data_26653 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for Nogo-A-Delta20 ; _BMRB_accession_number 26653 _BMRB_flat_file_name bmr26653.str _Entry_type original _Submission_date 2015-09-10 _Accession_date 2015-09-10 _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 Zelenay Viviane . . 2 Arzt Michael E. . 3 Bibow Stefan . . 4 Schwab Martin E. . 5 Riek Roland . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 237 "13C chemical shifts" 352 "15N chemical shifts" 170 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-12-12 update BMRB 'update entry citation' 2015-12-09 original author 'original release' stop_ _Original_release_date 2015-12-09 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; The Neurite Outgrowth Inhibitory Nogo-A-Delta20 Region is an Intrinsically Disordered Segment Harbouring Three Stretches with Helical Propensity ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 27611089 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Zelenay Viviane . . 2 Arzt Michael E. . 3 Bibow Stefan . . 4 Schwab Martin E. . 5 Riek Roland . . stop_ _Journal_abbreviation 'PLoS One' _Journal_volume 11 _Journal_issue 9 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first e0161813 _Page_last e0161813 _Year 2016 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Nogo-A-Delta20 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Nogo-A-Delta20, 1' $Nogo-A-Delta20 'Nogo-A-Delta20, 2' $Nogo-A-Delta20 stop_ _System_molecular_weight . _System_physical_state 'intrinsically disordered' _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Nogo-A-Delta20 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Nogo-A-Delta20 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 207 _Mol_residue_sequence ; GSHMASMTGGQQMGRGSTGT KIAYETKVDLVQTSEAIQES LYPTAQLCPSFEEAEATPSP VLPDIVMEAPLNSLLPSAGA SVVQPSVSPLEAPPPVSYDS IKLEPENPPPYEEAMNVALK ALGTKEGIKEPESFNAAVQE TEAPYISIACDLIKETKLST EPSPDFSNYSEIAKFEKSVP EHAELVEDSSPESEPVDLFL EHHHHHH ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 HIS 4 MET 5 ALA 6 SER 7 MET 8 THR 9 GLY 10 GLY 11 GLN 12 GLN 13 MET 14 GLY 15 ARG 16 GLY 17 SER 18 THR 19 GLY 20 THR 21 LYS 22 ILE 23 ALA 24 TYR 25 GLU 26 THR 27 LYS 28 VAL 29 ASP 30 LEU 31 VAL 32 GLN 33 THR 34 SER 35 GLU 36 ALA 37 ILE 38 GLN 39 GLU 40 SER 41 LEU 42 TYR 43 PRO 44 THR 45 ALA 46 GLN 47 LEU 48 CYS 49 PRO 50 SER 51 PHE 52 GLU 53 GLU 54 ALA 55 GLU 56 ALA 57 THR 58 PRO 59 SER 60 PRO 61 VAL 62 LEU 63 PRO 64 ASP 65 ILE 66 VAL 67 MET 68 GLU 69 ALA 70 PRO 71 LEU 72 ASN 73 SER 74 LEU 75 LEU 76 PRO 77 SER 78 ALA 79 GLY 80 ALA 81 SER 82 VAL 83 VAL 84 GLN 85 PRO 86 SER 87 VAL 88 SER 89 PRO 90 LEU 91 GLU 92 ALA 93 PRO 94 PRO 95 PRO 96 VAL 97 SER 98 TYR 99 ASP 100 SER 101 ILE 102 LYS 103 LEU 104 GLU 105 PRO 106 GLU 107 ASN 108 PRO 109 PRO 110 PRO 111 TYR 112 GLU 113 GLU 114 ALA 115 MET 116 ASN 117 VAL 118 ALA 119 LEU 120 LYS 121 ALA 122 LEU 123 GLY 124 THR 125 LYS 126 GLU 127 GLY 128 ILE 129 LYS 130 GLU 131 PRO 132 GLU 133 SER 134 PHE 135 ASN 136 ALA 137 ALA 138 VAL 139 GLN 140 GLU 141 THR 142 GLU 143 ALA 144 PRO 145 TYR 146 ILE 147 SER 148 ILE 149 ALA 150 CYS 151 ASP 152 LEU 153 ILE 154 LYS 155 GLU 156 THR 157 LYS 158 LEU 159 SER 160 THR 161 GLU 162 PRO 163 SER 164 PRO 165 ASP 166 PHE 167 SER 168 ASN 169 TYR 170 SER 171 GLU 172 ILE 173 ALA 174 LYS 175 PHE 176 GLU 177 LYS 178 SER 179 VAL 180 PRO 181 GLU 182 HIS 183 ALA 184 GLU 185 LEU 186 VAL 187 GLU 188 ASP 189 SER 190 SER 191 PRO 192 GLU 193 SER 194 GLU 195 PRO 196 VAL 197 ASP 198 LEU 199 PHE 200 LEU 201 GLU 202 HIS 203 HIS 204 HIS 205 HIS 206 HIS 207 HIS 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 $Nogo-A-Delta20 Rat 10116 Eukaryota Metazoa Rattus norvegicus 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 $Nogo-A-Delta20 'recombinant technology' . Escherichia coli . pET28 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 $Nogo-A-Delta20 0.4 mM '[U-100% 13C; U-100% 15N]' stop_ save_ ############################ # Computer software used # ############################ save_CCPNMR _Saveframe_category software _Name CCPNMR _Version . loop_ _Vendor _Address _Electronic_address CCPN . . 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 III' _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance III' _Field_strength 700 _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_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_HNN_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNN _Sample_label $sample_1 save_ save_HCAN_5 _Saveframe_category NMR_applied_experiment _Experiment_name HCAN _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' 0.15 . M pH 7.4 . pH pressure 1 . atm temperature 279 . 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 '2D 1H-15N HSQC' '3D HNCA' '3D HNCACB' HNN HCAN 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 'Nogo-A-Delta20, 1' _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 5 5 ALA CA C 52.821 0.000 1 2 6 6 SER H H 8.060 0.001 1 3 6 6 SER CA C 58.381 0.000 1 4 6 6 SER N N 114.495 0.002 1 5 7 7 MET CA C 55.605 0.000 1 6 8 8 THR H H 7.961 0.000 1 7 8 8 THR CA C 61.976 0.021 1 8 8 8 THR N N 114.165 0.006 1 9 9 9 GLY H H 8.259 0.007 1 10 9 9 GLY HA3 H 3.724 0.004 1 11 9 9 GLY CA C 45.401 0.019 1 12 9 9 GLY N N 111.200 0.030 1 13 10 10 GLY H H 8.134 0.006 1 14 10 10 GLY CA C 45.234 0.044 1 15 10 10 GLY N N 108.540 0.047 1 16 11 11 GLN H H 8.130 0.008 1 17 11 11 GLN CA C 55.709 0.076 1 18 11 11 GLN CB C 29.068 0.000 1 19 11 11 GLN N N 119.659 0.030 1 20 13 13 MET CA C 55.496 0.038 1 21 13 13 MET CB C 32.320 0.000 1 22 14 14 GLY H H 8.298 0.006 1 23 14 14 GLY CA C 45.324 0.095 1 24 14 14 GLY N N 110.093 0.057 1 25 15 15 ARG H H 8.104 0.003 1 26 15 15 ARG CA C 56.194 0.062 1 27 15 15 ARG CB C 30.403 0.040 1 28 15 15 ARG N N 120.522 0.013 1 29 16 16 GLY H H 8.350 0.007 1 30 16 16 GLY CA C 45.255 0.110 1 31 16 16 GLY N N 110.098 0.031 1 32 17 17 SER H H 8.128 0.006 1 33 17 17 SER CA C 58.232 0.046 1 34 17 17 SER CB C 63.692 0.018 1 35 17 17 SER N N 115.636 0.083 1 36 18 18 THR H H 8.111 0.004 1 37 18 18 THR HA H 4.119 0.001 1 38 18 18 THR CA C 62.008 0.071 1 39 18 18 THR CB C 69.656 0.044 1 40 18 18 THR N N 115.231 0.063 1 41 19 19 GLY H H 8.219 0.007 1 42 19 19 GLY HA3 H 3.738 0.000 1 43 19 19 GLY CA C 45.227 0.138 1 44 19 19 GLY N N 110.985 0.057 1 45 20 20 THR H H 7.865 0.008 1 46 20 20 THR CA C 62.022 0.023 1 47 20 20 THR CB C 69.741 0.046 1 48 20 20 THR N N 114.366 0.046 1 49 21 21 LYS H H 8.212 0.001 1 50 21 21 LYS CA C 56.300 0.005 1 51 21 21 LYS CB C 32.615 0.009 1 52 21 21 LYS N N 124.494 0.013 1 53 22 22 ILE H H 7.999 0.008 1 54 22 22 ILE CA C 60.916 0.066 1 55 22 22 ILE CB C 38.337 0.032 1 56 22 22 ILE N N 123.346 0.020 1 57 23 23 ALA H H 8.130 0.005 1 58 23 23 ALA HA H 4.023 0.001 1 59 23 23 ALA CA C 52.018 0.088 1 60 23 23 ALA CB C 19.149 0.034 1 61 23 23 ALA N N 128.511 0.032 1 62 24 24 TYR H H 7.930 0.006 1 63 24 24 TYR HA H 4.115 0.001 1 64 24 24 TYR CA C 57.845 0.059 1 65 24 24 TYR CB C 38.727 0.014 1 66 24 24 TYR N N 120.158 0.086 1 67 25 25 GLU H H 8.152 0.008 1 68 25 25 GLU HA H 4.031 0.002 1 69 25 25 GLU CA C 56.279 0.026 1 70 25 25 GLU CB C 30.214 0.006 1 71 25 25 GLU N N 122.513 0.033 1 72 26 26 THR H H 8.034 0.005 1 73 26 26 THR HA H 4.028 0.003 1 74 26 26 THR CA C 61.992 0.085 1 75 26 26 THR CB C 69.690 0.020 1 76 26 26 THR N N 116.843 0.035 1 77 27 27 LYS H H 8.241 0.010 1 78 27 27 LYS HA H 3.946 0.001 1 79 27 27 LYS CA C 56.102 0.051 1 80 27 27 LYS CB C 32.640 0.025 1 81 27 27 LYS N N 124.944 0.070 1 82 28 28 VAL H H 8.026 0.007 1 83 28 28 VAL CA C 62.097 0.119 1 84 28 28 VAL CB C 32.619 0.010 1 85 28 28 VAL N N 122.052 0.014 1 86 29 29 ASP H H 8.222 0.008 1 87 29 29 ASP HA H 4.304 0.005 1 88 29 29 ASP CA C 54.233 0.095 1 89 29 29 ASP CB C 40.940 0.000 1 90 29 29 ASP N N 124.382 0.028 1 91 30 30 LEU H H 8.022 0.007 1 92 30 30 LEU HA H 4.209 0.002 1 93 30 30 LEU CA C 54.924 0.138 1 94 30 30 LEU CB C 41.857 0.031 1 95 30 30 LEU N N 122.979 0.035 1 96 31 31 VAL H H 7.991 0.004 1 97 31 31 VAL HA H 3.764 0.001 1 98 31 31 VAL CA C 62.484 0.072 1 99 31 31 VAL CB C 32.579 0.015 1 100 31 31 VAL N N 122.209 0.052 1 101 32 32 GLN H H 8.332 0.006 1 102 32 32 GLN HA H 4.144 0.000 1 103 32 32 GLN CA C 55.621 0.092 1 104 32 32 GLN CB C 29.184 0.021 1 105 32 32 GLN N N 124.746 0.040 1 106 33 33 THR H H 8.082 0.009 1 107 33 33 THR HA H 4.033 0.001 1 108 33 33 THR CA C 61.800 0.034 1 109 33 33 THR CB C 69.817 0.006 1 110 33 33 THR N N 115.860 0.040 1 111 34 34 SER H H 8.226 0.007 1 112 34 34 SER HA H 4.163 0.001 1 113 34 34 SER CA C 58.591 0.024 1 114 34 34 SER CB C 63.714 0.053 1 115 34 34 SER N N 117.759 0.036 1 116 35 35 GLU H H 8.281 0.006 1 117 35 35 GLU HA H 3.960 0.000 1 118 35 35 GLU CA C 56.731 0.136 1 119 35 35 GLU CB C 29.931 0.026 1 120 35 35 GLU N N 122.705 0.037 1 121 36 36 ALA H H 8.041 0.009 1 122 36 36 ALA CA C 52.607 0.059 1 123 36 36 ALA CB C 18.812 0.022 1 124 36 36 ALA N N 124.841 0.043 1 125 37 37 ILE H H 7.952 0.005 1 126 37 37 ILE CA C 61.426 0.035 1 127 37 37 ILE CB C 38.251 0.060 1 128 37 37 ILE N N 120.820 0.044 1 129 38 38 GLN H H 8.240 0.007 1 130 38 38 GLN CA C 56.111 0.071 1 131 38 38 GLN CB C 28.665 0.011 1 132 38 38 GLN N N 124.708 0.053 1 133 39 39 GLU H H 8.246 0.010 1 134 39 39 GLU HA H 3.921 0.001 1 135 39 39 GLU CA C 56.817 0.068 1 136 39 39 GLU CB C 29.907 0.004 1 137 39 39 GLU N N 122.440 0.031 1 138 40 40 SER H H 8.084 0.006 1 139 40 40 SER HA H 4.165 0.001 1 140 40 40 SER CA C 58.441 0.083 1 141 40 40 SER CB C 63.361 0.006 1 142 40 40 SER N N 116.331 0.018 1 143 41 41 LEU H H 7.918 0.009 1 144 41 41 LEU HA H 3.989 0.000 1 145 41 41 LEU CA C 55.255 0.012 1 146 41 41 LEU CB C 42.097 0.007 1 147 41 41 LEU N N 123.650 0.015 1 148 42 42 TYR H H 7.832 0.009 1 149 42 42 TYR HA H 4.248 0.000 1 150 42 42 TYR CA C 55.618 0.070 1 151 42 42 TYR CB C 37.923 0.000 1 152 42 42 TYR N N 120.231 0.018 1 153 43 43 PRO CA C 63.258 0.002 1 154 43 43 PRO CB C 31.831 0.000 1 155 44 44 THR H H 8.087 0.006 1 156 44 44 THR HA H 4.014 0.000 1 157 44 44 THR CA C 61.950 0.087 1 158 44 44 THR CB C 69.803 0.037 1 159 44 44 THR N N 114.885 0.032 1 160 45 45 ALA H H 8.148 0.008 1 161 45 45 ALA CA C 52.565 0.086 1 162 45 45 ALA CB C 19.001 0.027 1 163 45 45 ALA N N 126.500 0.060 1 164 46 46 GLN H H 8.153 0.006 1 165 46 46 GLN CA C 55.578 0.060 1 166 46 46 GLN CB C 29.359 0.000 1 167 46 46 GLN N N 119.797 0.049 1 168 47 47 LEU H H 8.130 0.008 1 169 47 47 LEU CA C 55.430 0.060 1 170 47 47 LEU CB C 41.620 0.068 1 171 47 47 LEU N N 123.928 0.024 1 172 48 48 CYS H H 8.220 0.004 1 173 48 48 CYS CA C 57.211 0.080 1 174 48 48 CYS CB C 27.143 0.000 1 175 48 48 CYS N N 121.914 0.008 1 176 53 53 GLU H H 8.141 0.001 1 177 53 53 GLU CA C 56.292 0.000 1 178 53 53 GLU CB C 30.151 0.011 1 179 53 53 GLU N N 122.301 0.009 1 180 54 54 ALA H H 8.160 0.004 1 181 54 54 ALA CA C 52.418 0.064 1 182 54 54 ALA CB C 19.031 0.050 1 183 54 54 ALA N N 125.345 0.010 1 184 55 55 GLU H H 8.162 0.008 1 185 55 55 GLU HA H 3.920 0.001 1 186 55 55 GLU CA C 56.240 0.066 1 187 55 55 GLU CB C 30.060 0.028 1 188 55 55 GLU N N 120.368 0.041 1 189 56 56 ALA H H 8.157 0.005 1 190 56 56 ALA HA H 4.050 0.000 1 191 56 56 ALA CA C 52.285 0.063 1 192 56 56 ALA CB C 19.020 0.021 1 193 56 56 ALA N N 125.698 0.047 1 194 57 57 THR H H 8.110 0.007 1 195 57 57 THR HA H 4.271 0.002 1 196 57 57 THR CA C 59.763 0.065 1 197 57 57 THR CB C 69.679 0.000 1 198 57 57 THR N N 117.172 0.078 1 199 58 58 PRO HA H 4.159 0.003 1 200 58 58 PRO CA C 62.970 0.007 1 201 58 58 PRO CB C 31.966 0.000 1 202 58 58 PRO N N 139.441 0.065 1 203 59 59 SER H H 8.350 0.008 1 204 59 59 SER HA H 4.429 0.000 1 205 59 59 SER CA C 56.554 0.049 1 206 59 59 SER CB C 62.992 0.000 1 207 59 59 SER N N 118.451 0.047 1 208 60 60 PRO HA H 4.159 0.000 1 209 60 60 PRO CA C 62.952 0.086 1 210 60 60 PRO CB C 31.820 0.000 1 211 60 60 PRO N N 137.948 0.015 1 212 61 61 VAL H H 8.094 0.008 1 213 61 61 VAL HA H 4.002 0.000 1 214 61 61 VAL CA C 62.239 0.021 1 215 61 61 VAL CB C 32.239 0.020 1 216 61 61 VAL N N 121.639 0.051 1 217 62 62 LEU H H 8.283 0.006 1 218 62 62 LEU CA C 52.668 0.070 1 219 62 62 LEU CB C 41.323 0.000 1 220 62 62 LEU N N 128.855 0.019 1 221 63 63 PRO CA C 62.655 0.142 1 222 63 63 PRO CB C 31.853 0.000 1 223 64 64 ASP H H 8.173 0.007 1 224 64 64 ASP CA C 54.442 0.014 1 225 64 64 ASP CB C 40.820 0.070 1 226 64 64 ASP N N 120.611 0.026 1 227 65 65 ILE H H 7.897 0.009 1 228 65 65 ILE CA C 60.948 0.030 1 229 65 65 ILE CB C 38.330 0.052 1 230 65 65 ILE N N 121.380 0.020 1 231 66 66 VAL H H 8.128 0.007 1 232 66 66 VAL CA C 62.350 0.058 1 233 66 66 VAL CB C 32.252 0.006 1 234 66 66 VAL N N 126.136 0.010 1 235 67 67 MET H H 8.325 0.006 1 236 67 67 MET CA C 55.060 0.176 1 237 67 67 MET CB C 32.468 0.010 1 238 67 67 MET N N 125.635 0.047 1 239 68 68 GLU H H 8.233 0.004 1 240 68 68 GLU CA C 56.068 0.168 1 241 68 68 GLU CB C 30.230 0.056 1 242 68 68 GLU N N 123.032 0.034 1 243 69 69 ALA H H 8.219 0.002 1 244 69 69 ALA CA C 50.473 0.055 1 245 69 69 ALA CB C 17.748 0.000 1 246 69 69 ALA N N 127.055 0.008 1 247 70 70 PRO CA C 62.663 0.128 1 248 70 70 PRO CB C 32.047 0.000 1 249 71 71 LEU H H 8.232 0.003 1 250 71 71 LEU CA C 55.577 0.009 1 251 71 71 LEU CB C 41.912 0.026 1 252 71 71 LEU N N 122.588 0.025 1 253 72 72 ASN H H 8.285 0.008 1 254 72 72 ASN CA C 53.141 0.143 1 255 72 72 ASN CB C 38.428 0.072 1 256 72 72 ASN N N 119.249 0.123 1 257 73 73 SER H H 8.030 0.007 1 258 73 73 SER CA C 58.481 0.089 1 259 73 73 SER CB C 63.638 0.015 1 260 73 73 SER N N 116.045 0.025 1 261 74 74 LEU H H 7.997 0.010 1 262 74 74 LEU CA C 55.016 0.028 1 263 74 74 LEU CB C 41.700 0.024 1 264 74 74 LEU N N 123.378 0.009 1 265 75 75 LEU H H 7.879 0.007 1 266 75 75 LEU CA C 52.658 0.061 1 267 75 75 LEU CB C 41.367 0.000 1 268 75 75 LEU N N 123.858 0.014 1 269 76 76 PRO CA C 63.199 0.000 1 270 76 76 PRO CB C 31.796 0.000 1 271 77 77 SER H H 8.175 0.008 1 272 77 77 SER CA C 58.222 0.033 1 273 77 77 SER CB C 63.737 0.096 1 274 77 77 SER N N 115.910 0.020 1 275 78 78 ALA H H 8.216 0.007 1 276 78 78 ALA HA H 4.051 0.001 1 277 78 78 ALA CA C 52.741 0.077 1 278 78 78 ALA CB C 18.940 0.033 1 279 78 78 ALA N N 126.175 0.018 1 280 79 79 GLY H H 8.138 0.006 1 281 79 79 GLY HA3 H 3.657 0.000 1 282 79 79 GLY CA C 45.026 0.099 1 283 79 79 GLY N N 108.069 0.014 1 284 80 80 ALA H H 7.912 0.006 1 285 80 80 ALA HA H 4.063 0.000 1 286 80 80 ALA CA C 52.349 0.074 1 287 80 80 ALA CB C 19.120 0.002 1 288 80 80 ALA N N 123.477 0.028 1 289 81 81 SER H H 8.133 0.006 1 290 81 81 SER HA H 4.194 0.004 1 291 81 81 SER CA C 58.206 0.068 1 292 81 81 SER CB C 63.755 0.069 1 293 81 81 SER N N 115.396 0.044 1 294 82 82 VAL H H 7.971 0.010 1 295 82 82 VAL HA H 3.854 0.001 1 296 82 82 VAL CA C 62.207 0.055 1 297 82 82 VAL CB C 32.399 0.019 1 298 82 82 VAL N N 122.287 0.015 1 299 83 83 VAL H H 8.104 0.007 1 300 83 83 VAL HA H 3.776 0.001 1 301 83 83 VAL CA C 62.173 0.036 1 302 83 83 VAL CB C 32.287 0.003 1 303 83 83 VAL N N 125.481 0.046 1 304 84 84 GLN H H 8.399 0.007 1 305 84 84 GLN HA H 4.322 0.000 1 306 84 84 GLN CA C 53.272 0.096 1 307 84 84 GLN CB C 28.424 0.000 1 308 84 84 GLN N N 126.582 0.023 1 309 85 85 PRO HA H 4.165 0.002 1 310 85 85 PRO CA C 62.821 0.095 1 311 85 85 PRO CB C 31.962 0.000 1 312 85 85 PRO N N 136.923 0.070 1 313 86 86 SER H H 8.288 0.006 1 314 86 86 SER HA H 4.166 0.002 1 315 86 86 SER CA C 58.222 0.014 1 316 86 86 SER CB C 63.823 0.000 1 317 86 86 SER N N 116.700 0.008 1 318 87 87 VAL H H 8.038 0.007 1 319 87 87 VAL HA H 3.819 0.001 1 320 87 87 VAL CA C 61.980 0.102 1 321 87 87 VAL CB C 32.462 0.000 1 322 87 87 VAL N N 121.865 0.051 1 323 88 88 SER H H 8.313 0.008 1 324 88 88 SER CA C 56.225 0.034 1 325 88 88 SER CB C 63.219 0.000 1 326 88 88 SER N N 121.616 0.019 1 327 89 89 PRO CA C 62.862 0.000 1 328 89 89 PRO CB C 31.939 0.000 1 329 90 90 LEU H H 8.058 0.010 1 330 90 90 LEU CA C 55.559 0.000 1 331 90 90 LEU CB C 42.115 0.027 1 332 90 90 LEU N N 119.748 0.009 1 333 91 91 GLU H H 8.024 0.012 1 334 91 91 GLU HA H 4.283 0.001 1 335 91 91 GLU CA C 55.888 0.072 1 336 91 91 GLU CB C 30.243 0.003 1 337 91 91 GLU N N 121.680 0.020 1 338 92 92 ALA H H 8.106 0.007 1 339 92 92 ALA HA H 4.290 0.001 1 340 92 92 ALA CA C 50.247 0.079 1 341 92 92 ALA CB C 17.857 0.000 1 342 92 92 ALA N N 126.887 0.070 1 343 93 93 PRO N N 136.813 0.000 1 344 95 95 PRO HA H 4.162 0.010 1 345 95 95 PRO CA C 63.285 0.015 1 346 95 95 PRO CB C 32.251 0.000 1 347 95 95 PRO N N 136.219 0.000 1 348 96 96 VAL H H 8.016 0.009 1 349 96 96 VAL HA H 4.118 0.002 1 350 96 96 VAL CA C 62.348 0.085 1 351 96 96 VAL CB C 32.519 0.042 1 352 96 96 VAL N N 120.611 0.021 1 353 97 97 SER H H 8.099 0.006 1 354 97 97 SER HA H 4.171 0.000 1 355 97 97 SER CA C 57.459 0.106 1 356 97 97 SER CB C 63.966 0.006 1 357 97 97 SER N N 119.275 0.025 1 358 98 98 TYR H H 8.215 0.008 1 359 98 98 TYR CA C 57.950 0.067 1 360 98 98 TYR CB C 38.422 0.012 1 361 98 98 TYR N N 123.219 0.050 1 362 99 99 ASP H H 8.050 0.010 1 363 99 99 ASP CA C 54.340 0.056 1 364 99 99 ASP CB C 40.908 0.052 1 365 99 99 ASP N N 121.279 0.018 1 366 100 100 SER H H 7.929 0.009 1 367 100 100 SER CA C 58.463 0.035 1 368 100 100 SER CB C 63.736 0.005 1 369 100 100 SER N N 115.850 0.020 1 370 101 101 ILE H H 7.867 0.009 1 371 101 101 ILE CA C 61.174 0.075 1 372 101 101 ILE CB C 38.201 0.003 1 373 101 101 ILE N N 122.648 0.014 1 374 102 102 LYS H H 8.161 0.006 1 375 102 102 LYS CA C 55.905 0.084 1 376 102 102 LYS CB C 32.583 0.007 1 377 102 102 LYS N N 126.256 0.030 1 378 103 103 LEU H H 8.158 0.007 1 379 103 103 LEU CA C 54.767 0.008 1 380 103 103 LEU CB C 42.134 0.019 1 381 103 103 LEU N N 124.928 0.015 1 382 104 104 GLU H H 8.189 0.007 1 383 104 104 GLU CA C 54.226 0.004 1 384 104 104 GLU CB C 29.357 0.000 1 385 104 104 GLU N N 123.322 0.020 1 386 105 105 PRO CA C 63.179 0.046 1 387 105 105 PRO CB C 32.554 0.000 1 388 106 106 GLU H H 8.325 0.008 1 389 106 106 GLU CA C 56.420 0.033 1 390 106 106 GLU CB C 29.996 0.006 1 391 106 106 GLU N N 121.357 0.014 1 392 107 107 ASN H H 8.321 0.009 1 393 107 107 ASN CA C 51.185 0.148 1 394 107 107 ASN CB C 38.470 0.000 1 395 107 107 ASN N N 120.318 0.022 1 396 110 110 PRO CA C 63.145 0.143 1 397 110 110 PRO CB C 32.238 0.000 1 398 111 111 TYR H H 8.004 0.007 1 399 111 111 TYR CA C 58.205 0.072 1 400 111 111 TYR CB C 38.394 0.003 1 401 111 111 TYR N N 120.783 0.043 1 402 112 112 GLU H H 7.949 0.012 1 403 112 112 GLU CA C 56.200 0.206 1 404 112 112 GLU CB C 30.420 0.011 1 405 112 112 GLU N N 123.511 0.013 1 406 113 113 GLU H H 8.057 0.008 1 407 113 113 GLU CA C 56.828 0.157 1 408 113 113 GLU CB C 29.915 0.007 1 409 113 113 GLU N N 122.741 0.024 1 410 114 114 ALA H H 8.154 0.004 1 411 114 114 ALA CA C 53.137 0.013 1 412 114 114 ALA CB C 18.774 0.046 1 413 114 114 ALA N N 124.815 0.012 1 414 115 115 MET H H 8.046 0.009 1 415 115 115 MET CA C 55.917 0.089 1 416 115 115 MET CB C 32.325 0.019 1 417 115 115 MET N N 118.818 0.024 1 418 116 116 ASN H H 8.167 0.005 1 419 116 116 ASN CA C 55.624 0.017 1 420 116 116 ASN CB C 38.397 0.012 1 421 116 116 ASN N N 119.786 0.043 1 422 117 117 VAL H H 7.862 0.009 1 423 117 117 VAL CA C 63.437 0.067 1 424 117 117 VAL CB C 32.287 0.048 1 425 117 117 VAL N N 120.501 0.054 1 426 118 118 ALA H H 8.000 0.007 1 427 118 118 ALA HA H 3.981 0.002 1 428 118 118 ALA CA C 52.984 0.110 1 429 118 118 ALA CB C 18.571 0.074 1 430 118 118 ALA N N 125.948 0.032 1 431 119 119 LEU H H 7.847 0.011 1 432 119 119 LEU HA H 4.280 0.001 1 433 119 119 LEU CA C 55.568 0.057 1 434 119 119 LEU CB C 41.867 0.016 1 435 119 119 LEU N N 120.507 0.034 1 436 120 120 LYS H H 7.894 0.009 1 437 120 120 LYS CA C 56.528 0.221 1 438 120 120 LYS CB C 32.448 0.016 1 439 120 120 LYS N N 121.632 0.076 1 440 121 121 ALA H H 7.924 0.008 1 441 121 121 ALA HA H 4.002 0.001 1 442 121 121 ALA CA C 52.532 0.059 1 443 121 121 ALA CB C 18.744 0.061 1 444 121 121 ALA N N 124.269 0.019 1 445 122 122 LEU H H 7.934 0.007 1 446 122 122 LEU CA C 55.516 0.080 1 447 122 122 LEU CB C 41.968 0.052 1 448 122 122 LEU N N 121.149 0.019 1 449 123 123 GLY H H 8.138 0.006 1 450 123 123 GLY CA C 45.311 0.088 1 451 123 123 GLY N N 108.920 0.007 1 452 124 124 THR H H 7.810 0.008 1 453 124 124 THR CA C 61.930 0.001 1 454 124 124 THR CB C 69.844 0.001 1 455 124 124 THR N N 113.756 0.029 1 456 125 125 LYS H H 8.254 0.008 1 457 125 125 LYS CA C 56.293 0.035 1 458 125 125 LYS CB C 32.545 0.010 1 459 125 125 LYS N N 123.711 0.038 1 460 126 126 GLU H H 8.238 0.004 1 461 126 126 GLU CA C 56.688 0.084 1 462 126 126 GLU CB C 29.955 0.013 1 463 126 126 GLU N N 122.010 0.008 1 464 127 127 GLY H H 8.221 0.007 1 465 127 127 GLY CA C 45.110 0.113 1 466 127 127 GLY N N 110.031 0.021 1 467 128 128 ILE H H 7.768 0.011 1 468 128 128 ILE CA C 60.917 0.002 1 469 128 128 ILE CB C 38.303 0.029 1 470 128 128 ILE N N 120.345 0.009 1 471 129 129 LYS H H 8.254 0.005 1 472 129 129 LYS CA C 55.778 0.103 1 473 129 129 LYS CB C 32.705 0.021 1 474 129 129 LYS N N 126.626 0.010 1 475 130 130 GLU H H 8.332 0.008 1 476 130 130 GLU CA C 54.443 0.066 1 477 130 130 GLU CB C 29.115 0.000 1 478 130 130 GLU N N 124.569 0.036 1 479 131 131 PRO CA C 63.053 0.100 1 480 131 131 PRO CB C 31.880 0.000 1 481 132 132 GLU H H 8.395 0.008 1 482 132 132 GLU CA C 56.657 0.093 1 483 132 132 GLU CB C 29.945 0.013 1 484 132 132 GLU N N 121.255 0.023 1 485 133 133 SER H H 8.107 0.007 1 486 133 133 SER CA C 57.984 0.090 1 487 133 133 SER CB C 63.564 0.006 1 488 133 133 SER N N 116.594 0.014 1 489 134 134 PHE H H 8.084 0.007 1 490 134 134 PHE CA C 57.925 0.074 1 491 134 134 PHE CB C 39.365 0.041 1 492 134 134 PHE N N 122.389 0.020 1 493 135 135 ASN H H 8.085 0.007 1 494 135 135 ASN CA C 52.733 0.088 1 495 135 135 ASN CB C 38.701 0.030 1 496 135 135 ASN N N 121.222 0.021 1 497 136 136 ALA H H 8.022 0.007 1 498 136 136 ALA CA C 52.629 0.046 1 499 136 136 ALA CB C 18.945 0.000 1 500 136 136 ALA N N 125.003 0.010 1 501 137 137 ALA H H 7.998 0.010 1 502 137 137 ALA CA C 52.477 0.077 1 503 137 137 ALA CB C 18.814 0.000 1 504 137 137 ALA N N 122.881 0.016 1 505 138 138 VAL H H 7.850 0.009 1 506 138 138 VAL CA C 62.265 0.021 1 507 138 138 VAL CB C 32.509 0.014 1 508 138 138 VAL N N 119.737 0.028 1 509 139 139 GLN H H 8.250 0.008 1 510 139 139 GLN CA C 55.641 0.028 1 511 139 139 GLN CB C 29.149 0.014 1 512 139 139 GLN N N 124.492 0.017 1 513 140 140 GLU H H 8.372 0.009 1 514 140 140 GLU CA C 56.650 0.061 1 515 140 140 GLU CB C 29.901 0.005 1 516 140 140 GLU N N 123.236 0.023 1 517 141 141 THR H H 8.073 0.010 1 518 141 141 THR CA C 61.954 0.036 1 519 141 141 THR CB C 69.816 0.003 1 520 141 141 THR N N 115.731 0.067 1 521 142 142 GLU H H 8.250 0.009 1 522 142 142 GLU CA C 56.237 0.091 1 523 142 142 GLU CB C 30.216 0.018 1 524 142 142 GLU N N 123.766 0.042 1 525 143 143 ALA H H 8.221 0.012 1 526 143 143 ALA CA C 50.433 0.086 1 527 143 143 ALA CB C 17.737 0.000 1 528 143 143 ALA N N 127.185 0.038 1 529 144 144 PRO CA C 62.675 0.046 1 530 144 144 PRO CB C 31.236 0.000 1 531 145 145 TYR H H 8.053 0.010 1 532 145 145 TYR CA C 57.865 0.099 1 533 145 145 TYR CB C 38.642 0.010 1 534 145 145 TYR N N 120.861 0.054 1 535 146 146 ILE H H 7.704 0.008 1 536 146 146 ILE CA C 60.306 0.117 1 537 146 146 ILE CB C 38.401 0.022 1 538 146 146 ILE N N 125.155 0.022 1 539 147 147 SER H H 8.062 0.014 1 540 147 147 SER CA C 58.074 0.016 1 541 147 147 SER CB C 63.695 0.030 1 542 147 147 SER N N 120.320 0.040 1 543 148 148 ILE H H 7.984 0.001 1 544 148 148 ILE CA C 60.915 0.037 1 545 148 148 ILE CB C 38.476 0.001 1 546 148 148 ILE N N 123.246 0.019 1 547 149 149 ALA H H 8.166 0.007 1 548 149 149 ALA CA C 52.668 0.046 1 549 149 149 ALA CB C 18.936 0.042 1 550 149 149 ALA N N 128.162 0.029 1 551 150 150 CYS H H 8.148 0.006 1 552 150 150 CYS CA C 58.614 0.083 1 553 150 150 CYS CB C 27.894 0.004 1 554 150 150 CYS N N 118.954 0.029 1 555 151 151 ASP H H 8.202 0.004 1 556 151 151 ASP CA C 54.479 0.033 1 557 151 151 ASP CB C 40.731 0.024 1 558 151 151 ASP N N 122.819 0.014 1 559 158 158 LEU CA C 54.972 0.141 1 560 158 158 LEU CB C 42.153 0.000 1 561 159 159 SER H H 8.211 0.007 1 562 159 159 SER HA H 3.990 0.000 1 563 159 159 SER CA C 58.228 0.059 1 564 159 159 SER CB C 63.661 0.015 1 565 159 159 SER N N 116.949 0.015 1 566 160 160 THR H H 7.976 0.010 1 567 160 160 THR HA H 4.079 0.003 1 568 160 160 THR CA C 61.493 0.081 1 569 160 160 THR CB C 69.557 0.005 1 570 160 160 THR N N 115.539 0.016 1 571 161 161 GLU H H 8.097 0.008 1 572 161 161 GLU HA H 4.306 0.001 1 573 161 161 GLU CA C 54.255 0.062 1 574 161 161 GLU CB C 29.378 0.000 1 575 161 161 GLU N N 124.547 0.043 1 576 162 162 PRO HA H 4.143 0.001 1 577 162 162 PRO CA C 62.554 0.000 1 578 162 162 PRO CB C 31.934 0.000 1 579 162 162 PRO N N 137.209 0.115 1 580 163 163 SER H H 8.329 0.007 1 581 163 163 SER HA H 4.443 0.001 1 582 163 163 SER CA C 56.382 0.028 1 583 163 163 SER CB C 63.316 0.000 1 584 163 163 SER N N 117.889 0.046 1 585 164 164 PRO HA H 4.070 0.001 1 586 164 164 PRO CA C 63.200 0.118 1 587 164 164 PRO CB C 31.783 0.000 1 588 164 164 PRO N N 137.944 0.023 1 589 165 165 ASP H H 8.057 0.008 1 590 165 165 ASP HA H 4.244 0.004 1 591 165 165 ASP CA C 53.861 0.121 1 592 165 165 ASP CB C 40.850 0.095 1 593 165 165 ASP N N 119.753 0.017 1 594 166 166 PHE H H 8.010 0.009 1 595 166 166 PHE HA H 4.172 0.000 1 596 166 166 PHE CA C 57.983 0.084 1 597 166 166 PHE CB C 38.879 0.005 1 598 166 166 PHE N N 121.521 0.087 1 599 167 167 SER H H 8.057 0.005 1 600 167 167 SER HA H 4.028 0.001 1 601 167 167 SER CA C 58.786 0.265 1 602 167 167 SER CB C 63.855 0.054 1 603 167 167 SER N N 117.088 0.045 1 604 168 168 ASN H H 8.038 0.005 1 605 168 168 ASN HA H 4.405 0.001 1 606 168 168 ASN CA C 53.177 0.087 1 607 168 168 ASN CB C 38.442 0.051 1 608 168 168 ASN N N 120.167 0.054 1 609 169 169 TYR H H 7.885 0.009 1 610 169 169 TYR HA H 4.215 0.000 1 611 169 169 TYR CA C 58.557 0.064 1 612 169 169 TYR CB C 38.252 0.060 1 613 169 169 TYR N N 120.909 0.019 1 614 170 170 SER H H 7.890 0.009 1 615 170 170 SER HA H 4.045 0.000 1 616 170 170 SER CA C 58.488 0.091 1 617 170 170 SER CB C 63.743 0.057 1 618 170 170 SER N N 117.248 0.011 1 619 171 171 GLU H H 8.065 0.001 1 620 171 171 GLU CA C 56.665 0.100 1 621 171 171 GLU CB C 29.882 0.005 1 622 171 171 GLU N N 122.582 0.041 1 623 172 172 ILE H H 7.775 0.009 1 624 172 172 ILE CA C 61.479 0.046 1 625 172 172 ILE CB C 38.123 0.027 1 626 172 172 ILE N N 121.356 0.017 1 627 173 173 ALA H H 8.041 0.008 1 628 173 173 ALA CA C 52.690 0.072 1 629 173 173 ALA CB C 18.737 0.032 1 630 173 173 ALA N N 127.386 0.033 1 631 174 174 LYS H H 7.861 0.012 1 632 174 174 LYS CA C 56.434 0.066 1 633 174 174 LYS CB C 32.589 0.021 1 634 174 174 LYS N N 120.048 0.018 1 635 175 175 PHE H H 7.932 0.007 1 636 175 175 PHE CA C 57.735 0.035 1 637 175 175 PHE CB C 39.346 0.031 1 638 175 175 PHE N N 120.828 0.037 1 639 176 176 GLU H H 8.067 0.004 1 640 176 176 GLU CA C 56.630 0.164 1 641 176 176 GLU CB C 30.158 0.031 1 642 176 176 GLU N N 122.844 0.010 1 643 177 177 LYS H H 8.091 0.006 1 644 177 177 LYS CA C 56.149 0.133 1 645 177 177 LYS CB C 32.748 0.007 1 646 177 177 LYS N N 122.576 0.014 1 647 178 178 SER H H 8.178 0.008 1 648 178 178 SER CA C 58.248 0.022 1 649 178 178 SER CB C 63.673 0.000 1 650 178 178 SER N N 117.839 0.014 1 651 179 179 VAL H H 8.045 0.010 1 652 179 179 VAL HA H 4.153 0.001 1 653 179 179 VAL CA C 59.739 0.068 1 654 179 179 VAL CB C 32.393 0.000 1 655 179 179 VAL N N 123.385 0.008 1 656 180 180 PRO HA H 4.092 0.005 1 657 180 180 PRO CA C 63.055 0.048 1 658 180 180 PRO CB C 31.886 0.000 1 659 180 180 PRO N N 139.432 0.026 1 660 181 181 GLU H H 8.347 0.008 1 661 181 181 GLU HA H 3.862 0.000 1 662 181 181 GLU CA C 56.604 0.053 1 663 181 181 GLU CB C 29.993 0.000 1 664 181 181 GLU N N 121.162 0.045 1 665 182 182 HIS H H 8.108 0.003 1 666 182 182 HIS HA H 4.347 0.001 1 667 182 182 HIS CA C 55.705 0.093 1 668 182 182 HIS CB C 30.086 0.033 1 669 182 182 HIS N N 119.623 0.060 1 670 183 183 ALA H H 8.103 0.004 1 671 183 183 ALA HA H 4.004 0.003 1 672 183 183 ALA CA C 52.305 0.070 1 673 183 183 ALA CB C 19.222 0.009 1 674 183 183 ALA N N 125.646 0.053 1 675 184 184 GLU H H 8.283 0.005 1 676 184 184 GLU HA H 3.929 0.001 1 677 184 184 GLU CA C 56.320 0.025 1 678 184 184 GLU CB C 29.900 0.030 1 679 184 184 GLU N N 120.419 0.011 1 680 185 185 LEU H H 8.126 0.006 1 681 185 185 LEU HA H 4.302 0.004 1 682 185 185 LEU CA C 54.783 0.176 1 683 185 185 LEU CB C 41.867 0.008 1 684 185 185 LEU N N 123.925 0.015 1 685 186 186 VAL H H 8.054 0.007 1 686 186 186 VAL HA H 3.823 0.000 1 687 186 186 VAL CA C 62.141 0.014 1 688 186 186 VAL CB C 32.483 0.003 1 689 186 186 VAL N N 122.893 0.023 1 690 187 187 GLU H H 8.388 0.007 1 691 187 187 GLU HA H 4.004 0.003 1 692 187 187 GLU CA C 56.305 0.043 1 693 187 187 GLU CB C 30.230 0.011 1 694 187 187 GLU N N 125.746 0.029 1 695 188 188 ASP H H 8.286 0.006 1 696 188 188 ASP HA H 4.339 0.001 1 697 188 188 ASP CA C 54.215 0.076 1 698 188 188 ASP CB C 40.976 0.032 1 699 188 188 ASP N N 122.515 0.015 1 700 189 189 SER H H 8.114 0.006 1 701 189 189 SER HA H 4.201 0.000 1 702 189 189 SER CA C 57.989 0.069 1 703 189 189 SER CB C 63.820 0.013 1 704 189 189 SER N N 116.736 0.024 1 705 190 190 SER H H 8.277 0.006 1 706 190 190 SER HA H 4.471 0.001 1 707 190 190 SER CA C 56.543 0.043 1 708 190 190 SER CB C 63.140 0.000 1 709 190 190 SER N N 119.199 0.080 1 710 191 191 PRO HA H 4.164 0.000 1 711 191 191 PRO CA C 63.135 0.040 1 712 191 191 PRO CB C 31.876 0.000 1 713 191 191 PRO N N 137.957 0.051 1 714 192 192 GLU H H 8.344 0.008 1 715 192 192 GLU HA H 3.976 0.005 1 716 192 192 GLU CA C 56.615 0.080 1 717 192 192 GLU CB C 29.917 0.021 1 718 192 192 GLU N N 120.722 0.041 1 719 193 193 SER H H 8.070 0.009 1 720 193 193 SER HA H 4.161 0.004 1 721 193 193 SER CA C 58.141 0.063 1 722 193 193 SER CB C 63.933 0.010 1 723 193 193 SER N N 116.885 0.051 1 724 194 194 GLU H H 8.194 0.005 1 725 194 194 GLU HA H 4.298 0.001 1 726 194 194 GLU CA C 54.324 0.012 1 727 194 194 GLU CB C 29.373 0.000 1 728 194 194 GLU N N 123.924 0.030 1 729 195 195 PRO HA H 4.158 0.001 1 730 195 195 PRO CA C 62.960 0.049 1 731 195 195 PRO CB C 32.190 0.000 1 732 195 195 PRO N N 137.669 0.008 1 733 196 196 VAL H H 8.081 0.006 1 734 196 196 VAL HA H 3.775 0.000 1 735 196 196 VAL CA C 62.120 0.064 1 736 196 196 VAL CB C 32.607 0.001 1 737 196 196 VAL N N 120.557 0.041 1 738 197 197 ASP H H 8.186 0.006 1 739 197 197 ASP HA H 4.300 0.000 1 740 197 197 ASP CA C 54.823 0.305 1 741 197 197 ASP CB C 40.870 0.033 1 742 197 197 ASP N N 124.067 0.052 1 743 198 198 LEU H H 8.010 0.006 1 744 198 198 LEU CA C 56.310 0.012 1 745 198 198 LEU CB C 41.705 0.002 1 746 198 198 LEU N N 123.515 0.016 1 747 199 199 PHE H H 8.113 0.006 1 748 199 199 PHE HA H 4.199 0.002 1 749 199 199 PHE CA C 57.981 0.053 1 750 199 199 PHE CB C 38.445 0.004 1 751 199 199 PHE N N 119.824 0.032 1 752 200 200 LEU H H 7.659 0.009 1 753 200 200 LEU CA C 55.317 0.011 1 754 200 200 LEU CB C 41.970 0.013 1 755 200 200 LEU N N 122.507 0.027 1 756 201 201 GLU H H 8.051 0.008 1 757 201 201 GLU CA C 56.792 0.016 1 758 201 201 GLU CB C 29.866 0.000 1 759 201 201 GLU N N 120.714 0.031 1 stop_ save_