data_26646 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; A Novel MHC-I Surface Targeted for Binding by the MCMV m06 Immunoevasin Revealed by Solution NMR ; _BMRB_accession_number 26646 _BMRB_flat_file_name bmr26646.str _Entry_type original _Submission_date 2015-09-02 _Accession_date 2015-09-02 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'backbone and Cbeta assignments of the mini H2-Ld protein' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Sgourakis Nikolaos G. . 2 May Nathan A. . 3 Boyd Lisa F. . 4 Ying Jinfa . . 5 Bax Ad . . 6 Margulies David H. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 170 "13C chemical shifts" 506 "15N chemical shifts" 170 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-07-15 original BMRB . stop_ _Original_release_date 2016-07-15 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; A Novel MHC-I Surface Targeted for Binding by the MCMV m06 Immunoevasin Revealed by Solution NMR ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 26463211 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Sgourakis Nikolaos G. . 2 May Nathan A. . 3 Boyd Lisa F. . 4 Ying Jinfa . . 5 Bax Ad . . 6 Margulies David H. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 290 _Journal_issue 48 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 28857 _Page_last 28868 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'mini H2-Ld' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'mini H2-Ld' $mini_H2-Ld 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_mini_H2-Ld _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common mini_H2-Ld _Molecular_mass . _Mol_thiol_state 'free and disulfide bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 180 _Mol_residue_sequence ; MGPHSMRYYETATSRRGLGE PRYTSVGYVDDKEFVRFDSD AENPRYEPQVPWMEQEGPEY WERITQVAKGQEQWFRVNLR TLLGYYNQSAGGTHTLQRMY GCDVGSDGRLLRGYEQFAYD GCDYIALNEDLRTWTAADMA AQITRRKWEQAGAAEYYRAY LEGECVEWLHRYLKNGNATL ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 MET 2 2 GLY 3 3 PRO 4 4 HIS 5 5 SER 6 6 MET 7 7 ARG 8 8 TYR 9 9 TYR 10 10 GLU 11 11 THR 12 12 ALA 13 13 THR 14 14 SER 15 15 ARG 16 16 ARG 17 17 GLY 18 18 LEU 19 19 GLY 20 20 GLU 21 21 PRO 22 22 ARG 23 23 TYR 24 24 THR 25 25 SER 26 26 VAL 27 27 GLY 28 28 TYR 29 29 VAL 30 30 ASP 31 31 ASP 32 32 LYS 33 33 GLU 34 34 PHE 35 35 VAL 36 36 ARG 37 37 PHE 38 38 ASP 39 39 SER 40 40 ASP 41 41 ALA 42 42 GLU 43 43 ASN 44 44 PRO 45 45 ARG 46 46 TYR 47 47 GLU 48 48 PRO 49 49 GLN 50 50 VAL 51 51 PRO 52 52 TRP 53 53 MET 54 54 GLU 55 55 GLN 56 56 GLU 57 57 GLY 58 58 PRO 59 59 GLU 60 60 TYR 61 61 TRP 62 62 GLU 63 63 ARG 64 64 ILE 65 65 THR 66 66 GLN 67 67 VAL 68 68 ALA 69 69 LYS 70 70 GLY 71 71 GLN 72 72 GLU 73 73 GLN 74 74 TRP 75 75 PHE 76 76 ARG 77 77 VAL 78 78 ASN 79 79 LEU 80 80 ARG 81 81 THR 82 82 LEU 83 83 LEU 84 84 GLY 85 85 TYR 86 86 TYR 87 87 ASN 88 88 GLN 89 89 SER 90 90 ALA 91 91 GLY 92 92 GLY 93 93 THR 94 94 HIS 95 95 THR 96 96 LEU 97 97 GLN 98 98 ARG 99 99 MET 100 100 TYR 101 101 GLY 102 102 CYS 103 103 ASP 104 104 VAL 105 105 GLY 106 106 SER 107 107 ASP 108 108 GLY 109 109 ARG 110 110 LEU 111 111 LEU 112 112 ARG 113 113 GLY 114 114 TYR 115 115 GLU 116 116 GLN 117 117 PHE 118 118 ALA 119 119 TYR 120 120 ASP 121 121 GLY 122 122 CYS 123 123 ASP 124 124 TYR 125 125 ILE 126 126 ALA 127 127 LEU 128 128 ASN 129 129 GLU 130 130 ASP 131 131 LEU 132 132 ARG 133 133 THR 134 134 TRP 135 135 THR 136 136 ALA 137 137 ALA 138 138 ASP 139 139 MET 140 140 ALA 141 141 ALA 142 142 GLN 143 143 ILE 144 144 THR 145 145 ARG 146 146 ARG 147 147 LYS 148 148 TRP 149 149 GLU 150 150 GLN 151 151 ALA 152 152 GLY 153 153 ALA 154 154 ALA 155 155 GLU 156 156 TYR 157 157 TYR 158 158 ARG 159 159 ALA 160 160 TYR 161 161 LEU 162 162 GLU 163 163 GLY 164 164 GLU 165 165 CYS 166 166 VAL 167 167 GLU 168 168 TRP 169 169 LEU 170 170 HIS 171 171 ARG 172 172 TYR 173 173 LEU 174 174 LYS 175 175 ASN 176 176 GLY 177 177 ASN 178 178 ALA 179 179 THR 180 180 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $mini_H2-Ld enterobacteria 562 Bacteria . Escherichia coli stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $mini_H2-Ld 'recombinant technology' . Escherichia coli . pET28a 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 $mini_H2-Ld 0.9 mM '[U-100% 13C; U-100% 15N; U-80% 2H]' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' PIPES 20 mM 'natural abundance' NaCl 50 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CA)CB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CB' _Sample_label $sample_1 save_ save_3D_HN(CA)CO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D NOESY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.0257 . M pH 6.4 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio water C 13 protons ppm 4.7 internal indirect . . . 0.251449530 water H 1 protons ppm 4.7 internal direct . . . 1 water N 15 protons ppm 4.7 internal indirect . . . -0.10136329823 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 'Chemical shift offset: 2H isotope effect for all atoms.' loop_ _Software_label $SPARKY stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCO' '3D HNCA' '3D HN(CA)CB' '3D HN(CA)CO' '3D NOESY' 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 'mini H2-Ld' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 3 3 PRO C C 176.698 0.1 1 2 3 3 PRO CA C 62.172 0.1 1 3 3 3 PRO CB C 32.024 0.1 1 4 4 4 HIS H H 8.139 0.01 1 5 4 4 HIS C C 173.498 0.1 1 6 4 4 HIS CA C 54.791 0.1 1 7 4 4 HIS CB C 33.855 0.1 1 8 4 4 HIS N N 115.376 0.1 1 9 5 5 SER H H 9.380 0.01 1 10 5 5 SER C C 172.745 0.1 1 11 5 5 SER CA C 56.915 0.1 1 12 5 5 SER CB C 67.131 0.1 1 13 5 5 SER N N 114.985 0.1 1 14 6 6 MET H H 9.016 0.01 1 15 6 6 MET C C 175.438 0.1 1 16 6 6 MET CA C 54.532 0.1 1 17 6 6 MET CB C 37.682 0.1 1 18 6 6 MET N N 123.048 0.1 1 19 7 7 ARG H H 9.012 0.01 1 20 7 7 ARG C C 174.099 0.1 1 21 7 7 ARG CA C 53.214 0.1 1 22 7 7 ARG CB C 35.533 0.1 1 23 7 7 ARG N N 126.667 0.1 1 24 8 8 TYR H H 8.788 0.01 1 25 8 8 TYR C C 174.266 0.1 1 26 8 8 TYR CA C 57.258 0.1 1 27 8 8 TYR CB C 40.768 0.1 1 28 8 8 TYR N N 121.141 0.1 1 29 9 9 TYR H H 9.127 0.01 1 30 9 9 TYR C C 176.738 0.1 1 31 9 9 TYR CA C 56.588 0.1 1 32 9 9 TYR CB C 39.131 0.1 1 33 9 9 TYR N N 119.096 0.1 1 34 10 10 GLU H H 9.990 0.01 1 35 10 10 GLU C C 175.837 0.1 1 36 10 10 GLU CA C 54.032 0.1 1 37 10 10 GLU CB C 33.150 0.1 1 38 10 10 GLU N N 126.354 0.1 1 39 11 11 THR H H 9.100 0.01 1 40 11 11 THR C C 172.441 0.1 1 41 11 11 THR CA C 61.302 0.1 1 42 11 11 THR CB C 71.275 0.1 1 43 11 11 THR N N 119.367 0.1 1 44 12 12 ALA H H 9.065 0.01 1 45 12 12 ALA C C 175.722 0.1 1 46 12 12 ALA CA C 49.891 0.1 1 47 12 12 ALA CB C 21.789 0.1 1 48 12 12 ALA N N 129.009 0.1 1 49 13 13 THR H H 8.561 0.01 1 50 13 13 THR C C 175.030 0.1 1 51 13 13 THR CA C 59.931 0.1 1 52 13 13 THR CB C 71.451 0.1 1 53 13 13 THR N N 119.246 0.1 1 54 14 14 SER H H 9.355 0.01 1 55 14 14 SER C C 173.052 0.1 1 56 14 14 SER CA C 57.031 0.1 1 57 14 14 SER CB C 64.352 0.1 1 58 14 14 SER N N 123.363 0.1 1 59 15 15 ARG H H 8.718 0.01 1 60 15 15 ARG C C 175.790 0.1 1 61 15 15 ARG CA C 54.397 0.1 1 62 15 15 ARG CB C 31.506 0.1 1 63 15 15 ARG N N 121.057 0.1 1 64 16 16 ARG H H 8.157 0.01 1 65 16 16 ARG C C 177.032 0.1 1 66 16 16 ARG CA C 56.552 0.1 1 67 16 16 ARG CB C 28.840 0.1 1 68 16 16 ARG N N 121.541 0.1 1 69 17 17 GLY H H 8.387 0.01 1 70 17 17 GLY C C 173.763 0.1 1 71 17 17 GLY CA C 45.024 0.1 1 72 17 17 GLY N N 111.863 0.1 1 73 18 18 LEU H H 7.977 0.01 1 74 18 18 LEU C C 177.480 0.1 1 75 18 18 LEU CA C 54.267 0.1 1 76 18 18 LEU CB C 41.705 0.1 1 77 18 18 LEU N N 122.419 0.1 1 78 19 19 GLY H H 8.192 0.01 1 79 19 19 GLY C C 173.743 0.1 1 80 19 19 GLY CA C 44.681 0.1 1 81 19 19 GLY N N 109.586 0.1 1 82 20 20 GLU H H 8.229 0.01 1 83 20 20 GLU CA C 53.684 0.1 1 84 20 20 GLU CB C 28.243 0.1 1 85 20 20 GLU N N 121.362 0.1 1 86 21 21 PRO C C 176.043 0.1 1 87 21 21 PRO CA C 62.502 0.1 1 88 21 21 PRO CB C 31.205 0.1 1 89 22 22 ARG H H 8.329 0.01 1 90 22 22 ARG C C 174.682 0.1 1 91 22 22 ARG CA C 55.451 0.1 1 92 22 22 ARG CB C 30.483 0.1 1 93 22 22 ARG N N 123.850 0.1 1 94 23 23 TYR H H 9.432 0.01 1 95 23 23 TYR C C 173.356 0.1 1 96 23 23 TYR CA C 54.393 0.1 1 97 23 23 TYR CB C 40.988 0.1 1 98 23 23 TYR N N 133.541 0.1 1 99 24 24 THR H H 8.785 0.01 1 100 24 24 THR C C 172.655 0.1 1 101 24 24 THR CA C 58.396 0.1 1 102 24 24 THR CB C 71.844 0.1 1 103 24 24 THR N N 119.423 0.1 1 104 25 25 SER H H 8.590 0.01 1 105 25 25 SER C C 173.726 0.1 1 106 25 25 SER CA C 56.131 0.1 1 107 25 25 SER CB C 63.566 0.1 1 108 25 25 SER N N 116.280 0.1 1 109 26 26 VAL H H 8.837 0.01 1 110 26 26 VAL C C 174.851 0.1 1 111 26 26 VAL CA C 61.138 0.1 1 112 26 26 VAL CB C 33.575 0.1 1 113 26 26 VAL N N 128.960 0.1 1 114 27 27 GLY H H 8.195 0.01 1 115 27 27 GLY C C 172.960 0.1 1 116 27 27 GLY CA C 44.422 0.1 1 117 27 27 GLY N N 112.376 0.1 1 118 28 28 TYR H H 9.717 0.01 1 119 28 28 TYR C C 175.575 0.1 1 120 28 28 TYR CA C 57.378 0.1 1 121 28 28 TYR CB C 42.307 0.1 1 122 28 28 TYR N N 123.895 0.1 1 123 29 29 VAL H H 8.614 0.01 1 124 29 29 VAL C C 176.436 0.1 1 125 29 29 VAL CA C 61.223 0.1 1 126 29 29 VAL CB C 33.434 0.1 1 127 29 29 VAL N N 122.453 0.1 1 128 30 30 ASP H H 9.910 0.01 1 129 30 30 ASP CA C 55.520 0.1 1 130 30 30 ASP CB C 37.596 0.1 1 131 30 30 ASP N N 131.113 0.1 1 132 31 31 ASP C C 174.923 0.1 1 133 32 32 LYS H H 8.251 0.01 1 134 32 32 LYS C C 175.714 0.1 1 135 32 32 LYS CA C 54.395 0.1 1 136 32 32 LYS CB C 32.884 0.1 1 137 32 32 LYS N N 121.777 0.1 1 138 33 33 GLU H H 8.848 0.01 1 139 33 33 GLU C C 176.462 0.1 1 140 33 33 GLU CA C 56.303 0.1 1 141 33 33 GLU CB C 28.742 0.1 1 142 33 33 GLU N N 129.254 0.1 1 143 34 34 PHE H H 9.175 0.01 1 144 34 34 PHE C C 175.189 0.1 1 145 34 34 PHE CA C 56.609 0.1 1 146 34 34 PHE CB C 41.475 0.1 1 147 34 34 PHE N N 122.477 0.1 1 148 35 35 VAL H H 6.803 0.01 1 149 35 35 VAL C C 173.331 0.1 1 150 35 35 VAL CA C 59.934 0.1 1 151 35 35 VAL CB C 36.445 0.1 1 152 35 35 VAL N N 116.534 0.1 1 153 36 36 ARG H H 7.998 0.01 1 154 36 36 ARG C C 173.726 0.1 1 155 36 36 ARG CA C 55.987 0.1 1 156 36 36 ARG CB C 34.036 0.1 1 157 36 36 ARG N N 120.070 0.1 1 158 37 37 PHE H H 9.406 0.01 1 159 37 37 PHE C C 172.984 0.1 1 160 37 37 PHE CA C 56.615 0.1 1 161 37 37 PHE N N 129.457 0.1 1 162 38 38 ASP H H 7.607 0.01 1 163 38 38 ASP C C 175.673 0.1 1 164 38 38 ASP CA C 52.273 0.1 1 165 38 38 ASP CB C 42.978 0.1 1 166 38 38 ASP N N 128.706 0.1 1 167 39 39 SER H H 9.250 0.01 1 168 39 39 SER C C 174.588 0.1 1 169 39 39 SER CA C 60.960 0.1 1 170 39 39 SER CB C 62.622 0.1 1 171 39 39 SER N N 123.169 0.1 1 172 40 40 ASP H H 8.329 0.01 1 173 40 40 ASP C C 176.478 0.1 1 174 40 40 ASP CA C 53.798 0.1 1 175 40 40 ASP CB C 39.940 0.1 1 176 40 40 ASP N N 122.599 0.1 1 177 41 41 ALA H H 7.233 0.01 1 178 41 41 ALA C C 176.281 0.1 1 179 41 41 ALA CA C 51.408 0.1 1 180 41 41 ALA CB C 19.013 0.1 1 181 41 41 ALA N N 123.590 0.1 1 182 42 42 GLU H H 8.294 0.01 1 183 42 42 GLU C C 177.114 0.1 1 184 42 42 GLU CA C 58.481 0.1 1 185 42 42 GLU CB C 28.631 0.1 1 186 42 42 GLU N N 120.859 0.1 1 187 43 43 ASN H H 8.143 0.01 1 188 43 43 ASN CA C 50.282 0.1 1 189 43 43 ASN CB C 38.073 0.1 1 190 43 43 ASN N N 115.945 0.1 1 191 44 44 PRO C C 175.462 0.1 1 192 44 44 PRO CA C 63.226 0.1 1 193 45 45 ARG H H 7.769 0.01 1 194 45 45 ARG C C 176.455 0.1 1 195 45 45 ARG CA C 54.585 0.1 1 196 45 45 ARG CB C 31.279 0.1 1 197 45 45 ARG N N 121.903 0.1 1 198 46 46 TYR H H 8.025 0.01 1 199 46 46 TYR C C 176.168 0.1 1 200 46 46 TYR CA C 60.269 0.1 1 201 46 46 TYR CB C 38.912 0.1 1 202 46 46 TYR N N 120.498 0.1 1 203 47 47 GLU H H 8.626 0.01 1 204 47 47 GLU CA C 52.073 0.1 1 205 47 47 GLU CB C 31.086 0.1 1 206 47 47 GLU N N 118.972 0.1 1 207 48 48 PRO C C 176.818 0.1 1 208 48 48 PRO CA C 61.792 0.1 1 209 48 48 PRO CB C 31.671 0.1 1 210 49 49 GLN H H 7.818 0.01 1 211 49 49 GLN C C 173.712 0.1 1 212 49 49 GLN CA C 53.026 0.1 1 213 49 49 GLN CB C 29.487 0.1 1 214 49 49 GLN N N 117.291 0.1 1 215 50 50 VAL H H 6.905 0.01 1 216 50 50 VAL CA C 56.319 0.1 1 217 50 50 VAL CB C 34.009 0.1 1 218 50 50 VAL N N 111.619 0.1 1 219 51 51 PRO C C 179.161 0.1 1 220 51 51 PRO CA C 64.508 0.1 1 221 51 51 PRO CB C 31.076 0.1 1 222 52 52 TRP H H 6.677 0.01 1 223 52 52 TRP C C 178.125 0.1 1 224 52 52 TRP CA C 55.869 0.1 1 225 52 52 TRP CB C 27.316 0.1 1 226 52 52 TRP N N 112.370 0.1 1 227 53 53 MET H H 7.034 0.01 1 228 53 53 MET C C 178.130 0.1 1 229 53 53 MET CA C 53.645 0.1 1 230 53 53 MET CB C 30.597 0.1 1 231 53 53 MET N N 118.215 0.1 1 232 54 54 GLU H H 7.832 0.01 1 233 54 54 GLU C C 176.575 0.1 1 234 54 54 GLU CA C 58.205 0.1 1 235 54 54 GLU CB C 28.173 0.1 1 236 54 54 GLU N N 119.684 0.1 1 237 55 55 GLN H H 7.551 0.01 1 238 55 55 GLN C C 177.277 0.1 1 239 55 55 GLN CA C 56.298 0.1 1 240 55 55 GLN CB C 28.677 0.1 1 241 55 55 GLN N N 114.681 0.1 1 242 56 56 GLU H H 7.435 0.01 1 243 56 56 GLU C C 177.839 0.1 1 244 56 56 GLU CA C 55.622 0.1 1 245 56 56 GLU CB C 28.486 0.1 1 246 56 56 GLU N N 119.889 0.1 1 247 57 57 GLY H H 8.851 0.01 1 248 57 57 GLY CA C 44.625 0.1 1 249 57 57 GLY N N 110.981 0.1 1 250 58 58 PRO C C 179.218 0.1 1 251 58 58 PRO CA C 65.316 0.1 1 252 58 58 PRO CB C 31.343 0.1 1 253 59 59 GLU H H 9.055 0.01 1 254 59 59 GLU C C 178.588 0.1 1 255 59 59 GLU CA C 59.223 0.1 1 256 59 59 GLU CB C 27.858 0.1 1 257 59 59 GLU N N 118.337 0.1 1 258 60 60 TYR H H 7.730 0.01 1 259 60 60 TYR C C 176.153 0.1 1 260 60 60 TYR CA C 61.413 0.1 1 261 60 60 TYR CB C 37.357 0.1 1 262 60 60 TYR N N 122.661 0.1 1 263 61 61 TRP H H 6.852 0.01 1 264 61 61 TRP C C 179.426 0.1 1 265 61 61 TRP CA C 58.639 0.1 1 266 61 61 TRP CB C 28.475 0.1 1 267 61 61 TRP N N 119.414 0.1 1 268 62 62 GLU H H 8.379 0.01 1 269 62 62 GLU C C 179.074 0.1 1 270 62 62 GLU CA C 59.010 0.1 1 271 62 62 GLU CB C 28.811 0.1 1 272 62 62 GLU N N 121.559 0.1 1 273 63 63 ARG H H 8.100 0.01 1 274 63 63 ARG C C 180.695 0.1 1 275 63 63 ARG CA C 59.429 0.1 1 276 63 63 ARG CB C 29.192 0.1 1 277 63 63 ARG N N 120.471 0.1 1 278 64 64 ILE H H 8.219 0.01 1 279 64 64 ILE C C 178.547 0.1 1 280 64 64 ILE CA C 65.070 0.1 1 281 64 64 ILE CB C 35.725 0.1 1 282 64 64 ILE N N 113.125 0.1 1 283 65 65 THR H H 7.866 0.01 1 284 65 65 THR C C 175.286 0.1 1 285 65 65 THR CA C 68.053 0.1 1 286 65 65 THR CB C 67.778 0.1 1 287 65 65 THR N N 122.454 0.1 1 288 66 66 GLN H H 7.801 0.01 1 289 66 66 GLN C C 179.685 0.1 1 290 66 66 GLN CA C 58.728 0.1 1 291 66 66 GLN CB C 26.931 0.1 1 292 66 66 GLN N N 121.465 0.1 1 293 67 67 VAL H H 7.255 0.01 1 294 67 67 VAL C C 177.375 0.1 1 295 67 67 VAL CA C 66.320 0.1 1 296 67 67 VAL CB C 29.800 0.1 1 297 67 67 VAL N N 122.111 0.1 1 298 68 68 ALA H H 7.393 0.01 1 299 68 68 ALA C C 179.283 0.1 1 300 68 68 ALA CA C 54.550 0.1 1 301 68 68 ALA CB C 16.233 0.1 1 302 68 68 ALA N N 122.670 0.1 1 303 69 69 LYS H H 8.050 0.01 1 304 69 69 LYS C C 181.001 0.1 1 305 69 69 LYS CA C 58.352 0.1 1 306 69 69 LYS CB C 30.655 0.1 1 307 69 69 LYS N N 116.391 0.1 1 308 70 70 GLY H H 7.781 0.01 1 309 70 70 GLY C C 176.915 0.1 1 310 70 70 GLY CA C 46.377 0.1 1 311 70 70 GLY N N 108.981 0.1 1 312 71 71 GLN H H 8.836 0.01 1 313 71 71 GLN C C 178.332 0.1 1 314 71 71 GLN CA C 57.434 0.1 1 315 71 71 GLN CB C 27.195 0.1 1 316 71 71 GLN N N 128.707 0.1 1 317 72 72 GLU H H 8.820 0.01 1 318 72 72 GLU C C 179.329 0.1 1 319 72 72 GLU CA C 59.634 0.1 1 320 72 72 GLU CB C 28.920 0.1 1 321 72 72 GLU N N 122.006 0.1 1 322 73 73 GLN H H 6.980 0.01 1 323 73 73 GLN C C 177.473 0.1 1 324 73 73 GLN CA C 57.971 0.1 1 325 73 73 GLN CB C 26.814 0.1 1 326 73 73 GLN N N 116.493 0.1 1 327 74 74 TRP H H 7.843 0.01 1 328 74 74 TRP C C 180.876 0.1 1 329 74 74 TRP CA C 62.228 0.1 1 330 74 74 TRP CB C 28.128 0.1 1 331 74 74 TRP N N 122.736 0.1 1 332 75 75 PHE H H 9.241 0.01 1 333 75 75 PHE C C 177.743 0.1 1 334 75 75 PHE CA C 62.990 0.1 1 335 75 75 PHE CB C 38.554 0.1 1 336 75 75 PHE N N 120.965 0.1 1 337 76 76 ARG H H 7.786 0.01 1 338 76 76 ARG C C 179.493 0.1 1 339 76 76 ARG CA C 60.017 0.1 1 340 76 76 ARG CB C 29.330 0.1 1 341 76 76 ARG N N 118.547 0.1 1 342 77 77 VAL H H 7.366 0.01 1 343 77 77 VAL C C 178.129 0.1 1 344 77 77 VAL CA C 65.129 0.1 1 345 77 77 VAL CB C 31.379 0.1 1 346 77 77 VAL N N 117.472 0.1 1 347 78 78 ASN H H 7.543 0.01 1 348 78 78 ASN C C 177.093 0.1 1 349 78 78 ASN CA C 57.686 0.1 1 350 78 78 ASN CB C 37.458 0.1 1 351 78 78 ASN N N 118.595 0.1 1 352 79 79 LEU H H 8.502 0.01 1 353 79 79 LEU C C 180.039 0.1 1 354 79 79 LEU CA C 58.341 0.1 1 355 79 79 LEU CB C 41.371 0.1 1 356 79 79 LEU N N 121.871 0.1 1 357 80 80 ARG H H 6.586 0.01 1 358 80 80 ARG C C 179.668 0.1 1 359 80 80 ARG CA C 58.991 0.1 1 360 80 80 ARG CB C 28.222 0.1 1 361 80 80 ARG N N 118.463 0.1 1 362 81 81 THR H H 7.752 0.01 1 363 81 81 THR C C 176.556 0.1 1 364 81 81 THR CA C 65.455 0.1 1 365 81 81 THR CB C 67.494 0.1 1 366 81 81 THR N N 119.283 0.1 1 367 82 82 LEU H H 7.337 0.01 1 368 82 82 LEU C C 177.618 0.1 1 369 82 82 LEU CA C 57.842 0.1 1 370 82 82 LEU CB C 39.716 0.1 1 371 82 82 LEU N N 121.116 0.1 1 372 83 83 LEU H H 6.994 0.01 1 373 83 83 LEU C C 180.328 0.1 1 374 83 83 LEU CA C 57.712 0.1 1 375 83 83 LEU CB C 40.441 0.1 1 376 83 83 LEU N N 117.925 0.1 1 377 84 84 GLY H H 7.020 0.01 1 378 84 84 GLY C C 177.516 0.1 1 379 84 84 GLY CA C 46.286 0.1 1 380 84 84 GLY N N 103.008 0.1 1 381 85 85 TYR H H 7.920 0.01 1 382 85 85 TYR C C 178.378 0.1 1 383 85 85 TYR CA C 56.836 0.1 1 384 85 85 TYR CB C 35.748 0.1 1 385 85 85 TYR N N 122.650 0.1 1 386 86 86 TYR H H 7.879 0.01 1 387 86 86 TYR C C 174.632 0.1 1 388 86 86 TYR CA C 58.964 0.1 1 389 86 86 TYR CB C 36.885 0.1 1 390 86 86 TYR N N 114.310 0.1 1 391 87 87 ASN H H 7.786 0.01 1 392 87 87 ASN C C 174.685 0.1 1 393 87 87 ASN CA C 54.131 0.1 1 394 87 87 ASN CB C 36.650 0.1 1 395 87 87 ASN N N 120.095 0.1 1 396 88 88 GLN H H 8.787 0.01 1 397 88 88 GLN C C 175.987 0.1 1 398 88 88 GLN CA C 54.062 0.1 1 399 88 88 GLN CB C 29.974 0.1 1 400 88 88 GLN N N 118.238 0.1 1 401 89 89 SER H H 8.329 0.01 1 402 89 89 SER C C 175.129 0.1 1 403 89 89 SER CA C 57.502 0.1 1 404 89 89 SER CB C 63.683 0.1 1 405 89 89 SER N N 115.678 0.1 1 406 90 90 ALA H H 8.668 0.01 1 407 90 90 ALA C C 178.347 0.1 1 408 90 90 ALA CA C 52.771 0.1 1 409 90 90 ALA CB C 18.035 0.1 1 410 90 90 ALA N N 126.209 0.1 1 411 91 91 GLY H H 8.499 0.01 1 412 91 91 GLY C C 174.825 0.1 1 413 91 91 GLY CA C 45.437 0.1 1 414 91 91 GLY N N 108.678 0.1 1 415 92 92 GLY H H 8.226 0.01 1 416 92 92 GLY C C 173.031 0.1 1 417 92 92 GLY CA C 43.388 0.1 1 418 92 92 GLY N N 109.159 0.1 1 419 93 93 THR H H 7.982 0.01 1 420 93 93 THR C C 172.913 0.1 1 421 93 93 THR CA C 60.338 0.1 1 422 93 93 THR CB C 69.356 0.1 1 423 93 93 THR N N 116.476 0.1 1 424 94 94 HIS H H 8.092 0.01 1 425 94 94 HIS C C 173.323 0.1 1 426 94 94 HIS CA C 54.066 0.1 1 427 94 94 HIS CB C 32.841 0.1 1 428 94 94 HIS N N 124.192 0.1 1 429 95 95 THR H H 8.805 0.01 1 430 95 95 THR C C 172.641 0.1 1 431 95 95 THR CA C 60.833 0.1 1 432 95 95 THR CB C 71.906 0.1 1 433 95 95 THR N N 115.808 0.1 1 434 96 96 LEU H H 9.539 0.01 1 435 96 96 LEU C C 173.816 0.1 1 436 96 96 LEU CA C 53.290 0.1 1 437 96 96 LEU CB C 45.841 0.1 1 438 96 96 LEU N N 130.447 0.1 1 439 97 97 GLN H H 9.725 0.01 1 440 97 97 GLN C C 174.177 0.1 1 441 97 97 GLN CA C 53.782 0.1 1 442 97 97 GLN CB C 33.441 0.1 1 443 97 97 GLN N N 125.723 0.1 1 444 98 98 ARG H H 9.757 0.01 1 445 98 98 ARG C C 174.256 0.1 1 446 98 98 ARG CA C 53.459 0.1 1 447 98 98 ARG CB C 35.884 0.1 1 448 98 98 ARG N N 127.357 0.1 1 449 99 99 MET H H 9.045 0.01 1 450 99 99 MET C C 173.670 0.1 1 451 99 99 MET CA C 54.107 0.1 1 452 99 99 MET CB C 34.529 0.1 1 453 99 99 MET N N 129.747 0.1 1 454 100 100 TYR H H 8.436 0.01 1 455 100 100 TYR C C 173.599 0.1 1 456 100 100 TYR CA C 55.816 0.1 1 457 100 100 TYR CB C 41.593 0.1 1 458 100 100 TYR N N 121.849 0.1 1 459 101 101 GLY H H 8.243 0.01 1 460 101 101 GLY C C 170.764 0.1 1 461 101 101 GLY CA C 44.171 0.1 1 462 101 101 GLY N N 103.523 0.1 1 463 102 102 CYS H H 8.850 0.01 1 464 102 102 CYS C C 171.947 0.1 1 465 102 102 CYS CA C 52.544 0.1 1 466 102 102 CYS CB C 47.689 0.1 1 467 102 102 CYS N N 111.595 0.1 1 468 103 103 ASP H H 9.027 0.01 1 469 103 103 ASP C C 175.959 0.1 1 470 103 103 ASP CA C 52.483 0.1 1 471 103 103 ASP CB C 41.279 0.1 1 472 103 103 ASP N N 123.537 0.1 1 473 104 104 VAL H H 9.289 0.01 1 474 104 104 VAL C C 175.584 0.1 1 475 104 104 VAL CA C 59.657 0.1 1 476 104 104 VAL CB C 33.821 0.1 1 477 104 104 VAL N N 120.947 0.1 1 478 105 105 GLY H H 8.472 0.01 1 479 105 105 GLY C C 175.962 0.1 1 480 105 105 GLY CA C 43.694 0.1 1 481 105 105 GLY N N 110.155 0.1 1 482 106 106 SER H H 8.878 0.01 1 483 106 106 SER C C 174.292 0.1 1 484 106 106 SER CA C 60.694 0.1 1 485 106 106 SER CB C 62.302 0.1 1 486 106 106 SER N N 117.099 0.1 1 487 107 107 ASP H H 7.965 0.01 1 488 107 107 ASP C C 177.144 0.1 1 489 107 107 ASP CA C 52.561 0.1 1 490 107 107 ASP CB C 39.501 0.1 1 491 107 107 ASP N N 118.829 0.1 1 492 108 108 GLY H H 8.165 0.01 1 493 108 108 GLY C C 173.678 0.1 1 494 108 108 GLY CA C 45.129 0.1 1 495 108 108 GLY N N 108.440 0.1 1 496 109 109 ARG H H 7.650 0.01 1 497 109 109 ARG CA C 54.477 0.1 1 498 109 109 ARG CB C 30.326 0.1 1 499 109 109 ARG N N 119.739 0.1 1 500 110 110 LEU C C 176.225 0.1 1 501 110 110 LEU CA C 56.550 0.1 1 502 110 110 LEU CB C 41.210 0.1 1 503 111 111 LEU H H 9.439 0.01 1 504 111 111 LEU C C 177.006 0.1 1 505 111 111 LEU CA C 55.224 0.1 1 506 111 111 LEU CB C 43.202 0.1 1 507 111 111 LEU N N 130.290 0.1 1 508 112 112 ARG H H 7.360 0.01 1 509 112 112 ARG C C 173.835 0.1 1 510 112 112 ARG CA C 55.140 0.1 1 511 112 112 ARG CB C 33.165 0.1 1 512 112 112 ARG N N 118.422 0.1 1 513 113 113 GLY H H 8.326 0.01 1 514 113 113 GLY C C 169.650 0.1 1 515 113 113 GLY CA C 43.394 0.1 1 516 113 113 GLY N N 111.788 0.1 1 517 114 114 TYR H H 8.622 0.01 1 518 114 114 TYR C C 175.175 0.1 1 519 114 114 TYR CA C 56.479 0.1 1 520 114 114 TYR CB C 41.977 0.1 1 521 114 114 TYR N N 119.054 0.1 1 522 115 115 GLU H H 9.182 0.01 1 523 115 115 GLU C C 173.617 0.1 1 524 115 115 GLU CA C 57.738 0.1 1 525 115 115 GLU CB C 29.974 0.1 1 526 115 115 GLU N N 123.541 0.1 1 527 116 116 GLN H H 9.015 0.01 1 528 116 116 GLN C C 173.647 0.1 1 529 116 116 GLN CA C 56.966 0.1 1 530 116 116 GLN CB C 32.465 0.1 1 531 116 116 GLN N N 123.034 0.1 1 532 117 117 PHE H H 9.257 0.01 1 533 117 117 PHE C C 175.980 0.1 1 534 117 117 PHE CA C 56.769 0.1 1 535 117 117 PHE CB C 45.108 0.1 1 536 117 117 PHE N N 117.515 0.1 1 537 118 118 ALA H H 9.553 0.01 1 538 118 118 ALA C C 175.536 0.1 1 539 118 118 ALA CA C 51.617 0.1 1 540 118 118 ALA CB C 21.789 0.1 1 541 118 118 ALA N N 125.699 0.1 1 542 119 119 TYR H H 9.530 0.01 1 543 119 119 TYR C C 175.086 0.1 1 544 119 119 TYR CA C 54.687 0.1 1 545 119 119 TYR CB C 40.028 0.1 1 546 119 119 TYR N N 125.718 0.1 1 547 120 120 ASP H H 9.828 0.01 1 548 120 120 ASP C C 175.550 0.1 1 549 120 120 ASP CA C 55.042 0.1 1 550 120 120 ASP CB C 37.835 0.1 1 551 120 120 ASP N N 131.067 0.1 1 552 121 121 GLY H H 8.912 0.01 1 553 121 121 GLY C C 174.313 0.1 1 554 121 121 GLY CA C 44.720 0.1 1 555 121 121 GLY N N 102.704 0.1 1 556 122 122 CYS H H 7.932 0.01 1 557 122 122 CYS C C 173.747 0.1 1 558 122 122 CYS CA C 52.858 0.1 1 559 122 122 CYS CB C 41.808 0.1 1 560 122 122 CYS N N 120.477 0.1 1 561 123 123 ASP H H 8.915 0.01 1 562 123 123 ASP C C 174.412 0.1 1 563 123 123 ASP CA C 56.774 0.1 1 564 123 123 ASP CB C 40.285 0.1 1 565 123 123 ASP N N 125.073 0.1 1 566 124 124 TYR H H 8.674 0.01 1 567 124 124 TYR C C 171.789 0.1 1 568 124 124 TYR CA C 59.891 0.1 1 569 124 124 TYR CB C 40.274 0.1 1 570 124 124 TYR N N 123.248 0.1 1 571 125 125 ILE H H 7.320 0.01 1 572 125 125 ILE C C 172.478 0.1 1 573 125 125 ILE CA C 58.924 0.1 1 574 125 125 ILE CB C 41.551 0.1 1 575 125 125 ILE N N 115.249 0.1 1 576 126 126 ALA H H 8.466 0.01 1 577 126 126 ALA C C 175.450 0.1 1 578 126 126 ALA CA C 51.296 0.1 1 579 126 126 ALA CB C 22.943 0.1 1 580 126 126 ALA N N 127.200 0.1 1 581 127 127 LEU H H 9.096 0.01 1 582 127 127 LEU C C 177.105 0.1 1 583 127 127 LEU CA C 54.620 0.1 1 584 127 127 LEU CB C 42.275 0.1 1 585 127 127 LEU N N 127.268 0.1 1 586 128 128 ASN H H 8.842 0.01 1 587 128 128 ASN C C 175.607 0.1 1 588 128 128 ASN CA C 52.643 0.1 1 589 128 128 ASN CB C 37.599 0.1 1 590 128 128 ASN N N 127.526 0.1 1 591 129 129 GLU H H 8.820 0.01 1 592 129 129 GLU C C 176.143 0.1 1 593 129 129 GLU CA C 58.617 0.1 1 594 129 129 GLU CB C 28.493 0.1 1 595 129 129 GLU N N 119.175 0.1 1 596 130 130 ASP H H 7.340 0.01 1 597 130 130 ASP C C 175.536 0.1 1 598 130 130 ASP CA C 54.129 0.1 1 599 130 130 ASP CB C 39.254 0.1 1 600 130 130 ASP N N 116.597 0.1 1 601 131 131 LEU H H 8.486 0.01 1 602 131 131 LEU C C 174.911 0.1 1 603 131 131 LEU CA C 55.510 0.1 1 604 131 131 LEU CB C 38.210 0.1 1 605 131 131 LEU N N 116.045 0.1 1 606 132 132 ARG H H 8.488 0.01 1 607 132 132 ARG C C 175.090 0.1 1 608 132 132 ARG CA C 56.231 0.1 1 609 132 132 ARG CB C 34.308 0.1 1 610 132 132 ARG N N 114.844 0.1 1 611 133 133 THR H H 8.461 0.01 1 612 133 133 THR C C 171.813 0.1 1 613 133 133 THR CA C 59.274 0.1 1 614 133 133 THR CB C 72.866 0.1 1 615 133 133 THR N N 113.313 0.1 1 616 134 134 TRP H H 8.736 0.01 1 617 134 134 TRP C C 177.521 0.1 1 618 134 134 TRP CA C 55.168 0.1 1 619 134 134 TRP CB C 32.125 0.1 1 620 134 134 TRP N N 119.213 0.1 1 621 135 135 THR H H 9.728 0.01 1 622 135 135 THR C C 173.634 0.1 1 623 135 135 THR CA C 62.822 0.1 1 624 135 135 THR CB C 69.794 0.1 1 625 135 135 THR N N 120.487 0.1 1 626 136 136 ALA H H 8.832 0.01 1 627 136 136 ALA C C 176.179 0.1 1 628 136 136 ALA CA C 49.699 0.1 1 629 136 136 ALA CB C 19.923 0.1 1 630 136 136 ALA N N 131.989 0.1 1 631 137 137 ALA H H 8.213 0.01 1 632 137 137 ALA C C 176.868 0.1 1 633 137 137 ALA CA C 54.074 0.1 1 634 137 137 ALA CB C 20.020 0.1 1 635 137 137 ALA N N 125.468 0.1 1 636 138 138 ASP H H 7.338 0.01 1 637 138 138 ASP C C 176.007 0.1 1 638 138 138 ASP CA C 52.342 0.1 1 639 138 138 ASP CB C 41.249 0.1 1 640 138 138 ASP N N 115.707 0.1 1 641 139 139 MET H H 8.129 0.01 1 642 139 139 MET C C 178.442 0.1 1 643 139 139 MET CA C 58.071 0.1 1 644 139 139 MET CB C 31.255 0.1 1 645 139 139 MET N N 116.909 0.1 1 646 140 140 ALA H H 7.838 0.01 1 647 140 140 ALA C C 178.063 0.1 1 648 140 140 ALA CA C 54.272 0.1 1 649 140 140 ALA CB C 16.847 0.1 1 650 140 140 ALA N N 125.182 0.1 1 651 141 141 ALA H H 8.075 0.01 1 652 141 141 ALA C C 179.783 0.1 1 653 141 141 ALA CA C 53.451 0.1 1 654 141 141 ALA CB C 18.768 0.1 1 655 141 141 ALA N N 118.331 0.1 1 656 142 142 GLN H H 7.561 0.01 1 657 142 142 GLN C C 178.753 0.1 1 658 142 142 GLN CA C 58.025 0.1 1 659 142 142 GLN CB C 26.616 0.1 1 660 142 142 GLN N N 116.523 0.1 1 661 143 143 ILE H H 7.548 0.01 1 662 143 143 ILE C C 179.413 0.1 1 663 143 143 ILE CA C 64.843 0.1 1 664 143 143 ILE CB C 36.316 0.1 1 665 143 143 ILE N N 122.881 0.1 1 666 144 144 THR H H 6.705 0.01 1 667 144 144 THR C C 174.429 0.1 1 668 144 144 THR CA C 66.165 0.1 1 669 144 144 THR CB C 67.876 0.1 1 670 144 144 THR N N 117.470 0.1 1 671 145 145 ARG H H 8.608 0.01 1 672 145 145 ARG C C 176.911 0.1 1 673 145 145 ARG CA C 60.072 0.1 1 674 145 145 ARG CB C 29.057 0.1 1 675 145 145 ARG N N 120.419 0.1 1 676 146 146 ARG H H 7.720 0.01 1 677 146 146 ARG C C 179.393 0.1 1 678 146 146 ARG CA C 59.293 0.1 1 679 146 146 ARG CB C 28.972 0.1 1 680 146 146 ARG N N 118.073 0.1 1 681 147 147 LYS H H 7.444 0.01 1 682 147 147 LYS C C 180.013 0.1 1 683 147 147 LYS CA C 59.704 0.1 1 684 147 147 LYS CB C 31.492 0.1 1 685 147 147 LYS N N 119.180 0.1 1 686 148 148 TRP H H 9.258 0.01 1 687 148 148 TRP C C 180.823 0.1 1 688 148 148 TRP CA C 59.984 0.1 1 689 148 148 TRP CB C 26.818 0.1 1 690 148 148 TRP N N 123.560 0.1 1 691 149 149 GLU H H 9.302 0.01 1 692 149 149 GLU C C 179.819 0.1 1 693 149 149 GLU CA C 59.877 0.1 1 694 149 149 GLU CB C 28.851 0.1 1 695 149 149 GLU N N 125.613 0.1 1 696 150 150 GLN H H 8.014 0.01 1 697 150 150 GLN C C 177.636 0.1 1 698 150 150 GLN CA C 58.468 0.1 1 699 150 150 GLN CB C 27.600 0.1 1 700 150 150 GLN N N 120.616 0.1 1 701 151 151 ALA H H 7.778 0.01 1 702 151 151 ALA C C 177.791 0.1 1 703 151 151 ALA CA C 51.656 0.1 1 704 151 151 ALA CB C 18.555 0.1 1 705 151 151 ALA N N 117.570 0.1 1 706 152 152 GLY H H 7.701 0.01 1 707 152 152 GLY C C 176.540 0.1 1 708 152 152 GLY CA C 46.453 0.1 1 709 152 152 GLY N N 108.180 0.1 1 710 153 153 ALA H H 7.894 0.01 1 711 153 153 ALA C C 178.479 0.1 1 712 153 153 ALA CA C 55.097 0.1 1 713 153 153 ALA CB C 17.154 0.1 1 714 153 153 ALA N N 120.580 0.1 1 715 154 154 ALA H H 9.457 0.01 1 716 154 154 ALA C C 177.680 0.1 1 717 154 154 ALA CA C 56.103 0.1 1 718 154 154 ALA CB C 16.947 0.1 1 719 154 154 ALA N N 117.321 0.1 1 720 155 155 GLU H H 7.613 0.01 1 721 155 155 GLU C C 178.935 0.1 1 722 155 155 GLU CA C 59.063 0.1 1 723 155 155 GLU CB C 28.912 0.1 1 724 155 155 GLU N N 115.230 0.1 1 725 156 156 TYR H H 7.248 0.01 1 726 156 156 TYR C C 177.632 0.1 1 727 156 156 TYR CA C 60.328 0.1 1 728 156 156 TYR CB C 37.397 0.1 1 729 156 156 TYR N N 120.809 0.1 1 730 157 157 TYR H H 7.134 0.01 1 731 157 157 TYR C C 177.301 0.1 1 732 157 157 TYR CA C 62.491 0.1 1 733 157 157 TYR CB C 36.792 0.1 1 734 157 157 TYR N N 119.646 0.1 1 735 158 158 ARG H H 9.302 0.01 1 736 158 158 ARG C C 176.739 0.1 1 737 158 158 ARG CA C 60.485 0.1 1 738 158 158 ARG CB C 28.753 0.1 1 739 158 158 ARG N N 120.403 0.1 1 740 159 159 ALA H H 7.533 0.01 1 741 159 159 ALA C C 181.550 0.1 1 742 159 159 ALA CA C 54.571 0.1 1 743 159 159 ALA CB C 16.842 0.1 1 744 159 159 ALA N N 118.402 0.1 1 745 160 160 TYR H H 6.923 0.01 1 746 160 160 TYR C C 176.431 0.1 1 747 160 160 TYR CA C 60.708 0.1 1 748 160 160 TYR CB C 37.139 0.1 1 749 160 160 TYR N N 119.117 0.1 1 750 161 161 LEU H H 8.764 0.01 1 751 161 161 LEU C C 176.149 0.1 1 752 161 161 LEU CA C 57.681 0.1 1 753 161 161 LEU CB C 41.699 0.1 1 754 161 161 LEU N N 122.013 0.1 1 755 162 162 GLU H H 8.232 0.01 1 756 162 162 GLU C C 177.212 0.1 1 757 162 162 GLU CA C 56.768 0.1 1 758 162 162 GLU CB C 30.110 0.1 1 759 162 162 GLU N N 109.458 0.1 1 760 163 163 GLY H H 7.228 0.01 1 761 163 163 GLY C C 173.222 0.1 1 762 163 163 GLY CA C 45.499 0.1 1 763 163 163 GLY N N 108.436 0.1 1 764 164 164 GLU H H 8.648 0.01 1 765 164 164 GLU C C 176.982 0.1 1 766 164 164 GLU CA C 60.349 0.1 1 767 164 164 GLU CB C 30.343 0.1 1 768 164 164 GLU N N 129.737 0.1 1 769 165 165 CYS H H 8.826 0.01 1 770 165 165 CYS C C 175.172 0.1 1 771 165 165 CYS CA C 61.334 0.1 1 772 165 165 CYS CB C 41.120 0.1 1 773 165 165 CYS N N 118.185 0.1 1 774 166 166 VAL H H 6.188 0.01 1 775 166 166 VAL C C 178.014 0.1 1 776 166 166 VAL CA C 65.439 0.1 1 777 166 166 VAL CB C 31.786 0.1 1 778 166 166 VAL N N 116.198 0.1 1 779 167 167 GLU H H 8.044 0.01 1 780 167 167 GLU C C 180.491 0.1 1 781 167 167 GLU CA C 58.831 0.1 1 782 167 167 GLU CB C 29.011 0.1 1 783 167 167 GLU N N 120.296 0.1 1 784 168 168 TRP H H 8.919 0.01 1 785 168 168 TRP C C 176.282 0.1 1 786 168 168 TRP CA C 61.088 0.1 1 787 168 168 TRP CB C 26.408 0.1 1 788 168 168 TRP N N 120.236 0.1 1 789 169 169 LEU H H 7.883 0.01 1 790 169 169 LEU C C 178.162 0.1 1 791 169 169 LEU CA C 58.841 0.1 1 792 169 169 LEU CB C 39.661 0.1 1 793 169 169 LEU N N 120.397 0.1 1 794 170 170 HIS H H 7.718 0.01 1 795 170 170 HIS C C 177.715 0.1 1 796 170 170 HIS CA C 59.975 0.1 1 797 170 170 HIS CB C 28.388 0.1 1 798 170 170 HIS N N 115.018 0.1 1 799 171 171 ARG H H 7.344 0.01 1 800 171 171 ARG C C 178.223 0.1 1 801 171 171 ARG CA C 58.930 0.1 1 802 171 171 ARG CB C 28.442 0.1 1 803 171 171 ARG N N 122.099 0.1 1 804 172 172 TYR H H 8.620 0.01 1 805 172 172 TYR C C 179.371 0.1 1 806 172 172 TYR CA C 58.004 0.1 1 807 172 172 TYR CB C 36.302 0.1 1 808 172 172 TYR N N 120.544 0.1 1 809 173 173 LEU H H 8.375 0.01 1 810 173 173 LEU C C 179.434 0.1 1 811 173 173 LEU CA C 56.779 0.1 1 812 173 173 LEU CB C 40.174 0.1 1 813 173 173 LEU N N 119.571 0.1 1 814 174 174 LYS H H 7.497 0.01 1 815 174 174 LYS C C 179.905 0.1 1 816 174 174 LYS CA C 58.543 0.1 1 817 174 174 LYS CB C 30.616 0.1 1 818 174 174 LYS N N 120.562 0.1 1 819 175 175 ASN H H 8.319 0.01 1 820 175 175 ASN C C 176.972 0.1 1 821 175 175 ASN CA C 54.686 0.1 1 822 175 175 ASN CB C 37.056 0.1 1 823 175 175 ASN N N 120.692 0.1 1 824 176 176 GLY H H 7.456 0.01 1 825 176 176 GLY C C 173.877 0.1 1 826 176 176 GLY CA C 43.842 0.1 1 827 176 176 GLY N N 106.611 0.1 1 828 177 177 ASN H H 7.548 0.01 1 829 177 177 ASN C C 174.525 0.1 1 830 177 177 ASN CA C 53.374 0.1 1 831 177 177 ASN CB C 37.767 0.1 1 832 177 177 ASN N N 118.455 0.1 1 833 178 178 ALA H H 7.902 0.01 1 834 178 178 ALA C C 177.729 0.1 1 835 178 178 ALA CA C 52.204 0.1 1 836 178 178 ALA CB C 18.838 0.1 1 837 178 178 ALA N N 122.282 0.1 1 838 179 179 THR H H 8.073 0.01 1 839 179 179 THR C C 173.741 0.1 1 840 179 179 THR CA C 61.664 0.1 1 841 179 179 THR CB C 69.103 0.1 1 842 179 179 THR N N 115.116 0.1 1 843 180 180 LEU H H 7.900 0.01 1 844 180 180 LEU CA C 56.628 0.1 1 845 180 180 LEU CB C 41.738 0.1 1 846 180 180 LEU N N 131.909 0.1 1 stop_ save_