data_18953 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution Structure of gammaM7-Crystallin ; _BMRB_accession_number 18953 _BMRB_flat_file_name bmr18953.str _Entry_type original _Submission_date 2013-01-16 _Accession_date 2013-01-16 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mahler Bryon . . 2 Wu Zhengrong . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 689 "13C chemical shifts" 648 "15N chemical shifts" 165 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-12-11 update BMRB 'update entry citation' 2013-06-04 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structure and Dynamics of the Fish Eye Lens Protein, M7-Crystallin.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 23597261 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mahler Bryon . . 2 Chen Yingwei . . 3 Ford Jason . . 4 Thiel Caleb . . 5 Wistow Graeme . . 6 Wu Zhengrong . . stop_ _Journal_abbreviation Biochemistry _Journal_name_full Biochemistry _Journal_volume 52 _Journal_issue 20 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 3579 _Page_last 3587 _Year 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name gammaM-crystallin _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label gammaM-crystallin $gammaM-crystallin 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_gammaM-crystallin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity _Molecular_mass 20937.965 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 174 _Mol_residue_sequence ; MGKIIFYEDRNFGGRYHECM SDCADLHSYFNRCHSIRVES GCFMVYDRTNFMGRQYFLRR GEYPDYMRTMGMNDCVRSCR MIPLHHGSFKMRLYEHSDMG GRMMELMDDCPNLMDRFNMS DFHSCHVMDGHWLVYEQPNY TGRQFYLRPGEYRSYNDWGG VTSRMGSIRRITDL ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 MET 2 2 GLY 3 3 LYS 4 4 ILE 5 5 ILE 6 6 PHE 7 7 TYR 8 8 GLU 9 9 ASP 10 10 ARG 11 11 ASN 12 12 PHE 13 13 GLY 14 14 GLY 15 15 ARG 16 16 TYR 17 17 HIS 18 18 GLU 19 19 CYS 20 20 MET 21 21 SER 22 22 ASP 23 23 CYS 24 24 ALA 25 25 ASP 26 26 LEU 27 27 HIS 28 28 SER 29 29 TYR 30 30 PHE 31 31 ASN 32 32 ARG 33 33 CYS 34 34 HIS 35 35 SER 36 36 ILE 37 37 ARG 38 38 VAL 39 39 GLU 40 40 SER 41 41 GLY 42 42 CYS 43 43 PHE 44 44 MET 45 45 VAL 46 46 TYR 47 47 ASP 48 48 ARG 49 49 THR 50 50 ASN 51 51 PHE 52 52 MET 53 53 GLY 54 54 ARG 55 55 GLN 56 56 TYR 57 57 PHE 58 58 LEU 59 59 ARG 60 60 ARG 61 61 GLY 62 62 GLU 63 63 TYR 64 64 PRO 65 65 ASP 66 66 TYR 67 67 MET 68 68 ARG 69 69 THR 70 70 MET 71 71 GLY 72 72 MET 73 73 ASN 74 74 ASP 75 75 CYS 76 76 VAL 77 77 ARG 78 78 SER 79 79 CYS 80 80 ARG 81 81 MET 82 82 ILE 83 83 PRO 84 84 LEU 85 85 HIS 86 86 HIS 87 87 GLY 88 88 SER 89 89 PHE 90 90 LYS 91 91 MET 92 92 ARG 93 93 LEU 94 94 TYR 95 95 GLU 96 96 HIS 97 97 SER 98 98 ASP 99 99 MET 100 100 GLY 101 101 GLY 102 102 ARG 103 103 MET 104 104 MET 105 105 GLU 106 106 LEU 107 107 MET 108 108 ASP 109 109 ASP 110 110 CYS 111 111 PRO 112 112 ASN 113 113 LEU 114 114 MET 115 115 ASP 116 116 ARG 117 117 PHE 118 118 ASN 119 119 MET 120 120 SER 121 121 ASP 122 122 PHE 123 123 HIS 124 124 SER 125 125 CYS 126 126 HIS 127 127 VAL 128 128 MET 129 129 ASP 130 130 GLY 131 131 HIS 132 132 TRP 133 133 LEU 134 134 VAL 135 135 TYR 136 136 GLU 137 137 GLN 138 138 PRO 139 139 ASN 140 140 TYR 141 141 THR 142 142 GLY 143 143 ARG 144 144 GLN 145 145 PHE 146 146 TYR 147 147 LEU 148 148 ARG 149 149 PRO 150 150 GLY 151 151 GLU 152 152 TYR 153 153 ARG 154 154 SER 155 155 TYR 156 156 ASN 157 157 ASP 158 158 TRP 159 159 GLY 160 160 GLY 161 161 VAL 162 162 THR 163 163 SER 164 164 ARG 165 165 MET 166 166 GLY 167 167 SER 168 168 ILE 169 169 ARG 170 170 ARG 171 171 ILE 172 172 THR 173 173 ASP 174 174 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-03-03 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 2M3C "Solution Structure Of Gammam7-crystallin" 100.00 174 100.00 100.00 3.32e-124 GB AAI62654 "Crystallin, gamma M7 [Danio rerio]" 100.00 174 100.00 100.00 3.32e-124 GB AAI62659 "Crystallin, gamma M7 [Danio rerio]" 100.00 174 100.00 100.00 3.32e-124 GB AAU85784 "gammaM7-crystallin [Danio rerio]" 100.00 174 100.00 100.00 3.32e-124 REF NP_001018631 "crystallin, gamma M7 [Danio rerio]" 100.00 174 100.00 100.00 3.32e-124 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $gammaM-crystallin Zebrafish 7955 Eukaryota Metazoa Danio rerio crygm7 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Variant _Vector_name $gammaM-crystallin 'recombinant technology' . Escherichia coli BL21(DE3) pLysS pET 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 imidazole 25 mM [U-2H] 'potassium chloride' 20 mM 'natural abundance' DTT 2 mM 'natural abundance' 'sodium azide' 0.04 % 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, 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' 'data analysis' 'peak picking' stop_ _Details . save_ save_X-PLOR_NIH _Saveframe_category software _Name 'X-PLOR NIH' _Version . loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task refinement 'structure solution' stop_ _Details . save_ save_AQUA _Saveframe_category software _Name AQUA _Version . loop_ _Vendor _Address _Electronic_address 'Rullmann, Doreleijers and Kaptein' . . stop_ loop_ _Task refinement stop_ _Details . save_ save_ProcheckNMR _Saveframe_category software _Name ProcheckNMR _Version . loop_ _Vendor _Address _Electronic_address 'Laskowski and MacArthur' . . stop_ loop_ _Task refinement stop_ _Details . save_ save_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_xwinnmr _Saveframe_category software _Name xwinnmr _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 800 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_15N-edited_NOESY-HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-edited NOESY-HSQC' _Sample_label $sample_1 save_ save_3D_13C-edited_HMQC-NOESY-HMQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-edited HMQC-NOESY-HMQC' _Sample_label $sample_1 save_ save_RDC_by_HSQC-TROSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name 'RDC by HSQC-TROSY' _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_CBCACONH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCACONH' _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' 20 . mM pH 6.2 . 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 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D HNCA' '3D CBCACONH' 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 gammaM-crystallin _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 2 GLY HA2 H 3.5650 0.000 2 2 2 2 GLY HA3 H 3.6600 0.000 2 3 2 2 GLY C C 182.7820 0.000 1 4 2 2 GLY CA C 43.5470 0.000 1 5 3 3 LYS H H 8.3980 0.000 1 6 3 3 LYS HA H 5.0150 0.000 1 7 3 3 LYS HB2 H 1.5990 0.000 2 8 3 3 LYS HB3 H 1.7830 0.000 2 9 3 3 LYS HG3 H 1.1240 0.000 2 10 3 3 LYS C C 179.1400 0.000 1 11 3 3 LYS CA C 57.3100 0.000 1 12 3 3 LYS CB C 35.6980 0.000 1 13 3 3 LYS CG C 25.3610 0.000 1 14 3 3 LYS CD C 29.2260 0.000 1 15 3 3 LYS CE C 41.9940 0.000 1 16 3 3 LYS N N 120.1530 0.000 1 17 4 4 ILE H H 8.8710 0.000 1 18 4 4 ILE HA H 4.6060 0.000 1 19 4 4 ILE HB H -0.1800 0.000 1 20 4 4 ILE HG12 H -0.6210 0.000 2 21 4 4 ILE HG13 H 0.6280 0.000 2 22 4 4 ILE HG2 H 0.1220 0.000 1 23 4 4 ILE HD1 H -0.0200 0.000 1 24 4 4 ILE C C 180.6180 0.000 1 25 4 4 ILE CA C 58.4000 0.000 1 26 4 4 ILE CB C 41.0190 0.000 1 27 4 4 ILE CG1 C 28.1000 0.000 1 28 4 4 ILE CG2 C 17.1000 0.000 1 29 4 4 ILE CD1 C 14.9360 0.000 1 30 4 4 ILE N N 129.7690 0.000 1 31 5 5 ILE H H 8.7880 0.000 1 32 5 5 ILE HA H 4.5080 0.000 1 33 5 5 ILE HB H 1.5920 0.000 1 34 5 5 ILE HG12 H 0.8140 0.000 2 35 5 5 ILE HG13 H 1.2160 0.000 2 36 5 5 ILE HG2 H 0.2630 0.000 1 37 5 5 ILE HD1 H 0.6970 0.000 1 38 5 5 ILE C C 177.5160 0.000 1 39 5 5 ILE CA C 60.8290 0.000 1 40 5 5 ILE CB C 40.4170 0.000 1 41 5 5 ILE CG1 C 28.1510 0.000 1 42 5 5 ILE CG2 C 20.0960 0.000 1 43 5 5 ILE CD1 C 15.2250 0.000 1 44 5 5 ILE N N 125.1030 0.000 1 45 6 6 PHE H H 8.5400 0.000 1 46 6 6 PHE HA H 4.6230 0.000 1 47 6 6 PHE HD1 H 7.3060 0.000 3 48 6 6 PHE C C 176.5120 0.000 1 49 6 6 PHE CA C 57.2190 0.000 1 50 6 6 PHE CB C 41.4830 0.000 1 51 6 6 PHE N N 125.5580 0.000 1 52 7 7 TYR H H 8.8890 0.000 1 53 7 7 TYR HA H 5.1710 0.000 1 54 7 7 TYR C C 173.8980 0.000 1 55 7 7 TYR CA C 57.4460 0.000 1 56 7 7 TYR CB C 39.3100 0.000 1 57 7 7 TYR N N 120.6470 0.000 1 58 8 8 GLU H H 8.7560 0.000 1 59 8 8 GLU HA H 4.1810 0.000 1 60 8 8 GLU HB2 H 2.0850 0.000 2 61 8 8 GLU HG2 H 2.4490 0.000 2 62 8 8 GLU HG3 H 2.4980 0.000 2 63 8 8 GLU C C 174.8810 0.000 1 64 8 8 GLU CA C 60.0660 0.000 1 65 8 8 GLU CB C 32.0520 0.000 1 66 8 8 GLU CG C 37.2080 0.000 1 67 8 8 GLU N N 122.0070 0.000 1 68 9 9 ASP H H 7.9770 0.000 1 69 9 9 ASP HA H 5.2220 0.000 1 70 9 9 ASP HB2 H 2.1420 0.000 2 71 9 9 ASP HB3 H 2.7300 0.000 2 72 9 9 ASP CA C 52.3660 0.000 1 73 9 9 ASP CB C 43.4360 0.000 1 74 9 9 ASP N N 114.2030 0.000 1 75 11 11 ASN HA H 3.1190 0.000 1 76 11 11 ASN HB2 H 1.8600 0.000 2 77 11 11 ASN HB3 H 2.7700 0.000 2 78 11 11 ASN CA C 56.6600 0.000 1 79 11 11 ASN CB C 35.0500 0.000 1 80 13 13 GLY C C 178.2810 0.000 1 81 13 13 GLY CA C 44.4460 0.000 1 82 14 14 GLY H H 8.2610 0.000 1 83 14 14 GLY HA2 H 3.8700 0.000 2 84 14 14 GLY HA3 H 4.2920 0.000 2 85 14 14 GLY C C 176.4630 0.000 1 86 14 14 GLY CA C 45.1110 0.000 1 87 14 14 GLY N N 105.3480 0.000 1 88 15 15 ARG H H 8.5790 0.000 1 89 15 15 ARG HA H 4.2110 0.000 1 90 15 15 ARG HB2 H 1.8030 0.000 2 91 15 15 ARG HG2 H 1.6930 0.000 2 92 15 15 ARG HD2 H 3.2880 0.000 2 93 15 15 ARG C C 176.5740 0.000 1 94 15 15 ARG CA C 57.3320 0.000 1 95 15 15 ARG CB C 31.4120 0.000 1 96 15 15 ARG CG C 27.5500 0.000 1 97 15 15 ARG CD C 43.7450 0.000 1 98 15 15 ARG N N 119.6370 0.000 1 99 16 16 TYR H H 7.6170 0.000 1 100 16 16 TYR HA H 5.8580 0.000 1 101 16 16 TYR HB2 H 1.9520 0.000 2 102 16 16 TYR HB3 H 2.3570 0.000 2 103 16 16 TYR C C 176.5100 0.000 1 104 16 16 TYR CA C 54.6130 0.000 1 105 16 16 TYR CB C 42.4180 0.000 1 106 16 16 TYR N N 114.8460 0.000 1 107 17 17 HIS H H 8.7850 0.000 1 108 17 17 HIS HA H 4.8100 0.000 1 109 17 17 HIS HB2 H 2.9220 0.000 2 110 17 17 HIS HB3 H 2.9800 0.000 2 111 17 17 HIS C C 177.9700 0.000 1 112 17 17 HIS CA C 55.5620 0.000 1 113 17 17 HIS CB C 33.6040 0.000 1 114 17 17 HIS N N 118.4430 0.000 1 115 18 18 GLU H H 8.5290 0.000 1 116 18 18 GLU HA H 4.8380 0.000 1 117 18 18 GLU HG2 H 2.0430 0.000 2 118 18 18 GLU HG3 H 2.2320 0.000 2 119 18 18 GLU C C 176.5040 0.000 1 120 18 18 GLU CA C 55.0990 0.000 1 121 18 18 GLU CB C 32.1220 0.000 1 122 18 18 GLU CG C 36.8040 0.000 1 123 18 18 GLU N N 126.2230 0.000 1 124 19 19 CYS H H 9.1630 0.000 1 125 19 19 CYS HA H 4.6570 0.000 1 126 19 19 CYS HB2 H 2.6370 0.000 2 127 19 19 CYS HB3 H 3.0400 0.000 2 128 19 19 CYS C C 178.0180 0.000 1 129 19 19 CYS CA C 58.7770 0.000 1 130 19 19 CYS CB C 29.8120 0.000 1 131 19 19 CYS N N 121.3830 0.000 1 132 20 20 MET H H 8.9950 0.000 1 133 20 20 MET HA H 5.2950 0.000 1 134 20 20 MET HB2 H 1.9390 0.000 2 135 20 20 MET HB3 H 2.5940 0.000 2 136 20 20 MET HG2 H 2.5180 0.000 2 137 20 20 MET HG3 H 2.7350 0.000 2 138 20 20 MET HE H 2.0780 0.000 1 139 20 20 MET C C 176.7760 0.000 1 140 20 20 MET CA C 55.2600 0.000 1 141 20 20 MET CB C 33.3700 0.000 1 142 20 20 MET CG C 32.6700 0.000 1 143 20 20 MET CE C 16.8900 0.000 1 144 20 20 MET N N 126.8770 0.000 1 145 21 21 SER H H 7.9900 0.000 1 146 21 21 SER HA H 4.6580 0.000 1 147 21 21 SER HB2 H 3.9400 0.000 2 148 21 21 SER HB3 H 4.1700 0.000 2 149 21 21 SER C C 179.0420 0.000 1 150 21 21 SER CA C 57.5860 0.000 1 151 21 21 SER CB C 65.7820 0.000 1 152 21 21 SER N N 179.0420 0.000 1 153 22 22 ASP H H 8.3170 0.000 1 154 22 22 ASP HA H 4.9510 0.000 1 155 22 22 ASP C C 173.5640 0.000 1 156 22 22 ASP CA C 55.4710 0.000 1 157 22 22 ASP CB C 41.8190 0.000 1 158 22 22 ASP N N 117.2030 0.000 1 159 23 23 CYS H H 9.4100 0.000 1 160 23 23 CYS HA H 4.7910 0.000 1 161 23 23 CYS HB2 H 2.8220 0.000 2 162 23 23 CYS HB3 H 3.1870 0.000 2 163 23 23 CYS C C 177.2650 0.000 1 164 23 23 CYS CA C 59.9630 0.000 1 165 23 23 CYS CB C 29.4120 0.000 1 166 23 23 CYS N N 121.3080 0.000 1 167 24 24 ALA H H 9.2100 0.000 1 168 24 24 ALA HA H 3.5220 0.000 1 169 24 24 ALA HB H 1.3700 0.000 1 170 24 24 ALA C C 175.4550 0.000 1 171 24 24 ALA CA C 54.6140 0.000 1 172 24 24 ALA CB C 19.1750 0.000 1 173 24 24 ALA N N 131.6930 0.000 1 174 25 25 ASP H H 7.5240 0.000 1 175 25 25 ASP HA H 4.8950 0.000 1 176 25 25 ASP C C 174.9700 0.000 1 177 25 25 ASP CA C 53.9200 0.000 1 178 25 25 ASP CB C 40.5640 0.000 1 179 25 25 ASP N N 113.8730 0.000 1 180 26 26 LEU H H 8.4950 0.000 1 181 26 26 LEU HA H 3.9990 0.000 1 182 26 26 LEU HB2 H 0.9090 0.000 2 183 26 26 LEU HB3 H 1.0970 0.000 2 184 26 26 LEU HG H 1.1980 0.000 1 185 26 26 LEU HD1 H 0.2250 0.000 2 186 26 26 LEU HD2 H 0.7140 0.000 2 187 26 26 LEU C C 173.7270 0.000 1 188 26 26 LEU CA C 56.1510 0.000 1 189 26 26 LEU CB C 42.3590 0.000 1 190 26 26 LEU CG C 27.5090 0.000 1 191 26 26 LEU CD1 C 25.8950 0.000 2 192 26 26 LEU CD2 C 23.9360 0.000 2 193 26 26 LEU N N 127.1660 0.000 1 194 27 27 HIS H H 8.4460 0.000 1 195 27 27 HIS HA H 4.5370 0.000 1 196 27 27 HIS HB3 H 3.1770 0.000 2 197 27 27 HIS HD2 H 7.3900 0.000 1 198 27 27 HIS C C 175.6670 0.000 1 199 27 27 HIS CA C 57.7930 0.000 1 200 27 27 HIS CB C 28.0380 0.000 1 201 27 27 HIS CD2 C 119.3400 0.000 1 202 27 27 HIS N N 118.7320 0.000 1 203 28 28 SER H H 7.2370 0.000 1 204 28 28 SER HA H 3.7920 0.000 1 205 28 28 SER HB2 H 3.0680 0.000 2 206 28 28 SER HB3 H 3.1900 0.000 2 207 28 28 SER C C 177.5510 0.000 1 208 28 28 SER CA C 60.4060 0.000 1 209 28 28 SER CB C 62.8140 0.000 1 210 28 28 SER N N 112.5980 0.000 1 211 29 29 TYR H H 7.2240 0.000 1 212 29 29 TYR HA H 4.3020 0.000 1 213 29 29 TYR HB2 H 2.0820 0.000 2 214 29 29 TYR HB3 H 2.5410 0.000 2 215 29 29 TYR HD1 H 6.7130 0.000 3 216 29 29 TYR C C 176.2830 0.000 1 217 29 29 TYR CA C 58.6680 0.000 1 218 29 29 TYR CB C 39.4710 0.000 1 219 29 29 TYR N N 118.3010 0.000 1 220 30 30 PHE H H 7.1730 0.000 1 221 30 30 PHE HA H 4.6820 0.000 1 222 30 30 PHE HB2 H 3.1600 0.000 2 223 30 30 PHE HD2 H 6.8000 0.000 3 224 30 30 PHE HE2 H 6.6400 0.000 3 225 30 30 PHE C C 177.7850 0.000 1 226 30 30 PHE CA C 55.9240 0.000 1 227 30 30 PHE CB C 39.7440 0.000 1 228 30 30 PHE N N 112.7130 0.000 1 229 31 31 ASN H H 8.9180 0.000 1 230 31 31 ASN HA H 4.7100 0.000 1 231 31 31 ASN HB2 H 2.7330 0.000 2 232 31 31 ASN HB3 H 2.8710 0.000 2 233 31 31 ASN C C 176.5370 0.000 1 234 31 31 ASN CA C 53.5510 0.000 1 235 31 31 ASN CB C 40.0560 0.000 1 236 31 31 ASN N N 115.9590 0.000 1 237 32 32 ARG H H 7.8930 0.000 1 238 32 32 ARG HA H 4.6270 0.000 1 239 32 32 ARG HB2 H 1.7460 0.000 2 240 32 32 ARG HB3 H 1.8620 0.000 2 241 32 32 ARG HD2 H 3.1300 0.000 2 242 32 32 ARG HD3 H 3.2160 0.000 2 243 32 32 ARG C C 178.1770 0.000 1 244 32 32 ARG CA C 55.1560 0.000 1 245 32 32 ARG CB C 33.0910 0.000 1 246 32 32 ARG CG C 26.3520 0.000 1 247 32 32 ARG CD C 43.8410 0.000 1 248 32 32 ARG N N 117.6930 0.000 1 249 33 33 CYS H H 8.1610 0.000 1 250 33 33 CYS HA H 4.9520 0.000 1 251 33 33 CYS HB2 H 2.2850 0.000 2 252 33 33 CYS HB3 H 2.5770 0.000 2 253 33 33 CYS C C 176.2230 0.000 1 254 33 33 CYS CA C 58.3070 0.000 1 255 33 33 CYS CB C 28.7510 0.000 1 256 33 33 CYS N N 119.4940 0.000 1 257 34 34 HIS H H 8.3250 0.000 1 258 34 34 HIS HA H 5.0220 0.000 1 259 34 34 HIS HB3 H 3.2750 0.000 2 260 34 34 HIS C C 176.2240 0.000 1 261 34 34 HIS CA C 56.6980 0.000 1 262 34 34 HIS CB C 33.3090 0.000 1 263 34 34 HIS N N 126.7860 0.000 1 264 35 35 SER H H 8.4890 0.000 1 265 35 35 SER HA H 5.2640 0.000 1 266 35 35 SER C C 179.0930 0.000 1 267 35 35 SER CA C 59.9510 0.000 1 268 35 35 SER CB C 65.7540 0.000 1 269 35 35 SER N N 113.1320 0.000 1 270 36 36 ILE H H 8.5790 0.000 1 271 36 36 ILE HA H 5.3690 0.000 1 272 36 36 ILE HB H 1.3130 0.000 1 273 36 36 ILE HG12 H 0.9110 0.000 2 274 36 36 ILE HG13 H 1.4190 0.000 2 275 36 36 ILE HG2 H 0.4050 0.000 1 276 36 36 ILE HD1 H -0.0830 0.000 1 277 36 36 ILE C C 176.3130 0.000 1 278 36 36 ILE CA C 60.4940 0.000 1 279 36 36 ILE CB C 45.7700 0.000 1 280 36 36 ILE CG1 C 29.5100 0.000 1 281 36 36 ILE CG2 C 17.6610 0.000 1 282 36 36 ILE CD1 C 12.9990 0.000 1 283 36 36 ILE N N 119.6070 0.000 1 284 37 37 ARG H H 9.3420 0.000 1 285 37 37 ARG HA H 4.9590 0.000 1 286 37 37 ARG HG2 H 0.9970 0.000 2 287 37 37 ARG HG3 H 1.3970 0.000 2 288 37 37 ARG C C 176.7850 0.000 1 289 37 37 ARG CA C 56.1140 0.000 1 290 37 37 ARG CB C 34.3340 0.000 1 291 37 37 ARG CG C 29.5530 0.000 1 292 37 37 ARG CD C 42.6870 0.000 1 293 37 37 ARG N N 126.3280 0.000 1 294 38 38 VAL H H 9.1220 0.000 1 295 38 38 VAL HA H 4.3240 0.000 1 296 38 38 VAL HB H 2.3800 0.000 1 297 38 38 VAL HG1 H 0.7080 0.000 2 298 38 38 VAL HG2 H 0.6100 0.000 2 299 38 38 VAL C C 175.1960 0.000 1 300 38 38 VAL CA C 62.4360 0.000 1 301 38 38 VAL CB C 31.6740 0.000 1 302 38 38 VAL CG1 C 21.9550 0.000 2 303 38 38 VAL CG2 C 21.7910 0.000 2 304 38 38 VAL N N 125.4660 0.000 1 305 39 39 GLU H H 8.2580 0.000 1 306 39 39 GLU HA H 4.0840 0.000 1 307 39 39 GLU HG2 H 2.0550 0.000 2 308 39 39 GLU HG3 H 2.1250 0.000 2 309 39 39 GLU C C 175.2000 0.000 1 310 39 39 GLU CA C 58.4980 0.000 1 311 39 39 GLU CB C 31.8300 0.000 1 312 39 39 GLU CG C 36.8210 0.000 1 313 39 39 GLU N N 128.5820 0.000 1 314 40 40 SER H H 7.7530 0.000 1 315 40 40 SER HA H 4.3430 0.000 1 316 40 40 SER HB2 H 3.8000 0.000 2 317 40 40 SER HB3 H 3.9400 0.000 2 318 40 40 SER C C 178.0000 0.000 1 319 40 40 SER CA C 57.6230 0.000 1 320 40 40 SER CB C 64.5390 0.000 1 321 40 40 SER N N 108.4120 0.000 1 322 41 41 GLY H H 8.7140 0.000 1 323 41 41 GLY HA2 H 3.7060 0.000 2 324 41 41 GLY HA3 H 4.0880 0.000 2 325 41 41 GLY C C 179.8550 0.000 1 326 41 41 GLY CA C 44.8840 0.000 1 327 41 41 GLY N N 109.4510 0.000 1 328 42 42 CYS H H 7.7940 0.000 1 329 42 42 CYS HA H 4.9340 0.000 1 330 42 42 CYS HB2 H 2.4800 0.000 2 331 42 42 CYS HB3 H 2.7400 0.000 2 332 42 42 CYS C C 178.6630 0.000 1 333 42 42 CYS CA C 56.8770 0.000 1 334 42 42 CYS CB C 31.6790 0.000 1 335 42 42 CYS N N 112.2950 0.000 1 336 43 43 PHE H H 8.5090 0.000 1 337 43 43 PHE HA H 5.1240 0.000 1 338 43 43 PHE HD1 H 6.7740 0.000 3 339 43 43 PHE C C 178.0450 0.000 1 340 43 43 PHE CA C 56.4900 0.000 1 341 43 43 PHE CB C 44.9570 0.000 1 342 43 43 PHE N N 118.8410 0.000 1 343 44 44 MET H H 9.1100 0.000 1 344 44 44 MET HA H 5.4420 0.000 1 345 44 44 MET HE H 1.7930 0.000 1 346 44 44 MET C C 174.3360 0.000 1 347 44 44 MET CA C 52.9920 0.000 1 348 44 44 MET CB C 33.8350 0.000 1 349 44 44 MET CG C 31.8430 0.000 1 350 44 44 MET CE C 17.2110 0.000 1 351 44 44 MET N N 119.4940 0.000 1 352 45 45 VAL H H 9.3450 0.000 1 353 45 45 VAL HA H 5.3870 0.000 1 354 45 45 VAL HB H 2.4000 0.000 1 355 45 45 VAL HG1 H 0.8900 0.000 2 356 45 45 VAL HG2 H 0.8240 0.000 2 357 45 45 VAL C C 177.8440 0.000 1 358 45 45 VAL CA C 59.6330 0.000 1 359 45 45 VAL CB C 34.2800 0.000 1 360 45 45 VAL CG1 C 21.9610 0.000 2 361 45 45 VAL CG2 C 18.9400 0.000 2 362 45 45 VAL N N 117.6660 0.000 1 363 46 46 TYR H H 8.1450 0.000 1 364 46 46 TYR HA H 6.0050 0.000 1 365 46 46 TYR HB2 H 3.1500 0.000 2 366 46 46 TYR HB3 H 3.8620 0.000 2 367 46 46 TYR C C 173.1520 0.000 1 368 46 46 TYR CA C 56.6830 0.000 1 369 46 46 TYR CB C 41.0250 0.000 1 370 46 46 TYR N N 117.8760 0.000 1 371 47 47 ASP H H 8.6900 0.000 1 372 47 47 ASP HA H 4.8850 0.000 1 373 47 47 ASP HB2 H 2.6060 0.000 2 374 47 47 ASP HB3 H 3.3210 0.000 2 375 47 47 ASP C C 176.0400 0.000 1 376 47 47 ASP CA C 53.8260 0.000 1 377 47 47 ASP CB C 41.0670 0.000 1 378 47 47 ASP N N 119.7830 0.000 1 379 48 48 ARG H H 7.6270 0.000 1 380 48 48 ARG HA H 4.7380 0.000 1 381 48 48 ARG HB2 H 1.4880 0.000 2 382 48 48 ARG HB3 H 1.9560 0.000 2 383 48 48 ARG HD2 H 3.1920 0.000 2 384 48 48 ARG HD3 H 3.2880 0.000 2 385 48 48 ARG C C 175.4950 0.000 1 386 48 48 ARG CA C 54.3450 0.000 1 387 48 48 ARG CB C 34.6620 0.000 1 388 48 48 ARG CG C 27.0830 0.000 1 389 48 48 ARG CD C 43.7070 0.000 1 390 48 48 ARG N N 116.0080 0.000 1 391 49 49 THR H H 8.1730 0.000 1 392 49 49 THR HA H 3.7900 0.000 1 393 49 49 THR HB H 4.3410 0.000 1 394 49 49 THR HG2 H 1.2920 0.000 1 395 49 49 THR C C 176.9510 0.000 1 396 49 49 THR CA C 62.1120 0.000 1 397 49 49 THR CB C 70.1890 0.000 1 398 49 49 THR CG2 C 23.1350 0.000 1 399 49 49 THR N N 110.5260 0.000 1 400 50 50 ASN H H 9.6540 0.000 1 401 50 50 ASN HA H 3.2490 0.000 1 402 50 50 ASN HB2 H 2.5820 0.000 2 403 50 50 ASN HB3 H 2.8450 0.000 2 404 50 50 ASN C C 178.1720 0.000 1 405 50 50 ASN CA C 54.3770 0.000 1 406 50 50 ASN CB C 36.9070 0.000 1 407 50 50 ASN N N 112.5150 0.000 1 408 51 51 PHE H H 7.5680 0.000 1 409 51 51 PHE HA H 2.6500 0.000 1 410 51 51 PHE C C 176.2920 0.000 1 411 51 51 PHE CA C 55.6680 0.000 1 412 51 51 PHE CB C 35.9320 0.000 1 413 51 51 PHE N N 110.5570 0.000 1 414 52 52 MET H H 6.3550 0.000 1 415 52 52 MET HA H 4.8590 0.000 1 416 52 52 MET HB2 H 2.1210 0.000 2 417 52 52 MET HB3 H 1.9240 0.000 2 418 52 52 MET HG2 H 2.5200 0.000 2 419 52 52 MET HG3 H 2.6300 0.000 2 420 52 52 MET HE H 2.1570 0.000 1 421 52 52 MET C C 177.3990 0.000 1 422 52 52 MET CA C 53.9460 0.000 1 423 52 52 MET CB C 35.3350 0.000 1 424 52 52 MET CG C 32.3490 0.000 1 425 52 52 MET CE C 17.4080 0.000 1 426 52 52 MET N N 117.5470 0.000 1 427 53 53 GLY H H 8.2560 0.000 1 428 53 53 GLY HA2 H 3.7720 0.000 2 429 53 53 GLY HA3 H 4.6520 0.000 2 430 53 53 GLY C C 175.3270 0.000 1 431 53 53 GLY CA C 44.5830 0.000 1 432 53 53 GLY N N 103.4450 0.000 1 433 54 54 ARG H H 9.0340 0.000 1 434 54 54 ARG HA H 4.1620 0.000 1 435 54 54 ARG HB2 H 1.8160 0.000 2 436 54 54 ARG HB3 H 1.8620 0.000 2 437 54 54 ARG HD2 H 3.3060 0.000 2 438 54 54 ARG C C 177.2350 0.000 1 439 54 54 ARG CA C 57.2000 0.000 1 440 54 54 ARG CB C 31.2150 0.000 1 441 54 54 ARG CG C 28.1560 0.000 1 442 54 54 ARG CD C 43.6960 0.000 1 443 54 54 ARG N N 124.1950 0.000 1 444 55 55 GLN H H 7.6570 0.000 1 445 55 55 GLN HA H 5.0190 0.000 1 446 55 55 GLN HB2 H 1.5900 0.000 2 447 55 55 GLN HB3 H 1.6400 0.000 2 448 55 55 GLN HG2 H 2.4500 0.000 2 449 55 55 GLN HG3 H 2.5200 0.000 2 450 55 55 GLN C C 176.1660 0.000 1 451 55 55 GLN CA C 53.1140 0.000 1 452 55 55 GLN CB C 31.4710 0.000 1 453 55 55 GLN CG C 33.8750 0.000 1 454 55 55 GLN N N 118.8670 0.000 1 455 56 56 TYR H H 8.7040 0.000 1 456 56 56 TYR HA H 4.4500 0.000 1 457 56 56 TYR HB2 H 2.4510 0.000 2 458 56 56 TYR HB3 H 2.7230 0.000 2 459 56 56 TYR C C 177.2760 0.000 1 460 56 56 TYR CA C 57.2130 0.000 1 461 56 56 TYR CB C 41.5600 0.000 1 462 56 56 TYR N N 117.3230 0.000 1 463 57 57 PHE H H 8.6000 0.000 1 464 57 57 PHE HA H 5.2170 0.000 1 465 57 57 PHE HB3 H 2.8400 0.000 2 466 57 57 PHE C C 176.4120 0.000 1 467 57 57 PHE CA C 58.3710 0.000 1 468 57 57 PHE CB C 40.9890 0.000 1 469 57 57 PHE N N 125.5570 0.000 1 470 58 58 LEU H H 8.9690 0.000 1 471 58 58 LEU HA H 4.3550 0.000 1 472 58 58 LEU HB2 H 0.9710 0.000 2 473 58 58 LEU HB3 H 1.3800 0.000 2 474 58 58 LEU HG H 1.1890 0.000 1 475 58 58 LEU HD1 H 0.2440 0.000 2 476 58 58 LEU HD2 H 0.0460 0.000 2 477 58 58 LEU C C 177.3560 0.000 1 478 58 58 LEU CA C 53.8500 0.000 1 479 58 58 LEU CB C 44.8860 0.000 1 480 58 58 LEU CG C 26.4950 0.000 1 481 58 58 LEU CD1 C 27.1840 0.000 2 482 58 58 LEU CD2 C 22.6850 0.000 2 483 58 58 LEU N N 129.1410 0.000 1 484 59 59 ARG H H 7.1070 0.000 1 485 59 59 ARG HA H 4.5630 0.000 1 486 59 59 ARG C C 175.3410 0.000 1 487 59 59 ARG CA C 53.7340 0.000 1 488 59 59 ARG CB C 32.3960 0.000 1 489 59 59 ARG CG C 26.2710 0.000 1 490 59 59 ARG CD C 43.9400 0.000 1 491 59 59 ARG N N 118.5690 0.000 1 492 60 60 ARG H H 8.2580 0.000 1 493 60 60 ARG HA H 3.9650 0.000 1 494 60 60 ARG HG2 H 1.4400 0.000 2 495 60 60 ARG HG3 H 1.6500 0.000 2 496 60 60 ARG HD2 H 3.2500 0.000 2 497 60 60 ARG HD3 H 3.2100 0.000 2 498 60 60 ARG C C 175.5250 0.000 1 499 60 60 ARG CA C 57.9540 0.000 1 500 60 60 ARG CB C 30.8900 0.000 1 501 60 60 ARG CG C 26.7390 0.000 1 502 60 60 ARG CD C 43.9700 0.000 1 503 60 60 ARG N N 121.6350 0.000 1 504 61 61 GLY H H 8.7060 0.000 1 505 61 61 GLY HA2 H 3.8140 0.000 2 506 61 61 GLY HA3 H 4.1460 0.000 2 507 61 61 GLY C C 180.5180 0.000 1 508 61 61 GLY CA C 44.6780 0.000 1 509 61 61 GLY N N 112.9550 0.000 1 510 62 62 GLU H H 8.1610 0.000 1 511 62 62 GLU HA H 4.5490 0.000 1 512 62 62 GLU HG2 H 1.8410 0.000 2 513 62 62 GLU HG3 H 2.1710 0.000 2 514 62 62 GLU C C 176.2490 0.000 1 515 62 62 GLU CA C 55.8130 0.000 1 516 62 62 GLU CB C 32.8440 0.000 1 517 62 62 GLU CG C 36.5040 0.000 1 518 62 62 GLU N N 117.5630 0.000 1 519 63 63 TYR H H 8.8270 0.000 1 520 63 63 TYR HA H 5.1760 0.000 1 521 63 63 TYR CA C 55.2730 0.000 1 522 63 63 TYR CB C 38.0480 0.000 1 523 63 63 TYR N N 119.0570 0.000 1 524 64 64 PRO HA H 3.6840 0.000 1 525 64 64 PRO HD2 H 3.4810 0.000 2 526 64 64 PRO HD3 H 4.0470 0.000 2 527 64 64 PRO CA C 64.9700 0.000 1 528 64 64 PRO CB C 32.1350 0.000 1 529 64 64 PRO CG C 26.5190 0.000 1 530 64 64 PRO CD C 51.5060 0.000 1 531 65 65 ASP H H 8.6000 0.000 1 532 65 65 ASP HA H 5.0470 0.000 1 533 65 65 ASP C C 174.1750 0.000 1 534 65 65 ASP CA C 53.5740 0.000 1 535 65 65 ASP CB C 39.8050 0.000 1 536 65 65 ASP N N 118.8100 0.000 1 537 66 66 TYR H H 6.5300 0.000 1 538 66 66 TYR HA H 4.4010 0.000 1 539 66 66 TYR HB2 H 2.7410 0.000 2 540 66 66 TYR HB3 H 3.2960 0.000 2 541 66 66 TYR C C 175.4310 0.000 1 542 66 66 TYR CA C 60.9730 0.000 1 543 66 66 TYR CB C 38.0240 0.000 1 544 66 66 TYR N N 119.6620 0.000 1 545 67 67 MET H H 8.2990 0.000 1 546 67 67 MET HA H 3.6260 0.000 1 547 67 67 MET HB2 H 1.7230 0.000 2 548 67 67 MET HG2 H 1.8090 0.000 2 549 67 67 MET HG3 H 1.8930 0.000 2 550 67 67 MET HE H 1.7500 0.000 1 551 67 67 MET C C 172.7420 0.000 1 552 67 67 MET CA C 59.9980 0.000 1 553 67 67 MET CB C 32.0640 0.000 1 554 67 67 MET CG C 33.1180 0.000 1 555 67 67 MET CE C 16.2860 0.000 1 556 67 67 MET N N 121.5020 0.000 1 557 68 68 ARG H H 6.9190 0.000 1 558 68 68 ARG HA H 4.1550 0.000 1 559 68 68 ARG C C 171.9820 0.000 1 560 68 68 ARG CA C 58.6000 0.000 1 561 68 68 ARG CB C 31.0560 0.000 1 562 68 68 ARG CG C 27.2210 0.000 1 563 68 68 ARG CD C 43.2890 0.000 1 564 68 68 ARG N N 116.8240 0.000 1 565 69 69 THR H H 8.0200 0.000 1 566 69 69 THR HA H 4.1010 0.000 1 567 69 69 THR HB H 4.2950 0.000 1 568 69 69 THR HG2 H 1.3360 0.000 1 569 69 69 THR C C 174.5840 0.000 1 570 69 69 THR CA C 65.5120 0.000 1 571 69 69 THR CB C 68.8210 0.000 1 572 69 69 THR CG2 C 22.0000 0.000 1 573 69 69 THR N N 111.2920 0.000 1 574 70 70 MET H H 8.3150 0.000 1 575 70 70 MET HA H 4.4960 0.000 1 576 70 70 MET HB2 H 2.3830 0.000 2 577 70 70 MET HG2 H 2.4690 0.000 2 578 70 70 MET HE H 1.8130 0.000 1 579 70 70 MET C C 175.0150 0.000 1 580 70 70 MET CA C 56.0290 0.000 1 581 70 70 MET CB C 33.0130 0.000 1 582 70 70 MET CG C 33.0100 0.000 1 583 70 70 MET CE C 17.9730 0.000 1 584 70 70 MET N N 117.4810 0.000 1 585 71 71 GLY H H 7.3520 0.000 1 586 71 71 GLY HA2 H 3.9000 0.000 2 587 71 71 GLY C C 176.5340 0.000 1 588 71 71 GLY CA C 47.2090 0.000 1 589 71 71 GLY N N 108.5370 0.000 1 590 72 72 MET H H 7.8880 0.000 1 591 72 72 MET HA H 4.3750 0.000 1 592 72 72 MET HB2 H 1.5990 0.000 2 593 72 72 MET HB3 H 2.3760 0.000 2 594 72 72 MET HG2 H 2.0680 0.000 2 595 72 72 MET HG3 H 2.2420 0.000 2 596 72 72 MET HE H 1.8300 0.000 1 597 72 72 MET C C 176.0340 0.000 1 598 72 72 MET CA C 55.8840 0.000 1 599 72 72 MET CB C 35.7560 0.000 1 600 72 72 MET CG C 32.3400 0.000 1 601 72 72 MET CE C 17.1800 0.000 1 602 72 72 MET N N 118.3630 0.000 1 603 73 73 ASN H H 8.9560 0.000 1 604 73 73 ASN HA H 4.7210 0.000 1 605 73 73 ASN HB2 H 2.7400 0.000 2 606 73 73 ASN HB3 H 2.8700 0.000 2 607 73 73 ASN C C 177.3070 0.000 1 608 73 73 ASN CA C 53.8660 0.000 1 609 73 73 ASN CB C 39.8720 0.000 1 610 73 73 ASN N N 119.0520 0.000 1 611 74 74 ASP H H 7.8310 0.000 1 612 74 74 ASP HA H 4.8760 0.000 1 613 74 74 ASP HB2 H 2.6770 0.000 2 614 74 74 ASP HB3 H 2.9930 0.000 2 615 74 74 ASP C C 177.5950 0.000 1 616 74 74 ASP CA C 52.5460 0.000 1 617 74 74 ASP CB C 44.0430 0.000 1 618 74 74 ASP N N 118.5360 0.000 1 619 75 75 CYS H H 8.5270 0.000 1 620 75 75 CYS HA H 4.6610 0.000 1 621 75 75 CYS HB2 H 2.9000 0.000 2 622 75 75 CYS HB3 H 3.0200 0.000 2 623 75 75 CYS C C 177.3010 0.000 1 624 75 75 CYS CA C 58.0720 0.000 1 625 75 75 CYS CB C 29.6130 0.000 1 626 75 75 CYS N N 116.3780 0.000 1 627 76 76 VAL H H 7.2960 0.000 1 628 76 76 VAL HA H 3.9100 0.000 1 629 76 76 VAL HB H 1.8640 0.000 1 630 76 76 VAL HG1 H 0.9440 0.000 2 631 76 76 VAL HG2 H 0.9150 0.000 2 632 76 76 VAL C C 175.9060 0.000 1 633 76 76 VAL CA C 63.8230 0.000 1 634 76 76 VAL CB C 32.7050 0.000 1 635 76 76 VAL CG1 C 22.8400 0.000 2 636 76 76 VAL CG2 C 21.2070 0.000 2 637 76 76 VAL N N 116.5160 0.000 1 638 77 77 ARG H H 8.9230 0.000 1 639 77 77 ARG HA H 4.3800 0.000 1 640 77 77 ARG C C 175.5190 0.000 1 641 77 77 ARG CA C 55.4080 0.000 1 642 77 77 ARG CB C 34.2120 0.000 1 643 77 77 ARG CG C 27.1740 0.000 1 644 77 77 ARG CD C 42.8740 0.000 1 645 77 77 ARG N N 120.4350 0.000 1 646 78 78 SER H H 8.1000 0.000 1 647 78 78 SER HA H 4.5330 0.000 1 648 78 78 SER C C 177.6030 0.000 1 649 78 78 SER CA C 59.5120 0.000 1 650 78 78 SER CB C 65.8830 0.000 1 651 78 78 SER N N 110.3150 0.000 1 652 79 79 CYS H H 9.4380 0.000 1 653 79 79 CYS HA H 6.3170 0.000 1 654 79 79 CYS HB2 H 3.0670 0.000 2 655 79 79 CYS HB3 H 3.3940 0.000 2 656 79 79 CYS C C 179.6010 0.000 1 657 79 79 CYS CA C 56.4790 0.000 1 658 79 79 CYS CB C 32.3500 0.000 1 659 79 79 CYS N N 112.9010 0.000 1 660 80 80 ARG H H 10.0050 0.000 1 661 80 80 ARG HA H 5.0270 0.000 1 662 80 80 ARG C C 176.8880 0.000 1 663 80 80 ARG CA C 54.6860 0.000 1 664 80 80 ARG CB C 34.6860 0.000 1 665 80 80 ARG CG C 27.9070 0.000 1 666 80 80 ARG CD C 43.9750 0.000 1 667 80 80 ARG N N 122.8770 0.000 1 668 81 81 MET H H 9.1980 0.000 1 669 81 81 MET HA H 3.4940 0.000 1 670 81 81 MET HB2 H 1.3700 0.000 2 671 81 81 MET HB3 H 2.0460 0.000 2 672 81 81 MET HG2 H 1.5630 0.000 2 673 81 81 MET HG3 H 1.7200 0.000 2 674 81 81 MET HE H 2.0100 0.000 1 675 81 81 MET C C 176.3690 0.000 1 676 81 81 MET CA C 55.5870 0.000 1 677 81 81 MET CB C 34.2410 0.000 1 678 81 81 MET CG C 31.2410 0.000 1 679 81 81 MET CE C 17.3270 0.000 1 680 81 81 MET N N 125.6990 0.000 1 681 82 82 ILE H H 7.7440 0.000 1 682 82 82 ILE HA H 4.0340 0.000 1 683 82 82 ILE HB H 1.5070 0.000 1 684 82 82 ILE HG12 H 0.4340 0.000 2 685 82 82 ILE HG13 H 1.0490 0.000 2 686 82 82 ILE HG2 H 0.7270 0.000 1 687 82 82 ILE HD1 H 0.3390 0.000 1 688 82 82 ILE CA C 58.8500 0.000 1 689 82 82 ILE CB C 38.1930 0.000 1 690 82 82 ILE CG1 C 27.0930 0.000 1 691 82 82 ILE CG2 C 16.0460 0.000 1 692 82 82 ILE CD1 C 13.5460 0.000 1 693 82 82 ILE N N 131.1190 0.000 1 694 83 83 PRO HA H 4.2010 0.000 1 695 83 83 PRO HD2 H 2.8490 0.000 2 696 83 83 PRO HD3 H 3.7490 0.000 2 697 83 83 PRO C C 176.4340 0.000 1 698 83 83 PRO CA C 62.4260 0.000 1 699 83 83 PRO CB C 32.3940 0.000 1 700 83 83 PRO CG C 27.0130 0.000 1 701 83 83 PRO CD C 50.7680 0.000 1 702 84 84 LEU H H 7.8730 0.000 1 703 84 84 LEU HA H 4.2400 0.000 1 704 84 84 LEU HB2 H 1.3770 0.000 2 705 84 84 LEU HB3 H 1.5470 0.000 2 706 84 84 LEU HG H 1.4870 0.000 1 707 84 84 LEU HD1 H 0.8820 0.000 2 708 84 84 LEU HD2 H 0.7930 0.000 2 709 84 84 LEU C C 174.8990 0.000 1 710 84 84 LEU CA C 54.5270 0.000 1 711 84 84 LEU CB C 41.5600 0.000 1 712 84 84 LEU CG C 26.9600 0.000 1 713 84 84 LEU CD1 C 24.9270 0.000 2 714 84 84 LEU CD2 C 24.2840 0.000 2 715 84 84 LEU N N 120.5090 0.000 1 716 85 85 HIS H H 8.6000 0.000 1 717 85 85 HIS HA H 4.5840 0.000 1 718 85 85 HIS CA C 56.1670 0.000 1 719 85 85 HIS CB C 32.6440 0.000 1 720 85 85 HIS N N 125.2450 0.000 1 721 86 86 HIS H H 8.5000 0.000 1 722 86 86 HIS HA H 4.7610 0.000 1 723 86 86 HIS C C 177.2500 0.000 1 724 86 86 HIS CA C 54.7090 0.000 1 725 86 86 HIS CB C 29.6700 0.000 1 726 87 87 GLY H H 6.6620 0.000 1 727 87 87 GLY HA2 H 3.6640 0.000 2 728 87 87 GLY HA3 H 4.0490 0.000 2 729 87 87 GLY C C 178.6270 0.000 1 730 87 87 GLY CA C 44.8610 0.000 1 731 87 87 GLY N N 107.9090 0.000 1 732 88 88 SER H H 8.2350 0.000 1 733 88 88 SER HA H 4.5280 0.000 1 734 88 88 SER HB3 H 3.8000 0.000 2 735 88 88 SER C C 178.5270 0.000 1 736 88 88 SER CA C 58.2790 0.000 1 737 88 88 SER CB C 64.3600 0.000 1 738 88 88 SER N N 116.7420 0.000 1 739 89 89 PHE H H 8.4780 0.000 1 740 89 89 PHE HA H 4.5680 0.000 1 741 89 89 PHE C C 176.5510 0.000 1 742 89 89 PHE CA C 56.7350 0.000 1 743 89 89 PHE CB C 41.3210 0.000 1 744 89 89 PHE N N 119.9850 0.000 1 745 90 90 LYS H H 9.1300 0.000 1 746 90 90 LYS HA H 5.1560 0.000 1 747 90 90 LYS HB2 H 1.7440 0.000 2 748 90 90 LYS HB3 H 2.0220 0.000 2 749 90 90 LYS HG3 H 1.2230 0.000 2 750 90 90 LYS C C 177.5010 0.000 1 751 90 90 LYS CA C 57.8120 0.000 1 752 90 90 LYS CB C 35.7010 0.000 1 753 90 90 LYS CG C 25.4350 0.000 1 754 90 90 LYS CD C 29.6410 0.000 1 755 90 90 LYS CE C 41.7970 0.000 1 756 90 90 LYS N N 122.1790 0.000 1 757 91 91 MET H H 9.2020 0.000 1 758 91 91 MET HA H 4.8350 0.000 1 759 91 91 MET HB3 H 1.1010 0.000 2 760 91 91 MET HG2 H 0.8320 0.000 2 761 91 91 MET HG3 H 1.3240 0.000 2 762 91 91 MET HE H 0.7910 0.000 1 763 91 91 MET C C 179.2760 0.000 1 764 91 91 MET CA C 54.5270 0.000 1 765 91 91 MET CB C 36.9200 0.000 1 766 91 91 MET CG C 29.7610 0.000 1 767 91 91 MET CE C 16.3010 0.000 1 768 91 91 MET N N 127.0370 0.000 1 769 92 92 ARG H H 8.7760 0.000 1 770 92 92 ARG HA H 4.8680 0.000 1 771 92 92 ARG HD2 H 3.0590 0.000 2 772 92 92 ARG HD3 H 3.2610 0.000 2 773 92 92 ARG C C 177.4320 0.000 1 774 92 92 ARG CA C 54.9980 0.000 1 775 92 92 ARG CB C 34.4850 0.000 1 776 92 92 ARG CD C 44.5000 0.000 1 777 92 92 ARG N N 121.5200 0.000 1 778 93 93 LEU H H 8.8410 0.000 1 779 93 93 LEU HA H 4.2750 0.000 1 780 93 93 LEU HB2 H 0.6400 0.000 2 781 93 93 LEU HB3 H 0.8030 0.000 2 782 93 93 LEU HG H 0.7940 0.000 1 783 93 93 LEU HD1 H -0.1440 0.000 2 784 93 93 LEU HD2 H 0.1390 0.000 2 785 93 93 LEU C C 176.6620 0.000 1 786 93 93 LEU CA C 53.6960 0.000 1 787 93 93 LEU CB C 44.8900 0.000 1 788 93 93 LEU CG C 26.2970 0.000 1 789 93 93 LEU CD1 C 24.8400 0.000 2 790 93 93 LEU CD2 C 23.4420 0.000 2 791 93 93 LEU N N 124.7490 0.000 1 792 94 94 TYR H H 8.1610 0.000 1 793 94 94 TYR HA H 5.4240 0.000 1 794 94 94 TYR C C 175.2320 0.000 1 795 94 94 TYR CA C 57.0610 0.000 1 796 94 94 TYR CB C 40.3630 0.000 1 797 94 94 TYR N N 116.6730 0.000 1 798 95 95 GLU H H 8.5370 0.000 1 799 95 95 GLU HA H 4.0340 0.000 1 800 95 95 GLU HB2 H 1.9420 0.000 2 801 95 95 GLU HG2 H 1.5010 0.000 2 802 95 95 GLU HG3 H 2.0460 0.000 2 803 95 95 GLU C C 174.5870 0.000 1 804 95 95 GLU CA C 58.9600 0.000 1 805 95 95 GLU CB C 33.5240 0.000 1 806 95 95 GLU CG C 34.4770 0.000 1 807 95 95 GLU N N 121.5560 0.000 1 808 96 96 HIS H H 8.1540 0.000 1 809 96 96 HIS HA H 5.3060 0.000 1 810 96 96 HIS C C 175.8300 0.000 1 811 96 96 HIS CA C 53.1460 0.000 1 812 96 96 HIS CB C 33.3640 0.000 1 813 96 96 HIS N N 113.2140 0.000 1 814 97 97 SER H H 8.7280 0.000 1 815 97 97 SER HA H 4.1960 0.000 1 816 97 97 SER HB2 H 4.0310 0.000 2 817 97 97 SER HB3 H 4.1490 0.000 2 818 97 97 SER C C 177.5880 0.000 1 819 97 97 SER CA C 59.1800 0.000 1 820 97 97 SER CB C 63.7400 0.000 1 821 97 97 SER N N 115.9970 0.000 1 822 98 98 ASP H H 9.7140 0.000 1 823 98 98 ASP HA H 3.9650 0.000 1 824 98 98 ASP HB2 H 2.4780 0.000 2 825 98 98 ASP HB3 H 2.7940 0.000 2 826 98 98 ASP C C 176.9910 0.000 1 827 98 98 ASP CA C 56.8730 0.000 1 828 98 98 ASP CB C 39.5140 0.000 1 829 98 98 ASP N N 116.5600 0.000 1 830 99 99 MET H H 8.4250 0.000 1 831 99 99 MET HA H 2.6890 0.000 1 832 99 99 MET HB2 H 0.9190 0.000 2 833 99 99 MET HB3 H 1.7660 0.000 2 834 99 99 MET HG2 H 1.9160 0.000 2 835 99 99 MET HG3 H 2.1030 0.000 2 836 99 99 MET HE H 1.7600 0.000 1 837 99 99 MET C C 176.1330 0.000 1 838 99 99 MET CA C 56.5960 0.000 1 839 99 99 MET CB C 27.2030 0.000 1 840 99 99 MET CG C 34.8340 0.000 1 841 99 99 MET CE C 18.3010 0.000 1 842 99 99 MET N N 112.1090 0.000 1 843 100 100 GLY H H 6.6700 0.000 1 844 100 100 GLY HA2 H 3.7050 0.000 2 845 100 100 GLY HA3 H 4.5290 0.000 2 846 100 100 GLY C C 177.8550 0.000 1 847 100 100 GLY CA C 44.3450 0.000 1 848 100 100 GLY N N 104.5720 0.000 1 849 101 101 GLY H H 8.4460 0.000 1 850 101 101 GLY HA2 H 3.8020 0.000 2 851 101 101 GLY HA3 H 3.9000 0.000 2 852 101 101 GLY C C 177.5250 0.000 1 853 101 101 GLY CA C 45.1060 0.000 1 854 101 101 GLY N N 105.7920 0.000 1 855 102 102 ARG H H 8.7850 0.000 1 856 102 102 ARG HA H 3.9980 0.000 1 857 102 102 ARG HD2 H 3.1690 0.000 2 858 102 102 ARG C C 177.8030 0.000 1 859 102 102 ARG CA C 58.3680 0.000 1 860 102 102 ARG CB C 31.6840 0.000 1 861 102 102 ARG CG C 27.5490 0.000 1 862 102 102 ARG CD C 44.1340 0.000 1 863 102 102 ARG N N 121.6880 0.000 1 864 103 103 MET H H 7.9050 0.000 1 865 103 103 MET HA H 4.7540 0.000 1 866 103 103 MET HG2 H 1.4650 0.000 2 867 103 103 MET HG3 H 2.0070 0.000 2 868 103 103 MET HE H 1.8950 0.000 1 869 103 103 MET C C 175.4900 0.000 1 870 103 103 MET CA C 53.9930 0.000 1 871 103 103 MET CB C 34.8600 0.000 1 872 103 103 MET CG C 32.7490 0.000 1 873 103 103 MET CE C 16.9750 0.000 1 874 103 103 MET N N 122.3710 0.000 1 875 104 104 MET H H 8.7960 0.000 1 876 104 104 MET HA H 4.3180 0.000 1 877 104 104 MET HB2 H 0.6930 0.000 2 878 104 104 MET HB3 H 0.9020 0.000 2 879 104 104 MET HE H 1.8280 0.000 1 880 104 104 MET C C 177.8700 0.000 1 881 104 104 MET CA C 54.0800 0.000 1 882 104 104 MET CB C 35.3150 0.000 1 883 104 104 MET CG C 32.7370 0.000 1 884 104 104 MET CE C 18.3030 0.000 1 885 104 104 MET N N 127.6290 0.000 1 886 105 105 GLU H H 8.4670 0.000 1 887 105 105 GLU HA H 4.8460 0.000 1 888 105 105 GLU HG2 H 1.9720 0.000 2 889 105 105 GLU HG3 H 2.0560 0.000 2 890 105 105 GLU C C 176.8710 0.000 1 891 105 105 GLU CA C 55.6880 0.000 1 892 105 105 GLU CB C 33.5150 0.000 1 893 105 105 GLU CG C 38.6520 0.000 1 894 105 105 GLU N N 123.7530 0.000 1 895 106 106 LEU H H 8.9330 0.000 1 896 106 106 LEU HA H 4.8880 0.000 1 897 106 106 LEU HB2 H 1.2100 0.000 2 898 106 106 LEU HB3 H 1.7070 0.000 2 899 106 106 LEU HG H 1.7740 0.000 1 900 106 106 LEU HD1 H 0.9220 0.000 2 901 106 106 LEU HD2 H 0.9120 0.000 2 902 106 106 LEU C C 175.6660 0.000 1 903 106 106 LEU CA C 54.9000 0.000 1 904 106 106 LEU CB C 46.7970 0.000 1 905 106 106 LEU CG C 27.5580 0.000 1 906 106 106 LEU CD1 C 25.7250 0.000 2 907 106 106 LEU CD2 C 26.0680 0.000 2 908 106 106 LEU N N 125.0760 0.000 1 909 107 107 MET H H 9.0990 0.000 1 910 107 107 MET HA H 5.1520 0.000 1 911 107 107 MET HB2 H 2.0090 0.000 2 912 107 107 MET HB3 H 2.6830 0.000 2 913 107 107 MET HE H 2.1780 0.000 1 914 107 107 MET C C 177.8730 0.000 1 915 107 107 MET CA C 55.4300 0.000 1 916 107 107 MET CB C 35.1070 0.000 1 917 107 107 MET CG C 32.7020 0.000 1 918 107 107 MET CE C 16.9850 0.000 1 919 107 107 MET N N 120.8890 0.000 1 920 108 108 ASP H H 7.8740 0.000 1 921 108 108 ASP HA H 4.4490 0.000 1 922 108 108 ASP C C 178.9980 0.000 1 923 108 108 ASP CA C 51.9530 0.000 1 924 108 108 ASP CB C 43.3350 0.000 1 925 108 108 ASP N N 120.2610 0.000 1 926 109 109 ASP H H 8.0650 0.000 1 927 109 109 ASP HA H 4.8380 0.000 1 928 109 109 ASP HB3 H 0.0000 0.000 2 929 109 109 ASP C C 174.7680 0.000 1 930 109 109 ASP CA C 55.1060 0.000 1 931 109 109 ASP CB C 41.0580 0.000 1 932 109 109 ASP N N 115.1910 0.000 1 933 110 110 CYS H H 9.5830 0.000 1 934 110 110 CYS HA H 5.1390 0.000 1 935 110 110 CYS HB2 H 2.6190 0.000 2 936 110 110 CYS HB3 H 2.8240 0.000 2 937 110 110 CYS CA C 55.8170 0.000 1 938 110 110 CYS CB C 29.7300 0.000 1 939 110 110 CYS N N 120.7160 0.000 1 940 111 111 PRO HA H 3.9710 0.000 1 941 111 111 PRO HD2 H 3.5620 0.000 2 942 111 111 PRO HD3 H 4.0680 0.000 2 943 111 111 PRO CA C 64.1440 0.000 1 944 111 111 PRO CB C 31.9090 0.000 1 945 111 111 PRO CG C 26.0970 0.000 1 946 111 111 PRO CD C 51.3130 0.000 1 947 111 111 PRO N N 176.2700 0.000 1 948 112 112 ASN H H 7.3850 0.000 1 949 112 112 ASN HA H 4.7750 0.000 1 950 112 112 ASN C C 175.9480 0.000 1 951 112 112 ASN CA C 54.1210 0.000 1 952 112 112 ASN CB C 38.7090 0.000 1 953 112 112 ASN N N 116.3000 0.000 1 954 113 113 LEU H H 8.1540 0.000 1 955 113 113 LEU HA H 4.1570 0.000 1 956 113 113 LEU HB2 H 1.9350 0.000 2 957 113 113 LEU HB3 H 1.9860 0.000 2 958 113 113 LEU HG H 1.4550 0.000 1 959 113 113 LEU HD1 H 0.7120 0.000 2 960 113 113 LEU HD2 H 0.9740 0.000 2 961 113 113 LEU C C 173.7090 0.000 1 962 113 113 LEU CA C 58.8890 0.000 1 963 113 113 LEU CB C 42.4510 0.000 1 964 113 113 LEU CG C 28.5340 0.000 1 965 113 113 LEU CD1 C 26.3880 0.000 2 966 113 113 LEU CD2 C 24.1870 0.000 2 967 113 113 LEU N N 129.8950 0.000 1 968 114 114 MET H H 8.4210 0.000 1 969 114 114 MET HA H 4.2040 0.000 1 970 114 114 MET HB2 H 2.0530 0.000 2 971 114 114 MET HB3 H 2.2870 0.000 2 972 114 114 MET HG2 H 2.5040 0.000 2 973 114 114 MET HG3 H 2.6340 0.000 2 974 114 114 MET HE H 2.0090 0.000 1 975 114 114 MET C C 171.9420 0.000 1 976 114 114 MET CA C 58.3540 0.000 1 977 114 114 MET CB C 31.1180 0.000 1 978 114 114 MET CG C 32.4950 0.000 1 979 114 114 MET CE C 17.0120 0.000 1 980 114 114 MET N N 120.9390 0.000 1 981 115 115 ASP H H 7.6950 0.000 1 982 115 115 ASP HA H 4.2730 0.000 1 983 115 115 ASP C C 174.2280 0.000 1 984 115 115 ASP CA C 56.7370 0.000 1 985 115 115 ASP CB C 40.6210 0.000 1 986 115 115 ASP N N 119.2040 0.000 1 987 116 116 ARG H H 7.1180 0.000 1 988 116 116 ARG HA H 4.0580 0.000 1 989 116 116 ARG HB2 H 1.1090 0.000 2 990 116 116 ARG HB3 H 1.4300 0.000 2 991 116 116 ARG HG2 H 0.4600 0.000 2 992 116 116 ARG HG3 H 0.5820 0.000 2 993 116 116 ARG C C 174.0840 0.000 1 994 116 116 ARG CA C 57.8390 0.000 1 995 116 116 ARG CB C 32.0990 0.000 1 996 116 116 ARG CG C 25.5360 0.000 1 997 116 116 ARG CD C 42.2840 0.000 1 998 116 116 ARG N N 116.9370 0.000 1 999 117 117 PHE H H 8.6410 0.000 1 1000 117 117 PHE HA H 5.1250 0.000 1 1001 117 117 PHE HB2 H 2.9800 0.000 2 1002 117 117 PHE HB3 H 3.6880 0.000 2 1003 117 117 PHE C C 175.6810 0.000 1 1004 117 117 PHE CA C 57.0400 0.000 1 1005 117 117 PHE CB C 41.8810 0.000 1 1006 117 117 PHE N N 113.9140 0.000 1 1007 118 118 ASN H H 8.4780 0.000 1 1008 118 118 ASN HA H 4.8460 0.000 1 1009 118 118 ASN HB2 H 2.8170 0.000 2 1010 118 118 ASN HB3 H 3.2500 0.000 2 1011 118 118 ASN C C 177.5530 0.000 1 1012 118 118 ASN CA C 55.0380 0.000 1 1013 118 118 ASN CB C 38.0490 0.000 1 1014 118 118 ASN N N 117.1370 0.000 1 1015 119 119 MET H H 7.2860 0.000 1 1016 119 119 MET HA H 4.3860 0.000 1 1017 119 119 MET HB2 H 1.7370 0.000 2 1018 119 119 MET HB3 H 1.8180 0.000 2 1019 119 119 MET HG2 H 2.1660 0.000 2 1020 119 119 MET HE H 1.8220 0.000 1 1021 119 119 MET C C 178.3210 0.000 1 1022 119 119 MET CA C 55.9500 0.000 1 1023 119 119 MET CB C 37.2330 0.000 1 1024 119 119 MET CG C 31.3410 0.000 1 1025 119 119 MET CE C 16.6370 0.000 1 1026 119 119 MET N N 114.3160 0.000 1 1027 120 120 SER H H 8.3610 0.000 1 1028 120 120 SER HA H 4.6820 0.000 1 1029 120 120 SER HB2 H 3.6810 0.000 2 1030 120 120 SER HB3 H 4.0340 0.000 2 1031 120 120 SER C C 179.0470 0.000 1 1032 120 120 SER CA C 57.4350 0.000 1 1033 120 120 SER CB C 65.5940 0.000 1 1034 120 120 SER N N 111.3100 0.000 1 1035 121 121 ASP H H 6.8290 0.000 1 1036 121 121 ASP HA H 5.0820 0.000 1 1037 121 121 ASP C C 177.5320 0.000 1 1038 121 121 ASP CA C 53.6300 0.000 1 1039 121 121 ASP CB C 43.5130 0.000 1 1040 121 121 ASP N N 120.4220 0.000 1 1041 122 122 PHE H H 8.3760 0.000 1 1042 122 122 PHE HA H 4.6950 0.000 1 1043 122 122 PHE HB2 H 3.1510 0.000 2 1044 122 122 PHE C C 177.3160 0.000 1 1045 122 122 PHE CA C 57.6600 0.000 1 1046 122 122 PHE CB C 40.8710 0.000 1 1047 122 122 PHE N N 120.6110 0.000 1 1048 123 123 HIS H H 7.5770 0.000 1 1049 123 123 HIS HA H 4.7650 0.000 1 1050 123 123 HIS C C 176.4310 0.000 1 1051 123 123 HIS CA C 57.6040 0.000 1 1052 123 123 HIS CB C 33.2800 0.000 1 1053 123 123 HIS N N 116.1930 0.000 1 1054 124 124 SER H H 8.2560 0.000 1 1055 124 124 SER HA H 4.6980 0.000 1 1056 124 124 SER C C 178.1790 0.000 1 1057 124 124 SER CA C 59.5560 0.000 1 1058 124 124 SER CB C 65.6670 0.000 1 1059 124 124 SER N N 107.3320 0.000 1 1060 125 125 CYS H H 9.5610 0.000 1 1061 125 125 CYS HA H 5.5510 0.000 1 1062 125 125 CYS HB2 H 2.6660 0.000 2 1063 125 125 CYS HB3 H 2.7560 0.000 2 1064 125 125 CYS C C 179.6550 0.000 1 1065 125 125 CYS CA C 57.8710 0.000 1 1066 125 125 CYS CB C 30.5860 0.000 1 1067 125 125 CYS N N 113.8740 0.000 1 1068 126 126 HIS H H 9.8580 0.000 1 1069 126 126 HIS HA H 5.4810 0.000 1 1070 126 126 HIS HB2 H 3.1160 0.000 2 1071 126 126 HIS HB3 H 3.4300 0.000 2 1072 126 126 HIS C C 176.5750 0.000 1 1073 126 126 HIS CA C 53.3070 0.000 1 1074 126 126 HIS CB C 35.1230 0.000 1 1075 126 126 HIS N N 124.8290 0.000 1 1076 127 127 VAL H H 9.4080 0.000 1 1077 127 127 VAL HA H 3.8740 0.000 1 1078 127 127 VAL HB H 2.5940 0.000 1 1079 127 127 VAL HG1 H 0.8090 0.000 2 1080 127 127 VAL HG2 H 0.7180 0.000 2 1081 127 127 VAL C C 176.6600 0.000 1 1082 127 127 VAL CA C 63.4850 0.000 1 1083 127 127 VAL CB C 30.9990 0.000 1 1084 127 127 VAL CG1 C 23.2580 0.000 2 1085 127 127 VAL CG2 C 22.4750 0.000 2 1086 127 127 VAL N N 128.6200 0.000 1 1087 128 128 MET H H 7.9060 0.000 1 1088 128 128 MET HA H 3.9300 0.000 1 1089 128 128 MET HB2 H 1.4180 0.000 2 1090 128 128 MET HB3 H 2.1480 0.000 2 1091 128 128 MET HE H 1.8570 0.000 1 1092 128 128 MET C C 176.0930 0.000 1 1093 128 128 MET CA C 58.1090 0.000 1 1094 128 128 MET CB C 34.0190 0.000 1 1095 128 128 MET CG C 28.6200 0.000 1 1096 128 128 MET CE C 16.9430 0.000 1 1097 128 128 MET N N 129.4660 0.000 1 1098 129 129 ASP H H 8.3490 0.000 1 1099 129 129 ASP HA H 4.8320 0.000 1 1100 129 129 ASP HB2 H 2.2780 0.000 2 1101 129 129 ASP HB3 H 2.5150 0.000 2 1102 129 129 ASP C C 174.9590 0.000 1 1103 129 129 ASP CA C 54.1800 0.000 1 1104 129 129 ASP CB C 45.1310 0.000 1 1105 129 129 ASP N N 116.4350 0.000 1 1106 130 130 GLY H H 8.4790 0.000 1 1107 130 130 GLY HA2 H 3.6320 0.000 2 1108 130 130 GLY HA3 H 2.1830 0.000 2 1109 130 130 GLY C C 183.6420 0.000 1 1110 130 130 GLY CA C 44.4720 0.000 1 1111 130 130 GLY N N 113.0620 0.000 1 1112 131 131 HIS H H 6.2280 0.000 1 1113 131 131 HIS HA H 5.0020 0.000 1 1114 131 131 HIS C C 176.4700 0.000 1 1115 131 131 HIS CA C 56.3180 0.000 1 1116 131 131 HIS CB C 34.0350 0.000 1 1117 131 131 HIS N N 114.3890 0.000 1 1118 132 132 TRP H H 8.8380 0.000 1 1119 132 132 TRP HA H 5.1350 0.000 1 1120 132 132 TRP HD1 H 6.8800 0.000 1 1121 132 132 TRP HE1 H 9.0710 0.000 1 1122 132 132 TRP HZ2 H 7.0750 0.000 1 1123 132 132 TRP C C 177.5570 0.000 1 1124 132 132 TRP CA C 56.8960 0.000 1 1125 132 132 TRP CB C 33.7950 0.000 1 1126 132 132 TRP CD1 C 127.8030 0.000 1 1127 132 132 TRP CZ2 C 113.6970 0.000 1 1128 132 132 TRP N N 122.3330 0.000 1 1129 132 132 TRP NE1 N 124.0140 0.000 1 1130 133 133 LEU H H 9.4030 0.000 1 1131 133 133 LEU HA H 5.1220 0.000 1 1132 133 133 LEU HB2 H 1.0190 0.000 2 1133 133 133 LEU HB3 H 1.2030 0.000 2 1134 133 133 LEU HG H 1.0500 0.000 1 1135 133 133 LEU HD1 H 0.0880 0.000 2 1136 133 133 LEU HD2 H 0.4920 0.000 2 1137 133 133 LEU C C 176.4570 0.000 1 1138 133 133 LEU CA C 53.5360 0.000 1 1139 133 133 LEU CB C 46.5700 0.000 1 1140 133 133 LEU CG C 26.0730 0.000 1 1141 133 133 LEU CD1 C 24.4130 0.000 2 1142 133 133 LEU CD2 C 24.3590 0.000 2 1143 133 133 LEU N N 121.8830 0.000 1 1144 134 134 VAL H H 8.9480 0.000 1 1145 134 134 VAL HA H 4.5590 0.000 1 1146 134 134 VAL HG1 H 0.8350 0.000 2 1147 134 134 VAL HG2 H 0.5670 0.000 2 1148 134 134 VAL C C 177.7800 0.000 1 1149 134 134 VAL CA C 60.9490 0.000 1 1150 134 134 VAL CB C 34.0890 0.000 1 1151 134 134 VAL CG1 C 20.9960 0.000 2 1152 134 134 VAL CG2 C 21.8570 0.000 2 1153 134 134 VAL N N 123.0130 0.000 1 1154 135 135 TYR H H 9.0680 0.000 1 1155 135 135 TYR HA H 5.5400 0.000 1 1156 135 135 TYR HB2 H 3.1850 0.000 2 1157 135 135 TYR HB3 H 3.4730 0.000 2 1158 135 135 TYR C C 172.4560 0.000 1 1159 135 135 TYR CA C 55.9970 0.000 1 1160 135 135 TYR CB C 39.7450 0.000 1 1161 135 135 TYR N N 122.4050 0.000 1 1162 136 136 GLU H H 9.3600 0.000 1 1163 136 136 GLU HA H 4.1030 0.000 1 1164 136 136 GLU HG2 H 2.4670 0.000 2 1165 136 136 GLU HG3 H 2.7050 0.000 2 1166 136 136 GLU C C 176.0220 0.000 1 1167 136 136 GLU CA C 59.8960 0.000 1 1168 136 136 GLU CB C 32.9270 0.000 1 1169 136 136 GLU CG C 38.6140 0.000 1 1170 136 136 GLU N N 121.3350 0.000 1 1171 137 137 GLN H H 7.8080 0.000 1 1172 137 137 GLN HA H 4.9670 0.000 1 1173 137 137 GLN HB2 H 1.9800 0.000 2 1174 137 137 GLN HB3 H 2.0340 0.000 2 1175 137 137 GLN HG2 H 2.3370 0.000 2 1176 137 137 GLN HG3 H 2.4010 0.000 2 1177 137 137 GLN CA C 52.8330 0.000 1 1178 137 137 GLN CB C 29.1420 0.000 1 1179 137 137 GLN CG C 33.8750 0.000 1 1180 137 137 GLN N N 111.5300 0.000 1 1181 138 138 PRO HA H 4.1420 0.000 1 1182 138 138 PRO HD2 H 3.6470 0.000 2 1183 138 138 PRO HD3 H 3.8220 0.000 2 1184 138 138 PRO C C 176.6070 0.000 1 1185 138 138 PRO CA C 62.4610 0.000 1 1186 138 138 PRO CB C 33.1930 0.000 1 1187 138 138 PRO CG C 27.7860 0.000 1 1188 138 138 PRO CD C 51.3110 0.000 1 1189 139 139 ASN H H 9.6830 0.000 1 1190 139 139 ASN HA H 3.3560 0.000 1 1191 139 139 ASN HB2 H 2.7030 0.000 2 1192 139 139 ASN HB3 H 2.7680 0.000 2 1193 139 139 ASN C C 177.9960 0.000 1 1194 139 139 ASN CA C 54.2470 0.000 1 1195 139 139 ASN CB C 36.6350 0.000 1 1196 139 139 ASN N N 113.2400 0.000 1 1197 140 140 TYR H H 8.0000 0.000 1 1198 140 140 TYR HA H 2.7600 0.000 1 1199 140 140 TYR C C 176.4880 0.000 1 1200 140 140 TYR CA C 55.2960 0.000 1 1201 140 140 TYR CB C 33.9600 0.000 1 1202 140 140 TYR N N 113.2890 0.000 1 1203 141 141 THR H H 6.2800 0.000 1 1204 141 141 THR HA H 4.6970 0.000 1 1205 141 141 THR HB H 4.0870 0.000 1 1206 141 141 THR HG2 H 1.1210 0.000 1 1207 141 141 THR C C 178.5780 0.000 1 1208 141 141 THR CA C 60.1280 0.000 1 1209 141 141 THR CB C 72.8480 0.000 1 1210 141 141 THR CG2 C 20.5730 0.000 1 1211 141 141 THR N N 108.7660 0.000 1 1212 142 142 GLY H H 8.2850 0.000 1 1213 142 142 GLY HA2 H 3.8600 0.000 2 1214 142 142 GLY HA3 H 4.4160 0.000 2 1215 142 142 GLY C C 177.1170 0.000 1 1216 142 142 GLY CA C 44.1670 0.000 1 1217 142 142 GLY N N 106.1210 0.000 1 1218 143 143 ARG H H 8.5830 0.000 1 1219 143 143 ARG HA H 3.9360 0.000 1 1220 143 143 ARG HG2 H 1.4510 0.000 2 1221 143 143 ARG HG3 H 1.7330 0.000 2 1222 143 143 ARG HD2 H 3.3250 0.000 2 1223 143 143 ARG C C 177.5800 0.000 1 1224 143 143 ARG CA C 58.1200 0.000 1 1225 143 143 ARG CB C 31.1560 0.000 1 1226 143 143 ARG CG C 27.6020 0.000 1 1227 143 143 ARG CD C 43.9890 0.000 1 1228 143 143 ARG N N 120.2120 0.000 1 1229 144 144 GLN H H 7.5520 0.000 1 1230 144 144 GLN HA H 4.8910 0.000 1 1231 144 144 GLN HB3 H 1.3740 0.000 2 1232 144 144 GLN HG2 H 1.9870 0.000 2 1233 144 144 GLN HG3 H 2.0510 0.000 2 1234 144 144 GLN C C 176.9850 0.000 1 1235 144 144 GLN CA C 53.3220 0.000 1 1236 144 144 GLN CB C 32.6450 0.000 1 1237 144 144 GLN CG C 33.5370 0.000 1 1238 144 144 GLN N N 119.5160 0.000 1 1239 145 145 PHE H H 8.6960 0.000 1 1240 145 145 PHE HA H 4.6570 0.000 1 1241 145 145 PHE C C 176.9690 0.000 1 1242 145 145 PHE CA C 55.9060 0.000 1 1243 145 145 PHE CB C 42.2670 0.000 1 1244 145 145 PHE N N 114.7450 0.000 1 1245 146 146 TYR H H 8.9150 0.000 1 1246 146 146 TYR HA H 5.2740 0.000 1 1247 146 146 TYR C C 176.2120 0.000 1 1248 146 146 TYR CA C 55.7400 0.000 1 1249 146 146 TYR CB C 38.2340 0.000 1 1250 146 146 TYR N N 124.2710 0.000 1 1251 147 147 LEU H H 9.2290 0.000 1 1252 147 147 LEU HA H 4.3910 0.000 1 1253 147 147 LEU HG H 0.9630 0.000 1 1254 147 147 LEU HD1 H 0.1160 0.000 2 1255 147 147 LEU HD2 H -0.2740 0.000 2 1256 147 147 LEU C C 178.1980 0.000 1 1257 147 147 LEU CA C 54.9690 0.000 1 1258 147 147 LEU CB C 44.1450 0.000 1 1259 147 147 LEU CG C 28.7700 0.000 1 1260 147 147 LEU CD1 C 25.3840 0.000 2 1261 147 147 LEU CD2 C 24.5260 0.000 2 1262 147 147 LEU N N 103.2070 0.000 1 1263 148 148 ARG H H 6.9550 0.000 1 1264 148 148 ARG HA H 4.5790 0.000 1 1265 148 148 ARG HG2 H 1.3770 0.000 2 1266 148 148 ARG HG3 H 1.6800 0.000 2 1267 148 148 ARG CA C 52.9940 0.000 1 1268 148 148 ARG CB C 29.2560 0.000 1 1269 148 148 ARG CG C 25.3730 0.000 1 1270 148 148 ARG CD C 44.0050 0.000 1 1271 148 148 ARG N N 120.8150 0.000 1 1272 149 149 PRO HA H 4.1860 0.000 1 1273 149 149 PRO HD2 H 2.6750 0.000 2 1274 149 149 PRO HD3 H 3.0910 0.000 2 1275 149 149 PRO C C 175.1540 0.000 1 1276 149 149 PRO CA C 64.8550 0.000 1 1277 149 149 PRO CB C 31.6370 0.000 1 1278 149 149 PRO CG C 27.8860 0.000 1 1279 149 149 PRO CD C 49.8090 0.000 1 1280 150 150 GLY H H 8.9650 0.000 1 1281 150 150 GLY HA2 H 3.9060 0.000 2 1282 150 150 GLY HA3 H 4.2800 0.000 2 1283 150 150 GLY C C 179.7400 0.000 1 1284 150 150 GLY CA C 44.6130 0.000 1 1285 150 150 GLY N N 111.6950 0.000 1 1286 151 151 GLU H H 8.4030 0.000 1 1287 151 151 GLU HA H 4.3230 0.000 1 1288 151 151 GLU HG2 H 1.2240 0.000 2 1289 151 151 GLU HG3 H 1.8190 0.000 2 1290 151 151 GLU C C 176.0780 0.000 1 1291 151 151 GLU CA C 56.5530 0.000 1 1292 151 151 GLU CB C 31.8780 0.000 1 1293 151 151 GLU CG C 36.2870 0.000 1 1294 151 151 GLU N N 118.8220 0.000 1 1295 152 152 TYR H H 8.8590 0.000 1 1296 152 152 TYR HA H 4.7400 0.000 1 1297 152 152 TYR C C 176.4130 0.000 1 1298 152 152 TYR CA C 56.9700 0.000 1 1299 152 152 TYR CB C 38.7740 0.000 1 1300 152 152 TYR N N 123.0550 0.000 1 1301 153 153 ARG H H 8.8820 0.000 1 1302 153 153 ARG HA H 4.0160 0.000 1 1303 153 153 ARG HD2 H 3.1670 0.000 2 1304 153 153 ARG C C 176.7270 0.000 1 1305 153 153 ARG CA C 60.2040 0.000 1 1306 153 153 ARG CB C 30.3400 0.000 1 1307 153 153 ARG CD C 42.9300 0.000 1 1308 153 153 ARG N N 124.2710 0.000 1 1309 154 154 SER H H 8.0700 0.000 1 1310 154 154 SER HA H 5.1940 0.000 1 1311 154 154 SER HB2 H 3.6580 0.000 2 1312 154 154 SER HB3 H 3.7480 0.000 2 1313 154 154 SER C C 176.3790 0.000 1 1314 154 154 SER CA C 56.8940 0.000 1 1315 154 154 SER CB C 66.3520 0.000 1 1316 154 154 SER N N 111.5000 0.000 1 1317 155 155 TYR H H 7.6380 0.000 1 1318 155 155 TYR HA H 1.1630 0.000 1 1319 155 155 TYR C C 174.6390 0.000 1 1320 155 155 TYR CA C 57.3690 0.000 1 1321 155 155 TYR CB C 38.3990 0.000 1 1322 155 155 TYR N N 119.3860 0.000 1 1323 156 156 ASN H H 6.8190 0.000 1 1324 156 156 ASN HA H 4.1200 0.000 1 1325 156 156 ASN HB2 H 2.1290 0.000 2 1326 156 156 ASN HB3 H 2.4460 0.000 2 1327 156 156 ASN C C 172.8890 0.000 1 1328 156 156 ASN CA C 55.5960 0.000 1 1329 156 156 ASN CB C 38.6210 0.000 1 1330 156 156 ASN N N 119.0380 0.000 1 1331 157 157 ASP H H 7.7910 0.000 1 1332 157 157 ASP HA H 4.5810 0.000 1 1333 157 157 ASP C C 173.9080 0.000 1 1334 157 157 ASP CA C 57.3820 0.000 1 1335 157 157 ASP CB C 41.6270 0.000 1 1336 157 157 ASP N N 118.3380 0.000 1 1337 158 158 TRP H H 7.0000 0.000 1 1338 158 158 TRP HA H 5.3340 0.000 1 1339 158 158 TRP HB2 H 2.5820 0.000 2 1340 158 158 TRP HB3 H 3.3860 0.000 2 1341 158 158 TRP HD1 H 6.0820 0.000 1 1342 158 158 TRP HE1 H 9.8830 0.000 1 1343 158 158 TRP HZ2 H 7.2140 0.000 1 1344 158 158 TRP C C 175.7110 0.000 1 1345 158 158 TRP CA C 57.0690 0.000 1 1346 158 158 TRP CB C 28.1190 0.000 1 1347 158 158 TRP CD1 C 127.5490 0.000 1 1348 158 158 TRP CZ2 C 115.3090 0.000 1 1349 158 158 TRP N N 114.6100 0.000 1 1350 158 158 TRP NE1 N 129.5340 0.000 1 1351 159 159 GLY H H 7.5880 0.000 1 1352 159 159 GLY HA2 H 3.8770 0.000 2 1353 159 159 GLY HA3 H 4.4780 0.000 2 1354 159 159 GLY C C 175.9910 0.000 1 1355 159 159 GLY CA C 45.7320 0.000 1 1356 159 159 GLY N N 108.6470 0.000 1 1357 160 160 GLY H H 7.3260 0.000 1 1358 160 160 GLY HA2 H 2.9280 0.000 2 1359 160 160 GLY HA3 H 3.7810 0.000 2 1360 160 160 GLY C C 178.6040 0.000 1 1361 160 160 GLY CA C 45.3560 0.000 1 1362 160 160 GLY N N 107.3480 0.000 1 1363 161 161 VAL H H 8.6970 0.000 1 1364 161 161 VAL HA H 4.2520 0.000 1 1365 161 161 VAL HB H 2.2590 0.000 1 1366 161 161 VAL HG1 H 1.0650 0.000 2 1367 161 161 VAL HG2 H 1.0790 0.000 2 1368 161 161 VAL C C 175.1180 0.000 1 1369 161 161 VAL CA C 63.3030 0.000 1 1370 161 161 VAL CB C 32.8350 0.000 1 1371 161 161 VAL CG1 C 21.9250 0.000 2 1372 161 161 VAL CG2 C 20.6600 0.000 2 1373 161 161 VAL N N 118.0470 0.000 1 1374 162 162 THR H H 7.8640 0.000 1 1375 162 162 THR HA H 3.6590 0.000 1 1376 162 162 THR HB H 4.2140 0.000 1 1377 162 162 THR HG2 H 1.1300 0.000 1 1378 162 162 THR C C 179.1910 0.000 1 1379 162 162 THR CA C 59.4310 0.000 1 1380 162 162 THR CB C 71.9350 0.000 1 1381 162 162 THR CG2 C 21.0520 0.000 1 1382 162 162 THR N N 111.6300 0.000 1 1383 163 163 SER H H 7.5020 0.000 1 1384 163 163 SER HA H 4.0180 0.000 1 1385 163 163 SER HB2 H 2.7970 0.000 2 1386 163 163 SER HB3 H 3.6310 0.000 2 1387 163 163 SER C C 178.3070 0.000 1 1388 163 163 SER CA C 57.9680 0.000 1 1389 163 163 SER CB C 63.0930 0.000 1 1390 163 163 SER N N 112.2750 0.000 1 1391 164 164 ARG H H 7.5780 0.000 1 1392 164 164 ARG HA H 4.4250 0.000 1 1393 164 164 ARG C C 175.0030 0.000 1 1394 164 164 ARG CA C 57.1370 0.000 1 1395 164 164 ARG CB C 30.4530 0.000 1 1396 164 164 ARG CG C 26.5790 0.000 1 1397 164 164 ARG CD C 42.6710 0.000 1 1398 164 164 ARG N N 122.7700 0.000 1 1399 165 165 MET H H 8.4800 0.000 1 1400 165 165 MET HA H 4.6200 0.000 1 1401 165 165 MET HB2 H 1.6460 0.000 2 1402 165 165 MET HB3 H 1.8890 0.000 2 1403 165 165 MET HE H 1.0460 0.000 1 1404 165 165 MET C C 177.2440 0.000 1 1405 165 165 MET CA C 56.1920 0.000 1 1406 165 165 MET CB C 37.2690 0.000 1 1407 165 165 MET CG C 32.3170 0.000 1 1408 165 165 MET CE C 17.3950 0.000 1 1409 165 165 MET N N 122.4540 0.000 1 1410 166 166 GLY H H 9.0460 0.000 1 1411 166 166 GLY HA2 H 2.9910 0.000 2 1412 166 166 GLY HA3 H 4.5000 0.000 2 1413 166 166 GLY C C 177.6480 0.000 1 1414 166 166 GLY CA C 45.6920 0.000 1 1415 166 166 GLY N N 107.9870 0.000 1 1416 167 167 SER H H 8.2570 0.000 1 1417 167 167 SER HA H 4.5620 0.000 1 1418 167 167 SER HB2 H 3.9810 0.000 2 1419 167 167 SER HB3 H 4.1520 0.000 2 1420 167 167 SER C C 179.1040 0.000 1 1421 167 167 SER CA C 58.7290 0.000 1 1422 167 167 SER CB C 64.8160 0.000 1 1423 167 167 SER N N 113.0240 0.000 1 1424 168 168 ILE H H 8.9220 0.000 1 1425 168 168 ILE HA H 5.5080 0.000 1 1426 168 168 ILE HB H 1.5830 0.000 1 1427 168 168 ILE HG12 H 1.2170 0.000 2 1428 168 168 ILE HG13 H 1.6220 0.000 2 1429 168 168 ILE HG2 H 1.0380 0.000 1 1430 168 168 ILE HD1 H 0.5920 0.000 1 1431 168 168 ILE C C 177.7830 0.000 1 1432 168 168 ILE CA C 61.1610 0.000 1 1433 168 168 ILE CB C 44.2100 0.000 1 1434 168 168 ILE CG1 C 28.7770 0.000 1 1435 168 168 ILE CG2 C 19.3190 0.000 1 1436 168 168 ILE CD1 C 15.3090 0.000 1 1437 168 168 ILE N N 118.9270 0.000 1 1438 169 169 ARG H H 9.7570 0.000 1 1439 169 169 ARG HA H 5.0450 0.000 1 1440 169 169 ARG HG2 H 1.1340 0.000 2 1441 169 169 ARG HG3 H 1.4690 0.000 2 1442 169 169 ARG HD2 H 2.2830 0.000 2 1443 169 169 ARG HD3 H 2.3440 0.000 2 1444 169 169 ARG C C 177.3500 0.000 1 1445 169 169 ARG CA C 54.1850 0.000 1 1446 169 169 ARG CB C 34.9910 0.000 1 1447 169 169 ARG CG C 26.4460 0.000 1 1448 169 169 ARG CD C 43.3950 0.000 1 1449 169 169 ARG N N 124.8200 0.000 1 1450 170 170 ARG H H 8.5520 0.000 1 1451 170 170 ARG HA H 3.2650 0.000 1 1452 170 170 ARG HB2 H -0.3570 0.000 2 1453 170 170 ARG HB3 H 0.7960 0.000 2 1454 170 170 ARG C C 174.3730 0.000 1 1455 170 170 ARG CA C 55.1700 0.000 1 1456 170 170 ARG CB C 30.1500 0.000 1 1457 170 170 ARG CG C 25.1970 0.000 1 1458 170 170 ARG CD C 43.3950 0.000 1 1459 170 170 ARG N N 122.9510 0.000 1 1460 171 171 ILE H H 8.4240 0.000 1 1461 171 171 ILE HA H 3.8020 0.000 1 1462 171 171 ILE HB H 1.7220 0.000 1 1463 171 171 ILE HG12 H 0.2870 0.000 2 1464 171 171 ILE HG13 H 1.3120 0.000 2 1465 171 171 ILE HG2 H 0.9020 0.000 1 1466 171 171 ILE HD1 H 0.7760 0.000 1 1467 171 171 ILE C C 177.0880 0.000 1 1468 171 171 ILE CA C 62.5610 0.000 1 1469 171 171 ILE CB C 36.3260 0.000 1 1470 171 171 ILE CG1 C 27.6480 0.000 1 1471 171 171 ILE CG2 C 18.5060 0.000 1 1472 171 171 ILE CD1 C 15.0040 0.000 1 1473 171 171 ILE N N 123.2800 0.000 1 1474 172 172 THR H H 7.2990 0.000 1 1475 172 172 THR HA H 4.5580 0.000 1 1476 172 172 THR HB H 4.2310 0.000 1 1477 172 172 THR HG2 H 0.6630 0.000 1 1478 172 172 THR C C 177.6510 0.000 1 1479 172 172 THR CA C 60.0950 0.000 1 1480 172 172 THR CB C 70.0400 0.000 1 1481 172 172 THR CG2 C 20.6270 0.000 1 1482 172 172 THR N N 117.2700 0.000 1 1483 173 173 ASP H H 8.4770 0.000 1 1484 173 173 ASP HA H 4.4450 0.000 1 1485 173 173 ASP HB2 H 2.5930 0.000 2 1486 173 173 ASP HB3 H 2.7030 0.000 2 1487 173 173 ASP C C 177.0410 0.000 1 1488 173 173 ASP CA C 55.0100 0.000 1 1489 173 173 ASP CB C 41.5240 0.000 1 1490 173 173 ASP N N 121.5980 0.000 1 1491 174 174 LEU H H 7.7220 0.000 1 1492 174 174 LEU HA H 4.2240 0.000 1 1493 174 174 LEU HB2 H 1.5610 0.000 2 1494 174 174 LEU HG H 1.6120 0.000 1 1495 174 174 LEU HD1 H 0.8620 0.000 2 1496 174 174 LEU HD2 H 0.8330 0.000 2 1497 174 174 LEU CA C 56.6050 0.000 1 1498 174 174 LEU CB C 44.2090 0.000 1 1499 174 174 LEU CG C 27.0780 0.000 1 1500 174 174 LEU CD1 C 25.1100 0.000 2 1501 174 174 LEU CD2 C 23.9250 0.000 2 1502 174 174 LEU N N 126.6020 0.000 1 stop_ save_