data_19325 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C, and 15N Chemical Shift Assignments for a proteasome related subunit ; _BMRB_accession_number 19325 _BMRB_flat_file_name bmr19325.str _Entry_type original _Submission_date 2013-06-27 _Accession_date 2013-06-27 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 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" 1086 "13C chemical shifts" 811 "15N chemical shifts" 208 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-02-13 original author . stop_ _Original_release_date 2014-02-13 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title '(1)H, (13)C and (15)N resonance assignments of the VWA domain of Saccharomyces cerevisiae Rpn10, a regulatory subunit of 26S proteasome.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 24037519 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 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular NMR assignments' _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 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name '26S proteasome subunit monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label '26S proteasome subunit monomer' $26s_proteasome_subunit 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_26s_proteasome_subunit _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 26s_proteasome_subunit _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 207 _Mol_residue_sequence ; MVLEATVLVIDNSEYSRNGD FPRTRFEAQIDSVEFIFQAK RNSNPENTVGLISGAGANPR VLSTFTAEFGKILAGLHDTQ IEGKLHMATALQIAQLTLKH RQNKVQHQRIVAFVCSPISD SRDELIRLAKTLKKNNVAVD IINFGEIEQNTELLDEFIAA VNNPQEETSHLLTVTPGPRL LYENIASSPIILEEGSSGMG AFGGSGG ; loop_ _Residue_seq_code _Residue_label 1 MET 2 VAL 3 LEU 4 GLU 5 ALA 6 THR 7 VAL 8 LEU 9 VAL 10 ILE 11 ASP 12 ASN 13 SER 14 GLU 15 TYR 16 SER 17 ARG 18 ASN 19 GLY 20 ASP 21 PHE 22 PRO 23 ARG 24 THR 25 ARG 26 PHE 27 GLU 28 ALA 29 GLN 30 ILE 31 ASP 32 SER 33 VAL 34 GLU 35 PHE 36 ILE 37 PHE 38 GLN 39 ALA 40 LYS 41 ARG 42 ASN 43 SER 44 ASN 45 PRO 46 GLU 47 ASN 48 THR 49 VAL 50 GLY 51 LEU 52 ILE 53 SER 54 GLY 55 ALA 56 GLY 57 ALA 58 ASN 59 PRO 60 ARG 61 VAL 62 LEU 63 SER 64 THR 65 PHE 66 THR 67 ALA 68 GLU 69 PHE 70 GLY 71 LYS 72 ILE 73 LEU 74 ALA 75 GLY 76 LEU 77 HIS 78 ASP 79 THR 80 GLN 81 ILE 82 GLU 83 GLY 84 LYS 85 LEU 86 HIS 87 MET 88 ALA 89 THR 90 ALA 91 LEU 92 GLN 93 ILE 94 ALA 95 GLN 96 LEU 97 THR 98 LEU 99 LYS 100 HIS 101 ARG 102 GLN 103 ASN 104 LYS 105 VAL 106 GLN 107 HIS 108 GLN 109 ARG 110 ILE 111 VAL 112 ALA 113 PHE 114 VAL 115 CYS 116 SER 117 PRO 118 ILE 119 SER 120 ASP 121 SER 122 ARG 123 ASP 124 GLU 125 LEU 126 ILE 127 ARG 128 LEU 129 ALA 130 LYS 131 THR 132 LEU 133 LYS 134 LYS 135 ASN 136 ASN 137 VAL 138 ALA 139 VAL 140 ASP 141 ILE 142 ILE 143 ASN 144 PHE 145 GLY 146 GLU 147 ILE 148 GLU 149 GLN 150 ASN 151 THR 152 GLU 153 LEU 154 LEU 155 ASP 156 GLU 157 PHE 158 ILE 159 ALA 160 ALA 161 VAL 162 ASN 163 ASN 164 PRO 165 GLN 166 GLU 167 GLU 168 THR 169 SER 170 HIS 171 LEU 172 LEU 173 THR 174 VAL 175 THR 176 PRO 177 GLY 178 PRO 179 ARG 180 LEU 181 LEU 182 TYR 183 GLU 184 ASN 185 ILE 186 ALA 187 SER 188 SER 189 PRO 190 ILE 191 ILE 192 LEU 193 GLU 194 GLU 195 GLY 196 SER 197 SER 198 GLY 199 MET 200 GLY 201 ALA 202 PHE 203 GLY 204 GLY 205 SER 206 GLY 207 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-09-02 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 PDB 4CR2 "Deep Classification Of A Large Cryo-em Dataset Defines The Conformational Landscape Of The 26s Proteasome" 100.00 268 100.00 100.00 1.97e-147 PDB 4CR3 "Deep Classification Of A Large Cryo-em Dataset Defines The Conformational Landscape Of The 26s Proteasome" 100.00 268 100.00 100.00 1.97e-147 PDB 4CR4 "Deep Classification Of A Large Cryo-em Dataset Defines The Conformational Landscape Of The 26s Proteasome" 100.00 268 100.00 100.00 1.97e-147 PDB 5A5B "Structure Of The 26s Proteasome-ubp6 Complex" 100.00 268 100.00 100.00 1.97e-147 DBJ BAA11207 "proteasome subunit [Saccharomyces cerevisiae]" 100.00 268 100.00 100.00 1.97e-147 DBJ GAA23917 "K7_Rpn10p [Saccharomyces cerevisiae Kyokai no. 7]" 100.00 268 100.00 100.00 3.04e-147 EMBL CAY80217 "Rpn10p [Saccharomyces cerevisiae EC1118]" 100.00 268 100.00 100.00 1.97e-147 GB AAB68355 "Sun1p: Proteasome subunit [Saccharomyces cerevisiae]" 100.00 268 100.00 100.00 1.97e-147 GB AAS56615 "YHR200W [Saccharomyces cerevisiae]" 100.00 268 100.00 100.00 1.97e-147 GB AHY77896 "Rpn10p [Saccharomyces cerevisiae YJM993]" 100.00 268 100.00 100.00 1.97e-147 GB AJP39292 "Rpn10p [Saccharomyces cerevisiae YJM1078]" 100.00 268 100.00 100.00 1.97e-147 GB AJU16491 "Rpn10p [Saccharomyces cerevisiae YJM1356]" 100.00 268 100.00 100.00 1.97e-147 REF NP_012070 "proteasome regulatory particle base subunit RPN10 [Saccharomyces cerevisiae S288c]" 100.00 268 100.00 100.00 1.97e-147 SP P38886 "RecName: Full=26S proteasome regulatory subunit RPN10" 100.00 268 100.00 100.00 1.97e-147 TPG DAA06893 "TPA: proteasome regulatory particle base subunit RPN10 [Saccharomyces cerevisiae S288c]" 100.00 268 100.00 100.00 1.97e-147 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $26s_proteasome_subunit '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 $26s_proteasome_subunit '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 $26s_proteasome_subunit 1.0 mM '[U-100% 13C; U-100% 15N]' MES 30 mM 'natural abundance' DTT 10 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' DSS 0.03 % 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Zhengrong 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_ save_CARA _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . 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_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _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_HCCH-COSY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aliphatic_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_11 _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' 0.08 . M pH 6.8 . 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 '2D 1H-15N HSQC' '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 '26S proteasome subunit monomer' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 2 VAL HA H 3.771 0.02 1 2 2 2 VAL HB H 2.089 0.02 1 3 2 2 VAL HG1 H 0.843 0.02 1 4 2 2 VAL HG2 H 0.843 0.02 1 5 2 2 VAL C C 170.800 0.20 1 6 2 2 VAL CA C 60.796 0.20 1 7 2 2 VAL CB C 32.941 0.20 1 8 2 2 VAL CG1 C 19.998 0.20 1 9 2 2 VAL CG2 C 19.998 0.20 1 10 3 3 LEU H H 8.500 0.02 1 11 3 3 LEU HA H 5.060 0.02 1 12 3 3 LEU HB2 H 1.383 0.02 2 13 3 3 LEU HB3 H 1.875 0.02 2 14 3 3 LEU HG H 1.291 0.02 1 15 3 3 LEU HD1 H 0.877 0.02 2 16 3 3 LEU HD2 H 0.805 0.02 2 17 3 3 LEU C C 176.200 0.20 1 18 3 3 LEU CA C 54.623 0.20 1 19 3 3 LEU CB C 41.663 0.20 1 20 3 3 LEU CG C 28.199 0.20 1 21 3 3 LEU CD1 C 24.161 0.20 2 22 3 3 LEU CD2 C 25.800 0.20 2 23 3 3 LEU N N 127.800 0.20 1 24 4 4 GLU H H 9.470 0.02 1 25 4 4 GLU HA H 4.921 0.02 1 26 4 4 GLU HB2 H 1.817 0.02 2 27 4 4 GLU HB3 H 1.660 0.02 2 28 4 4 GLU HG2 H 1.840 0.02 2 29 4 4 GLU HG3 H 2.017 0.02 2 30 4 4 GLU C C 173.800 0.20 1 31 4 4 GLU CA C 55.500 0.20 1 32 4 4 GLU CB C 34.800 0.20 1 33 4 4 GLU CG C 36.036 0.20 1 34 4 4 GLU N N 128.940 0.20 1 35 5 5 ALA H H 8.769 0.02 1 36 5 5 ALA HA H 4.732 0.02 1 37 5 5 ALA HB H 0.642 0.02 1 38 5 5 ALA C C 175.000 0.20 1 39 5 5 ALA CA C 50.700 0.20 1 40 5 5 ALA CB C 18.811 0.20 1 41 5 5 ALA N N 130.300 0.20 1 42 6 6 THR H H 8.098 0.02 1 43 6 6 THR HA H 5.540 0.02 1 44 6 6 THR HB H 3.932 0.02 1 45 6 6 THR HG2 H 1.045 0.02 1 46 6 6 THR C C 175.000 0.20 1 47 6 6 THR CA C 61.500 0.20 1 48 6 6 THR CB C 70.713 0.20 1 49 6 6 THR CG2 C 22.795 0.20 1 50 6 6 THR N N 118.400 0.20 1 51 7 7 VAL H H 9.430 0.02 1 52 7 7 VAL HA H 4.350 0.02 1 53 7 7 VAL HB H 2.016 0.02 1 54 7 7 VAL HG1 H 0.936 0.02 2 55 7 7 VAL HG2 H 1.043 0.02 2 56 7 7 VAL C C 173.700 0.20 1 57 7 7 VAL CA C 60.979 0.20 1 58 7 7 VAL CB C 34.193 0.20 1 59 7 7 VAL CG1 C 22.560 0.20 2 60 7 7 VAL CG2 C 23.069 0.20 2 61 7 7 VAL N N 126.400 0.20 1 62 8 8 LEU H H 8.603 0.02 1 63 8 8 LEU HA H 5.637 0.02 1 64 8 8 LEU HB2 H 1.337 0.02 2 65 8 8 LEU HB3 H 2.249 0.02 2 66 8 8 LEU HG H 1.957 0.02 1 67 8 8 LEU HD1 H 1.070 0.02 2 68 8 8 LEU HD2 H 1.145 0.02 2 69 8 8 LEU C C 175.700 0.20 1 70 8 8 LEU CA C 53.500 0.20 1 71 8 8 LEU CB C 43.800 0.20 1 72 8 8 LEU CG C 27.807 0.20 1 73 8 8 LEU CD1 C 25.600 0.20 2 74 8 8 LEU CD2 C 28.170 0.20 2 75 8 8 LEU N N 129.350 0.20 1 76 9 9 VAL H H 9.401 0.02 1 77 9 9 VAL HA H 5.188 0.02 1 78 9 9 VAL HB H 2.074 0.02 1 79 9 9 VAL HG1 H 0.839 0.02 1 80 9 9 VAL HG2 H 0.839 0.02 1 81 9 9 VAL C C 175.900 0.20 1 82 9 9 VAL CA C 60.702 0.20 1 83 9 9 VAL CB C 33.516 0.20 1 84 9 9 VAL CG1 C 20.090 0.20 1 85 9 9 VAL CG2 C 20.090 0.20 1 86 9 9 VAL N N 124.700 0.20 1 87 10 10 ILE H H 8.470 0.02 1 88 10 10 ILE HA H 4.910 0.02 1 89 10 10 ILE HB H 1.790 0.02 1 90 10 10 ILE HG12 H 1.260 0.02 2 91 10 10 ILE HG13 H 1.540 0.02 2 92 10 10 ILE HG2 H 0.704 0.02 1 93 10 10 ILE HD1 H 0.790 0.02 1 94 10 10 ILE C C 174.200 0.20 1 95 10 10 ILE CA C 59.600 0.20 1 96 10 10 ILE CB C 40.434 0.20 1 97 10 10 ILE CG1 C 26.200 0.20 1 98 10 10 ILE CG2 C 17.400 0.20 1 99 10 10 ILE CD1 C 14.090 0.20 1 100 10 10 ILE N N 120.000 0.20 1 101 11 11 ASP H H 10.002 0.02 1 102 11 11 ASP HA H 4.707 0.02 1 103 11 11 ASP HB2 H 3.204 0.02 2 104 11 11 ASP HB3 H 2.986 0.02 2 105 11 11 ASP C C 174.500 0.20 1 106 11 11 ASP CA C 53.171 0.20 1 107 11 11 ASP CB C 41.038 0.20 1 108 11 11 ASP N N 125.300 0.20 1 109 12 12 ASN H H 8.483 0.02 1 110 12 12 ASN HA H 5.030 0.02 1 111 12 12 ASN HB2 H 1.980 0.02 2 112 12 12 ASN HB3 H 2.940 0.02 2 113 12 12 ASN HD21 H 6.743 0.02 2 114 12 12 ASN HD22 H 7.073 0.02 2 115 12 12 ASN C C 173.000 0.20 1 116 12 12 ASN CA C 51.500 0.20 1 117 12 12 ASN CB C 37.000 0.20 1 118 12 12 ASN N N 118.700 0.20 1 119 13 13 SER H H 8.470 0.02 1 120 13 13 SER HA H 4.020 0.02 1 121 13 13 SER HB2 H 4.499 0.02 1 122 13 13 SER HB3 H 4.499 0.02 1 123 13 13 SER C C 177.500 0.20 1 124 13 13 SER CA C 58.900 0.20 1 125 13 13 SER CB C 65.125 0.20 1 126 13 13 SER N N 114.540 0.20 1 127 14 14 GLU H H 8.642 0.02 1 128 14 14 GLU HA H 3.865 0.02 1 129 14 14 GLU HB2 H 1.980 0.02 2 130 14 14 GLU HB3 H 2.036 0.02 2 131 14 14 GLU HG2 H 2.376 0.02 1 132 14 14 GLU HG3 H 2.376 0.02 1 133 14 14 GLU C C 178.800 0.20 1 134 14 14 GLU CA C 59.756 0.20 1 135 14 14 GLU CB C 29.800 0.20 1 136 14 14 GLU CG C 35.400 0.20 1 137 14 14 GLU N N 119.750 0.20 1 138 15 15 TYR H H 7.641 0.02 1 139 15 15 TYR HA H 4.096 0.02 1 140 15 15 TYR HB2 H 3.186 0.02 2 141 15 15 TYR HB3 H 3.096 0.02 2 142 15 15 TYR C C 178.200 0.20 1 143 15 15 TYR CA C 61.070 0.20 1 144 15 15 TYR CB C 39.300 0.20 1 145 15 15 TYR N N 116.960 0.20 1 146 16 16 SER H H 8.534 0.02 1 147 16 16 SER HA H 4.400 0.02 1 148 16 16 SER HB2 H 3.878 0.02 1 149 16 16 SER HB3 H 3.878 0.02 1 150 16 16 SER C C 173.400 0.20 1 151 16 16 SER CA C 61.060 0.20 1 152 16 16 SER CB C 63.450 0.20 1 153 16 16 SER N N 117.150 0.20 1 154 17 17 ARG H H 7.211 0.02 1 155 17 17 ARG HA H 4.254 0.02 1 156 17 17 ARG HB2 H 1.835 0.02 2 157 17 17 ARG HB3 H 1.950 0.02 2 158 17 17 ARG HG2 H 1.764 0.02 2 159 17 17 ARG HG3 H 1.830 0.02 2 160 17 17 ARG HD2 H 3.307 0.02 2 161 17 17 ARG HD3 H 3.192 0.02 2 162 17 17 ARG HE H 7.647 0.02 1 163 17 17 ARG C C 175.900 0.20 1 164 17 17 ARG CA C 57.600 0.20 1 165 17 17 ARG CB C 31.197 0.20 1 166 17 17 ARG CG C 28.779 0.20 1 167 17 17 ARG CD C 43.309 0.20 1 168 17 17 ARG N N 120.460 0.20 1 169 17 17 ARG NE N 85.140 0.20 1 170 18 18 ASN H H 7.165 0.02 1 171 18 18 ASN HA H 4.443 0.02 1 172 18 18 ASN HB2 H 2.895 0.02 2 173 18 18 ASN HB3 H 3.040 0.02 2 174 18 18 ASN HD21 H 7.610 0.02 2 175 18 18 ASN HD22 H 7.156 0.02 2 176 18 18 ASN C C 175.900 0.20 1 177 18 18 ASN CA C 55.022 0.20 1 178 18 18 ASN CB C 39.400 0.20 1 179 18 18 ASN N N 116.960 0.20 1 180 18 18 ASN ND2 N 113.299 0.20 1 181 19 19 GLY H H 8.760 0.02 1 182 19 19 GLY HA2 H 4.693 0.02 2 183 19 19 GLY HA3 H 3.857 0.02 2 184 19 19 GLY C C 174.000 0.20 1 185 19 19 GLY CA C 45.800 0.20 1 186 19 19 GLY N N 112.200 0.20 1 187 20 20 ASP H H 9.001 0.02 1 188 20 20 ASP HA H 4.143 0.02 1 189 20 20 ASP HB2 H 2.910 0.02 2 190 20 20 ASP HB3 H 2.675 0.02 2 191 20 20 ASP C C 175.600 0.20 1 192 20 20 ASP CA C 55.409 0.20 1 193 20 20 ASP CB C 37.900 0.20 1 194 20 20 ASP N N 121.100 0.20 1 195 21 21 PHE H H 6.921 0.02 1 196 21 21 PHE HA H 4.668 0.02 1 197 21 21 PHE HB2 H 3.035 0.02 2 198 21 21 PHE HB3 H 2.780 0.02 2 199 21 21 PHE HD1 H 7.524 0.02 3 200 21 21 PHE C C 171.900 0.20 1 201 21 21 PHE CA C 55.321 0.20 1 202 21 21 PHE CB C 40.286 0.20 1 203 21 21 PHE N N 121.700 0.20 1 204 22 22 PRO HA H 4.283 0.02 1 205 22 22 PRO HB2 H 1.818 0.02 2 206 22 22 PRO HB3 H 2.393 0.02 2 207 22 22 PRO HG2 H 2.065 0.02 2 208 22 22 PRO HG3 H 1.933 0.02 2 209 22 22 PRO HD2 H 3.750 0.02 2 210 22 22 PRO HD3 H 3.690 0.02 2 211 22 22 PRO C C 179.400 0.20 1 212 22 22 PRO CA C 59.970 0.20 1 213 22 22 PRO CB C 31.740 0.20 1 214 22 22 PRO CG C 27.503 0.20 1 215 22 22 PRO CD C 51.250 0.20 1 216 23 23 ARG H H 8.246 0.02 1 217 23 23 ARG HA H 4.100 0.02 1 218 23 23 ARG HB2 H 1.932 0.02 1 219 23 23 ARG HB3 H 1.932 0.02 1 220 23 23 ARG HG2 H 1.786 0.02 2 221 23 23 ARG HG3 H 1.893 0.02 2 222 23 23 ARG HD2 H 3.393 0.02 1 223 23 23 ARG HD3 H 3.393 0.02 1 224 23 23 ARG HE H 7.726 0.02 1 225 23 23 ARG C C 178.500 0.20 1 226 23 23 ARG CA C 62.500 0.20 1 227 23 23 ARG CB C 32.400 0.20 1 228 23 23 ARG CG C 28.160 0.20 1 229 23 23 ARG CD C 43.360 0.20 1 230 23 23 ARG N N 121.600 0.20 1 231 23 23 ARG NE N 85.300 0.20 1 232 24 24 THR H H 7.754 0.02 1 233 24 24 THR HA H 4.991 0.02 1 234 24 24 THR HB H 4.730 0.02 1 235 24 24 THR HG2 H 1.397 0.02 1 236 24 24 THR C C 175.500 0.20 1 237 24 24 THR CA C 60.350 0.20 1 238 24 24 THR CB C 74.600 0.20 1 239 24 24 THR CG2 C 23.600 0.20 1 240 24 24 THR N N 109.950 0.20 1 241 25 25 ARG H H 9.210 0.02 1 242 25 25 ARG HA H 4.365 0.02 1 243 25 25 ARG HB2 H 2.540 0.02 2 244 25 25 ARG HB3 H 2.420 0.02 2 245 25 25 ARG C C 179.500 0.20 1 246 25 25 ARG CA C 61.400 0.20 1 247 25 25 ARG CB C 31.230 0.20 1 248 25 25 ARG CG C 27.570 0.20 1 249 25 25 ARG N N 119.200 0.20 1 250 26 26 PHE H H 9.095 0.02 1 251 26 26 PHE HA H 4.430 0.02 1 252 26 26 PHE HB2 H 3.450 0.02 2 253 26 26 PHE HB3 H 2.832 0.02 2 254 26 26 PHE HD1 H 7.118 0.02 3 255 26 26 PHE C C 177.400 0.20 1 256 26 26 PHE CA C 61.990 0.20 1 257 26 26 PHE CB C 39.100 0.20 1 258 26 26 PHE N N 120.100 0.20 1 259 27 27 GLU H H 8.423 0.02 1 260 27 27 GLU HA H 3.687 0.02 1 261 27 27 GLU HB2 H 2.087 0.02 2 262 27 27 GLU HB3 H 2.547 0.02 2 263 27 27 GLU HG2 H 2.425 0.02 1 264 27 27 GLU HG3 H 2.425 0.02 1 265 27 27 GLU C C 178.400 0.20 1 266 27 27 GLU CA C 60.200 0.20 1 267 27 27 GLU CB C 29.938 0.20 1 268 27 27 GLU CG C 38.782 0.20 1 269 27 27 GLU N N 121.650 0.20 1 270 28 28 ALA H H 9.640 0.02 1 271 28 28 ALA HA H 4.585 0.02 1 272 28 28 ALA HB H 1.576 0.02 1 273 28 28 ALA C C 183.700 0.20 1 274 28 28 ALA CA C 54.700 0.20 1 275 28 28 ALA CB C 17.900 0.20 1 276 28 28 ALA N N 122.350 0.20 1 277 29 29 GLN H H 7.705 0.02 1 278 29 29 GLN HA H 3.326 0.02 1 279 29 29 GLN HB2 H 1.222 0.02 2 280 29 29 GLN HB3 H 2.210 0.02 2 281 29 29 GLN HG2 H 2.710 0.02 2 282 29 29 GLN HG3 H 1.402 0.02 2 283 29 29 GLN HE21 H 6.224 0.02 2 284 29 29 GLN HE22 H 7.488 0.02 2 285 29 29 GLN C C 177.100 0.20 1 286 29 29 GLN CA C 59.686 0.20 1 287 29 29 GLN CB C 30.000 0.20 1 288 29 29 GLN CG C 35.634 0.20 1 289 29 29 GLN N N 121.600 0.20 1 290 30 30 ILE H H 7.625 0.02 1 291 30 30 ILE HA H 3.257 0.02 1 292 30 30 ILE HB H 2.067 0.02 1 293 30 30 ILE HG12 H 0.640 0.02 2 294 30 30 ILE HG13 H 1.110 0.02 2 295 30 30 ILE HG2 H 0.845 0.02 1 296 30 30 ILE HD1 H 0.456 0.02 1 297 30 30 ILE C C 178.500 0.20 1 298 30 30 ILE CA C 66.600 0.20 1 299 30 30 ILE CB C 36.300 0.20 1 300 30 30 ILE CG1 C 28.200 0.20 1 301 30 30 ILE CG2 C 16.700 0.20 1 302 30 30 ILE CD1 C 12.600 0.20 1 303 30 30 ILE N N 123.300 0.20 1 304 31 31 ASP H H 8.189 0.02 1 305 31 31 ASP HA H 4.410 0.02 1 306 31 31 ASP HB2 H 2.860 0.02 2 307 31 31 ASP HB3 H 2.660 0.02 2 308 31 31 ASP C C 179.600 0.20 1 309 31 31 ASP CA C 57.400 0.20 1 310 31 31 ASP CB C 40.678 0.20 1 311 31 31 ASP N N 119.300 0.20 1 312 32 32 SER H H 7.533 0.02 1 313 32 32 SER HA H 4.470 0.02 1 314 32 32 SER HB2 H 3.846 0.02 1 315 32 32 SER HB3 H 3.846 0.02 1 316 32 32 SER C C 175.200 0.20 1 317 32 32 SER CA C 63.100 0.20 1 318 32 32 SER CB C 64.108 0.20 1 319 32 32 SER N N 115.850 0.20 1 320 33 33 VAL H H 9.007 0.02 1 321 33 33 VAL HA H 3.612 0.02 1 322 33 33 VAL HB H 2.457 0.02 1 323 33 33 VAL HG1 H 0.993 0.02 2 324 33 33 VAL HG2 H 0.982 0.02 2 325 33 33 VAL C C 177.000 0.20 1 326 33 33 VAL CA C 67.500 0.20 1 327 33 33 VAL CB C 30.798 0.20 1 328 33 33 VAL CG1 C 23.700 0.20 2 329 33 33 VAL CG2 C 21.900 0.20 2 330 33 33 VAL N N 125.650 0.20 1 331 34 34 GLU H H 7.852 0.02 1 332 34 34 GLU HA H 3.661 0.02 1 333 34 34 GLU HB2 H 2.030 0.02 1 334 34 34 GLU HB3 H 2.030 0.02 1 335 34 34 GLU HG2 H 1.650 0.02 2 336 34 34 GLU HG3 H 1.790 0.02 2 337 34 34 GLU C C 177.400 0.20 1 338 34 34 GLU CA C 60.300 0.20 1 339 34 34 GLU CB C 29.000 0.20 1 340 34 34 GLU CG C 35.220 0.20 1 341 34 34 GLU N N 120.100 0.20 1 342 35 35 PHE H H 7.400 0.02 1 343 35 35 PHE HA H 4.040 0.02 1 344 35 35 PHE HB2 H 3.160 0.02 2 345 35 35 PHE HB3 H 3.040 0.02 2 346 35 35 PHE HD1 H 7.130 0.02 3 347 35 35 PHE C C 178.100 0.20 1 348 35 35 PHE CA C 62.200 0.20 1 349 35 35 PHE CB C 39.700 0.20 1 350 35 35 PHE N N 118.400 0.20 1 351 36 36 ILE H H 9.080 0.02 1 352 36 36 ILE HA H 3.483 0.02 1 353 36 36 ILE HB H 1.920 0.02 1 354 36 36 ILE HG12 H 0.910 0.02 2 355 36 36 ILE HG13 H 2.283 0.02 2 356 36 36 ILE HG2 H 0.910 0.02 1 357 36 36 ILE HD1 H 0.956 0.02 1 358 36 36 ILE C C 176.800 0.20 1 359 36 36 ILE CA C 65.800 0.20 1 360 36 36 ILE CB C 38.591 0.20 1 361 36 36 ILE CG1 C 30.100 0.20 1 362 36 36 ILE CG2 C 17.400 0.20 1 363 36 36 ILE CD1 C 14.900 0.20 1 364 36 36 ILE N N 120.270 0.20 1 365 37 37 PHE H H 9.000 0.02 1 366 37 37 PHE HA H 3.880 0.02 1 367 37 37 PHE HB2 H 3.070 0.02 2 368 37 37 PHE HB3 H 3.350 0.02 2 369 37 37 PHE HD1 H 7.007 0.02 3 370 37 37 PHE C C 176.300 0.20 1 371 37 37 PHE CA C 63.000 0.20 1 372 37 37 PHE CB C 40.000 0.20 1 373 37 37 PHE N N 120.356 0.20 1 374 38 38 GLN H H 7.896 0.02 1 375 38 38 GLN HA H 3.863 0.02 1 376 38 38 GLN HB2 H 1.980 0.02 2 377 38 38 GLN HB3 H 2.040 0.02 2 378 38 38 GLN HG2 H 2.366 0.02 2 379 38 38 GLN HG3 H 2.475 0.02 2 380 38 38 GLN HE21 H 7.033 0.02 2 381 38 38 GLN HE22 H 6.740 0.02 2 382 38 38 GLN C C 178.100 0.20 1 383 38 38 GLN CA C 58.500 0.20 1 384 38 38 GLN CB C 27.800 0.20 1 385 38 38 GLN CG C 33.400 0.20 1 386 38 38 GLN N N 116.550 0.20 1 387 38 38 GLN NE2 N 111.776 0.20 1 388 39 39 ALA H H 7.989 0.02 1 389 39 39 ALA HA H 3.992 0.02 1 390 39 39 ALA HB H 1.330 0.02 1 391 39 39 ALA C C 181.600 0.20 1 392 39 39 ALA CA C 55.200 0.20 1 393 39 39 ALA CB C 18.200 0.20 1 394 39 39 ALA N N 122.871 0.20 1 395 40 40 LYS H H 8.527 0.02 1 396 40 40 LYS HA H 4.090 0.02 1 397 40 40 LYS HB2 H 1.790 0.02 2 398 40 40 LYS HB3 H 1.880 0.02 2 399 40 40 LYS C C 180.200 0.20 1 400 40 40 LYS CA C 57.500 0.20 1 401 40 40 LYS CB C 30.800 0.20 1 402 40 40 LYS N N 118.200 0.20 1 403 41 41 ARG H H 7.994 0.02 1 404 41 41 ARG HA H 3.984 0.02 1 405 41 41 ARG HB2 H 1.662 0.02 1 406 41 41 ARG HB3 H 1.662 0.02 1 407 41 41 ARG HG2 H 1.105 0.02 2 408 41 41 ARG HG3 H 1.247 0.02 2 409 41 41 ARG HD2 H 2.822 0.02 2 410 41 41 ARG HD3 H 3.063 0.02 2 411 41 41 ARG HE H 7.264 0.02 1 412 41 41 ARG C C 177.900 0.20 1 413 41 41 ARG CA C 57.130 0.20 1 414 41 41 ARG CB C 27.570 0.20 1 415 41 41 ARG CG C 26.608 0.20 1 416 41 41 ARG CD C 41.190 0.20 1 417 41 41 ARG N N 119.600 0.20 1 418 41 41 ARG NE N 85.060 0.20 1 419 42 42 ASN H H 8.085 0.02 1 420 42 42 ASN HA H 4.427 0.02 1 421 42 42 ASN HB2 H 2.754 0.02 2 422 42 42 ASN HB3 H 2.809 0.02 2 423 42 42 ASN HD21 H 6.900 0.02 1 424 42 42 ASN HD22 H 6.900 0.02 1 425 42 42 ASN C C 177.000 0.20 1 426 42 42 ASN CA C 54.700 0.20 1 427 42 42 ASN CB C 38.669 0.20 1 428 42 42 ASN N N 116.100 0.20 1 429 43 43 SER H H 7.583 0.02 1 430 43 43 SER HA H 4.236 0.02 1 431 43 43 SER HB2 H 3.899 0.02 2 432 43 43 SER HB3 H 4.025 0.02 2 433 43 43 SER C C 175.600 0.20 1 434 43 43 SER CA C 60.697 0.20 1 435 43 43 SER CB C 63.485 0.20 1 436 43 43 SER N N 115.100 0.20 1 437 44 44 ASN H H 7.082 0.02 1 438 44 44 ASN HA H 4.803 0.02 1 439 44 44 ASN HB2 H 2.706 0.02 2 440 44 44 ASN HB3 H 2.830 0.02 2 441 44 44 ASN C C 173.300 0.20 1 442 44 44 ASN CA C 52.400 0.20 1 443 44 44 ASN CB C 41.232 0.20 1 444 44 44 ASN N N 116.887 0.20 1 445 45 45 PRO HA H 4.618 0.02 1 446 45 45 PRO HB2 H 2.150 0.02 2 447 45 45 PRO HB3 H 2.454 0.02 2 448 45 45 PRO HG2 H 1.989 0.02 2 449 45 45 PRO HG3 H 2.098 0.02 2 450 45 45 PRO HD2 H 3.694 0.02 2 451 45 45 PRO HD3 H 3.747 0.02 2 452 45 45 PRO C C 177.900 0.20 1 453 45 45 PRO CA C 64.500 0.20 1 454 45 45 PRO CB C 32.200 0.20 1 455 45 45 PRO CG C 27.046 0.20 1 456 45 45 PRO CD C 51.230 0.20 1 457 46 46 GLU H H 8.731 0.02 1 458 46 46 GLU HA H 4.450 0.02 1 459 46 46 GLU HB2 H 1.742 0.02 2 460 46 46 GLU HB3 H 2.214 0.02 2 461 46 46 GLU HG2 H 2.291 0.02 2 462 46 46 GLU HG3 H 2.142 0.02 2 463 46 46 GLU C C 176.200 0.20 1 464 46 46 GLU CA C 56.000 0.20 1 465 46 46 GLU CB C 30.213 0.20 1 466 46 46 GLU CG C 37.276 0.20 1 467 46 46 GLU N N 119.000 0.20 1 468 47 47 ASN H H 8.119 0.02 1 469 47 47 ASN HA H 4.832 0.02 1 470 47 47 ASN HB2 H 2.900 0.02 2 471 47 47 ASN HB3 H 3.112 0.02 2 472 47 47 ASN C C 175.900 0.20 1 473 47 47 ASN CA C 54.365 0.20 1 474 47 47 ASN CB C 37.282 0.20 1 475 47 47 ASN N N 123.100 0.20 1 476 48 48 THR H H 7.295 0.02 1 477 48 48 THR HA H 4.790 0.02 1 478 48 48 THR HB H 4.190 0.02 1 479 48 48 THR HG2 H 1.143 0.02 1 480 48 48 THR C C 174.800 0.20 1 481 48 48 THR CA C 59.406 0.20 1 482 48 48 THR CB C 72.510 0.20 1 483 48 48 THR CG2 C 22.713 0.20 1 484 48 48 THR N N 109.100 0.20 1 485 49 49 VAL H H 8.890 0.02 1 486 49 49 VAL HA H 5.880 0.02 1 487 49 49 VAL HB H 2.254 0.02 1 488 49 49 VAL HG1 H 0.868 0.02 2 489 49 49 VAL HG2 H 1.300 0.02 2 490 49 49 VAL C C 174.900 0.20 1 491 49 49 VAL CA C 61.121 0.20 1 492 49 49 VAL CB C 36.635 0.20 1 493 49 49 VAL CG1 C 21.773 0.20 2 494 49 49 VAL CG2 C 22.470 0.20 2 495 49 49 VAL N N 122.200 0.20 1 496 50 50 GLY H H 9.407 0.02 1 497 50 50 GLY HA2 H 2.960 0.02 2 498 50 50 GLY HA3 H 4.550 0.02 2 499 50 50 GLY C C 172.500 0.20 1 500 50 50 GLY CA C 42.610 0.20 1 501 50 50 GLY N N 114.700 0.20 1 502 51 51 LEU H H 8.770 0.02 1 503 51 51 LEU HA H 5.613 0.02 1 504 51 51 LEU HB2 H 1.312 0.02 2 505 51 51 LEU HB3 H 1.624 0.02 2 506 51 51 LEU HG H 0.820 0.02 1 507 51 51 LEU HD1 H 0.979 0.02 1 508 51 51 LEU HD2 H 0.979 0.02 1 509 51 51 LEU C C 174.100 0.20 1 510 51 51 LEU CA C 54.900 0.20 1 511 51 51 LEU CB C 47.990 0.20 1 512 51 51 LEU CG C 27.757 0.20 1 513 51 51 LEU CD1 C 24.000 0.20 1 514 51 51 LEU CD2 C 24.000 0.20 1 515 51 51 LEU N N 120.876 0.20 1 516 52 52 ILE H H 9.690 0.02 1 517 52 52 ILE HA H 5.155 0.02 1 518 52 52 ILE HB H 1.717 0.02 1 519 52 52 ILE HG12 H 1.536 0.02 2 520 52 52 ILE HG13 H 1.084 0.02 2 521 52 52 ILE HG2 H 0.800 0.02 1 522 52 52 ILE HD1 H 0.793 0.02 1 523 52 52 ILE C C 174.600 0.20 1 524 52 52 ILE CA C 59.400 0.20 1 525 52 52 ILE CB C 44.097 0.20 1 526 52 52 ILE CG1 C 28.775 0.20 1 527 52 52 ILE CG2 C 16.300 0.20 1 528 52 52 ILE CD1 C 14.942 0.20 1 529 52 52 ILE N N 130.070 0.20 1 530 53 53 SER H H 9.267 0.02 1 531 53 53 SER HA H 4.729 0.02 1 532 53 53 SER HB2 H 3.768 0.02 2 533 53 53 SER HB3 H 4.215 0.02 2 534 53 53 SER C C 174.600 0.20 1 535 53 53 SER CA C 56.300 0.20 1 536 53 53 SER CB C 63.710 0.20 1 537 53 53 SER N N 120.700 0.20 1 538 54 54 GLY H H 9.195 0.02 1 539 54 54 GLY HA2 H 3.370 0.02 2 540 54 54 GLY HA3 H 4.183 0.02 2 541 54 54 GLY C C 172.600 0.20 1 542 54 54 GLY CA C 45.900 0.20 1 543 54 54 GLY N N 109.900 0.20 1 544 55 55 ALA H H 8.796 0.02 1 545 55 55 ALA HA H 5.370 0.02 1 546 55 55 ALA HB H 1.051 0.02 1 547 55 55 ALA C C 176.900 0.20 1 548 55 55 ALA CA C 49.900 0.20 1 549 55 55 ALA CB C 20.200 0.20 1 550 55 55 ALA N N 125.733 0.20 1 551 56 56 GLY H H 7.992 0.02 1 552 56 56 GLY HA2 H 3.517 0.02 2 553 56 56 GLY HA3 H 4.165 0.02 2 554 56 56 GLY C C 174.200 0.20 1 555 56 56 GLY CA C 45.300 0.20 1 556 56 56 GLY N N 108.200 0.20 1 557 57 57 ALA H H 8.990 0.02 1 558 57 57 ALA HA H 4.261 0.02 1 559 57 57 ALA HB H 1.452 0.02 1 560 57 57 ALA C C 178.100 0.20 1 561 57 57 ALA CA C 54.564 0.20 1 562 57 57 ALA CB C 18.766 0.20 1 563 57 57 ALA N N 126.700 0.20 1 564 58 58 ASN H H 7.781 0.02 1 565 58 58 ASN HA H 4.573 0.02 1 566 58 58 ASN HB2 H 2.518 0.02 2 567 58 58 ASN HB3 H 2.620 0.02 2 568 58 58 ASN HD21 H 7.477 0.02 2 569 58 58 ASN HD22 H 6.840 0.02 2 570 58 58 ASN C C 171.200 0.20 1 571 58 58 ASN CA C 51.100 0.20 1 572 58 58 ASN CB C 40.900 0.20 1 573 58 58 ASN N N 112.600 0.20 1 574 58 58 ASN ND2 N 114.200 0.20 1 575 59 59 PRO HA H 4.873 0.02 1 576 59 59 PRO HB2 H 1.731 0.02 2 577 59 59 PRO HB3 H 2.507 0.02 2 578 59 59 PRO HG2 H 2.106 0.02 2 579 59 59 PRO HG3 H 1.891 0.02 2 580 59 59 PRO HD2 H 3.645 0.02 2 581 59 59 PRO HD3 H 3.440 0.02 2 582 59 59 PRO C C 175.400 0.20 1 583 59 59 PRO CA C 63.900 0.20 1 584 59 59 PRO CB C 32.474 0.20 1 585 59 59 PRO CG C 28.250 0.20 1 586 59 59 PRO CD C 50.519 0.20 1 587 60 60 ARG H H 8.170 0.02 1 588 60 60 ARG HA H 4.720 0.02 1 589 60 60 ARG HB2 H 1.740 0.02 2 590 60 60 ARG HB3 H 1.811 0.02 2 591 60 60 ARG HG2 H 1.514 0.02 2 592 60 60 ARG HG3 H 1.597 0.02 2 593 60 60 ARG HD2 H 3.166 0.02 2 594 60 60 ARG HD3 H 3.248 0.02 2 595 60 60 ARG HE H 7.190 0.02 1 596 60 60 ARG C C 174.700 0.20 1 597 60 60 ARG CA C 54.582 0.20 1 598 60 60 ARG CB C 34.031 0.20 1 599 60 60 ARG CG C 26.819 0.20 1 600 60 60 ARG CD C 43.900 0.20 1 601 60 60 ARG NE N 85.700 0.20 1 602 60 60 ARG N N 120.009 0.20 1 603 61 61 VAL H H 8.888 0.02 1 604 61 61 VAL HA H 4.015 0.02 1 605 61 61 VAL HB H 2.027 0.02 1 606 61 61 VAL HG1 H 0.842 0.02 2 607 61 61 VAL HG2 H 0.694 0.02 2 608 61 61 VAL C C 175.700 0.20 1 609 61 61 VAL CA C 63.487 0.20 1 610 61 61 VAL CB C 30.907 0.20 1 611 61 61 VAL CG1 C 21.124 0.20 2 612 61 61 VAL CG2 C 20.781 0.20 2 613 61 61 VAL N N 123.700 0.20 1 614 62 62 LEU H H 8.880 0.02 1 615 62 62 LEU HA H 4.393 0.02 1 616 62 62 LEU HB2 H 1.394 0.02 2 617 62 62 LEU HB3 H 1.308 0.02 2 618 62 62 LEU HG H 1.724 0.02 1 619 62 62 LEU HD1 H 0.854 0.02 2 620 62 62 LEU HD2 H 0.791 0.02 2 621 62 62 LEU C C 178.200 0.20 1 622 62 62 LEU CA C 55.364 0.20 1 623 62 62 LEU CB C 42.820 0.20 1 624 62 62 LEU CG C 27.030 0.20 1 625 62 62 LEU CD1 C 22.000 0.20 2 626 62 62 LEU CD2 C 25.801 0.20 2 627 62 62 LEU N N 131.800 0.20 1 628 63 63 SER H H 7.827 0.02 1 629 63 63 SER HA H 4.650 0.02 1 630 63 63 SER HB2 H 3.490 0.02 2 631 63 63 SER HB3 H 3.597 0.02 2 632 63 63 SER C C 174.900 0.20 1 633 63 63 SER CA C 58.354 0.20 1 634 63 63 SER CB C 65.712 0.20 1 635 63 63 SER N N 110.800 0.20 1 636 64 64 THR H H 8.200 0.02 1 637 64 64 THR HA H 3.993 0.02 1 638 64 64 THR HB H 4.375 0.02 1 639 64 64 THR HG2 H 1.259 0.02 1 640 64 64 THR C C 172.900 0.20 1 641 64 64 THR CA C 61.400 0.20 1 642 64 64 THR CB C 68.320 0.20 1 643 64 64 THR CG2 C 21.000 0.20 1 644 64 64 THR N N 119.750 0.20 1 645 65 65 PHE H H 7.098 0.02 1 646 65 65 PHE HA H 3.974 0.02 1 647 65 65 PHE HB2 H 2.948 0.02 2 648 65 65 PHE HB3 H 3.220 0.02 2 649 65 65 PHE C C 176.700 0.20 1 650 65 65 PHE CA C 61.077 0.20 1 651 65 65 PHE CB C 38.866 0.20 1 652 65 65 PHE N N 115.760 0.20 1 653 66 66 THR H H 9.103 0.02 1 654 66 66 THR HA H 4.920 0.02 1 655 66 66 THR HB H 4.154 0.02 1 656 66 66 THR HG2 H 1.451 0.02 1 657 66 66 THR C C 171.500 0.20 1 658 66 66 THR CA C 60.607 0.20 1 659 66 66 THR CB C 70.312 0.20 1 660 66 66 THR CG2 C 19.101 0.20 1 661 66 66 THR N N 120.000 0.20 1 662 67 67 ALA H H 8.687 0.02 1 663 67 67 ALA HA H 4.879 0.02 1 664 67 67 ALA HB H 1.569 0.02 1 665 67 67 ALA C C 176.600 0.20 1 666 67 67 ALA CA C 51.400 0.20 1 667 67 67 ALA CB C 19.700 0.20 1 668 67 67 ALA N N 128.000 0.20 1 669 68 68 GLU H H 9.205 0.02 1 670 68 68 GLU HA H 4.741 0.02 1 671 68 68 GLU HB2 H 2.130 0.02 2 672 68 68 GLU HB3 H 2.185 0.02 2 673 68 68 GLU HG2 H 2.330 0.02 2 674 68 68 GLU HG3 H 2.295 0.02 2 675 68 68 GLU C C 175.900 0.20 1 676 68 68 GLU CA C 55.000 0.20 1 677 68 68 GLU CB C 30.910 0.20 1 678 68 68 GLU CG C 36.140 0.20 1 679 68 68 GLU N N 124.085 0.20 1 680 69 69 PHE H H 9.440 0.02 1 681 69 69 PHE HA H 3.281 0.02 1 682 69 69 PHE HB2 H 2.716 0.02 2 683 69 69 PHE HB3 H 2.919 0.02 2 684 69 69 PHE HD1 H 6.415 0.02 3 685 69 69 PHE C C 177.100 0.20 1 686 69 69 PHE CA C 60.872 0.20 1 687 69 69 PHE CB C 38.172 0.20 1 688 69 69 PHE N N 128.680 0.20 1 689 70 70 GLY H H 9.217 0.02 1 690 70 70 GLY HA2 H 3.527 0.02 2 691 70 70 GLY HA3 H 3.954 0.02 2 692 70 70 GLY C C 176.900 0.20 1 693 70 70 GLY CA C 47.100 0.20 1 694 70 70 GLY N N 105.100 0.20 1 695 71 71 LYS H H 7.356 0.02 1 696 71 71 LYS HA H 4.128 0.02 1 697 71 71 LYS HB2 H 2.134 0.02 2 698 71 71 LYS HB3 H 2.020 0.02 2 699 71 71 LYS HG2 H 1.563 0.02 1 700 71 71 LYS HG3 H 1.563 0.02 1 701 71 71 LYS HD2 H 1.709 0.02 2 702 71 71 LYS HD3 H 1.742 0.02 2 703 71 71 LYS HE2 H 3.026 0.02 1 704 71 71 LYS HE3 H 3.026 0.02 1 705 71 71 LYS C C 179.500 0.20 1 706 71 71 LYS CA C 58.800 0.20 1 707 71 71 LYS CB C 32.540 0.20 1 708 71 71 LYS CG C 24.850 0.20 1 709 71 71 LYS CD C 29.350 0.20 1 710 71 71 LYS CE C 42.318 0.20 1 711 71 71 LYS N N 121.050 0.20 1 712 72 72 ILE H H 6.831 0.02 1 713 72 72 ILE HA H 3.575 0.02 1 714 72 72 ILE HB H 1.657 0.02 1 715 72 72 ILE HG12 H 1.149 0.02 2 716 72 72 ILE HG13 H 1.262 0.02 2 717 72 72 ILE HG2 H 0.541 0.02 1 718 72 72 ILE HD1 H 0.679 0.02 1 719 72 72 ILE C C 177.500 0.20 1 720 72 72 ILE CA C 61.900 0.20 1 721 72 72 ILE CB C 34.853 0.20 1 722 72 72 ILE CG1 C 27.554 0.20 1 723 72 72 ILE CG2 C 17.666 0.20 1 724 72 72 ILE CD1 C 9.220 0.20 1 725 72 72 ILE N N 122.500 0.20 1 726 73 73 LEU H H 7.869 0.02 1 727 73 73 LEU HA H 3.503 0.02 1 728 73 73 LEU HB2 H 1.050 0.02 2 729 73 73 LEU HB3 H 1.237 0.02 2 730 73 73 LEU HG H 0.861 0.02 1 731 73 73 LEU HD1 H 0.711 0.02 1 732 73 73 LEU HD2 H 0.711 0.02 1 733 73 73 LEU C C 178.700 0.20 1 734 73 73 LEU CA C 57.600 0.20 1 735 73 73 LEU CB C 41.300 0.20 1 736 73 73 LEU CG C 26.000 0.20 1 737 73 73 LEU CD1 C 23.869 0.20 1 738 73 73 LEU CD2 C 23.869 0.20 1 739 73 73 LEU N N 120.443 0.20 1 740 74 74 ALA H H 7.683 0.02 1 741 74 74 ALA HA H 4.014 0.02 1 742 74 74 ALA HB H 1.431 0.02 1 743 74 74 ALA C C 180.500 0.20 1 744 74 74 ALA CA C 55.000 0.20 1 745 74 74 ALA CB C 17.797 0.20 1 746 74 74 ALA N N 120.200 0.20 1 747 75 75 GLY H H 7.379 0.02 1 748 75 75 GLY HA2 H 3.382 0.02 2 749 75 75 GLY HA3 H 3.945 0.02 2 750 75 75 GLY C C 175.600 0.20 1 751 75 75 GLY CA C 47.500 0.20 1 752 75 75 GLY N N 106.047 0.20 1 753 76 76 LEU H H 8.101 0.02 1 754 76 76 LEU HA H 3.964 0.02 1 755 76 76 LEU HB2 H 1.248 0.02 2 756 76 76 LEU HB3 H 1.903 0.02 2 757 76 76 LEU HG H 0.790 0.02 1 758 76 76 LEU C C 179.500 0.20 1 759 76 76 LEU CA C 57.576 0.20 1 760 76 76 LEU CB C 41.600 0.20 1 761 76 76 LEU CG C 25.800 0.20 1 762 76 76 LEU N N 122.524 0.20 1 763 77 77 HIS H H 8.171 0.02 1 764 77 77 HIS HA H 4.578 0.02 1 765 77 77 HIS HB2 H 3.239 0.02 2 766 77 77 HIS HB3 H 3.370 0.02 2 767 77 77 HIS C C 175.600 0.20 1 768 77 77 HIS CA C 57.330 0.20 1 769 77 77 HIS CB C 28.975 0.20 1 770 77 77 HIS N N 117.060 0.20 1 771 78 78 ASP H H 7.645 0.02 1 772 78 78 ASP HA H 4.871 0.02 1 773 78 78 ASP HB2 H 2.705 0.02 2 774 78 78 ASP HB3 H 2.864 0.02 2 775 78 78 ASP C C 175.600 0.20 1 776 78 78 ASP CA C 54.100 0.20 1 777 78 78 ASP CB C 42.023 0.20 1 778 78 78 ASP N N 119.600 0.20 1 779 79 79 THR H H 7.309 0.02 1 780 79 79 THR HA H 4.279 0.02 1 781 79 79 THR HB H 4.250 0.02 1 782 79 79 THR HG2 H 1.216 0.02 1 783 79 79 THR C C 172.800 0.20 1 784 79 79 THR CA C 63.274 0.20 1 785 79 79 THR CB C 69.579 0.20 1 786 79 79 THR CG2 C 21.285 0.20 1 787 79 79 THR N N 116.700 0.20 1 788 80 80 GLN H H 8.495 0.02 1 789 80 80 GLN HA H 4.474 0.02 1 790 80 80 GLN HB2 H 1.818 0.02 2 791 80 80 GLN HB3 H 2.001 0.02 2 792 80 80 GLN HG2 H 2.233 0.02 2 793 80 80 GLN HG3 H 2.286 0.02 2 794 80 80 GLN HE21 H 7.453 0.02 2 795 80 80 GLN HE22 H 6.783 0.02 2 796 80 80 GLN C C 174.600 0.20 1 797 80 80 GLN CA C 53.600 0.20 1 798 80 80 GLN CB C 31.000 0.20 1 799 80 80 GLN CG C 33.364 0.20 1 800 80 80 GLN N N 124.400 0.20 1 801 80 80 GLN NE2 N 113.633 0.20 1 802 81 81 ILE H H 8.176 0.02 1 803 81 81 ILE HA H 4.204 0.02 1 804 81 81 ILE HB H 1.338 0.02 1 805 81 81 ILE HG12 H 0.100 0.02 2 806 81 81 ILE HG13 H 0.654 0.02 2 807 81 81 ILE HG2 H 0.488 0.02 1 808 81 81 ILE HD1 H 0.425 0.02 1 809 81 81 ILE C C 176.400 0.20 1 810 81 81 ILE CA C 61.400 0.20 1 811 81 81 ILE CB C 37.700 0.20 1 812 81 81 ILE CG1 C 26.714 0.20 1 813 81 81 ILE CG2 C 17.740 0.20 1 814 81 81 ILE CD1 C 13.496 0.20 1 815 81 81 ILE N N 124.950 0.20 1 816 82 82 GLU H H 8.760 0.02 1 817 82 82 GLU HA H 4.486 0.02 1 818 82 82 GLU HB2 H 1.873 0.02 2 819 82 82 GLU HB3 H 2.259 0.02 2 820 82 82 GLU HG2 H 2.070 0.02 1 821 82 82 GLU HG3 H 2.070 0.02 1 822 82 82 GLU C C 175.700 0.20 1 823 82 82 GLU CA C 55.700 0.20 1 824 82 82 GLU CB C 31.180 0.20 1 825 82 82 GLU CG C 34.348 0.20 1 826 82 82 GLU N N 125.700 0.20 1 827 83 83 GLY H H 8.838 0.02 1 828 83 83 GLY HA2 H 3.805 0.02 2 829 83 83 GLY HA3 H 3.920 0.02 2 830 83 83 GLY C C 173.300 0.20 1 831 83 83 GLY CA C 46.200 0.20 1 832 83 83 GLY N N 108.400 0.20 1 833 84 84 LYS H H 8.021 0.02 1 834 84 84 LYS HA H 4.805 0.02 1 835 84 84 LYS HB2 H 1.559 0.02 2 836 84 84 LYS HB3 H 1.789 0.02 2 837 84 84 LYS HG2 H 1.447 0.02 2 838 84 84 LYS HG3 H 1.262 0.02 2 839 84 84 LYS HD2 H 1.709 0.02 1 840 84 84 LYS HD3 H 1.709 0.02 1 841 84 84 LYS HE2 H 3.029 0.02 1 842 84 84 LYS HE3 H 3.029 0.02 1 843 84 84 LYS C C 174.100 0.20 1 844 84 84 LYS CA C 53.900 0.20 1 845 84 84 LYS CB C 35.676 0.20 1 846 84 84 LYS CG C 24.591 0.20 1 847 84 84 LYS CD C 29.224 0.20 1 848 84 84 LYS CE C 42.242 0.20 1 849 84 84 LYS N N 120.530 0.20 1 850 85 85 LEU H H 8.980 0.02 1 851 85 85 LEU HA H 3.697 0.02 1 852 85 85 LEU HB2 H 1.510 0.02 2 853 85 85 LEU HB3 H 1.649 0.02 2 854 85 85 LEU HG H 0.988 0.02 1 855 85 85 LEU HD1 H 0.812 0.02 1 856 85 85 LEU HD2 H 0.812 0.02 1 857 85 85 LEU C C 176.600 0.20 1 858 85 85 LEU CA C 55.700 0.20 1 859 85 85 LEU CB C 42.700 0.20 1 860 85 85 LEU CG C 26.863 0.20 1 861 85 85 LEU CD1 C 21.234 0.20 1 862 85 85 LEU CD2 C 21.234 0.20 1 863 85 85 LEU N N 121.300 0.20 1 864 86 86 HIS H H 8.700 0.02 1 865 86 86 HIS HA H 5.107 0.02 1 866 86 86 HIS HB2 H 3.325 0.02 2 867 86 86 HIS HB3 H 3.371 0.02 2 868 86 86 HIS C C 174.200 0.20 1 869 86 86 HIS CA C 53.100 0.20 1 870 86 86 HIS CB C 27.042 0.20 1 871 86 86 HIS N N 130.000 0.20 1 872 87 87 MET H H 7.966 0.02 1 873 87 87 MET HA H 3.769 0.02 1 874 87 87 MET HB2 H 1.779 0.02 2 875 87 87 MET HB3 H 2.270 0.02 2 876 87 87 MET HG2 H 2.269 0.02 2 877 87 87 MET HG3 H 2.089 0.02 2 878 87 87 MET C C 176.900 0.20 1 879 87 87 MET CA C 60.913 0.20 1 880 87 87 MET CB C 32.954 0.20 1 881 87 87 MET CG C 33.045 0.20 1 882 87 87 MET N N 121.800 0.20 1 883 88 88 ALA H H 8.806 0.02 1 884 88 88 ALA HA H 3.828 0.02 1 885 88 88 ALA HB H 1.333 0.02 1 886 88 88 ALA C C 179.900 0.20 1 887 88 88 ALA CA C 55.700 0.20 1 888 88 88 ALA CB C 17.200 0.20 1 889 88 88 ALA N N 121.050 0.20 1 890 89 89 THR H H 8.797 0.02 1 891 89 89 THR HA H 3.984 0.02 1 892 89 89 THR HB H 3.971 0.02 1 893 89 89 THR HG2 H 1.274 0.02 1 894 89 89 THR C C 176.500 0.20 1 895 89 89 THR CA C 66.700 0.20 1 896 89 89 THR CB C 68.643 0.20 1 897 89 89 THR CG2 C 22.578 0.20 1 898 89 89 THR N N 115.847 0.20 1 899 90 90 ALA H H 8.970 0.02 1 900 90 90 ALA HA H 3.909 0.02 1 901 90 90 ALA HB H 1.565 0.02 1 902 90 90 ALA C C 179.500 0.20 1 903 90 90 ALA CA C 55.919 0.20 1 904 90 90 ALA CB C 18.300 0.20 1 905 90 90 ALA N N 123.900 0.20 1 906 91 91 LEU H H 8.520 0.02 1 907 91 91 LEU HA H 4.070 0.02 1 908 91 91 LEU HB2 H 1.377 0.02 2 909 91 91 LEU HB3 H 2.193 0.02 2 910 91 91 LEU HG H 2.030 0.02 1 911 91 91 LEU HD1 H 0.723 0.02 2 912 91 91 LEU HD2 H 0.772 0.02 2 913 91 91 LEU C C 179.100 0.20 1 914 91 91 LEU CA C 58.311 0.20 1 915 91 91 LEU CB C 41.751 0.20 1 916 91 91 LEU CG C 28.106 0.20 1 917 91 91 LEU CD1 C 25.896 0.20 2 918 91 91 LEU CD2 C 23.328 0.20 2 919 91 91 LEU N N 117.668 0.20 1 920 92 92 GLN H H 8.230 0.02 1 921 92 92 GLN HA H 4.201 0.02 1 922 92 92 GLN HB2 H 2.238 0.02 2 923 92 92 GLN HB3 H 2.419 0.02 2 924 92 92 GLN HG2 H 2.405 0.02 2 925 92 92 GLN HG3 H 2.626 0.02 2 926 92 92 GLN HE21 H 7.136 0.02 2 927 92 92 GLN HE22 H 6.873 0.02 2 928 92 92 GLN C C 179.700 0.20 1 929 92 92 GLN CA C 59.653 0.20 1 930 92 92 GLN CB C 28.500 0.20 1 931 92 92 GLN CG C 34.663 0.20 1 932 92 92 GLN N N 120.900 0.20 1 933 92 92 GLN NE2 N 111.410 0.20 1 934 93 93 ILE H H 8.536 0.02 1 935 93 93 ILE HA H 3.871 0.02 1 936 93 93 ILE HB H 1.884 0.02 1 937 93 93 ILE HG12 H 1.246 0.02 2 938 93 93 ILE HG13 H 1.793 0.02 2 939 93 93 ILE HG2 H 0.859 0.02 1 940 93 93 ILE HD1 H 0.783 0.02 1 941 93 93 ILE C C 180.000 0.20 1 942 93 93 ILE CA C 64.851 0.20 1 943 93 93 ILE CB C 37.693 0.20 1 944 93 93 ILE CG1 C 28.805 0.20 1 945 93 93 ILE CG2 C 17.385 0.20 1 946 93 93 ILE CD1 C 13.760 0.20 1 947 93 93 ILE N N 122.000 0.20 1 948 94 94 ALA H H 8.877 0.02 1 949 94 94 ALA HA H 3.870 0.02 1 950 94 94 ALA HB H 1.527 0.02 1 951 94 94 ALA C C 178.600 0.20 1 952 94 94 ALA CA C 55.970 0.20 1 953 94 94 ALA CB C 17.740 0.20 1 954 94 94 ALA N N 127.120 0.20 1 955 95 95 GLN H H 8.640 0.02 1 956 95 95 GLN HA H 3.925 0.02 1 957 95 95 GLN HB2 H 2.101 0.02 2 958 95 95 GLN HB3 H 2.444 0.02 2 959 95 95 GLN HG2 H 2.317 0.02 1 960 95 95 GLN HG3 H 2.317 0.02 1 961 95 95 GLN HE21 H 7.362 0.02 2 962 95 95 GLN HE22 H 6.020 0.02 2 963 95 95 GLN CA C 60.200 0.20 1 964 95 95 GLN CB C 27.800 0.20 1 965 95 95 GLN CG C 34.148 0.20 1 966 95 95 GLN N N 119.749 0.20 1 967 95 95 GLN NE2 N 106.600 0.20 1 968 96 96 LEU H H 8.020 0.02 1 969 96 96 LEU HA H 4.064 0.02 1 970 96 96 LEU HB2 H 1.833 0.02 1 971 96 96 LEU HB3 H 1.833 0.02 1 972 96 96 LEU HG H 1.770 0.02 1 973 96 96 LEU HD1 H 0.940 0.02 2 974 96 96 LEU HD2 H 0.989 0.02 2 975 96 96 LEU C C 178.600 0.20 1 976 96 96 LEU CA C 58.300 0.20 1 977 96 96 LEU CB C 41.909 0.20 1 978 96 96 LEU CG C 26.947 0.20 1 979 96 96 LEU CD1 C 24.219 0.20 2 980 96 96 LEU CD2 C 24.550 0.20 2 981 97 97 THR H H 8.287 0.02 1 982 97 97 THR HA H 3.981 0.02 1 983 97 97 THR HB H 4.361 0.02 1 984 97 97 THR HG2 H 1.032 0.02 1 985 97 97 THR C C 177.800 0.20 1 986 97 97 THR CA C 67.185 0.20 1 987 97 97 THR CB C 68.747 0.20 1 988 97 97 THR CG2 C 20.616 0.20 1 989 97 97 THR N N 117.061 0.20 1 990 98 98 LEU H H 8.354 0.02 1 991 98 98 LEU HA H 4.119 0.02 1 992 98 98 LEU HB2 H 2.050 0.02 2 993 98 98 LEU HB3 H 2.142 0.02 2 994 98 98 LEU C C 179.700 0.20 1 995 98 98 LEU CA C 58.900 0.20 1 996 98 98 LEU CB C 41.930 0.20 1 997 98 98 LEU N N 123.220 0.20 1 998 99 99 LYS H H 8.298 0.02 1 999 99 99 LYS HA H 3.860 0.02 1 1000 99 99 LYS HB2 H 1.993 0.02 2 1001 99 99 LYS HB3 H 1.880 0.02 2 1002 99 99 LYS HG2 H 1.093 0.02 2 1003 99 99 LYS HG3 H 1.402 0.02 2 1004 99 99 LYS HD2 H 1.547 0.02 2 1005 99 99 LYS HD3 H 1.657 0.02 2 1006 99 99 LYS HE2 H 2.926 0.02 1 1007 99 99 LYS HE3 H 2.926 0.02 1 1008 99 99 LYS C C 177.100 0.20 1 1009 99 99 LYS CA C 59.200 0.20 1 1010 99 99 LYS CB C 32.300 0.20 1 1011 99 99 LYS CG C 24.727 0.20 1 1012 99 99 LYS CD C 29.722 0.20 1 1013 99 99 LYS CE C 42.189 0.20 1 1014 99 99 LYS N N 123.300 0.20 1 1015 100 100 HIS H H 7.258 0.02 1 1016 100 100 HIS HA H 4.753 0.02 1 1017 100 100 HIS HB2 H 3.049 0.02 2 1018 100 100 HIS HB3 H 3.620 0.02 2 1019 100 100 HIS C C 175.000 0.20 1 1020 100 100 HIS CA C 55.400 0.20 1 1021 100 100 HIS CB C 29.800 0.20 1 1022 100 100 HIS N N 114.400 0.20 1 1023 101 101 ARG H H 7.480 0.02 1 1024 101 101 ARG HA H 4.293 0.02 1 1025 101 101 ARG HB2 H 1.744 0.02 2 1026 101 101 ARG HB3 H 1.342 0.02 2 1027 101 101 ARG HG2 H 1.066 0.02 1 1028 101 101 ARG HG3 H 1.066 0.02 1 1029 101 101 ARG HD2 H 2.975 0.02 2 1030 101 101 ARG HD3 H 2.715 0.02 2 1031 101 101 ARG HE H 6.910 0.02 1 1032 101 101 ARG C C 174.700 0.20 1 1033 101 101 ARG CA C 55.760 0.20 1 1034 101 101 ARG CB C 27.900 0.20 1 1035 101 101 ARG CG C 25.450 0.20 1 1036 101 101 ARG CD C 43.480 0.20 1 1037 101 101 ARG N N 121.500 0.20 1 1038 101 101 ARG NE N 84.300 0.20 1 1039 102 102 GLN H H 8.850 0.02 1 1040 102 102 GLN HA H 4.051 0.02 1 1041 102 102 GLN HB2 H 2.110 0.02 1 1042 102 102 GLN HB3 H 2.110 0.02 1 1043 102 102 GLN HG2 H 2.528 0.02 1 1044 102 102 GLN HG3 H 2.528 0.02 1 1045 102 102 GLN HE21 H 6.966 0.02 2 1046 102 102 GLN HE22 H 7.659 0.02 2 1047 102 102 GLN C C 176.300 0.20 1 1048 102 102 GLN CA C 58.803 0.20 1 1049 102 102 GLN CB C 29.280 0.20 1 1050 102 102 GLN CG C 34.290 0.20 1 1051 102 102 GLN N N 122.437 0.20 1 1052 103 103 ASN H H 7.990 0.02 1 1053 103 103 ASN HA H 4.859 0.02 1 1054 103 103 ASN HB2 H 2.644 0.02 2 1055 103 103 ASN HB3 H 2.995 0.02 2 1056 103 103 ASN HD21 H 7.026 0.02 1 1057 103 103 ASN HD22 H 7.026 0.02 1 1058 103 103 ASN C C 176.100 0.20 1 1059 103 103 ASN CA C 51.400 0.20 1 1060 103 103 ASN CB C 37.700 0.20 1 1061 104 104 LYS H H 8.775 0.02 1 1062 104 104 LYS HA H 3.892 0.02 1 1063 104 104 LYS HB2 H 1.841 0.02 2 1064 104 104 LYS HB3 H 1.951 0.02 2 1065 104 104 LYS HG2 H 1.521 0.02 1 1066 104 104 LYS HG3 H 1.521 0.02 1 1067 104 104 LYS HD2 H 1.579 0.02 1 1068 104 104 LYS HD3 H 1.579 0.02 1 1069 104 104 LYS HE2 H 3.084 0.02 2 1070 104 104 LYS HE3 H 3.217 0.02 2 1071 104 104 LYS C C 177.200 0.20 1 1072 104 104 LYS CA C 57.200 0.20 1 1073 104 104 LYS CB C 31.492 0.20 1 1074 104 104 LYS CG C 25.000 0.20 1 1075 104 104 LYS CD C 28.100 0.20 1 1076 104 104 LYS CE C 42.752 0.20 1 1077 104 104 LYS N N 122.870 0.20 1 1078 105 105 VAL H H 7.736 0.02 1 1079 105 105 VAL HA H 3.809 0.02 1 1080 105 105 VAL HB H 2.108 0.02 1 1081 105 105 VAL HG1 H 0.962 0.02 1 1082 105 105 VAL HG2 H 0.962 0.02 1 1083 105 105 VAL C C 177.500 0.20 1 1084 105 105 VAL CA C 63.408 0.20 1 1085 105 105 VAL CB C 31.431 0.20 1 1086 105 105 VAL CG1 C 21.863 0.20 1 1087 105 105 VAL CG2 C 21.863 0.20 1 1088 105 105 VAL N N 117.300 0.20 1 1089 106 106 GLN H H 7.235 0.02 1 1090 106 106 GLN HA H 3.701 0.02 1 1091 106 106 GLN HB2 H 2.163 0.02 2 1092 106 106 GLN HB3 H 1.931 0.02 2 1093 106 106 GLN HG2 H 2.228 0.02 2 1094 106 106 GLN HG3 H 1.943 0.02 2 1095 106 106 GLN HE21 H 6.656 0.02 2 1096 106 106 GLN HE22 H 6.758 0.02 2 1097 106 106 GLN C C 177.400 0.20 1 1098 106 106 GLN CA C 56.600 0.20 1 1099 106 106 GLN CB C 29.626 0.20 1 1100 106 106 GLN CG C 34.800 0.20 1 1101 106 106 GLN N N 117.900 0.20 1 1102 107 107 HIS H H 8.774 0.02 1 1103 107 107 HIS HA H 4.707 0.02 1 1104 107 107 HIS HB2 H 3.167 0.02 2 1105 107 107 HIS HB3 H 3.741 0.02 2 1106 107 107 HIS C C 173.400 0.20 1 1107 107 107 HIS CA C 55.907 0.20 1 1108 107 107 HIS CB C 28.700 0.20 1 1109 107 107 HIS N N 122.200 0.20 1 1110 108 108 GLN H H 8.870 0.02 1 1111 108 108 GLN HA H 4.764 0.02 1 1112 108 108 GLN HB2 H 2.408 0.02 1 1113 108 108 GLN HB3 H 2.408 0.02 1 1114 108 108 GLN C C 174.900 0.20 1 1115 108 108 GLN CA C 56.013 0.20 1 1116 108 108 GLN CB C 34.735 0.20 1 1117 108 108 GLN N N 119.900 0.20 1 1118 109 109 ARG H H 8.810 0.02 1 1119 109 109 ARG HA H 5.505 0.02 1 1120 109 109 ARG HB2 H 1.722 0.02 1 1121 109 109 ARG HB3 H 1.722 0.02 1 1122 109 109 ARG C C 173.700 0.20 1 1123 109 109 ARG CA C 54.800 0.20 1 1124 109 109 ARG CB C 33.771 0.20 1 1125 109 109 ARG N N 127.800 0.20 1 1126 110 110 ILE H H 9.008 0.02 1 1127 110 110 ILE HA H 4.970 0.02 1 1128 110 110 ILE HB H 1.690 0.02 1 1129 110 110 ILE HG12 H 0.746 0.02 2 1130 110 110 ILE HG13 H 1.708 0.02 2 1131 110 110 ILE HG2 H 0.841 0.02 1 1132 110 110 ILE HD1 H 0.825 0.02 1 1133 110 110 ILE C C 174.600 0.20 1 1134 110 110 ILE CA C 59.700 0.20 1 1135 110 110 ILE CB C 41.520 0.20 1 1136 110 110 ILE CG1 C 28.550 0.20 1 1137 110 110 ILE CG2 C 17.198 0.20 1 1138 110 110 ILE CD1 C 16.070 0.20 1 1139 110 110 ILE N N 127.550 0.20 1 1140 111 111 VAL H H 9.113 0.02 1 1141 111 111 VAL HA H 5.114 0.02 1 1142 111 111 VAL HB H 2.006 0.02 1 1143 111 111 VAL HG1 H 0.933 0.02 2 1144 111 111 VAL HG2 H 0.526 0.02 2 1145 111 111 VAL C C 173.600 0.20 1 1146 111 111 VAL CA C 60.777 0.20 1 1147 111 111 VAL CB C 33.000 0.20 1 1148 111 111 VAL CG1 C 20.626 0.20 2 1149 111 111 VAL CG2 C 20.848 0.20 2 1150 111 111 VAL N N 127.900 0.20 1 1151 112 112 ALA H H 9.368 0.02 1 1152 112 112 ALA HA H 5.522 0.02 1 1153 112 112 ALA HB H 1.169 0.02 1 1154 112 112 ALA C C 174.700 0.20 1 1155 112 112 ALA CA C 49.700 0.20 1 1156 112 112 ALA CB C 21.000 0.20 1 1157 112 112 ALA N N 129.200 0.20 1 1158 113 113 PHE H H 8.675 0.02 1 1159 113 113 PHE HA H 5.052 0.02 1 1160 113 113 PHE HB2 H 2.947 0.02 2 1161 113 113 PHE HB3 H 3.518 0.02 2 1162 113 113 PHE HD1 H 7.495 0.02 3 1163 113 113 PHE HE1 H 6.920 0.02 3 1164 113 113 PHE C C 174.200 0.20 1 1165 113 113 PHE CA C 56.900 0.20 1 1166 113 113 PHE CB C 42.694 0.20 1 1167 113 113 PHE N N 122.600 0.20 1 1168 114 114 VAL H H 8.899 0.02 1 1169 114 114 VAL HA H 4.417 0.02 1 1170 114 114 VAL HB H 1.912 0.02 1 1171 114 114 VAL HG1 H 0.816 0.02 2 1172 114 114 VAL HG2 H 0.924 0.02 2 1173 114 114 VAL C C 175.100 0.20 1 1174 114 114 VAL CA C 61.700 0.20 1 1175 114 114 VAL CB C 34.900 0.20 1 1176 114 114 VAL CG1 C 21.100 0.20 2 1177 114 114 VAL CG2 C 22.220 0.20 2 1178 114 114 VAL N N 118.440 0.20 1 1179 115 115 CYS H H 10.342 0.02 1 1180 115 115 CYS HA H 5.601 0.02 1 1181 115 115 CYS HB2 H 0.759 0.02 2 1182 115 115 CYS HB3 H 2.260 0.02 2 1183 115 115 CYS C C 171.100 0.20 1 1184 115 115 CYS CA C 54.716 0.20 1 1185 115 115 CYS CB C 29.000 0.20 1 1186 115 115 CYS N N 127.600 0.20 1 1187 116 116 SER H H 6.896 0.02 1 1188 116 116 SER HA H 4.139 0.02 1 1189 116 116 SER HB2 H 3.360 0.02 2 1190 116 116 SER HB3 H 3.740 0.02 2 1191 116 116 SER C C 170.200 0.20 1 1192 116 116 SER CA C 56.200 0.20 1 1193 116 116 SER CB C 63.080 0.20 1 1194 116 116 SER N N 112.800 0.20 1 1195 117 117 PRO HA H 4.165 0.02 1 1196 117 117 PRO HB2 H 1.752 0.02 2 1197 117 117 PRO HB3 H 2.105 0.02 2 1198 117 117 PRO HG2 H 1.521 0.02 2 1199 117 117 PRO HG3 H 1.873 0.02 2 1200 117 117 PRO HD2 H 2.165 0.02 2 1201 117 117 PRO HD3 H 2.552 0.02 2 1202 117 117 PRO C C 176.800 0.20 1 1203 117 117 PRO CA C 63.056 0.20 1 1204 117 117 PRO CB C 31.600 0.20 1 1205 117 117 PRO CG C 28.324 0.20 1 1206 117 117 PRO CD C 49.159 0.20 1 1207 118 118 ILE H H 8.707 0.02 1 1208 118 118 ILE HA H 3.989 0.02 1 1209 118 118 ILE HB H 1.676 0.02 1 1210 118 118 ILE HG12 H 0.943 0.02 2 1211 118 118 ILE HG13 H 1.593 0.02 2 1212 118 118 ILE HG2 H 1.033 0.02 1 1213 118 118 ILE HD1 H 0.781 0.02 1 1214 118 118 ILE C C 177.200 0.20 1 1215 118 118 ILE CA C 62.153 0.20 1 1216 118 118 ILE CB C 39.100 0.20 1 1217 118 118 ILE CG1 C 28.200 0.20 1 1218 118 118 ILE CG2 C 18.214 0.20 1 1219 118 118 ILE CD1 C 14.759 0.20 1 1220 118 118 ILE N N 128.070 0.20 1 1221 119 119 SER H H 8.738 0.02 1 1222 119 119 SER HA H 4.644 0.02 1 1223 119 119 SER HB2 H 4.144 0.02 2 1224 119 119 SER HB3 H 3.819 0.02 2 1225 119 119 SER C C 174.600 0.20 1 1226 119 119 SER CA C 58.300 0.20 1 1227 119 119 SER CB C 64.200 0.20 1 1228 119 119 SER N N 122.600 0.20 1 1229 120 120 ASP H H 6.946 0.02 1 1230 120 120 ASP HA H 4.736 0.02 1 1231 120 120 ASP HB2 H 2.176 0.02 2 1232 120 120 ASP HB3 H 2.617 0.02 2 1233 120 120 ASP C C 174.200 0.20 1 1234 120 120 ASP CA C 54.600 0.20 1 1235 120 120 ASP CB C 43.800 0.20 1 1236 120 120 ASP N N 122.524 0.20 1 1237 121 121 SER H H 8.960 0.02 1 1238 121 121 SER HA H 4.383 0.02 1 1239 121 121 SER HB2 H 4.074 0.02 2 1240 121 121 SER HB3 H 4.333 0.02 2 1241 121 121 SER C C 174.800 0.20 1 1242 121 121 SER CA C 57.600 0.20 1 1243 121 121 SER CB C 64.950 0.20 1 1244 121 121 SER N N 117.400 0.20 1 1245 122 122 ARG H H 8.898 0.02 1 1246 122 122 ARG HA H 3.898 0.02 1 1247 122 122 ARG HB2 H 1.996 0.02 2 1248 122 122 ARG HB3 H 1.837 0.02 2 1249 122 122 ARG HG2 H 1.555 0.02 2 1250 122 122 ARG HG3 H 1.635 0.02 2 1251 122 122 ARG HD2 H 3.244 0.02 2 1252 122 122 ARG HD3 H 3.173 0.02 2 1253 122 122 ARG HE H 8.317 0.02 1 1254 122 122 ARG C C 177.800 0.20 1 1255 122 122 ARG CA C 60.300 0.20 1 1256 122 122 ARG CB C 30.000 0.20 1 1257 122 122 ARG CG C 27.293 0.20 1 1258 122 122 ARG CD C 43.529 0.20 1 1259 122 122 ARG N N 124.170 0.20 1 1260 122 122 ARG NE N 86.260 0.20 1 1261 123 123 ASP H H 8.473 0.02 1 1262 123 123 ASP HA H 4.300 0.02 1 1263 123 123 ASP HB2 H 2.518 0.02 2 1264 123 123 ASP HB3 H 2.620 0.02 2 1265 123 123 ASP C C 179.000 0.20 1 1266 123 123 ASP CA C 57.700 0.20 1 1267 123 123 ASP CB C 40.700 0.20 1 1268 123 123 ASP N N 116.801 0.20 1 1269 124 124 GLU H H 7.843 0.02 1 1270 124 124 GLU HA H 4.084 0.02 1 1271 124 124 GLU HB2 H 2.005 0.02 2 1272 124 124 GLU HB3 H 2.220 0.02 2 1273 124 124 GLU HG2 H 2.352 0.02 2 1274 124 124 GLU HG3 H 2.258 0.02 2 1275 124 124 GLU C C 179.600 0.20 1 1276 124 124 GLU CA C 59.100 0.20 1 1277 124 124 GLU CB C 29.600 0.20 1 1278 124 124 GLU CG C 36.200 0.20 1 1279 124 124 GLU N N 120.270 0.20 1 1280 125 125 LEU H H 8.281 0.02 1 1281 125 125 LEU HA H 4.185 0.02 1 1282 125 125 LEU HB2 H 1.477 0.02 2 1283 125 125 LEU HB3 H 2.069 0.02 2 1284 125 125 LEU HG H 1.726 0.02 1 1285 125 125 LEU HD1 H 0.728 0.02 2 1286 125 125 LEU HD2 H 0.620 0.02 2 1287 125 125 LEU C C 178.900 0.20 1 1288 125 125 LEU CA C 58.200 0.20 1 1289 125 125 LEU CB C 41.600 0.20 1 1290 125 125 LEU CG C 27.200 0.20 1 1291 125 125 LEU CD1 C 26.110 0.20 2 1292 125 125 LEU CD2 C 22.718 0.20 2 1293 125 125 LEU N N 120.900 0.20 1 1294 126 126 ILE H H 8.867 0.02 1 1295 126 126 ILE HA H 3.877 0.02 1 1296 126 126 ILE HB H 2.148 0.02 1 1297 126 126 ILE HG12 H 1.418 0.02 2 1298 126 126 ILE HG13 H 1.738 0.02 2 1299 126 126 ILE HG2 H 0.907 0.02 1 1300 126 126 ILE HD1 H 0.742 0.02 1 1301 126 126 ILE C C 178.400 0.20 1 1302 126 126 ILE CA C 63.200 0.20 1 1303 126 126 ILE CB C 35.380 0.20 1 1304 126 126 ILE CG1 C 28.160 0.20 1 1305 126 126 ILE CG2 C 17.900 0.20 1 1306 126 126 ILE CD1 C 9.922 0.20 1 1307 126 126 ILE N N 121.050 0.20 1 1308 127 127 ARG H H 7.836 0.02 1 1309 127 127 ARG HA H 4.005 0.02 1 1310 127 127 ARG HB2 H 1.989 0.02 2 1311 127 127 ARG HB3 H 1.940 0.02 2 1312 127 127 ARG HG2 H 1.592 0.02 2 1313 127 127 ARG HG3 H 1.844 0.02 2 1314 127 127 ARG HD2 H 3.224 0.02 2 1315 127 127 ARG HD3 H 3.262 0.02 2 1316 127 127 ARG HE H 7.446 0.02 1 1317 127 127 ARG C C 179.800 0.20 1 1318 127 127 ARG CA C 60.400 0.20 1 1319 127 127 ARG CB C 30.100 0.20 1 1320 127 127 ARG CG C 28.255 0.20 1 1321 127 127 ARG CD C 43.578 0.20 1 1322 127 127 ARG N N 121.400 0.20 1 1323 127 127 ARG NE N 85.120 0.20 1 1324 128 128 LEU H H 8.012 0.02 1 1325 128 128 LEU HA H 4.246 0.02 1 1326 128 128 LEU HB2 H 2.129 0.02 2 1327 128 128 LEU HB3 H 1.923 0.02 2 1328 128 128 LEU HG H 1.079 0.02 1 1329 128 128 LEU HD1 H 1.023 0.02 2 1330 128 128 LEU HD2 H 0.914 0.02 2 1331 128 128 LEU C C 178.400 0.20 1 1332 128 128 LEU CA C 57.700 0.20 1 1333 128 128 LEU CB C 41.940 0.20 1 1334 128 128 LEU CG C 27.127 0.20 1 1335 128 128 LEU CD1 C 23.898 0.20 2 1336 128 128 LEU CD2 C 25.230 0.20 2 1337 128 128 LEU N N 121.920 0.20 1 1338 129 129 ALA H H 8.735 0.02 1 1339 129 129 ALA HA H 3.590 0.02 1 1340 129 129 ALA HB H 1.102 0.02 1 1341 129 129 ALA C C 179.300 0.20 1 1342 129 129 ALA CA C 55.600 0.20 1 1343 129 129 ALA CB C 19.100 0.20 1 1344 129 129 ALA N N 123.600 0.20 1 1345 130 130 LYS H H 7.865 0.02 1 1346 130 130 LYS HA H 3.918 0.02 1 1347 130 130 LYS C C 180.100 0.20 1 1348 130 130 LYS CA C 59.935 0.20 1 1349 130 130 LYS CB C 32.183 0.20 1 1350 130 130 LYS N N 115.800 0.20 1 1351 131 131 THR H H 8.027 0.02 1 1352 131 131 THR HA H 3.987 0.02 1 1353 131 131 THR HB H 4.465 0.02 1 1354 131 131 THR HG2 H 1.312 0.02 1 1355 131 131 THR C C 176.400 0.20 1 1356 131 131 THR CA C 66.800 0.20 1 1357 131 131 THR CB C 68.800 0.20 1 1358 131 131 THR CG2 C 21.980 0.20 1 1359 131 131 THR N N 119.900 0.20 1 1360 132 132 LEU H H 8.925 0.02 1 1361 132 132 LEU HA H 3.887 0.02 1 1362 132 132 LEU HB2 H 1.271 0.02 2 1363 132 132 LEU HB3 H 2.054 0.02 2 1364 132 132 LEU HG H 0.895 0.02 1 1365 132 132 LEU HD1 H 0.727 0.02 1 1366 132 132 LEU HD2 H 0.727 0.02 1 1367 132 132 LEU C C 178.600 0.20 1 1368 132 132 LEU CA C 58.900 0.20 1 1369 132 132 LEU CB C 40.655 0.20 1 1370 132 132 LEU CG C 26.625 0.20 1 1371 132 132 LEU CD1 C 22.790 0.20 1 1372 132 132 LEU CD2 C 22.790 0.20 1 1373 132 132 LEU N N 125.560 0.20 1 1374 133 133 LYS H H 8.400 0.02 1 1375 133 133 LYS HA H 4.170 0.02 1 1376 133 133 LYS HB2 H 2.015 0.02 2 1377 133 133 LYS HB3 H 2.136 0.02 2 1378 133 133 LYS HG2 H 1.477 0.02 2 1379 133 133 LYS HG3 H 1.590 0.02 2 1380 133 133 LYS HD2 H 1.748 0.02 1 1381 133 133 LYS HD3 H 1.748 0.02 1 1382 133 133 LYS HE2 H 3.037 0.02 1 1383 133 133 LYS HE3 H 3.037 0.02 1 1384 133 133 LYS C C 181.300 0.20 1 1385 133 133 LYS CA C 60.000 0.20 1 1386 133 133 LYS CB C 32.800 0.20 1 1387 133 133 LYS CG C 25.772 0.20 1 1388 133 133 LYS CD C 28.690 0.20 1 1389 133 133 LYS CE C 42.290 0.20 1 1390 133 133 LYS N N 120.600 0.20 1 1391 134 134 LYS H H 8.037 0.02 1 1392 134 134 LYS HA H 4.118 0.02 1 1393 134 134 LYS HB2 H 2.024 0.02 1 1394 134 134 LYS HB3 H 2.024 0.02 1 1395 134 134 LYS HG2 H 1.565 0.02 1 1396 134 134 LYS HG3 H 1.565 0.02 1 1397 134 134 LYS HD2 H 1.712 0.02 1 1398 134 134 LYS HD3 H 1.712 0.02 1 1399 134 134 LYS HE2 H 3.023 0.02 1 1400 134 134 LYS HE3 H 3.023 0.02 1 1401 134 134 LYS C C 176.900 0.20 1 1402 134 134 LYS CA C 58.900 0.20 1 1403 134 134 LYS CB C 32.097 0.20 1 1404 134 134 LYS CG C 24.747 0.20 1 1405 134 134 LYS CD C 29.408 0.20 1 1406 134 134 LYS CE C 42.315 0.20 1 1407 134 134 LYS N N 121.800 0.20 1 1408 135 135 ASN H H 7.561 0.02 1 1409 135 135 ASN HA H 4.717 0.02 1 1410 135 135 ASN HB2 H 2.646 0.02 2 1411 135 135 ASN HB3 H 3.121 0.02 2 1412 135 135 ASN C C 173.300 0.20 1 1413 135 135 ASN CA C 53.683 0.20 1 1414 135 135 ASN CB C 39.800 0.20 1 1415 135 135 ASN N N 116.280 0.20 1 1416 136 136 ASN H H 8.055 0.02 1 1417 136 136 ASN HA H 4.727 0.02 1 1418 136 136 ASN HB2 H 2.960 0.02 2 1419 136 136 ASN HB3 H 3.104 0.02 2 1420 136 136 ASN C C 173.500 0.20 1 1421 136 136 ASN CA C 54.700 0.20 1 1422 136 136 ASN CB C 36.600 0.20 1 1423 136 136 ASN N N 114.370 0.20 1 1424 137 137 VAL H H 8.156 0.02 1 1425 137 137 VAL HA H 4.108 0.02 1 1426 137 137 VAL HB H 1.850 0.02 1 1427 137 137 VAL HG1 H 0.778 0.02 2 1428 137 137 VAL HG2 H 0.720 0.02 2 1429 137 137 VAL C C 175.500 0.20 1 1430 137 137 VAL CA C 62.300 0.20 1 1431 137 137 VAL CB C 32.400 0.20 1 1432 137 137 VAL CG1 C 21.545 0.20 2 1433 137 137 VAL CG2 C 22.693 0.20 2 1434 137 137 VAL N N 120.100 0.20 1 1435 138 138 ALA H H 7.951 0.02 1 1436 138 138 ALA HA H 4.424 0.02 1 1437 138 138 ALA HB H 1.238 0.02 1 1438 138 138 ALA C C 175.900 0.20 1 1439 138 138 ALA CA C 50.900 0.20 1 1440 138 138 ALA CB C 20.800 0.20 1 1441 138 138 ALA N N 131.190 0.20 1 1442 139 139 VAL H H 9.001 0.02 1 1443 139 139 VAL HA H 5.220 0.02 1 1444 139 139 VAL HB H 1.852 0.02 1 1445 139 139 VAL HG1 H 0.931 0.02 2 1446 139 139 VAL HG2 H 0.903 0.02 2 1447 139 139 VAL C C 173.600 0.20 1 1448 139 139 VAL CA C 60.300 0.20 1 1449 139 139 VAL CB C 35.700 0.20 1 1450 139 139 VAL CG1 C 23.100 0.20 2 1451 139 139 VAL CG2 C 21.950 0.20 2 1452 139 139 VAL N N 121.500 0.20 1 1453 140 140 ASP H H 9.373 0.02 1 1454 140 140 ASP HA H 6.206 0.02 1 1455 140 140 ASP HB2 H 2.336 0.02 2 1456 140 140 ASP HB3 H 2.669 0.02 2 1457 140 140 ASP C C 175.400 0.20 1 1458 140 140 ASP CA C 52.600 0.20 1 1459 140 140 ASP CB C 45.300 0.20 1 1460 140 140 ASP N N 124.200 0.20 1 1461 141 141 ILE H H 8.870 0.02 1 1462 141 141 ILE HA H 5.175 0.02 1 1463 141 141 ILE HB H 1.766 0.02 1 1464 141 141 ILE HG12 H 1.173 0.02 2 1465 141 141 ILE HG13 H 1.571 0.02 2 1466 141 141 ILE HG2 H 0.775 0.02 1 1467 141 141 ILE HD1 H 0.694 0.02 1 1468 141 141 ILE C C 173.800 0.20 1 1469 141 141 ILE CA C 58.200 0.20 1 1470 141 141 ILE CB C 40.600 0.20 1 1471 141 141 ILE CG1 C 28.049 0.20 1 1472 141 141 ILE CG2 C 18.194 0.20 1 1473 141 141 ILE CD1 C 13.328 0.20 1 1474 141 141 ILE N N 121.050 0.20 1 1475 142 142 ILE H H 8.897 0.02 1 1476 142 142 ILE HA H 4.542 0.02 1 1477 142 142 ILE HB H 1.599 0.02 1 1478 142 142 ILE HG12 H 0.701 0.02 2 1479 142 142 ILE HG13 H 1.005 0.02 2 1480 142 142 ILE HG2 H 0.736 0.02 1 1481 142 142 ILE HD1 H 0.057 0.02 1 1482 142 142 ILE C C 172.700 0.20 1 1483 142 142 ILE CA C 61.466 0.20 1 1484 142 142 ILE CB C 37.770 0.20 1 1485 142 142 ILE CG1 C 29.256 0.20 1 1486 142 142 ILE CG2 C 19.800 0.20 1 1487 142 142 ILE CD1 C 14.878 0.20 1 1488 142 142 ILE N N 128.760 0.20 1 1489 143 143 ASN H H 9.390 0.02 1 1490 143 143 ASN HA H 5.176 0.02 1 1491 143 143 ASN HB2 H 2.308 0.02 2 1492 143 143 ASN HB3 H 3.012 0.02 2 1493 143 143 ASN HD21 H 7.630 0.02 1 1494 143 143 ASN HD22 H 7.630 0.02 1 1495 143 143 ASN C C 171.900 0.20 1 1496 143 143 ASN CA C 51.300 0.20 1 1497 143 143 ASN CB C 41.876 0.20 1 1498 143 143 ASN N N 128.760 0.20 1 1499 144 144 PHE H H 8.616 0.02 1 1500 144 144 PHE HA H 5.098 0.02 1 1501 144 144 PHE HB2 H 2.598 0.02 2 1502 144 144 PHE HB3 H 2.394 0.02 2 1503 144 144 PHE HD1 H 7.272 0.02 3 1504 144 144 PHE C C 172.900 0.20 1 1505 144 144 PHE CA C 55.200 0.20 1 1506 144 144 PHE CB C 41.405 0.20 1 1507 144 144 PHE N N 123.560 0.20 1 1508 145 145 GLY H H 9.967 0.02 1 1509 145 145 GLY HA2 H 3.683 0.02 2 1510 145 145 GLY HA3 H 3.993 0.02 2 1511 145 145 GLY C C 174.800 0.20 1 1512 145 145 GLY CA C 45.900 0.20 1 1513 145 145 GLY N N 112.800 0.20 1 1514 146 146 GLU H H 7.139 0.02 1 1515 146 146 GLU HA H 4.858 0.02 1 1516 146 146 GLU HB2 H 1.249 0.02 2 1517 146 146 GLU HB3 H 1.974 0.02 2 1518 146 146 GLU HG2 H 1.523 0.02 2 1519 146 146 GLU HG3 H 1.730 0.02 2 1520 146 146 GLU C C 176.800 0.20 1 1521 146 146 GLU CA C 53.400 0.20 1 1522 146 146 GLU CB C 27.000 0.20 1 1523 146 146 GLU CG C 35.603 0.20 1 1524 146 146 GLU N N 122.870 0.20 1 1525 147 147 ILE H H 6.938 0.02 1 1526 147 147 ILE HA H 4.071 0.02 1 1527 147 147 ILE HB H 1.867 0.02 1 1528 147 147 ILE HG12 H 1.185 0.02 2 1529 147 147 ILE HG13 H 1.363 0.02 2 1530 147 147 ILE HG2 H 0.948 0.02 1 1531 147 147 ILE HD1 H 0.856 0.02 1 1532 147 147 ILE C C 179.700 0.20 1 1533 147 147 ILE CA C 63.697 0.20 1 1534 147 147 ILE CB C 36.951 0.20 1 1535 147 147 ILE CG1 C 25.919 0.20 1 1536 147 147 ILE CG2 C 18.287 0.20 1 1537 147 147 ILE CD1 C 14.153 0.20 1 1538 147 147 ILE N N 114.190 0.20 1 1539 148 148 GLU H H 9.210 0.02 1 1540 148 148 GLU HA H 4.144 0.02 1 1541 148 148 GLU HB2 H 2.086 0.02 2 1542 148 148 GLU HB3 H 2.054 0.02 2 1543 148 148 GLU HG2 H 2.369 0.02 1 1544 148 148 GLU HG3 H 2.369 0.02 1 1545 148 148 GLU C C 178.500 0.20 1 1546 148 148 GLU CA C 60.100 0.20 1 1547 148 148 GLU CB C 28.680 0.20 1 1548 148 148 GLU CG C 36.760 0.20 1 1549 148 148 GLU N N 126.200 0.20 1 1550 149 149 GLN H H 7.916 0.02 1 1551 149 149 GLN HA H 4.395 0.02 1 1552 149 149 GLN HB2 H 1.972 0.02 2 1553 149 149 GLN HB3 H 2.055 0.02 2 1554 149 149 GLN HG2 H 2.397 0.02 1 1555 149 149 GLN HG3 H 2.397 0.02 1 1556 149 149 GLN HE21 H 7.650 0.02 2 1557 149 149 GLN HE22 H 6.970 0.02 2 1558 149 149 GLN C C 178.000 0.20 1 1559 149 149 GLN CA C 57.400 0.20 1 1560 149 149 GLN CB C 29.500 0.20 1 1561 149 149 GLN CG C 34.079 0.20 1 1562 149 149 GLN N N 115.900 0.20 1 1563 149 149 GLN NE2 N 113.400 0.20 1 1564 150 150 ASN H H 7.520 0.02 1 1565 150 150 ASN HA H 4.947 0.02 1 1566 150 150 ASN HB2 H 2.571 0.02 2 1567 150 150 ASN HB3 H 2.543 0.02 2 1568 150 150 ASN C C 176.700 0.20 1 1569 150 150 ASN CA C 54.200 0.20 1 1570 150 150 ASN CB C 41.500 0.20 1 1571 150 150 ASN N N 114.000 0.20 1 1572 151 151 THR H H 7.805 0.02 1 1573 151 151 THR HA H 3.627 0.02 1 1574 151 151 THR HB H 4.185 0.02 1 1575 151 151 THR HG2 H 1.182 0.02 1 1576 151 151 THR C C 174.300 0.20 1 1577 151 151 THR CA C 70.000 0.20 1 1578 151 151 THR CB C 68.400 0.20 1 1579 151 151 THR CG2 C 21.670 0.20 1 1580 151 151 THR N N 117.700 0.20 1 1581 152 152 GLU H H 8.469 0.02 1 1582 152 152 GLU HA H 4.061 0.02 1 1583 152 152 GLU HB2 H 2.052 0.02 1 1584 152 152 GLU HB3 H 2.052 0.02 1 1585 152 152 GLU HG2 H 2.259 0.02 1 1586 152 152 GLU HG3 H 2.259 0.02 1 1587 152 152 GLU C C 179.300 0.20 1 1588 152 152 GLU CA C 60.479 0.20 1 1589 152 152 GLU CB C 29.132 0.20 1 1590 152 152 GLU CG C 36.500 0.20 1 1591 152 152 GLU N N 121.050 0.20 1 1592 153 153 LEU H H 8.168 0.02 1 1593 153 153 LEU HA H 4.250 0.02 1 1594 153 153 LEU HB2 H 1.648 0.02 2 1595 153 153 LEU HB3 H 1.790 0.02 2 1596 153 153 LEU HG H 1.532 0.02 1 1597 153 153 LEU HD1 H 0.916 0.02 2 1598 153 153 LEU HD2 H 1.015 0.02 2 1599 153 153 LEU C C 178.800 0.20 1 1600 153 153 LEU CA C 57.900 0.20 1 1601 153 153 LEU CB C 42.410 0.20 1 1602 153 153 LEU CG C 27.297 0.20 1 1603 153 153 LEU CD1 C 25.100 0.20 2 1604 153 153 LEU CD2 C 23.800 0.20 2 1605 153 153 LEU N N 121.600 0.20 1 1606 154 154 LEU H H 8.111 0.02 1 1607 154 154 LEU HA H 4.093 0.02 1 1608 154 154 LEU HB2 H 1.911 0.02 2 1609 154 154 LEU HB3 H 1.320 0.02 2 1610 154 154 LEU HG H 0.720 0.02 1 1611 154 154 LEU HD1 H 0.662 0.02 1 1612 154 154 LEU HD2 H 0.662 0.02 1 1613 154 154 LEU C C 178.400 0.20 1 1614 154 154 LEU CA C 57.500 0.20 1 1615 154 154 LEU CB C 41.957 0.20 1 1616 154 154 LEU CG C 25.716 0.20 1 1617 154 154 LEU CD1 C 22.028 0.20 1 1618 154 154 LEU CD2 C 22.028 0.20 1 1619 154 154 LEU N N 118.190 0.20 1 1620 155 155 ASP H H 9.092 0.02 1 1621 155 155 ASP HA H 4.385 0.02 1 1622 155 155 ASP HB2 H 2.711 0.02 1 1623 155 155 ASP HB3 H 2.711 0.02 1 1624 155 155 ASP C C 179.200 0.20 1 1625 155 155 ASP CA C 57.600 0.20 1 1626 155 155 ASP CB C 41.620 0.20 1 1627 155 155 ASP N N 122.500 0.20 1 1628 156 156 GLU H H 7.696 0.02 1 1629 156 156 GLU HA H 4.043 0.02 1 1630 156 156 GLU HB2 H 2.190 0.02 2 1631 156 156 GLU HB3 H 2.250 0.02 2 1632 156 156 GLU HG2 H 2.257 0.02 2 1633 156 156 GLU HG3 H 2.518 0.02 2 1634 156 156 GLU C C 179.200 0.20 1 1635 156 156 GLU CA C 59.800 0.20 1 1636 156 156 GLU CB C 29.500 0.20 1 1637 156 156 GLU CG C 36.800 0.20 1 1638 156 156 GLU N N 120.500 0.20 1 1639 157 157 PHE H H 8.578 0.02 1 1640 157 157 PHE HA H 3.845 0.02 1 1641 157 157 PHE HB2 H 3.396 0.02 2 1642 157 157 PHE HB3 H 2.971 0.02 2 1643 157 157 PHE HD1 H 7.025 0.02 3 1644 157 157 PHE C C 176.400 0.20 1 1645 157 157 PHE CA C 62.300 0.20 1 1646 157 157 PHE CB C 39.600 0.20 1 1647 157 157 PHE N N 121.400 0.20 1 1648 158 158 ILE H H 8.859 0.02 1 1649 158 158 ILE HA H 3.926 0.02 1 1650 158 158 ILE HB H 2.240 0.02 1 1651 158 158 ILE HG12 H 1.406 0.02 2 1652 158 158 ILE HG13 H 1.841 0.02 2 1653 158 158 ILE HG2 H 0.807 0.02 1 1654 158 158 ILE HD1 H 0.768 0.02 1 1655 158 158 ILE C C 177.600 0.20 1 1656 158 158 ILE CA C 60.200 0.20 1 1657 158 158 ILE CB C 35.480 0.20 1 1658 158 158 ILE CG1 C 28.100 0.20 1 1659 158 158 ILE CG2 C 17.502 0.20 1 1660 158 158 ILE CD1 C 10.327 0.20 1 1661 158 158 ILE N N 120.800 0.20 1 1662 159 159 ALA H H 8.016 0.02 1 1663 159 159 ALA HA H 4.145 0.02 1 1664 159 159 ALA HB H 1.493 0.02 1 1665 159 159 ALA C C 179.700 0.20 1 1666 159 159 ALA CA C 54.600 0.20 1 1667 159 159 ALA CB C 17.900 0.20 1 1668 159 159 ALA N N 122.200 0.20 1 1669 160 160 ALA H H 7.610 0.02 1 1670 160 160 ALA HA H 4.215 0.02 1 1671 160 160 ALA HB H 1.381 0.02 1 1672 160 160 ALA C C 178.000 0.20 1 1673 160 160 ALA CA C 53.750 0.20 1 1674 160 160 ALA CB C 19.100 0.20 1 1675 160 160 ALA N N 119.500 0.20 1 1676 161 161 VAL H H 7.806 0.02 1 1677 161 161 VAL HA H 4.099 0.02 1 1678 161 161 VAL HB H 1.474 0.02 1 1679 161 161 VAL HG1 H 1.030 0.02 2 1680 161 161 VAL HG2 H 1.045 0.02 2 1681 161 161 VAL C C 175.400 0.20 1 1682 161 161 VAL CA C 61.940 0.20 1 1683 161 161 VAL CB C 32.926 0.20 1 1684 161 161 VAL CG1 C 20.784 0.20 2 1685 161 161 VAL CG2 C 24.597 0.20 2 1686 161 161 VAL N N 117.700 0.20 1 1687 162 162 ASN H H 7.860 0.02 1 1688 162 162 ASN CA C 54.700 0.20 1 1689 162 162 ASN N N 120.500 0.20 1 1690 164 164 PRO HA H 4.241 0.02 1 1691 164 164 PRO HB2 H 1.988 0.02 2 1692 164 164 PRO HB3 H 2.343 0.02 2 1693 164 164 PRO HG2 H 1.982 0.02 2 1694 164 164 PRO HG3 H 2.012 0.02 2 1695 164 164 PRO HD2 H 3.645 0.02 2 1696 164 164 PRO HD3 H 3.853 0.02 2 1697 164 164 PRO C C 177.400 0.20 1 1698 164 164 PRO CA C 64.141 0.20 1 1699 164 164 PRO CB C 32.265 0.20 1 1700 164 164 PRO CG C 27.056 0.20 1 1701 164 164 PRO CD C 50.776 0.20 1 1702 165 165 GLN H H 7.666 0.02 1 1703 165 165 GLN HA H 4.290 0.02 1 1704 165 165 GLN HB2 H 2.240 0.02 2 1705 165 165 GLN HB3 H 2.080 0.02 2 1706 165 165 GLN HG2 H 2.400 0.02 1 1707 165 165 GLN HG3 H 2.400 0.02 1 1708 165 165 GLN HE21 H 7.607 0.02 2 1709 165 165 GLN HE22 H 6.870 0.02 2 1710 165 165 GLN C C 175.900 0.20 1 1711 165 165 GLN CA C 56.800 0.20 1 1712 165 165 GLN CB C 29.284 0.20 1 1713 165 165 GLN CG C 34.870 0.20 1 1714 165 165 GLN N N 115.400 0.20 1 1715 165 165 GLN NE2 N 112.980 0.20 1 1716 166 166 GLU H H 7.539 0.02 1 1717 166 166 GLU HA H 4.593 0.02 1 1718 166 166 GLU HB2 H 2.300 0.02 2 1719 166 166 GLU HB3 H 1.711 0.02 2 1720 166 166 GLU HG2 H 2.306 0.02 2 1721 166 166 GLU HG3 H 2.153 0.02 2 1722 166 166 GLU C C 174.400 0.20 1 1723 166 166 GLU CA C 55.400 0.20 1 1724 166 166 GLU CB C 30.360 0.20 1 1725 166 166 GLU CG C 35.912 0.20 1 1726 166 166 GLU N N 121.900 0.20 1 1727 167 167 GLU H H 7.860 0.02 1 1728 167 167 GLU C C 176.100 0.20 1 1729 167 167 GLU CA C 55.700 0.20 1 1730 167 167 GLU CB C 30.300 0.20 1 1731 167 167 GLU N N 120.500 0.20 1 1732 168 168 THR H H 7.995 0.02 1 1733 168 168 THR HA H 4.330 0.02 1 1734 168 168 THR HB H 4.187 0.02 1 1735 168 168 THR HG2 H 1.082 0.02 1 1736 168 168 THR CA C 53.480 0.20 1 1737 168 168 THR CB C 68.370 0.20 1 1738 168 168 THR CG2 C 18.280 0.20 1 1739 170 170 HIS H H 9.029 0.02 1 1740 170 170 HIS HA H 4.924 0.02 1 1741 170 170 HIS HB2 H 2.916 0.02 2 1742 170 170 HIS HB3 H 3.176 0.02 2 1743 170 170 HIS C C 172.100 0.20 1 1744 170 170 HIS CA C 55.700 0.20 1 1745 170 170 HIS CB C 31.776 0.20 1 1746 170 170 HIS N N 119.000 0.20 1 1747 171 171 LEU H H 9.010 0.02 1 1748 171 171 LEU HA H 5.070 0.02 1 1749 171 171 LEU HB2 H 1.255 0.02 2 1750 171 171 LEU HB3 H 2.082 0.02 2 1751 171 171 LEU HG H 0.886 0.02 1 1752 171 171 LEU C C 175.100 0.20 1 1753 171 171 LEU CA C 53.500 0.20 1 1754 171 171 LEU CB C 44.260 0.20 1 1755 171 171 LEU CG C 26.800 0.20 1 1756 171 171 LEU N N 124.300 0.20 1 1757 172 172 LEU H H 9.407 0.02 1 1758 172 172 LEU HA H 4.878 0.02 1 1759 172 172 LEU HB2 H 1.138 0.02 2 1760 172 172 LEU HB3 H 1.929 0.02 2 1761 172 172 LEU HG H 0.699 0.02 1 1762 172 172 LEU HD1 H 0.994 0.02 1 1763 172 172 LEU HD2 H 0.994 0.02 1 1764 172 172 LEU C C 173.500 0.20 1 1765 172 172 LEU CA C 53.500 0.20 1 1766 172 172 LEU CB C 44.700 0.20 1 1767 172 172 LEU CG C 27.004 0.20 1 1768 172 172 LEU CD1 C 23.350 0.20 1 1769 172 172 LEU CD2 C 23.350 0.20 1 1770 172 172 LEU N N 131.900 0.20 1 1771 173 173 THR H H 8.980 0.02 1 1772 173 173 THR HA H 5.293 0.02 1 1773 173 173 THR HB H 4.021 0.02 1 1774 173 173 THR HG2 H 1.200 0.02 1 1775 173 173 THR C C 174.500 0.20 1 1776 173 173 THR CA C 62.200 0.20 1 1777 173 173 THR CB C 69.300 0.20 1 1778 173 173 THR CG2 C 22.736 0.20 1 1779 173 173 THR N N 128.854 0.20 1 1780 174 174 VAL H H 8.832 0.02 1 1781 174 174 VAL HA H 4.418 0.02 1 1782 174 174 VAL HB H 1.886 0.02 1 1783 174 174 VAL HG1 H 0.711 0.02 2 1784 174 174 VAL HG2 H 1.102 0.02 2 1785 174 174 VAL C C 174.700 0.20 1 1786 174 174 VAL CA C 61.300 0.20 1 1787 174 174 VAL CB C 34.620 0.20 1 1788 174 174 VAL CG1 C 20.900 0.20 2 1789 174 174 VAL CG2 C 22.400 0.20 2 1790 174 174 VAL N N 129.100 0.20 1 1791 175 175 THR H H 8.304 0.02 1 1792 175 175 THR HA H 4.920 0.02 1 1793 175 175 THR HB H 4.452 0.02 1 1794 175 175 THR HG2 H 1.285 0.02 1 1795 175 175 THR C C 172.300 0.20 1 1796 175 175 THR CA C 59.187 0.20 1 1797 175 175 THR CB C 69.000 0.20 1 1798 175 175 THR CG2 C 21.954 0.20 1 1799 175 175 THR N N 118.400 0.20 1 1800 176 176 PRO HA H 3.999 0.02 1 1801 176 176 PRO HB2 H 1.873 0.02 2 1802 176 176 PRO HB3 H 1.760 0.02 2 1803 176 176 PRO HG2 H 2.080 0.02 2 1804 176 176 PRO HG3 H 1.856 0.02 2 1805 176 176 PRO HD2 H 3.747 0.02 2 1806 176 176 PRO HD3 H 4.105 0.02 2 1807 176 176 PRO C C 176.400 0.20 1 1808 176 176 PRO CA C 63.400 0.20 1 1809 176 176 PRO CB C 31.800 0.20 1 1810 176 176 PRO CG C 27.600 0.20 1 1811 176 176 PRO CD C 50.847 0.20 1 1812 177 177 GLY H H 8.025 0.02 1 1813 177 177 GLY HA2 H 3.909 0.02 2 1814 177 177 GLY HA3 H 4.292 0.02 2 1815 177 177 GLY C C 171.000 0.20 1 1816 177 177 GLY CA C 45.700 0.20 1 1817 177 177 GLY N N 111.700 0.20 1 1818 178 178 PRO HA H 4.347 0.02 1 1819 178 178 PRO HB2 H 1.996 0.02 2 1820 178 178 PRO HB3 H 2.248 0.02 2 1821 178 178 PRO HG2 H 1.910 0.02 2 1822 178 178 PRO HG3 H 2.030 0.02 2 1823 178 178 PRO HD2 H 3.465 0.02 2 1824 178 178 PRO HD3 H 3.694 0.02 2 1825 178 178 PRO C C 177.700 0.20 1 1826 178 178 PRO CA C 64.000 0.20 1 1827 178 178 PRO CB C 32.350 0.20 1 1828 178 178 PRO CG C 26.831 0.20 1 1829 178 178 PRO CD C 49.435 0.20 1 1830 179 179 ARG H H 7.998 0.02 1 1831 179 179 ARG HA H 4.351 0.02 1 1832 179 179 ARG HB2 H 1.530 0.02 2 1833 179 179 ARG HB3 H 1.701 0.02 2 1834 179 179 ARG HG2 H 1.573 0.02 2 1835 179 179 ARG HG3 H 1.474 0.02 2 1836 179 179 ARG HD2 H 3.007 0.02 2 1837 179 179 ARG HD3 H 2.962 0.02 2 1838 179 179 ARG HE H 7.091 0.02 1 1839 179 179 ARG C C 176.200 0.20 1 1840 179 179 ARG CA C 55.400 0.20 1 1841 179 179 ARG CB C 31.000 0.20 1 1842 179 179 ARG CG C 27.200 0.20 1 1843 179 179 ARG CD C 43.600 0.20 1 1844 179 179 ARG N N 119.400 0.20 1 1845 179 179 ARG NE N 84.860 0.20 1 1846 180 180 LEU H H 9.000 0.02 1 1847 180 180 LEU HA H 4.449 0.02 1 1848 180 180 LEU HB2 H 1.649 0.02 2 1849 180 180 LEU HB3 H 1.192 0.02 2 1850 180 180 LEU C C 179.400 0.20 1 1851 180 180 LEU CA C 54.000 0.20 1 1852 180 180 LEU CB C 42.220 0.20 1 1853 180 180 LEU N N 124.200 0.20 1 1854 181 181 LEU H H 9.231 0.02 1 1855 181 181 LEU HA H 3.977 0.02 1 1856 181 181 LEU HB2 H 1.267 0.02 2 1857 181 181 LEU HB3 H 2.161 0.02 2 1858 181 181 LEU HG H 1.356 0.02 1 1859 181 181 LEU HD1 H 0.251 0.02 2 1860 181 181 LEU HD2 H -0.130 0.02 2 1861 181 181 LEU C C 180.700 0.20 1 1862 181 181 LEU CA C 59.950 0.20 1 1863 181 181 LEU CB C 41.427 0.20 1 1864 181 181 LEU CG C 25.900 0.20 1 1865 181 181 LEU CD1 C 22.800 0.20 2 1866 181 181 LEU CD2 C 25.060 0.20 2 1867 181 181 LEU N N 126.500 0.20 1 1868 182 182 TYR H H 9.260 0.02 1 1869 182 182 TYR HA H 4.072 0.02 1 1870 182 182 TYR HB2 H 2.751 0.02 2 1871 182 182 TYR HB3 H 3.009 0.02 2 1872 182 182 TYR HD1 H 6.720 0.02 3 1873 182 182 TYR C C 176.200 0.20 1 1874 182 182 TYR CA C 60.510 0.20 1 1875 182 182 TYR CB C 36.100 0.20 1 1876 182 182 TYR N N 116.107 0.20 1 1877 183 183 GLU H H 6.270 0.02 1 1878 183 183 GLU HA H 3.497 0.02 1 1879 183 183 GLU HB2 H 2.061 0.02 2 1880 183 183 GLU HB3 H 1.674 0.02 2 1881 183 183 GLU HG2 H 1.126 0.02 2 1882 183 183 GLU HG3 H 1.582 0.02 2 1883 183 183 GLU C C 179.400 0.20 1 1884 183 183 GLU CA C 58.450 0.20 1 1885 183 183 GLU CB C 29.940 0.20 1 1886 183 183 GLU CG C 37.720 0.20 1 1887 183 183 GLU N N 121.740 0.20 1 1888 184 184 ASN H H 7.485 0.02 1 1889 184 184 ASN HA H 4.351 0.02 1 1890 184 184 ASN HB2 H 2.905 0.02 2 1891 184 184 ASN HB3 H 2.494 0.02 2 1892 184 184 ASN HD21 H 7.053 0.02 2 1893 184 184 ASN HD22 H 6.700 0.02 2 1894 184 184 ASN C C 177.500 0.20 1 1895 184 184 ASN CA C 56.300 0.20 1 1896 184 184 ASN CB C 39.800 0.20 1 1897 184 184 ASN N N 117.400 0.20 1 1898 185 185 ILE H H 7.767 0.02 1 1899 185 185 ILE HA H 3.410 0.02 1 1900 185 185 ILE HB H 1.890 0.02 1 1901 185 185 ILE HG12 H 1.890 0.02 2 1902 185 185 ILE HG13 H 1.785 0.02 2 1903 185 185 ILE HG2 H 0.808 0.02 1 1904 185 185 ILE HD1 H 1.015 0.02 1 1905 185 185 ILE C C 179.000 0.20 1 1906 185 185 ILE CA C 64.834 0.20 1 1907 185 185 ILE CB C 38.300 0.20 1 1908 185 185 ILE CG1 C 28.158 0.20 1 1909 185 185 ILE CG2 C 16.945 0.20 1 1910 185 185 ILE CD1 C 15.561 0.20 1 1911 185 185 ILE N N 120.000 0.20 1 1912 186 186 ALA H H 8.325 0.02 1 1913 186 186 ALA HA H 4.010 0.02 1 1914 186 186 ALA HB H 1.322 0.02 1 1915 186 186 ALA C C 177.000 0.20 1 1916 186 186 ALA CA C 55.200 0.20 1 1917 186 186 ALA CB C 19.200 0.20 1 1918 186 186 ALA N N 123.300 0.20 1 1919 187 187 SER H H 6.902 0.02 1 1920 187 187 SER HA H 4.680 0.02 1 1921 187 187 SER HB2 H 3.920 0.02 2 1922 187 187 SER HB3 H 3.994 0.02 2 1923 187 187 SER C C 173.000 0.20 1 1924 187 187 SER CA C 57.100 0.20 1 1925 187 187 SER CB C 63.700 0.20 1 1926 187 187 SER N N 109.100 0.20 1 1927 188 188 SER H H 7.816 0.02 1 1928 188 188 SER HA H 5.177 0.02 1 1929 188 188 SER HB2 H 4.127 0.02 2 1930 188 188 SER HB3 H 4.156 0.02 2 1931 188 188 SER C C 173.600 0.20 1 1932 188 188 SER CA C 57.300 0.20 1 1933 188 188 SER CB C 66.400 0.20 1 1934 188 188 SER N N 119.600 0.20 1 1935 189 189 PRO HA H 4.559 0.02 1 1936 189 189 PRO HB2 H 1.204 0.02 2 1937 189 189 PRO HB3 H 2.238 0.02 2 1938 189 189 PRO HG2 H 2.013 0.02 2 1939 189 189 PRO HG3 H 1.795 0.02 2 1940 189 189 PRO HD2 H 3.661 0.02 2 1941 189 189 PRO HD3 H 3.978 0.02 2 1942 189 189 PRO C C 175.700 0.20 1 1943 189 189 PRO CA C 63.620 0.20 1 1944 189 189 PRO CB C 32.200 0.20 1 1945 189 189 PRO CG C 27.625 0.20 1 1946 189 189 PRO CD C 51.394 0.20 1 1947 190 190 ILE H H 7.344 0.02 1 1948 190 190 ILE HA H 3.237 0.02 1 1949 190 190 ILE HB H 1.500 0.02 1 1950 190 190 ILE HG12 H 1.293 0.02 2 1951 190 190 ILE HG13 H 0.898 0.02 2 1952 190 190 ILE HG2 H 0.700 0.02 1 1953 190 190 ILE HD1 H 0.671 0.02 1 1954 190 190 ILE C C 175.500 0.20 1 1955 190 190 ILE CA C 64.170 0.20 1 1956 190 190 ILE CB C 37.607 0.20 1 1957 190 190 ILE CG1 C 29.643 0.20 1 1958 190 190 ILE CG2 C 16.000 0.20 1 1959 190 190 ILE CD1 C 14.370 0.20 1 1960 190 190 ILE N N 116.367 0.20 1 1961 191 191 ILE H H 6.983 0.02 1 1962 191 191 ILE HA H 4.242 0.02 1 1963 191 191 ILE HB H 2.123 0.02 1 1964 191 191 ILE HG12 H 1.353 0.02 1 1965 191 191 ILE HG13 H 1.353 0.02 1 1966 191 191 ILE HG2 H 1.002 0.02 1 1967 191 191 ILE HD1 H 0.743 0.02 1 1968 191 191 ILE C C 175.700 0.20 1 1969 191 191 ILE CA C 58.820 0.20 1 1970 191 191 ILE CB C 38.560 0.20 1 1971 191 191 ILE CG1 C 28.600 0.20 1 1972 191 191 ILE CG2 C 17.689 0.20 1 1973 191 191 ILE CD1 C 9.932 0.20 1 1974 191 191 ILE N N 116.450 0.20 1 1975 192 192 LEU H H 8.112 0.02 1 1976 192 192 LEU HA H 4.289 0.02 1 1977 192 192 LEU HB2 H 1.389 0.02 2 1978 192 192 LEU HB3 H 1.510 0.02 2 1979 192 192 LEU HG H 1.691 0.02 1 1980 192 192 LEU HD1 H 0.894 0.02 2 1981 192 192 LEU HD2 H 0.821 0.02 2 1982 192 192 LEU C C 176.800 0.20 1 1983 192 192 LEU CA C 55.100 0.20 1 1984 192 192 LEU CB C 42.300 0.20 1 1985 192 192 LEU CG C 26.379 0.20 1 1986 192 192 LEU CD1 C 23.000 0.20 2 1987 192 192 LEU CD2 C 25.506 0.20 2 1988 192 192 LEU N N 121.760 0.20 1 1989 193 193 GLU H H 8.280 0.02 1 1990 193 193 GLU HA H 4.302 0.02 1 1991 193 193 GLU HB2 H 1.967 0.02 2 1992 193 193 GLU HB3 H 2.088 0.02 2 1993 193 193 GLU HG2 H 2.275 0.02 1 1994 193 193 GLU HG3 H 2.275 0.02 1 1995 193 193 GLU C C 176.700 0.20 1 1996 193 193 GLU CA C 56.400 0.20 1 1997 193 193 GLU CB C 30.397 0.20 1 1998 193 193 GLU CG C 36.300 0.20 1 1999 193 193 GLU N N 122.620 0.20 1 2000 194 194 GLU H H 8.520 0.02 1 2001 194 194 GLU HA H 4.293 0.02 1 2002 194 194 GLU HB2 H 2.081 0.02 2 2003 194 194 GLU HB3 H 1.987 0.02 2 2004 194 194 GLU HG2 H 2.304 0.02 1 2005 194 194 GLU HG3 H 2.304 0.02 1 2006 194 194 GLU C C 177.100 0.20 1 2007 194 194 GLU CA C 57.000 0.20 1 2008 194 194 GLU CB C 30.274 0.20 1 2009 194 194 GLU CG C 36.083 0.20 1 2010 194 194 GLU N N 123.478 0.20 1 2011 195 195 GLY H H 8.570 0.02 1 2012 195 195 GLY HA2 H 4.020 0.02 1 2013 195 195 GLY HA3 H 4.020 0.02 1 2014 195 195 GLY C C 174.500 0.20 1 2015 195 195 GLY CA C 45.500 0.20 1 2016 195 195 GLY N N 111.100 0.20 1 2017 196 196 SER H H 8.242 0.02 1 2018 196 196 SER HA H 4.541 0.02 1 2019 196 196 SER HB2 H 3.904 0.02 2 2020 196 196 SER HB3 H 3.957 0.02 2 2021 196 196 SER C C 175.000 0.20 1 2022 196 196 SER CA C 58.500 0.20 1 2023 196 196 SER CB C 64.068 0.20 1 2024 196 196 SER N N 116.300 0.20 1 2025 197 197 SER H H 8.509 0.02 1 2026 197 197 SER HA H 4.496 0.02 1 2027 197 197 SER HB2 H 3.906 0.02 2 2028 197 197 SER HB3 H 3.951 0.02 2 2029 197 197 SER C C 175.200 0.20 1 2030 197 197 SER CA C 58.900 0.20 1 2031 197 197 SER CB C 64.000 0.20 1 2032 197 197 SER N N 118.500 0.20 1 2033 198 198 GLY H H 8.471 0.02 1 2034 198 198 GLY HA2 H 4.008 0.02 1 2035 198 198 GLY HA3 H 4.008 0.02 1 2036 198 198 GLY C C 174.400 0.20 1 2037 198 198 GLY CA C 45.600 0.20 1 2038 198 198 GLY N N 111.250 0.20 1 2039 199 199 MET H H 8.282 0.02 1 2040 199 199 MET HA H 4.516 0.02 1 2041 199 199 MET HB2 H 2.041 0.02 2 2042 199 199 MET HB3 H 2.162 0.02 2 2043 199 199 MET HG2 H 2.638 0.02 2 2044 199 199 MET HG3 H 2.554 0.02 2 2045 199 199 MET HE H 2.105 0.02 1 2046 199 199 MET C C 177.000 0.20 1 2047 199 199 MET CA C 55.800 0.20 1 2048 199 199 MET CB C 32.829 0.20 1 2049 199 199 MET CG C 32.100 0.20 1 2050 199 199 MET CE C 17.000 0.20 1 2051 199 199 MET N N 120.360 0.20 1 2052 200 200 GLY H H 8.480 0.02 1 2053 200 200 GLY HA2 H 3.920 0.02 1 2054 200 200 GLY HA3 H 3.920 0.02 1 2055 200 200 GLY C C 173.900 0.20 1 2056 200 200 GLY CA C 45.400 0.20 1 2057 200 200 GLY N N 110.818 0.20 1 2058 201 201 ALA H H 8.140 0.02 1 2059 201 201 ALA HA H 4.286 0.02 1 2060 201 201 ALA HB H 1.255 0.02 1 2061 201 201 ALA C C 177.600 0.20 1 2062 201 201 ALA CA C 52.600 0.20 1 2063 201 201 ALA CB C 19.100 0.20 1 2064 201 201 ALA N N 124.350 0.20 1 2065 202 202 PHE H H 8.290 0.02 1 2066 202 202 PHE HA H 4.651 0.02 1 2067 202 202 PHE HB2 H 3.072 0.02 2 2068 202 202 PHE HB3 H 3.215 0.02 2 2069 202 202 PHE HD1 H 7.297 0.02 3 2070 202 202 PHE C C 176.500 0.20 1 2071 202 202 PHE CA C 57.700 0.20 1 2072 202 202 PHE CB C 39.400 0.20 1 2073 202 202 PHE N N 120.100 0.20 1 2074 203 203 GLY H H 8.363 0.02 1 2075 203 203 GLY HA2 H 3.947 0.02 1 2076 203 203 GLY HA3 H 3.947 0.02 1 2077 203 203 GLY C C 174.700 0.20 1 2078 203 203 GLY CA C 45.500 0.20 1 2079 203 203 GLY N N 111.500 0.20 1 2080 204 204 GLY H H 8.030 0.02 1 2081 204 204 GLY HA2 H 4.033 0.02 1 2082 204 204 GLY HA3 H 4.033 0.02 1 2083 204 204 GLY C C 174.400 0.20 1 2084 204 204 GLY CA C 45.200 0.20 1 2085 204 204 GLY N N 109.200 0.20 1 2086 205 205 SER H H 8.390 0.02 1 2087 205 205 SER HA H 4.529 0.02 1 2088 205 205 SER HB2 H 3.893 0.02 2 2089 205 205 SER HB3 H 3.945 0.02 2 2090 205 205 SER C C 175.200 0.20 1 2091 205 205 SER CA C 58.600 0.20 1 2092 205 205 SER CB C 64.100 0.20 1 2093 205 205 SER N N 116.300 0.20 1 2094 206 206 GLY H H 8.548 0.02 1 2095 206 206 GLY HA2 H 4.014 0.02 1 2096 206 206 GLY HA3 H 4.014 0.02 1 2097 206 206 GLY C C 173.700 0.20 1 2098 206 206 GLY CA C 45.390 0.20 1 2099 206 206 GLY N N 112.052 0.20 1 2100 207 207 GLY H H 7.980 0.02 1 2101 207 207 GLY HA2 H 3.780 0.02 1 2102 207 207 GLY HA3 H 3.780 0.02 1 2103 207 207 GLY C C 179.200 0.20 1 2104 207 207 GLY CA C 45.900 0.20 1 2105 207 207 GLY N N 115.900 0.20 1 stop_ save_