data_16061 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution Structure of HybE from Escherichia coli ; _BMRB_accession_number 16061 _BMRB_flat_file_name bmr16061.str _Entry_type original _Submission_date 2008-12-17 _Accession_date 2008-12-17 _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 Jin Changwen . . 2 Shao Xuan . . 3 Lu Jie . . 4 Li You . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 883 "13C chemical shifts" 662 "15N chemical shifts" 159 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-06-02 update BMRB 'edit assembly name' 2009-08-20 update BMRB 'added PubMed ID' 2009-06-05 update BMRB 'completed entry citation' 2009-04-14 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_primary _Saveframe_category entry_citation _Citation_full . _Citation_title '1H, 13C and 15N resonance assignments of the chaperone HybE of hydrogenase-2 from Escherichia coli' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19636963 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Shao Xuan . . 2 Lu Jie . . 3 Xia Bin . . 4 Jin Changwen . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular 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 129 _Page_last 131 _Year 2009 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name HybE _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label HybE $HybE 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_HybE _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common HybE _Molecular_mass 17979.689 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 162 _Mol_residue_sequence ; MTEEIAGFQTSPKAQVQAAF EEIARRSMHDLSFLHPSMPV YVSDFTLFEGQWTGCVITPW MLSAVIFPGPDQLWPLRKVS EKIGLQLPYGTMTFTVGELD GVSQYLSCSLMSPLSHSMSI EEGQRLTDDCARMILSLPVT NPDVPHAGRRALLFGRRSGE NA ; loop_ _Residue_seq_code _Residue_label 1 MET 2 THR 3 GLU 4 GLU 5 ILE 6 ALA 7 GLY 8 PHE 9 GLN 10 THR 11 SER 12 PRO 13 LYS 14 ALA 15 GLN 16 VAL 17 GLN 18 ALA 19 ALA 20 PHE 21 GLU 22 GLU 23 ILE 24 ALA 25 ARG 26 ARG 27 SER 28 MET 29 HIS 30 ASP 31 LEU 32 SER 33 PHE 34 LEU 35 HIS 36 PRO 37 SER 38 MET 39 PRO 40 VAL 41 TYR 42 VAL 43 SER 44 ASP 45 PHE 46 THR 47 LEU 48 PHE 49 GLU 50 GLY 51 GLN 52 TRP 53 THR 54 GLY 55 CYS 56 VAL 57 ILE 58 THR 59 PRO 60 TRP 61 MET 62 LEU 63 SER 64 ALA 65 VAL 66 ILE 67 PHE 68 PRO 69 GLY 70 PRO 71 ASP 72 GLN 73 LEU 74 TRP 75 PRO 76 LEU 77 ARG 78 LYS 79 VAL 80 SER 81 GLU 82 LYS 83 ILE 84 GLY 85 LEU 86 GLN 87 LEU 88 PRO 89 TYR 90 GLY 91 THR 92 MET 93 THR 94 PHE 95 THR 96 VAL 97 GLY 98 GLU 99 LEU 100 ASP 101 GLY 102 VAL 103 SER 104 GLN 105 TYR 106 LEU 107 SER 108 CYS 109 SER 110 LEU 111 MET 112 SER 113 PRO 114 LEU 115 SER 116 HIS 117 SER 118 MET 119 SER 120 ILE 121 GLU 122 GLU 123 GLY 124 GLN 125 ARG 126 LEU 127 THR 128 ASP 129 ASP 130 CYS 131 ALA 132 ARG 133 MET 134 ILE 135 LEU 136 SER 137 LEU 138 PRO 139 VAL 140 THR 141 ASN 142 PRO 143 ASP 144 VAL 145 PRO 146 HIS 147 ALA 148 GLY 149 ARG 150 ARG 151 ALA 152 LEU 153 LEU 154 PHE 155 GLY 156 ARG 157 ARG 158 SER 159 GLY 160 GLU 161 ASN 162 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-29 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 2KC5 "Solution Structure Of Hybe From Escherichia Coli" 100.00 162 100.00 100.00 2.55e-115 DBJ BAB37300 "hydrogenase-2 operon protein HybE [Escherichia coli O157:H7 str. Sakai]" 100.00 162 99.38 99.38 3.41e-114 DBJ BAE77053 "hydrogenase 2-specific chaperone [Escherichia coli str. K12 substr. W3110]" 100.00 162 100.00 100.00 2.55e-115 DBJ BAG78801 "hydrogenase-2 component protein [Escherichia coli SE11]" 100.00 162 100.00 100.00 2.55e-115 DBJ BAI27283 "hydrogenase 2-specific chaperone HybE [Escherichia coli O26:H11 str. 11368]" 100.00 162 99.38 99.38 2.38e-114 DBJ BAI32397 "hydrogenase 2-specific chaperone HybE [Escherichia coli O103:H2 str. 12009]" 100.00 162 100.00 100.00 2.55e-115 EMBL CAP77457 "hydrogenase-2 operon protein hybE [Escherichia coli LF82]" 100.00 162 99.38 99.38 1.30e-114 EMBL CAQ33334 "hydrogenase 2-specific chaperone [Escherichia coli BL21(DE3)]" 100.00 162 100.00 100.00 2.55e-115 EMBL CAQ90428 "hydrogenase 2-specific chaperone [Escherichia fergusonii ATCC 35469]" 100.00 162 99.38 99.38 1.30e-114 EMBL CAQ99956 "hydrogenase 2-specific chaperone [Escherichia coli IAI1]" 100.00 162 99.38 99.38 1.29e-114 EMBL CAR04606 "hydrogenase 2-specific chaperone [Escherichia coli S88]" 100.00 162 99.38 99.38 1.30e-114 GB AAA21593 "hybE [Escherichia coli]" 100.00 162 99.38 99.38 9.49e-115 GB AAA69159 "hydrogenase-2 operon protein HybE [Escherichia coli str. K-12 substr. MG1655]" 100.00 162 100.00 100.00 2.55e-115 GB AAC76028 "hydrogenase 2-specific chaperone [Escherichia coli str. K-12 substr. MG1655]" 100.00 162 100.00 100.00 2.55e-115 GB AAG58129 "member of hyb operon [Escherichia coli O157:H7 str. EDL933]" 100.00 162 99.38 99.38 3.41e-114 GB AAN44517 "hydrogenase-2 component [Shigella flexneri 2a str. 301]" 100.00 162 99.38 99.38 1.57e-114 REF NP_311904 "hydrogenase 2-specific chaperone [Escherichia coli O157:H7 str. Sakai]" 100.00 162 99.38 99.38 3.41e-114 REF NP_417466 "hydrogenase 2-specific chaperone [Escherichia coli str. K-12 substr. MG1655]" 100.00 162 100.00 100.00 2.55e-115 REF NP_708810 "hydrogenase 2-specific chaperone [Shigella flexneri 2a str. 301]" 100.00 162 99.38 99.38 1.57e-114 REF WP_000133813 "hydrogenase-2 operon protein HybE [Escherichia fergusonii]" 100.00 162 99.38 100.00 7.96e-115 REF WP_000134002 "MULTISPECIES: hydrogenase-2 operon protein HybE [Enterobacteriaceae]" 100.00 162 99.38 99.38 3.41e-114 SP P0AAN1 "RecName: Full=Hydrogenase-2 operon protein HybE" 100.00 162 100.00 100.00 2.55e-115 SP P0AAN2 "RecName: Full=Hydrogenase-2 operon protein HybE" 100.00 162 100.00 100.00 2.55e-115 SP Q8XBW0 "RecName: Full=Hydrogenase-2 operon protein HybE" 100.00 162 99.38 99.38 3.41e-114 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $HybE 'E. coli' 562 Eubacteria . Escherichia coli 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 $HybE 'recombinant technology' . Escherichia coli BL21(DE3) pET21a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $HybE 1 mM '[U-99% 13C; U-99% 15N]' NaCl 50 mM 'natural abundance' PBS 50 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $HybE 1 mM '[U-99% 15N]' NaCl 50 mM 'natural abundance' PBS 50 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_xwinnmr _Saveframe_category software _Name xwinnmr _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection 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_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_CYANA _Saveframe_category software _Name CYANA _Version 2.0 loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_AMBER _Saveframe_category software _Name AMBER _Version 9 loop_ _Vendor _Address _Electronic_address 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollm' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 500 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_HCCH-COSY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-COSY' _Sample_label $sample_1 save_ save_3D_HNCO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 100 . mM pH 7.0 . 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 . 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_ _Software_label $NMRView stop_ loop_ _Experiment_label '3D CBCA(CO)NH' '3D HNCACB' '3D HCCH-TOCSY' '3D HCCH-COSY' 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 HybE _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 GLU H H 8.665 . 1 2 3 3 GLU HA H 4.419 . 1 3 3 3 GLU HB2 H 2.029 . 2 4 3 3 GLU HB3 H 2.166 . 2 5 3 3 GLU HG2 H 2.318 . 2 6 3 3 GLU HG3 H 2.318 . 2 7 3 3 GLU C C 175.276 . 1 8 3 3 GLU CA C 56.738 . 1 9 3 3 GLU CB C 30.019 . 1 10 3 3 GLU CG C 36.550 . 1 11 3 3 GLU N N 123.764 . 1 12 4 4 GLU H H 8.300 . 1 13 4 4 GLU HA H 4.764 . 1 14 4 4 GLU HB2 H 1.874 . 2 15 4 4 GLU HB3 H 1.927 . 2 16 4 4 GLU HG2 H 2.163 . 2 17 4 4 GLU HG3 H 2.163 . 2 18 4 4 GLU C C 175.685 . 1 19 4 4 GLU CA C 55.869 . 1 20 4 4 GLU CB C 32.620 . 1 21 4 4 GLU CG C 36.640 . 1 22 4 4 GLU N N 120.560 . 1 23 5 5 ILE H H 9.152 . 1 24 5 5 ILE HA H 4.282 . 1 25 5 5 ILE HB H 1.957 . 1 26 5 5 ILE HD1 H 1.005 . 1 27 5 5 ILE HG12 H 1.239 . 1 28 5 5 ILE HG13 H 1.509 . 1 29 5 5 ILE HG2 H 0.917 . 1 30 5 5 ILE C C 174.684 . 1 31 5 5 ILE CA C 59.930 . 1 32 5 5 ILE CB C 39.789 . 1 33 5 5 ILE CD1 C 14.057 . 1 34 5 5 ILE CG1 C 26.860 . 1 35 5 5 ILE CG2 C 17.992 . 1 36 5 5 ILE N N 121.648 . 1 37 6 6 ALA H H 8.316 . 1 38 6 6 ALA HA H 4.676 . 1 39 6 6 ALA HB H 1.347 . 1 40 6 6 ALA C C 178.094 . 1 41 6 6 ALA CA C 51.640 . 1 42 6 6 ALA CB C 20.158 . 1 43 6 6 ALA N N 128.410 . 1 44 7 7 GLY H H 7.953 . 1 45 7 7 GLY HA2 H 3.572 . 2 46 7 7 GLY HA3 H 4.255 . 2 47 7 7 GLY C C 173.916 . 1 48 7 7 GLY CA C 43.877 . 1 49 7 7 GLY N N 104.533 . 1 50 8 8 PHE H H 7.803 . 1 51 8 8 PHE HA H 4.541 . 1 52 8 8 PHE HB2 H 2.886 . 2 53 8 8 PHE HB3 H 3.510 . 2 54 8 8 PHE HD1 H 7.526 . 3 55 8 8 PHE C C 177.406 . 1 56 8 8 PHE CA C 58.105 . 1 57 8 8 PHE CB C 39.548 . 1 58 8 8 PHE CD1 C 131.870 . 3 59 8 8 PHE N N 118.756 . 1 60 9 9 GLN H H 9.186 . 1 61 9 9 GLN HA H 4.004 . 1 62 9 9 GLN HB2 H 2.244 . 2 63 9 9 GLN HB3 H 2.375 . 2 64 9 9 GLN HE21 H 7.616 . 2 65 9 9 GLN HE22 H 7.154 . 2 66 9 9 GLN HG2 H 2.559 . 2 67 9 9 GLN HG3 H 2.667 . 2 68 9 9 GLN C C 175.906 . 1 69 9 9 GLN CA C 58.503 . 1 70 9 9 GLN CB C 29.840 . 1 71 9 9 GLN CD C 180.030 . 1 72 9 9 GLN CG C 34.182 . 1 73 9 9 GLN N N 123.959 . 1 74 9 9 GLN NE2 N 112.810 . 1 75 10 10 THR H H 7.695 . 1 76 10 10 THR HA H 4.681 . 1 77 10 10 THR HB H 4.246 . 1 78 10 10 THR HG2 H 1.232 . 1 79 10 10 THR C C 173.059 . 1 80 10 10 THR CA C 59.416 . 1 81 10 10 THR CB C 71.193 . 1 82 10 10 THR CG2 C 21.624 . 1 83 10 10 THR N N 106.727 . 1 84 11 11 SER H H 8.138 . 1 85 11 11 SER HA H 2.120 . 1 86 11 11 SER HB2 H 3.334 . 2 87 11 11 SER HB3 H 3.379 . 2 88 11 11 SER CA C 54.416 . 1 89 11 11 SER CB C 63.727 . 1 90 11 11 SER N N 115.247 . 1 91 12 12 PRO HA H 4.419 . 1 92 12 12 PRO HB2 H 0.369 . 2 93 12 12 PRO HB3 H 0.896 . 2 94 12 12 PRO HD2 H 2.922 . 2 95 12 12 PRO HD3 H 3.006 . 2 96 12 12 PRO C C 174.083 . 1 97 12 12 PRO CA C 62.046 . 1 98 12 12 PRO CB C 28.530 . 1 99 12 12 PRO CG C 23.356 . 1 100 13 13 LYS H H 6.783 . 1 101 13 13 LYS HA H 3.003 . 1 102 13 13 LYS HB2 H 1.206 . 2 103 13 13 LYS HB3 H 1.376 . 2 104 13 13 LYS HD2 H 1.456 . 2 105 13 13 LYS HD3 H 1.456 . 2 106 13 13 LYS HE2 H 2.645 . 2 107 13 13 LYS HE3 H 2.645 . 2 108 13 13 LYS HG2 H 1.010 . 2 109 13 13 LYS HG3 H 0.867 . 2 110 13 13 LYS C C 176.151 . 1 111 13 13 LYS CA C 61.375 . 1 112 13 13 LYS CB C 33.500 . 1 113 13 13 LYS CD C 30.365 . 1 114 13 13 LYS CE C 41.880 . 1 115 13 13 LYS CG C 23.820 . 1 116 13 13 LYS N N 121.368 . 1 117 14 14 ALA H H 8.611 . 1 118 14 14 ALA HA H 3.967 . 1 119 14 14 ALA HB H 1.292 . 1 120 14 14 ALA C C 181.055 . 1 121 14 14 ALA CA C 55.110 . 1 122 14 14 ALA CB C 17.803 . 1 123 14 14 ALA N N 119.037 . 1 124 15 15 GLN H H 8.027 . 1 125 15 15 GLN HA H 3.986 . 1 126 15 15 GLN HB2 H 1.835 . 2 127 15 15 GLN HB3 H 1.835 . 2 128 15 15 GLN HE21 H 7.340 . 2 129 15 15 GLN HE22 H 6.880 . 2 130 15 15 GLN HG2 H 2.222 . 2 131 15 15 GLN HG3 H 2.371 . 2 132 15 15 GLN C C 178.957 . 1 133 15 15 GLN CA C 58.895 . 1 134 15 15 GLN CB C 28.530 . 1 135 15 15 GLN CD C 179.802 . 1 136 15 15 GLN CG C 34.387 . 1 137 15 15 GLN N N 119.070 . 1 138 15 15 GLN NE2 N 111.200 . 1 139 16 16 VAL H H 8.058 . 1 140 16 16 VAL HA H 3.244 . 1 141 16 16 VAL HB H 1.815 . 1 142 16 16 VAL HG1 H -0.105 . 2 143 16 16 VAL HG2 H 0.961 . 2 144 16 16 VAL C C 177.056 . 1 145 16 16 VAL CA C 66.653 . 1 146 16 16 VAL CB C 31.466 . 1 147 16 16 VAL CG1 C 23.120 . 1 148 16 16 VAL CG2 C 21.720 . 1 149 16 16 VAL N N 122.198 . 1 150 17 17 GLN H H 8.456 . 1 151 17 17 GLN HA H 3.657 . 1 152 17 17 GLN HB2 H 2.002 . 2 153 17 17 GLN HB3 H 2.002 . 2 154 17 17 GLN HE21 H 7.950 . 2 155 17 17 GLN HE22 H 6.700 . 2 156 17 17 GLN HG2 H 2.011 . 2 157 17 17 GLN HG3 H 2.279 . 2 158 17 17 GLN C C 177.388 . 1 159 17 17 GLN CA C 60.279 . 1 160 17 17 GLN CB C 27.450 . 1 161 17 17 GLN CD C 178.665 . 1 162 17 17 GLN CG C 32.720 . 1 163 17 17 GLN N N 120.400 . 1 164 17 17 GLN NE2 N 112.700 . 1 165 18 18 ALA H H 7.587 . 1 166 18 18 ALA HA H 4.239 . 1 167 18 18 ALA HB H 1.474 . 1 168 18 18 ALA C C 180.516 . 1 169 18 18 ALA CA C 55.000 . 1 170 18 18 ALA CB C 18.060 . 1 171 18 18 ALA N N 118.638 . 1 172 19 19 ALA H H 7.889 . 1 173 19 19 ALA HA H 4.298 . 1 174 19 19 ALA HB H 1.406 . 1 175 19 19 ALA C C 181.603 . 1 176 19 19 ALA CA C 54.960 . 1 177 19 19 ALA CB C 19.220 . 1 178 19 19 ALA N N 120.702 . 1 179 20 20 PHE H H 8.516 . 1 180 20 20 PHE HA H 4.548 . 1 181 20 20 PHE HB2 H 2.931 . 2 182 20 20 PHE HB3 H 2.983 . 2 183 20 20 PHE HD1 H 7.308 . 3 184 20 20 PHE C C 178.904 . 1 185 20 20 PHE CA C 63.278 . 1 186 20 20 PHE CB C 39.844 . 1 187 20 20 PHE CD1 C 131.167 . 3 188 20 20 PHE N N 117.214 . 1 189 21 21 GLU H H 8.644 . 1 190 21 21 GLU HA H 4.118 . 1 191 21 21 GLU HB2 H 2.077 . 2 192 21 21 GLU HB3 H 2.498 . 2 193 21 21 GLU HG2 H 2.309 . 2 194 21 21 GLU HG3 H 2.650 . 2 195 21 21 GLU C C 179.514 . 1 196 21 21 GLU CA C 60.481 . 1 197 21 21 GLU CB C 29.310 . 1 198 21 21 GLU CG C 37.490 . 1 199 21 21 GLU N N 121.000 . 1 200 22 22 GLU H H 7.810 . 1 201 22 22 GLU HA H 4.287 . 1 202 22 22 GLU HB2 H 2.245 . 2 203 22 22 GLU HB3 H 2.245 . 2 204 22 22 GLU HG2 H 2.352 . 2 205 22 22 GLU HG3 H 2.461 . 2 206 22 22 GLU C C 178.977 . 1 207 22 22 GLU CA C 59.420 . 1 208 22 22 GLU CB C 28.773 . 1 209 22 22 GLU CG C 35.442 . 1 210 22 22 GLU N N 120.227 . 1 211 23 23 ILE H H 7.869 . 1 212 23 23 ILE HA H 3.789 . 1 213 23 23 ILE HB H 2.230 . 1 214 23 23 ILE HD1 H 0.894 . 1 215 23 23 ILE HG12 H 1.217 . 1 216 23 23 ILE HG13 H 1.871 . 1 217 23 23 ILE HG2 H 1.074 . 1 218 23 23 ILE C C 175.623 . 1 219 23 23 ILE CA C 65.484 . 1 220 23 23 ILE CB C 38.370 . 1 221 23 23 ILE CD1 C 13.870 . 1 222 23 23 ILE CG1 C 29.118 . 1 223 23 23 ILE CG2 C 18.283 . 1 224 23 23 ILE N N 119.742 . 1 225 24 24 ALA H H 8.698 . 1 226 24 24 ALA HA H 4.412 . 1 227 24 24 ALA HB H 1.839 . 1 228 24 24 ALA C C 179.330 . 1 229 24 24 ALA CA C 55.471 . 1 230 24 24 ALA CB C 18.052 . 1 231 24 24 ALA N N 122.550 . 1 232 25 25 ARG H H 7.942 . 1 233 25 25 ARG HA H 4.273 . 1 234 25 25 ARG HB2 H 2.020 . 2 235 25 25 ARG HB3 H 2.108 . 2 236 25 25 ARG HD2 H 3.295 . 2 237 25 25 ARG HD3 H 3.295 . 2 238 25 25 ARG HG2 H 1.749 . 2 239 25 25 ARG HG3 H 1.893 . 2 240 25 25 ARG C C 178.353 . 1 241 25 25 ARG CA C 58.890 . 1 242 25 25 ARG CB C 30.880 . 1 243 25 25 ARG CD C 43.410 . 1 244 25 25 ARG CG C 27.480 . 1 245 25 25 ARG N N 116.810 . 1 246 26 26 ARG H H 7.922 . 1 247 26 26 ARG HA H 4.413 . 1 248 26 26 ARG HB2 H 1.961 . 2 249 26 26 ARG HB3 H 1.961 . 2 250 26 26 ARG HD2 H 3.209 . 2 251 26 26 ARG HD3 H 3.209 . 2 252 26 26 ARG HG2 H 1.740 . 2 253 26 26 ARG HG3 H 1.740 . 2 254 26 26 ARG C C 177.223 . 1 255 26 26 ARG CA C 57.380 . 1 256 26 26 ARG CB C 30.525 . 1 257 26 26 ARG CD C 43.360 . 1 258 26 26 ARG CG C 27.116 . 1 259 26 26 ARG N N 117.280 . 1 260 27 27 SER H H 7.974 . 1 261 27 27 SER HA H 4.478 . 1 262 27 27 SER HB2 H 3.841 . 2 263 27 27 SER HB3 H 3.801 . 2 264 27 27 SER C C 174.555 . 1 265 27 27 SER CA C 59.416 . 1 266 27 27 SER CB C 63.977 . 1 267 27 27 SER N N 113.990 . 1 268 28 28 MET H H 7.993 . 1 269 28 28 MET HA H 4.419 . 1 270 28 28 MET HB2 H 1.843 . 2 271 28 28 MET HB3 H 2.330 . 2 272 28 28 MET HE H 1.772 . 1 273 28 28 MET HG2 H 2.185 . 2 274 28 28 MET HG3 H 2.185 . 2 275 28 28 MET C C 175.558 . 1 276 28 28 MET CA C 55.450 . 1 277 28 28 MET CB C 32.272 . 1 278 28 28 MET CE C 16.756 . 1 279 28 28 MET CG C 36.447 . 1 280 28 28 MET N N 120.399 . 1 281 29 29 HIS H H 7.869 . 1 282 29 29 HIS HA H 4.508 . 1 283 29 29 HIS HB2 H 2.950 . 2 284 29 29 HIS HB3 H 3.157 . 2 285 29 29 HIS HD2 H 6.849 . 1 286 29 29 HIS C C 176.243 . 1 287 29 29 HIS CA C 56.530 . 1 288 29 29 HIS CB C 30.760 . 1 289 29 29 HIS N N 117.540 . 1 290 30 30 ASP H H 8.330 . 1 291 30 30 ASP HA H 4.242 . 1 292 30 30 ASP HB2 H 3.033 . 2 293 30 30 ASP HB3 H 3.033 . 2 294 30 30 ASP C C 175.897 . 1 295 30 30 ASP CA C 55.060 . 1 296 30 30 ASP CB C 42.440 . 1 297 30 30 ASP N N 119.780 . 1 298 31 31 LEU H H 8.520 . 1 299 31 31 LEU HA H 4.235 . 1 300 31 31 LEU HB2 H 1.482 . 2 301 31 31 LEU HB3 H 1.715 . 2 302 31 31 LEU HD1 H 0.966 . 2 303 31 31 LEU C C 178.473 . 1 304 31 31 LEU CA C 55.540 . 1 305 31 31 LEU CB C 42.150 . 1 306 31 31 LEU N N 124.540 . 1 307 32 32 SER H H 8.544 . 1 308 32 32 SER HA H 4.319 . 1 309 32 32 SER HB2 H 3.815 . 2 310 32 32 SER HB3 H 3.815 . 2 311 32 32 SER C C 177.029 . 1 312 32 32 SER CA C 60.524 . 1 313 32 32 SER CB C 63.470 . 1 314 32 32 SER N N 115.860 . 1 315 33 33 PHE HA H 4.748 . 1 316 33 33 PHE HB2 H 3.258 . 2 317 33 33 PHE HB3 H 3.258 . 2 318 33 33 PHE HD1 H 7.231 . 3 319 33 33 PHE HE1 H 7.168 . 3 320 33 33 PHE C C 176.359 . 1 321 33 33 PHE CA C 57.524 . 1 322 33 33 PHE CB C 39.283 . 1 323 34 34 LEU H H 7.673 . 1 324 34 34 LEU HA H 4.250 . 1 325 34 34 LEU HB2 H 1.674 . 2 326 34 34 LEU HB3 H 1.674 . 2 327 34 34 LEU HD1 H 0.976 . 2 328 34 34 LEU HD2 H 0.976 . 2 329 34 34 LEU HG H 1.476 . 1 330 34 34 LEU CA C 54.893 . 1 331 34 34 LEU CB C 42.352 . 1 332 34 34 LEU CD1 C 25.087 . 1 333 34 34 LEU CD2 C 25.087 . 1 334 34 34 LEU CG C 26.928 . 1 335 34 34 LEU N N 122.082 . 1 336 35 35 HIS H H 7.866 . 1 337 35 35 HIS HA H 4.582 . 1 338 35 35 HIS HB2 H 2.768 . 2 339 35 35 HIS HB3 H 2.635 . 2 340 35 35 HIS HD2 H 7.063 . 1 341 35 35 HIS CA C 54.705 . 1 342 35 35 HIS CB C 41.155 . 1 343 35 35 HIS CD2 C 117.220 . 1 344 35 35 HIS N N 121.967 . 1 345 36 36 PRO HA H 4.364 . 1 346 36 36 PRO HB2 H 1.979 . 2 347 36 36 PRO HB3 H 2.282 . 2 348 36 36 PRO HD2 H 2.680 . 2 349 36 36 PRO HD3 H 3.107 . 2 350 36 36 PRO HG2 H 1.850 . 2 351 36 36 PRO HG3 H 1.850 . 2 352 36 36 PRO C C 177.385 . 1 353 36 36 PRO CA C 64.327 . 1 354 36 36 PRO CB C 32.442 . 1 355 36 36 PRO CD C 50.173 . 1 356 36 36 PRO CG C 26.960 . 1 357 37 37 SER H H 9.764 . 1 358 37 37 SER HA H 4.698 . 1 359 37 37 SER HB2 H 3.835 . 2 360 37 37 SER HB3 H 3.957 . 2 361 37 37 SER C C 173.493 . 1 362 37 37 SER CA C 57.918 . 1 363 37 37 SER CB C 64.645 . 1 364 37 37 SER N N 115.100 . 1 365 38 38 MET H H 8.263 . 1 366 38 38 MET HA H 4.652 . 1 367 38 38 MET HB2 H 0.945 . 2 368 38 38 MET HB3 H 1.545 . 2 369 38 38 MET HE H 0.764 . 1 370 38 38 MET HG2 H 1.362 . 2 371 38 38 MET CA C 51.931 . 1 372 38 38 MET CB C 30.421 . 1 373 38 38 MET CE C 16.756 . 1 374 38 38 MET N N 125.475 . 1 375 39 39 PRO HA H 4.570 . 1 376 39 39 PRO HB2 H 1.820 . 2 377 39 39 PRO HB3 H 2.236 . 2 378 39 39 PRO HD2 H 3.865 . 2 379 39 39 PRO HD3 H 3.733 . 2 380 39 39 PRO HG2 H 1.962 . 2 381 39 39 PRO HG3 H 1.962 . 2 382 39 39 PRO C C 175.622 . 1 383 39 39 PRO CA C 62.033 . 1 384 39 39 PRO CB C 32.200 . 1 385 39 39 PRO CD C 50.820 . 1 386 39 39 PRO CG C 27.412 . 1 387 40 40 VAL H H 7.865 . 1 388 40 40 VAL HA H 4.470 . 1 389 40 40 VAL HB H 2.245 . 1 390 40 40 VAL HG1 H 1.007 . 2 391 40 40 VAL HG2 H 0.878 . 2 392 40 40 VAL C C 176.466 . 1 393 40 40 VAL CA C 62.850 . 1 394 40 40 VAL CB C 32.027 . 1 395 40 40 VAL CG1 C 21.990 . 1 396 40 40 VAL CG2 C 21.990 . 1 397 40 40 VAL N N 118.010 . 1 398 41 41 TYR H H 8.747 . 1 399 41 41 TYR HA H 4.638 . 1 400 41 41 TYR HB2 H 2.676 . 2 401 41 41 TYR HB3 H 2.835 . 2 402 41 41 TYR HD1 H 6.927 . 3 403 41 41 TYR HE1 H 6.660 . 3 404 41 41 TYR C C 171.679 . 1 405 41 41 TYR CA C 58.648 . 1 406 41 41 TYR CB C 40.453 . 1 407 41 41 TYR CD1 C 132.570 . 3 408 41 41 TYR CE1 C 118.270 . 3 409 41 41 TYR N N 130.639 . 1 410 42 42 VAL H H 7.001 . 1 411 42 42 VAL HA H 4.358 . 1 412 42 42 VAL HB H 1.620 . 1 413 42 42 VAL HG1 H 0.715 . 2 414 42 42 VAL HG2 H 0.981 . 2 415 42 42 VAL C C 174.281 . 1 416 42 42 VAL CA C 59.625 . 1 417 42 42 VAL CB C 34.225 . 1 418 42 42 VAL CG1 C 22.140 . 1 419 42 42 VAL CG2 C 22.514 . 1 420 42 42 VAL N N 126.943 . 1 421 43 43 SER H H 8.468 . 1 422 43 43 SER HA H 4.060 . 1 423 43 43 SER HB2 H 3.629 . 2 424 43 43 SER HB3 H 3.629 . 2 425 43 43 SER C C 172.778 . 1 426 43 43 SER CA C 58.784 . 1 427 43 43 SER CB C 65.950 . 1 428 43 43 SER N N 120.006 . 1 429 44 44 ASP H H 8.370 . 1 430 44 44 ASP HA H 4.468 . 1 431 44 44 ASP HB2 H 2.466 . 2 432 44 44 ASP HB3 H 2.641 . 2 433 44 44 ASP C C 173.969 . 1 434 44 44 ASP CA C 56.360 . 1 435 44 44 ASP CB C 40.785 . 1 436 44 44 ASP N N 114.108 . 1 437 45 45 PHE H H 8.638 . 1 438 45 45 PHE HA H 5.801 . 1 439 45 45 PHE HB2 H 3.092 . 2 440 45 45 PHE HB3 H 3.234 . 2 441 45 45 PHE HD1 H 6.914 . 3 442 45 45 PHE HE1 H 6.782 . 3 443 45 45 PHE C C 175.916 . 1 444 45 45 PHE CA C 55.221 . 1 445 45 45 PHE CB C 41.198 . 1 446 45 45 PHE CD1 C 130.350 . 3 447 45 45 PHE CE1 C 130.350 . 3 448 45 45 PHE N N 123.901 . 1 449 46 46 THR H H 9.559 . 1 450 46 46 THR HA H 4.810 . 1 451 46 46 THR HB H 3.850 . 1 452 46 46 THR HG2 H 1.365 . 1 453 46 46 THR C C 174.952 . 1 454 46 46 THR CA C 62.136 . 1 455 46 46 THR CB C 71.450 . 1 456 46 46 THR CG2 C 21.467 . 1 457 46 46 THR N N 118.800 . 1 458 47 47 LEU H H 9.211 . 1 459 47 47 LEU HA H 4.629 . 1 460 47 47 LEU HB2 H 1.138 . 2 461 47 47 LEU HB3 H 1.368 . 2 462 47 47 LEU HD1 H 0.197 . 2 463 47 47 LEU HD2 H -0.413 . 2 464 47 47 LEU HG H 0.843 . 1 465 47 47 LEU C C 176.783 . 1 466 47 47 LEU CA C 55.225 . 1 467 47 47 LEU CB C 42.229 . 1 468 47 47 LEU CD1 C 24.272 . 1 469 47 47 LEU CD2 C 23.290 . 1 470 47 47 LEU CG C 26.602 . 1 471 47 47 LEU N N 131.280 . 1 472 48 48 PHE H H 9.274 . 1 473 48 48 PHE HA H 4.647 . 1 474 48 48 PHE HB2 H 2.930 . 2 475 48 48 PHE HB3 H 3.087 . 2 476 48 48 PHE HD1 H 7.310 . 3 477 48 48 PHE HE1 H 7.476 . 3 478 48 48 PHE C C 174.596 . 1 479 48 48 PHE CA C 58.657 . 1 480 48 48 PHE CB C 42.378 . 1 481 48 48 PHE CD1 C 131.753 . 3 482 48 48 PHE CE1 C 131.753 . 3 483 48 48 PHE N N 125.100 . 1 484 49 49 GLU H H 9.021 . 1 485 49 49 GLU HA H 3.471 . 1 486 49 49 GLU HB2 H 1.446 . 2 487 49 49 GLU HB3 H 1.961 . 2 488 49 49 GLU HG2 H 1.279 . 2 489 49 49 GLU HG3 H 1.442 . 2 490 49 49 GLU C C 176.365 . 1 491 49 49 GLU CA C 57.083 . 1 492 49 49 GLU CB C 26.977 . 1 493 49 49 GLU CG C 36.144 . 1 494 49 49 GLU N N 128.200 . 1 495 50 50 GLY H H 8.315 . 1 496 50 50 GLY HA2 H 3.290 . 2 497 50 50 GLY HA3 H 3.998 . 2 498 50 50 GLY C C 173.255 . 1 499 50 50 GLY CA C 45.231 . 1 500 50 50 GLY N N 101.616 . 1 501 51 51 GLN H H 7.810 . 1 502 51 51 GLN HA H 4.660 . 1 503 51 51 GLN HB2 H 2.073 . 2 504 51 51 GLN HB3 H 2.670 . 2 505 51 51 GLN HE21 H 7.340 . 2 506 51 51 GLN HE22 H 6.710 . 2 507 51 51 GLN HG2 H 2.510 . 2 508 51 51 GLN HG3 H 2.705 . 2 509 51 51 GLN C C 176.240 . 1 510 51 51 GLN CA C 52.716 . 1 511 51 51 GLN CB C 30.500 . 1 512 51 51 GLN CD C 180.218 . 1 513 51 51 GLN CG C 33.293 . 1 514 51 51 GLN N N 116.489 . 1 515 51 51 GLN NE2 N 109.270 . 1 516 52 52 TRP H H 8.514 . 1 517 52 52 TRP HA H 4.700 . 1 518 52 52 TRP HB2 H 2.063 . 2 519 52 52 TRP HB3 H 3.077 . 2 520 52 52 TRP HD1 H 7.447 . 1 521 52 52 TRP HE1 H 10.478 . 1 522 52 52 TRP HZ2 H 7.097 . 1 523 52 52 TRP C C 175.718 . 1 524 52 52 TRP CA C 57.183 . 1 525 52 52 TRP CB C 31.300 . 1 526 52 52 TRP N N 122.109 . 1 527 52 52 TRP NE1 N 129.583 . 1 528 53 53 THR H H 8.900 . 1 529 53 53 THR HA H 5.720 . 1 530 53 53 THR HB H 4.218 . 1 531 53 53 THR HG2 H 1.457 . 1 532 53 53 THR C C 173.097 . 1 533 53 53 THR CA C 60.720 . 1 534 53 53 THR CB C 72.500 . 1 535 53 53 THR CG2 C 21.917 . 1 536 53 53 THR N N 115.750 . 1 537 54 54 GLY H H 8.621 . 1 538 54 54 GLY HA2 H 3.500 . 2 539 54 54 GLY HA3 H 4.370 . 2 540 54 54 GLY C C 171.476 . 1 541 54 54 GLY CA C 45.236 . 1 542 54 54 GLY N N 109.261 . 1 543 55 55 CYS H H 8.860 . 1 544 55 55 CYS HA H 5.810 . 1 545 55 55 CYS HB2 H 2.846 . 2 546 55 55 CYS HB3 H 2.973 . 2 547 55 55 CYS C C 171.113 . 1 548 55 55 CYS CA C 57.516 . 1 549 55 55 CYS CB C 34.008 . 1 550 55 55 CYS N N 115.990 . 1 551 56 56 VAL H H 8.987 . 1 552 56 56 VAL HA H 4.881 . 1 553 56 56 VAL HB H 1.545 . 1 554 56 56 VAL HG1 H 0.368 . 2 555 56 56 VAL HG2 H 0.474 . 2 556 56 56 VAL C C 171.920 . 1 557 56 56 VAL CA C 59.264 . 1 558 56 56 VAL CB C 35.665 . 1 559 56 56 VAL CG1 C 19.806 . 1 560 56 56 VAL CG2 C 21.700 . 1 561 56 56 VAL N N 118.661 . 1 562 57 57 ILE H H 9.247 . 1 563 57 57 ILE HA H 5.304 . 1 564 57 57 ILE HB H 2.212 . 1 565 57 57 ILE HD1 H 0.821 . 1 566 57 57 ILE HG12 H 1.077 . 1 567 57 57 ILE HG13 H 1.642 . 1 568 57 57 ILE HG2 H 0.970 . 1 569 57 57 ILE C C 172.036 . 1 570 57 57 ILE CA C 59.670 . 1 571 57 57 ILE CB C 40.747 . 1 572 57 57 ILE CD1 C 14.400 . 1 573 57 57 ILE CG1 C 30.103 . 1 574 57 57 ILE CG2 C 17.470 . 1 575 57 57 ILE N N 127.475 . 1 576 58 58 THR H H 8.354 . 1 577 58 58 THR HA H 4.366 . 1 578 58 58 THR HB H 3.125 . 1 579 58 58 THR HG2 H 0.518 . 1 580 58 58 THR C C 172.660 . 1 581 58 58 THR CA C 58.011 . 1 582 58 58 THR CB C 70.930 . 1 583 58 58 THR CG2 C 21.653 . 1 584 58 58 THR N N 114.935 . 1 585 59 59 PRO HA H 4.330 . 1 586 59 59 PRO HB2 H 2.129 . 2 587 59 59 PRO HB3 H 3.007 . 2 588 59 59 PRO HD2 H 3.510 . 2 589 59 59 PRO HD3 H 3.600 . 2 590 59 59 PRO HG2 H 2.356 . 2 591 59 59 PRO HG3 H 2.667 . 2 592 59 59 PRO C C 176.243 . 1 593 59 59 PRO CA C 65.237 . 1 594 59 59 PRO CB C 32.480 . 1 595 59 59 PRO CD C 50.240 . 1 596 59 59 PRO CG C 27.800 . 1 597 60 60 TRP H H 7.340 . 1 598 60 60 TRP HA H 5.303 . 1 599 60 60 TRP HB2 H 3.092 . 2 600 60 60 TRP HB3 H 3.583 . 2 601 60 60 TRP HD1 H 7.222 . 1 602 60 60 TRP HE1 H 10.667 . 1 603 60 60 TRP HZ2 H 7.724 . 1 604 60 60 TRP C C 174.009 . 1 605 60 60 TRP CA C 57.834 . 1 606 60 60 TRP CB C 31.442 . 1 607 60 60 TRP CD1 C 128.800 . 1 608 60 60 TRP CZ2 C 115.113 . 1 609 60 60 TRP N N 112.973 . 1 610 60 60 TRP NE1 N 132.279 . 1 611 61 61 MET H H 7.150 . 1 612 61 61 MET HA H 4.938 . 1 613 61 61 MET HB2 H 1.943 . 2 614 61 61 MET HB3 H 2.508 . 2 615 61 61 MET HE H 1.884 . 1 616 61 61 MET HG2 H 2.007 . 2 617 61 61 MET HG3 H 2.110 . 2 618 61 61 MET C C 176.237 . 1 619 61 61 MET CA C 55.724 . 1 620 61 61 MET CB C 34.547 . 1 621 61 61 MET CE C 18.660 . 1 622 61 61 MET CG C 31.544 . 1 623 61 61 MET N N 117.312 . 1 624 62 62 LEU H H 8.497 . 1 625 62 62 LEU HA H 5.440 . 1 626 62 62 LEU HB2 H 1.403 . 2 627 62 62 LEU HB3 H 1.830 . 2 628 62 62 LEU HD1 H 0.933 . 2 629 62 62 LEU HD2 H 0.933 . 2 630 62 62 LEU HG H 1.596 . 1 631 62 62 LEU C C 176.864 . 1 632 62 62 LEU CA C 55.079 . 1 633 62 62 LEU CB C 45.825 . 1 634 62 62 LEU CD1 C 25.916 . 1 635 62 62 LEU CD2 C 25.916 . 1 636 62 62 LEU CG C 29.056 . 1 637 62 62 LEU N N 123.370 . 1 638 63 63 SER H H 9.521 . 1 639 63 63 SER HA H 5.441 . 1 640 63 63 SER HB2 H 3.480 . 2 641 63 63 SER HB3 H 3.823 . 2 642 63 63 SER C C 172.840 . 1 643 63 63 SER CA C 57.845 . 1 644 63 63 SER CB C 66.710 . 1 645 63 63 SER N N 121.456 . 1 646 64 64 ALA H H 8.967 . 1 647 64 64 ALA HA H 5.564 . 1 648 64 64 ALA HB H 1.453 . 1 649 64 64 ALA C C 176.787 . 1 650 64 64 ALA CA C 51.289 . 1 651 64 64 ALA CB C 20.158 . 1 652 64 64 ALA N N 125.950 . 1 653 65 65 VAL H H 9.420 . 1 654 65 65 VAL HA H 6.105 . 1 655 65 65 VAL HB H 2.450 . 1 656 65 65 VAL HG1 H 0.958 . 2 657 65 65 VAL HG2 H 1.165 . 2 658 65 65 VAL C C 173.715 . 1 659 65 65 VAL CA C 58.830 . 1 660 65 65 VAL CB C 36.797 . 1 661 65 65 VAL CG1 C 19.429 . 1 662 65 65 VAL CG2 C 23.328 . 1 663 65 65 VAL N N 115.048 . 1 664 66 66 ILE H H 8.734 . 1 665 66 66 ILE HA H 5.530 . 1 666 66 66 ILE HB H 1.609 . 1 667 66 66 ILE HD1 H 0.294 . 1 668 66 66 ILE HG12 H 1.076 . 1 669 66 66 ILE HG13 H 1.207 . 1 670 66 66 ILE HG2 H 1.052 . 1 671 66 66 ILE C C 175.475 . 1 672 66 66 ILE CA C 59.670 . 1 673 66 66 ILE CB C 41.620 . 1 674 66 66 ILE CD1 C 12.690 . 1 675 66 66 ILE CG1 C 27.164 . 1 676 66 66 ILE CG2 C 18.043 . 1 677 66 66 ILE N N 119.308 . 1 678 67 67 PHE H H 9.420 . 1 679 67 67 PHE HB2 H 2.596 . 2 680 67 67 PHE HB3 H 3.011 . 2 681 67 67 PHE HD1 H 7.310 . 3 682 67 67 PHE CA C 55.350 . 1 683 67 67 PHE CB C 42.278 . 1 684 67 67 PHE N N 124.046 . 1 685 68 68 PRO HA H 4.291 . 1 686 68 68 PRO HB2 H 1.220 . 2 687 68 68 PRO HB3 H 1.220 . 2 688 68 68 PRO HD2 H 3.576 . 2 689 68 68 PRO HG2 H 0.993 . 2 690 68 68 PRO HG3 H 0.993 . 2 691 68 68 PRO C C 178.162 . 1 692 68 68 PRO CA C 62.830 . 1 693 68 68 PRO CB C 28.590 . 1 694 68 68 PRO CG C 26.960 . 1 695 69 69 GLY H H 8.041 . 1 696 69 69 GLY HA2 H 4.258 . 2 697 69 69 GLY HA3 H 4.258 . 2 698 69 69 GLY CA C 44.275 . 1 699 69 69 GLY N N 109.687 . 1 700 70 70 PRO HA H 3.810 . 1 701 70 70 PRO HB2 H 1.920 . 2 702 70 70 PRO HB3 H 2.389 . 2 703 70 70 PRO HD2 H 3.132 . 2 704 70 70 PRO HD3 H 3.070 . 2 705 70 70 PRO HG2 H 2.409 . 2 706 70 70 PRO HG3 H 2.409 . 2 707 70 70 PRO C C 178.394 . 1 708 70 70 PRO CA C 64.480 . 1 709 70 70 PRO CB C 32.438 . 1 710 70 70 PRO CD C 50.720 . 1 711 70 70 PRO CG C 26.700 . 1 712 71 71 ASP H H 9.074 . 1 713 71 71 ASP HA H 4.387 . 1 714 71 71 ASP HB2 H 2.832 . 2 715 71 71 ASP HB3 H 2.934 . 2 716 71 71 ASP C C 175.002 . 1 717 71 71 ASP CA C 55.907 . 1 718 71 71 ASP CB C 40.033 . 1 719 71 71 ASP N N 118.800 . 1 720 72 72 GLN H H 7.781 . 1 721 72 72 GLN HA H 4.414 . 1 722 72 72 GLN HB2 H 2.110 . 2 723 72 72 GLN HB3 H 2.110 . 2 724 72 72 GLN HE21 H 7.387 . 2 725 72 72 GLN HE22 H 6.836 . 2 726 72 72 GLN HG2 H 2.143 . 2 727 72 72 GLN HG3 H 2.364 . 2 728 72 72 GLN C C 175.927 . 1 729 72 72 GLN CA C 55.514 . 1 730 72 72 GLN CB C 31.020 . 1 731 72 72 GLN CD C 180.630 . 1 732 72 72 GLN CG C 33.968 . 1 733 72 72 GLN N N 117.160 . 1 734 72 72 GLN NE2 N 113.560 . 1 735 73 73 LEU H H 8.521 . 1 736 73 73 LEU HA H 5.097 . 1 737 73 73 LEU HB2 H 1.306 . 2 738 73 73 LEU HB3 H 1.627 . 2 739 73 73 LEU HD1 H 0.835 . 2 740 73 73 LEU HD2 H 0.835 . 2 741 73 73 LEU HG H 1.487 . 1 742 73 73 LEU C C 176.837 . 1 743 73 73 LEU CA C 53.792 . 1 744 73 73 LEU CB C 43.905 . 1 745 73 73 LEU CD1 C 23.810 . 1 746 73 73 LEU CD2 C 23.810 . 1 747 73 73 LEU CG C 26.963 . 1 748 73 73 LEU N N 123.831 . 1 749 74 74 TRP H H 9.293 . 1 750 74 74 TRP HA H 5.334 . 1 751 74 74 TRP HB2 H 3.114 . 2 752 74 74 TRP HB3 H 3.227 . 2 753 74 74 TRP HD1 H 7.108 . 1 754 74 74 TRP HE1 H 9.726 . 1 755 74 74 TRP CA C 52.642 . 1 756 74 74 TRP CB C 30.125 . 1 757 74 74 TRP CD1 C 123.316 . 1 758 74 74 TRP N N 125.620 . 1 759 74 74 TRP NE1 N 127.350 . 1 760 75 75 PRO HA H 4.684 . 1 761 75 75 PRO HB2 H 1.820 . 2 762 75 75 PRO HB3 H 2.275 . 2 763 75 75 PRO HD2 H 3.462 . 2 764 75 75 PRO HD3 H 3.837 . 2 765 75 75 PRO HG2 H 2.001 . 2 766 75 75 PRO HG3 H 2.001 . 2 767 75 75 PRO C C 175.844 . 1 768 75 75 PRO CA C 62.030 . 1 769 75 75 PRO CB C 31.935 . 1 770 75 75 PRO CD C 50.664 . 1 771 75 75 PRO CG C 27.220 . 1 772 76 76 LEU H H 8.235 . 1 773 76 76 LEU HA H 4.179 . 1 774 76 76 LEU HB2 H 1.427 . 2 775 76 76 LEU HB3 H 1.697 . 2 776 76 76 LEU HD1 H 0.979 . 2 777 76 76 LEU HD2 H 0.979 . 2 778 76 76 LEU HG H 1.560 . 1 779 76 76 LEU C C 177.148 . 1 780 76 76 LEU CA C 56.328 . 1 781 76 76 LEU CB C 42.041 . 1 782 76 76 LEU CD1 C 24.340 . 1 783 76 76 LEU CD2 C 24.340 . 1 784 76 76 LEU CG C 27.285 . 1 785 76 76 LEU N N 122.980 . 1 786 77 77 ARG H H 8.647 . 1 787 77 77 ARG HA H 4.699 . 1 788 77 77 ARG HB2 H 1.983 . 2 789 77 77 ARG HB3 H 1.568 . 2 790 77 77 ARG HD2 H 3.022 . 2 791 77 77 ARG HD3 H 3.022 . 2 792 77 77 ARG HG2 H 1.706 . 2 793 77 77 ARG HG3 H 1.706 . 2 794 77 77 ARG C C 179.550 . 1 795 77 77 ARG CA C 54.700 . 1 796 77 77 ARG CB C 34.470 . 1 797 77 77 ARG CD C 42.365 . 1 798 77 77 ARG CG C 29.138 . 1 799 77 77 ARG N N 129.094 . 1 800 78 78 LYS H H 8.664 . 1 801 78 78 LYS HA H 4.411 . 1 802 78 78 LYS HB2 H 1.765 . 2 803 78 78 LYS HB3 H 1.765 . 2 804 78 78 LYS HD2 H 1.707 . 2 805 78 78 LYS HD3 H 1.707 . 2 806 78 78 LYS HE2 H 3.021 . 2 807 78 78 LYS HE3 H 3.021 . 2 808 78 78 LYS HG2 H 1.469 . 2 809 78 78 LYS HG3 H 1.532 . 2 810 78 78 LYS C C 176.315 . 1 811 78 78 LYS CA C 55.404 . 1 812 78 78 LYS CB C 32.980 . 1 813 78 78 LYS CD C 29.011 . 1 814 78 78 LYS CE C 42.300 . 1 815 78 78 LYS CG C 24.869 . 1 816 78 78 LYS N N 122.153 . 1 817 79 79 VAL H H 8.438 . 1 818 79 79 VAL HA H 3.411 . 1 819 79 79 VAL HB H 2.019 . 1 820 79 79 VAL HG1 H 1.132 . 2 821 79 79 VAL HG2 H 1.054 . 2 822 79 79 VAL C C 177.600 . 1 823 79 79 VAL CA C 65.256 . 1 824 79 79 VAL CB C 31.410 . 1 825 79 79 VAL CG1 C 21.336 . 1 826 79 79 VAL CG2 C 22.770 . 1 827 79 79 VAL N N 123.836 . 1 828 80 80 SER H H 8.898 . 1 829 80 80 SER HA H 3.997 . 1 830 80 80 SER HB2 H 4.074 . 2 831 80 80 SER HB3 H 4.367 . 2 832 80 80 SER C C 174.091 . 1 833 80 80 SER CA C 62.390 . 1 834 80 80 SER CB C 62.550 . 1 835 80 80 SER N N 118.803 . 1 836 81 81 GLU H H 7.998 . 1 837 81 81 GLU HA H 4.263 . 1 838 81 81 GLU HB2 H 2.028 . 2 839 81 81 GLU HB3 H 2.247 . 2 840 81 81 GLU HG2 H 2.325 . 2 841 81 81 GLU HG3 H 2.409 . 2 842 81 81 GLU C C 175.009 . 1 843 81 81 GLU CA C 57.917 . 1 844 81 81 GLU CB C 30.628 . 1 845 81 81 GLU CG C 37.430 . 1 846 81 81 GLU N N 123.578 . 1 847 82 82 LYS H H 8.399 . 1 848 82 82 LYS HA H 5.386 . 1 849 82 82 LYS HB2 H 1.558 . 2 850 82 82 LYS HB3 H 1.776 . 2 851 82 82 LYS HD2 H 1.666 . 2 852 82 82 LYS HD3 H 1.600 . 2 853 82 82 LYS HE2 H 3.026 . 2 854 82 82 LYS HE3 H 3.026 . 2 855 82 82 LYS HG2 H 1.464 . 2 856 82 82 LYS HG3 H 1.554 . 2 857 82 82 LYS C C 176.901 . 1 858 82 82 LYS CA C 54.920 . 1 859 82 82 LYS CB C 34.443 . 1 860 82 82 LYS CD C 29.318 . 1 861 82 82 LYS CE C 42.339 . 1 862 82 82 LYS CG C 25.101 . 1 863 82 82 LYS N N 121.218 . 1 864 83 83 ILE H H 9.343 . 1 865 83 83 ILE HA H 4.420 . 1 866 83 83 ILE HB H 1.673 . 1 867 83 83 ILE HD1 H 0.630 . 1 868 83 83 ILE HG12 H 1.041 . 1 869 83 83 ILE HG13 H 1.231 . 1 870 83 83 ILE HG2 H 0.729 . 1 871 83 83 ILE C C 174.593 . 1 872 83 83 ILE CA C 59.404 . 1 873 83 83 ILE CB C 41.591 . 1 874 83 83 ILE CD1 C 12.750 . 1 875 83 83 ILE CG1 C 26.963 . 1 876 83 83 ILE CG2 C 16.820 . 1 877 83 83 ILE N N 122.931 . 1 878 84 84 GLY H H 8.766 . 1 879 84 84 GLY HA2 H 3.522 . 2 880 84 84 GLY HA3 H 4.390 . 2 881 84 84 GLY C C 173.134 . 1 882 84 84 GLY CA C 45.216 . 1 883 84 84 GLY N N 115.144 . 1 884 85 85 LEU H H 9.062 . 1 885 85 85 LEU HA H 4.729 . 1 886 85 85 LEU HB2 H 1.520 . 2 887 85 85 LEU HB3 H 1.520 . 2 888 85 85 LEU HD1 H 0.601 . 2 889 85 85 LEU HD2 H 0.430 . 2 890 85 85 LEU HG H 1.450 . 1 891 85 85 LEU C C 175.098 . 1 892 85 85 LEU CA C 54.201 . 1 893 85 85 LEU CB C 46.330 . 1 894 85 85 LEU CD1 C 24.346 . 1 895 85 85 LEU CD2 C 25.390 . 1 896 85 85 LEU CG C 27.225 . 1 897 85 85 LEU N N 126.300 . 1 898 86 86 GLN H H 8.666 . 1 899 86 86 GLN HA H 4.546 . 1 900 86 86 GLN HB2 H 2.023 . 2 901 86 86 GLN HB3 H 2.083 . 2 902 86 86 GLN HE21 H 7.560 . 2 903 86 86 GLN HE22 H 6.820 . 2 904 86 86 GLN HG2 H 2.247 . 2 905 86 86 GLN HG3 H 2.330 . 2 906 86 86 GLN C C 174.761 . 1 907 86 86 GLN CA C 55.752 . 1 908 86 86 GLN CB C 28.698 . 1 909 86 86 GLN CD C 180.546 . 1 910 86 86 GLN CG C 33.799 . 1 911 86 86 GLN N N 122.110 . 1 912 86 86 GLN NE2 N 112.160 . 1 913 87 87 LEU H H 7.965 . 1 914 87 87 LEU HA H 4.718 . 1 915 87 87 LEU HB2 H 1.958 . 2 916 87 87 LEU HB3 H 1.851 . 2 917 87 87 LEU HD1 H 1.044 . 2 918 87 87 LEU HD2 H 0.866 . 2 919 87 87 LEU HG H 1.730 . 1 920 87 87 LEU CA C 53.386 . 1 921 87 87 LEU CB C 41.304 . 1 922 87 87 LEU CD1 C 25.916 . 1 923 87 87 LEU CD2 C 23.916 . 1 924 87 87 LEU CG C 29.045 . 1 925 87 87 LEU N N 129.540 . 1 926 88 88 PRO HA H 4.164 . 1 927 88 88 PRO HB2 H 1.480 . 2 928 88 88 PRO HB3 H 2.167 . 2 929 88 88 PRO HD2 H 3.651 . 2 930 88 88 PRO HD3 H 3.035 . 2 931 88 88 PRO HG2 H 2.009 . 2 932 88 88 PRO HG3 H 1.742 . 2 933 88 88 PRO C C 178.584 . 1 934 88 88 PRO CA C 66.040 . 1 935 88 88 PRO CB C 31.620 . 1 936 88 88 PRO CD C 49.209 . 1 937 88 88 PRO CG C 29.056 . 1 938 89 89 TYR H H 6.719 . 1 939 89 89 TYR HA H 4.229 . 1 940 89 89 TYR HB2 H 2.505 . 2 941 89 89 TYR HB3 H 3.675 . 2 942 89 89 TYR HD1 H 7.051 . 3 943 89 89 TYR HE1 H 6.779 . 3 944 89 89 TYR C C 175.127 . 1 945 89 89 TYR CA C 59.726 . 1 946 89 89 TYR CB C 41.163 . 1 947 89 89 TYR CD1 C 133.270 . 3 948 89 89 TYR CE1 C 117.800 . 3 949 89 89 TYR N N 112.123 . 1 950 90 90 GLY H H 7.453 . 1 951 90 90 GLY HA2 H 3.802 . 2 952 90 90 GLY HA3 H 4.197 . 2 953 90 90 GLY C C 172.345 . 1 954 90 90 GLY CA C 44.090 . 1 955 90 90 GLY N N 104.158 . 1 956 91 91 THR H H 8.405 . 1 957 91 91 THR HA H 4.814 . 1 958 91 91 THR HB H 4.031 . 1 959 91 91 THR HG2 H 1.131 . 1 960 91 91 THR C C 175.244 . 1 961 91 91 THR CA C 63.210 . 1 962 91 91 THR CB C 68.764 . 1 963 91 91 THR CG2 C 21.700 . 1 964 91 91 THR N N 116.590 . 1 965 92 92 MET H H 9.050 . 1 966 92 92 MET HA H 4.717 . 1 967 92 92 MET HB2 H 1.980 . 2 968 92 92 MET HB3 H 2.142 . 2 969 92 92 MET HE H 1.947 . 1 970 92 92 MET HG2 H 2.463 . 2 971 92 92 MET HG3 H 2.569 . 2 972 92 92 MET C C 174.454 . 1 973 92 92 MET CA C 54.980 . 1 974 92 92 MET CB C 39.000 . 1 975 92 92 MET CE C 17.279 . 1 976 92 92 MET CG C 32.087 . 1 977 92 92 MET N N 127.943 . 1 978 93 93 THR H H 8.747 . 1 979 93 93 THR HA H 4.734 . 1 980 93 93 THR HB H 3.996 . 1 981 93 93 THR HG2 H 1.131 . 1 982 93 93 THR C C 174.117 . 1 983 93 93 THR CA C 63.246 . 1 984 93 93 THR CB C 68.360 . 1 985 93 93 THR CG2 C 22.120 . 1 986 93 93 THR N N 119.176 . 1 987 94 94 PHE H H 9.565 . 1 988 94 94 PHE HA H 4.749 . 1 989 94 94 PHE HB2 H 2.830 . 2 990 94 94 PHE HB3 H 3.005 . 2 991 94 94 PHE HD1 H 7.021 . 3 992 94 94 PHE HE1 H 7.168 . 3 993 94 94 PHE C C 174.512 . 1 994 94 94 PHE CA C 56.600 . 1 995 94 94 PHE CB C 43.200 . 1 996 94 94 PHE CD1 C 131.870 . 3 997 94 94 PHE CE1 C 131.870 . 3 998 94 94 PHE N N 129.352 . 1 999 95 95 THR H H 9.717 . 1 1000 95 95 THR HA H 5.211 . 1 1001 95 95 THR HB H 3.931 . 1 1002 95 95 THR HG2 H 1.182 . 1 1003 95 95 THR C C 175.305 . 1 1004 95 95 THR CA C 61.093 . 1 1005 95 95 THR CB C 71.340 . 1 1006 95 95 THR CG2 C 21.479 . 1 1007 95 95 THR N N 115.246 . 1 1008 96 96 VAL H H 9.028 . 1 1009 96 96 VAL HA H 4.237 . 1 1010 96 96 VAL HB H 2.261 . 1 1011 96 96 VAL HG1 H 0.747 . 2 1012 96 96 VAL HG2 H 0.843 . 2 1013 96 96 VAL C C 176.341 . 1 1014 96 96 VAL CA C 63.520 . 1 1015 96 96 VAL CB C 31.330 . 1 1016 96 96 VAL CG1 C 21.728 . 1 1017 96 96 VAL CG2 C 22.514 . 1 1018 96 96 VAL N N 127.968 . 1 1019 97 97 GLY H H 9.018 . 1 1020 97 97 GLY HA2 H 3.233 . 2 1021 97 97 GLY HA3 H 4.640 . 2 1022 97 97 GLY C C 171.466 . 1 1023 97 97 GLY CA C 43.750 . 1 1024 97 97 GLY N N 119.417 . 1 1025 98 98 GLU H H 8.749 . 1 1026 98 98 GLU HA H 4.889 . 1 1027 98 98 GLU HB2 H 1.982 . 2 1028 98 98 GLU HB3 H 2.053 . 2 1029 98 98 GLU HG2 H 2.178 . 2 1030 98 98 GLU HG3 H 2.178 . 2 1031 98 98 GLU C C 174.515 . 1 1032 98 98 GLU CA C 56.606 . 1 1033 98 98 GLU CB C 33.000 . 1 1034 98 98 GLU CG C 36.340 . 1 1035 98 98 GLU N N 117.804 . 1 1036 99 99 LEU H H 7.998 . 1 1037 99 99 LEU HA H 4.783 . 1 1038 99 99 LEU HB2 H 1.427 . 2 1039 99 99 LEU HB3 H 1.588 . 2 1040 99 99 LEU HD1 H 0.435 . 2 1041 99 99 LEU HD2 H 0.295 . 2 1042 99 99 LEU HG H 1.336 . 1 1043 99 99 LEU C C 175.946 . 1 1044 99 99 LEU CA C 52.817 . 1 1045 99 99 LEU CB C 43.280 . 1 1046 99 99 LEU CD1 C 25.116 . 1 1047 99 99 LEU CD2 C 23.925 . 1 1048 99 99 LEU CG C 26.178 . 1 1049 99 99 LEU N N 126.497 . 1 1050 100 100 ASP H H 9.114 . 1 1051 100 100 ASP HA H 4.329 . 1 1052 100 100 ASP HB2 H 2.634 . 2 1053 100 100 ASP HB3 H 2.634 . 2 1054 100 100 ASP C C 176.753 . 1 1055 100 100 ASP CA C 56.490 . 1 1056 100 100 ASP CB C 40.505 . 1 1057 100 100 ASP N N 129.122 . 1 1058 101 101 GLY H H 8.808 . 1 1059 101 101 GLY HA2 H 3.759 . 2 1060 101 101 GLY HA3 H 4.205 . 2 1061 101 101 GLY C C 174.117 . 1 1062 101 101 GLY CA C 45.568 . 1 1063 101 101 GLY N N 112.632 . 1 1064 102 102 VAL H H 8.177 . 1 1065 102 102 VAL HA H 4.341 . 1 1066 102 102 VAL HB H 1.948 . 1 1067 102 102 VAL HG1 H 0.647 . 2 1068 102 102 VAL HG2 H 0.877 . 2 1069 102 102 VAL C C 173.648 . 1 1070 102 102 VAL CA C 63.537 . 1 1071 102 102 VAL CB C 33.500 . 1 1072 102 102 VAL CG1 C 21.460 . 1 1073 102 102 VAL CG2 C 21.990 . 1 1074 102 102 VAL N N 120.643 . 1 1075 103 103 SER H H 7.863 . 1 1076 103 103 SER HA H 4.799 . 1 1077 103 103 SER HB2 H 4.305 . 2 1078 103 103 SER HB3 H 4.320 . 2 1079 103 103 SER C C 175.995 . 1 1080 103 103 SER CA C 59.577 . 1 1081 103 103 SER CB C 65.584 . 1 1082 103 103 SER N N 111.706 . 1 1083 104 104 GLN H H 7.727 . 1 1084 104 104 GLN HA H 5.411 . 1 1085 104 104 GLN HB2 H 2.254 . 2 1086 104 104 GLN HB3 H 2.254 . 2 1087 104 104 GLN HE21 H 7.720 . 2 1088 104 104 GLN HE22 H 7.470 . 2 1089 104 104 GLN HG2 H 2.408 . 2 1090 104 104 GLN HG3 H 2.875 . 2 1091 104 104 GLN C C 175.083 . 1 1092 104 104 GLN CA C 58.245 . 1 1093 104 104 GLN CB C 29.722 . 1 1094 104 104 GLN CD C 179.977 . 1 1095 104 104 GLN CG C 35.370 . 1 1096 104 104 GLN N N 117.876 . 1 1097 104 104 GLN NE2 N 110.490 . 1 1098 105 105 TYR H H 8.832 . 1 1099 105 105 TYR HA H 5.111 . 1 1100 105 105 TYR HB2 H 1.970 . 2 1101 105 105 TYR HB3 H 2.400 . 2 1102 105 105 TYR HD1 H 6.830 . 3 1103 105 105 TYR HE1 H 6.670 . 3 1104 105 105 TYR C C 172.148 . 1 1105 105 105 TYR CA C 55.731 . 1 1106 105 105 TYR CB C 40.401 . 1 1107 105 105 TYR CD1 C 133.970 . 3 1108 105 105 TYR CE1 C 117.100 . 3 1109 105 105 TYR N N 118.623 . 1 1110 106 106 LEU H H 8.686 . 1 1111 106 106 LEU HA H 5.160 . 1 1112 106 106 LEU HB2 H 1.310 . 2 1113 106 106 LEU HB3 H 1.628 . 2 1114 106 106 LEU HD1 H 0.309 . 2 1115 106 106 LEU HD2 H 0.579 . 2 1116 106 106 LEU HG H 1.618 . 1 1117 106 106 LEU C C 176.562 . 1 1118 106 106 LEU CA C 52.453 . 1 1119 106 106 LEU CB C 43.929 . 1 1120 106 106 LEU CD1 C 25.390 . 1 1121 106 106 LEU CD2 C 24.080 . 1 1122 106 106 LEU CG C 26.700 . 1 1123 106 106 LEU N N 119.030 . 1 1124 107 107 SER H H 9.121 . 1 1125 107 107 SER HA H 6.018 . 1 1126 107 107 SER HB2 H 3.913 . 2 1127 107 107 SER HB3 H 3.988 . 2 1128 107 107 SER C C 173.874 . 1 1129 107 107 SER CA C 56.677 . 1 1130 107 107 SER CB C 66.931 . 1 1131 107 107 SER N N 115.413 . 1 1132 108 108 CYS H H 9.318 . 1 1133 108 108 CYS HA H 4.634 . 1 1134 108 108 CYS HB2 H 1.167 . 2 1135 108 108 CYS HB3 H 1.928 . 2 1136 108 108 CYS C C 174.117 . 1 1137 108 108 CYS CA C 57.840 . 1 1138 108 108 CYS CB C 27.779 . 1 1139 108 108 CYS N N 126.488 . 1 1140 109 109 SER H H 8.963 . 1 1141 109 109 SER HA H 4.540 . 1 1142 109 109 SER HB2 H 3.853 . 2 1143 109 109 SER HB3 H 3.853 . 2 1144 109 109 SER C C 174.527 . 1 1145 109 109 SER CA C 59.404 . 1 1146 109 109 SER CB C 63.340 . 1 1147 109 109 SER N N 124.768 . 1 1148 110 110 LEU H H 9.411 . 1 1149 110 110 LEU HA H 4.535 . 1 1150 110 110 LEU HB2 H 1.593 . 2 1151 110 110 LEU HB3 H 1.593 . 2 1152 110 110 LEU HD1 H 0.750 . 2 1153 110 110 LEU HD2 H 0.750 . 2 1154 110 110 LEU HG H 1.469 . 1 1155 110 110 LEU C C 177.576 . 1 1156 110 110 LEU CA C 55.490 . 1 1157 110 110 LEU CB C 42.278 . 1 1158 110 110 LEU CD1 C 23.610 . 1 1159 110 110 LEU CD2 C 23.610 . 1 1160 110 110 LEU CG C 26.793 . 1 1161 110 110 LEU N N 128.060 . 1 1162 111 111 MET H H 7.782 . 1 1163 111 111 MET HA H 4.486 . 1 1164 111 111 MET HB2 H 1.887 . 2 1165 111 111 MET HB3 H 2.052 . 2 1166 111 111 MET HE H 0.773 . 1 1167 111 111 MET HG2 H 2.438 . 2 1168 111 111 MET HG3 H 2.485 . 2 1169 111 111 MET C C 174.322 . 1 1170 111 111 MET CA C 56.293 . 1 1171 111 111 MET CB C 36.900 . 1 1172 111 111 MET CE C 26.430 . 1 1173 111 111 MET CG C 31.310 . 1 1174 111 111 MET N N 117.783 . 1 1175 112 112 SER H H 8.431 . 1 1176 112 112 SER HA H 4.290 . 1 1177 112 112 SER HB2 H 3.731 . 2 1178 112 112 SER HB3 H 4.155 . 2 1179 112 112 SER CA C 57.584 . 1 1180 112 112 SER CB C 64.509 . 1 1181 112 112 SER N N 120.432 . 1 1182 113 113 PRO HB2 H 2.290 . 2 1183 113 113 PRO HB3 H 2.390 . 2 1184 113 113 PRO HD2 H 3.640 . 2 1185 113 113 PRO HD3 H 3.498 . 2 1186 113 113 PRO HG2 H 1.708 . 2 1187 113 113 PRO HG3 H 1.845 . 2 1188 113 113 PRO C C 176.153 . 1 1189 113 113 PRO CA C 63.220 . 1 1190 113 113 PRO CB C 34.540 . 1 1191 113 113 PRO CD C 50.155 . 1 1192 113 113 PRO CG C 24.800 . 1 1193 114 114 LEU H H 8.997 . 1 1194 114 114 LEU HA H 4.315 . 1 1195 114 114 LEU HB2 H 1.782 . 2 1196 114 114 LEU HB3 H 1.527 . 2 1197 114 114 LEU HD1 H 0.723 . 2 1198 114 114 LEU HD2 H 0.723 . 2 1199 114 114 LEU HG H 0.901 . 1 1200 114 114 LEU C C 177.922 . 1 1201 114 114 LEU CA C 54.403 . 1 1202 114 114 LEU CB C 43.410 . 1 1203 114 114 LEU CD1 C 22.425 . 1 1204 114 114 LEU CD2 C 22.425 . 1 1205 114 114 LEU CG C 26.036 . 1 1206 114 114 LEU N N 117.254 . 1 1207 115 115 SER H H 7.960 . 1 1208 115 115 SER HA H 4.417 . 1 1209 115 115 SER HB2 H 3.806 . 2 1210 115 115 SER HB3 H 4.005 . 2 1211 115 115 SER C C 177.330 . 1 1212 115 115 SER CA C 57.969 . 1 1213 115 115 SER CB C 63.393 . 1 1214 115 115 SER N N 115.640 . 1 1215 116 116 HIS HA H 4.151 . 1 1216 116 116 HIS HB2 H 3.038 . 2 1217 116 116 HIS HB3 H 3.079 . 2 1218 116 116 HIS HD2 H 7.239 . 1 1219 116 116 HIS C C 175.123 . 1 1220 116 116 HIS CA C 57.576 . 1 1221 116 116 HIS CB C 30.100 . 1 1222 117 117 SER H H 7.931 . 1 1223 117 117 SER HA H 4.337 . 1 1224 117 117 SER HB2 H 3.800 . 2 1225 117 117 SER HB3 H 3.950 . 2 1226 117 117 SER C C 174.644 . 1 1227 117 117 SER CA C 58.360 . 1 1228 117 117 SER CB C 63.246 . 1 1229 117 117 SER N N 111.560 . 1 1230 118 118 MET H H 7.423 . 1 1231 118 118 MET HA H 4.334 . 1 1232 118 118 MET HB2 H 1.987 . 2 1233 118 118 MET HB3 H 2.101 . 2 1234 118 118 MET HE H 1.365 . 1 1235 118 118 MET HG2 H 2.459 . 2 1236 118 118 MET HG3 H 2.691 . 2 1237 118 118 MET C C 176.323 . 1 1238 118 118 MET CA C 56.690 . 1 1239 118 118 MET CB C 34.822 . 1 1240 118 118 MET CE C 13.870 . 1 1241 118 118 MET CG C 31.150 . 1 1242 118 118 MET N N 123.370 . 1 1243 119 119 SER H H 8.906 . 1 1244 119 119 SER HA H 4.688 . 1 1245 119 119 SER HB2 H 4.102 . 2 1246 119 119 SER HB3 H 4.441 . 2 1247 119 119 SER C C 175.103 . 1 1248 119 119 SER CA C 57.060 . 1 1249 119 119 SER CB C 65.584 . 1 1250 119 119 SER N N 124.070 . 1 1251 120 120 ILE H H 8.674 . 1 1252 120 120 ILE HA H 3.587 . 1 1253 120 120 ILE HB H 1.683 . 1 1254 120 120 ILE HD1 H 0.934 . 1 1255 120 120 ILE HG12 H 1.074 . 1 1256 120 120 ILE HG13 H 1.074 . 1 1257 120 120 ILE HG2 H 0.761 . 1 1258 120 120 ILE C C 178.001 . 1 1259 120 120 ILE CA C 66.310 . 1 1260 120 120 ILE CB C 32.949 . 1 1261 120 120 ILE CD1 C 13.721 . 1 1262 120 120 ILE CG1 C 29.144 . 1 1263 120 120 ILE CG2 C 16.723 . 1 1264 120 120 ILE N N 122.201 . 1 1265 121 121 GLU H H 8.661 . 1 1266 121 121 GLU HA H 3.844 . 1 1267 121 121 GLU HB2 H 1.869 . 2 1268 121 121 GLU HB3 H 2.016 . 2 1269 121 121 GLU HG2 H 2.239 . 2 1270 121 121 GLU HG3 H 2.314 . 2 1271 121 121 GLU C C 179.396 . 1 1272 121 121 GLU CA C 60.129 . 1 1273 121 121 GLU CB C 29.074 . 1 1274 121 121 GLU CG C 36.622 . 1 1275 121 121 GLU N N 118.920 . 1 1276 122 122 GLU H H 7.898 . 1 1277 122 122 GLU HA H 3.925 . 1 1278 122 122 GLU HB2 H 1.914 . 2 1279 122 122 GLU HB3 H 2.216 . 2 1280 122 122 GLU HG2 H 2.240 . 2 1281 122 122 GLU HG3 H 2.313 . 2 1282 122 122 GLU C C 179.396 . 1 1283 122 122 GLU CA C 59.150 . 1 1284 122 122 GLU CB C 29.600 . 1 1285 122 122 GLU CG C 36.627 . 1 1286 122 122 GLU N N 119.788 . 1 1287 123 123 GLY H H 8.492 . 1 1288 123 123 GLY HA2 H 3.615 . 2 1289 123 123 GLY HA3 H 3.811 . 2 1290 123 123 GLY C C 176.152 . 1 1291 123 123 GLY CA C 47.863 . 1 1292 123 123 GLY N N 108.020 . 1 1293 124 124 GLN H H 8.270 . 1 1294 124 124 GLN HA H 3.427 . 1 1295 124 124 GLN HB2 H 1.642 . 2 1296 124 124 GLN HB3 H 1.150 . 2 1297 124 124 GLN HE21 H 6.900 . 2 1298 124 124 GLN HE22 H 6.600 . 2 1299 124 124 GLN HG2 H 1.974 . 2 1300 124 124 GLN HG3 H 1.151 . 2 1301 124 124 GLN C C 176.966 . 1 1302 124 124 GLN CA C 59.747 . 1 1303 124 124 GLN CB C 27.021 . 1 1304 124 124 GLN CD C 179.580 . 1 1305 124 124 GLN CG C 33.500 . 1 1306 124 124 GLN N N 123.600 . 1 1307 124 124 GLN NE2 N 109.530 . 1 1308 125 125 ARG H H 7.863 . 1 1309 125 125 ARG HA H 4.055 . 1 1310 125 125 ARG HB2 H 1.884 . 2 1311 125 125 ARG HB3 H 1.884 . 2 1312 125 125 ARG HD2 H 3.211 . 2 1313 125 125 ARG HD3 H 3.211 . 2 1314 125 125 ARG HG2 H 1.672 . 2 1315 125 125 ARG HG3 H 1.672 . 2 1316 125 125 ARG C C 178.789 . 1 1317 125 125 ARG CA C 59.270 . 1 1318 125 125 ARG CB C 30.137 . 1 1319 125 125 ARG CD C 43.436 . 1 1320 125 125 ARG CG C 26.960 . 1 1321 125 125 ARG N N 118.756 . 1 1322 126 126 LEU H H 8.494 . 1 1323 126 126 LEU HA H 4.217 . 1 1324 126 126 LEU HB2 H 1.729 . 2 1325 126 126 LEU HB3 H 1.803 . 2 1326 126 126 LEU HD1 H 0.817 . 2 1327 126 126 LEU HD2 H 0.817 . 2 1328 126 126 LEU HG H 1.614 . 1 1329 126 126 LEU C C 178.958 . 1 1330 126 126 LEU CA C 57.726 . 1 1331 126 126 LEU CB C 42.285 . 1 1332 126 126 LEU CD1 C 25.390 . 1 1333 126 126 LEU CD2 C 25.390 . 1 1334 126 126 LEU CG C 26.492 . 1 1335 126 126 LEU N N 119.270 . 1 1336 127 127 THR H H 7.779 . 1 1337 127 127 THR HA H 3.598 . 1 1338 127 127 THR HB H 4.484 . 1 1339 127 127 THR HG2 H 1.066 . 1 1340 127 127 THR C C 176.172 . 1 1341 127 127 THR CA C 68.808 . 1 1342 127 127 THR CB C 67.739 . 1 1343 127 127 THR CG2 C 21.851 . 1 1344 127 127 THR N N 118.831 . 1 1345 128 128 ASP H H 8.060 . 1 1346 128 128 ASP HA H 4.424 . 1 1347 128 128 ASP HB2 H 2.732 . 2 1348 128 128 ASP HB3 H 2.937 . 2 1349 128 128 ASP C C 179.716 . 1 1350 128 128 ASP CA C 57.783 . 1 1351 128 128 ASP CB C 40.149 . 1 1352 128 128 ASP N N 121.615 . 1 1353 129 129 ASP H H 9.043 . 1 1354 129 129 ASP HA H 4.511 . 1 1355 129 129 ASP HB2 H 2.658 . 2 1356 129 129 ASP HB3 H 2.956 . 2 1357 129 129 ASP C C 180.232 . 1 1358 129 129 ASP CA C 57.635 . 1 1359 129 129 ASP CB C 40.223 . 1 1360 129 129 ASP N N 121.515 . 1 1361 130 130 CYS H H 9.155 . 1 1362 130 130 CYS HA H 4.136 . 1 1363 130 130 CYS HB2 H 2.568 . 2 1364 130 130 CYS HB3 H 3.180 . 2 1365 130 130 CYS C C 175.644 . 1 1366 130 130 CYS CA C 64.910 . 1 1367 130 130 CYS CB C 27.601 . 1 1368 130 130 CYS N N 120.670 . 1 1369 131 131 ALA H H 7.799 . 1 1370 131 131 ALA HA H 4.024 . 1 1371 131 131 ALA HB H 1.696 . 1 1372 131 131 ALA C C 179.018 . 1 1373 131 131 ALA CA C 55.750 . 1 1374 131 131 ALA CB C 17.800 . 1 1375 131 131 ALA N N 123.055 . 1 1376 132 132 ARG H H 7.087 . 1 1377 132 132 ARG HA H 4.159 . 1 1378 132 132 ARG HB2 H 1.904 . 2 1379 132 132 ARG HB3 H 1.985 . 2 1380 132 132 ARG HD2 H 3.301 . 2 1381 132 132 ARG HD3 H 3.301 . 2 1382 132 132 ARG HG2 H 1.896 . 2 1383 132 132 ARG HG3 H 1.699 . 2 1384 132 132 ARG C C 179.493 . 1 1385 132 132 ARG CA C 58.264 . 1 1386 132 132 ARG CB C 30.151 . 1 1387 132 132 ARG CD C 43.401 . 1 1388 132 132 ARG CG C 27.748 . 1 1389 132 132 ARG N N 114.942 . 1 1390 133 133 MET H H 8.627 . 1 1391 133 133 MET HA H 3.985 . 1 1392 133 133 MET HB2 H 2.070 . 2 1393 133 133 MET HB3 H 2.146 . 2 1394 133 133 MET HE H 2.000 . 1 1395 133 133 MET HG2 H 2.493 . 2 1396 133 133 MET HG3 H 2.493 . 2 1397 133 133 MET C C 180.245 . 1 1398 133 133 MET CA C 59.154 . 1 1399 133 133 MET CB C 34.020 . 1 1400 133 133 MET CE C 17.017 . 1 1401 133 133 MET CG C 31.643 . 1 1402 133 133 MET N N 122.080 . 1 1403 134 134 ILE H H 7.899 . 1 1404 134 134 ILE HA H 3.857 . 1 1405 134 134 ILE HB H 1.993 . 1 1406 134 134 ILE HD1 H 0.816 . 1 1407 134 134 ILE HG12 H 1.280 . 1 1408 134 134 ILE HG13 H 1.599 . 1 1409 134 134 ILE HG2 H 0.743 . 1 1410 134 134 ILE C C 174.721 . 1 1411 134 134 ILE CA C 65.413 . 1 1412 134 134 ILE CB C 37.436 . 1 1413 134 134 ILE CD1 C 13.670 . 1 1414 134 134 ILE CG1 C 25.362 . 1 1415 134 134 ILE CG2 C 17.196 . 1 1416 134 134 ILE N N 111.186 . 1 1417 135 135 LEU H H 6.606 . 1 1418 135 135 LEU HA H 4.198 . 1 1419 135 135 LEU HB2 H 1.742 . 2 1420 135 135 LEU HB3 H 1.742 . 2 1421 135 135 LEU HD1 H 1.003 . 2 1422 135 135 LEU HD2 H 0.487 . 2 1423 135 135 LEU HG H 1.643 . 1 1424 135 135 LEU C C 175.747 . 1 1425 135 135 LEU CA C 53.396 . 1 1426 135 135 LEU CB C 41.538 . 1 1427 135 135 LEU CD1 C 25.692 . 1 1428 135 135 LEU CD2 C 21.300 . 1 1429 135 135 LEU CG C 26.910 . 1 1430 135 135 LEU N N 115.674 . 1 1431 136 136 SER H H 7.841 . 1 1432 136 136 SER HA H 4.490 . 1 1433 136 136 SER HB2 H 3.836 . 2 1434 136 136 SER HB3 H 4.004 . 2 1435 136 136 SER C C 172.803 . 1 1436 136 136 SER CA C 57.846 . 1 1437 136 136 SER CB C 63.982 . 1 1438 136 136 SER N N 115.428 . 1 1439 137 137 LEU H H 8.027 . 1 1440 137 137 LEU HA H 4.584 . 1 1441 137 137 LEU HB2 H 1.514 . 2 1442 137 137 LEU HB3 H 1.586 . 2 1443 137 137 LEU HD1 H 1.007 . 2 1444 137 137 LEU HD2 H 1.007 . 2 1445 137 137 LEU HG H 1.007 . 1 1446 137 137 LEU CA C 52.940 . 1 1447 137 137 LEU CB C 40.997 . 1 1448 137 137 LEU CD1 C 22.709 . 1 1449 137 137 LEU CD2 C 22.709 . 1 1450 137 137 LEU CG C 25.500 . 1 1451 137 137 LEU N N 121.850 . 1 1452 138 138 PRO HA H 4.474 . 1 1453 138 138 PRO HB2 H 2.245 . 2 1454 138 138 PRO HB3 H 1.870 . 2 1455 138 138 PRO HD2 H 4.014 . 2 1456 138 138 PRO HD3 H 3.601 . 2 1457 138 138 PRO HG2 H 2.004 . 2 1458 138 138 PRO HG3 H 2.004 . 2 1459 138 138 PRO C C 174.240 . 1 1460 138 138 PRO CA C 63.080 . 1 1461 138 138 PRO CB C 32.160 . 1 1462 138 138 PRO CD C 50.256 . 1 1463 138 138 PRO CG C 27.359 . 1 1464 139 139 VAL H H 8.220 . 1 1465 139 139 VAL HA H 4.254 . 1 1466 139 139 VAL HB H 2.130 . 1 1467 139 139 VAL HG1 H 0.980 . 2 1468 139 139 VAL HG2 H 0.980 . 2 1469 139 139 VAL C C 176.485 . 1 1470 139 139 VAL CA C 62.030 . 1 1471 139 139 VAL CB C 32.980 . 1 1472 139 139 VAL CG1 C 20.450 . 1 1473 139 139 VAL CG2 C 20.450 . 1 1474 139 139 VAL N N 119.738 . 1 1475 140 140 THR H H 8.368 . 1 1476 140 140 THR HA H 4.323 . 1 1477 140 140 THR HB H 4.180 . 1 1478 140 140 THR HG2 H 1.180 . 1 1479 140 140 THR C C 173.937 . 1 1480 140 140 THR CA C 61.870 . 1 1481 140 140 THR CB C 69.880 . 1 1482 140 140 THR CG2 C 21.399 . 1 1483 140 140 THR N N 117.865 . 1 1484 141 141 ASN H H 8.413 . 1 1485 141 141 ASN HA H 5.003 . 1 1486 141 141 ASN HB2 H 2.743 . 2 1487 141 141 ASN HB3 H 2.870 . 2 1488 141 141 ASN HD21 H 7.741 . 2 1489 141 141 ASN HD22 H 7.017 . 2 1490 141 141 ASN CA C 51.240 . 1 1491 141 141 ASN CB C 39.042 . 1 1492 141 141 ASN CG C 177.090 . 1 1493 141 141 ASN N N 122.435 . 1 1494 141 141 ASN ND2 N 112.625 . 1 1495 142 142 PRO HA H 4.391 . 1 1496 142 142 PRO HB2 H 2.007 . 2 1497 142 142 PRO HB3 H 2.246 . 2 1498 142 142 PRO HD2 H 3.796 . 2 1499 142 142 PRO HD3 H 3.796 . 2 1500 142 142 PRO HG2 H 2.005 . 2 1501 142 142 PRO HG3 H 2.005 . 2 1502 142 142 PRO C C 176.588 . 1 1503 142 142 PRO CA C 63.760 . 1 1504 142 142 PRO CB C 32.147 . 1 1505 142 142 PRO CD C 50.761 . 1 1506 142 142 PRO CG C 27.296 . 1 1507 143 143 ASP H H 8.314 . 1 1508 143 143 ASP HA H 4.624 . 1 1509 143 143 ASP HB2 H 2.611 . 2 1510 143 143 ASP HB3 H 2.741 . 2 1511 143 143 ASP C C 175.868 . 1 1512 143 143 ASP CA C 54.440 . 1 1513 143 143 ASP CB C 41.002 . 1 1514 143 143 ASP N N 119.660 . 1 1515 144 144 VAL H H 7.660 . 1 1516 144 144 VAL HA H 4.390 . 1 1517 144 144 VAL HB H 2.098 . 1 1518 144 144 VAL HG1 H 0.908 . 2 1519 144 144 VAL HG2 H 0.939 . 2 1520 144 144 VAL C C 174.328 . 1 1521 144 144 VAL CA C 60.061 . 1 1522 144 144 VAL CB C 32.508 . 1 1523 144 144 VAL CG1 C 20.430 . 1 1524 144 144 VAL CG2 C 21.310 . 1 1525 144 144 VAL N N 120.028 . 1 1526 145 145 PRO HA H 4.389 . 1 1527 145 145 PRO HB2 H 1.835 . 2 1528 145 145 PRO HB3 H 2.259 . 2 1529 145 145 PRO HD2 H 3.676 . 2 1530 145 145 PRO HD3 H 3.797 . 2 1531 145 145 PRO HG2 H 2.000 . 2 1532 145 145 PRO HG3 H 2.000 . 2 1533 145 145 PRO C C 176.558 . 1 1534 145 145 PRO CA C 63.600 . 1 1535 145 145 PRO CB C 31.966 . 1 1536 145 145 PRO CD C 51.037 . 1 1537 145 145 PRO CG C 27.158 . 1 1538 146 146 HIS H H 8.369 . 1 1539 146 146 HIS HA H 4.584 . 1 1540 146 146 HIS HB2 H 3.161 . 2 1541 146 146 HIS HB3 H 3.161 . 2 1542 146 146 HIS HD2 H 7.081 . 1 1543 146 146 HIS C C 175.431 . 1 1544 146 146 HIS CA C 56.275 . 1 1545 146 146 HIS CB C 30.309 . 1 1546 146 146 HIS N N 119.248 . 1 1547 147 147 ALA H H 8.331 . 1 1548 147 147 ALA HA H 4.258 . 1 1549 147 147 ALA HB H 1.406 . 1 1550 147 147 ALA C C 178.520 . 1 1551 147 147 ALA CA C 53.130 . 1 1552 147 147 ALA CB C 19.124 . 1 1553 147 147 ALA N N 124.702 . 1 1554 148 148 GLY H H 8.494 . 1 1555 148 148 GLY HA2 H 3.293 . 2 1556 148 148 GLY HA3 H 3.964 . 2 1557 148 148 GLY C C 175.232 . 1 1558 148 148 GLY CA C 45.202 . 1 1559 148 148 GLY N N 108.130 . 1 1560 149 149 ARG H H 8.315 . 1 1561 149 149 ARG HA H 4.381 . 1 1562 149 149 ARG HB2 H 1.999 . 2 1563 149 149 ARG HB3 H 2.228 . 2 1564 149 149 ARG C C 176.855 . 1 1565 149 149 ARG CA C 56.630 . 1 1566 149 149 ARG CB C 30.389 . 1 1567 149 149 ARG N N 119.068 . 1 1568 150 150 ARG H H 8.319 . 1 1569 150 150 ARG HA H 4.222 . 1 1570 150 150 ARG HB2 H 1.864 . 2 1571 150 150 ARG HB3 H 1.864 . 2 1572 150 150 ARG HD2 H 3.209 . 2 1573 150 150 ARG HD3 H 3.209 . 2 1574 150 150 ARG HG2 H 1.677 . 2 1575 150 150 ARG HG3 H 1.677 . 2 1576 150 150 ARG C C 176.449 . 1 1577 150 150 ARG CA C 57.223 . 1 1578 150 150 ARG CB C 30.290 . 1 1579 150 150 ARG CD C 43.364 . 1 1580 150 150 ARG CG C 27.287 . 1 1581 150 150 ARG N N 120.907 . 1 1582 151 151 ALA H H 8.122 . 1 1583 151 151 ALA HA H 4.259 . 1 1584 151 151 ALA HB H 1.406 . 1 1585 151 151 ALA C C 178.037 . 1 1586 151 151 ALA CA C 53.222 . 1 1587 151 151 ALA CB C 19.272 . 1 1588 151 151 ALA N N 123.326 . 1 1589 152 152 LEU H H 7.918 . 1 1590 152 152 LEU HA H 4.277 . 1 1591 152 152 LEU HB2 H 1.527 . 2 1592 152 152 LEU HB3 H 1.662 . 2 1593 152 152 LEU HD1 H 0.887 . 2 1594 152 152 LEU HD2 H 0.844 . 2 1595 152 152 LEU HG H 1.516 . 1 1596 152 152 LEU C C 177.376 . 1 1597 152 152 LEU CA C 55.490 . 1 1598 152 152 LEU CB C 42.290 . 1 1599 152 152 LEU CD1 C 25.222 . 1 1600 152 152 LEU CD2 C 23.603 . 1 1601 152 152 LEU CG C 26.774 . 1 1602 152 152 LEU N N 119.802 . 1 1603 153 153 LEU H H 7.917 . 1 1604 153 153 LEU HA H 4.231 . 1 1605 153 153 LEU HB2 H 1.310 . 2 1606 153 153 LEU HB3 H 1.530 . 2 1607 153 153 LEU HD1 H 0.817 . 2 1608 153 153 LEU HD2 H 0.817 . 2 1609 153 153 LEU HG H 0.816 . 1 1610 153 153 LEU C C 176.983 . 1 1611 153 153 LEU CA C 55.513 . 1 1612 153 153 LEU CB C 42.290 . 1 1613 153 153 LEU CD1 C 26.246 . 1 1614 153 153 LEU CD2 C 24.325 . 1 1615 153 153 LEU CG C 26.774 . 1 1616 153 153 LEU N N 120.483 . 1 1617 154 154 PHE H H 7.937 . 1 1618 154 154 PHE HA H 4.610 . 1 1619 154 154 PHE HB2 H 3.016 . 2 1620 154 154 PHE HB3 H 3.249 . 2 1621 154 154 PHE HD1 H 7.211 . 3 1622 154 154 PHE C C 176.353 . 1 1623 154 154 PHE CA C 57.759 . 1 1624 154 154 PHE CB C 39.525 . 1 1625 154 154 PHE CD1 C 131.980 . 3 1626 154 154 PHE N N 118.162 . 1 1627 155 155 GLY H H 8.245 . 1 1628 155 155 GLY HA2 H 3.967 . 2 1629 155 155 GLY HA3 H 4.800 . 2 1630 155 155 GLY C C 174.073 . 1 1631 155 155 GLY CA C 45.806 . 1 1632 155 155 GLY N N 109.155 . 1 1633 156 156 ARG H H 8.134 . 1 1634 156 156 ARG HA H 4.401 . 1 1635 156 156 ARG HB2 H 1.775 . 2 1636 156 156 ARG HB3 H 1.890 . 2 1637 156 156 ARG HD2 H 3.212 . 2 1638 156 156 ARG HD3 H 3.212 . 2 1639 156 156 ARG HG2 H 1.650 . 2 1640 156 156 ARG HG3 H 1.650 . 2 1641 156 156 ARG C C 176.414 . 1 1642 156 156 ARG CA C 55.953 . 1 1643 156 156 ARG CB C 30.790 . 1 1644 156 156 ARG CD C 43.408 . 1 1645 156 156 ARG CG C 27.074 . 1 1646 156 156 ARG N N 120.508 . 1 1647 157 157 ARG H H 8.514 . 1 1648 157 157 ARG HA H 4.412 . 1 1649 157 157 ARG HB2 H 1.803 . 2 1650 157 157 ARG HB3 H 1.917 . 2 1651 157 157 ARG HD2 H 3.200 . 2 1652 157 157 ARG HD3 H 3.200 . 2 1653 157 157 ARG HG2 H 1.672 . 2 1654 157 157 ARG HG3 H 1.672 . 2 1655 157 157 ARG C C 176.382 . 1 1656 157 157 ARG CA C 56.010 . 1 1657 157 157 ARG CB C 30.869 . 1 1658 157 157 ARG CD C 43.330 . 1 1659 157 157 ARG CG C 27.000 . 1 1660 157 157 ARG N N 122.600 . 1 1661 158 158 SER H H 8.446 . 1 1662 158 158 SER HA H 4.450 . 1 1663 158 158 SER HB2 H 3.889 . 2 1664 158 158 SER HB3 H 3.889 . 2 1665 158 158 SER C C 175.139 . 1 1666 158 158 SER CA C 58.774 . 1 1667 158 158 SER CB C 63.863 . 1 1668 158 158 SER N N 117.229 . 1 1669 159 159 GLY H H 8.519 . 1 1670 159 159 GLY HA2 H 3.970 . 2 1671 159 159 GLY HA3 H 4.800 . 2 1672 159 159 GLY C C 174.235 . 1 1673 159 159 GLY CA C 45.402 . 1 1674 159 159 GLY N N 111.180 . 1 1675 160 160 GLU H H 8.256 . 1 1676 160 160 GLU HA H 4.324 . 1 1677 160 160 GLU HB2 H 1.956 . 2 1678 160 160 GLU HB3 H 2.096 . 2 1679 160 160 GLU HG2 H 2.278 . 2 1680 160 160 GLU HG3 H 2.278 . 2 1681 160 160 GLU C C 176.334 . 1 1682 160 160 GLU CA C 56.772 . 1 1683 160 160 GLU CB C 30.275 . 1 1684 160 160 GLU CG C 36.311 . 1 1685 160 160 GLU N N 120.327 . 1 1686 161 161 ASN H H 8.490 . 1 1687 161 161 ASN HA H 4.744 . 1 1688 161 161 ASN HB2 H 2.763 . 2 1689 161 161 ASN HB3 H 2.885 . 2 1690 161 161 ASN HD21 H 7.630 . 2 1691 161 161 ASN HD22 H 6.930 . 2 1692 161 161 ASN C C 173.831 . 1 1693 161 161 ASN CA C 53.235 . 1 1694 161 161 ASN CB C 39.173 . 1 1695 161 161 ASN CG C 177.484 . 1 1696 161 161 ASN N N 119.662 . 1 1697 161 161 ASN ND2 N 113.300 . 1 1698 162 162 ALA H H 7.865 . 1 1699 162 162 ALA HA H 4.136 . 1 1700 162 162 ALA HB H 1.347 . 1 1701 162 162 ALA C C 182.582 . 1 1702 162 162 ALA CA C 53.920 . 1 1703 162 162 ALA CB C 20.247 . 1 1704 162 162 ALA N N 129.565 . 1 stop_ save_