data_15383 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C, and 15N Chemical Shift Assignments for the N-domain of Bacillus subtilis ClpC ; _BMRB_accession_number 15383 _BMRB_flat_file_name bmr15383.str _Entry_type original _Submission_date 2007-07-17 _Accession_date 2007-07-17 _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 Kojetin Douglas J. . 2 McLaughlin Patrick D. . 3 Thompson Richele J. . 4 Venters Ronald A. . 5 Rance Mark . . 6 Cavanagh John . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 813 "13C chemical shifts" 621 "15N chemical shifts" 169 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-08-12 update BMRB 'added PubMed ID' 2008-01-29 update BMRB 'complete entry citation' 2007-09-17 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'NMR assignment of the N-terminal repeat domain of Bacillus subtilis ClpC' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19636855 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kojetin Douglas J. . 2 McLaughlin Patrick D. . 3 Thompson Richele J. . 4 Venters Ronald A. . 5 Rance Mark . . 6 Cavanagh John . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume 1 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 163 _Page_last 165 _Year 2007 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'ClpC N-domain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'ClpC N-domain' $NClpCR 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_NClpCR _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common NClpCR _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 146 _Mol_residue_sequence ; HMMFGRFTERAQKVLALAQE EALRLGHNNIGTEHILLGLV REGEGIAAKALQALGLGSEK IQKEVESLIGRGQEMSQTIH YTPRAKKVIELSMDEARKLG HSYVGTEHILLGLIREGEGV AARVLNNLGVSLNKARQQVL QLLGSN ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -1 HIS 2 1 MET 3 2 MET 4 3 PHE 5 4 GLY 6 5 ARG 7 6 PHE 8 7 THR 9 8 GLU 10 9 ARG 11 10 ALA 12 11 GLN 13 12 LYS 14 13 VAL 15 14 LEU 16 15 ALA 17 16 LEU 18 17 ALA 19 18 GLN 20 19 GLU 21 20 GLU 22 21 ALA 23 22 LEU 24 23 ARG 25 24 LEU 26 25 GLY 27 26 HIS 28 27 ASN 29 28 ASN 30 29 ILE 31 30 GLY 32 31 THR 33 32 GLU 34 33 HIS 35 34 ILE 36 35 LEU 37 36 LEU 38 37 GLY 39 38 LEU 40 39 VAL 41 40 ARG 42 41 GLU 43 42 GLY 44 43 GLU 45 44 GLY 46 45 ILE 47 46 ALA 48 47 ALA 49 48 LYS 50 49 ALA 51 50 LEU 52 51 GLN 53 52 ALA 54 53 LEU 55 54 GLY 56 55 LEU 57 56 GLY 58 57 SER 59 58 GLU 60 59 LYS 61 60 ILE 62 61 GLN 63 62 LYS 64 63 GLU 65 64 VAL 66 65 GLU 67 66 SER 68 67 LEU 69 68 ILE 70 69 GLY 71 70 ARG 72 71 GLY 73 72 GLN 74 73 GLU 75 74 MET 76 75 SER 77 76 GLN 78 77 THR 79 78 ILE 80 79 HIS 81 80 TYR 82 81 THR 83 82 PRO 84 83 ARG 85 84 ALA 86 85 LYS 87 86 LYS 88 87 VAL 89 88 ILE 90 89 GLU 91 90 LEU 92 91 SER 93 92 MET 94 93 ASP 95 94 GLU 96 95 ALA 97 96 ARG 98 97 LYS 99 98 LEU 100 99 GLY 101 100 HIS 102 101 SER 103 102 TYR 104 103 VAL 105 104 GLY 106 105 THR 107 106 GLU 108 107 HIS 109 108 ILE 110 109 LEU 111 110 LEU 112 111 GLY 113 112 LEU 114 113 ILE 115 114 ARG 116 115 GLU 117 116 GLY 118 117 GLU 119 118 GLY 120 119 VAL 121 120 ALA 122 121 ALA 123 122 ARG 124 123 VAL 125 124 LEU 126 125 ASN 127 126 ASN 128 127 LEU 129 128 GLY 130 129 VAL 131 130 SER 132 131 LEU 133 132 ASN 134 133 LYS 135 134 ALA 136 135 ARG 137 136 GLN 138 137 GLN 139 138 VAL 140 139 LEU 141 140 GLN 142 141 LEU 143 142 LEU 144 143 GLY 145 144 SER 146 145 ASN stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-18 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 15910 N-ClpCR 100.00 146 100.00 100.00 1.77e-95 PDB 2K77 "Nmr Solution Structure Of The Bacillus Subtilis Clpc N- Domain" 100.00 146 100.00 100.00 1.77e-95 PDB 2Y1Q "Crystal Structure Of Clpc N-Terminal Domain" 99.32 150 98.62 99.31 2.55e-93 PDB 2Y1R "Structure Of Meca121 & Clpc N-Domain Complex" 99.32 149 100.00 100.00 2.09e-94 PDB 3PXG "Structure Of Meca121 And Clpc1-485 Complex" 99.32 468 100.00 100.00 5.15e-93 GB ALC83305 "Clp protease ClpX [Bacillus gobiensis]" 99.32 810 98.62 99.31 1.21e-87 REF WP_053605144 "ATP-dependent Clp protease ATP-binding subunit ClpC [Bacillus gobiensis]" 99.32 810 98.62 99.31 1.21e-87 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $NClpCR 'Bacillus subtilis' 1423 Bacteria . Bacillus subtilis 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 _Details $NClpCR 'recombinant technology' . Escherichia coli . pET-16b 'Factor Xa clevable N-terminal deca-His tag' 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 $NClpCR 0.75 mM '[U-13C; U-15N]' MES 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' EDTA 2 mM 'natural abundance' D2O 10 % 'natural abundance' H2O 90 % 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $NClpCR 0.75 mM [U-15N] MES 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' EDTA 2 mM 'natural abundance' D2O 10 % 'natural abundance' H2O 90 % 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $NClpCR 0.75 mM '[U-10% 13C]' MES 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' EDTA 2 mM 'natural abundance' D2O 10 % 'natural abundance' H2O 90 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'data analysis' 'peak picking' 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 Varian _Model INOVA _Field_strength 800 _Details 'cold probe' save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 500 _Details 'cold probe' 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_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_HN(CA)CB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CB' _Sample_label $sample_1 save_ save_3D_CB(CACO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CB(CACO)NH' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_1 save_ save_3D_HNHA_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $sample_2 save_ save_3D_HNHB_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHB' _Sample_label $sample_2 save_ save_4D_1H-13C-15N-1H_NOESY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '4D 1H-13C-15N-1H NOESY' _Sample_label $sample_1 save_ save_4D_1H-13C-13C-1H_NOESY_14 _Saveframe_category NMR_applied_experiment _Experiment_name '4D 1H-13C-13C-1H NOESY' _Sample_label $sample_1 save_ save_2D_1H-1H_NOESY_15 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_16 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_3 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' 50 . mM pH 5.5 . pH pressure 1 . atm temperature 305 . 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' '2D 1H-13C HSQC' '3D HNCO' '3D HNCA' '3D HN(CO)CA' '3D HN(CA)CB' '3D CB(CACO)NH' '3D HBHA(CO)NH' '3D 1H-15N NOESY' '3D 1H-13C NOESY' '3D HNHA' '3D HNHB' '4D 1H-13C-15N-1H NOESY' '4D 1H-13C-13C-1H NOESY' '2D 1H-1H NOESY' stop_ loop_ _Sample_label $sample_1 $sample_2 $sample_3 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'ClpC N-domain' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 2 MET H H 8.784 0.02 1 2 1 2 MET HE H 1.981 0.02 1 3 1 2 MET C C 175.633 0.2 1 4 1 2 MET CE C 16.965 0.2 1 5 1 2 MET N N 122.825 0.2 1 6 2 3 MET H H 8.604 0.02 1 7 2 3 MET HA H 4.429 0.02 1 8 2 3 MET HB2 H 1.936 0.02 2 9 2 3 MET HE H 1.997 0.02 1 10 2 3 MET HG2 H 2.377 0.02 2 11 2 3 MET HG3 H 2.449 0.02 2 12 2 3 MET C C 175.745 0.2 1 13 2 3 MET CA C 55.671 0.2 1 14 2 3 MET CB C 33.009 0.2 1 15 2 3 MET CE C 17.083 0.2 1 16 2 3 MET CG C 31.961 0.2 1 17 2 3 MET N N 122.365 0.2 1 18 3 4 PHE H H 8.192 0.02 1 19 3 4 PHE HA H 4.592 0.02 1 20 3 4 PHE HB2 H 3.070 0.02 2 21 3 4 PHE HB3 H 2.918 0.02 2 22 3 4 PHE HD1 H 7.037 0.02 3 23 3 4 PHE HE1 H 7.223 0.02 3 24 3 4 PHE C C 176.236 0.2 1 25 3 4 PHE CA C 57.799 0.2 1 26 3 4 PHE CB C 39.310 0.2 1 27 3 4 PHE N N 120.735 0.2 1 28 4 5 GLY H H 8.129 0.02 1 29 4 5 GLY HA2 H 3.875 0.02 2 30 4 5 GLY C C 173.773 0.2 1 31 4 5 GLY CA C 45.860 0.2 1 32 4 5 GLY N N 109.261 0.2 1 33 5 6 ARG H H 8.052 0.02 1 34 5 6 ARG HA H 4.484 0.02 1 35 5 6 ARG HB2 H 1.863 0.02 2 36 5 6 ARG HB3 H 1.711 0.02 2 37 5 6 ARG HD2 H 3.111 0.02 2 38 5 6 ARG HE H 7.023 0.02 1 39 5 6 ARG HG2 H 1.546 0.02 2 40 5 6 ARG HG3 H 1.609 0.02 2 41 5 6 ARG C C 175.601 0.2 1 42 5 6 ARG CA C 55.551 0.2 1 43 5 6 ARG CB C 30.218 0.2 1 44 5 6 ARG CD C 43.268 0.2 1 45 5 6 ARG CG C 27.091 0.2 1 46 5 6 ARG N N 118.800 0.2 1 47 5 6 ARG NE N 84.636 0.2 1 48 6 7 PHE H H 8.432 0.02 1 49 6 7 PHE HA H 5.473 0.02 1 50 6 7 PHE HB2 H 3.282 0.02 2 51 6 7 PHE HB3 H 3.141 0.02 2 52 6 7 PHE HD1 H 7.215 0.02 3 53 6 7 PHE HE1 H 7.126 0.02 3 54 6 7 PHE C C 177.738 0.2 1 55 6 7 PHE CA C 57.031 0.2 1 56 6 7 PHE CB C 40.437 0.2 1 57 6 7 PHE N N 122.625 0.2 1 58 7 8 THR H H 9.115 0.02 1 59 7 8 THR HA H 4.457 0.02 1 60 7 8 THR HB H 5.018 0.02 1 61 7 8 THR HG1 H 5.547 0.02 1 62 7 8 THR HG2 H 1.458 0.02 1 63 7 8 THR C C 175.139 0.2 1 64 7 8 THR CA C 61.268 0.2 1 65 7 8 THR CB C 71.196 0.2 1 66 7 8 THR CG2 C 22.891 0.2 1 67 7 8 THR N N 114.062 0.2 1 68 8 9 GLU H H 9.221 0.02 1 69 8 9 GLU HA H 4.078 0.02 1 70 8 9 GLU HB2 H 2.133 0.02 2 71 8 9 GLU HB3 H 2.195 0.02 2 72 8 9 GLU HG2 H 2.357 0.02 2 73 8 9 GLU HG3 H 2.458 0.02 2 74 8 9 GLU C C 179.959 0.2 1 75 8 9 GLU CA C 60.423 0.2 1 76 8 9 GLU CB C 29.268 0.2 1 77 8 9 GLU CG C 36.553 0.2 1 78 8 9 GLU N N 121.730 0.2 1 79 9 10 ARG H H 8.545 0.02 1 80 9 10 ARG HA H 4.166 0.02 1 81 9 10 ARG HB2 H 2.051 0.02 2 82 9 10 ARG HB3 H 1.851 0.02 2 83 9 10 ARG HD2 H 3.267 0.02 2 84 9 10 ARG HD3 H 3.395 0.02 2 85 9 10 ARG HE H 7.709 0.02 1 86 9 10 ARG HG2 H 1.687 0.02 2 87 9 10 ARG HG3 H 1.969 0.02 2 88 9 10 ARG C C 178.306 0.2 1 89 9 10 ARG CA C 59.309 0.2 1 90 9 10 ARG CB C 29.642 0.2 1 91 9 10 ARG CD C 42.556 0.2 1 92 9 10 ARG CG C 27.865 0.2 1 93 9 10 ARG N N 118.166 0.2 1 94 9 10 ARG NE N 83.640 0.2 1 95 10 11 ALA H H 8.023 0.02 1 96 10 11 ALA HA H 3.900 0.02 1 97 10 11 ALA HB H 1.652 0.02 1 98 10 11 ALA C C 179.238 0.2 1 99 10 11 ALA CA C 55.825 0.2 1 100 10 11 ALA CB C 19.187 0.2 1 101 10 11 ALA N N 122.406 0.2 1 102 11 12 GLN H H 8.601 0.02 1 103 11 12 GLN HA H 3.910 0.02 1 104 11 12 GLN HB2 H 2.287 0.02 2 105 11 12 GLN HB3 H 2.199 0.02 2 106 11 12 GLN HE21 H 7.124 0.02 1 107 11 12 GLN HE22 H 6.926 0.02 1 108 11 12 GLN HG2 H 2.284 0.02 2 109 11 12 GLN HG3 H 2.629 0.02 2 110 11 12 GLN C C 179.511 0.2 1 111 11 12 GLN CA C 59.629 0.2 1 112 11 12 GLN CB C 28.300 0.2 1 113 11 12 GLN CG C 34.734 0.2 1 114 11 12 GLN N N 116.426 0.2 1 115 11 12 GLN NE2 N 111.561 0.2 1 116 12 13 LYS H H 8.062 0.02 1 117 12 13 LYS HA H 4.236 0.02 1 118 12 13 LYS HB2 H 2.285 0.02 2 119 12 13 LYS HB3 H 2.050 0.02 2 120 12 13 LYS HD2 H 1.857 0.02 2 121 12 13 LYS HE2 H 3.057 0.02 2 122 12 13 LYS HG2 H 1.598 0.02 2 123 12 13 LYS C C 178.434 0.2 1 124 12 13 LYS CA C 58.906 0.2 1 125 12 13 LYS CB C 31.538 0.2 1 126 12 13 LYS CD C 29.344 0.2 1 127 12 13 LYS CE C 42.477 0.2 1 128 12 13 LYS CG C 25.022 0.2 1 129 12 13 LYS N N 122.168 0.2 1 130 13 14 VAL H H 7.976 0.02 1 131 13 14 VAL HA H 3.418 0.02 1 132 13 14 VAL HB H 2.567 0.02 1 133 13 14 VAL HG1 H 1.262 0.02 1 134 13 14 VAL HG2 H 0.890 0.02 1 135 13 14 VAL C C 177.472 0.2 1 136 13 14 VAL CA C 67.388 0.2 1 137 13 14 VAL CB C 30.674 0.2 1 138 13 14 VAL CG1 C 24.196 0.2 1 139 13 14 VAL CG2 C 20.875 0.2 1 140 13 14 VAL N N 119.521 0.2 1 141 14 15 LEU H H 7.504 0.02 1 142 14 15 LEU HA H 4.123 0.02 1 143 14 15 LEU HB2 H 1.615 0.02 2 144 14 15 LEU HB3 H 1.876 0.02 2 145 14 15 LEU HD1 H 0.511 0.02 1 146 14 15 LEU HD2 H 0.799 0.02 1 147 14 15 LEU HG H 1.850 0.02 1 148 14 15 LEU C C 179.854 0.2 1 149 14 15 LEU CA C 57.720 0.2 1 150 14 15 LEU CB C 39.713 0.2 1 151 14 15 LEU CD1 C 24.769 0.2 1 152 14 15 LEU CD2 C 21.210 0.2 1 153 14 15 LEU CG C 26.725 0.2 1 154 14 15 LEU N N 117.908 0.2 1 155 15 16 ALA H H 8.128 0.02 1 156 15 16 ALA HA H 4.262 0.02 1 157 15 16 ALA HB H 1.613 0.02 1 158 15 16 ALA C C 181.657 0.2 1 159 15 16 ALA CA C 55.428 0.2 1 160 15 16 ALA CB C 17.989 0.2 1 161 15 16 ALA N N 125.312 0.2 1 162 16 17 LEU H H 9.049 0.02 1 163 16 17 LEU HA H 4.127 0.02 1 164 16 17 LEU HB2 H 2.195 0.02 2 165 16 17 LEU HB3 H 1.303 0.02 2 166 16 17 LEU HD1 H 0.863 0.02 2 167 16 17 LEU HD2 H 0.873 0.02 2 168 16 17 LEU HG H 1.940 0.02 1 169 16 17 LEU C C 179.195 0.2 1 170 16 17 LEU CA C 57.552 0.2 1 171 16 17 LEU CB C 42.319 0.2 1 172 16 17 LEU CD1 C 25.793 0.2 2 173 16 17 LEU CD2 C 22.415 0.2 2 174 16 17 LEU CG C 26.725 0.2 1 175 16 17 LEU N N 121.282 0.2 1 176 17 18 ALA H H 8.709 0.02 1 177 17 18 ALA HA H 4.087 0.02 1 178 17 18 ALA HB H 1.494 0.02 1 179 17 18 ALA C C 179.175 0.2 1 180 17 18 ALA CA C 55.032 0.2 1 181 17 18 ALA CB C 18.409 0.2 1 182 17 18 ALA N N 122.850 0.2 1 183 18 19 GLN H H 7.361 0.02 1 184 18 19 GLN HA H 3.788 0.02 1 185 18 19 GLN HB2 H 2.335 0.02 2 186 18 19 GLN HB3 H 2.199 0.02 2 187 18 19 GLN HE21 H 7.253 0.02 1 188 18 19 GLN HE22 H 6.850 0.02 1 189 18 19 GLN HG2 H 2.276 0.02 2 190 18 19 GLN C C 177.305 0.2 1 191 18 19 GLN CA C 59.352 0.2 1 192 18 19 GLN CB C 28.102 0.2 1 193 18 19 GLN CG C 34.121 0.2 1 194 18 19 GLN N N 116.354 0.2 1 195 18 19 GLN NE2 N 110.943 0.2 1 196 19 20 GLU H H 7.721 0.02 1 197 19 20 GLU HA H 3.998 0.02 1 198 19 20 GLU HB2 H 2.278 0.02 2 199 19 20 GLU HG2 H 2.284 0.02 2 200 19 20 GLU HG3 H 2.527 0.02 2 201 19 20 GLU C C 179.800 0.2 1 202 19 20 GLU CA C 59.616 0.2 1 203 19 20 GLU CB C 29.558 0.2 1 204 19 20 GLU CG C 36.277 0.2 1 205 19 20 GLU N N 118.891 0.2 1 206 20 21 GLU H H 8.767 0.02 1 207 20 21 GLU HA H 4.217 0.02 1 208 20 21 GLU HB2 H 2.343 0.02 2 209 20 21 GLU HB3 H 2.231 0.02 2 210 20 21 GLU HG2 H 2.109 0.02 2 211 20 21 GLU HG3 H 2.533 0.02 2 212 20 21 GLU C C 177.909 0.2 1 213 20 21 GLU CA C 58.550 0.2 1 214 20 21 GLU CB C 29.879 0.2 1 215 20 21 GLU CG C 36.399 0.2 1 216 20 21 GLU N N 120.180 0.2 1 217 21 22 ALA H H 7.872 0.02 1 218 21 22 ALA HA H 3.533 0.02 1 219 21 22 ALA HB H 0.823 0.02 1 220 21 22 ALA C C 179.446 0.2 1 221 21 22 ALA CA C 56.062 0.2 1 222 21 22 ALA CB C 16.672 0.2 1 223 21 22 ALA N N 122.119 0.2 1 224 22 23 LEU H H 7.857 0.02 1 225 22 23 LEU HA H 4.104 0.02 1 226 22 23 LEU HB2 H 1.572 0.02 2 227 22 23 LEU HB3 H 1.816 0.02 2 228 22 23 LEU HD1 H 0.897 0.02 1 229 22 23 LEU HD2 H 0.883 0.02 1 230 22 23 LEU HG H 1.737 0.02 1 231 22 23 LEU C C 181.182 0.2 1 232 22 23 LEU CA C 57.906 0.2 1 233 22 23 LEU CB C 41.661 0.2 1 234 22 23 LEU CD1 C 25.145 0.2 1 235 22 23 LEU CD2 C 23.718 0.2 1 236 22 23 LEU CG C 27.135 0.2 1 237 22 23 LEU N N 117.391 0.2 1 238 23 24 ARG H H 8.354 0.02 1 239 23 24 ARG HA H 4.006 0.02 1 240 23 24 ARG HB2 H 2.125 0.02 2 241 23 24 ARG HB3 H 1.915 0.02 2 242 23 24 ARG HD2 H 3.132 0.02 2 243 23 24 ARG HD3 H 3.393 0.02 2 244 23 24 ARG HE H 7.863 0.02 1 245 23 24 ARG HG2 H 1.656 0.02 2 246 23 24 ARG HG3 H 1.561 0.02 2 247 23 24 ARG C C 178.271 0.2 1 248 23 24 ARG CA C 59.339 0.2 1 249 23 24 ARG CB C 30.353 0.2 1 250 23 24 ARG CD C 43.149 0.2 1 251 23 24 ARG CG C 27.412 0.2 1 252 23 24 ARG N N 121.980 0.2 1 253 23 24 ARG NE N 82.448 0.2 1 254 24 25 LEU H H 7.625 0.02 1 255 24 25 LEU HA H 4.214 0.02 1 256 24 25 LEU HB2 H 1.416 0.02 2 257 24 25 LEU HB3 H 1.716 0.02 2 258 24 25 LEU HD1 H 0.875 0.02 2 259 24 25 LEU HD2 H 0.969 0.02 2 260 24 25 LEU HG H 1.755 0.02 1 261 24 25 LEU C C 175.849 0.2 1 262 24 25 LEU CA C 54.759 0.2 1 263 24 25 LEU CB C 42.550 0.2 1 264 24 25 LEU CD1 C 22.652 0.2 2 265 24 25 LEU CD2 C 25.970 0.2 2 266 24 25 LEU CG C 27.154 0.2 1 267 24 25 LEU N N 117.480 0.2 1 268 25 26 GLY H H 7.757 0.02 1 269 25 26 GLY HA2 H 3.787 0.02 2 270 25 26 GLY HA3 H 3.895 0.02 2 271 25 26 GLY C C 174.324 0.2 1 272 25 26 GLY CA C 46.274 0.2 1 273 25 26 GLY N N 107.631 0.2 1 274 26 27 HIS H H 8.417 0.02 1 275 26 27 HIS HA H 4.926 0.02 1 276 26 27 HIS HB2 H 2.958 0.02 2 277 26 27 HIS HB3 H 3.341 0.02 2 278 26 27 HIS HD2 H 7.042 0.02 1 279 26 27 HIS HE1 H 7.734 0.02 1 280 26 27 HIS C C 174.493 0.2 1 281 26 27 HIS CA C 54.996 0.2 1 282 26 27 HIS CB C 33.066 0.2 1 283 26 27 HIS CD2 C 115.840 0.2 1 284 26 27 HIS CE1 C 139.166 0.2 1 285 26 27 HIS N N 119.517 0.2 1 286 27 28 ASN H H 8.507 0.02 1 287 27 28 ASN HA H 4.667 0.02 1 288 27 28 ASN HB2 H 2.764 0.02 2 289 27 28 ASN HB3 H 2.913 0.02 2 290 27 28 ASN HD21 H 7.484 0.02 1 291 27 28 ASN HD22 H 6.844 0.02 1 292 27 28 ASN C C 173.854 0.2 1 293 27 28 ASN CA C 52.896 0.2 1 294 27 28 ASN CB C 39.002 0.2 1 295 27 28 ASN N N 116.636 0.2 1 296 27 28 ASN ND2 N 111.533 0.2 1 297 28 29 ASN H H 7.721 0.02 1 298 28 29 ASN HA H 5.042 0.02 1 299 28 29 ASN HB2 H 2.466 0.02 2 300 28 29 ASN HB3 H 2.561 0.02 2 301 28 29 ASN HD21 H 7.425 0.02 1 302 28 29 ASN HD22 H 6.907 0.02 1 303 28 29 ASN C C 173.102 0.2 1 304 28 29 ASN CA C 51.560 0.2 1 305 28 29 ASN CB C 41.371 0.2 1 306 28 29 ASN N N 115.792 0.2 1 307 28 29 ASN ND2 N 113.443 0.2 1 308 29 30 ILE H H 8.509 0.02 1 309 29 30 ILE HA H 4.007 0.02 1 310 29 30 ILE HB H 1.399 0.02 1 311 29 30 ILE HD1 H 0.404 0.02 1 312 29 30 ILE HG12 H 1.209 0.02 2 313 29 30 ILE HG13 H 0.534 0.02 2 314 29 30 ILE HG2 H 0.808 0.02 1 315 29 30 ILE C C 175.247 0.2 1 316 29 30 ILE CA C 61.329 0.2 1 317 29 30 ILE CB C 38.173 0.2 1 318 29 30 ILE CD1 C 13.885 0.2 1 319 29 30 ILE CG1 C 27.747 0.2 1 320 29 30 ILE CG2 C 18.428 0.2 1 321 29 30 ILE N N 121.087 0.2 1 322 30 31 GLY H H 11.966 0.02 1 323 30 31 GLY HA2 H 5.202 0.02 2 324 30 31 GLY HA3 H 4.033 0.02 2 325 30 31 GLY CA C 43.741 0.2 1 326 30 31 GLY N N 120.116 0.2 1 327 31 32 THR H H 8.373 0.02 1 328 31 32 THR HA H 3.702 0.02 1 329 31 32 THR HB H 4.293 0.02 1 330 31 32 THR HG1 H 5.572 0.02 1 331 31 32 THR HG2 H 1.347 0.02 1 332 31 32 THR C C 176.998 0.2 1 333 31 32 THR CA C 66.835 0.2 1 334 31 32 THR CB C 67.220 0.2 1 335 31 32 THR CG2 C 22.344 0.2 1 336 31 32 THR N N 111.281 0.2 1 337 32 33 GLU H H 11.651 0.02 1 338 32 33 GLU HA H 3.773 0.02 1 339 32 33 GLU HB2 H 1.503 0.02 2 340 32 33 GLU HB3 H 1.845 0.02 2 341 32 33 GLU HG2 H 1.862 0.02 2 342 32 33 GLU HG3 H 1.278 0.02 2 343 32 33 GLU C C 176.405 0.2 1 344 32 33 GLU CA C 58.431 0.2 1 345 32 33 GLU CB C 27.628 0.2 1 346 32 33 GLU CG C 32.841 0.2 1 347 32 33 GLU N N 123.205 0.2 1 348 33 34 HIS H H 7.033 0.02 1 349 33 34 HIS HA H 4.258 0.02 1 350 33 34 HIS HB2 H 3.892 0.02 2 351 33 34 HIS HB3 H 3.276 0.02 2 352 33 34 HIS HD2 H 6.576 0.02 1 353 33 34 HIS HE1 H 7.821 0.02 1 354 33 34 HIS C C 178.017 0.2 1 355 33 34 HIS CA C 60.800 0.2 1 356 33 34 HIS CB C 30.827 0.2 1 357 33 34 HIS CD2 C 112.280 0.2 1 358 33 34 HIS CE1 C 136.589 0.2 1 359 33 34 HIS N N 121.357 0.2 1 360 34 35 ILE H H 7.555 0.02 1 361 34 35 ILE HA H 3.651 0.02 1 362 34 35 ILE HB H 2.027 0.02 1 363 34 35 ILE HD1 H 0.819 0.02 1 364 34 35 ILE HG12 H 1.941 0.02 2 365 34 35 ILE HG13 H 0.814 0.02 2 366 34 35 ILE HG2 H 0.776 0.02 1 367 34 35 ILE C C 177.004 0.2 1 368 34 35 ILE CA C 65.896 0.2 1 369 34 35 ILE CB C 37.092 0.2 1 370 34 35 ILE CD1 C 13.174 0.2 1 371 34 35 ILE CG1 C 28.813 0.2 1 372 34 35 ILE CG2 C 18.031 0.2 1 373 34 35 ILE N N 119.144 0.2 1 374 35 36 LEU H H 7.973 0.02 1 375 35 36 LEU HA H 4.018 0.02 1 376 35 36 LEU HB2 H 2.028 0.02 2 377 35 36 LEU HB3 H 1.429 0.02 2 378 35 36 LEU HD1 H 0.894 0.02 1 379 35 36 LEU HD2 H 0.803 0.02 1 380 35 36 LEU HG H 1.445 0.02 1 381 35 36 LEU C C 177.302 0.2 1 382 35 36 LEU CA C 58.356 0.2 1 383 35 36 LEU CB C 41.016 0.2 1 384 35 36 LEU CD1 C 22.415 0.2 1 385 35 36 LEU CD2 C 26.680 0.2 1 386 35 36 LEU CG C 27.121 0.2 1 387 35 36 LEU N N 119.301 0.2 1 388 36 37 LEU H H 7.913 0.02 1 389 36 37 LEU HA H 4.017 0.02 1 390 36 37 LEU HB2 H 1.701 0.02 2 391 36 37 LEU HB3 H 1.970 0.02 2 392 36 37 LEU HD1 H 0.875 0.02 2 393 36 37 LEU HD2 H 0.926 0.02 2 394 36 37 LEU HG H 1.947 0.02 1 395 36 37 LEU C C 179.598 0.2 1 396 36 37 LEU CA C 58.081 0.2 1 397 36 37 LEU CB C 41.266 0.2 1 398 36 37 LEU CD1 C 22.652 0.2 2 399 36 37 LEU CD2 C 25.614 0.2 2 400 36 37 LEU CG C 26.680 0.2 1 401 36 37 LEU N N 116.713 0.2 1 402 37 38 GLY H H 8.628 0.02 1 403 37 38 GLY HA2 H 3.724 0.02 2 404 37 38 GLY HA3 H 3.670 0.02 2 405 37 38 GLY C C 174.409 0.2 1 406 37 38 GLY CA C 47.630 0.2 1 407 37 38 GLY N N 107.733 0.2 1 408 38 39 LEU H H 8.381 0.02 1 409 38 39 LEU HA H 4.115 0.02 1 410 38 39 LEU HB2 H 1.610 0.02 2 411 38 39 LEU HB3 H 2.043 0.02 2 412 38 39 LEU HD1 H 0.865 0.02 1 413 38 39 LEU HD2 H 0.856 0.02 1 414 38 39 LEU HG H 1.793 0.02 1 415 38 39 LEU C C 179.404 0.2 1 416 38 39 LEU CA C 58.076 0.2 1 417 38 39 LEU CB C 43.124 0.2 1 418 38 39 LEU CD1 C 27.036 0.2 1 419 38 39 LEU CD2 C 25.615 0.2 1 420 38 39 LEU CG C 25.925 0.2 1 421 38 39 LEU N N 121.377 0.2 1 422 39 40 VAL H H 7.613 0.02 1 423 39 40 VAL HA H 3.934 0.02 1 424 39 40 VAL HB H 2.183 0.02 1 425 39 40 VAL HG1 H 0.990 0.02 1 426 39 40 VAL HG2 H 1.053 0.02 1 427 39 40 VAL C C 177.927 0.2 1 428 39 40 VAL CA C 64.469 0.2 1 429 39 40 VAL CB C 31.668 0.2 1 430 39 40 VAL CG1 C 21.941 0.2 1 431 39 40 VAL CG2 C 21.337 0.2 1 432 39 40 VAL N N 113.190 0.2 1 433 40 41 ARG H H 8.143 0.02 1 434 40 41 ARG HA H 4.079 0.02 1 435 40 41 ARG HB2 H 1.959 0.02 2 436 40 41 ARG HD2 H 3.021 0.02 2 437 40 41 ARG HD3 H 3.272 0.02 2 438 40 41 ARG HE H 7.451 0.02 1 439 40 41 ARG HG2 H 1.920 0.02 2 440 40 41 ARG HG3 H 1.683 0.02 2 441 40 41 ARG C C 177.656 0.2 1 442 40 41 ARG CA C 58.076 0.2 1 443 40 41 ARG CB C 30.472 0.2 1 444 40 41 ARG CD C 43.504 0.2 1 445 40 41 ARG CG C 27.628 0.2 1 446 40 41 ARG N N 120.925 0.2 1 447 40 41 ARG NE N 84.677 0.2 1 448 41 42 GLU H H 7.923 0.02 1 449 41 42 GLU HA H 3.967 0.02 1 450 41 42 GLU HB2 H 2.391 0.02 2 451 41 42 GLU HB3 H 1.922 0.02 2 452 41 42 GLU HG2 H 2.481 0.02 2 453 41 42 GLU HG3 H 2.221 0.02 2 454 41 42 GLU C C 179.346 0.2 1 455 41 42 GLU CA C 59.616 0.2 1 456 41 42 GLU CB C 29.050 0.2 1 457 41 42 GLU CG C 36.102 0.2 1 458 41 42 GLU N N 121.833 0.2 1 459 42 43 GLY H H 6.968 0.02 1 460 42 43 GLY HA2 H 3.687 0.02 2 461 42 43 GLY HA3 H 4.015 0.02 2 462 42 43 GLY C C 174.139 0.2 1 463 42 43 GLY CA C 47.970 0.2 1 464 42 43 GLY N N 102.716 0.2 1 465 43 44 GLU H H 8.157 0.02 1 466 43 44 GLU HA H 4.541 0.02 1 467 43 44 GLU HB2 H 2.139 0.02 2 468 43 44 GLU HB3 H 2.039 0.02 2 469 43 44 GLU HG2 H 2.407 0.02 2 470 43 44 GLU HG3 H 2.266 0.02 2 471 43 44 GLU C C 177.220 0.2 1 472 43 44 GLU CA C 56.654 0.2 1 473 43 44 GLU CB C 32.367 0.2 1 474 43 44 GLU CG C 36.514 0.2 1 475 43 44 GLU N N 120.657 0.2 1 476 44 45 GLY H H 10.065 0.02 1 477 44 45 GLY HA2 H 3.869 0.02 2 478 44 45 GLY HA3 H 4.138 0.02 2 479 44 45 GLY C C 172.703 0.2 1 480 44 45 GLY CA C 44.484 0.2 1 481 44 45 GLY N N 110.513 0.2 1 482 45 46 ILE H H 8.203 0.02 1 483 45 46 ILE HA H 3.618 0.02 1 484 45 46 ILE HB H 1.927 0.02 1 485 45 46 ILE HD1 H 0.802 0.02 1 486 45 46 ILE HG12 H 1.588 0.02 2 487 45 46 ILE HG2 H 0.861 0.02 1 488 45 46 ILE C C 176.478 0.2 1 489 45 46 ILE CA C 62.933 0.2 1 490 45 46 ILE CB C 35.803 0.2 1 491 45 46 ILE CD1 C 10.362 0.2 1 492 45 46 ILE CG1 C 28.102 0.2 1 493 45 46 ILE CG2 C 18.505 0.2 1 494 45 46 ILE N N 117.938 0.2 1 495 46 47 ALA H H 7.933 0.02 1 496 46 47 ALA HA H 3.765 0.02 1 497 46 47 ALA HB H 1.396 0.02 1 498 46 47 ALA C C 178.182 0.2 1 499 46 47 ALA CA C 55.470 0.2 1 500 46 47 ALA CB C 20.461 0.2 1 501 46 47 ALA N N 118.905 0.2 1 502 47 48 ALA H H 7.501 0.02 1 503 47 48 ALA HA H 3.898 0.02 1 504 47 48 ALA HB H 1.521 0.02 1 505 47 48 ALA C C 180.821 0.2 1 506 47 48 ALA CA C 55.519 0.2 1 507 47 48 ALA CB C 17.835 0.2 1 508 47 48 ALA N N 119.394 0.2 1 509 48 49 LYS H H 8.032 0.02 1 510 48 49 LYS HA H 4.001 0.02 1 511 48 49 LYS HB2 H 1.895 0.02 2 512 48 49 LYS HB3 H 1.823 0.02 2 513 48 49 LYS HD2 H 1.861 0.02 2 514 48 49 LYS HE2 H 3.034 0.02 2 515 48 49 LYS HG2 H 1.460 0.02 2 516 48 49 LYS HG3 H 1.565 0.02 2 517 48 49 LYS C C 179.577 0.2 1 518 48 49 LYS CA C 58.959 0.2 1 519 48 49 LYS CB C 32.486 0.2 1 520 48 49 LYS CD C 29.587 0.2 1 521 48 49 LYS CE C 42.201 0.2 1 522 48 49 LYS CG C 25.257 0.2 1 523 48 49 LYS N N 117.337 0.2 1 524 49 50 ALA H H 8.998 0.02 1 525 49 50 ALA HA H 3.912 0.02 1 526 49 50 ALA HB H 1.276 0.02 1 527 49 50 ALA C C 178.701 0.2 1 528 49 50 ALA CA C 55.233 0.2 1 529 49 50 ALA CB C 17.499 0.2 1 530 49 50 ALA N N 124.658 0.2 1 531 50 51 LEU H H 7.951 0.02 1 532 50 51 LEU HA H 3.943 0.02 1 533 50 51 LEU HB2 H 1.437 0.02 2 534 50 51 LEU HB3 H 1.966 0.02 2 535 50 51 LEU HD1 H 0.679 0.02 1 536 50 51 LEU HD2 H 0.736 0.02 1 537 50 51 LEU HG H 1.857 0.02 1 538 50 51 LEU C C 179.065 0.2 1 539 50 51 LEU CA C 58.194 0.2 1 540 50 51 LEU CB C 40.542 0.2 1 541 50 51 LEU CD1 C 25.495 0.2 1 542 50 51 LEU CD2 C 22.652 0.2 1 543 50 51 LEU CG C 26.621 0.2 1 544 50 51 LEU N N 116.368 0.2 1 545 51 52 GLN H H 8.071 0.02 1 546 51 52 GLN HA H 4.027 0.02 1 547 51 52 GLN HB2 H 2.158 0.02 2 548 51 52 GLN HE21 H 7.359 0.02 1 549 51 52 GLN HE22 H 6.792 0.02 1 550 51 52 GLN HG2 H 2.546 0.02 2 551 51 52 GLN HG3 H 2.431 0.02 2 552 51 52 GLN C C 180.680 0.2 1 553 51 52 GLN CA C 59.143 0.2 1 554 51 52 GLN CB C 28.256 0.2 1 555 51 52 GLN CG C 34.028 0.2 1 556 51 52 GLN N N 118.975 0.2 1 557 51 52 GLN NE2 N 110.882 0.2 1 558 52 53 ALA H H 8.265 0.02 1 559 52 53 ALA HA H 4.187 0.02 1 560 52 53 ALA HB H 1.514 0.02 1 561 52 53 ALA C C 179.444 0.2 1 562 52 53 ALA CA C 54.829 0.2 1 563 52 53 ALA CB C 18.077 0.2 1 564 52 53 ALA N N 124.515 0.2 1 565 53 54 LEU H H 7.485 0.02 1 566 53 54 LEU HA H 4.342 0.02 1 567 53 54 LEU HB2 H 1.721 0.02 2 568 53 54 LEU HB3 H 1.928 0.02 2 569 53 54 LEU HD1 H 0.789 0.02 1 570 53 54 LEU HD2 H 0.944 0.02 1 571 53 54 LEU HG H 1.945 0.02 1 572 53 54 LEU C C 176.440 0.2 1 573 53 54 LEU CA C 54.878 0.2 1 574 53 54 LEU CB C 41.964 0.2 1 575 53 54 LEU CD1 C 25.732 0.2 1 576 53 54 LEU CD2 C 23.010 0.2 1 577 53 54 LEU CG C 26.680 0.2 1 578 53 54 LEU N N 117.018 0.2 1 579 54 55 GLY H H 7.981 0.02 1 580 54 55 GLY HA2 H 3.806 0.02 2 581 54 55 GLY HA3 H 4.223 0.02 2 582 54 55 GLY C C 174.445 0.2 1 583 54 55 GLY CA C 45.391 0.2 1 584 54 55 GLY N N 107.344 0.2 1 585 55 56 LEU H H 8.069 0.02 1 586 55 56 LEU HA H 4.554 0.02 1 587 55 56 LEU HB2 H 1.131 0.02 2 588 55 56 LEU HB3 H 1.783 0.02 2 589 55 56 LEU HD1 H 0.818 0.02 1 590 55 56 LEU HD2 H 0.861 0.02 1 591 55 56 LEU HG H 1.536 0.02 1 592 55 56 LEU C C 174.537 0.2 1 593 55 56 LEU CA C 53.519 0.2 1 594 55 56 LEU CB C 42.438 0.2 1 595 55 56 LEU CD1 C 26.207 0.2 1 596 55 56 LEU CD2 C 24.984 0.2 1 597 55 56 LEU CG C 27.109 0.2 1 598 55 56 LEU N N 121.996 0.2 1 599 56 57 GLY H H 7.641 0.02 1 600 56 57 GLY HA2 H 3.924 0.02 2 601 56 57 GLY HA3 H 4.276 0.02 2 602 56 57 GLY C C 174.295 0.2 1 603 56 57 GLY CA C 44.169 0.2 1 604 56 57 GLY N N 107.895 0.2 1 605 57 58 SER H H 8.664 0.02 1 606 57 58 SER HA H 3.845 0.02 1 607 57 58 SER HB2 H 3.869 0.02 2 608 57 58 SER C C 176.188 0.2 1 609 57 58 SER CA C 62.388 0.2 1 610 57 58 SER CB C 62.511 0.2 1 611 57 58 SER N N 116.390 0.2 1 612 58 59 GLU H H 8.767 0.02 1 613 58 59 GLU HA H 4.108 0.02 1 614 58 59 GLU HB2 H 2.074 0.02 2 615 58 59 GLU HB3 H 2.041 0.02 2 616 58 59 GLU HG2 H 2.363 0.02 2 617 58 59 GLU HG3 H 2.297 0.02 2 618 58 59 GLU C C 177.349 0.2 1 619 58 59 GLU CA C 59.763 0.2 1 620 58 59 GLU CB C 28.801 0.2 1 621 58 59 GLU CG C 36.514 0.2 1 622 58 59 GLU N N 120.991 0.2 1 623 59 60 LYS H H 7.692 0.02 1 624 59 60 LYS HA H 4.111 0.02 1 625 59 60 LYS HB2 H 1.937 0.02 2 626 59 60 LYS HD2 H 1.923 0.02 2 627 59 60 LYS HE2 H 3.024 0.02 2 628 59 60 LYS HG2 H 1.531 0.02 2 629 59 60 LYS C C 178.910 0.2 1 630 59 60 LYS CA C 58.972 0.2 1 631 59 60 LYS CB C 32.705 0.2 1 632 59 60 LYS CD C 29.525 0.2 1 633 59 60 LYS CE C 42.281 0.2 1 634 59 60 LYS CG C 25.146 0.2 1 635 59 60 LYS N N 119.855 0.2 1 636 60 61 ILE H H 7.664 0.02 1 637 60 61 ILE HA H 3.489 0.02 1 638 60 61 ILE HB H 1.876 0.02 1 639 60 61 ILE HD1 H 0.734 0.02 1 640 60 61 ILE HG12 H 0.868 0.02 2 641 60 61 ILE HG13 H 1.679 0.02 2 642 60 61 ILE HG2 H 0.758 0.02 1 643 60 61 ILE C C 177.167 0.2 1 644 60 61 ILE CA C 65.184 0.2 1 645 60 61 ILE CB C 37.394 0.2 1 646 60 61 ILE CD1 C 13.529 0.2 1 647 60 61 ILE CG1 C 29.287 0.2 1 648 60 61 ILE CG2 C 17.439 0.2 1 649 60 61 ILE N N 117.324 0.2 1 650 61 62 GLN H H 8.649 0.02 1 651 61 62 GLN HA H 3.706 0.02 1 652 61 62 GLN HB2 H 2.205 0.02 2 653 61 62 GLN HB3 H 2.083 0.02 2 654 61 62 GLN HE21 H 7.799 0.02 1 655 61 62 GLN HE22 H 6.727 0.02 1 656 61 62 GLN HG2 H 2.355 0.02 2 657 61 62 GLN HG3 H 2.300 0.02 2 658 61 62 GLN C C 177.887 0.2 1 659 61 62 GLN CA C 60.121 0.2 1 660 61 62 GLN CB C 28.018 0.2 1 661 61 62 GLN CG C 33.552 0.2 1 662 61 62 GLN N N 118.894 0.2 1 663 61 62 GLN NE2 N 111.116 0.2 1 664 62 63 LYS H H 8.061 0.02 1 665 62 63 LYS HA H 4.083 0.02 1 666 62 63 LYS HB2 H 1.947 0.02 2 667 62 63 LYS HB3 H 2.000 0.02 2 668 62 63 LYS HD2 H 1.710 0.02 2 669 62 63 LYS HE2 H 3.052 0.02 2 670 62 63 LYS HG2 H 1.598 0.02 2 671 62 63 LYS HG3 H 1.523 0.02 2 672 62 63 LYS C C 179.610 0.2 1 673 62 63 LYS CA C 59.222 0.2 1 674 62 63 LYS CB C 32.224 0.2 1 675 62 63 LYS CD C 29.050 0.2 1 676 62 63 LYS CE C 42.430 0.2 1 677 62 63 LYS CG C 25.051 0.2 1 678 62 63 LYS N N 117.479 0.2 1 679 63 64 GLU H H 7.879 0.02 1 680 63 64 GLU HA H 4.145 0.02 1 681 63 64 GLU HB2 H 2.148 0.02 2 682 63 64 GLU HG2 H 2.275 0.02 2 683 63 64 GLU HG3 H 2.495 0.02 2 684 63 64 GLU C C 179.564 0.2 1 685 63 64 GLU CA C 58.901 0.2 1 686 63 64 GLU CB C 29.402 0.2 1 687 63 64 GLU CG C 35.803 0.2 1 688 63 64 GLU N N 120.004 0.2 1 689 64 65 VAL H H 8.493 0.02 1 690 64 65 VAL HA H 3.394 0.02 1 691 64 65 VAL HB H 2.245 0.02 1 692 64 65 VAL HG1 H 0.816 0.02 1 693 64 65 VAL HG2 H 1.002 0.02 1 694 64 65 VAL C C 177.956 0.2 1 695 64 65 VAL CA C 67.251 0.2 1 696 64 65 VAL CB C 31.791 0.2 1 697 64 65 VAL CG1 C 22.387 0.2 1 698 64 65 VAL CG2 C 24.488 0.2 1 699 64 65 VAL N N 118.363 0.2 1 700 65 66 GLU H H 8.502 0.02 1 701 65 66 GLU HA H 3.935 0.02 1 702 65 66 GLU HB2 H 2.136 0.02 2 703 65 66 GLU HG2 H 2.222 0.02 2 704 65 66 GLU HG3 H 2.633 0.02 2 705 65 66 GLU C C 179.002 0.2 1 706 65 66 GLU CA C 60.120 0.2 1 707 65 66 GLU CB C 29.388 0.2 1 708 65 66 GLU CG C 37.817 0.2 1 709 65 66 GLU N N 116.960 0.2 1 710 66 67 SER H H 7.880 0.02 1 711 66 67 SER HA H 4.348 0.02 1 712 66 67 SER HB2 H 4.047 0.02 2 713 66 67 SER C C 175.340 0.2 1 714 66 67 SER CA C 60.963 0.2 1 715 66 67 SER CB C 63.405 0.2 1 716 66 67 SER N N 113.395 0.2 1 717 67 68 LEU H H 7.543 0.02 1 718 67 68 LEU HA H 4.474 0.02 1 719 67 68 LEU HB2 H 1.593 0.02 2 720 67 68 LEU HB3 H 1.794 0.02 2 721 67 68 LEU HD1 H 0.863 0.02 1 722 67 68 LEU HD2 H 0.874 0.02 1 723 67 68 LEU HG H 1.831 0.02 1 724 67 68 LEU C C 178.325 0.2 1 725 67 68 LEU CA C 56.299 0.2 1 726 67 68 LEU CB C 44.114 0.2 1 727 67 68 LEU CD1 C 25.970 0.2 1 728 67 68 LEU CD2 C 23.338 0.2 1 729 67 68 LEU CG C 27.036 0.2 1 730 67 68 LEU N N 120.277 0.2 1 731 68 69 ILE H H 7.676 0.02 1 732 68 69 ILE HA H 4.508 0.02 1 733 68 69 ILE HB H 2.105 0.02 1 734 68 69 ILE HD1 H 0.811 0.02 1 735 68 69 ILE HG12 H 1.720 0.02 2 736 68 69 ILE HG13 H 1.460 0.02 2 737 68 69 ILE HG2 H 0.936 0.02 1 738 68 69 ILE C C 176.244 0.2 1 739 68 69 ILE CA C 61.156 0.2 1 740 68 69 ILE CB C 39.713 0.2 1 741 68 69 ILE CD1 C 14.359 0.2 1 742 68 69 ILE CG1 C 25.259 0.2 1 743 68 69 ILE CG2 C 18.289 0.2 1 744 68 69 ILE N N 113.228 0.2 1 745 69 70 GLY H H 8.175 0.02 1 746 69 70 GLY HA2 H 4.024 0.02 2 747 69 70 GLY HA3 H 4.243 0.02 2 748 69 70 GLY C C 173.477 0.2 1 749 69 70 GLY CA C 45.191 0.2 1 750 69 70 GLY N N 110.321 0.2 1 751 70 71 ARG H H 8.357 0.02 1 752 70 71 ARG HA H 4.703 0.02 1 753 70 71 ARG HB2 H 1.964 0.02 2 754 70 71 ARG HB3 H 1.776 0.02 2 755 70 71 ARG HD2 H 3.241 0.02 2 756 70 71 ARG HE H 7.841 0.02 1 757 70 71 ARG HG2 H 1.709 0.02 2 758 70 71 ARG C C 177.311 0.2 1 759 70 71 ARG CA C 55.779 0.2 1 760 70 71 ARG CB C 32.012 0.2 1 761 70 71 ARG CD C 43.386 0.2 1 762 70 71 ARG CG C 27.510 0.2 1 763 70 71 ARG N N 119.749 0.2 1 764 70 71 ARG NE N 84.149 0.2 1 765 71 72 GLY H H 8.667 0.02 1 766 71 72 GLY HA2 H 3.915 0.02 2 767 71 72 GLY HA3 H 4.379 0.02 2 768 71 72 GLY C C 173.881 0.2 1 769 71 72 GLY CA C 44.761 0.2 1 770 71 72 GLY N N 110.644 0.2 1 771 72 73 GLN H H 8.509 0.02 1 772 72 73 GLN HA H 4.575 0.02 1 773 72 73 GLN HB2 H 1.983 0.02 2 774 72 73 GLN HB3 H 2.248 0.02 2 775 72 73 GLN HE21 H 7.538 0.02 1 776 72 73 GLN HE22 H 6.844 0.02 1 777 72 73 GLN HG2 H 2.391 0.02 2 778 72 73 GLN C C 173.145 0.2 1 779 72 73 GLN CA C 55.299 0.2 1 780 72 73 GLN CB C 30.235 0.2 1 781 72 73 GLN CG C 33.907 0.2 1 782 72 73 GLN N N 118.661 0.2 1 783 72 73 GLN NE2 N 112.184 0.2 1 784 73 74 GLU H H 8.446 0.02 1 785 73 74 GLU HA H 4.349 0.02 1 786 73 74 GLU HB2 H 1.945 0.02 2 787 73 74 GLU HB3 H 2.042 0.02 2 788 73 74 GLU HG2 H 2.331 0.02 2 789 73 74 GLU C C 176.139 0.2 1 790 73 74 GLU CA C 56.386 0.2 1 791 73 74 GLU CB C 30.425 0.2 1 792 73 74 GLU CG C 36.116 0.2 1 793 73 74 GLU N N 121.687 0.2 1 794 74 75 MET H H 8.530 0.02 1 795 74 75 MET HA H 4.575 0.02 1 796 74 75 MET HB2 H 2.113 0.02 2 797 74 75 MET HB3 H 2.013 0.02 2 798 74 75 MET HE H 2.094 0.02 1 799 74 75 MET HG2 H 2.550 0.02 2 800 74 75 MET HG3 H 2.589 0.02 2 801 74 75 MET C C 176.027 0.2 1 802 74 75 MET CA C 55.082 0.2 1 803 74 75 MET CB C 33.495 0.2 1 804 74 75 MET CE C 16.965 0.2 1 805 74 75 MET CG C 31.960 0.2 1 806 74 75 MET N N 122.094 0.2 1 807 75 76 SER H H 8.379 0.02 1 808 75 76 SER HA H 4.551 0.02 1 809 75 76 SER HB2 H 3.917 0.02 2 810 75 76 SER HB3 H 3.843 0.02 2 811 75 76 SER C C 175.763 0.2 1 812 75 76 SER CA C 58.076 0.2 1 813 75 76 SER CB C 64.118 0.2 1 814 75 76 SER N N 117.163 0.2 1 815 76 77 GLN H H 8.451 0.02 1 816 76 77 GLN HA H 4.391 0.02 1 817 76 77 GLN HB2 H 2.007 0.02 2 818 76 77 GLN HB3 H 2.237 0.02 2 819 76 77 GLN HE21 H 7.520 0.02 1 820 76 77 GLN HE22 H 6.844 0.02 1 821 76 77 GLN HG2 H 2.394 0.02 2 822 76 77 GLN C C 175.753 0.2 1 823 76 77 GLN CA C 56.417 0.2 1 824 76 77 GLN CB C 29.879 0.2 1 825 76 77 GLN CG C 34.010 0.2 1 826 76 77 GLN N N 121.687 0.2 1 827 76 77 GLN NE2 N 112.326 0.2 1 828 77 78 THR H H 8.003 0.02 1 829 77 78 THR HA H 4.352 0.02 1 830 77 78 THR HB H 4.037 0.02 1 831 77 78 THR HG2 H 1.121 0.02 1 832 77 78 THR C C 173.559 0.2 1 833 77 78 THR CA C 61.394 0.2 1 834 77 78 THR CB C 69.918 0.2 1 835 77 78 THR CG2 C 21.653 0.2 1 836 77 78 THR N N 114.633 0.2 1 837 78 79 ILE H H 8.174 0.02 1 838 78 79 ILE HA H 4.463 0.02 1 839 78 79 ILE HB H 1.671 0.02 1 840 78 79 ILE HD1 H 0.733 0.02 1 841 78 79 ILE HG12 H 1.052 0.02 2 842 78 79 ILE HG13 H 1.331 0.02 2 843 78 79 ILE HG2 H 0.727 0.02 1 844 78 79 ILE C C 175.293 0.2 1 845 78 79 ILE CA C 60.455 0.2 1 846 78 79 ILE CB C 39.357 0.2 1 847 78 79 ILE CD1 C 13.529 0.2 1 848 78 79 ILE CG1 C 27.154 0.2 1 849 78 79 ILE CG2 C 17.795 0.2 1 850 78 79 ILE N N 123.716 0.2 1 851 79 80 HIS H H 8.108 0.02 1 852 79 80 HIS HA H 4.954 0.02 1 853 79 80 HIS HB2 H 3.197 0.02 2 854 79 80 HIS HB3 H 3.388 0.02 2 855 79 80 HIS HD2 H 7.175 0.02 1 856 79 80 HIS HE1 H 8.462 0.02 1 857 79 80 HIS C C 174.070 0.2 1 858 79 80 HIS CA C 54.641 0.2 1 859 79 80 HIS CB C 31.538 0.2 1 860 79 80 HIS CD2 C 119.562 0.2 1 861 79 80 HIS CE1 C 135.663 0.2 1 862 79 80 HIS N N 121.190 0.2 1 863 80 81 TYR H H 8.870 0.02 1 864 80 81 TYR HA H 5.180 0.02 1 865 80 81 TYR HB2 H 2.875 0.02 2 866 80 81 TYR HB3 H 3.107 0.02 2 867 80 81 TYR HD1 H 7.069 0.02 3 868 80 81 TYR HE1 H 6.693 0.02 3 869 80 81 TYR C C 177.511 0.2 1 870 80 81 TYR CA C 58.109 0.2 1 871 80 81 TYR CB C 39.831 0.2 1 872 80 81 TYR CD1 C 132.819 0.2 1 873 80 81 TYR CE1 C 117.290 0.2 1 874 80 81 TYR N N 121.365 0.2 1 875 81 82 THR H H 8.865 0.02 1 876 81 82 THR HA H 4.744 0.02 1 877 81 82 THR HB H 5.091 0.02 1 878 81 82 THR HG1 H 5.580 0.02 1 879 81 82 THR HG2 H 1.417 0.02 1 880 81 82 THR C C 171.095 0.2 1 881 81 82 THR CA C 60.212 0.2 1 882 81 82 THR CB C 68.620 0.2 1 883 81 82 THR CG2 C 22.756 0.2 1 884 81 82 THR N N 114.121 0.2 1 885 82 83 PRO HA H 4.334 0.02 1 886 82 83 PRO HG2 H 2.185 0.02 2 887 82 83 PRO HG3 H 2.344 0.02 2 888 82 83 PRO HD2 H 4.047 0.02 2 889 82 83 PRO HD3 H 4.095 0.02 2 890 82 83 PRO HB2 H 2.536 0.02 2 891 82 83 PRO HB3 H 2.055 0.02 2 892 82 83 PRO C C 180.316 0.2 1 893 82 83 PRO CA C 66.133 0.2 1 894 82 83 PRO CG C 28.221 0.2 1 895 82 83 PRO CD C 50.494 0.2 1 896 82 83 PRO CB C 32.089 0.2 1 897 83 84 ARG H H 8.236 0.02 1 898 83 84 ARG HA H 4.209 0.02 1 899 83 84 ARG HB2 H 1.817 0.02 2 900 83 84 ARG HB3 H 2.029 0.02 2 901 83 84 ARG HD2 H 3.267 0.02 2 902 83 84 ARG HD3 H 3.400 0.02 2 903 83 84 ARG HE H 7.888 0.02 1 904 83 84 ARG HG2 H 1.758 0.02 2 905 83 84 ARG HG3 H 2.011 0.02 2 906 83 84 ARG C C 177.080 0.2 1 907 83 84 ARG CA C 59.025 0.2 1 908 83 84 ARG CB C 29.405 0.2 1 909 83 84 ARG CD C 42.556 0.2 1 910 83 84 ARG CG C 27.865 0.2 1 911 83 84 ARG N N 115.683 0.2 1 912 83 84 ARG NE N 84.172 0.2 1 913 84 85 ALA H H 8.090 0.02 1 914 84 85 ALA HA H 3.879 0.02 1 915 84 85 ALA HB H 1.655 0.02 1 916 84 85 ALA C C 179.404 0.2 1 917 84 85 ALA CA C 55.910 0.2 1 918 84 85 ALA CB C 19.224 0.2 1 919 84 85 ALA N N 123.056 0.2 1 920 85 86 LYS H H 8.343 0.02 1 921 85 86 LYS HA H 3.814 0.02 1 922 85 86 LYS HB2 H 1.973 0.02 2 923 85 86 LYS HD2 H 1.740 0.02 2 924 85 86 LYS HE2 H 3.043 0.02 2 925 85 86 LYS HG2 H 1.665 0.02 2 926 85 86 LYS HG3 H 1.357 0.02 2 927 85 86 LYS C C 179.367 0.2 1 928 85 86 LYS CA C 60.328 0.2 1 929 85 86 LYS CB C 31.931 0.2 1 930 85 86 LYS CD C 29.524 0.2 1 931 85 86 LYS CE C 42.082 0.2 1 932 85 86 LYS CG C 25.851 0.2 1 933 85 86 LYS N N 116.949 0.2 1 934 86 87 LYS H H 7.876 0.02 1 935 86 87 LYS HA H 4.232 0.02 1 936 86 87 LYS HB2 H 2.262 0.02 2 937 86 87 LYS HB3 H 2.035 0.02 2 938 86 87 LYS HD2 H 1.577 0.02 2 939 86 87 LYS HD3 H 1.660 0.02 2 940 86 87 LYS HE2 H 3.015 0.02 2 941 86 87 LYS HG2 H 1.847 0.02 2 942 86 87 LYS C C 178.369 0.2 1 943 86 87 LYS CA C 58.432 0.2 1 944 86 87 LYS CB C 31.419 0.2 1 945 86 87 LYS CD C 28.692 0.2 1 946 86 87 LYS CE C 42.200 0.2 1 947 86 87 LYS CG C 28.576 0.2 1 948 86 87 LYS N N 120.630 0.2 1 949 87 88 VAL H H 8.085 0.02 1 950 87 88 VAL HA H 3.407 0.02 1 951 87 88 VAL HB H 2.571 0.02 1 952 87 88 VAL HG1 H 0.839 0.02 1 953 87 88 VAL HG2 H 1.272 0.02 1 954 87 88 VAL C C 178.773 0.2 1 955 87 88 VAL CA C 67.369 0.2 1 956 87 88 VAL CB C 30.709 0.2 1 957 87 88 VAL CG1 C 20.756 0.2 1 958 87 88 VAL CG2 C 24.299 0.2 1 959 87 88 VAL N N 119.306 0.2 1 960 88 89 ILE H H 7.820 0.02 1 961 88 89 ILE HA H 3.680 0.02 1 962 88 89 ILE HB H 2.197 0.02 1 963 88 89 ILE HD1 H 0.588 0.02 1 964 88 89 ILE HG12 H 1.291 0.02 2 965 88 89 ILE HG13 H 1.564 0.02 2 966 88 89 ILE HG2 H 1.012 0.02 1 967 88 89 ILE C C 178.274 0.2 1 968 88 89 ILE CA C 65.185 0.2 1 969 88 89 ILE CB C 36.514 0.2 1 970 88 89 ILE CD1 C 11.160 0.2 1 971 88 89 ILE CG1 C 28.458 0.2 1 972 88 89 ILE CG2 C 17.676 0.2 1 973 88 89 ILE N N 122.021 0.2 1 974 89 90 GLU H H 8.073 0.02 1 975 89 90 GLU HA H 4.114 0.02 1 976 89 90 GLU HB2 H 2.312 0.02 2 977 89 90 GLU HB3 H 2.216 0.02 2 978 89 90 GLU HG2 H 2.223 0.02 2 979 89 90 GLU HG3 H 2.484 0.02 2 980 89 90 GLU C C 180.562 0.2 1 981 89 90 GLU CA C 60.131 0.2 1 982 89 90 GLU CB C 29.713 0.2 1 983 89 90 GLU CG C 36.158 0.2 1 984 89 90 GLU N N 121.375 0.2 1 985 90 91 LEU H H 9.211 0.02 1 986 90 91 LEU HA H 4.180 0.02 1 987 90 91 LEU HB2 H 1.290 0.02 2 988 90 91 LEU HB3 H 2.118 0.02 2 989 90 91 LEU HD1 H 0.827 0.02 1 990 90 91 LEU HD2 H 0.888 0.02 1 991 90 91 LEU HG H 1.973 0.02 1 992 90 91 LEU C C 179.293 0.2 1 993 90 91 LEU CA C 57.484 0.2 1 994 90 91 LEU CB C 42.556 0.2 1 995 90 91 LEU CD1 C 25.732 0.2 1 996 90 91 LEU CD2 C 21.941 0.2 1 997 90 91 LEU CG C 26.562 0.2 1 998 90 91 LEU N N 120.698 0.2 1 999 91 92 SER H H 8.694 0.02 1 1000 91 92 SER HA H 4.180 0.02 1 1001 91 92 SER HB2 H 4.089 0.02 2 1002 91 92 SER HB3 H 3.637 0.02 2 1003 91 92 SER HG H 4.901 0.02 1 1004 91 92 SER C C 175.941 0.2 1 1005 91 92 SER CA C 62.816 0.2 1 1006 91 92 SER CB C 62.579 0.2 1 1007 91 92 SER N N 118.603 0.2 1 1008 92 93 MET H H 7.457 0.02 1 1009 92 93 MET HA H 3.912 0.02 1 1010 92 93 MET HB2 H 2.092 0.02 2 1011 92 93 MET HB3 H 2.320 0.02 2 1012 92 93 MET HE H 2.077 0.02 1 1013 92 93 MET HG2 H 2.435 0.02 2 1014 92 93 MET HG3 H 2.814 0.02 2 1015 92 93 MET C C 178.540 0.2 1 1016 92 93 MET CA C 58.906 0.2 1 1017 92 93 MET CB C 32.723 0.2 1 1018 92 93 MET CE C 17.577 0.2 1 1019 92 93 MET CG C 32.722 0.2 1 1020 92 93 MET N N 120.144 0.2 1 1021 93 94 ASP H H 7.682 0.02 1 1022 93 94 ASP HA H 4.430 0.02 1 1023 93 94 ASP HB2 H 2.817 0.02 2 1024 93 94 ASP HB3 H 2.889 0.02 2 1025 93 94 ASP C C 178.003 0.2 1 1026 93 94 ASP CA C 57.939 0.2 1 1027 93 94 ASP CB C 42.440 0.2 1 1028 93 94 ASP N N 121.042 0.2 1 1029 94 95 GLU H H 8.728 0.02 1 1030 94 95 GLU HA H 3.913 0.02 1 1031 94 95 GLU HB2 H 2.269 0.02 2 1032 94 95 GLU HG2 H 2.166 0.02 2 1033 94 95 GLU HG3 H 2.518 0.02 2 1034 94 95 GLU C C 178.818 0.2 1 1035 94 95 GLU CA C 59.030 0.2 1 1036 94 95 GLU CB C 29.524 0.2 1 1037 94 95 GLU CG C 36.158 0.2 1 1038 94 95 GLU N N 118.504 0.2 1 1039 95 96 ALA H H 7.689 0.02 1 1040 95 96 ALA HA H 3.512 0.02 1 1041 95 96 ALA HB H 0.796 0.02 1 1042 95 96 ALA C C 179.178 0.2 1 1043 95 96 ALA CA C 56.062 0.2 1 1044 95 96 ALA CB C 16.778 0.2 1 1045 95 96 ALA N N 120.824 0.2 1 1046 96 97 ARG H H 7.707 0.02 1 1047 96 97 ARG HA H 4.009 0.02 1 1048 96 97 ARG HB2 H 2.026 0.02 2 1049 96 97 ARG HB3 H 1.959 0.02 2 1050 96 97 ARG HD2 H 3.229 0.02 2 1051 96 97 ARG HD3 H 3.185 0.02 2 1052 96 97 ARG HE H 7.217 0.02 1 1053 96 97 ARG HG2 H 1.718 0.02 2 1054 96 97 ARG HG3 H 1.560 0.02 2 1055 96 97 ARG C C 181.088 0.2 1 1056 96 97 ARG CA C 59.467 0.2 1 1057 96 97 ARG CB C 29.642 0.2 1 1058 96 97 ARG CD C 43.267 0.2 1 1059 96 97 ARG CG C 27.154 0.2 1 1060 96 97 ARG N N 118.316 0.2 1 1061 96 97 ARG NE N 83.727 0.2 1 1062 97 98 LYS H H 8.374 0.02 1 1063 97 98 LYS HA H 3.938 0.02 1 1064 97 98 LYS HB2 H 1.860 0.02 2 1065 97 98 LYS HB3 H 1.937 0.02 2 1066 97 98 LYS HD2 H 1.630 0.02 2 1067 97 98 LYS HE2 H 2.949 0.02 2 1068 97 98 LYS HG2 H 1.633 0.02 2 1069 97 98 LYS HG3 H 1.423 0.02 2 1070 97 98 LYS C C 178.613 0.2 1 1071 97 98 LYS CA C 59.565 0.2 1 1072 97 98 LYS CB C 32.604 0.2 1 1073 97 98 LYS CD C 29.050 0.2 1 1074 97 98 LYS CE C 41.964 0.2 1 1075 97 98 LYS CG C 25.732 0.2 1 1076 97 98 LYS N N 120.860 0.2 1 1077 98 99 LEU H H 7.453 0.02 1 1078 98 99 LEU HA H 4.213 0.02 1 1079 98 99 LEU HB2 H 1.194 0.02 2 1080 98 99 LEU HB3 H 1.563 0.02 2 1081 98 99 LEU HD1 H 0.877 0.02 2 1082 98 99 LEU HD2 H 0.961 0.02 2 1083 98 99 LEU HG H 1.826 0.02 1 1084 98 99 LEU C C 176.509 0.2 1 1085 98 99 LEU CA C 54.878 0.2 1 1086 98 99 LEU CB C 42.319 0.2 1 1087 98 99 LEU CD1 C 22.751 0.2 2 1088 98 99 LEU CD2 C 25.614 0.2 2 1089 98 99 LEU CG C 26.917 0.2 1 1090 98 99 LEU N N 117.534 0.2 1 1091 99 100 GLY H H 7.773 0.02 1 1092 99 100 GLY HA2 H 3.735 0.02 2 1093 99 100 GLY HA3 H 4.018 0.02 2 1094 99 100 GLY C C 174.815 0.2 1 1095 99 100 GLY CA C 45.710 0.2 1 1096 99 100 GLY N N 107.492 0.2 1 1097 100 101 HIS H H 8.258 0.02 1 1098 100 101 HIS HA H 4.994 0.02 1 1099 100 101 HIS HB2 H 2.872 0.02 2 1100 100 101 HIS HB3 H 3.008 0.02 2 1101 100 101 HIS HD2 H 7.047 0.02 1 1102 100 101 HIS HE1 H 7.443 0.02 1 1103 100 101 HIS C C 175.623 0.2 1 1104 100 101 HIS CA C 54.641 0.2 1 1105 100 101 HIS CB C 32.960 0.2 1 1106 100 101 HIS CD2 C 115.679 0.2 1 1107 100 101 HIS CE1 C 139.301 0.2 1 1108 100 101 HIS N N 120.938 0.2 1 1109 101 102 SER H H 8.888 0.02 1 1110 101 102 SER HA H 4.306 0.02 1 1111 101 102 SER HB2 H 3.934 0.02 2 1112 101 102 SER HB3 H 3.818 0.02 2 1113 101 102 SER C C 172.722 0.2 1 1114 101 102 SER CA C 59.004 0.2 1 1115 101 102 SER CB C 63.706 0.2 1 1116 101 102 SER N N 117.679 0.2 1 1117 102 103 TYR H H 7.355 0.02 1 1118 102 103 TYR HA H 4.854 0.02 1 1119 102 103 TYR HB2 H 2.768 0.02 2 1120 102 103 TYR HB3 H 2.807 0.02 2 1121 102 103 TYR HD1 H 6.975 0.02 3 1122 102 103 TYR HE1 H 6.837 0.02 3 1123 102 103 TYR C C 173.176 0.2 1 1124 102 103 TYR CA C 55.470 0.2 1 1125 102 103 TYR CB C 41.371 0.2 1 1126 102 103 TYR CD1 C 132.396 0.2 1 1127 102 103 TYR CE1 C 117.137 0.2 1 1128 102 103 TYR N N 118.749 0.2 1 1129 103 104 VAL H H 8.324 0.02 1 1130 103 104 VAL HA H 4.097 0.02 1 1131 103 104 VAL HB H 1.360 0.02 1 1132 103 104 VAL HG1 H 0.694 0.02 1 1133 103 104 VAL HG2 H 0.511 0.02 1 1134 103 104 VAL C C 175.651 0.2 1 1135 103 104 VAL CA C 61.986 0.2 1 1136 103 104 VAL CB C 32.130 0.2 1 1137 103 104 VAL CG1 C 22.152 0.2 1 1138 103 104 VAL CG2 C 21.862 0.2 1 1139 103 104 VAL N N 119.943 0.2 1 1140 104 105 GLY H H 12.174 0.02 1 1141 104 105 GLY HA2 H 5.308 0.02 2 1142 104 105 GLY HA3 H 4.077 0.02 2 1143 104 105 GLY C C 176.833 0.2 1 1144 104 105 GLY CA C 43.741 0.2 1 1145 104 105 GLY N N 119.940 0.2 1 1146 105 106 THR H H 8.379 0.02 1 1147 105 106 THR HA H 3.733 0.02 1 1148 105 106 THR HB H 4.290 0.02 1 1149 105 106 THR HG1 H 5.572 0.02 1 1150 105 106 THR HG2 H 1.368 0.02 1 1151 105 106 THR C C 176.920 0.2 1 1152 105 106 THR CA C 66.857 0.2 1 1153 105 106 THR CB C 67.211 0.2 1 1154 105 106 THR CG2 C 22.515 0.2 1 1155 105 106 THR N N 110.684 0.2 1 1156 106 107 GLU H H 11.835 0.02 1 1157 106 107 GLU HA H 3.744 0.02 1 1158 106 107 GLU HB2 H 1.551 0.02 2 1159 106 107 GLU HB3 H 1.869 0.02 2 1160 106 107 GLU HG2 H 1.211 0.02 2 1161 106 107 GLU HG3 H 1.829 0.02 2 1162 106 107 GLU C C 176.169 0.2 1 1163 106 107 GLU CA C 58.551 0.2 1 1164 106 107 GLU CB C 27.658 0.2 1 1165 106 107 GLU CG C 32.604 0.2 1 1166 106 107 GLU N N 123.810 0.2 1 1167 107 108 HIS H H 6.963 0.02 1 1168 107 108 HIS HA H 4.233 0.02 1 1169 107 108 HIS HB2 H 3.889 0.02 2 1170 107 108 HIS HB3 H 3.281 0.02 2 1171 107 108 HIS HD2 H 6.557 0.02 1 1172 107 108 HIS HE1 H 7.661 0.02 1 1173 107 108 HIS C C 177.663 0.2 1 1174 107 108 HIS CA C 60.564 0.2 1 1175 107 108 HIS CB C 30.946 0.2 1 1176 107 108 HIS CD2 C 112.066 0.2 1 1177 107 108 HIS CE1 C 135.894 0.2 1 1178 107 108 HIS N N 120.900 0.2 1 1179 108 109 ILE H H 7.476 0.02 1 1180 108 109 ILE HA H 4.399 0.02 1 1181 108 109 ILE HB H 2.011 0.02 1 1182 108 109 ILE HD1 H 0.844 0.02 1 1183 108 109 ILE HG12 H 1.923 0.02 2 1184 108 109 ILE HG13 H 1.010 0.02 2 1185 108 109 ILE HG2 H 0.748 0.02 1 1186 108 109 ILE C C 177.798 0.2 1 1187 108 109 ILE CA C 63.948 0.2 1 1188 108 109 ILE CB C 37.191 0.2 1 1189 108 109 ILE CD1 C 13.354 0.2 1 1190 108 109 ILE CG1 C 28.221 0.2 1 1191 108 109 ILE CG2 C 17.812 0.2 1 1192 108 109 ILE N N 119.656 0.2 1 1193 109 110 LEU H H 7.774 0.02 1 1194 109 110 LEU HA H 3.940 0.02 1 1195 109 110 LEU HB2 H 1.411 0.02 2 1196 109 110 LEU HB3 H 2.093 0.02 2 1197 109 110 LEU HD1 H 0.841 0.02 1 1198 109 110 LEU HD2 H 0.793 0.02 1 1199 109 110 LEU HG H 1.429 0.02 1 1200 109 110 LEU C C 177.019 0.2 1 1201 109 110 LEU CA C 58.432 0.2 1 1202 109 110 LEU CB C 41.016 0.2 1 1203 109 110 LEU CD1 C 22.763 0.2 1 1204 109 110 LEU CD2 C 25.970 0.2 1 1205 109 110 LEU CG C 27.391 0.2 1 1206 109 110 LEU N N 118.821 0.2 1 1207 110 111 LEU H H 7.462 0.02 1 1208 110 111 LEU HA H 3.939 0.02 1 1209 110 111 LEU HB2 H 1.962 0.02 2 1210 110 111 LEU HB3 H 1.532 0.02 2 1211 110 111 LEU HD1 H 0.972 0.02 1 1212 110 111 LEU HD2 H 0.759 0.02 1 1213 110 111 LEU HG H 2.125 0.02 1 1214 110 111 LEU C C 179.234 0.2 1 1215 110 111 LEU CA C 58.195 0.2 1 1216 110 111 LEU CB C 40.661 0.2 1 1217 110 111 LEU CD1 C 25.528 0.2 1 1218 110 111 LEU CD2 C 22.534 0.2 1 1219 110 111 LEU CG C 26.443 0.2 1 1220 110 111 LEU N N 115.197 0.2 1 1221 111 112 GLY H H 8.923 0.02 1 1222 111 112 GLY HA2 H 3.563 0.02 2 1223 111 112 GLY HA3 H 3.813 0.02 2 1224 111 112 GLY C C 174.877 0.2 1 1225 111 112 GLY CA C 47.528 0.2 1 1226 111 112 GLY N N 108.974 0.2 1 1227 112 113 LEU H H 8.534 0.02 1 1228 112 113 LEU HA H 4.057 0.02 1 1229 112 113 LEU HB2 H 1.238 0.02 2 1230 112 113 LEU HB3 H 2.190 0.02 2 1231 112 113 LEU HD1 H 0.812 0.02 1 1232 112 113 LEU HD2 H 0.892 0.02 1 1233 112 113 LEU HG H 1.872 0.02 1 1234 112 113 LEU C C 179.046 0.2 1 1235 112 113 LEU CA C 57.958 0.2 1 1236 112 113 LEU CB C 42.912 0.2 1 1237 112 113 LEU CD1 C 27.747 0.2 1 1238 112 113 LEU CD2 C 25.022 0.2 1 1239 112 113 LEU CG C 25.837 0.2 1 1240 112 113 LEU N N 121.269 0.2 1 1241 113 114 ILE H H 7.433 0.02 1 1242 113 114 ILE HA H 3.606 0.02 1 1243 113 114 ILE HB H 1.800 0.02 1 1244 113 114 ILE HD1 H 0.655 0.02 1 1245 113 114 ILE HG12 H 1.843 0.02 2 1246 113 114 ILE HG13 H 0.818 0.02 2 1247 113 114 ILE HG2 H 0.910 0.02 1 1248 113 114 ILE C C 178.604 0.2 1 1249 113 114 ILE CA C 64.891 0.2 1 1250 113 114 ILE CB C 38.847 0.2 1 1251 113 114 ILE CD1 C 14.995 0.2 1 1252 113 114 ILE CG1 C 29.524 0.2 1 1253 113 114 ILE CG2 C 18.031 0.2 1 1254 113 114 ILE N N 117.348 0.2 1 1255 114 115 ARG H H 8.602 0.02 1 1256 114 115 ARG HA H 3.958 0.02 1 1257 114 115 ARG HB2 H 1.893 0.02 2 1258 114 115 ARG HB3 H 1.960 0.02 2 1259 114 115 ARG HD2 H 3.379 0.02 2 1260 114 115 ARG HD3 H 2.979 0.02 2 1261 114 115 ARG HE H 7.430 0.02 1 1262 114 115 ARG HG2 H 1.629 0.02 2 1263 114 115 ARG HG3 H 1.935 0.02 2 1264 114 115 ARG C C 177.639 0.2 1 1265 114 115 ARG CA C 58.314 0.2 1 1266 114 115 ARG CB C 30.827 0.2 1 1267 114 115 ARG CD C 44.096 0.2 1 1268 114 115 ARG CG C 27.273 0.2 1 1269 114 115 ARG N N 120.188 0.2 1 1270 114 115 ARG NE N 83.751 0.2 1 1271 115 116 GLU H H 8.074 0.02 1 1272 115 116 GLU HA H 3.733 0.02 1 1273 115 116 GLU HB2 H 1.904 0.02 2 1274 115 116 GLU HB3 H 2.394 0.02 2 1275 115 116 GLU HG2 H 2.217 0.02 2 1276 115 116 GLU HG3 H 2.525 0.02 2 1277 115 116 GLU C C 179.945 0.2 1 1278 115 116 GLU CA C 60.683 0.2 1 1279 115 116 GLU CB C 29.050 0.2 1 1280 115 116 GLU CG C 35.922 0.2 1 1281 115 116 GLU N N 121.088 0.2 1 1282 116 117 GLY H H 6.764 0.02 1 1283 116 117 GLY HA2 H 3.621 0.02 2 1284 116 117 GLY HA3 H 4.063 0.02 2 1285 116 117 GLY C C 174.321 0.2 1 1286 116 117 GLY CA C 48.361 0.2 1 1287 116 117 GLY N N 101.422 0.2 1 1288 117 118 GLU H H 8.067 0.02 1 1289 117 118 GLU HA H 4.554 0.02 1 1290 117 118 GLU HB2 H 2.117 0.02 2 1291 117 118 GLU HG2 H 2.411 0.02 2 1292 117 118 GLU HG3 H 2.256 0.02 2 1293 117 118 GLU C C 177.473 0.2 1 1294 117 118 GLU CA C 57.010 0.2 1 1295 117 118 GLU CB C 32.809 0.2 1 1296 117 118 GLU CG C 36.632 0.2 1 1297 117 118 GLU N N 121.941 0.2 1 1298 118 119 GLY H H 10.769 0.02 1 1299 118 119 GLY HA2 H 4.182 0.02 2 1300 118 119 GLY HA3 H 3.828 0.02 2 1301 118 119 GLY C C 172.582 0.2 1 1302 118 119 GLY CA C 44.436 0.2 1 1303 118 119 GLY N N 112.717 0.2 1 1304 119 120 VAL H H 8.244 0.02 1 1305 119 120 VAL HA H 3.423 0.02 1 1306 119 120 VAL HB H 1.865 0.02 1 1307 119 120 VAL HG1 H 0.839 0.02 1 1308 119 120 VAL HG2 H 1.077 0.02 1 1309 119 120 VAL C C 177.341 0.2 1 1310 119 120 VAL CA C 66.488 0.2 1 1311 119 120 VAL CB C 32.130 0.2 1 1312 119 120 VAL CG1 C 22.060 0.2 1 1313 119 120 VAL CG2 C 23.431 0.2 1 1314 119 120 VAL N N 118.245 0.2 1 1315 120 121 ALA H H 7.974 0.02 1 1316 120 121 ALA HA H 3.688 0.02 1 1317 120 121 ALA HB H 1.360 0.02 1 1318 120 121 ALA C C 177.897 0.2 1 1319 120 121 ALA CA C 55.352 0.2 1 1320 120 121 ALA CB C 20.697 0.2 1 1321 120 121 ALA N N 117.732 0.2 1 1322 121 122 ALA H H 7.555 0.02 1 1323 121 122 ALA HA H 3.784 0.02 1 1324 121 122 ALA HB H 1.531 0.02 1 1325 121 122 ALA C C 179.778 0.2 1 1326 121 122 ALA CA C 55.470 0.2 1 1327 121 122 ALA CB C 18.036 0.2 1 1328 121 122 ALA N N 119.145 0.2 1 1329 122 123 ARG H H 7.902 0.02 1 1330 122 123 ARG HA H 3.992 0.02 1 1331 122 123 ARG HB2 H 1.893 0.02 2 1332 122 123 ARG HD2 H 3.201 0.02 2 1333 122 123 ARG HE H 7.086 0.02 1 1334 122 123 ARG HG2 H 1.725 0.02 2 1335 122 123 ARG HG3 H 1.666 0.02 2 1336 122 123 ARG C C 178.896 0.2 1 1337 122 123 ARG CA C 59.380 0.2 1 1338 122 123 ARG CB C 29.998 0.2 1 1339 122 123 ARG CD C 43.859 0.2 1 1340 122 123 ARG CG C 27.154 0.2 1 1341 122 123 ARG N N 117.987 0.2 1 1342 122 123 ARG NE N 84.791 0.2 1 1343 123 124 VAL H H 8.595 0.02 1 1344 123 124 VAL HA H 3.554 0.02 1 1345 123 124 VAL HB H 2.132 0.02 1 1346 123 124 VAL HG1 H 0.838 0.02 1 1347 123 124 VAL HG2 H 0.977 0.02 1 1348 123 124 VAL C C 176.460 0.2 1 1349 123 124 VAL CA C 66.607 0.2 1 1350 123 124 VAL CB C 31.419 0.2 1 1351 123 124 VAL CG1 C 21.349 0.2 1 1352 123 124 VAL CG2 C 24.177 0.2 1 1353 123 124 VAL N N 120.102 0.2 1 1354 124 125 LEU H H 8.076 0.02 1 1355 124 125 LEU HA H 3.810 0.02 1 1356 124 125 LEU HB2 H 1.338 0.02 2 1357 124 125 LEU HB3 H 1.845 0.02 2 1358 124 125 LEU HD1 H 0.667 0.02 1 1359 124 125 LEU HD2 H 0.661 0.02 1 1360 124 125 LEU HG H 1.764 0.02 1 1361 124 125 LEU C C 178.632 0.2 1 1362 124 125 LEU CA C 58.659 0.2 1 1363 124 125 LEU CB C 40.068 0.2 1 1364 124 125 LEU CD1 C 25.614 0.2 1 1365 124 125 LEU CD2 C 22.534 0.2 1 1366 124 125 LEU CG C 27.154 0.2 1 1367 124 125 LEU N N 117.298 0.2 1 1368 125 126 ASN H H 8.475 0.02 1 1369 125 126 ASN HA H 4.341 0.02 1 1370 125 126 ASN HB2 H 2.828 0.02 2 1371 125 126 ASN HB3 H 2.913 0.02 2 1372 125 126 ASN HD21 H 7.664 0.02 1 1373 125 126 ASN HD22 H 6.878 0.02 1 1374 125 126 ASN C C 179.606 0.2 1 1375 125 126 ASN CA C 57.037 0.2 1 1376 125 126 ASN CB C 39.119 0.2 1 1377 125 126 ASN N N 117.715 0.2 1 1378 125 126 ASN ND2 N 112.078 0.2 1 1379 126 127 ASN H H 8.708 0.02 1 1380 126 127 ASN HA H 4.446 0.02 1 1381 126 127 ASN HB2 H 2.874 0.02 2 1382 126 127 ASN HB3 H 3.125 0.02 2 1383 126 127 ASN HD21 H 8.021 0.02 1 1384 126 127 ASN HD22 H 6.711 0.02 1 1385 126 127 ASN C C 177.385 0.2 1 1386 126 127 ASN CA C 55.611 0.2 1 1387 126 127 ASN CB C 37.580 0.2 1 1388 126 127 ASN N N 121.571 0.2 1 1389 126 127 ASN ND2 N 110.079 0.2 1 1390 127 128 LEU H H 7.676 0.02 1 1391 127 128 LEU HA H 4.421 0.02 1 1392 127 128 LEU HB2 H 1.766 0.02 2 1393 127 128 LEU HB3 H 1.861 0.02 2 1394 127 128 LEU HD1 H 0.754 0.02 1 1395 127 128 LEU HD2 H 0.859 0.02 1 1396 127 128 LEU HG H 1.950 0.02 1 1397 127 128 LEU C C 176.551 0.2 1 1398 127 128 LEU CA C 54.404 0.2 1 1399 127 128 LEU CB C 41.608 0.2 1 1400 127 128 LEU CD1 C 26.799 0.2 1 1401 127 128 LEU CD2 C 22.297 0.2 1 1402 127 128 LEU CG C 26.562 0.2 1 1403 127 128 LEU N N 118.004 0.2 1 1404 128 129 GLY H H 7.839 0.02 1 1405 128 129 GLY HA2 H 3.833 0.02 2 1406 128 129 GLY HA3 H 4.238 0.02 2 1407 128 129 GLY C C 174.566 0.2 1 1408 128 129 GLY CA C 45.753 0.2 1 1409 128 129 GLY N N 106.887 0.2 1 1410 129 130 VAL H H 8.493 0.02 1 1411 129 130 VAL HA H 3.936 0.02 1 1412 129 130 VAL HB H 1.998 0.02 1 1413 129 130 VAL HG1 H 0.794 0.02 2 1414 129 130 VAL HG2 H 0.820 0.02 2 1415 129 130 VAL C C 173.311 0.2 1 1416 129 130 VAL CA C 62.455 0.2 1 1417 129 130 VAL CB C 31.183 0.2 1 1418 129 130 VAL CG1 C 22.652 0.2 2 1419 129 130 VAL CG2 C 22.060 0.2 2 1420 129 130 VAL N N 122.959 0.2 1 1421 130 131 SER H H 7.114 0.02 1 1422 130 131 SER HA H 4.643 0.02 1 1423 130 131 SER HB2 H 4.325 0.02 2 1424 130 131 SER HB3 H 3.996 0.02 2 1425 130 131 SER C C 174.980 0.2 1 1426 130 131 SER CA C 55.825 0.2 1 1427 130 131 SER CB C 65.636 0.2 1 1428 130 131 SER N N 118.817 0.2 1 1429 131 132 LEU H H 8.998 0.02 1 1430 131 132 LEU HA H 3.984 0.02 1 1431 131 132 LEU HB2 H 1.854 0.02 2 1432 131 132 LEU HB3 H 1.590 0.02 2 1433 131 132 LEU HD1 H 0.954 0.02 1 1434 131 132 LEU HD2 H 1.005 0.02 1 1435 131 132 LEU HG H 1.649 0.02 1 1436 131 132 LEU C C 178.357 0.2 1 1437 131 132 LEU CA C 58.788 0.2 1 1438 131 132 LEU CB C 41.016 0.2 1 1439 131 132 LEU CD1 C 25.377 0.2 1 1440 131 132 LEU CD2 C 24.429 0.2 1 1441 131 132 LEU CG C 27.154 0.2 1 1442 131 132 LEU N N 122.809 0.2 1 1443 132 133 ASN H H 8.648 0.02 1 1444 132 133 ASN HA H 4.415 0.02 1 1445 132 133 ASN HB2 H 2.769 0.02 2 1446 132 133 ASN HD21 H 7.635 0.02 1 1447 132 133 ASN HD22 H 6.995 0.02 1 1448 132 133 ASN C C 177.942 0.2 1 1449 132 133 ASN CA C 56.418 0.2 1 1450 132 133 ASN CB C 38.041 0.2 1 1451 132 133 ASN N N 115.084 0.2 1 1452 132 133 ASN ND2 N 113.020 0.2 1 1453 133 134 LYS H H 7.719 0.02 1 1454 133 134 LYS HA H 4.107 0.02 1 1455 133 134 LYS HB2 H 1.923 0.02 2 1456 133 134 LYS HD2 H 1.867 0.02 2 1457 133 134 LYS HE2 H 3.057 0.02 2 1458 133 134 LYS HG2 H 1.602 0.02 2 1459 133 134 LYS C C 179.180 0.2 1 1460 133 134 LYS CA C 59.261 0.2 1 1461 133 134 LYS CB C 32.967 0.2 1 1462 133 134 LYS CD C 29.527 0.2 1 1463 133 134 LYS CE C 42.082 0.2 1 1464 133 134 LYS CG C 25.259 0.2 1 1465 133 134 LYS N N 120.451 0.2 1 1466 134 135 ALA H H 8.414 0.02 1 1467 134 135 ALA HA H 3.886 0.02 1 1468 134 135 ALA HB H 1.221 0.02 1 1469 134 135 ALA C C 178.555 0.2 1 1470 134 135 ALA CA C 55.589 0.2 1 1471 134 135 ALA CB C 18.048 0.2 1 1472 134 135 ALA N N 120.943 0.2 1 1473 135 136 ARG H H 8.715 0.02 1 1474 135 136 ARG HA H 3.704 0.02 1 1475 135 136 ARG HB2 H 1.924 0.02 2 1476 135 136 ARG HD2 H 3.233 0.02 2 1477 135 136 ARG HE H 7.309 0.02 1 1478 135 136 ARG HG2 H 1.636 0.02 2 1479 135 136 ARG HG3 H 1.607 0.02 2 1480 135 136 ARG C C 177.723 0.2 1 1481 135 136 ARG CA C 60.683 0.2 1 1482 135 136 ARG CB C 30.235 0.2 1 1483 135 136 ARG CD C 43.622 0.2 1 1484 135 136 ARG CG C 28.576 0.2 1 1485 135 136 ARG N N 117.727 0.2 1 1486 135 136 ARG NE N 84.918 0.2 1 1487 136 137 GLN H H 7.980 0.02 1 1488 136 137 GLN HA H 4.000 0.02 1 1489 136 137 GLN HB2 H 2.181 0.02 2 1490 136 137 GLN HB3 H 2.220 0.02 2 1491 136 137 GLN HE21 H 7.435 0.02 1 1492 136 137 GLN HE22 H 6.840 0.02 1 1493 136 137 GLN HG2 H 2.426 0.02 2 1494 136 137 GLN HG3 H 2.539 0.02 2 1495 136 137 GLN C C 178.623 0.2 1 1496 136 137 GLN CA C 59.008 0.2 1 1497 136 137 GLN CB C 28.321 0.2 1 1498 136 137 GLN CG C 33.803 0.2 1 1499 136 137 GLN N N 116.433 0.2 1 1500 136 137 GLN NE2 N 111.548 0.2 1 1501 137 138 GLN H H 7.980 0.02 1 1502 137 138 GLN HA H 4.081 0.02 1 1503 137 138 GLN HB2 H 2.244 0.02 2 1504 137 138 GLN HB3 H 2.108 0.02 2 1505 137 138 GLN HE21 H 6.665 0.02 1 1506 137 138 GLN HE22 H 7.027 0.02 1 1507 137 138 GLN HG2 H 2.105 0.02 2 1508 137 138 GLN HG3 H 2.568 0.02 2 1509 137 138 GLN C C 178.658 0.2 1 1510 137 138 GLN CA C 58.105 0.2 1 1511 137 138 GLN CB C 29.002 0.2 1 1512 137 138 GLN CG C 34.500 0.2 1 1513 137 138 GLN N N 118.180 0.2 1 1514 137 138 GLN NE2 N 112.260 0.2 1 1515 138 139 VAL H H 8.320 0.02 1 1516 138 139 VAL HA H 3.432 0.02 1 1517 138 139 VAL HB H 2.284 0.02 1 1518 138 139 VAL HG1 H 0.811 0.02 1 1519 138 139 VAL HG2 H 0.936 0.02 1 1520 138 139 VAL C C 177.197 0.2 1 1521 138 139 VAL CA C 67.336 0.2 1 1522 138 139 VAL CB C 31.530 0.2 1 1523 138 139 VAL CG1 C 21.780 0.2 1 1524 138 139 VAL CG2 C 22.952 0.2 1 1525 138 139 VAL N N 118.746 0.2 1 1526 139 140 LEU H H 8.308 0.02 1 1527 139 140 LEU HA H 4.057 0.02 1 1528 139 140 LEU HB2 H 1.529 0.02 2 1529 139 140 LEU HB3 H 1.939 0.02 2 1530 139 140 LEU HD1 H 0.920 0.02 1 1531 139 140 LEU HD2 H 0.974 0.02 1 1532 139 140 LEU HG H 1.903 0.02 1 1533 139 140 LEU C C 180.372 0.2 1 1534 139 140 LEU CA C 58.314 0.2 1 1535 139 140 LEU CB C 40.898 0.2 1 1536 139 140 LEU CD1 C 25.377 0.2 1 1537 139 140 LEU CD2 C 22.534 0.2 1 1538 139 140 LEU CG C 27.230 0.2 1 1539 139 140 LEU N N 118.027 0.2 1 1540 140 141 GLN H H 8.068 0.02 1 1541 140 141 GLN HA H 4.146 0.02 1 1542 140 141 GLN HB2 H 2.205 0.02 2 1543 140 141 GLN HE21 H 7.368 0.02 1 1544 140 141 GLN HE22 H 6.871 0.02 1 1545 140 141 GLN HG2 H 2.432 0.02 2 1546 140 141 GLN HG3 H 2.546 0.02 2 1547 140 141 GLN C C 179.197 0.2 1 1548 140 141 GLN CA C 58.919 0.2 1 1549 140 141 GLN CB C 28.357 0.2 1 1550 140 141 GLN CG C 34.020 0.2 1 1551 140 141 GLN N N 119.065 0.2 1 1552 140 141 GLN NE2 N 110.791 0.2 1 1553 141 142 LEU H H 7.785 0.02 1 1554 141 142 LEU HA H 4.234 0.02 1 1555 141 142 LEU HB2 H 2.016 0.02 2 1556 141 142 LEU HB3 H 1.523 0.02 2 1557 141 142 LEU HD1 H 0.931 0.02 1 1558 141 142 LEU HD2 H 0.877 0.02 1 1559 141 142 LEU HG H 1.851 0.02 1 1560 141 142 LEU C C 178.999 0.2 1 1561 141 142 LEU CA C 57.010 0.2 1 1562 141 142 LEU CB C 42.438 0.2 1 1563 141 142 LEU CD1 C 22.924 0.2 1 1564 141 142 LEU CD2 C 26.325 0.2 1 1565 141 142 LEU CG C 27.576 0.2 1 1566 141 142 LEU N N 119.772 0.2 1 1567 142 143 LEU H H 7.977 0.02 1 1568 142 143 LEU HA H 4.277 0.02 1 1569 142 143 LEU HB2 H 1.963 0.02 2 1570 142 143 LEU HB3 H 1.704 0.02 2 1571 142 143 LEU HD1 H 0.957 0.02 2 1572 142 143 LEU HD2 H 0.913 0.02 2 1573 142 143 LEU HG H 1.945 0.02 1 1574 142 143 LEU C C 178.323 0.2 1 1575 142 143 LEU CA C 56.181 0.2 1 1576 142 143 LEU CB C 42.556 0.2 1 1577 142 143 LEU CD1 C 26.325 0.2 2 1578 142 143 LEU CD2 C 23.009 0.2 2 1579 142 143 LEU CG C 26.562 0.2 1 1580 142 143 LEU N N 119.136 0.2 1 1581 143 144 GLY H H 7.818 0.02 1 1582 143 144 GLY HA2 H 4.080 0.02 2 1583 143 144 GLY C C 174.296 0.2 1 1584 143 144 GLY CA C 45.755 0.2 1 1585 143 144 GLY N N 106.774 0.2 1 1586 144 145 SER H H 8.025 0.02 1 1587 144 145 SER HA H 4.605 0.02 1 1588 144 145 SER HB2 H 3.919 0.02 2 1589 144 145 SER HB3 H 3.948 0.02 2 1590 144 145 SER C C 173.443 0.2 1 1591 144 145 SER CA C 58.181 0.2 1 1592 144 145 SER CB C 64.237 0.2 1 1593 144 145 SER N N 115.479 0.2 1 1594 145 146 ASN H H 8.086 0.02 1 1595 145 146 ASN HA H 4.561 0.02 1 1596 145 146 ASN HB2 H 2.728 0.02 2 1597 145 146 ASN HB3 H 2.826 0.02 2 1598 145 146 ASN HD21 H 7.534 0.02 1 1599 145 146 ASN HD22 H 6.823 0.02 1 1600 145 146 ASN CA C 54.989 0.2 1 1601 145 146 ASN CB C 40.661 0.2 1 1602 145 146 ASN N N 125.940 0.2 1 1603 145 146 ASN ND2 N 112.671 0.2 1 stop_ save_