0.908 0.02 2 116 14 14 LEU HD2 H 0.870 0.02 2 117 14 14 LEU C C 179.880 0.2 1 118 14 14 LEU CA C 58.000 0.2 1 119 14 14 LEU CB C 41.550 0.2 1 120 14 14 LEU CG C 26.870 0.2 1 121 14 14 LEU CD1 C 23.780 0.2 2 122 14 14 LEU CD2 C 24.400 0.2 2 123 14 14 LEU N N 120.470 0.2 1 124 15 15 TYR H H 8.135 0.02 1 125 15 15 TYR HA H 4.265 0.02 1 126 15 15 TYR HB2 H 3.124 0.02 2 127 15 15 TYR HB3 H 3.234 0.02 2 128 15 15 TYR HD1 H 7.013 0.02 3 129 15 15 TYR HE1 H 6.693 0.02 3 130 15 15 TYR C C 177.033 0.2 1 131 15 15 TYR CA C 60.730 0.2 1 132 15 15 TYR CB C 38.100 0.2 1 133 15 15 TYR CD2 C 133.037 0.2 3 134 15 15 TYR CE2 C 118.160 0.2 3 135 15 15 TYR N N 122.257 0.2 1 136 16 16 LEU H H 8.452 0.02 1 137 16 16 LEU HA H 3.805 0.02 1 138 16 16 LEU HB2 H 1.877 0.02 2 139 16 16 LEU HB3 H 1.521 0.02 2 140 16 16 LEU HG H 1.889 0.02 1 141 16 16 LEU HD1 H 0.531 0.02 2 142 16 16 LEU HD2 H 0.849 0.02 2 143 16 16 LEU C C 179.055 0.2 1 144 16 16 LEU CA C 57.213 0.2 1 145 16 16 LEU CB C 42.065 0.2 1 146 16 16 LEU CG C 27.133 0.2 1 147 16 16 LEU CD1 C 25.865 0.2 2 148 16 16 LEU CD2 C 23.440 0.2 2 149 16 16 LEU N N 118.440 0.2 1 150 17 17 SER H H 7.848 0.02 1 151 17 17 SER HA H 4.430 0.02 1 152 17 17 SER HB2 H 4.091 0.02 2 153 17 17 SER C C 175.197 0.2 1 154 17 17 SER CA C 61.040 0.2 1 155 17 17 SER CB C 63.460 0.2 1 156 17 17 SER N N 114.450 0.2 1 157 18 18 THR H H 7.505 0.02 1 158 18 18 THR HA H 4.452 0.02 1 159 18 18 THR HB H 4.414 0.02 1 160 18 18 THR HG2 H 1.236 0.02 1 161 18 18 THR C C 174.439 0.2 1 162 18 18 THR CA C 61.421 0.2 1 163 18 18 THR CB C 69.940 0.2 1 164 18 18 THR CG2 C 21.272 0.2 1 165 18 18 THR N N 110.850 0.2 1 166 19 19 LEU H H 7.095 0.02 1 167 19 19 LEU HA H 4.160 0.02 1 168 19 19 LEU HB2 H 1.453 0.02 2 169 19 19 LEU HB3 H 1.501 0.02 2 170 19 19 LEU HG H 1.505 0.02 1 171 19 19 LEU HD1 H 0.749 0.02 2 172 19 19 LEU HD2 H 0.665 0.02 2 173 19 19 LEU C C 176.926 0.2 1 174 19 19 LEU CA C 55.290 0.2 1 175 19 19 LEU CB C 42.448 0.2 1 176 19 19 LEU CG C 25.980 0.2 1 177 19 19 LEU CD1 C 24.868 0.2 2 178 19 19 LEU CD2 C 23.891 0.2 2 179 19 19 LEU N N 123.180 0.2 1 180 20 20 GLU H H 8.535 0.02 1 181 20 20 GLU HA H 4.608 0.02 1 182 20 20 GLU HB2 H 2.138 0.02 2 183 20 20 GLU HB3 H 1.925 0.02 2 184 20 20 GLU HG2 H 2.352 0.02 2 185 20 20 GLU HG3 H 2.298 0.02 2 186 20 20 GLU C C 175.915 0.2 1 187 20 20 GLU CA C 54.773 0.2 1 188 20 20 GLU CB C 29.590 0.2 1 189 20 20 GLU CG C 36.260 0.2 1 190 20 20 GLU N N 125.330 0.2 1 191 21 21 PRO HA H 4.333 0.02 1 192 21 21 PRO HB2 H 2.309 0.02 2 193 21 21 PRO HB3 H 1.961 0.02 2 194 21 21 PRO HG2 H 2.095 0.02 2 195 21 21 PRO HD2 H 3.894 0.02 2 196 21 21 PRO HD3 H 3.801 0.02 2 197 21 21 PRO C C 177.196 0.2 1 198 21 21 PRO CA C 64.780 0.2 1 199 21 21 PRO CB C 31.850 0.2 1 200 21 21 PRO CG C 27.685 0.2 1 201 21 21 PRO CD C 50.838 0.2 1 202 22 22 SER H H 7.967 0.02 1 203 22 22 SER HA H 4.398 0.02 1 204 22 22 SER HB2 H 4.030 0.02 2 205 22 22 SER HB3 H 3.841 0.02 2 206 22 22 SER C C 175.056 0.2 1 207 22 22 SER CA C 58.530 0.2 1 208 22 22 SER CB C 63.500 0.2 1 209 22 22 SER N N 111.220 0.2 1 210 23 23 THR H H 7.936 0.02 1 211 23 23 THR HA H 4.279 0.02 1 212 23 23 THR HB H 4.291 0.02 1 213 23 23 THR HG2 H 1.224 0.02 1 214 23 23 THR C C 174.573 0.2 1 215 23 23 THR CA C 62.920 0.2 1 216 23 23 THR CB C 69.260 0.2 1 217 23 23 THR CG2 C 21.608 0.2 1 218 23 23 THR N N 117.440 0.2 1 219 24 24 SER H H 8.438 0.02 1 220 24 24 SER HA H 4.485 0.02 1 221 24 24 SER HB2 H 3.886 0.02 2 222 24 24 SER C C 174.082 0.2 1 223 24 24 SER CA C 58.600 0.2 1 224 24 24 SER CB C 63.430 0.2 1 225 24 24 SER N N 119.820 0.2 1 226 25 25 ILE H H 7.870 0.02 1 227 25 25 ILE HA H 4.479 0.02 1 228 25 25 ILE HB H 1.817 0.02 1 229 25 25 ILE HG12 H 1.531 0.02 2 230 25 25 ILE HG13 H 1.189 0.02 2 231 25 25 ILE HG2 H 0.979 0.02 1 232 25 25 ILE HD1 H 0.843 0.02 1 233 25 25 ILE C C 176.472 0.2 1 234 25 25 ILE CA C 61.010 0.2 1 235 25 25 ILE CB C 39.460 0.2 1 236 25 25 ILE CG1 C 27.319 0.2 1 237 25 25 ILE CG2 C 17.582 0.2 1 238 25 25 ILE CD1 C 13.430 0.2 1 239 25 25 ILE N N 123.140 0.2 1 240 26 26 THR H H 8.649 0.02 1 241 26 26 THR HA H 4.394 0.02 1 242 26 26 THR HB H 4.682 0.02 1 243 26 26 THR HG2 H 1.402 0.02 1 244 26 26 THR C C 175.540 0.2 1 245 26 26 THR CA C 61.890 0.2 1 246 26 26 THR CB C 71.320 0.2 1 247 26 26 THR CG2 C 21.914 0.2 1 248 26 26 THR N N 118.120 0.2 1 249 27 27 LEU H H 8.766 0.02 1 250 27 27 LEU HA H 4.089 0.02 1 251 27 27 LEU HB2 H 1.846 0.02 2 252 27 27 LEU HB3 H 1.687 0.02 2 253 27 27 LEU HG H 1.539 0.02 1 254 27 27 LEU HD1 H 0.982 0.02 2 255 27 27 LEU HD2 H 1.028 0.02 2 256 27 27 LEU C C 178.653 0.2 1 257 27 27 LEU CA C 58.760 0.2 1 258 27 27 LEU CB C 41.180 0.2 1 259 27 27 LEU CG C 27.150 0.2 1 260 27 27 LEU CD1 C 24.940 0.2 2 261 27 27 LEU CD2 C 23.349 0.2 2 262 27 27 LEU N N 123.130 0.2 1 263 28 28 ALA H H 8.546 0.02 1 264 28 28 ALA HA H 4.263 0.02 1 265 28 28 ALA HB H 1.465 0.02 1 266 28 28 ALA C C 178.218 0.2 1 267 28 28 ALA CA C 55.320 0.2 1 268 28 28 ALA CB C 18.120 0.2 1 269 28 28 ALA N N 119.510 0.2 1 270 29 29 GLU H H 7.719 0.02 1 271 29 29 GLU HA H 4.081 0.02 1 272 29 29 GLU HB2 H 2.001 0.02 2 273 29 29 GLU HB3 H 2.340 0.02 2 274 29 29 GLU HG3 H 2.296 0.02 2 275 29 29 GLU C C 179.929 0.2 1 276 29 29 GLU CA C 59.300 0.2 1 277 29 29 GLU CB C 30.076 0.2 1 278 29 29 GLU CG C 37.655 0.2 1 279 29 29 GLU N N 118.210 0.2 1 280 30 30 ARG H H 8.410 0.02 1 281 30 30 ARG HA H 3.959 0.02 1 282 30 30 ARG HB2 H 2.160 0.02 2 283 30 30 ARG HB3 H 1.936 0.02 2 284 30 30 ARG HG2 H 1.477 0.02 2 285 30 30 ARG HG3 H 1.882 0.02 2 286 30 30 ARG HD2 H 3.148 0.02 2 287 30 30 ARG HD3 H 3.234 0.02 2 288 30 30 ARG HE H 6.911 0.02 1 289 30 30 ARG C C 177.538 0.2 1 290 30 30 ARG CA C 60.645 0.2 1 291 30 30 ARG CB C 31.000 0.2 1 292 30 30 ARG CG C 29.355 0.2 1 293 30 30 ARG CD C 43.811 0.2 1 294 30 30 ARG N N 121.350 0.2 1 295 30 30 ARG NE N 84.370 0.2 1 296 31 31 GLN H H 8.742 0.02 1 297 31 31 GLN HA H 3.952 0.02 1 298 31 31 GLN HB2 H 2.261 0.02 2 299 31 31 GLN HB3 H 1.702 0.02 2 300 31 31 GLN HG2 H 2.594 0.02 2 301 31 31 GLN HG3 H 1.997 0.02 2 302 31 31 GLN HE21 H 7.361 0.02 2 303 31 31 GLN HE22 H 7.671 0.02 2 304 31 31 GLN C C 178.220 0.2 1 305 31 31 GLN CA C 58.955 0.2 1 306 31 31 GLN CB C 28.630 0.2 1 307 31 31 GLN CG C 34.748 0.2 1 308 31 31 GLN N N 117.670 0.2 1 309 31 31 GLN NE2 N 112.750 0.2 1 310 32 32 GLN H H 7.732 0.02 1 311 32 32 GLN HA H 3.987 0.02 1 312 32 32 GLN HB2 H 2.174 0.02 2 313 32 32 GLN HB3 H 2.260 0.02 2 314 32 32 GLN HG2 H 2.479 0.02 2 315 32 32 GLN HE21 H 8.071 0.02 2 316 32 32 GLN HE22 H 6.685 0.02 2 317 32 32 GLN C C 177.712 0.2 1 318 32 32 GLN CA C 58.330 0.2 1 319 32 32 GLN CB C 28.320 0.2 1 320 32 32 GLN CG C 33.491 0.2 1 321 32 32 GLN N N 117.910 0.2 1 322 32 32 GLN NE2 N 115.900 0.2 1 323 33 33 LEU H H 7.846 0.02 1 324 33 33 LEU HA H 4.404 0.02 1 325 33 33 LEU HB2 H 1.684 0.02 2 326 33 33 LEU HB3 H 1.917 0.02 2 327 33 33 LEU HG H 1.749 0.02 1 328 33 33 LEU HD1 H 0.998 0.02 2 329 33 33 LEU HD2 H 1.049 0.02 2 330 33 33 LEU C C 178.876 0.2 1 331 33 33 LEU CA C 58.050 0.2 1 332 33 33 LEU CB C 41.800 0.2 1 333 33 33 LEU CG C 27.417 0.2 1 334 33 33 LEU CD1 C 24.920 0.2 2 335 33 33 LEU CD2 C 24.546 0.2 2 336 33 33 LEU N N 119.680 0.2 1 337 34 34 ALA H H 8.308 0.02 1 338 34 34 ALA HA H 3.741 0.02 1 339 34 34 ALA HB H 1.388 0.02 1 340 34 34 ALA C C 180.025 0.2 1 341 34 34 ALA CA C 55.670 0.2 1 342 34 34 ALA CB C 18.940 0.2 1 343 34 34 ALA N N 121.660 0.2 1 344 35 35 TYR H H 8.457 0.02 1 345 35 35 TYR HA H 3.758 0.02 1 346 35 35 TYR HB2 H 2.831 0.02 2 347 35 35 TYR HB3 H 3.279 0.02 2 348 35 35 TYR HD1 H 7.067 0.02 3 349 35 35 TYR HE1 H 6.686 0.02 3 350 35 35 TYR C C 176.384 0.2 1 351 35 35 TYR CA C 62.020 0.2 1 352 35 35 TYR CB C 38.460 0.2 1 353 35 35 TYR CD1 C 133.340 0.2 3 354 35 35 TYR CE1 C 118.208 0.2 3 355 35 35 TYR N N 120.860 0.2 1 356 36 36 ASP H H 9.072 0.02 1 357 36 36 ASP HA H 4.235 0.02 1 358 36 36 ASP HB2 H 2.508 0.02 2 359 36 36 ASP HB3 H 2.903 0.02 2 360 36 36 ASP C C 180.544 0.2 1 361 36 36 ASP CA C 57.940 0.2 1 362 36 36 ASP CB C 40.470 0.2 1 363 36 36 ASP N N 120.570 0.2 1 364 37 37 LEU H H 9.068 0.02 1 365 37 37 LEU HA H 4.146 0.02 1 366 37 37 LEU HB2 H 1.657 0.02 2 367 37 37 LEU HB3 H 1.787 0.02 2 368 37 37 LEU HG H 0.855 0.02 1 369 37 37 LEU HD1 H 0.580 0.02 2 370 37 37 LEU HD2 H 0.529 0.02 2 371 37 37 LEU C C 178.743 0.2 1 372 37 37 LEU CA C 58.614 0.2 1 373 37 37 LEU CB C 42.810 0.2 1 374 37 37 LEU CG C 26.810 0.2 1 375 37 37 LEU CD1 C 25.685 0.2 2 376 37 37 LEU CD2 C 25.865 0.2 2 377 37 37 LEU N N 123.000 0.2 1 378 38 38 SER H H 7.824 0.02 1 379 38 38 SER HA H 3.680 0.02 1 380 38 38 SER HB2 H 3.971 0.02 2 381 38 38 SER HB3 H 3.228 0.02 2 382 38 38 SER C C 174.113 0.2 1 383 38 38 SER CA C 59.430 0.2 1 384 38 38 SER CB C 63.559 0.2 1 385 38 38 SER N N 116.650 0.2 1 386 39 39 ILE H H 8.313 0.02 1 387 39 39 ILE HA H 3.405 0.02 1 388 39 39 ILE HB H 1.843 0.02 1 389 39 39 ILE HG12 H 0.917 0.02 2 390 39 39 ILE HG13 H 1.019 0.02 2 391 39 39 ILE HG2 H 0.533 0.02 1 392 39 39 ILE HD1 H 0.463 0.02 1 393 39 39 ILE C C 176.113 0.2 1 394 39 39 ILE CA C 62.360 0.2 1 395 39 39 ILE CB C 35.348 0.2 1 396 39 39 ILE CG1 C 26.940 0.2 1 397 39 39 ILE CG2 C 17.800 0.2 1 398 39 39 ILE CD1 C 8.920 0.2 1 399 39 39 ILE N N 121.198 0.2 1 400 40 40 SER H H 7.961 0.02 1 401 40 40 SER HA H 4.534 0.02 1 402 40 40 SER HB3 H 4.336 0.02 2 403 40 40 SER C C 174.881 0.2 1 404 40 40 SER CA C 62.520 0.2 1 405 40 40 SER CB C 62.670 0.2 1 406 40 40 SER N N 115.537 0.2 1 407 41 41 ALA H H 7.878 0.02 1 408 41 41 ALA HA H 3.592 0.02 1 409 41 41 ALA HB H 1.204 0.02 1 410 41 41 ALA C C 178.822 0.2 1 411 41 41 ALA CA C 54.122 0.2 1 412 41 41 ALA CB C 18.390 0.2 1 413 41 41 ALA N N 123.360 0.2 1 414 42 42 LEU H H 7.737 0.02 1 415 42 42 LEU HA H 3.576 0.02 1 416 42 42 LEU HB2 H 1.169 0.02 2 417 42 42 LEU HB3 H 1.846 0.02 2 418 42 42 LEU HG H 1.521 0.02 1 419 42 42 LEU HD1 H 0.622 0.02 2 420 42 42 LEU HD2 H 0.598 0.02 2 421 42 42 LEU C C 179.683 0.2 1 422 42 42 LEU CA C 58.731 0.2 1 423 42 42 LEU CB C 42.210 0.2 1 424 42 42 LEU CG C 26.598 0.2 1 425 42 42 LEU CD1 C 25.990 0.2 2 426 42 42 LEU CD2 C 24.733 0.2 2 427 42 42 LEU N N 115.790 0.2 1 428 43 43 LEU H H 7.798 0.02 1 429 43 43 LEU HA H 4.007 0.02 1 430 43 43 LEU HB2 H 0.236 0.02 2 431 43 43 LEU HB3 H 0.326 0.02 2 432 43 43 LEU HG H 1.268 0.02 1 433 43 43 LEU HD1 H -0.107 0.02 2 434 43 43 LEU HD2 H 0.450 0.02 2 435 43 43 LEU C C 177.279 0.2 1 436 43 43 LEU CA C 54.930 0.2 1 437 43 43 LEU CB C 40.820 0.2 1 438 43 43 LEU CG C 25.850 0.2 1 439 43 43 LEU CD1 C 26.093 0.2 2 440 43 43 LEU CD2 C 22.584 0.2 2 441 43 43 LEU N N 113.670 0.2 1 442 44 44 GLY H H 7.984 0.02 1 443 44 44 GLY HA2 H 3.979 0.02 2 444 44 44 GLY HA3 H 3.497 0.02 2 445 44 44 GLY C C 177.020 0.2 1 446 44 44 GLY CA C 46.890 0.2 1 447 44 44 GLY N N 108.270 0.2 1 448 45 45 ASP H H 9.073 0.02 1 449 45 45 ASP HA H 4.559 0.02 1 450 45 45 ASP HB2 H 2.688 0.02 2 451 45 45 ASP HB3 H 3.314 0.02 2 452 45 45 ASP C C 177.183 0.2 1 453 45 45 ASP CA C 55.450 0.2 1 454 45 45 ASP CB C 39.790 0.2 1 455 45 45 ASP N N 128.400 0.2 1 456 46 46 LYS H H 8.987 0.02 1 457 46 46 LYS HA H 4.945 0.02 1 458 46 46 LYS HB2 H 2.289 0.02 2 459 46 46 LYS HB3 H 1.547 0.02 2 460 46 46 LYS HG2 H 1.583 0.02 2 461 46 46 LYS HG3 H 1.686 0.02 2 462 46 46 LYS HD3 H 1.870 0.02 2 463 46 46 LYS HE2 H 3.110 0.02 2 464 46 46 LYS C C 176.544 0.2 1 465 46 46 LYS CA C 55.610 0.2 1 466 46 46 LYS CB C 33.960 0.2 1 467 46 46 LYS CG C 25.667 0.2 1 468 46 46 LYS CD C 29.219 0.2 1 469 46 46 LYS CE C 42.453 0.2 1 470 46 46 LYS N N 117.230 0.2 1 471 47 47 ILE H H 6.840 0.02 1 472 47 47 ILE HA H 4.097 0.02 1 473 47 47 ILE HB H 1.844 0.02 1 474 47 47 ILE HG12 H 1.085 0.02 2 475 47 47 ILE HG13 H 0.906 0.02 2 476 47 47 ILE HG2 H 0.311 0.02 1 477 47 47 ILE HD1 H 0.386 0.02 1 478 47 47 ILE C C 174.082 0.2 1 479 47 47 ILE CA C 61.080 0.2 1 480 47 47 ILE CB C 37.008 0.2 1 481 47 47 ILE CG1 C 26.528 0.2 1 482 47 47 ILE CG2 C 17.832 0.2 1 483 47 47 ILE CD1 C 13.579 0.2 1 484 47 47 ILE N N 121.540 0.2 1 485 48 48 TYR H H 8.511 0.02 1 486 48 48 TYR HA H 4.309 0.02 1 487 48 48 TYR HB2 H 2.399 0.02 2 488 48 48 TYR HB3 H 3.249 0.02 2 489 48 48 TYR HD1 H 6.852 0.02 3 490 48 48 TYR HE1 H 6.734 0.02 3 491 48 48 TYR C C 173.249 0.2 1 492 48 48 TYR CA C 57.350 0.2 1 493 48 48 TYR CB C 39.230 0.2 1 494 48 48 TYR CD2 C 132.690 0.2 3 495 48 48 TYR CE2 C 118.300 0.2 3 496 48 48 TYR N N 123.820 0.2 1 497 49 49 ASN H H 6.906 0.02 1 498 49 49 ASN HA H 4.451 0.02 1 499 49 49 ASN HB2 H 2.830 0.02 2 500 49 49 ASN HB3 H 2.712 0.02 2 501 49 49 ASN HD21 H 7.128 0.02 2 502 49 49 ASN HD22 H 7.869 0.02 2 503 49 49 ASN C C 175.429 0.2 1 504 49 49 ASN CA C 53.077 0.2 1 505 49 49 ASN CB C 39.916 0.2 1 506 49 49 ASN N N 116.100 0.2 1 507 49 49 ASN ND2 N 113.516 0.2 1 508 50 50 PHE H H 8.980 0.02 1 509 50 50 PHE HA H 5.011 0.02 1 510 50 50 PHE HB2 H 2.750 0.02 2 511 50 50 PHE HB3 H 3.345 0.02 2 512 50 50 PHE HD1 H 6.901 0.02 3 513 50 50 PHE C C 176.190 0.2 1 514 50 50 PHE CA C 55.863 0.2 1 515 50 50 PHE CB C 38.482 0.2 1 516 50 50 PHE CD2 C 130.644 0.2 3 517 50 50 PHE N N 124.360 0.2 1 518 51 51 GLY H H 8.658 0.02 1 519 51 51 GLY HA2 H 4.037 0.02 2 520 51 51 GLY HA3 H 3.747 0.02 2 521 51 51 GLY C C 175.758 0.2 1 522 51 51 GLY CA C 48.300 0.2 1 523 51 51 GLY N N 109.740 0.2 1 524 52 52 GLU H H 8.321 0.02 1 525 52 52 GLU HA H 4.082 0.02 1 526 52 52 GLU HB2 H 2.218 0.02 2 527 52 52 GLU HB3 H 2.054 0.02 2 528 52 52 GLU HG2 H 2.321 0.02 2 529 52 52 GLU HG3 H 2.238 0.02 2 530 52 52 GLU C C 178.240 0.2 1 531 52 52 GLU CA C 59.210 0.2 1 532 52 52 GLU CB C 29.739 0.2 1 533 52 52 GLU CG C 36.780 0.2 1 534 52 52 GLU N N 120.700 0.2 1 535 53 53 LEU H H 7.694 0.02 1 536 53 53 LEU HA H 4.158 0.02 1 537 53 53 LEU HB2 H 1.991 0.02 2 538 53 53 LEU HB3 H 1.781 0.02 2 539 53 53 LEU HG H 1.506 0.02 1 540 53 53 LEU HD1 H 0.897 0.02 2 541 53 53 LEU HD2 H 0.850 0.02 2 542 53 53 LEU C C 178.344 0.2 1 543 53 53 LEU CA C 57.790 0.2 1 544 53 53 LEU CB C 42.840 0.2 1 545 53 53 LEU CG C 27.380 0.2 1 546 53 53 LEU CD1 C 23.966 0.2 2 547 53 53 LEU CD2 C 26.800 0.2 2 548 53 53 LEU N N 119.400 0.2 1 549 54 54 LEU H H 8.369 0.02 1 550 54 54 LEU HA H 3.923 0.02 1 551 54 54 LEU HB2 H 1.692 0.02 2 552 54 54 LEU HB3 H 1.342 0.02 2 553 54 54 LEU HG H 1.689 0.02 1 554 54 54 LEU HD1 H 0.878 0.02 2 555 54 54 LEU HD2 H 0.857 0.02 2 556 54 54 LEU C C 178.643 0.2 1 557 54 54 LEU CA C 57.730 0.2 1 558 54 54 LEU CB C 41.850 0.2 1 559 54 54 LEU CG C 27.500 0.2 1 560 54 54 LEU CD1 C 23.375 0.2 2 561 54 54 LEU CD2 C 25.450 0.2 2 562 54 54 LEU N N 114.230 0.2 1 563 55 55 HIS H H 7.569 0.02 1 564 55 55 HIS HA H 4.707 0.02 1 565 55 55 HIS HB2 H 3.466 0.02 2 566 55 55 HIS HB3 H 3.030 0.02 2 567 55 55 HIS HD2 H 7.225 0.02 1 568 55 55 HIS HE1 H 7.672 0.02 1 569 55 55 HIS C C 173.981 0.2 1 570 55 55 HIS CA C 55.520 0.2 1 571 55 55 HIS CB C 29.280 0.2 1 572 55 55 HIS CD2 C 120.770 0.2 1 573 55 55 HIS CE1 C 137.483 0.2 1 574 55 55 HIS N N 113.420 0.2 1 575 56 56 HIS H H 8.068 0.02 1 576 56 56 HIS HA H 4.481 0.02 1 577 56 56 HIS HB2 H 3.526 0.02 2 578 56 56 HIS HB3 H 3.135 0.02 2 579 56 56 HIS HD2 H 6.986 0.02 1 580 56 56 HIS HE1 H 7.640 0.02 1 581 56 56 HIS C C 176.705 0.2 1 582 56 56 HIS CA C 57.350 0.2 1 583 56 56 HIS CB C 31.720 0.2 1 584 56 56 HIS CD2 C 117.900 0.2 1 585 56 56 HIS CE1 C 137.430 0.2 1 586 56 56 HIS N N 126.050 0.2 1 587 57 57 PRO HA H 4.377 0.02 1 588 57 57 PRO HB2 H 2.360 0.02 2 589 57 57 PRO HB3 H 1.861 0.02 2 590 57 57 PRO HG2 H 1.886 0.02 2 591 57 57 PRO HD2 H 2.280 0.02 2 592 57 57 PRO HD3 H 3.612 0.02 2 593 57 57 PRO C C 179.790 0.2 1 594 57 57 PRO CA C 65.440 0.2 1 595 57 57 PRO CB C 32.430 0.2 1 596 57 57 PRO CG C 27.335 0.2 1 597 57 57 PRO CD C 50.980 0.2 1 598 58 58 ILE H H 11.871 0.02 1 599 58 58 ILE HA H 4.270 0.02 1 600 58 58 ILE HB H 2.004 0.02 1 601 58 58 ILE HG12 H 1.570 0.02 2 602 58 58 ILE HG13 H 1.296 0.02 2 603 58 58 ILE HG2 H 0.660 0.02 1 604 58 58 ILE HD1 H 0.981 0.02 1 605 58 58 ILE C C 177.782 0.2 1 606 58 58 ILE CA C 62.530 0.2 1 607 58 58 ILE CB C 38.270 0.2 1 608 58 58 ILE CG1 C 29.660 0.2 1 609 58 58 ILE CG2 C 18.730 0.2 1 610 58 58 ILE CD1 C 14.748 0.2 1 611 58 58 ILE N N 124.900 0.2 1 612 59 59 MET H H 8.152 0.02 1 613 59 59 MET HA H 4.431 0.02 1 614 59 59 MET HB2 H 2.118 0.02 2 615 59 59 MET HB3 H 2.335 0.02 2 616 59 59 MET HG2 H 2.995 0.02 2 617 59 59 MET HG3 H 2.608 0.02 2 618 59 59 MET HE H 1.712 0.02 1 619 59 59 MET C C 178.757 0.2 1 620 59 59 MET CA C 55.720 0.2 1 621 59 59 MET CB C 30.980 0.2 1 622 59 59 MET CG C 34.220 0.2 1 623 59 59 MET CE C 17.710 0.2 1 624 59 59 MET N N 120.230 0.2 1 625 60 60 GLU H H 7.889 0.02 1 626 60 60 GLU HA H 4.008 0.02 1 627 60 60 GLU HB3 H 2.111 0.02 2 628 60 60 GLU HG2 H 2.310 0.02 2 629 60 60 GLU HG3 H 2.398 0.02 2 630 60 60 GLU C C 178.242 0.2 1 631 60 60 GLU CA C 58.520 0.2 1 632 60 60 GLU CB C 29.547 0.2 1 633 60 60 GLU CG C 36.547 0.2 1 634 60 60 GLU N N 119.080 0.2 1 635 61 61 THR H H 7.558 0.02 1 636 61 61 THR HA H 4.120 0.02 1 637 61 61 THR HB H 4.161 0.02 1 638 61 61 THR HG1 H 4.368 0.02 1 639 61 61 THR HG2 H 1.320 0.02 1 640 61 61 THR C C 176.056 0.2 1 641 61 61 THR CA C 64.520 0.2 1 642 61 61 THR CB C 69.420 0.2 1 643 61 61 THR CG2 C 22.246 0.2 1 644 61 61 THR N N 106.740 0.2 1 645 62 62 ILE H H 7.235 0.02 1 646 62 62 ILE HA H 4.587 0.02 1 647 62 62 ILE HB H 1.867 0.02 1 648 62 62 ILE HG12 H 1.551 0.02 2 649 62 62 ILE HG13 H 0.985 0.02 2 650 62 62 ILE HG2 H 0.519 0.02 1 651 62 62 ILE HD1 H 0.502 0.02 1 652 62 62 ILE C C 176.843 0.2 1 653 62 62 ILE CA C 61.790 0.2 1 654 62 62 ILE CB C 40.370 0.2 1 655 62 62 ILE CG1 C 26.210 0.2 1 656 62 62 ILE CG2 C 18.606 0.2 1 657 62 62 ILE CD1 C 12.972 0.2 1 658 62 62 ILE N N 113.140 0.2 1 659 63 63 VAL H H 7.436 0.02 1 660 63 63 VAL HA H 3.346 0.02 1 661 63 63 VAL HB H 1.739 0.02 1 662 63 63 VAL HG1 H 0.316 0.02 2 663 63 63 VAL HG2 H 0.703 0.02 2 664 63 63 VAL C C 175.165 0.2 1 665 63 63 VAL CA C 64.440 0.2 1 666 63 63 VAL CB C 31.199 0.2 1 667 63 63 VAL CG1 C 21.208 0.2 2 668 63 63 VAL CG2 C 19.660 0.2 2 669 63 63 VAL N N 122.110 0.2 1 670 64 64 ASN H H 8.352 0.02 1 671 64 64 ASN HA H 4.781 0.02 1 672 64 64 ASN HB2 H 2.693 0.02 2 673 64 64 ASN HB3 H 2.950 0.02 2 674 64 64 ASN HD21 H 7.569 0.02 2 675 64 64 ASN HD22 H 6.922 0.02 2 676 64 64 ASN C C 174.101 0.2 1 677 64 64 ASN CA C 52.900 0.2 1 678 64 64 ASN CB C 38.779 0.2 1 679 64 64 ASN N N 116.810 0.2 1 680 64 64 ASN ND2 N 114.200 0.2 1 681 65 65 ASP H H 7.453 0.02 1 682 65 65 ASP HA H 4.880 0.02 1 683 65 65 ASP HB2 H 3.279 0.02 2 684 65 65 ASP HB3 H 2.513 0.02 2 685 65 65 ASP C C 177.534 0.2 1 686 65 65 ASP CA C 53.170 0.2 1 687 65 65 ASP CB C 43.100 0.2 1 688 65 65 ASP N N 120.930 0.2 1 689 66 66 SER H H 7.010 0.02 1 690 66 66 SER HA H 4.356 0.02 1 691 66 66 SER HB2 H 4.009 0.02 2 692 66 66 SER C C 176.310 0.2 1 693 66 66 SER CA C 61.350 0.2 1 694 66 66 SER CB C 63.120 0.2 1 695 67 67 ASN H H 9.014 0.02 1 696 67 67 ASN HA H 4.605 0.02 1 697 67 67 ASN HB2 H 2.557 0.02 2 698 67 67 ASN HB3 H 2.269 0.02 2 699 67 67 ASN HD21 H 6.958 0.02 2 700 67 67 ASN HD22 H 7.989 0.02 2 701 67 67 ASN C C 176.107 0.2 1 702 67 67 ASN CA C 55.570 0.2 1 703 67 67 ASN CB C 38.600 0.2 1 704 67 67 ASN N N 120.050 0.2 1 705 67 67 ASN ND2 N 116.188 0.2 1 706 68 68 TYR H H 8.276 0.02 1 707 68 68 TYR HA H 4.519 0.02 1 708 68 68 TYR HB2 H 3.324 0.02 2 709 68 68 TYR HB3 H 2.984 0.02 2 710 68 68 TYR HD1 H 7.017 0.02 3 711 68 68 TYR HE1 H 6.695 0.02 3 712 68 68 TYR C C 175.709 0.2 1 713 68 68 TYR CA C 57.610 0.2 1 714 68 68 TYR CB C 39.750 0.2 1 715 68 68 TYR CD2 C 132.880 0.2 3 716 68 68 TYR CE2 C 118.250 0.2 3 717 68 68 TYR N N 114.840 0.2 1 718 69 69 ASP H H 7.806 0.02 1 719 69 69 ASP HA H 4.452 0.02 1 720 69 69 ASP HB2 H 2.794 0.02 2 721 69 69 ASP HB3 H 2.904 0.02 2 722 69 69 ASP C C 178.371 0.2 1 723 69 69 ASP CA C 58.630 0.2 1 724 69 69 ASP CB C 40.630 0.2 1 725 69 69 ASP N N 122.810 0.2 1 726 70 70 TRP H H 8.172 0.02 1 727 70 70 TRP HA H 4.164 0.02 1 728 70 70 TRP HB2 H 3.181 0.02 1 729 70 70 TRP HB3 H 3.181 0.02 1 730 70 70 TRP HD1 H 7.570 0.02 1 731 70 70 TRP HE1 H 10.208 0.02 1 732 70 70 TRP HE3 H 7.082 0.02 1 733 70 70 TRP HZ2 H 7.706 0.02 1 734 70 70 TRP HZ3 H 6.635 0.02 1 735 70 70 TRP HH2 H 7.042 0.02 1 736 70 70 TRP C C 176.090 0.2 1 737 70 70 TRP CA C 58.530 0.2 1 738 70 70 TRP CB C 27.550 0.2 1 739 70 70 TRP CD1 C 128.208 0.2 1 740 70 70 TRP CE3 C 119.422 0.2 1 741 70 70 TRP CZ2 C 114.970 0.2 1 742 70 70 TRP CZ3 C 121.005 0.2 1 743 70 70 TRP CH2 C 124.390 0.2 1 744 70 70 TRP N N 117.270 0.2 1 745 70 70 TRP NE1 N 130.045 0.2 1 746 71 71 LEU H H 6.251 0.02 1 747 71 71 LEU HA H 3.240 0.02 1 748 71 71 LEU HB2 H -0.138 0.02 2 749 71 71 LEU HB3 H 1.197 0.02 2 750 71 71 LEU HG H 0.489 0.02 1 751 71 71 LEU HD1 H 0.334 0.02 2 752 71 71 LEU HD2 H 0.393 0.02 2 753 71 71 LEU C C 178.306 0.2 1 754 71 71 LEU CA C 57.610 0.2 1 755 71 71 LEU CB C 41.190 0.2 1 756 71 71 LEU CG C 26.156 0.2 1 757 71 71 LEU CD1 C 25.180 0.2 2 758 71 71 LEU CD2 C 23.055 0.2 2 759 71 71 LEU N N 125.263 0.2 1 760 72 72 PHE H H 6.996 0.02 1 761 72 72 PHE HA H 3.813 0.02 1 762 72 72 PHE HB2 H 2.956 0.02 2 763 72 72 PHE HB3 H 3.111 0.02 2 764 72 72 PHE HD1 H 7.240 0.02 3 765 72 72 PHE C C 178.797 0.2 1 766 72 72 PHE CA C 62.571 0.2 1 767 72 72 PHE CB C 38.810 0.2 1 768 72 72 PHE CD1 C 131.644 0.2 3 769 72 72 PHE N N 117.630 0.2 1 770 73 73 GLN H H 8.415 0.02 1 771 73 73 GLN HA H 4.066 0.02 1 772 73 73 GLN HB2 H 2.222 0.02 2 773 73 73 GLN HB3 H 2.077 0.02 2 774 73 73 GLN HG2 H 2.653 0.02 2 775 73 73 GLN HG3 H 2.502 0.02 2 776 73 73 GLN HE21 H 6.810 0.02 2 777 73 73 GLN HE22 H 7.787 0.02 2 778 73 73 GLN C C 179.341 0.2 1 779 73 73 GLN CA C 59.090 0.2 1 780 73 73 GLN CB C 28.250 0.2 1 781 73 73 GLN CG C 33.530 0.2 1 782 73 73 GLN N N 117.950 0.2 1 783 73 73 GLN NE2 N 112.225 0.2 1 784 74 74 LEU H H 8.365 0.02 1 785 74 74 LEU HA H 4.070 0.02 1 786 74 74 LEU HB2 H 1.928 0.02 2 787 74 74 LEU HB3 H 1.873 0.02 2 788 74 74 LEU HD1 H 0.994 0.02 2 789 74 74 LEU HD2 H 0.914 0.02 2 790 74 74 LEU C C 177.889 0.2 1 791 74 74 LEU CA C 58.570 0.2 1 792 74 74 LEU CB C 42.180 0.2 1 793 74 74 LEU CD1 C 24.930 0.2 2 794 74 74 LEU CD2 C 26.980 0.2 2 795 74 74 LEU N N 122.275 0.2 1 796 75 75 LEU H H 8.210 0.02 1 797 75 75 LEU HA H 3.727 0.02 1 798 75 75 LEU HB2 H 1.759 0.02 2 799 75 75 LEU HB3 H 1.080 0.02 2 800 75 75 LEU HG H 1.490 0.02 1 801 75 75 LEU HD1 H 0.376 0.02 2 802 75 75 LEU HD2 H 0.054 0.02 2 803 75 75 LEU C C 180.172 0.2 1 804 75 75 LEU CA C 58.453 0.2 1 805 75 75 LEU CB C 42.340 0.2 1 806 75 75 LEU CG C 26.886 0.2 1 807 75 75 LEU CD1 C 25.834 0.2 2 808 75 75 LEU CD2 C 22.497 0.2 2 809 75 75 LEU N N 118.123 0.2 1 810 76 76 ASN H H 8.363 0.02 1 811 76 76 ASN HA H 4.375 0.02 1 812 76 76 ASN HB2 H 2.730 0.02 2 813 76 76 ASN HB3 H 2.698 0.02 2 814 76 76 ASN HD21 H 6.703 0.02 2 815 76 76 ASN HD22 H 7.440 0.02 2 816 76 76 ASN C C 176.582 0.2 1 817 76 76 ASN CA C 56.960 0.2 1 818 76 76 ASN CB C 38.950 0.2 1 819 76 76 ASN N N 117.960 0.2 1 820 76 76 ASN ND2 N 112.225 0.2 1 821 77 77 ALA H H 8.385 0.02 1 822 77 77 ALA HA H 4.167 0.02 1 823 77 77 ALA HB H 1.621 0.02 1 824 77 77 ALA C C 179.988 0.2 1 825 77 77 ALA CA C 55.560 0.2 1 826 77 77 ALA CB C 17.330 0.2 1 827 77 77 ALA N N 121.740 0.2 1 828 78 78 LEU H H 7.965 0.02 1 829 78 78 LEU HA H 3.653 0.02 1 830 78 78 LEU HB2 H 1.796 0.02 2 831 78 78 LEU HB3 H 1.743 0.02 2 832 78 78 LEU HG H 1.518 0.02 1 833 78 78 LEU HD1 H 0.746 0.02 2 834 78 78 LEU HD2 H 0.685 0.02 2 835 78 78 LEU C C 177.576 0.2 1 836 78 78 LEU CA C 58.984 0.2 1 837 78 78 LEU CB C 42.010 0.2 1 838 78 78 LEU CG C 29.428 0.2 1 839 78 78 LEU CD1 C 25.683 0.2 2 840 78 78 LEU CD2 C 25.424 0.2 2 841 78 78 LEU N N 116.550 0.2 1 842 79 79 THR H H 7.565 0.02 1 843 79 79 THR HA H 3.807 0.02 1 844 79 79 THR HB H 4.416 0.02 1 845 79 79 THR HG1 H 5.077 0.02 1 846 79 79 THR HG2 H 1.236 0.02 1 847 79 79 THR C C 176.163 0.2 1 848 79 79 THR CA C 66.980 0.2 1 849 79 79 THR CB C 69.240 0.2 1 850 79 79 THR CG2 C 21.170 0.2 1 851 79 79 THR N N 113.220 0.2 1 852 80 80 VAL H H 7.792 0.02 1 853 80 80 VAL HA H 4.509 0.02 1 854 80 80 VAL HB H 2.468 0.02 1 855 80 80 VAL HG1 H 0.946 0.02 2 856 80 80 VAL HG2 H 0.986 0.02 2 857 80 80 VAL C C 176.751 0.2 1 858 80 80 VAL CA C 60.890 0.2 1 859 80 80 VAL CB C 32.005 0.2 1 860 80 80 VAL CG1 C 20.941 0.2 2 861 80 80 VAL CG2 C 19.228 0.2 2 862 80 80 VAL N N 110.800 0.2 1 863 81 81 GLY H H 7.506 0.02 1 864 81 81 GLY HA2 H 3.149 0.02 2 865 81 81 GLY HA3 H 3.853 0.02 2 866 81 81 GLY C C 173.874 0.2 1 867 81 81 GLY CA C 47.280 0.2 1 868 81 81 GLY N N 112.910 0.2 1 869 82 82 ASP H H 8.254 0.02 1 870 82 82 ASP HA H 4.840 0.02 1 871 82 82 ASP HB2 H 2.886 0.02 2 872 82 82 ASP HB3 H 2.401 0.02 2 873 82 82 ASP C C 175.706 0.2 1 874 82 82 ASP CA C 51.920 0.2 1 875 82 82 ASP CB C 39.950 0.2 1 876 82 82 ASP N N 119.112 0.2 1 877 83 83 PHE H H 8.025 0.02 1 878 83 83 PHE HA H 3.828 0.02 1 879 83 83 PHE HB2 H 2.803 0.02 2 880 83 83 PHE HB3 H 3.088 0.02 2 881 83 83 PHE HD1 H 7.156 0.02 3 882 83 83 PHE C C 177.950 0.2 1 883 83 83 PHE CA C 62.570 0.2 1 884 83 83 PHE CB C 39.120 0.2 1 885 83 83 PHE CD1 C 131.258 0.2 3 886 83 83 PHE N N 123.870 0.2 1 887 84 84 ASP H H 8.464 0.02 1 888 84 84 ASP HA H 4.522 0.02 1 889 84 84 ASP HB2 H 2.764 0.02 2 890 84 84 ASP HB3 H 2.809 0.02 2 891 84 84 ASP C C 179.005 0.2 1 892 84 84 ASP CA C 57.660 0.2 1 893 84 84 ASP CB C 40.560 0.2 1 894 84 84 ASP N N 119.583 0.2 1 895 85 85 LYS H H 8.009 0.02 1 896 85 85 LYS HA H 4.092 0.02 1 897 85 85 LYS HB2 H 1.569 0.02 2 898 85 85 LYS HB3 H 1.819 0.02 2 899 85 85 LYS HG2 H 1.482 0.02 2 900 85 85 LYS HG3 H 1.445 0.02 2 901 85 85 LYS HD2 H 1.733 0.02 2 902 85 85 LYS HE3 H 3.012 0.02 2 903 85 85 LYS C C 178.580 0.2 1 904 85 85 LYS CA C 58.250 0.2 1 905 85 85 LYS CB C 32.310 0.2 1 906 85 85 LYS CG C 24.780 0.2 1 907 85 85 LYS CD C 28.541 0.2 1 908 85 85 LYS CE C 42.127 0.2 1 909 85 85 LYS N N 122.200 0.2 1 910 86 86 PHE H H 8.331 0.02 1 911 86 86 PHE HA H 3.836 0.02 1 912 86 86 PHE HB2 H 2.813 0.02 2 913 86 86 PHE HB3 H 3.121 0.02 2 914 86 86 PHE HD1 H 7.131 0.02 3 915 86 86 PHE C C 175.649 0.2 1 916 86 86 PHE CA C 62.410 0.2 1 917 86 86 PHE CB C 40.080 0.2 1 918 86 86 PHE CD2 C 131.820 0.2 3 919 86 86 PHE N N 118.590 0.2 1 920 87 87 ASP H H 8.560 0.02 1 921 87 87 ASP HA H 4.198 0.02 1 922 87 87 ASP HB2 H 2.954 0.02 2 923 87 87 ASP HB3 H 2.689 0.02 2 924 87 87 ASP C C 178.542 0.2 1 925 87 87 ASP CA C 57.840 0.2 1 926 87 87 ASP CB C 41.890 0.2 1 927 87 87 ASP N N 117.790 0.2 1 928 88 88 SER H H 7.757 0.02 1 929 88 88 SER HA H 4.153 0.02 1 930 88 88 SER HB2 H 4.001 0.02 2 931 88 88 SER C C 176.823 0.2 1 932 88 88 SER CA C 61.590 0.2 1 933 88 88 SER CB C 63.085 0.2 1 934 88 88 SER N N 112.940 0.2 1 935 89 89 LEU H H 8.173 0.02 1 936 89 89 LEU HA H 4.168 0.02 1 937 89 89 LEU HB2 H 1.964 0.02 2 938 89 89 LEU HB3 H 1.252 0.02 2 939 89 89 LEU HG H 1.845 0.02 1 940 89 89 LEU HD1 H 1.014 0.02 2 941 89 89 LEU HD2 H 0.849 0.02 2 942 89 89 LEU C C 180.006 0.2 1 943 89 89 LEU CA C 57.830 0.2 1 944 89 89 LEU CB C 43.380 0.2 1 945 89 89 LEU CG C 27.130 0.2 1 946 89 89 LEU CD1 C 23.635 0.2 2 947 89 89 LEU CD2 C 26.800 0.2 2 948 89 89 LEU N N 121.710 0.2 1 949 90 90 ILE H H 8.424 0.02 1 950 90 90 ILE HA H 3.545 0.02 1 951 90 90 ILE HB H 1.660 0.02 1 952 90 90 ILE HG12 H 0.915 0.02 1 953 90 90 ILE HG13 H 0.915 0.02 1 954 90 90 ILE HG2 H 0.705 0.02 1 955 90 90 ILE HD1 H 0.449 0.02 1 956 90 90 ILE C C 177.083 0.2 1 957 90 90 ILE CA C 62.910 0.2 1 958 90 90 ILE CB C 36.080 0.2 1 959 90 90 ILE CG1 C 27.842 0.2 1 960 90 90 ILE CG2 C 18.285 0.2 1 961 90 90 ILE CD1 C 11.847 0.2 1 962 90 90 ILE N N 119.830 0.2 1 963 91 91 LYS H H 7.569 0.02 1 964 91 91 LYS HA H 3.901 0.02 1 965 91 91 LYS HB2 H 1.881 0.02 2 966 91 91 LYS HB3 H 1.829 0.02 2 967 91 91 LYS HG2 H 1.521 0.02 2 968 91 91 LYS HG3 H 1.403 0.02 2 969 91 91 LYS HD2 H 1.638 0.02 1 970 91 91 LYS HD3 H 1.638 0.02 1 971 91 91 LYS HE2 H 2.946 0.02 1 972 91 91 LYS HE3 H 2.946 0.02 1 973 91 91 LYS C C 178.803 0.2 1 974 91 91 LYS CA C 59.510 0.2 1 975 91 91 LYS CB C 32.760 0.2 1 976 91 91 LYS CG C 25.801 0.2 1 977 91 91 LYS CD C 29.373 0.2 1 978 91 91 LYS CE C 42.131 0.2 1 979 91 91 LYS N N 117.980 0.2 1 980 92 92 VAL H H 7.432 0.02 1 981 92 92 VAL HA H 3.928 0.02 1 982 92 92 VAL HB H 2.068 0.02 1 983 92 92 VAL HG1 H 0.854 0.02 2 984 92 92 VAL HG2 H 1.016 0.02 2 985 92 92 VAL C C 177.767 0.2 1 986 92 92 VAL CA C 64.550 0.2 1 987 92 92 VAL CB C 32.790 0.2 1 988 92 92 VAL CG1 C 21.180 0.2 2 989 92 92 VAL CG2 C 21.701 0.2 2 990 92 92 VAL N N 115.450 0.2 1 991 93 93 GLN H H 8.127 0.02 1 992 93 93 GLN HA H 3.997 0.02 1 993 93 93 GLN HB2 H 1.589 0.02 2 994 93 93 GLN HB3 H 1.439 0.02 2 995 93 93 GLN HG2 H 2.167 0.02 2 996 93 93 GLN HG3 H 1.835 0.02 2 997 93 93 GLN HE21 H 5.945 0.02 2 998 93 93 GLN HE22 H 6.496 0.02 2 999 93 93 GLN C C 178.756 0.2 1 1000 93 93 GLN CA C 57.560 0.2 1 1001 93 93 GLN CB C 28.670 0.2 1 1002 93 93 GLN CG C 33.101 0.2 1 1003 93 93 GLN N N 117.250 0.2 1 1004 93 93 GLN NE2 N 108.050 0.2 1 1005 94 94 ILE H H 8.390 0.02 1 1006 94 94 ILE HA H 3.640 0.02 1 1007 94 94 ILE HB H 1.971 0.02 1 1008 94 94 ILE HG12 H 1.267 0.02 2 1009 94 94 ILE HG13 H 1.304 0.02 2 1010 94 94 ILE HG2 H 0.829 0.02 1 1011 94 94 ILE HD1 H 0.769 0.02 1 1012 94 94 ILE C C 176.252 0.2 1 1013 94 94 ILE CA C 64.980 0.2 1 1014 94 94 ILE CB C 37.130 0.2 1 1015 94 94 ILE CG1 C 28.550 0.2 1 1016 94 94 ILE CG2 C 17.739 0.2 1 1017 94 94 ILE CD1 C 14.024 0.2 1 1018 94 94 ILE N N 118.013 0.2 1 1019 95 95 SER H H 7.227 0.02 1 1020 95 95 SER HA H 4.158 0.02 1 1021 95 95 SER HB2 H 3.883 0.02 1 1022 95 95 SER HB3 H 3.883 0.02 1 1023 95 95 SER C C 174.893 0.2 1 1024 95 95 SER CA C 59.890 0.2 1 1025 95 95 SER CB C 63.170 0.2 1 1026 95 95 SER N N 112.220 0.2 1 1027 96 96 LYS H H 7.250 0.02 1 1028 96 96 LYS HA H 4.325 0.02 1 1029 96 96 LYS HB2 H 1.874 0.02 2 1030 96 96 LYS HB3 H 1.653 0.02 2 1031 96 96 LYS HG2 H 1.286 0.02 2 1032 96 96 LYS HG3 H 1.340 0.02 2 1033 96 96 LYS HD3 H 1.517 0.02 2 1034 96 96 LYS HE2 H 2.859 0.02 2 1035 96 96 LYS C C 175.903 0.2 1 1036 96 96 LYS CA C 56.600 0.2 1 1037 96 96 LYS CB C 33.940 0.2 1 1038 96 96 LYS CG C 24.663 0.2 1 1039 96 96 LYS CD C 28.965 0.2 1 1040 96 96 LYS CE C 42.094 0.2 1 1041 96 96 LYS N N 119.000 0.2 1 1042 97 97 ILE H H 7.713 0.02 1 1043 97 97 ILE HA H 4.599 0.02 1 1044 97 97 ILE HB H 1.975 0.02 1 1045 97 97 ILE HG12 H 1.074 0.02 1 1046 97 97 ILE HG13 H 1.074 0.02 1 1047 97 97 ILE HG2 H 0.973 0.02 1 1048 97 97 ILE HD1 H 0.451 0.02 1 1049 97 97 ILE C C 173.784 0.2 1 1050 97 97 ILE CA C 57.412 0.2 1 1051 97 97 ILE CB C 37.560 0.2 1 1052 97 97 ILE CG1 C 25.701 0.2 1 1053 97 97 ILE CG2 C 18.470 0.2 1 1054 97 97 ILE CD1 C 11.891 0.2 1 1055 97 97 ILE N N 120.530 0.2 1 1056 98 98 PRO HA H 4.293 0.02 1 1057 98 98 PRO HB2 H 2.381 0.02 2 1058 98 98 PRO HB3 H 1.975 0.02 2 1059 98 98 PRO HG2 H 2.158 0.02 2 1060 98 98 PRO HG3 H 1.983 0.02 2 1061 98 98 PRO HD3 H 3.895 0.02 2 1062 98 98 PRO C C 178.885 0.2 1 1063 98 98 PRO CA C 66.320 0.2 1 1064 98 98 PRO CB C 32.270 0.2 1 1065 98 98 PRO CG C 27.178 0.2 1 1066 98 98 PRO CD C 50.840 0.2 1 1067 99 99 ILE H H 8.552 0.02 1 1068 99 99 ILE HA H 4.292 0.02 1 1069 99 99 ILE HB H 1.984 0.02 1 1070 99 99 ILE HG12 H 1.321 0.02 2 1071 99 99 ILE HG13 H 1.613 0.02 2 1072 99 99 ILE HG2 H 0.907 0.02 1 1073 99 99 ILE HD1 H 1.045 0.02 1 1074 99 99 ILE C C 177.025 0.2 1 1075 99 99 ILE CA C 63.780 0.2 1 1076 99 99 ILE CB C 38.080 0.2 1 1077 99 99 ILE CG1 C 29.820 0.2 1 1078 99 99 ILE CG2 C 17.882 0.2 1 1079 99 99 ILE CD1 C 14.466 0.2 1 1080 99 99 ILE N N 115.600 0.2 1 1081 100 100 LEU H H 7.404 0.02 1 1082 100 100 LEU HA H 4.223 0.02 1 1083 100 100 LEU HB2 H 1.918 0.02 2 1084 100 100 LEU HB3 H 1.287 0.02 2 1085 100 100 LEU HG H 0.962 0.02 1 1086 100 100 LEU HD1 H 0.757 0.02 2 1087 100 100 LEU HD2 H 0.449 0.02 2 1088 100 100 LEU C C 178.223 0.2 1 1089 100 100 LEU CA C 57.110 0.2 1 1090 100 100 LEU CB C 42.220 0.2 1 1091 100 100 LEU CG C 25.953 0.2 1 1092 100 100 LEU CD1 C 22.730 0.2 2 1093 100 100 LEU CD2 C 22.596 0.2 2 1094 100 100 LEU N N 119.430 0.2 1 1095 101 101 ALA H H 7.839 0.02 1 1096 101 101 ALA HA H 3.917 0.02 1 1097 101 101 ALA HB H 1.563 0.02 1 1098 101 101 ALA C C 181.827 0.2 1 1099 101 101 ALA CA C 55.410 0.2 1 1100 101 101 ALA CB C 17.950 0.2 1 1101 101 101 ALA N N 121.390 0.2 1 1102 102 102 GLN H H 8.276 0.02 1 1103 102 102 GLN HA H 4.077 0.02 1 1104 102 102 GLN HB2 H 2.061 0.02 2 1105 102 102 GLN HB3 H 1.922 0.02 2 1106 102 102 GLN HG2 H 2.272 0.02 2 1107 102 102 GLN HG3 H 2.140 0.02 2 1108 102 102 GLN HE21 H 6.758 0.02 2 1109 102 102 GLN HE22 H 7.331 0.02 2 1110 102 102 GLN C C 176.572 0.2 1 1111 102 102 GLN CA C 57.580 0.2 1 1112 102 102 GLN CB C 28.630 0.2 1 1113 102 102 GLN CG C 33.512 0.2 1 1114 102 102 GLN N N 115.470 0.2 1 1115 102 102 GLN NE2 N 110.610 0.2 1 1116 103 103 HIS H H 7.450 0.02 1 1117 103 103 HIS HA H 5.124 0.02 1 1118 103 103 HIS HB2 H 3.674 0.02 2 1119 103 103 HIS HB3 H 2.744 0.02 2 1120 103 103 HIS HD2 H 7.003 0.02 1 1121 103 103 HIS HE1 H 7.781 0.02 1 1122 103 103 HIS C C 175.326 0.2 1 1123 103 103 HIS CA C 56.350 0.2 1 1124 103 103 HIS CB C 30.990 0.2 1 1125 103 103 HIS CD2 C 119.570 0.2 1 1126 103 103 HIS CE1 C 138.140 0.2 1 1127 103 103 HIS N N 115.980 0.2 1 1128 104 104 GLU H H 7.332 0.02 1 1129 104 104 GLU HA H 3.813 0.02 1 1130 104 104 GLU HB2 H 2.262 0.02 2 1131 104 104 GLU HB3 H 2.055 0.02 2 1132 104 104 GLU HG3 H 2.238 0.02 2 1133 104 104 GLU C C 177.960 0.2 1 1134 104 104 GLU CA C 61.510 0.2 1 1135 104 104 GLU CB C 29.500 0.2 1 1136 104 104 GLU CG C 35.820 0.2 1 1137 104 104 GLU N N 122.920 0.2 1 1138 105 105 SER H H 8.931 0.02 1 1139 105 105 SER HA H 4.234 0.02 1 1140 105 105 SER HB3 H 3.993 0.02 2 1141 105 105 SER C C 177.512 0.2 1 1142 105 105 SER CA C 62.100 0.2 1 1143 105 105 SER CB C 62.100 0.2 1 1144 105 105 SER N N 113.180 0.2 1 1145 106 106 PHE H H 8.040 0.02 1 1146 106 106 PHE HA H 4.427 0.02 1 1147 106 106 PHE HB2 H 3.555 0.02 2 1148 106 106 PHE HB3 H 3.339 0.02 2 1149 106 106 PHE HD1 H 7.344 0.02 3 1150 106 106 PHE C C 178.007 0.2 1 1151 106 106 PHE CA C 61.390 0.2 1 1152 106 106 PHE CB C 39.130 0.2 1 1153 106 106 PHE CD2 C 131.610 0.2 3 1154 106 106 PHE N N 123.770 0.2 1 1155 107 107 LEU H H 8.481 0.02 1 1156 107 107 LEU HA H 4.006 0.02 1 1157 107 107 LEU HB2 H 2.213 0.02 2 1158 107 107 LEU HB3 H 1.667 0.02 2 1159 107 107 LEU HG H 1.961 0.02 1 1160 107 107 LEU HD1 H 0.949 0.02 2 1161 107 107 LEU HD2 H 0.960 0.02 2 1162 107 107 LEU C C 178.165 0.2 1 1163 107 107 LEU CA C 58.280 0.2 1 1164 107 107 LEU CB C 42.169 0.2 1 1165 107 107 LEU CG C 27.242 0.2 1 1166 107 107 LEU CD1 C 24.790 0.2 2 1167 107 107 LEU CD2 C 25.958 0.2 2 1168 107 107 LEU N N 121.397 0.2 1 1169 108 108 ARG H H 8.480 0.02 1 1170 108 108 ARG HA H 4.139 0.02 1 1171 108 108 ARG HB2 H 1.893 0.02 2 1172 108 108 ARG HB3 H 2.045 0.02 2 1173 108 108 ARG HG2 H 1.519 0.02 2 1174 108 108 ARG HG3 H 1.611 0.02 2 1175 108 108 ARG HD2 H 3.269 0.02 2 1176 108 108 ARG HD3 H 3.392 0.02 2 1177 108 108 ARG HE H 8.299 0.02 1 1178 108 108 ARG C C 178.343 0.2 1 1179 108 108 ARG CA C 59.580 0.2 1 1180 108 108 ARG CB C 29.170 0.2 1 1181 108 108 ARG CG C 26.480 0.2 1 1182 108 108 ARG CD C 42.960 0.2 1 1183 108 108 ARG N N 117.450 0.2 1 1184 108 108 ARG NE N 85.081 0.2 1 1185 109 109 GLN H H 7.886 0.02 1 1186 109 109 GLN HA H 4.075 0.02 1 1187 109 109 GLN HB2 H 2.197 0.02 2 1188 109 109 GLN HB3 H 2.039 0.02 2 1189 109 109 GLN HG2 H 2.401 0.02 2 1190 109 109 GLN HG3 H 2.232 0.02 2 1191 109 109 GLN HE21 H 7.118 0.02 2 1192 109 109 GLN HE22 H 7.829 0.02 2 1193 109 109 GLN CA C 59.295 0.2 1 1194 109 109 GLN CB C 29.508 0.2 1 1195 109 109 GLN CG C 34.980 0.2 1 1196 109 109 GLN N N 119.098 0.2 1 1197 109 109 GLN NE2 N 111.512 0.2 1 1198 110 110 LYS H H 8.356 0.02 1 1199 110 110 LYS HA H 3.988 0.02 1 1200 110 110 LYS HB2 H 1.884 0.02 2 1201 110 110 LYS HB3 H 1.523 0.02 2 1202 110 110 LYS HG2 H 1.427 0.02 2 1203 110 110 LYS HG3 H 1.572 0.02 2 1204 110 110 LYS HD2 H 1.690 0.02 2 1205 110 110 LYS HD3 H 1.831 0.02 2 1206 110 110 LYS HE2 H 2.301 0.02 2 1207 110 110 LYS HE3 H 2.781 0.02 2 1208 110 110 LYS C C 178.368 0.2 1 1209 110 110 LYS CA C 61.550 0.2 1 1210 110 110 LYS CB C 30.260 0.2 1 1211 110 110 LYS CG C 26.190 0.2 1 1212 110 110 LYS CD C 29.440 0.2 1 1213 110 110 LYS CE C 42.150 0.2 1 1214 110 110 LYS N N 121.110 0.2 1 1215 111 111 ILE H H 7.848 0.02 1 1216 111 111 ILE HA H 3.898 0.02 1 1217 111 111 ILE HB H 0.980 0.02 1 1218 111 111 ILE HG12 H 0.537 0.02 2 1219 111 111 ILE HG13 H 1.153 0.02 2 1220 111 111 ILE HG2 H 0.719 0.02 1 1221 111 111 ILE HD1 H -0.189 0.02 1 1222 111 111 ILE C C 178.036 0.2 1 1223 111 111 ILE CA C 65.101 0.2 1 1224 111 111 ILE CB C 36.915 0.2 1 1225 111 111 ILE CG1 C 29.169 0.2 1 1226 111 111 ILE CG2 C 16.036 0.2 1 1227 111 111 ILE CD1 C 13.151 0.2 1 1228 111 111 ILE N N 116.870 0.2 1 1229 112 112 CYS H H 7.473 0.02 1 1230 112 112 CYS HA H 4.081 0.02 1 1231 112 112 CYS HB2 H 2.857 0.02 2 1232 112 112 CYS HB3 H 3.185 0.02 2 1233 112 112 CYS HG H 4.320 0.02 1 1234 112 112 CYS C C 176.276 0.2 1 1235 112 112 CYS CA C 65.400 0.2 1 1236 112 112 CYS CB C 27.370 0.2 1 1237 112 112 CYS N N 123.990 0.2 1 1238 113 113 LEU H H 8.443 0.02 1 1239 113 113 LEU HA H 3.843 0.02 1 1240 113 113 LEU HB2 H 1.073 0.02 2 1241 113 113 LEU HB3 H 2.016 0.02 2 1242 113 113 LEU HG H 0.744 0.02 1 1243 113 113 LEU HD1 H 0.656 0.02 2 1244 113 113 LEU C C 178.584 0.2 1 1245 113 113 LEU CA C 58.520 0.2 1 1246 113 113 LEU CB C 42.550 0.2 1 1247 113 113 LEU CG C 26.715 0.2 1 1248 113 113 LEU CD1 C 24.280 0.2 2 1249 113 113 LEU N N 120.218 0.2 1 1250 114 114 MET H H 8.840 0.02 1 1251 114 114 MET HA H 3.952 0.02 1 1252 114 114 MET HB2 H 2.358 0.02 2 1253 114 114 MET HB3 H 1.940 0.02 2 1254 114 114 MET HG2 H 2.756 0.02 2 1255 114 114 MET HG3 H 2.846 0.02 2 1256 114 114 MET HE H 1.725 0.02 1 1257 114 114 MET C C 178.724 0.2 1 1258 114 114 MET CA C 60.070 0.2 1 1259 114 114 MET CB C 32.910 0.2 1 1260 114 114 MET CG C 33.680 0.2 1 1261 114 114 MET CE C 15.833 0.2 1 1262 114 114 MET N N 116.910 0.2 1 1263 115 115 THR H H 8.095 0.02 1 1264 115 115 THR HA H 4.083 0.02 1 1265 115 115 THR HB H 4.241 0.02 1 1266 115 115 THR HG2 H 1.348 0.02 1 1267 115 115 THR C C 177.434 0.2 1 1268 115 115 THR CA C 66.740 0.2 1 1269 115 115 THR CB C 68.630 0.2 1 1270 115 115 THR CG2 C 21.579 0.2 1 1271 115 115 THR N N 115.670 0.2 1 1272 116 116 LEU H H 8.164 0.02 1 1273 116 116 LEU HA H 3.855 0.02 1 1274 116 116 LEU HB2 H 1.393 0.02 2 1275 116 116 LEU HB3 H 2.188 0.02 2 1276 116 116 LEU HG H 0.754 0.02 1 1277 116 116 LEU HD1 H 0.742 0.02 2 1278 116 116 LEU HD2 H 0.689 0.02 2 1279 116 116 LEU C C 176.903 0.2 1 1280 116 116 LEU CA C 58.936 0.2 1 1281 116 116 LEU CB C 41.676 0.2 1 1282 116 116 LEU CG C 26.710 0.2 1 1283 116 116 LEU CD1 C 23.223 0.2 2 1284 116 116 LEU CD2 C 26.054 0.2 2 1285 116 116 LEU N N 125.420 0.2 1 1286 117 117 ILE H H 8.032 0.02 1 1287 117 117 ILE HA H 3.619 0.02 1 1288 117 117 ILE HB H 1.974 0.02 1 1289 117 117 ILE HG12 H 1.613 0.02 2 1290 117 117 ILE HG13 H 1.374 0.02 2 1291 117 117 ILE HG2 H 0.868 0.02 1 1292 117 117 ILE HD1 H 0.669 0.02 1 1293 117 117 ILE C C 177.806 0.2 1 1294 117 117 ILE CA C 64.590 0.2 1 1295 117 117 ILE CB C 36.360 0.2 1 1296 117 117 ILE CG1 C 27.050 0.2 1 1297 117 117 ILE CG2 C 18.191 0.2 1 1298 117 117 ILE CD1 C 12.542 0.2 1 1299 117 117 ILE N N 114.740 0.2 1 1300 118 118 GLU H H 8.176 0.02 1 1301 118 118 GLU HA H 4.200 0.02 1 1302 118 118 GLU HB2 H 2.119 0.02 2 1303 118 118 GLU HB3 H 2.268 0.02 2 1304 118 118 GLU HG2 H 2.507 0.02 2 1305 118 118 GLU HG3 H 2.317 0.02 2 1306 118 118 GLU C C 178.314 0.2 1 1307 118 118 GLU CA C 59.980 0.2 1 1308 118 118 GLU CB C 29.380 0.2 1 1309 118 118 GLU CG C 34.970 0.2 1 1310 118 118 GLU N N 121.200 0.2 1 1311 119 119 THR H H 8.008 0.02 1 1312 119 119 THR HA H 3.917 0.02 1 1313 119 119 THR HB H 4.345 0.02 1 1314 119 119 THR HG1 H 5.383 0.02 1 1315 119 119 THR HG2 H 1.149 0.02 1 1316 119 119 THR C C 175.551 0.2 1 1317 119 119 THR CA C 67.470 0.2 1 1318 119 119 THR CB C 69.110 0.2 1 1319 119 119 THR CG2 C 20.480 0.2 1 1320 119 119 THR N N 114.460 0.2 1 1321 120 120 VAL H H 7.800 0.02 1 1322 120 120 VAL HA H 3.620 0.02 1 1323 120 120 VAL HB H 2.142 0.02 1 1324 120 120 VAL HG1 H 0.923 0.02 2 1325 120 120 VAL HG2 H 0.901 0.02 2 1326 120 120 VAL C C 178.213 0.2 1 1327 120 120 VAL CA C 66.020 0.2 1 1328 120 120 VAL CB C 31.830 0.2 1 1329 120 120 VAL CG1 C 22.576 0.2 2 1330 120 120 VAL CG2 C 22.076 0.2 2 1331 120 120 VAL N N 118.050 0.2 1 1332 121 121 PHE H H 8.370 0.02 1 1333 121 121 PHE HA H 4.220 0.02 1 1334 121 121 PHE HB2 H 3.113 0.02 1 1335 121 121 PHE HB3 H 3.113 0.02 1 1336 121 121 PHE HD1 H 7.131 0.02 3 1337 121 121 PHE C C 178.739 0.2 1 1338 121 121 PHE CA C 61.540 0.2 1 1339 121 121 PHE CB C 40.130 0.2 1 1340 121 121 PHE CD1 C 132.154 0.2 3 1341 121 121 PHE N N 118.360 0.2 1 1342 122 122 VAL H H 8.959 0.02 1 1343 122 122 VAL HA H 3.625 0.02 1 1344 122 122 VAL HB H 2.277 0.02 1 1345 122 122 VAL HG1 H 1.048 0.02 2 1346 122 122 VAL HG2 H 1.221 0.02 2 1347 122 122 VAL C C 178.247 0.2 1 1348 122 122 VAL CA C 65.850 0.2 1 1349 122 122 VAL CB C 31.881 0.2 1 1350 122 122 VAL CG1 C 21.414 0.2 2 1351 122 122 VAL CG2 C 22.770 0.2 2 1352 122 122 VAL N N 118.710 0.2 1 1353 123 123 LYS H H 7.688 0.02 1 1354 123 123 LYS HA H 4.316 0.02 1 1355 123 123 LYS HB2 H 2.286 0.02 2 1356 123 123 LYS HB3 H 1.947 0.02 2 1357 123 123 LYS HG2 H 1.467 0.02 2 1358 123 123 LYS HG3 H 1.640 0.02 2 1359 123 123 LYS HD3 H 1.672 0.02 2 1360 123 123 LYS HE2 H 3.009 0.02 2 1361 123 123 LYS C C 176.148 0.2 1 1362 123 123 LYS CA C 56.530 0.2 1 1363 123 123 LYS CB C 32.030 0.2 1 1364 123 123 LYS CG C 26.210 0.2 1 1365 123 123 LYS CD C 29.050 0.2 1 1366 123 123 LYS CE C 42.120 0.2 1 1367 123 123 LYS N N 115.960 0.2 1 1368 124 124 ASN H H 7.560 0.02 1 1369 124 124 ASN HA H 4.344 0.02 1 1370 124 124 ASN HB2 H 3.091 0.02 2 1371 124 124 ASN HB3 H 2.519 0.02 2 1372 124 124 ASN HD21 H 7.490 0.02 2 1373 124 124 ASN HD22 H 6.716 0.02 2 1374 124 124 ASN C C 174.205 0.2 1 1375 124 124 ASN CA C 53.920 0.2 1 1376 124 124 ASN CB C 37.070 0.2 1 1377 124 124 ASN N N 117.440 0.2 1 1378 124 124 ASN ND2 N 112.019 0.2 1 1379 125 125 ILE H H 7.658 0.02 1 1380 125 125 ILE HA H 4.110 0.02 1 1381 125 125 ILE HB H 1.733 0.02 1 1382 125 125 ILE HG12 H 1.502 0.02 2 1383 125 125 ILE HG13 H 1.131 0.02 2 1384 125 125 ILE HG2 H 0.919 0.02 1 1385 125 125 ILE HD1 H 0.851 0.02 1 1386 125 125 ILE C C 175.909 0.2 1 1387 125 125 ILE CA C 61.570 0.2 1 1388 125 125 ILE CB C 39.970 0.2 1 1389 125 125 ILE CG1 C 27.738 0.2 1 1390 125 125 ILE CG2 C 18.815 0.2 1 1391 125 125 ILE CD1 C 13.442 0.2 1 1392 125 125 ILE N N 116.780 0.2 1 1393 126 126 ARG H H 8.658 0.02 1 1394 126 126 ARG HA H 4.631 0.02 1 1395 126 126 ARG HB2 H 2.243 0.02 2 1396 126 126 ARG HB3 H 1.746 0.02 2 1397 126 126 ARG HG2 H 1.550 0.02 2 1398 126 126 ARG HG3 H 1.698 0.02 2 1399 126 126 ARG HD3 H 3.155 0.02 2 1400 126 126 ARG C C 175.296 0.2 1 1401 126 126 ARG CA C 55.210 0.2 1 1402 126 126 ARG CB C 31.217 0.2 1 1403 126 126 ARG CG C 27.128 0.2 1 1404 126 126 ARG CD C 42.846 0.2 1 1405 126 126 ARG N N 122.400 0.2 1 1406 127 127 MET H H 7.487 0.02 1 1407 127 127 MET HA H 5.412 0.02 1 1408 127 127 MET HB2 H 2.002 0.02 1 1409 127 127 MET HB3 H 2.002 0.02 1 1410 127 127 MET HG2 H 2.468 0.02 1 1411 127 127 MET HG3 H 2.468 0.02 1 1412 127 127 MET HE H 1.168 0.02 1 1413 127 127 MET C C 174.169 0.2 1 1414 127 127 MET CA C 55.130 0.2 1 1415 127 127 MET CB C 35.300 0.2 1 1416 127 127 MET CG C 31.618 0.2 1 1417 127 127 MET CE C 21.365 0.2 1 1418 127 127 MET N N 119.870 0.2 1 1419 128 128 LEU H H 8.961 0.02 1 1420 128 128 LEU HA H 4.890 0.02 1 1421 128 128 LEU HB2 H 1.716 0.02 2 1422 128 128 LEU HB3 H 1.606 0.02 2 1423 128 128 LEU HG H 0.708 0.02 1 1424 128 128 LEU HD1 H 0.810 0.02 2 1425 128 128 LEU C C 174.857 0.2 1 1426 128 128 LEU CA C 54.170 0.2 1 1427 128 128 LEU CB C 46.090 0.2 1 1428 128 128 LEU CG C 26.080 0.2 1 1429 128 128 LEU CD1 C 25.085 0.2 2 1430 128 128 LEU N N 124.940 0.2 1 1431 129 129 SER H H 9.512 0.02 1 1432 129 129 SER HA H 5.503 0.02 1 1433 129 129 SER HB2 H 4.051 0.02 2 1434 129 129 SER HB3 H 4.698 0.02 2 1435 129 129 SER HG H 5.742 0.02 1 1436 129 129 SER C C 176.225 0.2 1 1437 129 129 SER CA C 56.630 0.2 1 1438 129 129 SER CB C 66.030 0.2 1 1439 129 129 SER N N 119.080 0.2 1 1440 130 130 PHE H H 8.712 0.02 1 1441 130 130 PHE HA H 4.440 0.02 1 1442 130 130 PHE HB2 H 3.454 0.02 2 1443 130 130 PHE HB3 H 3.098 0.02 2 1444 130 130 PHE HD1 H 6.992 0.02 3 1445 130 130 PHE HE1 H 7.243 0.02 3 1446 130 130 PHE C C 179.046 0.2 1 1447 130 130 PHE CA C 58.730 0.2 1 1448 130 130 PHE CB C 36.520 0.2 1 1449 130 130 PHE CD1 C 129.319 0.2 3 1450 130 130 PHE CE1 C 131.310 0.2 3 1451 130 130 PHE N N 120.530 0.2 1 1452 131 131 GLU H H 8.961 0.02 1 1453 131 131 GLU HA H 4.025 0.02 1 1454 131 131 GLU HB2 H 2.181 0.02 2 1455 131 131 GLU HB3 H 2.008 0.02 2 1456 131 131 GLU HG2 H 2.321 0.02 1 1457 131 131 GLU HG3 H 2.321 0.02 1 1458 131 131 GLU C C 178.039 0.2 1 1459 131 131 GLU CA C 59.870 0.2 1 1460 131 131 GLU CB C 29.470 0.2 1 1461 131 131 GLU CG C 36.055 0.2 1 1462 131 131 GLU N N 121.180 0.2 1 1463 132 132 ASP H H 8.369 0.02 1 1464 132 132 ASP HA H 4.397 0.02 1 1465 132 132 ASP HB2 H 2.555 0.02 2 1466 132 132 ASP HB3 H 3.114 0.02 2 1467 132 132 ASP C C 180.369 0.2 1 1468 132 132 ASP CA C 57.690 0.2 1 1469 132 132 ASP CB C 40.740 0.2 1 1470 132 132 ASP N N 120.930 0.2 1 1471 133 133 ILE H H 8.062 0.02 1 1472 133 133 ILE HA H 3.509 0.02 1 1473 133 133 ILE HB H 1.885 0.02 1 1474 133 133 ILE HG12 H 0.637 0.02 2 1475 133 133 ILE HG13 H 2.027 0.02 2 1476 133 133 ILE HG2 H 0.782 0.02 1 1477 133 133 ILE HD1 H 0.629 0.02 1 1478 133 133 ILE C C 178.895 0.2 1 1479 133 133 ILE CA C 66.280 0.2 1 1480 133 133 ILE CB C 37.530 0.2 1 1481 133 133 ILE CG1 C 30.094 0.2 1 1482 133 133 ILE CG2 C 19.122 0.2 1 1483 133 133 ILE CD1 C 13.451 0.2 1 1484 133 133 ILE N N 120.360 0.2 1 1485 134 134 SER H H 8.823 0.02 1 1486 134 134 SER HA H 4.074 0.02 1 1487 134 134 SER HB2 H 4.093 0.02 2 1488 134 134 SER HB3 H 3.856 0.02 2 1489 134 134 SER HG H 5.716 0.02 1 1490 134 134 SER C C 176.934 0.2 1 1491 134 134 SER CA C 61.240 0.2 1 1492 134 134 SER CB C 63.400 0.2 1 1493 134 134 SER N N 120.050 0.2 1 1494 135 135 LYS H H 8.258 0.02 1 1495 135 135 LYS HA H 3.930 0.02 1 1496 135 135 LYS HB3 H 1.890 0.02 2 1497 135 135 LYS HG2 H 1.636 0.02 2 1498 135 135 LYS HG3 H 1.442 0.02 2 1499 135 135 LYS HD3 H 1.698 0.02 2 1500 135 135 LYS HE3 H 2.999 0.02 2 1501 135 135 LYS C C 178.986 0.2 1 1502 135 135 LYS CA C 59.270 0.2 1 1503 135 135 LYS CB C 32.470 0.2 1 1504 135 135 LYS CG C 25.627 0.2 1 1505 135 135 LYS CD C 29.210 0.2 1 1506 135 135 LYS CE C 42.138 0.2 1 1507 135 135 LYS N N 119.060 0.2 1 1508 136 136 ALA H H 7.538 0.02 1 1509 136 136 ALA HA H 4.202 0.02 1 1510 136 136 ALA HB H 1.460 0.02 1 1511 136 136 ALA C C 178.653 0.2 1 1512 136 136 ALA CA C 54.480 0.2 1 1513 136 136 ALA CB C 18.841 0.2 1 1514 136 136 ALA N N 118.350 0.2 1 1515 137 137 THR H H 7.777 0.02 1 1516 137 137 THR HA H 4.274 0.02 1 1517 137 137 THR HB H 4.327 0.02 1 1518 137 137 THR HG1 H 3.740 0.02 1 1519 137 137 THR HG2 H 1.201 0.02 1 1520 137 137 THR C C 172.932 0.2 1 1521 137 137 THR CA C 61.990 0.2 1 1522 137 137 THR CB C 71.200 0.2 1 1523 137 137 THR CG2 C 21.960 0.2 1 1524 137 137 THR N N 101.770 0.2 1 1525 138 138 HIS H H 7.567 0.02 1 1526 138 138 HIS HA H 3.959 0.02 1 1527 138 138 HIS HB2 H 2.900 0.02 2 1528 138 138 HIS HB3 H 3.043 0.02 2 1529 138 138 HIS HD2 H 6.154 0.02 1 1530 138 138 HIS C C 173.700 0.2 1 1531 138 138 HIS CA C 56.330 0.2 1 1532 138 138 HIS CB C 25.410 0.2 1 1533 138 138 HIS CD2 C 118.810 0.2 1 1534 138 138 HIS N N 113.660 0.2 1 1535 139 139 LEU H H 7.513 0.02 1 1536 139 139 LEU HA H 4.843 0.02 1 1537 139 139 LEU HB2 H 1.437 0.02 2 1538 139 139 LEU HB3 H 1.282 0.02 2 1539 139 139 LEU HG H 1.703 0.02 1 1540 139 139 LEU HD1 H 0.948 0.02 2 1541 139 139 LEU HD2 H 0.932 0.02 2 1542 139 139 LEU C C 174.376 0.2 1 1543 139 139 LEU CA C 51.870 0.2 1 1544 139 139 LEU CB C 44.750 0.2 1 1545 139 139 LEU CG C 26.340 0.2 1 1546 139 139 LEU CD1 C 24.018 0.2 2 1547 139 139 LEU CD2 C 26.406 0.2 2 1548 139 139 LEU N N 120.070 0.2 1 1549 140 140 PRO HA H 4.391 0.02 1 1550 140 140 PRO HB2 H 2.370 0.02 2 1551 140 140 PRO HB3 H 1.971 0.02 2 1552 140 140 PRO HG2 H 2.053 0.02 2 1553 140 140 PRO HG3 H 1.992 0.02 2 1554 140 140 PRO HD2 H 3.489 0.02 2 1555 140 140 PRO HD3 H 3.902 0.02 2 1556 140 140 PRO C C 177.985 0.2 1 1557 140 140 PRO CA C 62.390 0.2 1 1558 140 140 PRO CB C 32.070 0.2 1 1559 140 140 PRO CG C 28.010 0.2 1 1560 140 140 PRO CD C 50.800 0.2 1 1561 141 141 LYS H H 8.950 0.02 1 1562 141 141 LYS HA H 3.819 0.02 1 1563 141 141 LYS HB2 H 1.919 0.02 2 1564 141 141 LYS HG3 H 1.589 0.02 2 1565 141 141 LYS HD3 H 1.890 0.02 2 1566 141 141 LYS HE2 H 3.062 0.02 2 1567 141 141 LYS HE3 H 3.012 0.02 2 1568 141 141 LYS C C 178.083 0.2 1 1569 141 141 LYS CA C 60.830 0.2 1 1570 141 141 LYS CB C 31.890 0.2 1 1571 141 141 LYS CG C 26.107 0.2 1 1572 141 141 LYS CD C 29.271 0.2 1 1573 141 141 LYS CE C 41.315 0.2 1 1574 141 141 LYS N N 123.930 0.2 1 1575 142 142 ASP H H 8.491 0.02 1 1576 142 142 ASP HA H 4.495 0.02 1 1577 142 142 ASP HB2 H 2.713 0.02 2 1578 142 142 ASP C C 176.656 0.2 1 1579 142 142 ASP CA C 55.590 0.2 1 1580 142 142 ASP CB C 39.740 0.2 1 1581 142 142 ASP N N 114.510 0.2 1 1582 143 143 ASN H H 8.191 0.02 1 1583 143 143 ASN HA H 5.066 0.02 1 1584 143 143 ASN HB2 H 3.019 0.02 2 1585 143 143 ASN HB3 H 2.628 0.02 2 1586 143 143 ASN HD21 H 6.934 0.02 2 1587 143 143 ASN HD22 H 7.219 0.02 2 1588 143 143 ASN C C 175.954 0.2 1 1589 143 143 ASN CA C 53.220 0.2 1 1590 143 143 ASN CB C 40.950 0.2 1 1591 143 143 ASN N N 116.400 0.2 1 1592 143 143 ASN ND2 N 109.670 0.2 1 1593 144 144 VAL H H 7.472 0.02 1 1594 144 144 VAL HA H 3.323 0.02 1 1595 144 144 VAL HB H 1.785 0.02 1 1596 144 144 VAL HG1 H 0.872 0.02 2 1597 144 144 VAL HG2 H 0.410 0.02 2 1598 144 144 VAL C C 176.423 0.2 1 1599 144 144 VAL CA C 66.990 0.2 1 1600 144 144 VAL CB C 31.440 0.2 1 1601 144 144 VAL CG1 C 22.746 0.2 2 1602 144 144 VAL CG2 C 21.392 0.2 2 1603 144 144 VAL N N 120.490 0.2 1 1604 145 145 GLU H H 9.141 0.02 1 1605 145 145 GLU HA H 3.261 0.02 1 1606 145 145 GLU HB2 H 1.890 0.02 1 1607 145 145 GLU HB3 H 1.890 0.02 1 1608 145 145 GLU HG2 H 2.028 0.02 1 1609 145 145 GLU HG3 H 2.028 0.02 1 1610 145 145 GLU C C 177.853 0.2 1 1611 145 145 GLU CA C 60.830 0.2 1 1612 145 145 GLU CB C 28.810 0.2 1 1613 145 145 GLU CG C 36.640 0.2 1 1614 145 145 GLU N N 122.340 0.2 1 1615 146 146 HIS H H 8.162 0.02 1 1616 146 146 HIS HA H 4.174 0.02 1 1617 146 146 HIS HB2 H 3.033 0.02 2 1618 146 146 HIS HB3 H 3.098 0.02 2 1619 146 146 HIS HD2 H 6.954 0.02 1 1620 146 146 HIS C C 177.947 0.2 1 1621 146 146 HIS CA C 59.540 0.2 1 1622 146 146 HIS CB C 30.450 0.2 1 1623 146 146 HIS CD2 C 118.223 0.2 1 1624 146 146 HIS N N 116.970 0.2 1 1625 147 147 LEU H H 7.336 0.02 1 1626 147 147 LEU HA H 3.960 0.02 1 1627 147 147 LEU HB2 H 1.946 0.02 2 1628 147 147 LEU HB3 H 1.548 0.02 2 1629 147 147 LEU HG H 0.844 0.02 1 1630 147 147 LEU HD1 H 0.872 0.02 2 1631 147 147 LEU C C 178.427 0.2 1 1632 147 147 LEU CA C 58.270 0.2 1 1633 147 147 LEU CB C 41.736 0.2 1 1634 147 147 LEU CG C 26.780 0.2 1 1635 147 147 LEU CD1 C 24.120 0.2 2 1636 147 147 LEU N N 120.670 0.2 1 1637 148 148 VAL H H 8.172 0.02 1 1638 148 148 VAL HA H 3.223 0.02 1 1639 148 148 VAL HB H 1.968 0.02 1 1640 148 148 VAL HG1 H 0.844 0.02 2 1641 148 148 VAL HG2 H 0.779 0.02 2 1642 148 148 VAL C C 177.801 0.2 1 1643 148 148 VAL CA C 66.961 0.2 1 1644 148 148 VAL CB C 31.010 0.2 1 1645 148 148 VAL CG1 C 23.368 0.2 2 1646 148 148 VAL CG2 C 21.778 0.2 2 1647 148 148 VAL N N 118.060 0.2 1 1648 149 149 MET H H 8.585 0.02 1 1649 149 149 MET HA H 4.123 0.02 1 1650 149 149 MET HB2 H 2.084 0.02 2 1651 149 149 MET HB3 H 2.152 0.02 2 1652 149 149 MET HG2 H 2.752 0.02 2 1653 149 149 MET HG3 H 2.552 0.02 2 1654 149 149 MET HE H 0.911 0.02 1 1655 149 149 MET C C 179.823 0.2 1 1656 149 149 MET CA C 58.630 0.2 1 1657 149 149 MET CB C 31.496 0.2 1 1658 149 149 MET CG C 32.400 0.2 1 1659 149 149 MET CE C 14.750 0.2 1 1660 149 149 MET N N 117.770 0.2 1 1661 150 150 ARG H H 8.160 0.02 1 1662 150 150 ARG HA H 4.094 0.02 1 1663 150 150 ARG HB2 H 1.914 0.02 2 1664 150 150 ARG HB3 H 2.026 0.02 2 1665 150 150 ARG HG2 H 1.578 0.02 2 1666 150 150 ARG HD2 H 3.175 0.02 2 1667 150 150 ARG HD3 H 3.285 0.02 2 1668 150 150 ARG C C 177.928 0.2 1 1669 150 150 ARG CA C 58.150 0.2 1 1670 150 150 ARG CB C 28.750 0.2 1 1671 150 150 ARG CG C 26.501 0.2 1 1672 150 150 ARG CD C 42.800 0.2 1 1673 150 150 ARG N N 121.900 0.2 1 1674 151 151 ALA H H 8.165 0.02 1 1675 151 151 ALA HA H 3.798 0.02 1 1676 151 151 ALA HB H 1.374 0.02 1 1677 151 151 ALA C C 179.518 0.2 1 1678 151 151 ALA CA C 55.740 0.2 1 1679 151 151 ALA CB C 17.890 0.2 1 1680 151 151 ALA N N 121.710 0.2 1 1681 152 152 ILE H H 8.331 0.02 1 1682 152 152 ILE HA H 4.382 0.02 1 1683 152 152 ILE HB H 1.940 0.02 1 1684 152 152 ILE HG12 H 0.875 0.02 2 1685 152 152 ILE HG13 H 1.781 0.02 2 1686 152 152 ILE HG2 H 1.079 0.02 1 1687 152 152 ILE HD1 H 0.741 0.02 1 1688 152 152 ILE C C 181.439 0.2 1 1689 152 152 ILE CA C 64.560 0.2 1 1690 152 152 ILE CB C 38.700 0.2 1 1691 152 152 ILE CG1 C 29.577 0.2 1 1692 152 152 ILE CG2 C 16.921 0.2 1 1693 152 152 ILE CD1 C 13.319 0.2 1 1694 152 152 ILE N N 118.590 0.2 1 1695 153 153 SER H H 8.756 0.02 1 1696 153 153 SER HA H 4.279 0.02 1 1697 153 153 SER HB3 H 4.101 0.02 2 1698 153 153 SER C C 176.745 0.2 1 1699 153 153 SER CA C 62.040 0.2 1 1700 153 153 SER CB C 62.930 0.2 1 1701 153 153 SER N N 120.250 0.2 1 1702 154 154 LEU H H 8.129 0.02 1 1703 154 154 LEU HA H 4.345 0.02 1 1704 154 154 LEU HB2 H 1.587 0.02 2 1705 154 154 LEU HB3 H 1.755 0.02 2 1706 154 154 LEU HG H 0.780 0.02 1 1707 154 154 LEU HD1 H 1.057 0.02 2 1708 154 154 LEU C C 177.351 0.2 1 1709 154 154 LEU CA C 55.455 0.2 1 1710 154 154 LEU CB C 44.000 0.2 1 1711 154 154 LEU CG C 26.791 0.2 1 1712 154 154 LEU CD1 C 22.487 0.2 2 1713 154 154 LEU N N 119.480 0.2 1 1714 155 155 GLY H H 8.023 0.02 1 1715 155 155 GLY HA2 H 4.206 0.02 2 1716 155 155 GLY HA3 H 4.053 0.02 2 1717 155 155 GLY C C 174.867 0.2 1 1718 155 155 GLY CA C 45.800 0.2 1 1719 155 155 GLY N N 106.990 0.2 1 1720 156 156 LEU H H 8.101 0.02 1 1721 156 156 LEU HA H 4.260 0.02 1 1722 156 156 LEU HB2 H 1.413 0.02 2 1723 156 156 LEU HB3 H 1.524 0.02 2 1724 156 156 LEU HG H 1.434 0.02 1 1725 156 156 LEU HD1 H 0.607 0.02 2 1726 156 156 LEU HD2 H 0.280 0.02 2 1727 156 156 LEU C C 175.387 0.2 1 1728 156 156 LEU CA C 55.930 0.2 1 1729 156 156 LEU CB C 43.220 0.2 1 1730 156 156 LEU CG C 26.720 0.2 1 1731 156 156 LEU CD1 C 21.603 0.2 2 1732 156 156 LEU CD2 C 25.051 0.2 2 1733 156 156 LEU N N 116.510 0.2 1 1734 157 157 LEU H H 7.194 0.02 1 1735 157 157 LEU HA H 5.000 0.02 1 1736 157 157 LEU HB2 H 1.556 0.02 2 1737 157 157 LEU HB3 H 1.481 0.02 2 1738 157 157 LEU HG H 1.498 0.02 1 1739 157 157 LEU HD1 H 0.708 0.02 2 1740 157 157 LEU HD2 H 0.748 0.02 2 1741 157 157 LEU C C 175.382 0.2 1 1742 157 157 LEU CA C 53.640 0.2 1 1743 157 157 LEU CB C 46.560 0.2 1 1744 157 157 LEU CG C 26.210 0.2 1 1745 157 157 LEU CD1 C 25.280 0.2 2 1746 157 157 LEU CD2 C 25.840 0.2 2 1747 157 157 LEU N N 112.790 0.2 1 1748 158 158 LYS H H 9.056 0.02 1 1749 158 158 LYS HA H 4.795 0.02 1 1750 158 158 LYS HB2 H 1.865 0.02 2 1751 158 158 LYS HB3 H 1.916 0.02 2 1752 158 158 LYS HG2 H 1.409 0.02 2 1753 158 158 LYS HG3 H 1.477 0.02 2 1754 158 158 LYS HD2 H 1.557 0.02 2 1755 158 158 LYS HD3 H 1.290 0.02 2 1756 158 158 LYS HE2 H 2.548 0.02 2 1757 158 158 LYS HE3 H 2.438 0.02 2 1758 158 158 LYS C C 175.461 0.2 1 1759 158 158 LYS CA C 56.060 0.2 1 1760 158 158 LYS CB C 36.190 0.2 1 1761 158 158 LYS CG C 25.933 0.2 1 1762 158 158 LYS CD C 29.220 0.2 1 1763 158 158 LYS CE C 41.980 0.2 1 1764 158 158 LYS N N 121.010 0.2 1 1765 159 159 GLY H H 8.287 0.02 1 1766 159 159 GLY HA2 H 4.636 0.02 2 1767 159 159 GLY HA3 H 4.220 0.02 2 1768 159 159 GLY C C 170.992 0.2 1 1769 159 159 GLY CA C 46.140 0.2 1 1770 159 159 GLY N N 109.800 0.2 1 1771 160 160 SER H H 8.847 0.02 1 1772 160 160 SER HA H 4.780 0.02 1 1773 160 160 SER HB2 H 3.771 0.02 2 1774 160 160 SER C C 172.525 0.2 1 1775 160 160 SER CA C 56.840 0.2 1 1776 160 160 SER CB C 65.660 0.2 1 1777 160 160 SER N N 112.940 0.2 1 1778 161 161 ILE H H 8.867 0.02 1 1779 161 161 ILE HA H 4.406 0.02 1 1780 161 161 ILE HB H 1.906 0.02 1 1781 161 161 ILE HG12 H 1.613 0.02 2 1782 161 161 ILE HG13 H 0.876 0.02 2 1783 161 161 ILE HG2 H 0.992 0.02 1 1784 161 161 ILE HD1 H 0.912 0.02 1 1785 161 161 ILE C C 174.457 0.2 1 1786 161 161 ILE CA C 61.419 0.2 1 1787 161 161 ILE CB C 40.228 0.2 1 1788 161 161 ILE CG1 C 28.420 0.2 1 1789 161 161 ILE CG2 C 18.203 0.2 1 1790 161 161 ILE CD1 C 14.801 0.2 1 1791 161 161 ILE N N 123.020 0.2 1 1792 162 162 ASP H H 8.955 0.02 1 1793 162 162 ASP HA H 4.916 0.02 1 1794 162 162 ASP HB2 H 2.979 0.02 2 1795 162 162 ASP HB3 H 2.581 0.02 2 1796 162 162 ASP C C 176.575 0.2 1 1797 162 162 ASP CA C 51.740 0.2 1 1798 162 162 ASP CB C 41.140 0.2 1 1799 162 162 ASP N N 128.130 0.2 1 1800 163 163 GLN H H 8.982 0.02 1 1801 163 163 GLN HA H 3.853 0.02 1 1802 163 163 GLN HB2 H 2.194 0.02 2 1803 163 163 GLN HG2 H 2.521 0.02 2 1804 163 163 GLN HG3 H 2.553 0.02 2 1805 163 163 GLN HE21 H 8.484 0.02 2 1806 163 163 GLN HE22 H 6.807 0.02 2 1807 163 163 GLN C C 177.627 0.2 1 1808 163 163 GLN CA C 59.210 0.2 1 1809 163 163 GLN CB C 28.920 0.2 1 1810 163 163 GLN CG C 34.271 0.2 1 1811 163 163 GLN N N 123.480 0.2 1 1812 163 163 GLN NE2 N 113.470 0.2 1 1813 164 164 VAL H H 7.974 0.02 1 1814 164 164 VAL HA H 3.683 0.02 1 1815 164 164 VAL HB H 2.060 0.02 1 1816 164 164 VAL HG1 H 1.047 0.02 2 1817 164 164 VAL HG2 H 0.855 0.02 2 1818 164 164 VAL C C 177.519 0.2 1 1819 164 164 VAL CA C 65.770 0.2 1 1820 164 164 VAL CB C 31.930 0.2 1 1821 164 164 VAL CG1 C 22.343 0.2 2 1822 164 164 VAL CG2 C 20.704 0.2 2 1823 164 164 VAL N N 119.220 0.2 1 1824 165 165 ASN H H 7.502 0.02 1 1825 165 165 ASN HA H 4.601 0.02 1 1826 165 165 ASN HB2 H 2.661 0.02 2 1827 165 165 ASN HB3 H 2.193 0.02 2 1828 165 165 ASN HD21 H 8.957 0.02 2 1829 165 165 ASN HD22 H 6.936 0.02 2 1830 165 165 ASN C C 172.795 0.2 1 1831 165 165 ASN CA C 52.900 0.2 1 1832 165 165 ASN CB C 38.830 0.2 1 1833 165 165 ASN N N 114.430 0.2 1 1834 165 165 ASN ND2 N 118.680 0.2 1 1835 166 166 GLU H H 7.268 0.02 1 1836 166 166 GLU HA H 2.014 0.02 1 1837 166 166 GLU HB2 H 1.255 0.02 2 1838 166 166 GLU HB3 H 2.050 0.02 2 1839 166 166 GLU HG2 H 1.919 0.02 2 1840 166 166 GLU HG3 H 1.517 0.02 2 1841 166 166 GLU C C 174.562 0.2 1 1842 166 166 GLU CA C 56.228 0.2 1 1843 166 166 GLU CB C 26.816 0.2 1 1844 166 166 GLU CG C 36.243 0.2 1 1845 166 166 GLU N N 116.970 0.2 1 1846 167 167 LEU H H 7.699 0.02 1 1847 167 167 LEU HA H 4.998 0.02 1 1848 167 167 LEU HB2 H 1.382 0.02 1 1849 167 167 LEU HB3 H 1.382 0.02 1 1850 167 167 LEU HG H 1.370 0.02 1 1851 167 167 LEU HD1 H 0.776 0.02 2 1852 167 167 LEU HD2 H 0.794 0.02 2 1853 167 167 LEU C C 175.659 0.2 1 1854 167 167 LEU CA C 53.670 0.2 1 1855 167 167 LEU CB C 47.310 0.2 1 1856 167 167 LEU CG C 26.211 0.2 1 1857 167 167 LEU CD1 C 24.124 0.2 2 1858 167 167 LEU CD2 C 24.550 0.2 2 1859 167 167 LEU N N 117.360 0.2 1 1860 168 168 VAL H H 9.445 0.02 1 1861 168 168 VAL HA H 4.839 0.02 1 1862 168 168 VAL HB H 2.088 0.02 1 1863 168 168 VAL HG1 H 0.782 0.02 2 1864 168 168 VAL HG2 H 0.970 0.02 2 1865 168 168 VAL C C 174.792 0.2 1 1866 168 168 VAL CA C 61.130 0.2 1 1867 168 168 VAL CB C 34.349 0.2 1 1868 168 168 VAL CG1 C 20.643 0.2 2 1869 168 168 VAL CG2 C 22.199 0.2 2 1870 168 168 VAL N N 125.350 0.2 1 1871 169 169 THR H H 8.824 0.02 1 1872 169 169 THR HA H 4.869 0.02 1 1873 169 169 THR HB H 4.077 0.02 1 1874 169 169 THR HG2 H 1.171 0.02 1 1875 169 169 THR C C 173.876 0.2 1 1876 169 169 THR CA C 61.580 0.2 1 1877 169 169 THR CB C 69.750 0.2 1 1878 169 169 THR CG2 C 21.361 0.2 1 1879 169 169 THR N N 123.020 0.2 1 1880 170 170 ILE H H 8.911 0.02 1 1881 170 170 ILE HA H 4.542 0.02 1 1882 170 170 ILE HB H 1.855 0.02 1 1883 170 170 ILE HG12 H 1.038 0.02 2 1884 170 170 ILE HG13 H 1.351 0.02 2 1885 170 170 ILE HG2 H 0.880 0.02 1 1886 170 170 ILE HD1 H 0.657 0.02 1 1887 170 170 ILE C C 175.672 0.2 1 1888 170 170 ILE CA C 60.330 0.2 1 1889 170 170 ILE CB C 39.610 0.2 1 1890 170 170 ILE CG1 C 27.886 0.2 1 1891 170 170 ILE CG2 C 18.640 0.2 1 1892 170 170 ILE CD1 C 13.442 0.2 1 1893 170 170 ILE N N 126.700 0.2 1 1894 171 171 SER H H 9.242 0.02 1 1895 171 171 SER HA H 4.670 0.02 1 1896 171 171 SER HB2 H 3.932 0.02 2 1897 171 171 SER HB3 H 3.758 0.02 2 1898 171 171 SER C C 174.700 0.2 1 1899 171 171 SER CA C 58.280 0.2 1 1900 171 171 SER CB C 64.560 0.2 1 1901 171 171 SER N N 122.780 0.2 1 1902 172 172 TRP H H 7.929 0.02 1 1903 172 172 TRP HA H 4.635 0.02 1 1904 172 172 TRP HB2 H 3.542 0.02 2 1905 172 172 TRP HB3 H 2.706 0.02 2 1906 172 172 TRP HD1 H 7.423 0.02 1 1907 172 172 TRP HE1 H 10.233 0.02 1 1908 172 172 TRP HE3 H 7.046 0.02 1 1909 172 172 TRP HZ2 H 7.525 0.02 1 1910 172 172 TRP HZ3 H 6.881 0.02 1 1911 172 172 TRP HH2 H 7.308 0.02 1 1912 172 172 TRP C C 172.618 0.2 1 1913 172 172 TRP CA C 58.910 0.2 1 1914 172 172 TRP CB C 31.650 0.2 1 1915 172 172 TRP CD1 C 127.470 0.2 1 1916 172 172 TRP CE3 C 119.068 0.2 1 1917 172 172 TRP CZ2 C 114.650 0.2 1 1918 172 172 TRP CZ3 C 122.168 0.2 1 1919 172 172 TRP CH2 C 124.590 0.2 1 1920 172 172 TRP N N 123.970 0.2 1 1921 172 172 TRP NE1 N 130.368 0.2 1 1922 173 173 VAL H H 6.764 0.02 1 1923 173 173 VAL HA H 4.130 0.02 1 1924 173 173 VAL HB H 1.635 0.02 1 1925 173 173 VAL HG1 H 0.855 0.02 2 1926 173 173 VAL HG2 H 0.701 0.02 2 1927 173 173 VAL C C 170.746 0.2 1 1928 173 173 VAL CA C 59.100 0.2 1 1929 173 173 VAL CB C 35.220 0.2 1 1930 173 173 VAL CG1 C 21.450 0.2 2 1931 173 173 VAL CG2 C 20.056 0.2 2 1932 173 173 VAL N N 123.660 0.2 1 1933 174 174 GLN H H 7.071 0.02 1 1934 174 174 GLN HA H 3.606 0.02 1 1935 174 174 GLN HB2 H 1.832 0.02 2 1936 174 174 GLN HB3 H 2.015 0.02 2 1937 174 174 GLN HG3 H 2.358 0.02 2 1938 174 174 GLN HE21 H 6.847 0.02 2 1939 174 174 GLN HE22 H 7.640 0.02 2 1940 174 174 GLN C C 172.955 0.2 1 1941 174 174 GLN CA C 54.050 0.2 1 1942 174 174 GLN CB C 29.760 0.2 1 1943 174 174 GLN CG C 33.520 0.2 1 1944 174 174 GLN N N 126.430 0.2 1 1945 174 174 GLN NE2 N 111.655 0.2 1 1946 175 175 PRO HA H 3.861 0.02 1 1947 175 175 PRO HB2 H 1.846 0.02 2 1948 175 175 PRO HB3 H 2.145 0.02 2 1949 175 175 PRO HG2 H 1.991 0.02 2 1950 175 175 PRO HD3 H 3.632 0.02 2 1951 175 175 PRO C C 175.955 0.2 1 1952 175 175 PRO CA C 62.750 0.2 1 1953 175 175 PRO CB C 32.400 0.2 1 1954 175 175 PRO CG C 27.287 0.2 1 1955 175 175 PRO CD C 50.937 0.2 1 1956 176 176 ARG H H 6.457 0.02 1 1957 176 176 ARG HA H 4.021 0.02 1 1958 176 176 ARG HB2 H 1.676 0.02 2 1959 176 176 ARG HB3 H 1.425 0.02 2 1960 176 176 ARG HG2 H 1.251 0.02 2 1961 176 176 ARG HG3 H 1.307 0.02 2 1962 176 176 ARG HD3 H 2.900 0.02 2 1963 176 176 ARG HE H 7.593 0.02 1 1964 176 176 ARG C C 180.731 0.2 1 1965 176 176 ARG CA C 56.790 0.2 1 1966 176 176 ARG CB C 31.240 0.2 1 1967 176 176 ARG CG C 26.683 0.2 1 1968 176 176 ARG CD C 43.356 0.2 1 1969 176 176 ARG N N 124.370 0.2 1 1970 176 176 ARG NE N 85.473 0.2 1 stop_ save_