data_25138 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Chemical shift assignments of DRB4(1-153), a dsRNA binding protein in A. thaliana RNAi pathway ; _BMRB_accession_number 25138 _BMRB_flat_file_name bmr25138.str _Entry_type original _Submission_date 2014-08-09 _Accession_date 2014-08-09 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'DRB4 is a regulator of tasi and siRNA pathway in A. thaliana.' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Deshmukh 'Mandar V.' . . 2 Chiliveri 'Sai Chaitanya' . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 797 "13C chemical shifts" 559 "15N chemical shifts" 148 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2015-10-12 update BMRB 'update entry citation' 2014-10-14 original author 'original release' stop_ _Original_release_date 2015-10-12 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Chemical shift assignments of DRB4 (1-153), a dsRNA binding protein in A. thaliana RNAi pathway. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 25281003 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Chiliveri 'Sai Chaitanya' C. . 2 Deshmukh Mandar V. . stop_ _Journal_abbreviation 'Biomol NMR Assign' _Journal_name_full 'Biomolecular NMR assignments' _Journal_volume 9 _Journal_issue 2 _Journal_ISSN 1874-270X _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 253 _Page_last 256 _Year 2015 _Details . loop_ _Keyword 'Arabidopsis thaliana' DCL4 DRB4 RNAi dsRBD stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name DRB4(1-153) _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label DRB4(1-153) $DRB4(1-153) 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_DRB4(1-153) _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common DRB4(1-153) _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 153 _Mol_residue_sequence ; MDHVYKGQLQAYALQHNLEL PVYANEREGPPHAPRFRCNV TFCGQTFQSSEFFPTLKSAE HAAAKIAVASLTPQSPEGID VAYKNLLQEIAQKESSLLPF YATATSGPSHAPTFTSTVEF AGKVFSGEEAKTKKLAEMSA AKVAFMSIKNGNS ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ASP 3 HIS 4 VAL 5 TYR 6 LYS 7 GLY 8 GLN 9 LEU 10 GLN 11 ALA 12 TYR 13 ALA 14 LEU 15 GLN 16 HIS 17 ASN 18 LEU 19 GLU 20 LEU 21 PRO 22 VAL 23 TYR 24 ALA 25 ASN 26 GLU 27 ARG 28 GLU 29 GLY 30 PRO 31 PRO 32 HIS 33 ALA 34 PRO 35 ARG 36 PHE 37 ARG 38 CYS 39 ASN 40 VAL 41 THR 42 PHE 43 CYS 44 GLY 45 GLN 46 THR 47 PHE 48 GLN 49 SER 50 SER 51 GLU 52 PHE 53 PHE 54 PRO 55 THR 56 LEU 57 LYS 58 SER 59 ALA 60 GLU 61 HIS 62 ALA 63 ALA 64 ALA 65 LYS 66 ILE 67 ALA 68 VAL 69 ALA 70 SER 71 LEU 72 THR 73 PRO 74 GLN 75 SER 76 PRO 77 GLU 78 GLY 79 ILE 80 ASP 81 VAL 82 ALA 83 TYR 84 LYS 85 ASN 86 LEU 87 LEU 88 GLN 89 GLU 90 ILE 91 ALA 92 GLN 93 LYS 94 GLU 95 SER 96 SER 97 LEU 98 LEU 99 PRO 100 PHE 101 TYR 102 ALA 103 THR 104 ALA 105 THR 106 SER 107 GLY 108 PRO 109 SER 110 HIS 111 ALA 112 PRO 113 THR 114 PHE 115 THR 116 SER 117 THR 118 VAL 119 GLU 120 PHE 121 ALA 122 GLY 123 LYS 124 VAL 125 PHE 126 SER 127 GLY 128 GLU 129 GLU 130 ALA 131 LYS 132 THR 133 LYS 134 LYS 135 LEU 136 ALA 137 GLU 138 MET 139 SER 140 ALA 141 ALA 142 LYS 143 VAL 144 ALA 145 PHE 146 MET 147 SER 148 ILE 149 LYS 150 ASN 151 GLY 152 ASN 153 SER stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-25 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 DBJ BAG69145 "dsRNA-binding protein [Arabidopsis thaliana]" 100.00 329 100.00 100.00 2.85e-105 GB AAL67059 "unknown protein [Arabidopsis thaliana]" 100.00 355 100.00 100.00 5.42e-105 GB AAN13025 "unknown protein [Arabidopsis thaliana]" 100.00 355 100.00 100.00 5.79e-105 GB AEE80393 "double-stranded-RNA-binding protein 4 [Arabidopsis thaliana]" 100.00 355 100.00 100.00 5.79e-105 GB AEE80394 "double-stranded-RNA-binding protein 4 [Arabidopsis thaliana]" 100.00 355 100.00 100.00 5.79e-105 GB AEE80395 "double-stranded-RNA-binding protein 4 [Arabidopsis thaliana]" 100.00 329 100.00 100.00 2.85e-105 REF NP_001154686 "double-stranded-RNA-binding protein 4 [Arabidopsis thaliana]" 100.00 329 100.00 100.00 2.85e-105 REF NP_191839 "double-stranded-RNA-binding protein 4 [Arabidopsis thaliana]" 100.00 355 100.00 100.00 5.79e-105 REF NP_974480 "double-stranded-RNA-binding protein 4 [Arabidopsis thaliana]" 100.00 355 100.00 100.00 5.79e-105 SP Q8H1D4 "RecName: Full=Double-stranded RNA-binding protein 4; AltName: Full=dsRNA-binding protein 4; Short=AtDRB4" 100.00 355 100.00 100.00 5.79e-105 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $DRB4(1-153) 'Thale cress' 3702 Eukaryota Viridiplantae Arabidopsis thaliana 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 $DRB4(1-153) 'recombinant technology' . Escherichia coli . pET-30a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DRB4(1-153) 0.5 mM '[U-100% 15N]' 'Potassium phosphate buffer' 50 mM 'natural abundance' Na2SO4 100 mM 'natural abundance' DTT 4 mM 'natural abundance' stop_ save_ save_13C_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DRB4(1-153) 0.5 mM '[U-100% 13C; U-100% 15N]' 'Potassium phosphate buffer' 50 mM 'natural abundance' Na2SO4 100 mM 'natural abundance' DTT 4 mM 'natural abundance' stop_ save_ save_10_13C _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DRB4(1-153) 0.5 mM '[U-10% 13C; U-100% 15N]' 'Potassium phosphate buffer' 50 mM 'natural abundance' Na2SO4 100 mM 'natural abundance' DTT 4 mM 'natural abundance' stop_ save_ save_15N_D2O _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DRB4(1-153) 0.5 mM '[U-100% 15N]' 'Potassium phosphate buffer' 50 mM 'natural abundance' Na2SO4 100 mM 'natural abundance' DTT 4 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1.6 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection processing stop_ _Details . save_ save_CARA _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . 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 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $15N save_ save_3D_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $13C_15N save_ save_3D_HN(CA)CO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $13C_15N save_ save_3D_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $13C_15N save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $13C_15N save_ save_3D_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $13C_15N save_ save_3D_HN(CO)CACB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CACB' _Sample_label $13C_15N save_ save_2D_1H-13C_HSQC_8 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $13C_15N save_ save_3D_H(CCO)NH-TOCSY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH-TOCSY' _Sample_label $13C_15N save_ save_3D_(H)C(CO)NH-TOCSY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D (H)C(CO)NH-TOCSY' _Sample_label $13C_15N save_ save_3D_HCCH-TOCSY_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $13C_15N save_ save_3D_HNHA_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $13C_15N save_ save_3D_HNHB_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHB' _Sample_label $13C_15N save_ save_2D_1H-15N_HSQC_14 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $15N_D2O save_ save_2D_1H-13C_HSQC_15 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $10_13C save_ save_2D_1H-1H_TOCSY_16 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $15N_D2O save_ save_2D_1H-1H_NOESY_17 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $15N_D2O save_ save_3D_1H-15N_NOESY_18 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $15N save_ save_3D_1H-13C_NOESY_19 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $13C_15N 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' 0.15 . M pH 7.2 . 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 water H 1 protons ppm 4.705 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 HNCO' '3D HN(CA)CO' '3D HNCA' '3D HN(CO)CA' '3D HNCACB' '3D HN(CO)CACB' '2D 1H-13C HSQC' '3D H(CCO)NH-TOCSY' '3D (H)C(CO)NH-TOCSY' '3D HCCH-TOCSY' '3D HNHA' '3D HNHB' '2D 1H-1H TOCSY' '2D 1H-1H NOESY' '3D 1H-15N NOESY' '3D 1H-13C NOESY' stop_ loop_ _Sample_label $15N $13C_15N $15N_D2O $10_13C stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name DRB4(1-153) _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 3 3 HIS HA H 3.68 0.02 1 2 3 3 HIS HB2 H 2.58 0.02 2 3 3 3 HIS HB3 H 2.20 0.02 2 4 3 3 HIS C C 175.9 0.3 1 5 3 3 HIS CA C 54.1 0.3 1 6 3 3 HIS CB C 28.2 0.3 1 7 4 4 VAL H H 6.86 0.02 1 8 4 4 VAL HA H 4.37 0.02 1 9 4 4 VAL HB H 1.99 0.02 1 10 4 4 VAL HG1 H 0.48 0.02 1 11 4 4 VAL HG2 H -0.17 0.02 1 12 4 4 VAL C C 177.1 0.3 1 13 4 4 VAL CA C 60.4 0.3 1 14 4 4 VAL CB C 32.7 0.3 1 15 4 4 VAL CG1 C 20.7 0.3 1 16 4 4 VAL CG2 C 16.6 0.3 1 17 4 4 VAL N N 111.8 0.3 1 18 5 5 TYR H H 8.26 0.02 1 19 5 5 TYR HA H 4.19 0.02 1 20 5 5 TYR HB2 H 3.09 0.02 2 21 5 5 TYR HB3 H 2.75 0.02 2 22 5 5 TYR HD1 H 6.94 0.02 3 23 5 5 TYR HD2 H 7.01 0.02 3 24 5 5 TYR C C 177.9 0.3 1 25 5 5 TYR CA C 62.3 0.3 1 26 5 5 TYR CB C 39.6 0.3 1 27 5 5 TYR N N 123.6 0.3 1 28 6 6 LYS H H 8.48 0.02 1 29 6 6 LYS C C 180.5 0.3 1 30 6 6 LYS CA C 60.6 0.3 1 31 6 6 LYS CB C 31.6 0.3 1 32 6 6 LYS N N 121.2 0.3 1 33 7 7 GLY H H 8.70 0.02 1 34 7 7 GLY HA2 H 3.71 0.02 2 35 7 7 GLY HA3 H 3.78 0.02 2 36 7 7 GLY C C 176.5 0.3 1 37 7 7 GLY CA C 46.5 0.3 1 38 7 7 GLY N N 108.8 0.3 1 39 8 8 GLN H H 7.29 0.02 1 40 8 8 GLN HA H 4.03 0.02 1 41 8 8 GLN HB2 H 2.08 0.02 2 42 8 8 GLN HB3 H 2.19 0.02 2 43 8 8 GLN HG2 H 2.48 0.02 1 44 8 8 GLN HG3 H 2.48 0.02 1 45 8 8 GLN HE21 H 6.94 0.02 1 46 8 8 GLN HE22 H 6.45 0.02 1 47 8 8 GLN C C 178.9 0.3 1 48 8 8 GLN CA C 58.8 0.3 1 49 8 8 GLN CB C 28.5 0.3 1 50 8 8 GLN CG C 33.7 0.3 1 51 8 8 GLN N N 122.9 0.3 1 52 8 8 GLN NE2 N 109.6 0.3 1 53 9 9 LEU H H 7.73 0.02 1 54 9 9 LEU HA H 3.80 0.02 1 55 9 9 LEU HB2 H 1.22 0.02 2 56 9 9 LEU HB3 H 1.45 0.02 2 57 9 9 LEU HG H 0.99 0.02 1 58 9 9 LEU HD1 H 0.18 0.02 1 59 9 9 LEU HD2 H 0.37 0.02 1 60 9 9 LEU C C 177.4 0.3 1 61 9 9 LEU CA C 57.1 0.3 1 62 9 9 LEU CB C 41.0 0.3 1 63 9 9 LEU CG C 26.1 0.3 1 64 9 9 LEU CD1 C 23.0 0.3 1 65 9 9 LEU CD2 C 24.8 0.3 1 66 9 9 LEU N N 121.7 0.3 1 67 10 10 GLN H H 7.75 0.02 1 68 10 10 GLN HA H 3.63 0.02 1 69 10 10 GLN HB2 H 2.05 0.02 1 70 10 10 GLN HB3 H 2.05 0.02 1 71 10 10 GLN HG2 H 1.44 0.02 1 72 10 10 GLN HG3 H 1.44 0.02 1 73 10 10 GLN HE21 H 7.11 0.02 1 74 10 10 GLN HE22 H 6.64 0.02 1 75 10 10 GLN C C 176.9 0.3 1 76 10 10 GLN CA C 59.5 0.3 1 77 10 10 GLN CB C 28.3 0.3 1 78 10 10 GLN CG C 33.4 0.3 1 79 10 10 GLN N N 119.0 0.3 1 80 10 10 GLN NE2 N 111.7 0.3 1 81 11 11 ALA H H 8.09 0.02 1 82 11 11 ALA HA H 3.84 0.02 1 83 11 11 ALA HB H 1.40 0.02 1 84 11 11 ALA C C 180.0 0.3 1 85 11 11 ALA CA C 55.0 0.3 1 86 11 11 ALA CB C 17.6 0.3 1 87 11 11 ALA N N 120.6 0.3 1 88 12 12 TYR H H 7.75 0.02 1 89 12 12 TYR HA H 4.13 0.02 1 90 12 12 TYR HB2 H 3.14 0.02 2 91 12 12 TYR HB3 H 3.08 0.02 2 92 12 12 TYR HD1 H 7.04 0.02 1 93 12 12 TYR HD2 H 7.04 0.02 1 94 12 12 TYR HE1 H 7.04 0.02 1 95 12 12 TYR HE2 H 7.04 0.02 1 96 12 12 TYR C C 177.7 0.3 1 97 12 12 TYR CA C 61.9 0.3 1 98 12 12 TYR CB C 38.3 0.3 1 99 12 12 TYR N N 120.8 0.3 1 100 13 13 ALA H H 8.26 0.02 1 101 13 13 ALA HA H 4.10 0.02 1 102 13 13 ALA HB H 1.67 0.02 1 103 13 13 ALA C C 179.5 0.3 1 104 13 13 ALA CA C 55.8 0.3 1 105 13 13 ALA CB C 18.0 0.3 1 106 13 13 ALA N N 122.2 0.3 1 107 14 14 LEU H H 8.25 0.02 1 108 14 14 LEU HA H 4.09 0.02 1 109 14 14 LEU HB2 H 1.46 0.02 1 110 14 14 LEU HB3 H 1.46 0.02 1 111 14 14 LEU HG H 1.77 0.02 1 112 14 14 LEU HD1 H 0.84 0.02 1 113 14 14 LEU HD2 H 0.84 0.02 1 114 14 14 LEU C C 180.6 0.3 1 115 14 14 LEU CA C 57.3 0.3 1 116 14 14 LEU CB C 41.5 0.3 1 117 14 14 LEU CG C 26.6 0.3 1 118 14 14 LEU CD1 C 22.8 0.3 1 119 14 14 LEU CD2 C 25.1 0.3 1 120 14 14 LEU N N 117.6 0.3 1 121 15 15 GLN H H 8.11 0.02 1 122 15 15 GLN HA H 3.79 0.02 1 123 15 15 GLN HB2 H 1.59 0.02 2 124 15 15 GLN HB3 H 1.69 0.02 2 125 15 15 GLN HG2 H 1.92 0.02 1 126 15 15 GLN HG3 H 1.92 0.02 1 127 15 15 GLN C C 176.7 0.3 1 128 15 15 GLN CA C 58.0 0.3 1 129 15 15 GLN CB C 28.1 0.3 1 130 15 15 GLN CG C 32.9 0.3 1 131 15 15 GLN N N 120.0 0.3 1 132 16 16 HIS H H 7.25 0.02 1 133 16 16 HIS HA H 4.46 0.02 1 134 16 16 HIS HB2 H 3.19 0.02 2 135 16 16 HIS HB3 H 2.32 0.02 2 136 16 16 HIS C C 173.1 0.3 1 137 16 16 HIS CA C 55.9 0.3 1 138 16 16 HIS CB C 29.5 0.3 1 139 16 16 HIS N N 114.2 0.3 1 140 17 17 ASN H H 7.63 0.02 1 141 17 17 ASN HA H 4.33 0.02 1 142 17 17 ASN HB2 H 2.65 0.02 2 143 17 17 ASN HB3 H 3.00 0.02 2 144 17 17 ASN C C 173.8 0.3 1 145 17 17 ASN CA C 54.3 0.3 1 146 17 17 ASN CB C 36.6 0.3 1 147 17 17 ASN N N 118.2 0.3 1 148 18 18 LEU H H 8.53 0.02 1 149 18 18 LEU HA H 4.55 0.02 1 150 18 18 LEU HB2 H 1.57 0.02 1 151 18 18 LEU HB3 H 1.57 0.02 1 152 18 18 LEU HG H 1.47 0.02 1 153 18 18 LEU HD1 H 0.84 0.02 1 154 18 18 LEU HD2 H 0.75 0.02 1 155 18 18 LEU C C 176.4 0.3 1 156 18 18 LEU CA C 52.8 0.3 1 157 18 18 LEU CB C 44.2 0.3 1 158 18 18 LEU CG C 26.5 0.3 1 159 18 18 LEU CD1 C 22.0 0.3 1 160 18 18 LEU CD2 C 22.2 0.3 1 161 18 18 LEU N N 119.5 0.3 1 162 19 19 GLU H H 8.07 0.02 1 163 19 19 GLU HA H 4.01 0.02 1 164 19 19 GLU HB2 H 1.95 0.02 2 165 19 19 GLU HB3 H 1.86 0.02 2 166 19 19 GLU HG2 H 2.30 0.02 1 167 19 19 GLU HG3 H 2.30 0.02 1 168 19 19 GLU C C 176.6 0.3 1 169 19 19 GLU CA C 56.7 0.3 1 170 19 19 GLU CB C 29.3 0.3 1 171 19 19 GLU CG C 36.5 0.3 1 172 19 19 GLU N N 120.6 0.3 1 173 20 20 LEU H H 8.18 0.02 1 174 20 20 LEU HA H 4.37 0.02 1 175 20 20 LEU HB2 H 1.67 0.02 1 176 20 20 LEU HB3 H 1.67 0.02 1 177 20 20 LEU HD1 H 0.92 0.02 1 178 20 20 LEU HD2 H 0.92 0.02 1 179 20 20 LEU C C 175.5 0.3 1 180 20 20 LEU CA C 54.0 0.3 1 181 20 20 LEU CB C 39.4 0.3 1 182 20 20 LEU N N 122.5 0.3 1 183 21 21 PRO HA H 4.63 0.02 1 184 21 21 PRO HB2 H 1.89 0.02 1 185 21 21 PRO HB3 H 1.89 0.02 1 186 21 21 PRO HG2 H 1.85 0.02 1 187 21 21 PRO HG3 H 1.85 0.02 1 188 21 21 PRO HD2 H 3.56 0.02 2 189 21 21 PRO HD3 H 3.59 0.02 2 190 21 21 PRO C C 175.0 0.3 1 191 21 21 PRO CA C 62.4 0.3 1 192 21 21 PRO CB C 32.7 0.3 1 193 21 21 PRO CG C 27.2 0.3 1 194 21 21 PRO CD C 49.8 0.3 1 195 22 22 VAL H H 7.97 0.02 1 196 22 22 VAL HA H 4.30 0.02 1 197 22 22 VAL HB H 1.74 0.02 1 198 22 22 VAL HG1 H 0.84 0.02 1 199 22 22 VAL HG2 H 0.92 0.02 1 200 22 22 VAL C C 175.5 0.3 1 201 22 22 VAL CA C 61.3 0.3 1 202 22 22 VAL CB C 34.5 0.3 1 203 22 22 VAL CG1 C 20.8 0.3 1 204 22 22 VAL CG2 C 20.8 0.3 1 205 22 22 VAL N N 121.0 0.3 1 206 23 23 TYR H H 9.24 0.02 1 207 23 23 TYR HA H 4.82 0.02 1 208 23 23 TYR HB2 H 2.77 0.02 1 209 23 23 TYR HB3 H 2.77 0.02 1 210 23 23 TYR HD1 H 6.88 0.02 1 211 23 23 TYR HD2 H 6.88 0.02 1 212 23 23 TYR HE1 H 6.88 0.02 1 213 23 23 TYR HE2 H 6.88 0.02 1 214 23 23 TYR C C 174.7 0.3 1 215 23 23 TYR CA C 58.1 0.3 1 216 23 23 TYR CB C 40.0 0.3 1 217 23 23 TYR N N 131.0 0.3 1 218 24 24 ALA H H 8.70 0.02 1 219 24 24 ALA HA H 4.73 0.02 1 220 24 24 ALA HB H 1.35 0.02 1 221 24 24 ALA C C 175.6 0.3 1 222 24 24 ALA CA C 51.2 0.3 1 223 24 24 ALA CB C 21.4 0.3 1 224 24 24 ALA N N 127.2 0.3 1 225 25 25 ASN H H 8.78 0.02 1 226 25 25 ASN HA H 5.68 0.02 1 227 25 25 ASN HB2 H 2.62 0.02 2 228 25 25 ASN HB3 H 2.44 0.02 2 229 25 25 ASN HD21 H 7.66 0.02 1 230 25 25 ASN HD22 H 6.81 0.02 1 231 25 25 ASN C C 173.5 0.3 1 232 25 25 ASN CA C 52.2 0.3 1 233 25 25 ASN CB C 44.6 0.3 1 234 25 25 ASN N N 117.0 0.3 1 235 25 25 ASN ND2 N 116.4 0.3 1 236 26 26 GLU H H 8.88 0.02 1 237 26 26 GLU HA H 4.59 0.02 1 238 26 26 GLU HB2 H 1.91 0.02 1 239 26 26 GLU HB3 H 1.91 0.02 1 240 26 26 GLU HG2 H 2.18 0.02 1 241 26 26 GLU HG3 H 2.18 0.02 1 242 26 26 GLU C C 173.8 0.3 1 243 26 26 GLU CA C 54.7 0.3 1 244 26 26 GLU CB C 33.5 0.3 1 245 26 26 GLU CG C 36.2 0.3 1 246 26 26 GLU N N 121.3 0.3 1 247 27 27 ARG H H 8.48 0.02 1 248 27 27 ARG HA H 5.28 0.02 1 249 27 27 ARG HB2 H 1.51 0.02 1 250 27 27 ARG HB3 H 1.51 0.02 1 251 27 27 ARG HG2 H 1.15 0.02 2 252 27 27 ARG HG3 H 0.99 0.02 2 253 27 27 ARG HD2 H 2.96 0.02 2 254 27 27 ARG HD3 H 2.91 0.02 2 255 27 27 ARG C C 175.3 0.3 1 256 27 27 ARG CA C 53.9 0.3 1 257 27 27 ARG CB C 33.0 0.3 1 258 27 27 ARG CG C 26.2 0.3 1 259 27 27 ARG CD C 43.4 0.3 1 260 27 27 ARG N N 123.4 0.3 1 261 28 28 GLU H H 8.74 0.02 1 262 28 28 GLU HA H 4.53 0.02 1 263 28 28 GLU HB2 H 1.36 0.02 1 264 28 28 GLU HB3 H 1.36 0.02 1 265 28 28 GLU HG2 H 1.71 0.02 2 266 28 28 GLU HG3 H 1.83 0.02 2 267 28 28 GLU C C 174.8 0.3 1 268 28 28 GLU CA C 54.3 0.3 1 269 28 28 GLU CB C 33.1 0.3 1 270 28 28 GLU CG C 35.5 0.3 1 271 28 28 GLU N N 125.4 0.3 1 272 29 29 GLY H H 8.14 0.02 1 273 29 29 GLY HA2 H 4.26 0.02 2 274 29 29 GLY HA3 H 3.61 0.02 2 275 29 29 GLY C C 171.0 0.3 1 276 29 29 GLY CA C 43.6 0.3 1 277 29 29 GLY N N 107.9 0.3 1 278 31 31 PRO HA H 3.97 0.02 1 279 31 31 PRO HB2 H 2.25 0.02 2 280 31 31 PRO HB3 H 2.08 0.02 2 281 31 31 PRO HG2 H 1.95 0.02 2 282 31 31 PRO HG3 H 1.88 0.02 2 283 31 31 PRO HD2 H 3.72 0.02 2 284 31 31 PRO HD3 H 3.68 0.02 2 285 31 31 PRO C C 177.2 0.3 1 286 31 31 PRO CA C 65.1 0.3 1 287 31 31 PRO CB C 31.5 0.3 1 288 31 31 PRO CG C 27.5 0.3 1 289 32 32 HIS H H 7.35 0.02 1 290 32 32 HIS HA H 4.52 0.02 1 291 32 32 HIS HB2 H 3.24 0.02 2 292 32 32 HIS HB3 H 2.87 0.02 2 293 32 32 HIS C C 175.1 0.3 1 294 32 32 HIS CA C 55.7 0.3 1 295 32 32 HIS CB C 30.0 0.3 1 296 32 32 HIS N N 110.4 0.3 1 297 33 33 ALA H H 7.24 0.02 1 298 33 33 ALA HA H 4.53 0.02 1 299 33 33 ALA HB H 0.87 0.02 1 300 33 33 ALA C C 175.1 0.3 1 301 33 33 ALA CA C 50.5 0.3 1 302 33 33 ALA CB C 18.3 0.3 1 303 33 33 ALA N N 125.9 0.3 1 304 34 34 PRO HA H 4.31 0.02 1 305 34 34 PRO HB2 H 1.71 0.02 1 306 34 34 PRO HB3 H 1.71 0.02 1 307 34 34 PRO HG2 H 1.20 0.02 1 308 34 34 PRO HG3 H 1.20 0.02 1 309 34 34 PRO HD2 H 3.38 0.02 2 310 34 34 PRO HD3 H 3.29 0.02 2 311 34 34 PRO C C 175.7 0.3 1 312 34 34 PRO CA C 62.6 0.3 1 313 34 34 PRO CB C 32.2 0.3 1 314 34 34 PRO CG C 26.6 0.3 1 315 34 34 PRO CD C 49.3 0.3 1 316 35 35 ARG H H 8.14 0.02 1 317 35 35 ARG HA H 4.74 0.02 1 318 35 35 ARG HB2 H 1.33 0.02 1 319 35 35 ARG HB3 H 1.33 0.02 1 320 35 35 ARG HG2 H 1.24 0.02 1 321 35 35 ARG HG3 H 1.24 0.02 1 322 35 35 ARG HD2 H 2.62 0.02 2 323 35 35 ARG HD3 H 2.85 0.02 2 324 35 35 ARG C C 174.6 0.3 1 325 35 35 ARG CA C 54.1 0.3 1 326 35 35 ARG CB C 33.1 0.3 1 327 35 35 ARG CG C 26.7 0.3 1 328 35 35 ARG CD C 43.2 0.3 1 329 35 35 ARG N N 117.1 0.3 1 330 36 36 PHE H H 9.42 0.02 1 331 36 36 PHE HA H 5.70 0.02 1 332 36 36 PHE HB2 H 2.70 0.02 1 333 36 36 PHE HB3 H 2.70 0.02 1 334 36 36 PHE HD1 H 6.91 0.02 1 335 36 36 PHE HD2 H 6.91 0.02 1 336 36 36 PHE HE1 H 6.91 0.02 1 337 36 36 PHE HE2 H 6.91 0.02 1 338 36 36 PHE C C 174.7 0.3 1 339 36 36 PHE CA C 57.2 0.3 1 340 36 36 PHE CB C 43.9 0.3 1 341 36 36 PHE N N 119.0 0.3 1 342 37 37 ARG H H 8.78 0.02 1 343 37 37 ARG HA H 4.97 0.02 1 344 37 37 ARG HG2 H 0.92 0.02 2 345 37 37 ARG HG3 H 0.96 0.02 2 346 37 37 ARG HD2 H 2.93 0.02 2 347 37 37 ARG HD3 H 2.88 0.02 2 348 37 37 ARG C C 176.0 0.3 1 349 37 37 ARG CA C 55.1 0.3 1 350 37 37 ARG CB C 34.0 0.3 1 351 37 37 ARG CG C 25.9 0.3 1 352 37 37 ARG CD C 43.9 0.3 1 353 37 37 ARG N N 122.9 0.3 1 354 38 38 CYS H H 9.34 0.02 1 355 38 38 CYS HA H 5.59 0.02 1 356 38 38 CYS HB2 H 2.95 0.02 2 357 38 38 CYS HB3 H 2.59 0.02 2 358 38 38 CYS C C 172.8 0.3 1 359 38 38 CYS CA C 58.2 0.3 1 360 38 38 CYS CB C 31.5 0.3 1 361 38 38 CYS N N 126.0 0.3 1 362 39 39 ASN H H 8.56 0.02 1 363 39 39 ASN HA H 5.32 0.02 1 364 39 39 ASN HB2 H 2.47 0.02 1 365 39 39 ASN HB3 H 2.47 0.02 1 366 39 39 ASN HD21 H 7.30 0.02 1 367 39 39 ASN HD22 H 6.69 0.02 1 368 39 39 ASN C C 172.8 0.3 1 369 39 39 ASN CA C 50.9 0.3 1 370 39 39 ASN CB C 42.4 0.3 1 371 39 39 ASN N N 118.7 0.3 1 372 39 39 ASN ND2 N 115.7 0.3 1 373 40 40 VAL H H 8.80 0.02 1 374 40 40 VAL HA H 4.91 0.02 1 375 40 40 VAL HB H 1.48 0.02 1 376 40 40 VAL HG1 H 0.66 0.02 1 377 40 40 VAL HG2 H -0.09 0.02 1 378 40 40 VAL C C 172.6 0.3 1 379 40 40 VAL CA C 58.1 0.3 1 380 40 40 VAL CB C 34.9 0.3 1 381 40 40 VAL CG1 C 20.8 0.3 1 382 40 40 VAL CG2 C 22.5 0.3 1 383 40 40 VAL N N 119.1 0.3 1 384 41 41 THR H H 8.86 0.02 1 385 41 41 THR HA H 5.36 0.02 1 386 41 41 THR HB H 3.76 0.02 1 387 41 41 THR HG2 H 0.89 0.02 1 388 41 41 THR C C 174.2 0.3 1 389 41 41 THR CA C 61.4 0.3 1 390 41 41 THR CB C 69.5 0.3 1 391 41 41 THR CG2 C 20.0 0.3 1 392 41 41 THR N N 126.8 0.3 1 393 42 42 PHE H H 9.40 0.02 1 394 42 42 PHE HA H 4.90 0.02 1 395 42 42 PHE HB2 H 2.97 0.02 2 396 42 42 PHE HB3 H 2.62 0.02 2 397 42 42 PHE HD1 H 7.10 0.02 1 398 42 42 PHE HD2 H 7.10 0.02 1 399 42 42 PHE HE1 H 7.10 0.02 1 400 42 42 PHE HE2 H 7.10 0.02 1 401 42 42 PHE C C 173.5 0.3 1 402 42 42 PHE CA C 56.5 0.3 1 403 42 42 PHE CB C 42.1 0.3 1 404 42 42 PHE N N 129.0 0.3 1 405 43 43 CYS H H 9.26 0.02 1 406 43 43 CYS HA H 3.59 0.02 1 407 43 43 CYS HB2 H 2.79 0.02 2 408 43 43 CYS HB3 H 2.29 0.02 2 409 43 43 CYS C C 174.8 0.3 1 410 43 43 CYS CA C 60.6 0.3 1 411 43 43 CYS CB C 25.2 0.3 1 412 43 43 CYS N N 126.0 0.3 1 413 44 44 GLY H H 8.66 0.02 1 414 44 44 GLY HA2 H 3.88 0.02 2 415 44 44 GLY HA3 H 3.42 0.02 2 416 44 44 GLY C C 173.1 0.3 1 417 44 44 GLY CA C 45.2 0.3 1 418 44 44 GLY N N 104.8 0.3 1 419 45 45 GLN H H 7.53 0.02 1 420 45 45 GLN HA H 4.36 0.02 1 421 45 45 GLN HB2 H 1.41 0.02 1 422 45 45 GLN HB3 H 1.41 0.02 1 423 45 45 GLN HG2 H 1.75 0.02 2 424 45 45 GLN HG3 H 1.85 0.02 2 425 45 45 GLN C C 173.0 0.3 1 426 45 45 GLN CA C 53.7 0.3 1 427 45 45 GLN CB C 32.2 0.3 1 428 45 45 GLN CG C 33.5 0.3 1 429 45 45 GLN N N 120.7 0.3 1 430 46 46 THR H H 8.29 0.02 1 431 46 46 THR HA H 4.77 0.02 1 432 46 46 THR HB H 3.55 0.02 1 433 46 46 THR HG2 H 0.85 0.02 1 434 46 46 THR C C 173.2 0.3 1 435 46 46 THR CA C 61.9 0.3 1 436 46 46 THR CB C 69.7 0.3 1 437 46 46 THR CG2 C 21.6 0.3 1 438 46 46 THR N N 119.0 0.3 1 439 47 47 PHE H H 9.38 0.02 1 440 47 47 PHE HA H 4.54 0.02 1 441 47 47 PHE HB2 H 2.90 0.02 2 442 47 47 PHE HB3 H 2.66 0.02 2 443 47 47 PHE HD1 H 7.13 0.02 1 444 47 47 PHE HD2 H 7.13 0.02 1 445 47 47 PHE HE1 H 7.13 0.02 1 446 47 47 PHE HE2 H 7.13 0.02 1 447 47 47 PHE C C 173.9 0.3 1 448 47 47 PHE CA C 56.6 0.3 1 449 47 47 PHE CB C 38.8 0.3 1 450 47 47 PHE N N 128.8 0.3 1 451 48 48 GLN H H 8.92 0.02 1 452 48 48 GLN HA H 4.44 0.02 1 453 48 48 GLN HB2 H 2.11 0.02 2 454 48 48 GLN HB3 H 1.83 0.02 2 455 48 48 GLN HE21 H 7.79 0.02 1 456 48 48 GLN HE22 H 7.25 0.02 1 457 48 48 GLN C C 174.9 0.3 1 458 48 48 GLN CA C 54.2 0.3 1 459 48 48 GLN CB C 32.0 0.3 1 460 48 48 GLN N N 124.8 0.3 1 461 48 48 GLN NE2 N 116.9 0.3 1 462 49 49 SER H H 7.95 0.02 1 463 49 49 SER C C 175.2 0.3 1 464 49 49 SER CA C 57.5 0.3 1 465 49 49 SER CB C 63.3 0.3 1 466 49 49 SER N N 120.3 0.3 1 467 50 50 SER HA H 4.41 0.02 1 468 50 50 SER HB2 H 3.94 0.02 2 469 50 50 SER HB3 H 3.84 0.02 2 470 50 50 SER C C 174.3 0.3 1 471 50 50 SER CA C 59.1 0.3 1 472 50 50 SER CB C 63.7 0.3 1 473 51 51 GLU H H 7.71 0.02 1 474 51 51 GLU HA H 4.30 0.02 1 475 51 51 GLU HB2 H 1.65 0.02 1 476 51 51 GLU HB3 H 1.65 0.02 1 477 51 51 GLU HG2 H 2.02 0.02 1 478 51 51 GLU HG3 H 2.02 0.02 1 479 51 51 GLU C C 173.4 0.3 1 480 51 51 GLU CA C 55.4 0.3 1 481 51 51 GLU CB C 32.6 0.3 1 482 51 51 GLU CG C 36.6 0.3 1 483 51 51 GLU N N 123.3 0.3 1 484 52 52 PHE H H 8.10 0.02 1 485 52 52 PHE HA H 5.03 0.02 1 486 52 52 PHE HB2 H 2.66 0.02 2 487 52 52 PHE HB3 H 2.55 0.02 2 488 52 52 PHE HD1 H 6.88 0.02 1 489 52 52 PHE HD2 H 6.88 0.02 1 490 52 52 PHE HE1 H 6.88 0.02 1 491 52 52 PHE HE2 H 6.88 0.02 1 492 52 52 PHE C C 176.4 0.3 1 493 52 52 PHE CA C 56.7 0.3 1 494 52 52 PHE CB C 41.7 0.3 1 495 52 52 PHE N N 117.9 0.3 1 496 53 53 PHE H H 9.70 0.02 1 497 53 53 PHE HA H 4.86 0.02 1 498 53 53 PHE HB2 H 3.30 0.02 1 499 53 53 PHE HB3 H 3.30 0.02 1 500 53 53 PHE HD1 H 7.29 0.02 1 501 53 53 PHE HD2 H 7.29 0.02 1 502 53 53 PHE HE1 H 7.29 0.02 1 503 53 53 PHE HE2 H 7.29 0.02 1 504 53 53 PHE C C 175.2 0.3 1 505 53 53 PHE CA C 56.2 0.3 1 506 53 53 PHE CB C 43.0 0.3 1 507 53 53 PHE N N 119.3 0.3 1 508 54 54 PRO HA H 4.89 0.02 1 509 54 54 PRO HB2 H 2.41 0.02 1 510 54 54 PRO HB3 H 2.41 0.02 1 511 54 54 PRO HG2 H 2.21 0.02 1 512 54 54 PRO HG3 H 2.21 0.02 1 513 54 54 PRO HD2 H 3.68 0.02 1 514 54 54 PRO HD3 H 3.68 0.02 1 515 54 54 PRO C C 175.9 0.3 1 516 54 54 PRO CA C 63.9 0.3 1 517 54 54 PRO CB C 32.4 0.3 1 518 54 54 PRO CG C 27.1 0.3 1 519 55 55 THR H H 7.03 0.02 1 520 55 55 THR HA H 4.61 0.02 1 521 55 55 THR HB H 4.28 0.02 1 522 55 55 THR HG2 H 1.21 0.02 1 523 55 55 THR C C 173.0 0.3 1 524 55 55 THR CA C 58.3 0.3 1 525 55 55 THR CB C 72.0 0.3 1 526 55 55 THR CG2 C 21.6 0.3 1 527 55 55 THR N N 104.8 0.3 1 528 56 56 LEU H H 8.12 0.02 1 529 56 56 LEU HA H 3.31 0.02 1 530 56 56 LEU HB2 H 1.05 0.02 2 531 56 56 LEU HB3 H 0.07 0.02 2 532 56 56 LEU HG H 0.87 0.02 1 533 56 56 LEU HD1 H 0.53 0.02 1 534 56 56 LEU HD2 H 0.47 0.02 1 535 56 56 LEU C C 177.8 0.3 1 536 56 56 LEU CA C 56.9 0.3 1 537 56 56 LEU CB C 40.0 0.3 1 538 56 56 LEU CG C 26.3 0.3 1 539 56 56 LEU CD1 C 22.8 0.3 1 540 56 56 LEU CD2 C 24.9 0.3 1 541 56 56 LEU N N 126.7 0.3 1 542 57 57 LYS H H 8.05 0.02 1 543 57 57 LYS HA H 3.76 0.02 1 544 57 57 LYS HB2 H 1.62 0.02 1 545 57 57 LYS HB3 H 1.62 0.02 1 546 57 57 LYS HG2 H 0.84 0.02 1 547 57 57 LYS HG3 H 0.84 0.02 1 548 57 57 LYS HD2 H 1.41 0.02 1 549 57 57 LYS HD3 H 1.41 0.02 1 550 57 57 LYS HE2 H 2.75 0.02 1 551 57 57 LYS HE3 H 2.75 0.02 1 552 57 57 LYS C C 178.8 0.3 1 553 57 57 LYS CA C 59.3 0.3 1 554 57 57 LYS CB C 32.1 0.3 1 555 57 57 LYS CG C 24.6 0.3 1 556 57 57 LYS CD C 28.8 0.3 1 557 57 57 LYS CE C 43.9 0.3 1 558 57 57 LYS N N 118.4 0.3 1 559 58 58 SER H H 7.58 0.02 1 560 58 58 SER HA H 3.94 0.02 1 561 58 58 SER HB2 H 3.64 0.02 1 562 58 58 SER HB3 H 3.64 0.02 1 563 58 58 SER C C 174.9 0.3 1 564 58 58 SER CA C 62.3 0.3 1 565 58 58 SER N N 114.3 0.3 1 566 59 59 ALA H H 7.27 0.02 1 567 59 59 ALA HA H 3.82 0.02 1 568 59 59 ALA HB H 1.63 0.02 1 569 59 59 ALA C C 180.0 0.3 1 570 59 59 ALA CA C 55.1 0.3 1 571 59 59 ALA CB C 19.2 0.3 1 572 59 59 ALA N N 125.4 0.3 1 573 60 60 GLU H H 8.57 0.02 1 574 60 60 GLU HA H 3.92 0.02 1 575 60 60 GLU HB2 H 1.93 0.02 1 576 60 60 GLU HB3 H 1.93 0.02 1 577 60 60 GLU HG2 H 2.41 0.02 1 578 60 60 GLU HG3 H 2.41 0.02 1 579 60 60 GLU C C 179.4 0.3 1 580 60 60 GLU CA C 59.6 0.3 1 581 60 60 GLU CB C 30.1 0.3 1 582 60 60 GLU CG C 37.4 0.3 1 583 60 60 GLU N N 120.6 0.3 1 584 61 61 HIS H H 7.93 0.02 1 585 61 61 HIS HA H 4.00 0.02 1 586 61 61 HIS HB2 H 3.22 0.02 2 587 61 61 HIS HB3 H 2.95 0.02 2 588 61 61 HIS C C 177.1 0.3 1 589 61 61 HIS CA C 61.3 0.3 1 590 61 61 HIS CB C 31.3 0.3 1 591 61 61 HIS N N 118.2 0.3 1 592 62 62 ALA H H 7.90 0.02 1 593 62 62 ALA HA H 3.87 0.02 1 594 62 62 ALA HB H 1.25 0.02 1 595 62 62 ALA C C 180.5 0.3 1 596 62 62 ALA CA C 54.9 0.3 1 597 62 62 ALA CB C 19.9 0.3 1 598 62 62 ALA N N 122.3 0.3 1 599 63 63 ALA H H 7.56 0.02 1 600 63 63 ALA HA H 3.97 0.02 1 601 63 63 ALA HB H 1.36 0.02 1 602 63 63 ALA C C 178.4 0.3 1 603 63 63 ALA CA C 55.0 0.3 1 604 63 63 ALA CB C 17.2 0.3 1 605 63 63 ALA N N 121.5 0.3 1 606 64 64 ALA H H 8.42 0.02 1 607 64 64 ALA HA H 3.69 0.02 1 608 64 64 ALA HB H 1.42 0.02 1 609 64 64 ALA C C 178.2 0.3 1 610 64 64 ALA CA C 55.0 0.3 1 611 64 64 ALA CB C 17.3 0.3 1 612 64 64 ALA N N 120.3 0.3 1 613 65 65 LYS H H 8.31 0.02 1 614 65 65 LYS HA H 3.02 0.02 1 615 65 65 LYS HB2 H 1.50 0.02 1 616 65 65 LYS HB3 H 1.50 0.02 1 617 65 65 LYS HG2 H 0.72 0.02 1 618 65 65 LYS HG3 H 0.72 0.02 1 619 65 65 LYS HD2 H 1.09 0.02 1 620 65 65 LYS HD3 H 1.09 0.02 1 621 65 65 LYS HE2 H 2.74 0.02 1 622 65 65 LYS HE3 H 2.74 0.02 1 623 65 65 LYS C C 178.0 0.3 1 624 65 65 LYS CA C 59.9 0.3 1 625 65 65 LYS CB C 32.4 0.3 1 626 65 65 LYS CG C 24.5 0.3 1 627 65 65 LYS CD C 29.8 0.3 1 628 65 65 LYS CE C 42.0 0.3 1 629 65 65 LYS N N 120.2 0.3 1 630 66 66 ILE H H 6.78 0.02 1 631 66 66 ILE HA H 3.48 0.02 1 632 66 66 ILE HB H 1.81 0.02 1 633 66 66 ILE HG12 H 1.04 0.02 1 634 66 66 ILE HG13 H 1.04 0.02 1 635 66 66 ILE HG2 H 0.95 0.02 1 636 66 66 ILE HD1 H 0.84 0.02 1 637 66 66 ILE C C 178.3 0.3 1 638 66 66 ILE CA C 64.0 0.3 1 639 66 66 ILE CB C 37.9 0.3 1 640 66 66 ILE CG1 C 27.9 0.3 1 641 66 66 ILE CG2 C 17.7 0.3 1 642 66 66 ILE CD1 C 13.3 0.3 1 643 66 66 ILE N N 119.2 0.3 1 644 67 67 ALA H H 7.00 0.02 1 645 67 67 ALA HA H 2.30 0.02 1 646 67 67 ALA HB H 0.68 0.02 1 647 67 67 ALA C C 179.5 0.3 1 648 67 67 ALA CA C 54.3 0.3 1 649 67 67 ALA CB C 18.9 0.3 1 650 67 67 ALA N N 123.6 0.3 1 651 68 68 VAL H H 8.65 0.02 1 652 68 68 VAL HA H 3.12 0.02 1 653 68 68 VAL HB H 1.90 0.02 1 654 68 68 VAL HG1 H 0.83 0.02 1 655 68 68 VAL HG2 H 0.91 0.02 1 656 68 68 VAL C C 178.2 0.3 1 657 68 68 VAL CA C 66.1 0.3 1 658 68 68 VAL CB C 31.4 0.3 1 659 68 68 VAL CG1 C 21.0 0.3 1 660 68 68 VAL CG2 C 24.0 0.3 1 661 68 68 VAL N N 118.9 0.3 1 662 69 69 ALA H H 7.55 0.02 1 663 69 69 ALA HA H 3.94 0.02 1 664 69 69 ALA HB H 1.33 0.02 1 665 69 69 ALA C C 178.9 0.3 1 666 69 69 ALA CA C 54.2 0.3 1 667 69 69 ALA CB C 17.6 0.3 1 668 69 69 ALA N N 122.7 0.3 1 669 70 70 SER H H 7.24 0.02 1 670 70 70 SER HA H 4.27 0.02 1 671 70 70 SER HB2 H 3.83 0.02 1 672 70 70 SER HB3 H 3.83 0.02 1 673 70 70 SER C C 174.8 0.3 1 674 70 70 SER CA C 60.0 0.3 1 675 70 70 SER CB C 63.9 0.3 1 676 70 70 SER N N 112.9 0.3 1 677 71 71 LEU H H 7.33 0.02 1 678 71 71 LEU HA H 4.11 0.02 1 679 71 71 LEU HB2 H 1.44 0.02 1 680 71 71 LEU HB3 H 1.44 0.02 1 681 71 71 LEU HG H 1.01 0.02 1 682 71 71 LEU HD1 H 0.18 0.02 1 683 71 71 LEU HD2 H 0.47 0.02 1 684 71 71 LEU C C 177.1 0.3 1 685 71 71 LEU CA C 55.1 0.3 1 686 71 71 LEU CB C 41.8 0.3 1 687 71 71 LEU CG C 24.6 0.3 1 688 71 71 LEU CD1 C 24.8 0.3 1 689 71 71 LEU CD2 C 21.5 0.3 1 690 71 71 LEU N N 121.2 0.3 1 691 72 72 THR H H 7.66 0.02 1 692 72 72 THR HA H 4.48 0.02 1 693 72 72 THR HB H 4.06 0.02 1 694 72 72 THR HG2 H 1.07 0.02 1 695 72 72 THR C C 172.4 0.3 1 696 72 72 THR CA C 59.7 0.3 1 697 72 72 THR CB C 69.5 0.3 1 698 72 72 THR N N 115.3 0.3 1 699 73 73 PRO HA H 4.32 0.02 1 700 73 73 PRO HB2 H 2.21 0.02 1 701 73 73 PRO HB3 H 2.21 0.02 1 702 73 73 PRO HG2 H 1.90 0.02 2 703 73 73 PRO HG3 H 1.83 0.02 2 704 73 73 PRO HD2 H 3.70 0.02 2 705 73 73 PRO HD3 H 3.63 0.02 2 706 73 73 PRO C C 176.8 0.3 1 707 73 73 PRO CA C 63.3 0.3 1 708 73 73 PRO CB C 31.7 0.3 1 709 73 73 PRO CG C 27.3 0.3 1 710 73 73 PRO CD C 50.7 0.3 1 711 74 74 GLN H H 8.41 0.02 1 712 74 74 GLN HA H 4.28 0.02 1 713 74 74 GLN HB2 H 1.89 0.02 2 714 74 74 GLN HB3 H 2.04 0.02 2 715 74 74 GLN HG2 H 2.28 0.02 1 716 74 74 GLN HG3 H 2.28 0.02 1 717 74 74 GLN C C 175.7 0.3 1 718 74 74 GLN CA C 55.3 0.3 1 719 74 74 GLN CB C 29.4 0.3 1 720 74 74 GLN CG C 33.6 0.3 1 721 74 74 GLN N N 121.2 0.3 1 722 75 75 SER H H 8.30 0.02 1 723 75 75 SER HA H 4.78 0.02 1 724 75 75 SER C C 172.9 0.3 1 725 75 75 SER CA C 56.2 0.3 1 726 75 75 SER CB C 63.1 0.3 1 727 75 75 SER N N 119.2 0.3 1 728 76 76 PRO HA H 4.33 0.02 1 729 76 76 PRO HB2 H 2.19 0.02 1 730 76 76 PRO HB3 H 2.19 0.02 1 731 76 76 PRO HG2 H 1.83 0.02 2 732 76 76 PRO HG3 H 1.90 0.02 2 733 76 76 PRO HD2 H 3.57 0.02 1 734 76 76 PRO HD3 H 3.57 0.02 1 735 76 76 PRO C C 176.8 0.3 1 736 76 76 PRO CA C 63.4 0.3 1 737 76 76 PRO CB C 31.7 0.3 1 738 76 76 PRO CG C 27.3 0.3 1 739 77 77 GLU H H 8.38 0.02 1 740 77 77 GLU HA H 4.14 0.02 1 741 77 77 GLU HB2 H 1.88 0.02 1 742 77 77 GLU HB3 H 1.88 0.02 1 743 77 77 GLU HG2 H 2.17 0.02 1 744 77 77 GLU HG3 H 2.17 0.02 1 745 77 77 GLU C C 176.8 0.3 1 746 77 77 GLU CA C 56.7 0.3 1 747 77 77 GLU CB C 29.8 0.3 1 748 77 77 GLU CG C 36.2 0.3 1 749 77 77 GLU N N 121.0 0.3 1 750 78 78 GLY H H 8.21 0.02 1 751 78 78 GLY HA2 H 3.83 0.02 1 752 78 78 GLY HA3 H 3.83 0.02 1 753 78 78 GLY C C 174.0 0.3 1 754 78 78 GLY CA C 45.1 0.3 1 755 78 78 GLY N N 110.3 0.3 1 756 79 79 ILE H H 7.76 0.02 1 757 79 79 ILE HA H 4.03 0.02 1 758 79 79 ILE HB H 1.72 0.02 1 759 79 79 ILE HG12 H 1.26 0.02 2 760 79 79 ILE HG13 H 1.02 0.02 2 761 79 79 ILE HG2 H 0.75 0.02 1 762 79 79 ILE HD1 H 0.75 0.02 1 763 79 79 ILE C C 175.5 0.3 1 764 79 79 ILE CA C 61.0 0.3 1 765 79 79 ILE CB C 38.4 0.3 1 766 79 79 ILE CG1 C 26.9 0.3 1 767 79 79 ILE CG2 C 17.3 0.3 1 768 79 79 ILE CD1 C 12.9 0.3 1 769 79 79 ILE N N 120.3 0.3 1 770 80 80 ASP H H 8.27 0.02 1 771 80 80 ASP HA H 4.49 0.02 1 772 80 80 ASP HB2 H 2.52 0.02 1 773 80 80 ASP HB3 H 2.52 0.02 1 774 80 80 ASP C C 175.6 0.3 1 775 80 80 ASP CA C 54.3 0.3 1 776 80 80 ASP CB C 40.7 0.3 1 777 80 80 ASP N N 124.2 0.3 1 778 81 81 VAL H H 7.58 0.02 1 779 81 81 VAL HA H 3.71 0.02 1 780 81 81 VAL HB H 1.58 0.02 1 781 81 81 VAL HG1 H 0.21 0.02 1 782 81 81 VAL HG2 H 0.58 0.02 1 783 81 81 VAL C C 175.5 0.3 1 784 81 81 VAL CA C 61.8 0.3 1 785 81 81 VAL CB C 32.1 0.3 1 786 81 81 VAL CG1 C 20.9 0.3 1 787 81 81 VAL CG2 C 20.3 0.3 1 788 81 81 VAL N N 120.0 0.3 1 789 82 82 ALA H H 8.04 0.02 1 790 82 82 ALA HA H 4.27 0.02 1 791 82 82 ALA HB H 1.10 0.02 1 792 82 82 ALA C C 177.8 0.3 1 793 82 82 ALA CA C 50.9 0.3 1 794 82 82 ALA CB C 17.2 0.3 1 795 82 82 ALA N N 128.6 0.3 1 796 83 83 TYR H H 7.33 0.02 1 797 83 83 TYR HA H 3.48 0.02 1 798 83 83 TYR HB2 H 2.63 0.02 1 799 83 83 TYR HB3 H 2.63 0.02 1 800 83 83 TYR HD1 H 6.62 0.02 1 801 83 83 TYR HD2 H 6.62 0.02 1 802 83 83 TYR HE1 H 6.62 0.02 1 803 83 83 TYR HE2 H 6.62 0.02 1 804 83 83 TYR C C 176.9 0.3 1 805 83 83 TYR CA C 63.5 0.3 1 806 83 83 TYR CB C 38.2 0.3 1 807 83 83 TYR N N 119.5 0.3 1 808 84 84 LYS H H 7.95 0.02 1 809 84 84 LYS HA H 3.82 0.02 1 810 84 84 LYS HB2 H 1.69 0.02 1 811 84 84 LYS HB3 H 1.69 0.02 1 812 84 84 LYS HG2 H 1.21 0.02 1 813 84 84 LYS HG3 H 1.21 0.02 1 814 84 84 LYS HD2 H 1.51 0.02 1 815 84 84 LYS HD3 H 1.51 0.02 1 816 84 84 LYS C C 179.6 0.3 1 817 84 84 LYS CA C 60.4 0.3 1 818 84 84 LYS CB C 31.8 0.3 1 819 84 84 LYS N N 117.5 0.3 1 820 85 85 ASN H H 7.41 0.02 1 821 85 85 ASN HA H 4.23 0.02 1 822 85 85 ASN HB2 H 2.69 0.02 1 823 85 85 ASN HB3 H 2.69 0.02 1 824 85 85 ASN HD21 H 7.34 0.02 1 825 85 85 ASN HD22 H 6.78 0.02 1 826 85 85 ASN C C 177.3 0.3 1 827 85 85 ASN CA C 55.9 0.3 1 828 85 85 ASN CB C 37.3 0.3 1 829 85 85 ASN N N 120.5 0.3 1 830 85 85 ASN ND2 N 112.2 0.3 1 831 86 86 LEU H H 7.94 0.02 1 832 86 86 LEU HA H 3.85 0.02 1 833 86 86 LEU HD1 H 0.01 0.02 1 834 86 86 LEU HD2 H 0.54 0.02 1 835 86 86 LEU C C 179.6 0.3 1 836 86 86 LEU CA C 57.7 0.3 1 837 86 86 LEU CB C 41.1 0.3 1 838 86 86 LEU N N 121.6 0.3 1 839 87 87 LEU H H 8.02 0.02 1 840 87 87 LEU HA H 3.93 0.02 1 841 87 87 LEU HB2 H 1.44 0.02 1 842 87 87 LEU HB3 H 1.44 0.02 1 843 87 87 LEU HG H 1.44 0.02 1 844 87 87 LEU HD1 H 0.45 0.02 1 845 87 87 LEU HD2 H 0.53 0.02 1 846 87 87 LEU C C 178.1 0.3 1 847 87 87 LEU CA C 57.5 0.3 1 848 87 87 LEU CB C 41.4 0.3 1 849 87 87 LEU CD1 C 23.8 0.3 1 850 87 87 LEU CD2 C 24.1 0.3 1 851 87 87 LEU N N 119.1 0.3 1 852 88 88 GLN H H 7.49 0.02 1 853 88 88 GLN HA H 3.69 0.02 1 854 88 88 GLN HB2 H 2.24 0.02 1 855 88 88 GLN HB3 H 2.24 0.02 1 856 88 88 GLN HG2 H 2.24 0.02 1 857 88 88 GLN HG3 H 2.24 0.02 1 858 88 88 GLN HE21 H 7.53 0.02 1 859 88 88 GLN HE22 H 6.86 0.02 1 860 88 88 GLN C C 177.3 0.3 1 861 88 88 GLN CA C 59.7 0.3 1 862 88 88 GLN CB C 27.8 0.3 1 863 88 88 GLN CG C 33.8 0.3 1 864 88 88 GLN N N 118.5 0.3 1 865 88 88 GLN NE2 N 113.3 0.3 1 866 89 89 GLU H H 7.87 0.02 1 867 89 89 GLU HA H 4.00 0.02 1 868 89 89 GLU HB2 H 2.12 0.02 1 869 89 89 GLU HB3 H 2.12 0.02 1 870 89 89 GLU HG2 H 2.33 0.02 1 871 89 89 GLU HG3 H 2.33 0.02 1 872 89 89 GLU C C 179.2 0.3 1 873 89 89 GLU CA C 59.1 0.3 1 874 89 89 GLU CB C 29.2 0.3 1 875 89 89 GLU CG C 36.3 0.3 1 876 89 89 GLU N N 119.5 0.3 1 877 90 90 ILE H H 7.72 0.02 1 878 90 90 ILE HA H 3.72 0.02 1 879 90 90 ILE HB H 1.97 0.02 1 880 90 90 ILE HG12 H 1.87 0.02 1 881 90 90 ILE HG13 H 1.87 0.02 1 882 90 90 ILE HG2 H 0.97 0.02 1 883 90 90 ILE HD1 H 0.87 0.02 1 884 90 90 ILE C C 177.7 0.3 1 885 90 90 ILE CA C 65.1 0.3 1 886 90 90 ILE CB C 38.1 0.3 1 887 90 90 ILE CG1 C 32.3 0.3 1 888 90 90 ILE CG2 C 17.4 0.3 1 889 90 90 ILE CD1 C 13.7 0.3 1 890 90 90 ILE N N 120.8 0.3 1 891 91 91 ALA H H 8.05 0.02 1 892 91 91 ALA HA H 4.07 0.02 1 893 91 91 ALA HB H 1.45 0.02 1 894 91 91 ALA C C 179.7 0.3 1 895 91 91 ALA CA C 55.0 0.3 1 896 91 91 ALA CB C 18.4 0.3 1 897 91 91 ALA N N 122.7 0.3 1 898 92 92 GLN H H 8.14 0.02 1 899 92 92 GLN HA H 4.12 0.02 1 900 92 92 GLN HB2 H 2.16 0.02 1 901 92 92 GLN HB3 H 2.16 0.02 1 902 92 92 GLN HG2 H 2.34 0.02 2 903 92 92 GLN HG3 H 2.48 0.02 2 904 92 92 GLN HE21 H 7.43 0.02 1 905 92 92 GLN HE22 H 6.79 0.02 1 906 92 92 GLN C C 178.8 0.3 1 907 92 92 GLN CA C 58.3 0.3 1 908 92 92 GLN CB C 28.3 0.3 1 909 92 92 GLN CG C 34.4 0.3 1 910 92 92 GLN N N 116.5 0.3 1 911 92 92 GLN NE2 N 112.6 0.3 1 912 93 93 LYS H H 7.97 0.02 1 913 93 93 LYS HA H 4.07 0.02 1 914 93 93 LYS HB2 H 1.93 0.02 1 915 93 93 LYS HB3 H 1.93 0.02 1 916 93 93 LYS HG2 H 1.47 0.02 1 917 93 93 LYS HG3 H 1.47 0.02 1 918 93 93 LYS HD2 H 1.56 0.02 1 919 93 93 LYS HD3 H 1.56 0.02 1 920 93 93 LYS C C 178.1 0.3 1 921 93 93 LYS CA C 58.7 0.3 1 922 93 93 LYS CB C 32.3 0.3 1 923 93 93 LYS CG C 25.1 0.3 1 924 93 93 LYS CD C 28.8 0.3 1 925 93 93 LYS N N 120.8 0.3 1 926 94 94 GLU H H 7.93 0.02 1 927 94 94 GLU HA H 4.34 0.02 1 928 94 94 GLU HB2 H 2.25 0.02 1 929 94 94 GLU HB3 H 2.25 0.02 1 930 94 94 GLU HG2 H 2.25 0.02 1 931 94 94 GLU HG3 H 2.25 0.02 1 932 94 94 GLU C C 176.0 0.3 1 933 94 94 GLU CA C 55.9 0.3 1 934 94 94 GLU CB C 29.7 0.3 1 935 94 94 GLU CG C 36.0 0.3 1 936 94 94 GLU N N 116.8 0.3 1 937 95 95 SER H H 7.90 0.02 1 938 95 95 SER HA H 4.25 0.02 1 939 95 95 SER HB2 H 3.84 0.02 1 940 95 95 SER HB3 H 3.84 0.02 1 941 95 95 SER C C 173.9 0.3 1 942 95 95 SER CA C 58.4 0.3 1 943 95 95 SER CB C 62.6 0.3 1 944 95 95 SER N N 115.0 0.3 1 945 96 96 SER H H 8.37 0.02 1 946 96 96 SER HA H 4.52 0.02 1 947 96 96 SER HB2 H 3.76 0.02 1 948 96 96 SER HB3 H 3.76 0.02 1 949 96 96 SER C C 173.7 0.3 1 950 96 96 SER CA C 57.1 0.3 1 951 96 96 SER CB C 64.4 0.3 1 952 96 96 SER N N 116.3 0.3 1 953 97 97 LEU H H 7.83 0.02 1 954 97 97 LEU HA H 4.21 0.02 1 955 97 97 LEU HB2 H 1.51 0.02 1 956 97 97 LEU HB3 H 1.51 0.02 1 957 97 97 LEU HG H 1.51 0.02 1 958 97 97 LEU HD1 H 0.81 0.02 1 959 97 97 LEU HD2 H 0.81 0.02 1 960 97 97 LEU C C 177.0 0.3 1 961 97 97 LEU CA C 54.9 0.3 1 962 97 97 LEU CB C 42.2 0.3 1 963 97 97 LEU CG C 26.9 0.3 1 964 97 97 LEU CD1 C 24.8 0.3 1 965 97 97 LEU CD2 C 23.2 0.3 1 966 97 97 LEU N N 122.5 0.3 1 967 98 98 LEU H H 8.14 0.02 1 968 98 98 LEU HA H 4.25 0.02 1 969 98 98 LEU HB2 H 1.63 0.02 2 970 98 98 LEU HB3 H 1.51 0.02 2 971 98 98 LEU HG H 1.45 0.02 1 972 98 98 LEU HD1 H 0.90 0.02 1 973 98 98 LEU HD2 H 0.93 0.02 1 974 98 98 LEU C C 175.3 0.3 1 975 98 98 LEU CA C 53.5 0.3 1 976 98 98 LEU CB C 39.9 0.3 1 977 98 98 LEU N N 123.1 0.3 1 978 99 99 PRO HA H 4.57 0.02 1 979 99 99 PRO HB2 H 2.04 0.02 1 980 99 99 PRO HB3 H 2.04 0.02 1 981 99 99 PRO HG2 H 1.80 0.02 1 982 99 99 PRO HG3 H 1.80 0.02 1 983 99 99 PRO HD2 H 3.59 0.02 2 984 99 99 PRO HD3 H 3.56 0.02 2 985 99 99 PRO C C 174.8 0.3 1 986 99 99 PRO CA C 63.0 0.3 1 987 99 99 PRO CB C 32.1 0.3 1 988 99 99 PRO CG C 27.6 0.3 1 989 100 100 PHE H H 7.90 0.02 1 990 100 100 PHE HA H 4.89 0.02 1 991 100 100 PHE HB2 H 2.90 0.02 2 992 100 100 PHE HB3 H 3.04 0.02 2 993 100 100 PHE C C 174.1 0.3 1 994 100 100 PHE CA C 56.4 0.3 1 995 100 100 PHE CB C 41.4 0.3 1 996 100 100 PHE N N 123.5 0.3 1 997 101 101 TYR H H 8.38 0.02 1 998 101 101 TYR HA H 4.96 0.02 1 999 101 101 TYR HB2 H 2.55 0.02 1 1000 101 101 TYR HB3 H 2.55 0.02 1 1001 101 101 TYR HD1 H 6.82 0.02 3 1002 101 101 TYR HD2 H 6.81 0.02 3 1003 101 101 TYR HE1 H 6.82 0.02 1 1004 101 101 TYR HE2 H 6.82 0.02 1 1005 101 101 TYR C C 174.2 0.3 1 1006 101 101 TYR CA C 57.5 0.3 1 1007 101 101 TYR CB C 40.5 0.3 1 1008 101 101 TYR N N 128.7 0.3 1 1009 102 102 ALA H H 8.58 0.02 1 1010 102 102 ALA HA H 4.53 0.02 1 1011 102 102 ALA HB H 1.25 0.02 1 1012 102 102 ALA C C 176.4 0.3 1 1013 102 102 ALA CA C 51.4 0.3 1 1014 102 102 ALA CB C 20.9 0.3 1 1015 102 102 ALA N N 126.5 0.3 1 1016 103 103 THR H H 8.68 0.02 1 1017 103 103 THR HA H 5.00 0.02 1 1018 103 103 THR HB H 3.77 0.02 1 1019 103 103 THR HG2 H 1.18 0.02 1 1020 103 103 THR C C 172.5 0.3 1 1021 103 103 THR CA C 62.7 0.3 1 1022 103 103 THR CB C 70.3 0.3 1 1023 103 103 THR CG2 C 22.9 0.3 1 1024 103 103 THR N N 120.7 0.3 1 1025 104 104 ALA H H 9.10 0.02 1 1026 104 104 ALA HA H 4.77 0.02 1 1027 104 104 ALA HB H 1.33 0.02 1 1028 104 104 ALA C C 176.3 0.3 1 1029 104 104 ALA CA C 50.2 0.3 1 1030 104 104 ALA CB C 21.7 0.3 1 1031 104 104 ALA N N 132.9 0.3 1 1032 105 105 THR H H 8.34 0.02 1 1033 105 105 THR HA H 4.72 0.02 1 1034 105 105 THR HB H 3.83 0.02 1 1035 105 105 THR HG2 H 0.85 0.02 1 1036 105 105 THR C C 173.7 0.3 1 1037 105 105 THR CA C 60.8 0.3 1 1038 105 105 THR CB C 70.0 0.3 1 1039 105 105 THR CG2 C 21.4 0.3 1 1040 105 105 THR N N 116.0 0.3 1 1041 106 106 SER H H 8.51 0.02 1 1042 106 106 SER HA H 4.53 0.02 1 1043 106 106 SER HB2 H 3.66 0.02 2 1044 106 106 SER HB3 H 3.52 0.02 2 1045 106 106 SER C C 173.7 0.3 1 1046 106 106 SER CA C 56.5 0.3 1 1047 106 106 SER CB C 64.8 0.3 1 1048 106 106 SER N N 121.2 0.3 1 1049 107 107 GLY H H 8.12 0.02 1 1050 107 107 GLY HA2 H 4.25 0.02 2 1051 107 107 GLY HA3 H 3.71 0.02 2 1052 107 107 GLY C C 171.3 0.3 1 1053 107 107 GLY CA C 44.3 0.3 1 1054 107 107 GLY N N 108.3 0.3 1 1055 108 108 PRO HA H 4.34 0.02 1 1056 108 108 PRO HB2 H 2.20 0.02 1 1057 108 108 PRO HB3 H 2.20 0.02 1 1058 108 108 PRO HG2 H 1.82 0.02 1 1059 108 108 PRO HG3 H 1.82 0.02 1 1060 108 108 PRO C C 178.4 0.3 1 1061 108 108 PRO CA C 61.9 0.3 1 1062 108 108 PRO CB C 31.8 0.3 1 1063 109 109 SER H H 8.66 0.02 1 1064 109 109 SER HA H 4.07 0.02 1 1065 109 109 SER C C 178.8 0.3 1 1066 109 109 SER CA C 61.3 0.3 1 1067 109 109 SER CB C 62.5 0.3 1 1068 109 109 SER N N 117.0 0.3 1 1069 110 110 HIS H H 8.08 0.02 1 1070 110 110 HIS HA H 4.50 0.02 1 1071 110 110 HIS HB2 H 3.21 0.02 2 1072 110 110 HIS HB3 H 2.86 0.02 2 1073 110 110 HIS C C 175.1 0.3 1 1074 110 110 HIS CA C 56.0 0.3 1 1075 110 110 HIS CB C 30.2 0.3 1 1076 110 110 HIS N N 120.4 0.3 1 1077 111 111 ALA H H 6.99 0.02 1 1078 111 111 ALA HA H 4.46 0.02 1 1079 111 111 ALA HB H 0.88 0.02 1 1080 111 111 ALA C C 175.1 0.3 1 1081 111 111 ALA CA C 50.6 0.3 1 1082 111 111 ALA CB C 18.0 0.3 1 1083 111 111 ALA N N 125.0 0.3 1 1084 112 112 PRO HA H 4.37 0.02 1 1085 112 112 PRO HB2 H 1.80 0.02 1 1086 112 112 PRO HB3 H 1.80 0.02 1 1087 112 112 PRO HG2 H 1.31 0.02 1 1088 112 112 PRO HG3 H 1.31 0.02 1 1089 112 112 PRO HD2 H 3.36 0.02 2 1090 112 112 PRO HD3 H 3.33 0.02 2 1091 112 112 PRO C C 176.7 0.3 1 1092 112 112 PRO CA C 63.1 0.3 1 1093 112 112 PRO CB C 32.2 0.3 1 1094 112 112 PRO CG C 26.8 0.3 1 1095 112 112 PRO CD C 48.5 0.3 1 1096 113 113 THR H H 8.13 0.02 1 1097 113 113 THR HA H 4.34 0.02 1 1098 113 113 THR HB H 3.97 0.02 1 1099 113 113 THR HG2 H 0.94 0.02 1 1100 113 113 THR C C 172.5 0.3 1 1101 113 113 THR CA C 60.0 0.3 1 1102 113 113 THR CB C 71.0 0.3 1 1103 113 113 THR CG2 C 21.8 0.3 1 1104 113 113 THR N N 113.3 0.3 1 1105 114 114 PHE H H 8.84 0.02 1 1106 114 114 PHE HA H 5.23 0.02 1 1107 114 114 PHE HB2 H 2.46 0.02 2 1108 114 114 PHE HB3 H 2.31 0.02 2 1109 114 114 PHE HD1 H 6.70 0.02 1 1110 114 114 PHE HD2 H 6.70 0.02 1 1111 114 114 PHE HE1 H 6.70 0.02 1 1112 114 114 PHE HE2 H 6.70 0.02 1 1113 114 114 PHE C C 174.5 0.3 1 1114 114 114 PHE CA C 56.7 0.3 1 1115 114 114 PHE CB C 42.7 0.3 1 1116 114 114 PHE N N 120.2 0.3 1 1117 115 115 THR H H 8.50 0.02 1 1118 115 115 THR HA H 4.52 0.02 1 1119 115 115 THR HB H 3.82 0.02 1 1120 115 115 THR HG2 H 0.99 0.02 1 1121 115 115 THR C C 173.7 0.3 1 1122 115 115 THR CA C 61.9 0.3 1 1123 115 115 THR CB C 71.3 0.3 1 1124 115 115 THR CG2 C 21.3 0.3 1 1125 115 115 THR N N 115.5 0.3 1 1126 116 116 SER H H 9.98 0.02 1 1127 116 116 SER HA H 5.74 0.02 1 1128 116 116 SER HB2 H 3.76 0.02 2 1129 116 116 SER HB3 H 3.35 0.02 2 1130 116 116 SER C C 173.2 0.3 1 1131 116 116 SER CA C 58.0 0.3 1 1132 116 116 SER CB C 65.3 0.3 1 1133 116 116 SER N N 126.7 0.3 1 1134 117 117 THR H H 9.05 0.02 1 1135 117 117 THR HA H 5.32 0.02 1 1136 117 117 THR HB H 3.97 0.02 1 1137 117 117 THR HG2 H 1.00 0.02 1 1138 117 117 THR C C 173.5 0.3 1 1139 117 117 THR CA C 59.1 0.3 1 1140 117 117 THR CB C 71.9 0.3 1 1141 117 117 THR CG2 C 21.2 0.3 1 1142 117 117 THR N N 115.4 0.3 1 1143 118 118 VAL H H 9.03 0.02 1 1144 118 118 VAL HA H 4.82 0.02 1 1145 118 118 VAL HB H 1.42 0.02 1 1146 118 118 VAL HG1 H 0.65 0.02 1 1147 118 118 VAL HG2 H -0.06 0.02 1 1148 118 118 VAL C C 172.0 0.3 1 1149 118 118 VAL CA C 57.9 0.3 1 1150 118 118 VAL CB C 35.2 0.3 1 1151 118 118 VAL CG1 C 21.0 0.3 1 1152 118 118 VAL CG2 C 22.2 0.3 1 1153 118 118 VAL N N 120.0 0.3 1 1154 119 119 GLU H H 8.52 0.02 1 1155 119 119 GLU HA H 5.32 0.02 1 1156 119 119 GLU HB2 H 2.05 0.02 1 1157 119 119 GLU HB3 H 2.05 0.02 1 1158 119 119 GLU HG2 H 1.91 0.02 1 1159 119 119 GLU HG3 H 1.91 0.02 1 1160 119 119 GLU C C 176.2 0.3 1 1161 119 119 GLU CA C 54.0 0.3 1 1162 119 119 GLU CB C 31.1 0.3 1 1163 119 119 GLU CG C 35.9 0.3 1 1164 119 119 GLU N N 129.4 0.3 1 1165 120 120 PHE H H 9.08 0.02 1 1166 120 120 PHE HA H 4.70 0.02 1 1167 120 120 PHE HB2 H 2.92 0.02 2 1168 120 120 PHE HB3 H 2.72 0.02 2 1169 120 120 PHE HD1 H 6.98 0.02 1 1170 120 120 PHE HD2 H 6.98 0.02 1 1171 120 120 PHE HE1 H 6.98 0.02 1 1172 120 120 PHE HE2 H 6.98 0.02 1 1173 120 120 PHE C C 173.1 0.3 1 1174 120 120 PHE CA C 57.0 0.3 1 1175 120 120 PHE CB C 41.7 0.3 1 1176 120 120 PHE N N 127.7 0.3 1 1177 121 121 ALA H H 8.66 0.02 1 1178 121 121 ALA HA H 3.64 0.02 1 1179 121 121 ALA HB H 0.89 0.02 1 1180 121 121 ALA C C 176.9 0.3 1 1181 121 121 ALA CA C 52.4 0.3 1 1182 121 121 ALA CB C 16.5 0.3 1 1183 121 121 ALA N N 129.7 0.3 1 1184 122 122 GLY H H 8.58 0.02 1 1185 122 122 GLY HA2 H 3.93 0.02 2 1186 122 122 GLY HA3 H 3.47 0.02 2 1187 122 122 GLY C C 173.6 0.3 1 1188 122 122 GLY CA C 45.2 0.3 1 1189 122 122 GLY N N 105.0 0.3 1 1190 123 123 LYS H H 7.82 0.02 1 1191 123 123 LYS HA H 4.32 0.02 1 1192 123 123 LYS HG2 H 1.14 0.02 1 1193 123 123 LYS HG3 H 1.14 0.02 1 1194 123 123 LYS HD2 H 1.47 0.02 1 1195 123 123 LYS HD3 H 1.47 0.02 1 1196 123 123 LYS C C 173.5 0.3 1 1197 123 123 LYS CA C 54.3 0.3 1 1198 123 123 LYS CB C 35.5 0.3 1 1199 123 123 LYS CG C 24.7 0.3 1 1200 123 123 LYS CD C 28.8 0.3 1 1201 123 123 LYS CE C 41.4 0.3 1 1202 123 123 LYS N N 122.9 0.3 1 1203 124 124 VAL H H 7.69 0.02 1 1204 124 124 VAL HA H 4.66 0.02 1 1205 124 124 VAL HB H 1.63 0.02 1 1206 124 124 VAL HG1 H 0.86 0.02 1 1207 124 124 VAL HG2 H 0.69 0.02 1 1208 124 124 VAL C C 175.1 0.3 1 1209 124 124 VAL CA C 61.0 0.3 1 1210 124 124 VAL CB C 33.0 0.3 1 1211 124 124 VAL CG1 C 20.8 0.3 1 1212 124 124 VAL CG2 C 20.8 0.3 1 1213 124 124 VAL N N 120.4 0.3 1 1214 125 125 PHE H H 9.08 0.02 1 1215 125 125 PHE HA H 4.70 0.02 1 1216 125 125 PHE HB2 H 2.77 0.02 1 1217 125 125 PHE HB3 H 2.77 0.02 1 1218 125 125 PHE HD2 H 7.14 0.02 1 1219 125 125 PHE HE2 H 7.14 0.02 1 1220 125 125 PHE C C 174.6 0.3 1 1221 125 125 PHE CA C 56.3 0.3 1 1222 125 125 PHE CB C 41.2 0.3 1 1223 125 125 PHE N N 127.1 0.3 1 1224 126 126 SER H H 8.80 0.02 1 1225 126 126 SER HA H 5.11 0.02 1 1226 126 126 SER HB2 H 3.71 0.02 1 1227 126 126 SER HB3 H 3.71 0.02 1 1228 126 126 SER C C 174.6 0.3 1 1229 126 126 SER CA C 57.5 0.3 1 1230 126 126 SER CB C 64.7 0.3 1 1231 126 126 SER N N 117.9 0.3 1 1232 127 127 GLY H H 8.52 0.02 1 1233 127 127 GLY HA2 H 4.25 0.02 1 1234 127 127 GLY HA3 H 4.25 0.02 1 1235 127 127 GLY C C 172.8 0.3 1 1236 127 127 GLY CA C 43.3 0.3 1 1237 127 127 GLY N N 111.4 0.3 1 1238 128 128 GLU H H 8.37 0.02 1 1239 128 128 GLU HA H 4.36 0.02 1 1240 128 128 GLU HB2 H 2.15 0.02 1 1241 128 128 GLU HB3 H 2.15 0.02 1 1242 128 128 GLU HG2 H 2.15 0.02 1 1243 128 128 GLU HG3 H 2.15 0.02 1 1244 128 128 GLU C C 176.5 0.3 1 1245 128 128 GLU CA C 54.3 0.3 1 1246 128 128 GLU CB C 31.5 0.3 1 1247 128 128 GLU CG C 36.2 0.3 1 1248 128 128 GLU N N 116.4 0.3 1 1249 129 129 GLU H H 8.31 0.02 1 1250 129 129 GLU HA H 4.50 0.02 1 1251 129 129 GLU HB2 H 2.09 0.02 2 1252 129 129 GLU HB3 H 2.06 0.02 2 1253 129 129 GLU HG2 H 1.78 0.02 2 1254 129 129 GLU HG3 H 1.75 0.02 2 1255 129 129 GLU C C 176.8 0.3 1 1256 129 129 GLU CA C 56.9 0.3 1 1257 129 129 GLU CB C 30.2 0.3 1 1258 129 129 GLU CG C 36.5 0.3 1 1259 129 129 GLU N N 121.7 0.3 1 1260 130 130 ALA H H 9.57 0.02 1 1261 130 130 ALA HA H 4.87 0.02 1 1262 130 130 ALA HB H 1.39 0.02 1 1263 130 130 ALA C C 177.4 0.3 1 1264 130 130 ALA CA C 50.3 0.3 1 1265 130 130 ALA CB C 23.6 0.3 1 1266 130 130 ALA N N 127.4 0.3 1 1267 131 131 LYS H H 8.68 0.02 1 1268 131 131 LYS HA H 4.35 0.02 1 1269 131 131 LYS HB2 H 1.97 0.02 2 1270 131 131 LYS HB3 H 1.77 0.02 2 1271 131 131 LYS HG2 H 1.51 0.02 2 1272 131 131 LYS HG3 H 1.47 0.02 2 1273 131 131 LYS HD2 H 1.63 0.02 1 1274 131 131 LYS HD3 H 1.63 0.02 1 1275 131 131 LYS C C 176.4 0.3 1 1276 131 131 LYS CA C 57.5 0.3 1 1277 131 131 LYS CB C 33.5 0.3 1 1278 131 131 LYS N N 116.2 0.3 1 1279 132 132 THR H H 7.10 0.02 1 1280 132 132 THR HA H 4.31 0.02 1 1281 132 132 THR HB H 4.26 0.02 1 1282 132 132 THR HG2 H 1.07 0.02 1 1283 132 132 THR C C 173.3 0.3 1 1284 132 132 THR CA C 58.4 0.3 1 1285 132 132 THR CB C 72.2 0.3 1 1286 132 132 THR CG2 C 21.7 0.3 1 1287 132 132 THR N N 105.1 0.3 1 1288 133 133 LYS H H 7.97 0.02 1 1289 133 133 LYS HA H 3.17 0.02 1 1290 133 133 LYS HB2 H 1.27 0.02 1 1291 133 133 LYS HB3 H 1.27 0.02 1 1292 133 133 LYS HG2 H 1.06 0.02 2 1293 133 133 LYS HG3 H 0.95 0.02 2 1294 133 133 LYS HE2 H 2.75 0.02 1 1295 133 133 LYS HE3 H 2.75 0.02 1 1296 133 133 LYS C C 177.1 0.3 1 1297 133 133 LYS CA C 59.6 0.3 1 1298 133 133 LYS CB C 31.7 0.3 1 1299 133 133 LYS CG C 24.2 0.3 1 1300 133 133 LYS CD C 30.5 0.3 1 1301 133 133 LYS CE C 37.3 0.3 1 1302 133 133 LYS N N 124.1 0.3 1 1303 134 134 LYS H H 7.94 0.02 1 1304 134 134 LYS HA H 3.72 0.02 1 1305 134 134 LYS HB2 H 1.51 0.02 1 1306 134 134 LYS HB3 H 1.51 0.02 1 1307 134 134 LYS HG2 H 1.28 0.02 1 1308 134 134 LYS HG3 H 1.28 0.02 1 1309 134 134 LYS HD2 H 1.58 0.02 1 1310 134 134 LYS HD3 H 1.58 0.02 1 1311 134 134 LYS HE2 H 2.79 0.02 1 1312 134 134 LYS HE3 H 2.79 0.02 1 1313 134 134 LYS C C 179.7 0.3 1 1314 134 134 LYS CA C 59.3 0.3 1 1315 134 134 LYS CB C 31.8 0.3 1 1316 134 134 LYS CG C 24.9 0.3 1 1317 134 134 LYS CD C 28.6 0.3 1 1318 134 134 LYS CE C 40.7 0.3 1 1319 134 134 LYS N N 118.3 0.3 1 1320 135 135 LEU H H 7.59 0.02 1 1321 135 135 LEU HA H 3.99 0.02 1 1322 135 135 LEU HB2 H 1.42 0.02 1 1323 135 135 LEU HB3 H 1.42 0.02 1 1324 135 135 LEU HG H 1.49 0.02 1 1325 135 135 LEU HD1 H 0.81 0.02 1 1326 135 135 LEU HD2 H 0.90 0.02 1 1327 135 135 LEU C C 179.8 0.3 1 1328 135 135 LEU CA C 57.1 0.3 1 1329 135 135 LEU CB C 41.8 0.3 1 1330 135 135 LEU CG C 25.6 0.3 1 1331 135 135 LEU CD1 C 21.9 0.3 1 1332 135 135 LEU CD2 C 21.9 0.3 1 1333 135 135 LEU N N 119.3 0.3 1 1334 136 136 ALA H H 8.12 0.02 1 1335 136 136 ALA HA H 3.98 0.02 1 1336 136 136 ALA HB H 1.51 0.02 1 1337 136 136 ALA C C 181.3 0.3 1 1338 136 136 ALA CA C 55.6 0.3 1 1339 136 136 ALA CB C 18.5 0.3 1 1340 136 136 ALA N N 127.3 0.3 1 1341 137 137 GLU H H 8.37 0.02 1 1342 137 137 GLU HA H 3.81 0.02 1 1343 137 137 GLU HB2 H 1.25 0.02 1 1344 137 137 GLU HB3 H 1.25 0.02 1 1345 137 137 GLU HG2 H 2.27 0.02 1 1346 137 137 GLU HG3 H 2.27 0.02 1 1347 137 137 GLU C C 178.4 0.3 1 1348 137 137 GLU CA C 59.7 0.3 1 1349 137 137 GLU CB C 29.5 0.3 1 1350 137 137 GLU CG C 36.1 0.3 1 1351 137 137 GLU N N 122.2 0.3 1 1352 138 138 MET H H 7.77 0.02 1 1353 138 138 MET HA H 3.97 0.02 1 1354 138 138 MET HB2 H 2.12 0.02 1 1355 138 138 MET HB3 H 2.12 0.02 1 1356 138 138 MET HG2 H 2.67 0.02 1 1357 138 138 MET HG3 H 2.67 0.02 1 1358 138 138 MET C C 177.5 0.3 1 1359 138 138 MET CA C 58.2 0.3 1 1360 138 138 MET CB C 31.3 0.3 1 1361 138 138 MET CG C 32.2 0.3 1 1362 138 138 MET N N 118.4 0.3 1 1363 139 139 SER H H 7.62 0.02 1 1364 139 139 SER HA H 4.14 0.02 1 1365 139 139 SER HB2 H 3.84 0.02 1 1366 139 139 SER HB3 H 3.84 0.02 1 1367 139 139 SER C C 176.5 0.3 1 1368 139 139 SER CA C 60.6 0.3 1 1369 139 139 SER CB C 62.1 0.3 1 1370 139 139 SER N N 113.1 0.3 1 1371 140 140 ALA H H 7.59 0.02 1 1372 140 140 ALA HA H 3.69 0.02 1 1373 140 140 ALA HB H 1.32 0.02 1 1374 140 140 ALA C C 177.8 0.3 1 1375 140 140 ALA CA C 55.4 0.3 1 1376 140 140 ALA CB C 17.2 0.3 1 1377 140 140 ALA N N 121.8 0.3 1 1378 141 141 ALA H H 8.24 0.02 1 1379 141 141 ALA HA H 3.85 0.02 1 1380 141 141 ALA HB H 1.47 0.02 1 1381 141 141 ALA C C 178.5 0.3 1 1382 141 141 ALA CA C 54.8 0.3 1 1383 141 141 ALA CB C 18.1 0.3 1 1384 141 141 ALA N N 118.8 0.3 1 1385 142 142 LYS H H 7.96 0.02 1 1386 142 142 LYS HA H 3.83 0.02 1 1387 142 142 LYS HE2 H 3.00 0.02 1 1388 142 142 LYS HE3 H 3.00 0.02 1 1389 142 142 LYS C C 177.5 0.3 1 1390 142 142 LYS CA C 59.9 0.3 1 1391 142 142 LYS CB C 32.0 0.3 1 1392 142 142 LYS N N 120.3 0.3 1 1393 143 143 VAL H H 7.77 0.02 1 1394 143 143 VAL HA H 3.34 0.02 1 1395 143 143 VAL HB H 1.95 0.02 1 1396 143 143 VAL HG1 H 0.99 0.02 1 1397 143 143 VAL HG2 H 1.09 0.02 1 1398 143 143 VAL C C 179.4 0.3 1 1399 143 143 VAL CA C 66.5 0.3 1 1400 143 143 VAL CB C 31.3 0.3 1 1401 143 143 VAL CG1 C 21.2 0.3 1 1402 143 143 VAL CG2 C 22.3 0.3 1 1403 143 143 VAL N N 119.9 0.3 1 1404 144 144 ALA H H 7.82 0.02 1 1405 144 144 ALA HA H 2.28 0.02 1 1406 144 144 ALA HB H 0.77 0.02 1 1407 144 144 ALA C C 178.3 0.3 1 1408 144 144 ALA CA C 54.3 0.3 1 1409 144 144 ALA CB C 19.3 0.3 1 1410 144 144 ALA N N 123.3 0.3 1 1411 145 145 PHE H H 8.73 0.02 1 1412 145 145 PHE HA H 3.58 0.02 1 1413 145 145 PHE HB2 H 2.97 0.02 1 1414 145 145 PHE HB3 H 2.97 0.02 1 1415 145 145 PHE HD1 H 7.24 0.02 1 1416 145 145 PHE HD2 H 7.24 0.02 1 1417 145 145 PHE HE1 H 7.24 0.02 1 1418 145 145 PHE HE2 H 7.24 0.02 1 1419 145 145 PHE C C 177.0 0.3 1 1420 145 145 PHE CA C 62.0 0.3 1 1421 145 145 PHE CB C 39.5 0.3 1 1422 145 145 PHE N N 119.2 0.3 1 1423 146 146 MET H H 8.53 0.02 1 1424 146 146 MET HA H 3.92 0.02 1 1425 146 146 MET HB2 H 2.66 0.02 1 1426 146 146 MET HB3 H 2.66 0.02 1 1427 146 146 MET HG2 H 2.66 0.02 1 1428 146 146 MET HG3 H 2.66 0.02 1 1429 146 146 MET C C 178.1 0.3 1 1430 146 146 MET CA C 57.1 0.3 1 1431 146 146 MET CB C 30.7 0.3 1 1432 146 146 MET CG C 32.8 0.3 1 1433 146 146 MET N N 116.2 0.3 1 1434 147 147 SER H H 7.51 0.02 1 1435 147 147 SER HA H 4.14 0.02 1 1436 147 147 SER HB2 H 3.84 0.02 1 1437 147 147 SER HB3 H 3.84 0.02 1 1438 147 147 SER C C 176.2 0.3 1 1439 147 147 SER CA C 60.9 0.3 1 1440 147 147 SER CB C 63.3 0.3 1 1441 147 147 SER N N 115.3 0.3 1 1442 148 148 ILE H H 7.59 0.02 1 1443 148 148 ILE HA H 3.80 0.02 1 1444 148 148 ILE HB H 1.61 0.02 1 1445 148 148 ILE HG12 H 1.40 0.02 2 1446 148 148 ILE HG13 H 1.09 0.02 2 1447 148 148 ILE HG2 H 0.74 0.02 1 1448 148 148 ILE HD1 H 0.64 0.02 1 1449 148 148 ILE C C 177.1 0.3 1 1450 148 148 ILE CA C 62.9 0.3 1 1451 148 148 ILE CB C 37.6 0.3 1 1452 148 148 ILE CG1 C 31.4 0.3 1 1453 148 148 ILE CG2 C 17.2 0.3 1 1454 148 148 ILE CD1 C 13.4 0.3 1 1455 148 148 ILE N N 121.4 0.3 1 1456 149 149 LYS H H 7.93 0.02 1 1457 149 149 LYS HA H 3.93 0.02 1 1458 149 149 LYS HB2 H 1.50 0.02 1 1459 149 149 LYS HB3 H 1.50 0.02 1 1460 149 149 LYS HG2 H 1.01 0.02 1 1461 149 149 LYS HG3 H 1.01 0.02 1 1462 149 149 LYS HD2 H 1.41 0.02 1 1463 149 149 LYS HD3 H 1.41 0.02 1 1464 149 149 LYS HE2 H 2.84 0.02 2 1465 149 149 LYS HE3 H 2.77 0.02 2 1466 149 149 LYS C C 176.9 0.3 1 1467 149 149 LYS CA C 56.7 0.3 1 1468 149 149 LYS CB C 31.6 0.3 1 1469 149 149 LYS CG C 23.3 0.3 1 1470 149 149 LYS CD C 29.8 0.3 1 1471 149 149 LYS N N 122.1 0.3 1 1472 150 150 ASN H H 7.93 0.02 1 1473 150 150 ASN HA H 4.54 0.02 1 1474 150 150 ASN HB2 H 2.72 0.02 1 1475 150 150 ASN HB3 H 2.72 0.02 1 1476 150 150 ASN HD21 H 7.48 0.02 1 1477 150 150 ASN HD22 H 6.80 0.02 1 1478 150 150 ASN C C 175.8 0.3 1 1479 150 150 ASN CA C 53.5 0.3 1 1480 150 150 ASN CB C 38.6 0.3 1 1481 150 150 ASN N N 118.0 0.3 1 1482 150 150 ASN ND2 N 113.6 0.3 1 1483 151 151 GLY H H 7.98 0.02 1 1484 151 151 GLY HA2 H 3.84 0.02 1 1485 151 151 GLY HA3 H 3.84 0.02 1 1486 151 151 GLY C C 173.9 0.3 1 1487 151 151 GLY CA C 45.6 0.3 1 1488 151 151 GLY N N 109.4 0.3 1 1489 152 152 ASN H H 8.18 0.02 1 1490 152 152 ASN HA H 4.66 0.02 1 1491 152 152 ASN HB2 H 2.70 0.02 1 1492 152 152 ASN HB3 H 2.70 0.02 1 1493 152 152 ASN C C 175.2 0.3 1 1494 152 152 ASN CA C 53.0 0.3 1 1495 152 152 ASN CB C 38.8 0.3 1 1496 152 152 ASN N N 119.4 0.3 1 1497 153 153 SER H H 8.19 0.02 1 1498 153 153 SER HA H 4.30 0.02 1 1499 153 153 SER HB2 H 3.78 0.02 2 1500 153 153 SER HB3 H 3.82 0.02 2 1501 153 153 SER C C 174.5 0.3 1 1502 153 153 SER CA C 58.6 0.3 1 1503 153 153 SER CB C 63.4 0.3 1 1504 153 153 SER N N 116.8 0.3 1 stop_ save_