data_15954 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; human eIF5A ; _BMRB_accession_number 15954 _BMRB_flat_file_name bmr15954.str _Entry_type original _Submission_date 2008-09-16 _Accession_date 2008-09-16 _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 Jinqiao Yuan . . 2 Nan Jiang . . 3 Changwen Jin . . 4 Xuemin Zhang . . 5 Xianzhong Yan . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 825 "13C chemical shifts" 454 "15N chemical shifts" 155 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-08-20 update BMRB 'added PubMed ID' 2009-05-22 update BMRB 'complete entry citation' 2009-01-06 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Backbone and sidechain 1H, 15N, and 13C assignments of the human eIF5A' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19636939 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Yuan Jinqiao . . 2 Jiang Nan . . 3 Jin Changwen . . 4 Zhang Xuemin . . 5 Yan Xianzhong . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume 3 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 25 _Page_last 28 _Year 2009 _Details . loop_ _Keyword eIF5A Hypusine 'NMR assignment' 'Translation initiation factor' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name eIF5A _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label eIF5A $eIF5A 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_eIF5A _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common eIF5A _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 153 _Mol_residue_sequence ; MADDLDFETGDAGASATFPM QCSALRKNGFVVLKGRPCKI VEMSTSKTGKHGHAKVHLVG IDIFTGKKYEDICPSTHNMD VPNIKRNDFQLIGIQDGYLS LLQDSGEVREDLRLPEGDLG KEIEQKYDCGEEILITVLSA MTEEAAVAIKAMA ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 ASP 4 ASP 5 LEU 6 ASP 7 PHE 8 GLU 9 THR 10 GLY 11 ASP 12 ALA 13 GLY 14 ALA 15 SER 16 ALA 17 THR 18 PHE 19 PRO 20 MET 21 GLN 22 CYS 23 SER 24 ALA 25 LEU 26 ARG 27 LYS 28 ASN 29 GLY 30 PHE 31 VAL 32 VAL 33 LEU 34 LYS 35 GLY 36 ARG 37 PRO 38 CYS 39 LYS 40 ILE 41 VAL 42 GLU 43 MET 44 SER 45 THR 46 SER 47 LYS 48 THR 49 GLY 50 LYS 51 HIS 52 GLY 53 HIS 54 ALA 55 LYS 56 VAL 57 HIS 58 LEU 59 VAL 60 GLY 61 ILE 62 ASP 63 ILE 64 PHE 65 THR 66 GLY 67 LYS 68 LYS 69 TYR 70 GLU 71 ASP 72 ILE 73 CYS 74 PRO 75 SER 76 THR 77 HIS 78 ASN 79 MET 80 ASP 81 VAL 82 PRO 83 ASN 84 ILE 85 LYS 86 ARG 87 ASN 88 ASP 89 PHE 90 GLN 91 LEU 92 ILE 93 GLY 94 ILE 95 GLN 96 ASP 97 GLY 98 TYR 99 LEU 100 SER 101 LEU 102 LEU 103 GLN 104 ASP 105 SER 106 GLY 107 GLU 108 VAL 109 ARG 110 GLU 111 ASP 112 LEU 113 ARG 114 LEU 115 PRO 116 GLU 117 GLY 118 ASP 119 LEU 120 GLY 121 LYS 122 GLU 123 ILE 124 GLU 125 GLN 126 LYS 127 TYR 128 ASP 129 CYS 130 GLY 131 GLU 132 GLU 133 ILE 134 LEU 135 ILE 136 THR 137 VAL 138 LEU 139 SER 140 ALA 141 MET 142 THR 143 GLU 144 GLU 145 ALA 146 ALA 147 VAL 148 ALA 149 ILE 150 LYS 151 ALA 152 MET 153 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-03-05 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 3CPF "Crystal Structure Of Human Eukaryotic Translation Initiation Factor Eif5a" 90.20 138 99.28 99.28 1.70e-95 DBJ BAB27532 "unnamed protein product [Mus musculus]" 100.00 154 100.00 100.00 5.70e-108 DBJ BAE29039 "unnamed protein product [Mus musculus]" 100.00 154 100.00 100.00 5.70e-108 DBJ BAF85304 "unnamed protein product [Homo sapiens]" 100.00 154 100.00 100.00 5.70e-108 EMBL CAE12193 "eukaryotic translation initiation factor 5A [Bos taurus]" 100.00 154 100.00 100.00 5.70e-108 EMBL CAE12194 "eukaryotic translation initiation factor 5A [Bos taurus]" 100.00 154 100.00 100.00 5.70e-108 GB AAA58453 "initiation factor 4D [Homo sapiens]" 100.00 154 100.00 100.00 5.70e-108 GB AAA86989 "eIF-5A [Homo sapiens]" 100.00 154 100.00 100.00 5.70e-108 GB AAB29229 "REV binding factor, eukaryotic initiation factor 5A, eIF-5A [human, HeLa cells, Peptide Partial, 154 aa]" 100.00 154 100.00 100.00 5.70e-108 GB AAD14095 "eukaryotic initiation factor 5A [Homo sapiens]" 100.00 154 97.39 98.04 1.43e-104 GB AAH00751 "Eukaryotic translation initiation factor 5A [Homo sapiens]" 100.00 154 100.00 100.00 5.70e-108 REF NP_001003658 "eukaryotic translation initiation factor 5A-1 [Bos taurus]" 100.00 154 100.00 100.00 5.70e-108 REF NP_001028853 "eukaryotic translation initiation factor 5A-1 [Rattus norvegicus]" 100.00 154 100.00 100.00 5.70e-108 REF NP_001088861 "uncharacterized protein LOC496181 [Xenopus laevis]" 100.00 154 100.00 100.00 5.70e-108 REF NP_001093162 "eukaryotic translation initiation factor 5A-1-like [Homo sapiens]" 100.00 154 98.04 98.04 5.75e-105 REF NP_001137232 "eukaryotic translation initiation factor 5A-1 isoform A [Homo sapiens]" 100.00 184 100.00 100.00 1.62e-107 SP P10160 "RecName: Full=Eukaryotic translation initiation factor 5A-1; Short=eIF-5A-1; Short=eIF-5A1; AltName: Full=Eukaryotic initiation" 100.00 154 99.35 99.35 5.66e-107 SP P63241 "RecName: Full=Eukaryotic translation initiation factor 5A-1; Short=eIF-5A-1; Short=eIF-5A1; AltName: Full=Eukaryotic initiation" 100.00 154 100.00 100.00 5.70e-108 SP P63242 "RecName: Full=Eukaryotic translation initiation factor 5A-1; Short=eIF-5A-1; Short=eIF-5A1; AltName: Full=Eukaryotic initiation" 100.00 154 100.00 100.00 5.70e-108 SP Q3T1J1 "RecName: Full=Eukaryotic translation initiation factor 5A-1; Short=eIF-5A-1; Short=eIF-5A1; AltName: Full=Eukaryotic initiation" 100.00 154 100.00 100.00 5.70e-108 SP Q6EWQ7 "RecName: Full=Eukaryotic translation initiation factor 5A-1; Short=eIF-5A-1; Short=eIF-5A1; AltName: Full=Eukaryotic initiation" 100.00 154 100.00 100.00 5.70e-108 TPG DAA18838 "TPA: eukaryotic translation initiation factor 5A-1 [Bos taurus]" 100.00 154 100.00 100.00 5.70e-108 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $eIF5A Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $eIF5A 'recombinant technology' . Escherichia coli . pGEX-2T stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $eIF5A 1.0-1.2 mM '[U-99% 13C; U-99% 15N]' 'sodium phosphate' 100 mM . stop_ save_ save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $eIF5A 1.0-1.2 mM '[U-99% 15N]' 'sodium phosphate' 100 mM . stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Saveframe_category software _Name NMRView _Version 5.0.4 loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # 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_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _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 $sample_1 save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_2 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_2 save_ save_3D_CBCA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2 save_ save_3D_1H-15N_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_2 save_ save_3D_HBHA(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_2 save_ save_3D_HNCA_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_2 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' 0.1 . M pH 6.7 . pH pressure 1 . atm temperature 300 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' 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 eIF5A _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 MET HA H 4.485 . 1 2 1 1 MET HB2 H 2.102 . 2 3 1 1 MET HB3 H 2.021 . 2 4 1 1 MET HG2 H 2.620 . 2 5 1 1 MET HG3 H 2.560 . 2 6 1 1 MET CA C 55.412 . 1 7 1 1 MET CB C 32.248 . 1 8 1 1 MET CG C 32.248 . 1 9 2 2 ALA H H 8.290 . 1 10 2 2 ALA HA H 4.258 . 1 11 2 2 ALA CA C 52.990 . 1 12 2 2 ALA N N 124.724 . 1 13 3 3 ASP H H 8.125 . 1 14 3 3 ASP N N 119.465 . 1 15 4 4 ASP H H 8.136 . 1 16 4 4 ASP HA H 4.567 . 1 17 4 4 ASP HB2 H 2.621 . 2 18 4 4 ASP HB3 H 2.697 . 2 19 4 4 ASP CA C 54.201 . 1 20 4 4 ASP CB C 41.122 . 1 21 4 4 ASP N N 120.496 . 1 22 5 5 LEU H H 8.034 . 1 23 5 5 LEU HA H 4.274 . 1 24 5 5 LEU HB2 H 1.466 . 2 25 5 5 LEU HB3 H 1.607 . 2 26 5 5 LEU HD1 H 0.908 . 2 27 5 5 LEU HD2 H 0.846 . 2 28 5 5 LEU HG H 1.603 . 1 29 5 5 LEU CA C 55.170 . 1 30 5 5 LEU CB C 42.333 . 1 31 5 5 LEU CD1 C 25.379 . 1 32 5 5 LEU CD2 C 23.441 . 1 33 5 5 LEU CG C 26.832 . 1 34 5 5 LEU N N 122.352 . 1 35 6 6 ASP H H 8.176 . 1 36 6 6 ASP HA H 4.563 . 1 37 6 6 ASP HB2 H 2.540 . 2 38 6 6 ASP HB3 H 2.540 . 2 39 6 6 ASP CA C 54.201 . 1 40 6 6 ASP CB C 41.122 . 1 41 6 6 ASP N N 121.424 . 1 42 7 7 PHE H H 7.973 . 1 43 7 7 PHE HA H 4.597 . 1 44 7 7 PHE HB2 H 3.016 . 2 45 7 7 PHE HB3 H 3.150 . 2 46 7 7 PHE HD1 H 7.164 . 3 47 7 7 PHE HD2 H 7.164 . 3 48 7 7 PHE HE1 H 7.299 . 3 49 7 7 PHE HE2 H 7.299 . 3 50 7 7 PHE CA C 57.834 . 1 51 7 7 PHE CB C 39.669 . 1 52 7 7 PHE N N 121.012 . 1 53 8 8 GLU H H 8.372 . 1 54 8 8 GLU HA H 4.325 . 1 55 8 8 GLU HB2 H 1.950 . 2 56 8 8 GLU HB3 H 2.048 . 2 57 8 8 GLU HG2 H 2.217 . 2 58 8 8 GLU HG3 H 2.217 . 2 59 8 8 GLU CA C 56.623 . 1 60 8 8 GLU CB C 30.465 . 1 61 8 8 GLU CG C 36.278 . 1 62 8 8 GLU N N 122.868 . 1 63 9 9 THR H H 8.179 . 1 64 9 9 THR HA H 4.344 . 1 65 9 9 THR HB H 4.264 . 1 66 9 9 THR HG2 H 1.215 . 1 67 9 9 THR CA C 61.952 . 1 68 9 9 THR CB C 69.945 . 1 69 9 9 THR CG2 C 21.746 . 1 70 9 9 THR N N 115.236 . 1 71 10 10 GLY H H 8.360 . 1 72 10 10 GLY HA2 H 3.961 . 2 73 10 10 GLY HA3 H 3.961 . 2 74 10 10 GLY CA C 45.482 . 1 75 10 10 GLY N N 111.730 . 1 76 11 11 ASP H H 8.233 . 1 77 11 11 ASP HA H 4.589 . 1 78 11 11 ASP HB2 H 2.599 . 2 79 11 11 ASP HB3 H 2.665 . 2 80 11 11 ASP CA C 54.201 . 1 81 11 11 ASP CB C 41.607 . 1 82 11 11 ASP N N 121.424 . 1 83 12 12 ALA H H 8.392 . 1 84 12 12 ALA HA H 4.241 . 1 85 12 12 ALA HB H 1.372 . 1 86 12 12 ALA CA C 53.233 . 1 87 12 12 ALA CB C 19.081 . 1 88 12 12 ALA N N 125.962 . 1 89 13 13 GLY H H 8.360 . 1 90 13 13 GLY HA2 H 3.917 . 2 91 13 13 GLY HA3 H 3.881 . 2 92 13 13 GLY CA C 45.482 . 1 93 13 13 GLY N N 108.121 . 1 94 14 14 ALA H H 8.039 . 1 95 14 14 ALA HA H 4.355 . 1 96 14 14 ALA HB H 1.403 . 1 97 14 14 ALA CA C 52.506 . 1 98 14 14 ALA CB C 19.566 . 1 99 14 14 ALA N N 124.208 . 1 100 15 15 SER H H 8.206 . 1 101 15 15 SER HA H 4.537 . 1 102 15 15 SER HB2 H 3.969 . 2 103 15 15 SER HB3 H 3.990 . 2 104 15 15 SER CA C 58.319 . 1 105 15 15 SER CB C 64.132 . 1 106 15 15 SER N N 115.236 . 1 107 16 16 ALA H H 8.699 . 1 108 16 16 ALA HA H 4.434 . 1 109 16 16 ALA HB H 1.564 . 1 110 16 16 ALA CA C 54.201 . 1 111 16 16 ALA CB C 19.808 . 1 112 17 17 THR H H 7.755 . 1 113 17 17 THR HA H 5.250 . 1 114 17 17 THR HB H 3.769 . 1 115 17 17 THR HG2 H 0.919 . 1 116 17 17 THR CA C 59.046 . 1 117 17 17 THR CB C 73.094 . 1 118 17 17 THR CG2 C 21.503 . 1 119 17 17 THR N N 108.121 . 1 120 18 18 PHE H H 8.718 . 1 121 18 18 PHE HA H 5.144 . 1 122 18 18 PHE HB2 H 3.084 . 2 123 18 18 PHE HB3 H 3.043 . 2 124 18 18 PHE HD1 H 7.062 . 3 125 18 18 PHE HD2 H 7.062 . 3 126 18 18 PHE HE1 H 7.169 . 3 127 18 18 PHE HE2 H 7.169 . 3 128 18 18 PHE CA C 54.686 . 1 129 18 18 PHE CB C 39.911 . 1 130 18 18 PHE N N 119.362 . 1 131 19 19 PRO HA H 5.301 . 1 132 19 19 PRO HB2 H 1.736 . 2 133 19 19 PRO HB3 H 2.099 . 2 134 19 19 PRO HD2 H 3.838 . 2 135 19 19 PRO HD3 H 3.814 . 2 136 19 19 PRO HG2 H 2.176 . 2 137 19 19 PRO HG3 H 2.038 . 2 138 19 19 PRO CA C 61.952 . 1 139 19 19 PRO CB C 32.645 . 1 140 19 19 PRO CD C 50.326 . 1 141 19 19 PRO CG C 27.074 . 1 142 20 20 MET H H 8.949 . 1 143 20 20 MET HA H 4.600 . 1 144 20 20 MET HB2 H 2.574 . 2 145 20 20 MET HB3 H 2.645 . 2 146 20 20 MET HE H 2.183 . 1 147 20 20 MET HG2 H 1.792 . 2 148 20 20 MET HG3 H 1.851 . 2 149 20 20 MET CA C 54.928 . 1 150 20 20 MET CB C 32.161 . 1 151 20 20 MET CE C 16.901 . 1 152 20 20 MET CG C 37.005 . 1 153 20 20 MET N N 120.651 . 1 154 21 21 GLN H H 8.700 . 1 155 21 21 GLN HA H 4.296 . 1 156 21 21 GLN HB2 H 2.027 . 2 157 21 21 GLN HB3 H 1.975 . 2 158 21 21 GLN HE21 H 7.457 . 2 159 21 21 GLN HE22 H 6.880 . 2 160 21 21 GLN HG2 H 2.319 . 2 161 21 21 GLN HG3 H 2.544 . 2 162 21 21 GLN CA C 57.592 . 1 163 21 21 GLN CB C 29.496 . 1 164 21 21 GLN CG C 35.309 . 1 165 21 21 GLN N N 126.168 . 1 166 21 21 GLN NE2 N 112.916 . 1 167 22 22 CYS H H 8.921 . 1 168 22 22 CYS HA H 3.882 . 1 169 22 22 CYS HB2 H 3.099 . 2 170 22 22 CYS HB3 H 3.099 . 2 171 22 22 CYS CA C 62.679 . 1 172 22 22 CYS CB C 26.832 . 1 173 22 22 CYS N N 125.704 . 1 174 23 23 SER H H 8.043 . 1 175 23 23 SER HA H 4.027 . 1 176 23 23 SER HB2 H 3.876 . 2 177 23 23 SER HB3 H 4.027 . 2 178 23 23 SER CA C 60.014 . 1 179 23 23 SER CB C 62.679 . 1 180 23 23 SER N N 109.461 . 1 181 24 24 ALA H H 8.006 . 1 182 24 24 ALA HA H 4.456 . 1 183 24 24 ALA HB H 1.539 . 1 184 24 24 ALA CA C 52.264 . 1 185 24 24 ALA CB C 19.808 . 1 186 24 24 ALA N N 124.930 . 1 187 25 25 LEU H H 7.387 . 1 188 25 25 LEU HA H 4.259 . 1 189 25 25 LEU HB2 H 1.185 . 2 190 25 25 LEU HB3 H 1.940 . 2 191 25 25 LEU HD1 H 0.936 . 2 192 25 25 LEU HD2 H 0.812 . 2 193 25 25 LEU HG H 1.840 . 1 194 25 25 LEU CA C 55.170 . 1 195 25 25 LEU CB C 42.333 . 1 196 25 25 LEU CD1 C 27.801 . 1 197 25 25 LEU CD2 C 22.957 . 1 198 25 25 LEU CG C 26.590 . 1 199 25 25 LEU N N 120.702 . 1 200 26 26 ARG H H 7.985 . 1 201 26 26 ARG HA H 4.679 . 1 202 26 26 ARG HB2 H 1.555 . 2 203 26 26 ARG HB3 H 1.804 . 2 204 26 26 ARG HD2 H 3.143 . 2 205 26 26 ARG HD3 H 3.311 . 2 206 26 26 ARG HG2 H 1.552 . 2 207 26 26 ARG HG3 H 1.612 . 2 208 26 26 ARG CA C 53.475 . 1 209 26 26 ARG CB C 34.583 . 1 210 26 26 ARG CD C 43.302 . 1 211 26 26 ARG CG C 26.590 . 1 212 26 26 ARG N N 117.299 . 1 213 27 27 LYS H H 8.471 . 1 214 27 27 LYS HA H 3.464 . 1 215 27 27 LYS HB2 H 1.608 . 2 216 27 27 LYS HB3 H 1.608 . 2 217 27 27 LYS HD2 H 1.712 . 2 218 27 27 LYS HD3 H 1.712 . 2 219 27 27 LYS HE2 H 3.014 . 2 220 27 27 LYS HE3 H 3.014 . 2 221 27 27 LYS HG2 H 1.200 . 2 222 27 27 LYS HG3 H 1.266 . 2 223 27 27 LYS CA C 58.803 . 1 224 27 27 LYS CB C 32.161 . 1 225 27 27 LYS CD C 29.496 . 1 226 27 27 LYS CE C 41.849 . 1 227 27 27 LYS CG C 25.621 . 1 228 27 27 LYS N N 121.012 . 1 229 28 28 ASN H H 8.889 . 1 230 28 28 ASN HA H 4.037 . 1 231 28 28 ASN HB2 H 2.874 . 2 232 28 28 ASN HB3 H 3.348 . 2 233 28 28 ASN HD21 H 7.529 . 2 234 28 28 ASN HD22 H 7.003 . 2 235 28 28 ASN CA C 56.381 . 1 236 28 28 ASN CB C 37.247 . 1 237 28 28 ASN N N 118.846 . 1 238 28 28 ASN ND2 N 114.102 . 1 239 29 29 GLY H H 8.113 . 1 240 29 29 GLY HA2 H 3.889 . 2 241 29 29 GLY HA3 H 4.148 . 2 242 29 29 GLY CA C 44.029 . 1 243 29 29 GLY N N 107.605 . 1 244 30 30 PHE H H 8.026 . 1 245 30 30 PHE HA H 5.820 . 1 246 30 30 PHE HB2 H 2.778 . 2 247 30 30 PHE HB3 H 2.778 . 2 248 30 30 PHE CA C 56.623 . 1 249 30 30 PHE CB C 43.060 . 1 250 30 30 PHE N N 115.443 . 1 251 31 31 VAL H H 9.242 . 1 252 31 31 VAL HA H 4.706 . 1 253 31 31 VAL HB H 2.216 . 1 254 31 31 VAL HG1 H 0.601 . 2 255 31 31 VAL HG2 H 1.070 . 2 256 31 31 VAL CA C 61.225 . 1 257 31 31 VAL CB C 34.812 . 1 258 31 31 VAL CG1 C 19.566 . 1 259 31 31 VAL CG2 C 22.957 . 1 260 31 31 VAL N N 117.608 . 1 261 32 32 VAL H H 8.710 . 1 262 32 32 VAL HA H 4.565 . 1 263 32 32 VAL HB H 2.046 . 1 264 32 32 VAL HG1 H 0.647 . 2 265 32 32 VAL HG2 H 0.647 . 2 266 32 32 VAL CA C 62.194 . 1 267 32 32 VAL CB C 30.463 . 1 268 32 32 VAL CG1 C 21.261 . 1 269 32 32 VAL CG2 C 22.472 . 1 270 32 32 VAL N N 128.437 . 1 271 33 33 LEU H H 8.724 . 1 272 33 33 LEU HA H 4.720 . 1 273 33 33 LEU HB2 H 1.292 . 2 274 33 33 LEU HB3 H 1.626 . 2 275 33 33 LEU CA C 53.233 . 1 276 33 33 LEU CB C 45.482 . 1 277 33 33 LEU N N 130.396 . 1 278 34 34 LYS H H 9.448 . 1 279 34 34 LYS HA H 3.772 . 1 280 34 34 LYS HB2 H 1.718 . 2 281 34 34 LYS HB3 H 1.831 . 2 282 34 34 LYS HD2 H 1.831 . 2 283 34 34 LYS HD3 H 1.831 . 2 284 34 34 LYS HE2 H 3.147 . 2 285 34 34 LYS HE3 H 3.178 . 2 286 34 34 LYS HG2 H 1.293 . 2 287 34 34 LYS HG3 H 1.645 . 2 288 34 34 LYS CA C 55.655 . 1 289 34 34 LYS CB C 28.527 . 1 290 34 34 LYS CD C 28.527 . 1 291 34 34 LYS CE C 42.818 . 1 292 34 34 LYS CG C 25.136 . 1 293 34 34 LYS N N 121.424 . 1 294 35 35 GLY H H 8.196 . 1 295 35 35 GLY HA2 H 3.352 . 2 296 35 35 GLY HA3 H 3.972 . 2 297 35 35 GLY CA C 45.240 . 1 298 35 35 GLY N N 128.540 . 1 299 36 36 ARG H H 7.902 . 1 300 36 36 ARG HA H 4.774 . 1 301 36 36 ARG HB2 H 1.736 . 2 302 36 36 ARG HB3 H 1.318 . 2 303 36 36 ARG HE H 9.059 . 1 304 36 36 ARG CA C 49.110 . 1 305 36 36 ARG CB C 28.770 . 1 306 36 36 ARG N N 120.393 . 1 307 36 36 ARG NE N 110.596 . 1 308 37 37 PRO HA H 4.504 . 1 309 37 37 PRO HB2 H 2.044 . 2 310 37 37 PRO CA C 62.679 . 1 311 37 37 PRO CB C 30.949 . 1 312 38 38 CYS H H 9.041 . 1 313 38 38 CYS HA H 5.449 . 1 314 38 38 CYS HB2 H 2.257 . 2 315 38 38 CYS HB3 H 2.817 . 2 316 38 38 CYS CA C 58.319 . 1 317 38 38 CYS CB C 31.918 . 1 318 38 38 CYS N N 122.198 . 1 319 39 39 LYS H H 8.778 . 1 320 39 39 LYS CA C 54.686 . 1 321 39 39 LYS CB C 34.700 . 1 322 39 39 LYS CG C 24.635 . 1 323 39 39 LYS N N 123.538 . 1 324 40 40 ILE H H 9.015 . 1 325 40 40 ILE HA H 3.884 . 1 326 40 40 ILE HB H 1.663 . 1 327 40 40 ILE HD1 H 0.714 . 1 328 40 40 ILE HG12 H 0.936 . 1 329 40 40 ILE HG13 H 0.936 . 1 330 40 40 ILE HG2 H 0.670 . 1 331 40 40 ILE CA C 63.405 . 1 332 40 40 ILE CB C 37.973 . 1 333 40 40 ILE CD1 C 14.964 . 1 334 40 40 ILE CG1 C 27.801 . 1 335 40 40 ILE CG2 C 18.355 . 1 336 40 40 ILE N N 128.127 . 1 337 41 41 VAL H H 9.095 . 1 338 41 41 VAL HA H 4.570 . 1 339 41 41 VAL HB H 2.224 . 1 340 41 41 VAL HG1 H 0.785 . 2 341 41 41 VAL HG2 H 0.918 . 2 342 41 41 VAL CA C 61.710 . 1 343 41 41 VAL CB C 32.887 . 1 344 41 41 VAL CG1 C 19.081 . 1 345 41 41 VAL CG2 C 21.503 . 1 346 41 41 VAL N N 124.724 . 1 347 42 42 GLU H H 7.762 . 1 348 42 42 GLU HA H 4.501 . 1 349 42 42 GLU HB2 H 1.806 . 2 350 42 42 GLU HB3 H 1.806 . 2 351 42 42 GLU HG2 H 2.133 . 2 352 42 42 GLU HG3 H 2.133 . 2 353 42 42 GLU CA C 56.139 . 1 354 42 42 GLU CB C 33.372 . 1 355 42 42 GLU CG C 36.278 . 1 356 42 42 GLU N N 121.012 . 1 357 43 43 MET H H 8.530 . 1 358 43 43 MET HA H 5.220 . 1 359 43 43 MET HB2 H 1.660 . 2 360 43 43 MET HB3 H 1.810 . 2 361 43 43 MET HE H 1.990 . 1 362 43 43 MET HG2 H 2.180 . 2 363 43 43 MET HG3 H 2.180 . 2 364 43 43 MET CA C 55.412 . 1 365 43 43 MET CB C 36.036 . 1 366 43 43 MET CE C 18.112 . 1 367 43 43 MET CG C 32.160 . 1 368 43 43 MET N N 123.126 . 1 369 44 44 SER H H 8.713 . 1 370 44 44 SER HA H 4.888 . 1 371 44 44 SER HB2 H 3.910 . 2 372 44 44 SER HB3 H 3.910 . 2 373 44 44 SER CA C 57.350 . 1 374 44 44 SER CB C 65.343 . 1 375 44 44 SER N N 119.980 . 1 376 45 45 THR H H 8.772 . 1 377 45 45 THR HA H 5.127 . 1 378 45 45 THR HB H 4.024 . 1 379 45 45 THR HG2 H 1.186 . 1 380 45 45 THR CA C 61.710 . 1 381 45 45 THR CB C 70.429 . 1 382 45 45 THR CG2 C 21.988 . 1 383 45 45 THR N N 119.671 . 1 384 46 46 SER H H 8.945 . 1 385 46 46 SER HA H 4.691 . 1 386 46 46 SER HB2 H 3.911 . 2 387 46 46 SER HB3 H 3.855 . 2 388 46 46 SER CA C 57.592 . 1 389 46 46 SER CB C 65.343 . 1 390 46 46 SER N N 121.527 . 1 391 47 47 LYS H H 8.664 . 1 392 47 47 LYS HA H 4.542 . 1 393 47 47 LYS HB2 H 1.866 . 2 394 47 47 LYS HB3 H 1.741 . 2 395 47 47 LYS HD2 H 1.696 . 2 396 47 47 LYS HD3 H 1.696 . 2 397 47 47 LYS HE2 H 1.377 . 2 398 47 47 LYS HE3 H 1.377 . 2 399 47 47 LYS HG2 H 1.410 . 2 400 47 47 LYS HG3 H 1.410 . 2 401 47 47 LYS CA C 56.381 . 1 402 47 47 LYS CB C 33.613 . 1 403 47 47 LYS CD C 29.011 . 1 404 47 47 LYS CE C 41.122 . 1 405 47 47 LYS CG C 25.065 . 1 406 47 47 LYS N N 124.002 . 1 407 48 48 THR H H 8.347 . 1 408 48 48 THR HA H 4.406 . 1 409 48 48 THR HB H 4.196 . 1 410 48 48 THR HG2 H 1.163 . 1 411 48 48 THR CA C 61.952 . 1 412 48 48 THR CB C 69.945 . 1 413 48 48 THR CG2 C 21.503 . 1 414 48 48 THR N N 116.474 . 1 415 50 50 LYS H H 8.660 . 1 416 50 50 LYS HA H 4.140 . 1 417 50 50 LYS HB2 H 1.563 . 2 418 50 50 LYS HB3 H 1.563 . 2 419 50 50 LYS HG2 H 1.204 . 2 420 50 50 LYS HG3 H 1.204 . 2 421 50 50 LYS CA C 57.350 . 1 422 50 50 LYS CB C 32.887 . 1 423 50 50 LYS CD C 29.178 . 1 424 50 50 LYS CG C 24.652 . 1 425 51 51 HIS H H 8.150 . 1 426 51 51 HIS HA H 4.650 . 1 427 51 51 HIS HB2 H 3.255 . 2 428 51 51 HIS HB3 H 2.978 . 2 429 51 51 HIS CA C 55.897 . 1 430 51 51 HIS CB C 29.254 . 1 431 51 51 HIS N N 109.478 . 1 432 52 52 GLY H H 8.105 . 1 433 52 52 GLY HA2 H 3.973 . 2 434 52 52 GLY HA3 H 3.747 . 2 435 52 52 GLY CA C 45.724 . 1 436 53 53 HIS H H 8.103 . 1 437 53 53 HIS HA H 4.777 . 1 438 53 53 HIS HB2 H 3.153 . 2 439 53 53 HIS HB3 H 3.252 . 2 440 53 53 HIS CA C 55.655 . 1 441 53 53 HIS CB C 30.465 . 1 442 53 53 HIS N N 119.067 . 1 443 54 54 ALA H H 8.747 . 1 444 54 54 ALA HA H 4.696 . 1 445 54 54 ALA HB H 1.378 . 1 446 54 54 ALA CA C 52.264 . 1 447 54 54 ALA CB C 20.292 . 1 448 54 54 ALA N N 122.043 . 1 449 55 55 LYS H H 8.748 . 1 450 55 55 LYS HA H 4.721 . 1 451 55 55 LYS HB2 H 1.490 . 2 452 55 55 LYS HB3 H 1.645 . 2 453 55 55 LYS HG2 H 1.209 . 2 454 55 55 LYS HG3 H 1.412 . 2 455 55 55 LYS CA C 55.170 . 1 456 55 55 LYS CB C 35.551 . 1 457 55 55 LYS CG C 25.379 . 1 458 55 55 LYS N N 121.940 . 1 459 56 56 VAL H H 9.184 . 1 460 56 56 VAL HA H 4.677 . 1 461 56 56 VAL HB H 2.071 . 1 462 56 56 VAL HG1 H 0.760 . 2 463 56 56 VAL HG2 H 0.807 . 2 464 56 56 VAL CA C 60.983 . 1 465 56 56 VAL CB C 34.098 . 1 466 56 56 VAL CG1 C 21.746 . 1 467 56 56 VAL CG2 C 21.019 . 1 468 56 56 VAL N N 124.827 . 1 469 57 57 HIS H H 9.254 . 1 470 57 57 HIS HA H 5.302 . 1 471 57 57 HIS HB2 H 3.267 . 2 472 57 57 HIS HB3 H 2.973 . 2 473 57 57 HIS CA C 53.717 . 1 474 57 57 HIS CB C 30.950 . 1 475 57 57 HIS N N 127.818 . 1 476 58 58 LEU H H 8.958 . 1 477 58 58 LEU HA H 4.901 . 1 478 58 58 LEU HB2 H 1.169 . 2 479 58 58 LEU HB3 H 1.624 . 2 480 58 58 LEU HD1 H 0.831 . 2 481 58 58 LEU HD2 H 0.831 . 2 482 58 58 LEU HG H 0.834 . 1 483 58 58 LEU CA C 54.621 . 1 484 58 58 LEU CB C 46.693 . 1 485 58 58 LEU CD1 C 25.621 . 1 486 58 58 LEU CD2 C 25.621 . 1 487 58 58 LEU CG C 27.316 . 1 488 58 58 LEU N N 128.437 . 1 489 59 59 VAL H H 8.210 . 1 490 59 59 VAL HA H 4.616 . 1 491 59 59 VAL HB H 1.804 . 1 492 59 59 VAL HG1 H 0.615 . 2 493 59 59 VAL HG2 H 0.842 . 2 494 59 59 VAL CA C 61.225 . 1 495 59 59 VAL CB C 33.372 . 1 496 59 59 VAL CG1 C 20.292 . 1 497 59 59 VAL CG2 C 21.261 . 1 498 59 59 VAL N N 120.496 . 1 499 60 60 GLY H H 9.521 . 1 500 60 60 GLY HA2 H 3.129 . 2 501 60 60 GLY HA3 H 5.540 . 2 502 60 60 GLY CA C 44.029 . 1 503 60 60 GLY N N 115.546 . 1 504 61 61 ILE H H 8.798 . 1 505 61 61 ILE HA H 4.880 . 1 506 61 61 ILE HB H 1.694 . 1 507 61 61 ILE HD1 H 0.774 . 1 508 61 61 ILE HG12 H 1.199 . 1 509 61 61 ILE HG13 H 1.484 . 1 510 61 61 ILE HG2 H 0.816 . 1 511 61 61 ILE CA C 58.077 . 1 512 61 61 ILE CB C 39.669 . 1 513 61 61 ILE CD1 C 11.573 . 1 514 61 61 ILE CG1 C 27.074 . 1 515 61 61 ILE CG2 C 17.144 . 1 516 61 61 ILE N N 119.774 . 1 517 62 62 ASP H H 9.325 . 1 518 62 62 ASP HA H 5.051 . 1 519 62 62 ASP HB2 H 2.855 . 2 520 62 62 ASP HB3 H 3.218 . 2 521 62 62 ASP CA C 55.170 . 1 522 62 62 ASP CB C 44.271 . 1 523 62 62 ASP N N 132.046 . 1 524 63 63 ILE H H 8.622 . 1 525 63 63 ILE HA H 4.046 . 1 526 63 63 ILE HB H 1.730 . 1 527 63 63 ILE HD1 H 0.289 . 1 528 63 63 ILE HG12 H 0.970 . 1 529 63 63 ILE HG13 H 0.970 . 1 530 63 63 ILE HG2 H 0.970 . 1 531 63 63 ILE CA C 64.132 . 1 532 63 63 ILE CB C 37.005 . 1 533 63 63 ILE CD1 C 14.237 . 1 534 63 63 ILE CG1 C 24.410 . 1 535 63 63 ILE CG2 C 18.112 . 1 536 63 63 ILE N N 123.899 . 1 537 64 64 PHE H H 9.385 . 1 538 64 64 PHE HA H 4.792 . 1 539 64 64 PHE HB2 H 3.187 . 2 540 64 64 PHE HB3 H 3.187 . 2 541 64 64 PHE HD1 H 7.073 . 3 542 64 64 PHE HD2 H 7.073 . 3 543 64 64 PHE HE1 H 7.189 . 3 544 64 64 PHE HE2 H 7.189 . 3 545 64 64 PHE CA C 60.257 . 1 546 64 64 PHE CB C 41.122 . 1 547 64 64 PHE N N 118.433 . 1 548 65 65 THR H H 8.385 . 1 549 65 65 THR HA H 4.649 . 1 550 65 65 THR HB H 4.545 . 1 551 65 65 THR HG2 H 1.324 . 1 552 65 65 THR CA C 61.952 . 1 553 65 65 THR CB C 71.883 . 1 554 65 65 THR CG2 C 20.777 . 1 555 65 65 THR N N 108.379 . 1 556 66 66 GLY H H 8.359 . 1 557 66 66 GLY HA2 H 4.242 . 2 558 66 66 GLY HA3 H 3.753 . 2 559 66 66 GLY CA C 45.724 . 1 560 66 66 GLY N N 111.318 . 1 561 67 67 LYS H H 7.552 . 1 562 67 67 LYS HA H 4.080 . 1 563 67 67 LYS HB2 H 1.601 . 2 564 67 67 LYS HB3 H 1.601 . 2 565 67 67 LYS HD2 H 1.696 . 2 566 67 67 LYS HD3 H 1.696 . 2 567 67 67 LYS HE2 H 2.947 . 2 568 67 67 LYS HE3 H 2.947 . 2 569 67 67 LYS HG2 H 1.200 . 2 570 67 67 LYS HG3 H 1.387 . 2 571 67 67 LYS CA C 57.108 . 1 572 67 67 LYS CB C 33.614 . 1 573 67 67 LYS CD C 29.012 . 1 574 67 67 LYS CE C 42.333 . 1 575 67 67 LYS CG C 25.863 . 1 576 67 67 LYS N N 121.733 . 1 577 68 68 LYS H H 8.021 . 1 578 68 68 LYS HA H 5.015 . 1 579 68 68 LYS HB2 H 1.598 . 2 580 68 68 LYS HB3 H 1.598 . 2 581 68 68 LYS HD2 H 1.573 . 2 582 68 68 LYS HD3 H 1.573 . 2 583 68 68 LYS HE2 H 2.766 . 2 584 68 68 LYS HE3 H 2.766 . 2 585 68 68 LYS HG2 H 1.164 . 2 586 68 68 LYS HG3 H 1.354 . 2 587 68 68 LYS CA C 55.655 . 1 588 68 68 LYS CB C 33.614 . 1 589 68 68 LYS CD C 29.254 . 1 590 68 68 LYS CE C 41.605 . 1 591 68 68 LYS CG C 25.136 . 1 592 68 68 LYS N N 123.435 . 1 593 69 69 TYR H H 9.089 . 1 594 69 69 TYR HA H 4.745 . 1 595 69 69 TYR HB2 H 2.563 . 2 596 69 69 TYR HB3 H 2.739 . 2 597 69 69 TYR CA C 57.350 . 1 598 69 69 TYR CB C 43.544 . 1 599 69 69 TYR N N 125.343 . 1 600 70 70 GLU H H 8.525 . 1 601 70 70 GLU HA H 5.573 . 1 602 70 70 GLU HB2 H 2.033 . 2 603 70 70 GLU HB3 H 2.140 . 2 604 70 70 GLU HG2 H 2.330 . 2 605 70 70 GLU HG3 H 2.330 . 2 606 70 70 GLU CA C 54.201 . 1 607 70 70 GLU CB C 34.825 . 1 608 70 70 GLU CG C 36.278 . 1 609 70 70 GLU N N 117.815 . 1 610 71 71 ASP H H 8.795 . 1 611 71 71 ASP HA H 4.932 . 1 612 71 71 ASP HB2 H 2.470 . 2 613 71 71 ASP HB3 H 2.578 . 2 614 71 71 ASP CA C 53.233 . 1 615 71 71 ASP CB C 45.724 . 1 616 71 71 ASP N N 118.537 . 1 617 72 72 ILE H H 8.743 . 1 618 72 72 ILE HA H 5.274 . 1 619 72 72 ILE HB H 1.609 . 1 620 72 72 ILE HD1 H 0.691 . 1 621 72 72 ILE HG12 H 0.750 . 1 622 72 72 ILE HG13 H 1.480 . 1 623 72 72 ILE HG2 H 0.689 . 1 624 72 72 ILE CA C 60.257 . 1 625 72 72 ILE CB C 40.638 . 1 626 72 72 ILE CD1 C 13.753 . 1 627 72 72 ILE CG1 C 28.285 . 1 628 72 72 ILE CG2 C 18.112 . 1 629 72 72 ILE N N 121.527 . 1 630 73 73 CYS H H 9.090 . 1 631 73 73 CYS HA H 5.086 . 1 632 73 73 CYS HB2 H 2.688 . 2 633 73 73 CYS HB3 H 2.943 . 2 634 73 73 CYS CA C 55.170 . 1 635 73 73 CYS CB C 31.676 . 1 636 73 73 CYS N N 126.323 . 1 637 74 74 PRO HA H 4.695 . 1 638 74 74 PRO HB2 H 1.630 . 2 639 74 74 PRO HB3 H 2.376 . 2 640 74 74 PRO HD2 H 3.314 . 2 641 74 74 PRO HD3 H 3.885 . 2 642 74 74 PRO HG2 H 1.854 . 2 643 74 74 PRO HG3 H 1.854 . 2 644 74 74 PRO CA C 63.647 . 1 645 74 74 PRO CB C 32.403 . 1 646 74 74 PRO CD C 51.295 . 1 647 74 74 PRO CG C 28.527 . 1 648 75 75 SER H H 8.644 . 1 649 75 75 SER HA H 3.974 . 1 650 75 75 SER HB2 H 3.705 . 2 651 75 75 SER HB3 H 3.705 . 2 652 75 75 SER CA C 62.436 . 1 653 75 75 SER CB C 62.921 . 1 654 75 75 SER N N 119.362 . 1 655 76 76 THR H H 7.195 . 1 656 76 76 THR HA H 4.369 . 1 657 76 76 THR HB H 4.544 . 1 658 76 76 THR HG2 H 1.186 . 1 659 76 76 THR CA C 60.983 . 1 660 76 76 THR CB C 69.218 . 1 661 76 76 THR CG2 C 22.230 . 1 662 76 76 THR N N 132.459 . 1 663 77 77 HIS H H 7.764 . 1 664 77 77 HIS HA H 4.574 . 1 665 77 77 HIS HB2 H 3.212 . 2 666 77 77 HIS HB3 H 3.104 . 2 667 77 77 HIS CA C 56.139 . 1 668 77 77 HIS CB C 31.918 . 1 669 77 77 HIS N N 123.641 . 1 670 78 78 ASN H H 8.478 . 1 671 78 78 ASN HA H 4.908 . 1 672 78 78 ASN HB2 H 2.597 . 2 673 78 78 ASN HB3 H 2.327 . 2 674 78 78 ASN HD21 H 6.739 . 2 675 78 78 ASN HD22 H 7.433 . 2 676 78 78 ASN CA C 53.233 . 1 677 78 78 ASN CB C 38.942 . 1 678 78 78 ASN N N 123.693 . 1 679 78 78 ASN ND2 N 112.246 . 1 680 79 79 MET H H 8.904 . 1 681 79 79 MET HA H 4.672 . 1 682 79 79 MET HB2 H 1.673 . 2 683 79 79 MET HB3 H 1.673 . 2 684 79 79 MET HE H 2.112 . 1 685 79 79 MET HG2 H 2.466 . 2 686 79 79 MET HG3 H 2.569 . 2 687 79 79 MET CA C 52.990 . 1 688 79 79 MET CB C 34.825 . 1 689 79 79 MET CE C 18.112 . 1 690 79 79 MET CG C 33.129 . 1 691 79 79 MET N N 122.868 . 1 692 80 80 ASP H H 8.909 . 1 693 80 80 ASP HA H 4.795 . 1 694 80 80 ASP HB2 H 2.452 . 2 695 80 80 ASP HB3 H 2.030 . 2 696 80 80 ASP CA C 54.444 . 1 697 80 80 ASP CB C 42.091 . 1 698 80 80 ASP N N 120.805 . 1 699 81 81 VAL H H 9.096 . 1 700 81 81 VAL HA H 4.294 . 1 701 81 81 VAL HB H 0.965 . 1 702 81 81 VAL HG1 H 0.796 . 2 703 81 81 VAL HG2 H 0.855 . 2 704 81 81 VAL CA C 58.803 . 1 705 81 81 VAL CB C 33.129 . 1 706 81 81 VAL CG1 C 21.503 . 1 707 81 81 VAL CG2 C 21.503 . 1 708 81 81 VAL N N 124.724 . 1 709 82 82 PRO HD2 H 3.520 . 2 710 82 82 PRO HD3 H 3.604 . 2 711 82 82 PRO HG2 H 1.613 . 2 712 82 82 PRO HG3 H 1.613 . 2 713 82 82 PRO CD C 49.357 . 1 714 82 82 PRO CG C 26.693 . 1 715 83 83 ASN H H 7.944 . 1 716 83 83 ASN HA H 4.822 . 1 717 83 83 ASN HB2 H 2.790 . 2 718 83 83 ASN HB3 H 2.554 . 2 719 83 83 ASN HD21 H 7.432 . 2 720 83 83 ASN HD22 H 6.891 . 2 721 83 83 ASN CA C 53.232 . 1 722 83 83 ASN CB C 38.700 . 1 723 83 83 ASN N N 120.702 . 1 724 83 83 ASN ND2 N 112.710 . 1 725 84 84 ILE H H 8.220 . 1 726 84 84 ILE HA H 4.489 . 1 727 84 84 ILE HB H 1.377 . 1 728 84 84 ILE HD1 H -0.051 . 1 729 84 84 ILE HG12 H 0.536 . 1 730 84 84 ILE HG13 H 0.902 . 1 731 84 84 ILE HG2 H 0.475 . 1 732 84 84 ILE CA C 60.499 . 1 733 84 84 ILE CB C 39.427 . 1 734 84 84 ILE CD1 C 13.268 . 1 735 84 84 ILE CG1 C 27.316 . 1 736 84 84 ILE CG2 C 17.870 . 1 737 84 84 ILE N N 127.715 . 1 738 85 85 LYS H H 8.712 . 1 739 85 85 LYS HA H 4.713 . 1 740 85 85 LYS HB2 H 1.754 . 2 741 85 85 LYS HB3 H 1.792 . 2 742 85 85 LYS HD2 H 1.684 . 2 743 85 85 LYS HD3 H 1.684 . 2 744 85 85 LYS HE2 H 2.949 . 2 745 85 85 LYS HE3 H 2.949 . 2 746 85 85 LYS HG2 H 1.388 . 2 747 85 85 LYS HG3 H 1.388 . 2 748 85 85 LYS CA C 54.686 . 1 749 85 85 LYS CB C 35.309 . 1 750 85 85 LYS CD C 29.254 . 1 751 85 85 LYS CE C 42.333 . 1 752 85 85 LYS CG C 24.894 . 1 753 85 85 LYS N N 128.127 . 1 754 86 86 ARG H H 8.357 . 1 755 86 86 ARG HA H 5.220 . 1 756 86 86 ARG HB2 H 1.464 . 2 757 86 86 ARG HB3 H 1.601 . 2 758 86 86 ARG HD2 H 3.070 . 2 759 86 86 ARG HD3 H 3.028 . 2 760 86 86 ARG HG2 H 1.394 . 2 761 86 86 ARG HG3 H 1.282 . 2 762 86 86 ARG CA C 54.686 . 1 763 86 86 ARG CB C 33.372 . 1 764 86 86 ARG CD C 43.544 . 1 765 86 86 ARG CG C 28.043 . 1 766 86 86 ARG N N 122.868 . 1 767 87 87 ASN H H 8.496 . 1 768 87 87 ASN HA H 4.842 . 1 769 87 87 ASN HB2 H 2.331 . 2 770 87 87 ASN HB3 H 2.102 . 2 771 87 87 ASN HD21 H 7.834 . 2 772 87 87 ASN HD22 H 6.800 . 2 773 87 87 ASN CA C 52.748 . 1 774 87 87 ASN CB C 44.271 . 1 775 87 87 ASN N N 122.198 . 1 776 87 87 ASN ND2 N 114.412 . 1 777 88 88 ASP H H 8.420 . 1 778 88 88 ASP HA H 5.617 . 1 779 88 88 ASP HB2 H 2.455 . 2 780 88 88 ASP HB3 H 2.248 . 2 781 88 88 ASP CA C 52.990 . 1 782 88 88 ASP CB C 43.060 . 1 783 88 88 ASP N N 121.940 . 1 784 89 89 PHE H H 9.153 . 1 785 89 89 PHE HA H 5.018 . 1 786 89 89 PHE HB2 H 2.705 . 2 787 89 89 PHE HB3 H 3.083 . 2 788 89 89 PHE HD1 H 7.171 . 3 789 89 89 PHE HD2 H 7.171 . 3 790 89 89 PHE HE1 H 7.281 . 3 791 89 89 PHE HE2 H 7.281 . 3 792 89 89 PHE CA C 55.655 . 1 793 89 89 PHE CB C 44.997 . 1 794 89 89 PHE N N 120.702 . 1 795 90 90 GLN H H 9.012 . 1 796 90 90 GLN HA H 4.602 . 1 797 90 90 GLN HB2 H 2.081 . 2 798 90 90 GLN HB3 H 2.081 . 2 799 90 90 GLN HE21 H 6.754 . 2 800 90 90 GLN HE22 H 7.513 . 2 801 90 90 GLN HG2 H 2.296 . 2 802 90 90 GLN HG3 H 2.532 . 2 803 90 90 GLN CA C 56.866 . 1 804 90 90 GLN CB C 29.738 . 1 805 90 90 GLN CG C 33.614 . 1 806 90 90 GLN N N 123.899 . 1 807 90 90 GLN NE2 N 110.854 . 1 808 91 91 LEU H H 8.398 . 1 809 91 91 LEU HA H 4.722 . 1 810 91 91 LEU HB2 H 2.602 . 2 811 91 91 LEU HB3 H 2.602 . 2 812 91 91 LEU HD1 H 0.982 . 2 813 91 91 LEU HG H 0.860 . 1 814 91 91 LEU CA C 54.686 . 1 815 91 91 LEU CB C 42.091 . 1 816 91 91 LEU CD1 C 25.621 . 1 817 91 91 LEU CG C 28.043 . 1 818 91 91 LEU N N 128.024 . 1 819 92 92 ILE H H 8.915 . 1 820 92 92 ILE HA H 4.875 . 1 821 92 92 ILE HB H 2.139 . 1 822 92 92 ILE HD1 H 0.843 . 1 823 92 92 ILE HG12 H 0.976 . 1 824 92 92 ILE HG13 H 1.165 . 1 825 92 92 ILE HG2 H 0.908 . 1 826 92 92 ILE CA C 60.983 . 1 827 92 92 ILE CB C 39.185 . 1 828 92 92 ILE CD1 C 13.995 . 1 829 92 92 ILE CG1 C 27.074 . 1 830 92 92 ILE CG2 C 18.112 . 1 831 92 92 ILE N N 122.971 . 1 832 93 93 GLY H H 7.331 . 1 833 93 93 GLY HA2 H 4.091 . 2 834 93 93 GLY HA3 H 4.091 . 2 835 93 93 GLY CA C 45.724 . 1 836 93 93 GLY N N 108.946 . 1 837 94 94 ILE H H 7.177 . 1 838 94 94 ILE HA H 4.530 . 1 839 94 94 ILE HB H 1.380 . 1 840 94 94 ILE HD1 H 0.619 . 1 841 94 94 ILE HG12 H 0.981 . 1 842 94 94 ILE HG13 H 0.981 . 1 843 94 94 ILE HG2 H 0.654 . 1 844 94 94 ILE CA C 61.710 . 1 845 94 94 ILE CB C 41.122 . 1 846 94 94 ILE CD1 C 14.964 . 1 847 94 94 ILE CG1 C 25.621 . 1 848 94 94 ILE CG2 C 17.144 . 1 849 94 94 ILE N N 118.433 . 1 850 95 95 GLN H H 8.788 . 1 851 95 95 GLN HA H 4.637 . 1 852 95 95 GLN HB2 H 2.042 . 2 853 95 95 GLN HB3 H 1.952 . 2 854 95 95 GLN HE21 H 6.752 . 2 855 95 95 GLN HE22 H 7.504 . 2 856 95 95 GLN HG2 H 2.271 . 2 857 95 95 GLN HG3 H 2.271 . 2 858 95 95 GLN CA C 55.170 . 1 859 95 95 GLN CB C 30.949 . 1 860 95 95 GLN CG C 33.372 . 1 861 95 95 GLN N N 126.632 . 1 862 95 95 GLN NE2 N 112.865 . 1 863 96 96 ASP H H 9.448 . 1 864 96 96 ASP HA H 4.342 . 1 865 96 96 ASP HB2 H 3.077 . 2 866 96 96 ASP HB3 H 2.711 . 2 867 96 96 ASP CA C 55.412 . 1 868 96 96 ASP CB C 40.396 . 1 869 96 96 ASP N N 128.024 . 1 870 97 97 GLY H H 8.482 . 1 871 97 97 GLY HA2 H 3.362 . 2 872 97 97 GLY HA3 H 4.071 . 2 873 97 97 GLY CA C 45.724 . 1 874 97 97 GLY N N 129.158 . 1 875 98 98 TYR H H 8.232 . 1 876 98 98 TYR HA H 4.658 . 1 877 98 98 TYR HB2 H 2.841 . 2 878 98 98 TYR HB3 H 2.841 . 2 879 98 98 TYR HD1 H 6.960 . 3 880 98 98 TYR CA C 58.319 . 1 881 98 98 TYR CB C 40.153 . 1 882 98 98 TYR N N 120.857 . 1 883 99 99 LEU H H 8.827 . 1 884 99 99 LEU HA H 4.311 . 1 885 99 99 LEU HB2 H 1.035 . 2 886 99 99 LEU HB3 H 1.780 . 2 887 99 99 LEU HD1 H 0.749 . 2 888 99 99 LEU HD2 H 0.785 . 2 889 99 99 LEU HG H 1.552 . 1 890 99 99 LEU CA C 53.959 . 1 891 99 99 LEU CB C 42.333 . 1 892 99 99 LEU CD1 C 26.590 . 1 893 99 99 LEU CD2 C 24.168 . 1 894 99 99 LEU CG C 26.105 . 1 895 99 99 LEU N N 120.908 . 1 896 100 100 SER H H 8.380 . 1 897 100 100 SER HA H 4.970 . 1 898 100 100 SER HB2 H 3.496 . 2 899 100 100 SER HB3 H 3.451 . 2 900 100 100 SER CA C 58.076 . 1 901 100 100 SER CB C 62.679 . 1 902 100 100 SER N N 118.949 . 1 903 101 101 LEU H H 8.699 . 1 904 101 101 LEU HA H 5.217 . 1 905 101 101 LEU HB2 H 1.140 . 2 906 101 101 LEU HB3 H 1.530 . 2 907 101 101 LEU HD1 H 0.824 . 2 908 101 101 LEU HD2 H 0.824 . 2 909 101 101 LEU HG H 0.509 . 1 910 101 101 LEU CA C 52.748 . 1 911 101 101 LEU CB C 44.029 . 1 912 101 101 LEU CD1 C 23.925 . 1 913 101 101 LEU CD2 C 23.925 . 1 914 101 101 LEU CG C 26.105 . 1 915 101 101 LEU N N 126.529 . 1 916 102 102 LEU H H 9.135 . 1 917 102 102 LEU HA H 4.729 . 1 918 102 102 LEU HB2 H 1.969 . 2 919 102 102 LEU HB3 H 1.363 . 2 920 102 102 LEU HD1 H 0.853 . 2 921 102 102 LEU HD2 H 0.853 . 2 922 102 102 LEU HG H 0.884 . 1 923 102 102 LEU CA C 54.685 . 1 924 102 102 LEU CB C 45.240 . 1 925 102 102 LEU CD1 C 23.925 . 1 926 102 102 LEU CD2 C 23.925 . 1 927 102 102 LEU CG C 26.105 . 1 928 102 102 LEU N N 125.961 . 1 929 103 103 GLN H H 8.799 . 1 930 103 103 GLN HA H 4.629 . 1 931 103 103 GLN HB2 H 2.368 . 2 932 103 103 GLN HB3 H 2.368 . 2 933 103 103 GLN HE21 H 6.689 . 2 934 103 103 GLN HE22 H 6.689 . 2 935 103 103 GLN HG2 H 2.221 . 2 936 103 103 GLN HG3 H 2.101 . 2 937 103 103 GLN CA C 55.170 . 1 938 103 103 GLN CB C 31.192 . 1 939 103 103 GLN CG C 35.309 . 1 940 103 103 GLN N N 127.251 . 1 941 103 103 GLN NE2 N 111.421 . 1 942 104 104 ASP H H 9.181 . 1 943 104 104 ASP HA H 4.366 . 1 944 104 104 ASP HB2 H 2.772 . 2 945 104 104 ASP HB3 H 2.772 . 2 946 104 104 ASP CA C 57.108 . 1 947 104 104 ASP CB C 40.153 . 1 948 104 104 ASP N N 124.827 . 1 949 105 105 SER H H 7.740 . 1 950 105 105 SER HA H 4.321 . 1 951 105 105 SER HB2 H 4.133 . 2 952 105 105 SER HB3 H 3.896 . 2 953 105 105 SER CA C 58.319 . 1 954 105 105 SER CB C 63.889 . 1 955 105 105 SER N N 111.885 . 1 956 106 106 GLY H H 8.251 . 1 957 106 106 GLY HA2 H 4.457 . 2 958 106 106 GLY HA3 H 3.610 . 2 959 106 106 GLY CA C 44.997 . 1 960 106 106 GLY N N 111.421 . 1 961 107 107 GLU H H 7.669 . 1 962 107 107 GLU HA H 4.298 . 1 963 107 107 GLU HB2 H 1.749 . 2 964 107 107 GLU HB3 H 1.944 . 2 965 107 107 GLU HG2 H 2.167 . 2 966 107 107 GLU HG3 H 2.223 . 2 967 107 107 GLU CA C 56.139 . 1 968 107 107 GLU CB C 30.707 . 1 969 107 107 GLU CG C 36.520 . 1 970 107 107 GLU N N 120.702 . 1 971 108 108 VAL H H 8.512 . 1 972 108 108 VAL HA H 4.905 . 1 973 108 108 VAL HB H 1.899 . 1 974 108 108 VAL HG1 H 0.791 . 2 975 108 108 VAL HG2 H 0.903 . 2 976 108 108 VAL CA C 61.468 . 1 977 108 108 VAL CB C 34.098 . 1 978 108 108 VAL CG1 C 21.745 . 1 979 108 108 VAL CG2 C 21.745 . 1 980 108 108 VAL N N 123.383 . 1 981 109 109 ARG H H 9.123 . 1 982 109 109 ARG HA H 4.805 . 1 983 109 109 ARG HB2 H 1.871 . 2 984 109 109 ARG HB3 H 1.734 . 2 985 109 109 ARG HD2 H 2.949 . 2 986 109 109 ARG HD3 H 2.949 . 2 987 109 109 ARG HE H 8.720 . 1 988 109 109 ARG HG2 H 1.617 . 2 989 109 109 ARG HG3 H 1.560 . 2 990 109 109 ARG CA C 54.686 . 1 991 109 109 ARG CB C 32.645 . 1 992 109 109 ARG CD C 42.333 . 1 993 109 109 ARG CG C 26.347 . 1 994 109 109 ARG N N 125.446 . 1 995 109 109 ARG NE N 110.390 . 1 996 110 110 GLU H H 9.192 . 1 997 110 110 GLU HA H 5.415 . 1 998 110 110 GLU HB2 H 2.174 . 2 999 110 110 GLU HB3 H 1.654 . 2 1000 110 110 GLU HG2 H 2.076 . 2 1001 110 110 GLU HG3 H 2.030 . 2 1002 110 110 GLU CA C 55.412 . 1 1003 110 110 GLU CB C 30.707 . 1 1004 110 110 GLU CG C 37.247 . 1 1005 110 110 GLU N N 127.251 . 1 1006 111 111 ASP H H 9.053 . 1 1007 111 111 ASP HA H 4.456 . 1 1008 111 111 ASP HB2 H 2.759 . 2 1009 111 111 ASP HB3 H 2.538 . 2 1010 111 111 ASP CA C 54.201 . 1 1011 111 111 ASP CB C 40.880 . 1 1012 111 111 ASP N N 116.062 . 1 1013 112 112 LEU H H 8.781 . 1 1014 112 112 LEU HA H 4.591 . 1 1015 112 112 LEU HB2 H 1.788 . 2 1016 112 112 LEU HB3 H 1.312 . 2 1017 112 112 LEU HD1 H 0.686 . 2 1018 112 112 LEU HD2 H 0.686 . 2 1019 112 112 LEU HG H 0.619 . 1 1020 112 112 LEU CA C 54.201 . 1 1021 112 112 LEU CB C 42.091 . 1 1022 112 112 LEU CD1 C 24.652 . 1 1023 112 112 LEU CD2 C 24.652 . 1 1024 112 112 LEU CG C 26.347 . 1 1025 112 112 LEU N N 123.693 . 1 1026 113 113 ARG H H 8.358 . 1 1027 113 113 ARG HA H 3.949 . 1 1028 113 113 ARG HB2 H 1.591 . 2 1029 113 113 ARG HB3 H 1.468 . 2 1030 113 113 ARG HD2 H 2.953 . 2 1031 113 113 ARG HD3 H 2.879 . 2 1032 113 113 ARG HE H 7.002 . 1 1033 113 113 ARG HG2 H 1.467 . 2 1034 113 113 ARG HG3 H 1.116 . 2 1035 113 113 ARG CA C 55.655 . 1 1036 113 113 ARG CB C 31.192 . 1 1037 113 113 ARG CD C 43.060 . 1 1038 113 113 ARG CG C 27.801 . 1 1039 113 113 ARG N N 122.868 . 1 1040 113 113 ARG NE N 111.627 . 1 1041 114 114 LEU H H 7.853 . 1 1042 114 114 LEU HA H 4.048 . 1 1043 114 114 LEU HB2 H 0.956 . 2 1044 114 114 LEU HB3 H 1.570 . 2 1045 114 114 LEU HD1 H 0.937 . 2 1046 114 114 LEU HG H 0.798 . 1 1047 114 114 LEU CA C 53.474 . 1 1048 114 114 LEU CB C 43.302 . 1 1049 114 114 LEU CD1 C 25.863 . 1 1050 114 114 LEU CG C 26.347 . 1 1051 114 114 LEU N N 122.713 . 1 1052 115 115 PRO HA H 4.430 . 1 1053 115 115 PRO HB2 H 2.569 . 2 1054 115 115 PRO HB3 H 1.737 . 2 1055 115 115 PRO HD2 H 3.396 . 2 1056 115 115 PRO HD3 H 3.993 . 2 1057 115 115 PRO HG2 H 2.036 . 2 1058 115 115 PRO HG3 H 1.638 . 2 1059 115 115 PRO CA C 62.921 . 1 1060 115 115 PRO CB C 32.645 . 1 1061 115 115 PRO CD C 50.811 . 1 1062 115 115 PRO CG C 28.043 . 1 1063 116 116 GLU H H 8.314 . 1 1064 116 116 GLU HA H 4.300 . 1 1065 116 116 GLU HB2 H 2.135 . 2 1066 116 116 GLU HB3 H 1.956 . 2 1067 116 116 GLU HG2 H 2.378 . 2 1068 116 116 GLU HG3 H 2.334 . 2 1069 116 116 GLU CA C 56.139 . 1 1070 116 116 GLU CB C 30.949 . 1 1071 116 116 GLU CG C 36.762 . 1 1072 116 116 GLU N N 119.774 . 1 1073 117 117 GLY H H 8.499 . 1 1074 117 117 GLY HA2 H 4.158 . 2 1075 117 117 GLY HA3 H 3.914 . 2 1076 117 117 GLY CA C 45.482 . 1 1077 117 117 GLY N N 108.224 . 1 1078 118 118 ASP H H 8.757 . 1 1079 118 118 ASP HA H 4.780 . 1 1080 118 118 ASP HB2 H 2.609 . 2 1081 118 118 ASP HB3 H 2.751 . 2 1082 118 118 ASP CA C 53.233 . 1 1083 118 118 ASP CB C 40.880 . 1 1084 118 118 ASP N N 123.590 . 1 1085 119 119 LEU H H 8.742 . 1 1086 119 119 LEU HA H 4.340 . 1 1087 119 119 LEU HB2 H 1.612 . 2 1088 119 119 LEU HB3 H 1.666 . 2 1089 119 119 LEU HD1 H 0.943 . 2 1090 119 119 LEU HD2 H 0.943 . 2 1091 119 119 LEU HG H 0.751 . 1 1092 119 119 LEU CA C 57.834 . 1 1093 119 119 LEU CB C 41.607 . 1 1094 119 119 LEU CD1 C 22.957 . 1 1095 119 119 LEU CD2 C 22.957 . 1 1096 119 119 LEU CG C 26.105 . 1 1097 119 119 LEU N N 121.527 . 1 1098 120 120 GLY H H 6.809 . 1 1099 120 120 GLY HA2 H 4.223 . 2 1100 120 120 GLY HA3 H 3.473 . 2 1101 120 120 GLY CA C 47.662 . 1 1102 120 120 GLY N N 131.118 . 1 1103 121 121 LYS H H 7.380 . 1 1104 121 121 LYS HA H 4.185 . 1 1105 121 121 LYS HB2 H 1.917 . 2 1106 121 121 LYS HB3 H 1.917 . 2 1107 121 121 LYS HD2 H 1.693 . 2 1108 121 121 LYS HD3 H 1.693 . 2 1109 121 121 LYS HE2 H 2.958 . 2 1110 121 121 LYS HE3 H 2.958 . 2 1111 121 121 LYS HG2 H 1.448 . 2 1112 121 121 LYS HG3 H 1.556 . 2 1113 121 121 LYS CA C 58.803 . 1 1114 121 121 LYS CB C 32.161 . 1 1115 121 121 LYS CD C 29.012 . 1 1116 121 121 LYS CE C 42.333 . 1 1117 121 121 LYS CG C 24.894 . 1 1118 121 121 LYS N N 120.702 . 1 1119 122 122 GLU H H 8.194 . 1 1120 122 122 GLU HA H 4.056 . 1 1121 122 122 GLU HB2 H 2.135 . 2 1122 122 122 GLU HB3 H 2.135 . 2 1123 122 122 GLU HG2 H 2.341 . 2 1124 122 122 GLU HG3 H 2.135 . 2 1125 122 122 GLU CA C 59.530 . 1 1126 122 122 GLU CB C 29.738 . 1 1127 122 122 GLU CG C 36.520 . 1 1128 122 122 GLU N N 121.940 . 1 1129 123 123 ILE H H 8.172 . 1 1130 123 123 ILE HA H 3.355 . 1 1131 123 123 ILE HB H 1.866 . 1 1132 123 123 ILE HD1 H 0.782 . 1 1133 123 123 ILE HG12 H 0.944 . 1 1134 123 123 ILE HG13 H 0.944 . 1 1135 123 123 ILE HG2 H 0.728 . 1 1136 123 123 ILE CA C 66.554 . 1 1137 123 123 ILE CB C 38.215 . 1 1138 123 123 ILE CD1 C 14.721 . 1 1139 123 123 ILE CG1 C 22.957 . 1 1140 123 123 ILE CG2 C 17.628 . 1 1141 123 123 ILE N N 119.465 . 1 1142 124 124 GLU H H 8.081 . 1 1143 124 124 GLU HA H 3.796 . 1 1144 124 124 GLU HB2 H 2.149 . 2 1145 124 124 GLU HB3 H 2.077 . 2 1146 124 124 GLU HG2 H 2.498 . 2 1147 124 124 GLU HG3 H 2.153 . 2 1148 124 124 GLU CA C 60.741 . 1 1149 124 124 GLU CB C 30.465 . 1 1150 124 124 GLU CG C 37.731 . 1 1151 124 124 GLU N N 117.815 . 1 1152 125 125 GLN H H 8.277 . 1 1153 125 125 GLN HA H 4.140 . 1 1154 125 125 GLN HB2 H 2.218 . 2 1155 125 125 GLN HB3 H 2.218 . 2 1156 125 125 GLN HE21 H 7.386 . 2 1157 125 125 GLN HE22 H 6.835 . 2 1158 125 125 GLN HG2 H 2.576 . 2 1159 125 125 GLN HG3 H 2.392 . 2 1160 125 125 GLN CA C 59.530 . 1 1161 125 125 GLN CB C 28.527 . 1 1162 125 125 GLN CG C 34.098 . 1 1163 125 125 GLN N N 119.001 . 1 1164 125 125 GLN NE2 N 112.246 . 1 1165 126 126 LYS H H 8.279 . 1 1166 126 126 LYS HA H 3.993 . 1 1167 126 126 LYS HB2 H 1.976 . 2 1168 126 126 LYS HB3 H 1.976 . 2 1169 126 126 LYS HD2 H 1.481 . 2 1170 126 126 LYS HD3 H 1.618 . 2 1171 126 126 LYS HE2 H 2.946 . 2 1172 126 126 LYS HE3 H 2.946 . 2 1173 126 126 LYS HG2 H 1.560 . 2 1174 126 126 LYS HG3 H 1.618 . 2 1175 126 126 LYS CA C 59.530 . 1 1176 126 126 LYS CB C 32.403 . 1 1177 126 126 LYS CD C 29.254 . 1 1178 126 126 LYS CE C 42.332 . 1 1179 126 126 LYS CG C 26.348 . 1 1180 126 126 LYS N N 120.187 . 1 1181 127 127 TYR H H 8.560 . 1 1182 127 127 TYR HA H 4.296 . 1 1183 127 127 TYR HB2 H 3.056 . 2 1184 127 127 TYR HB3 H 3.056 . 2 1185 127 127 TYR HD1 H 7.282 . 3 1186 127 127 TYR HD2 H 7.282 . 3 1187 127 127 TYR HE1 H 7.172 . 3 1188 127 127 TYR HE2 H 7.172 . 3 1189 127 127 TYR CA C 61.468 . 1 1190 127 127 TYR CB C 38.942 . 1 1191 127 127 TYR N N 120.908 . 1 1192 128 128 ASP H H 8.769 . 1 1193 128 128 ASP HA H 4.284 . 1 1194 128 128 ASP HB2 H 2.919 . 2 1195 128 128 ASP HB3 H 2.705 . 2 1196 128 128 ASP CA C 57.108 . 1 1197 128 128 ASP CB C 40.880 . 1 1198 128 128 ASP N N 121.837 . 1 1199 129 129 CYS H H 7.639 . 1 1200 129 129 CYS HA H 4.561 . 1 1201 129 129 CYS HB2 H 3.127 . 2 1202 129 129 CYS HB3 H 3.127 . 2 1203 129 129 CYS CA C 59.530 . 1 1204 129 129 CYS CB C 27.801 . 1 1205 129 129 CYS N N 114.412 . 1 1206 130 130 GLY H H 7.835 . 1 1207 130 130 GLY HA2 H 4.012 . 2 1208 130 130 GLY HA3 H 3.806 . 2 1209 130 130 GLY CA C 46.209 . 1 1210 130 130 GLY N N 110.441 . 1 1211 131 131 GLU H H 7.810 . 1 1212 131 131 GLU HA H 4.231 . 1 1213 131 131 GLU HB2 H 1.929 . 2 1214 131 131 GLU HB3 H 1.742 . 2 1215 131 131 GLU HG2 H 2.277 . 2 1216 131 131 GLU HG3 H 2.151 . 2 1217 131 131 GLU CA C 56.623 . 1 1218 131 131 GLU CB C 30.223 . 1 1219 131 131 GLU CG C 36.520 . 1 1220 131 131 GLU N N 121.424 . 1 1221 132 132 GLU H H 8.541 . 1 1222 132 132 GLU HA H 4.506 . 1 1223 132 132 GLU HB2 H 1.999 . 2 1224 132 132 GLU HB3 H 2.088 . 2 1225 132 132 GLU HG2 H 2.372 . 2 1226 132 132 GLU HG3 H 2.237 . 2 1227 132 132 GLU CA C 56.381 . 1 1228 132 132 GLU CB C 29.981 . 1 1229 132 132 GLU CG C 36.278 . 1 1230 132 132 GLU N N 124.827 . 1 1231 133 133 ILE H H 8.884 . 1 1232 133 133 ILE HA H 4.865 . 1 1233 133 133 ILE HB H 1.953 . 1 1234 133 133 ILE HD1 H 0.882 . 1 1235 133 133 ILE HG12 H 1.489 . 1 1236 133 133 ILE HG13 H 1.489 . 1 1237 133 133 ILE HG2 H 0.861 . 1 1238 133 133 ILE CA C 60.014 . 1 1239 133 133 ILE CB C 42.818 . 1 1240 133 133 ILE CD1 C 14.722 . 1 1241 133 133 ILE CG1 C 25.379 . 1 1242 133 133 ILE CG2 C 19.081 . 1 1243 133 133 ILE N N 121.011 . 1 1244 134 134 LEU H H 8.779 . 1 1245 134 134 LEU HA H 5.057 . 1 1246 134 134 LEU HB2 H 1.692 . 2 1247 134 134 LEU HB3 H 1.103 . 2 1248 134 134 LEU HD1 H 0.765 . 2 1249 134 134 LEU HD2 H 0.831 . 2 1250 134 134 LEU HG H 1.548 . 1 1251 134 134 LEU CA C 52.990 . 1 1252 134 134 LEU CB C 44.513 . 1 1253 134 134 LEU CD1 C 23.683 . 1 1254 134 134 LEU CD2 C 25.621 . 1 1255 134 134 LEU CG C 27.074 . 1 1256 134 134 LEU N N 122.352 . 1 1257 135 135 ILE H H 9.439 . 1 1258 135 135 ILE HA H 4.846 . 1 1259 135 135 ILE HB H 2.078 . 1 1260 135 135 ILE HD1 H 0.836 . 1 1261 135 135 ILE HG12 H 1.350 . 1 1262 135 135 ILE HG13 H 1.594 . 1 1263 135 135 ILE HG2 H 0.890 . 1 1264 135 135 ILE CA C 57.350 . 1 1265 135 135 ILE CB C 38.942 . 1 1266 135 135 ILE CD1 C 11.573 . 1 1267 135 135 ILE CG1 C 28.043 . 1 1268 135 135 ILE CG2 C 17.870 . 1 1269 135 135 ILE N N 122.352 . 1 1270 136 136 THR H H 8.754 . 1 1271 136 136 THR HA H 4.810 . 1 1272 136 136 THR HB H 3.692 . 1 1273 136 136 THR HG2 H 1.449 . 1 1274 136 136 THR CA C 62.436 . 1 1275 136 136 THR CB C 69.460 . 1 1276 136 136 THR CG2 C 21.988 . 1 1277 136 136 THR N N 126.168 . 1 1278 137 137 VAL H H 9.629 . 1 1279 137 137 VAL HA H 4.793 . 1 1280 137 137 VAL HB H 2.159 . 1 1281 137 137 VAL HG1 H 0.778 . 2 1282 137 137 VAL HG2 H 0.798 . 2 1283 137 137 VAL CA C 61.225 . 1 1284 137 137 VAL CB C 34.098 . 1 1285 137 137 VAL CG1 C 22.714 . 1 1286 137 137 VAL CG2 C 21.503 . 1 1287 137 137 VAL N N 131.118 . 1 1288 138 138 LEU H H 8.924 . 1 1289 138 138 LEU HA H 5.220 . 1 1290 138 138 LEU HB2 H 1.683 . 2 1291 138 138 LEU HB3 H 1.398 . 2 1292 138 138 LEU HD1 H 0.691 . 2 1293 138 138 LEU HD2 H 0.449 . 2 1294 138 138 LEU HG H 1.390 . 1 1295 138 138 LEU CA C 53.475 . 1 1296 138 138 LEU CB C 46.451 . 1 1297 138 138 LEU CD1 C 25.136 . 1 1298 138 138 LEU CD2 C 25.136 . 1 1299 138 138 LEU CG C 27.316 . 1 1300 138 138 LEU N N 132.561 . 1 1301 139 139 SER H H 9.084 . 1 1302 139 139 SER HA H 5.737 . 1 1303 139 139 SER HB2 H 3.858 . 2 1304 139 139 SER HB3 H 3.768 . 2 1305 139 139 SER CA C 56.139 . 1 1306 139 139 SER CB C 65.343 . 1 1307 139 139 SER N N 118.846 . 1 1308 140 140 ALA H H 8.929 . 1 1309 140 140 ALA HA H 4.587 . 1 1310 140 140 ALA HB H 1.359 . 1 1311 140 140 ALA CA C 52.506 . 1 1312 140 140 ALA CB C 22.472 . 1 1313 140 140 ALA N N 125.704 . 1 1314 141 141 MET H H 9.978 . 1 1315 141 141 MET HA H 3.926 . 1 1316 141 141 MET HB2 H 2.330 . 2 1317 141 141 MET HB3 H 2.330 . 2 1318 141 141 MET HE H 1.938 . 1 1319 141 141 MET HG2 H 2.407 . 2 1320 141 141 MET HG3 H 2.222 . 2 1321 141 141 MET CA C 56.866 . 1 1322 141 141 MET CB C 32.403 . 1 1323 141 141 MET CE C 16.417 . 1 1324 141 141 MET CG C 29.981 . 1 1325 141 141 MET N N 119.362 . 1 1326 142 142 THR H H 8.483 . 1 1327 142 142 THR HA H 4.119 . 1 1328 142 142 THR HB H 4.538 . 1 1329 142 142 THR HG2 H 1.184 . 1 1330 142 142 THR CA C 63.890 . 1 1331 142 142 THR CB C 69.218 . 1 1332 142 142 THR CG2 C 21.988 . 1 1333 142 142 THR N N 111.730 . 1 1334 143 143 GLU H H 8.136 . 1 1335 143 143 GLU HA H 4.455 . 1 1336 143 143 GLU HB2 H 1.565 . 2 1337 143 143 GLU HB3 H 1.365 . 2 1338 143 143 GLU HG2 H 1.862 . 2 1339 143 143 GLU HG3 H 1.561 . 2 1340 143 143 GLU CA C 55.655 . 1 1341 143 143 GLU CB C 32.403 . 1 1342 143 143 GLU CG C 36.036 . 1 1343 143 143 GLU N N 125.137 . 1 1344 144 144 GLU H H 7.937 . 1 1345 144 144 GLU HA H 5.682 . 1 1346 144 144 GLU HB2 H 1.799 . 2 1347 144 144 GLU HB3 H 1.821 . 2 1348 144 144 GLU HG2 H 2.074 . 2 1349 144 144 GLU HG3 H 2.074 . 2 1350 144 144 GLU CA C 54.928 . 1 1351 144 144 GLU CB C 34.825 . 1 1352 144 144 GLU CG C 37.247 . 1 1353 144 144 GLU N N 120.805 . 1 1354 145 145 ALA H H 8.746 . 1 1355 145 145 ALA HA H 4.592 . 1 1356 145 145 ALA HB H 1.521 . 1 1357 145 145 ALA CA C 52.022 . 1 1358 145 145 ALA CB C 23.441 . 1 1359 145 145 ALA N N 122.301 . 1 1360 146 146 ALA H H 8.872 . 1 1361 146 146 ALA HA H 4.828 . 1 1362 146 146 ALA HB H 1.142 . 1 1363 146 146 ALA CA C 52.149 . 1 1364 146 146 ALA CB C 19.081 . 1 1365 146 146 ALA N N 125.033 . 1 1366 147 147 VAL H H 8.778 . 1 1367 147 147 VAL HA H 4.671 . 1 1368 147 147 VAL HB H 2.493 . 1 1369 147 147 VAL HG1 H 0.777 . 2 1370 147 147 VAL HG2 H 1.041 . 2 1371 147 147 VAL CA C 61.225 . 1 1372 147 147 VAL CB C 34.583 . 1 1373 147 147 VAL CG1 C 18.597 . 1 1374 147 147 VAL CG2 C 21.988 . 1 1375 147 147 VAL N N 111.730 . 1 1376 148 148 ALA H H 7.714 . 1 1377 148 148 ALA HA H 4.640 . 1 1378 148 148 ALA HB H 0.941 . 1 1379 148 148 ALA CA C 52.264 . 1 1380 148 148 ALA CB C 22.957 . 1 1381 148 148 ALA N N 121.630 . 1 1382 149 149 ILE H H 8.546 . 1 1383 149 149 ILE HA H 5.075 . 1 1384 149 149 ILE HB H 1.666 . 1 1385 149 149 ILE HD1 H 0.783 . 1 1386 149 149 ILE HG12 H 1.461 . 1 1387 149 149 ILE HG13 H 0.861 . 1 1388 149 149 ILE HG2 H 0.884 . 1 1389 149 149 ILE CA C 59.772 . 1 1390 149 149 ILE CB C 41.607 . 1 1391 149 149 ILE CD1 C 14.722 . 1 1392 149 149 ILE CG1 C 27.074 . 1 1393 149 149 ILE CG2 C 18.355 . 1 1394 149 149 ILE N N 117.712 . 1 1395 150 150 LYS H H 8.908 . 1 1396 150 150 LYS HA H 4.531 . 1 1397 150 150 LYS HB2 H 1.545 . 2 1398 150 150 LYS HB3 H 1.761 . 2 1399 150 150 LYS HD2 H 1.541 . 2 1400 150 150 LYS HD3 H 1.541 . 2 1401 150 150 LYS HE2 H 2.851 . 2 1402 150 150 LYS HE3 H 2.851 . 2 1403 150 150 LYS HG2 H 1.347 . 2 1404 150 150 LYS HG3 H 1.278 . 2 1405 150 150 LYS CA C 55.170 . 1 1406 150 150 LYS CB C 35.794 . 1 1407 150 150 LYS CD C 29.496 . 1 1408 150 150 LYS CE C 42.091 . 1 1409 150 150 LYS CG C 24.652 . 1 1410 150 150 LYS N N 126.168 . 1 1411 151 151 ALA H H 8.516 . 1 1412 151 151 ALA HA H 4.513 . 1 1413 151 151 ALA HB H 1.434 . 1 1414 151 151 ALA CA C 52.364 . 1 1415 151 151 ALA CB C 19.566 . 1 1416 151 151 ALA N N 126.993 . 1 1417 152 152 MET H H 8.279 . 1 1418 152 152 MET HA H 4.299 . 1 1419 152 152 MET HB2 H 2.477 . 2 1420 152 152 MET HB3 H 2.477 . 2 1421 152 152 MET HE H 2.017 . 1 1422 152 152 MET HG2 H 2.105 . 2 1423 152 152 MET HG3 H 2.105 . 2 1424 152 152 MET CA C 56.139 . 1 1425 152 152 MET CB C 32.887 . 1 1426 152 152 MET CE C 17.144 . 1 1427 152 152 MET CG C 33.372 . 1 1428 152 152 MET N N 121.424 . 1 1429 153 153 ALA H H 7.840 . 1 1430 153 153 ALA HA H 4.139 . 1 1431 153 153 ALA HB H 1.327 . 1 1432 153 153 ALA CA C 53.717 . 1 1433 153 153 ALA CB C 20.535 . 1 1434 153 153 ALA N N 131.427 . 1 stop_ save_