data_15158 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the adhesion protein Bd37 from Babesia divergens ; _BMRB_accession_number 15158 _BMRB_flat_file_name bmr15158.str _Entry_type original _Submission_date 2007-03-02 _Accession_date 2007-03-02 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Solution structure of the adhesion protein Bd37 from Babesia divergens' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Auguin Daniel . . 2 Yang Yin-Shan . . 3 Lohr Frank . . 4 Arold Stefan . . 5 Schetters Theo . . 6 Precigout Eric . . 7 Gorenflot Andre . . 8 Delbecq Stephane . . 9 Roumestand Christian . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 1243 "13C chemical shifts" 847 "15N chemical shifts" 278 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2008-05-06 original author . stop_ _Original_release_date 2008-05-06 save_ ############################# # Citation for this entry # ############################# save_entry_citation_2 _Saveframe_category entry_citation _Citation_full . _Citation_title 'The solution structure of the adhesion protein Bd37 from Babesia divergens reveals structural homology with eukaryotic proteins involved in membrane trafficking' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 18035372 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Delbecq Stephane . . 2 Auguin Daniel . . 3 Yang Yin-Shan . . 4 Lohr Frank . . 5 Arold Stefan . . 6 Schetters Theo . . 7 Precigout Eric . . 8 Gorenflot Andre . . 9 Roumestand Christian . . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 375 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 409 _Page_last 424 _Year 2008 _Details . save_ ####################################### # Cited references within the entry # ####################################### save_entry_citation _Saveframe_category citation _Citation_full . _Citation_title ; Letter to the Editor: 1H, 15N and 13C Backbone resonance assignments of the 37 kDA surface antigen protein Bd37 from Babesia divergens. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 15692742 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Yang Yin-Shan . . 2 Delbecq Stephane . . 3 Roumestand Christian . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_name_full . _Journal_volume 31 _Journal_issue 1 _Journal_CSD . _Book_title . _Book_chapter_title . _Book_volume . _Book_series . _Book_publisher . _Book_publisher_city . _Book_ISBN . _Conference_title . _Conference_site . _Conference_state_province . _Conference_country . _Conference_start_date . _Conference_end_date . _Conference_abstract_number . _Thesis_institution . _Thesis_institution_city . _Thesis_institution_country . _Page_first 67 _Page_last 68 _Year 2005 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Bd37 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Bd37 $Bd37 stop_ _System_molecular_weight 37000 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function 'Membrane adhesion protein' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Bd37 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Bd37 _Molecular_mass 31467.693 _Mol_thiol_state 'all disulfide bound' loop_ _Biological_function 'erythrocyte binding protein' stop_ _Details ; The produced protein so-called ?-Bd37 weights around 27 kDa and that the two cysteins involved in disulfide bond have been removed. ; ############################## # Polymer residue sequence # ############################## _Residue_count 294 _Mol_residue_sequence ; CTNLNGSQEPAAANPVVSTP GNDAQQAGTQQGGANSKSVP EQQPQQAAGETTATVVVKTL DVLRGELRGQREAFLSEIIK SDGPFTILQLVGYLRVVDTD LLLKVDSTKVDEAGKKVKAY LEKIGIRGDSVEAALDNLMI KVYEITKGTVESSAQGTDSE ELKTLLLKFSEDLKAEQELH SEAKGGEALLSSMKTQHDEL LKKFAALTPTFLTSEDISGY LTVPEYGAPMNAAKWKKVEG MIHGKLESSEVPANLKALVA ELIELREQMMDLLYGPIGHH DCAAGSGQGSSKLN ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 13 CYS 2 14 THR 3 15 ASN 4 16 LEU 5 17 ASN 6 18 GLY 7 19 SER 8 20 GLN 9 21 GLU 10 22 PRO 11 23 ALA 12 24 ALA 13 25 ALA 14 26 ASN 15 27 PRO 16 28 VAL 17 29 VAL 18 30 SER 19 31 THR 20 32 PRO 21 33 GLY 22 34 ASN 23 35 ASP 24 36 ALA 25 37 GLN 26 38 GLN 27 39 ALA 28 40 GLY 29 41 THR 30 42 GLN 31 43 GLN 32 44 GLY 33 45 GLY 34 46 ALA 35 47 ASN 36 48 SER 37 49 LYS 38 50 SER 39 51 VAL 40 52 PRO 41 53 GLU 42 54 GLN 43 55 GLN 44 56 PRO 45 57 GLN 46 58 GLN 47 59 ALA 48 60 ALA 49 61 GLY 50 62 GLU 51 63 THR 52 64 THR 53 65 ALA 54 66 THR 55 67 VAL 56 68 VAL 57 69 VAL 58 70 LYS 59 71 THR 60 72 LEU 61 73 ASP 62 74 VAL 63 75 LEU 64 76 ARG 65 77 GLY 66 78 GLU 67 79 LEU 68 80 ARG 69 81 GLY 70 82 GLN 71 83 ARG 72 84 GLU 73 85 ALA 74 86 PHE 75 87 LEU 76 88 SER 77 89 GLU 78 90 ILE 79 91 ILE 80 92 LYS 81 93 SER 82 94 ASP 83 95 GLY 84 96 PRO 85 97 PHE 86 98 THR 87 99 ILE 88 100 LEU 89 101 GLN 90 102 LEU 91 103 VAL 92 104 GLY 93 105 TYR 94 106 LEU 95 107 ARG 96 108 VAL 97 109 VAL 98 110 ASP 99 111 THR 100 112 ASP 101 113 LEU 102 114 LEU 103 115 LEU 104 116 LYS 105 117 VAL 106 118 ASP 107 119 SER 108 120 THR 109 121 LYS 110 122 VAL 111 123 ASP 112 124 GLU 113 125 ALA 114 126 GLY 115 127 LYS 116 128 LYS 117 129 VAL 118 130 LYS 119 131 ALA 120 132 TYR 121 133 LEU 122 134 GLU 123 135 LYS 124 136 ILE 125 137 GLY 126 138 ILE 127 139 ARG 128 140 GLY 129 141 ASP 130 142 SER 131 143 VAL 132 144 GLU 133 145 ALA 134 146 ALA 135 147 LEU 136 148 ASP 137 149 ASN 138 150 LEU 139 151 MET 140 152 ILE 141 153 LYS 142 154 VAL 143 155 TYR 144 156 GLU 145 157 ILE 146 158 THR 147 159 LYS 148 160 GLY 149 161 THR 150 162 VAL 151 163 GLU 152 164 SER 153 165 SER 154 166 ALA 155 167 GLN 156 168 GLY 157 169 THR 158 170 ASP 159 171 SER 160 172 GLU 161 173 GLU 162 174 LEU 163 175 LYS 164 176 THR 165 177 LEU 166 178 LEU 167 179 LEU 168 180 LYS 169 181 PHE 170 182 SER 171 183 GLU 172 184 ASP 173 185 LEU 174 186 LYS 175 187 ALA 176 188 GLU 177 189 GLN 178 190 GLU 179 191 LEU 180 192 HIS 181 193 SER 182 194 GLU 183 195 ALA 184 196 LYS 185 197 GLY 186 198 GLY 187 199 GLU 188 200 ALA 189 201 LEU 190 202 LEU 191 203 SER 192 204 SER 193 205 MET 194 206 LYS 195 207 THR 196 208 GLN 197 209 HIS 198 210 ASP 199 211 GLU 200 212 LEU 201 213 LEU 202 214 LYS 203 215 LYS 204 216 PHE 205 217 ALA 206 218 ALA 207 219 LEU 208 220 THR 209 221 PRO 210 222 THR 211 223 PHE 212 224 LEU 213 225 THR 214 226 SER 215 227 GLU 216 228 ASP 217 229 ILE 218 230 SER 219 231 GLY 220 232 TYR 221 233 LEU 222 234 THR 223 235 VAL 224 236 PRO 225 237 GLU 226 238 TYR 227 239 GLY 228 240 ALA 229 241 PRO 230 242 MET 231 243 ASN 232 244 ALA 233 245 ALA 234 246 LYS 235 247 TRP 236 248 LYS 237 249 LYS 238 250 VAL 239 251 GLU 240 252 GLY 241 253 MET 242 254 ILE 243 255 HIS 244 256 GLY 245 257 LYS 246 258 LEU 247 259 GLU 248 260 SER 249 261 SER 250 262 GLU 251 263 VAL 252 264 PRO 253 265 ALA 254 266 ASN 255 267 LEU 256 268 LYS 257 269 ALA 258 270 LEU 259 271 VAL 260 272 ALA 261 273 GLU 262 274 LEU 263 275 ILE 264 276 GLU 265 277 LEU 266 278 ARG 267 279 GLU 268 280 GLN 269 281 MET 270 282 MET 271 283 ASP 272 284 LEU 273 285 LEU 274 286 TYR 275 287 GLY 276 288 PRO 277 289 ILE 278 290 GLY 279 291 HIS 280 292 HIS 281 293 ASP 282 294 CYS 283 295 ALA 284 296 ALA 285 297 GLY 286 298 SER 287 299 GLY 288 300 GLN 289 301 GLY 290 302 SER 291 303 SER 292 304 LYS 293 305 LEU 294 306 ASN stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-02-06 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 18517 EDK-delta-Bd37 76.19 224 98.66 98.66 1.88e-154 PDB 2JO7 "Solution Structure Of The Adhesion Protein Bd37 From Babesia Divergens" 76.19 224 100.00 100.00 2.24e-157 PDB 2LUD "Solution Structure Of A Conformational Mutant Of The Adhesion Protein Delta-bd37 From Babesia Divergens" 76.19 224 98.66 98.66 1.88e-154 EMBL CAD19563 "glycosylphosphatidylinositol-anchored merozoite surface protein [Babesia divergens]" 98.98 341 100.00 100.00 0.00e+00 EMBL CAD48924 "glycosylphosphatidylinositol-anchored merozoite surface protein [Babesia divergens]" 98.98 341 99.66 99.66 0.00e+00 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Details $Bd37 'Babesia Divergens' 32595 Eukaryota . Babesia Divergens ; 27 kDa structured core of the major merozoite surface antigen of Babesia divergens, a 37 kDa membrane protein GPI-anchored at the surface of the merozoite ; 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 $Bd37 'recombinant technology' . Escherichia coli BL21(DE3) 'pIVEX 2.3MCS' 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 _Concentration_min_value _Concentration_max_value _Isotopic_labeling $Bd37 . mM 0.5 1 '[U-99% 15N]' 'phosphate buffer' 20 mM . . 'natural abundance' NaCl 50 mM . . 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $Bd37 . mM 0.5 1 '[U-99% 13C; U-99% 15N]' 'phosphate buffer' 20 mM . . 'natural abundance' NaCl 50 mM . . 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $Bd37 . mM 0.5 1 '[13C]-I,V,L methyl' 'phosphate buffer' 20 mM . . 'natural abundance' NaCl 50 mM . . 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_PREDITOR _Saveframe_category software _Name PREDITOR _Version 1 loop_ _Vendor _Address _Electronic_address '(PREDITOR) Berjanskii' . . stop_ loop_ _Task 'geometry optimization' stop_ _Details . save_ save_CINDY _Saveframe_category software _Name CINDY _Version . loop_ _Vendor _Address _Electronic_address PADILLA . andre@cbs.cnrs.fr stop_ loop_ _Task 'data analysis' stop_ _Details ftp://ftp.cbs.cnrs.fr/pub/CINDY save_ save_CYANA _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_AMBER _Saveframe_category software _Name AMBER _Version 8 loop_ _Vendor _Address _Electronic_address 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Koll' . . stop_ loop_ _Task refinement stop_ _Details . save_ save_GIFA _Saveframe_category software _Name GIFA _Version 4 loop_ _Vendor _Address _Electronic_address Delsuc . . stop_ loop_ _Task processing stop_ _Details . save_ save_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'geometry optimization' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details '5 mn Z-gradient 1H-13C-15N cryogenic probe' save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_2 save_ save_3D_1H-15N_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_(in-phase/antiphase)_[15N-1H]_HSQC_5 _Saveframe_category NMR_applied_experiment _Experiment_name '(in-phase/antiphase) [15N-1H] HSQC' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details ; 0.5 to 1 mM in protein concentration, dissolved in 20 mM phosphate buffer, 50 mM NaCl buffer at pH 6.8 5% D2O ; loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 50 . mM pH 6.8 0.2 pH pressure 1 . atm temperature 310 0.1 K stop_ save_ save_sample_conditions_2 _Saveframe_category sample_conditions _Details '0.5 to 1 mM in protein concentration, dissolved in 100% D2O with 20 mM phosphate buffer at pD 6.8 and 50 mM NaCl' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pD 6.8 0.1 pH stop_ save_ save_sample_conditions_3 _Saveframe_category sample_conditions _Details ; 0.8 mM of ?-Bd37 20 mg/mL pf1 phage 20 mM phosphate buffer at pH 6.8 50 mM NaCl, and 5% 2H2O ; loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.8 0.2 pH stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D 1H-15N NOESY' '3D 1H-13C NOESY' stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name Bd37 _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 14 2 THR H H 8.224 0.01 1 2 14 2 THR CA C 61.82 0.05 1 3 14 2 THR CB C 69.15 0.05 1 4 14 2 THR N N 115.299 0.1 1 5 15 3 ASN H H 8.44 0.01 1 6 15 3 ASN C C 175.15 0.05 1 7 15 3 ASN CA C 53.07 0.05 1 8 15 3 ASN CB C 37.98 0.05 1 9 15 3 ASN N N 121.088 0.1 1 10 16 4 LEU H H 8.24 0.01 1 11 16 4 LEU C C 177.28 0.05 1 12 16 4 LEU CA C 55.29 0.05 1 13 16 4 LEU CB C 40.95 0.05 1 14 16 4 LEU N N 122.854 0.1 1 15 17 5 ASN H H 8.378 0.01 1 16 17 5 ASN C C 175.71 0.05 1 17 17 5 ASN CA C 53.26 0.05 1 18 17 5 ASN CB C 38.19 0.05 1 19 17 5 ASN N N 118.684 0.1 1 20 18 6 GLY H H 8.26 0.01 1 21 18 6 GLY C C 174.22 0.05 1 22 18 6 GLY CA C 45.26 0.05 1 23 18 6 GLY N N 109.216 0.1 1 24 19 7 SER H H 8.162 0.01 1 25 19 7 SER C C 174.44 0.05 1 26 19 7 SER CA C 58.21 0.05 1 27 19 7 SER CB C 63.15 0.05 1 28 19 7 SER N N 115.593 0.1 1 29 20 8 GLN H H 8.389 0.01 1 30 20 8 GLN C C 175.67 0.05 1 31 20 8 GLN CA C 55.38 0.05 1 32 20 8 GLN CB C 28.66 0.05 1 33 20 8 GLN N N 121.873 0.1 1 34 21 9 GLU H H 8.414 0.01 1 35 21 9 GLU CA C 53.52 0.05 1 36 21 9 GLU CB C 27.94 0.05 1 37 21 9 GLU N N 122.903 0.1 1 38 22 10 PRO C C 176.72 0.05 1 39 22 10 PRO CA C 63.0 0.05 1 40 22 10 PRO CB C 30.91 0.05 1 41 23 11 ALA H H 8.322 0.01 1 42 23 11 ALA C C 177.42 0.05 1 43 23 11 ALA CA C 52.11 0.05 1 44 23 11 ALA CB C 18.28 0.05 1 45 23 11 ALA N N 124.081 0.1 1 46 24 12 ALA H H 8.142 0.01 1 47 24 12 ALA C C 177.42 0.05 1 48 24 12 ALA CA C 51.98 0.05 1 49 24 12 ALA CB C 18.28 0.05 1 50 24 12 ALA N N 123.1 0.1 1 51 25 13 ALA H H 8.168 0.01 1 52 25 13 ALA C C 177.16 0.05 1 53 25 13 ALA CA C 51.99 0.05 1 54 25 13 ALA CB C 18.26 0.05 1 55 25 13 ALA N N 123.345 0.1 1 56 26 14 ASN H H 8.265 0.01 1 57 26 14 ASN CA C 51.1 0.05 1 58 26 14 ASN CB C 38.26 0.05 1 59 26 14 ASN N N 118.831 0.1 1 60 27 15 PRO C C 176.73 0.05 1 61 27 15 PRO CA C 63.01 0.05 1 62 27 15 PRO CB C 31.01 0.05 1 63 28 16 VAL H H 8.147 0.01 1 64 28 16 VAL C C 176.23 0.05 1 65 28 16 VAL CA C 62.26 0.05 1 66 28 16 VAL CB C 31.52 0.05 1 67 28 16 VAL N N 120.499 0.1 1 68 29 17 VAL H H 8.132 0.01 1 69 29 17 VAL C C 175.95 0.05 1 70 29 17 VAL CA C 61.73 0.05 1 71 29 17 VAL CB C 31.84 0.05 1 72 29 17 VAL N N 124.032 0.1 1 73 30 18 SER H H 8.347 0.01 1 74 30 18 SER C C 174.13 0.05 1 75 30 18 SER CA C 57.85 0.05 1 76 30 18 SER CB C 63.16 0.05 1 77 30 18 SER N N 120.009 0.1 1 78 31 19 THR H H 8.193 0.01 1 79 31 19 THR CA C 59.38 0.05 1 80 31 19 THR CB C 69.25 0.05 1 81 31 19 THR N N 118.243 0.1 1 82 32 20 PRO C C 177.52 0.05 1 83 32 20 PRO CA C 63.37 0.05 1 84 32 20 PRO CB C 30.88 0.05 1 85 33 21 GLY H H 8.445 0.01 1 86 33 21 GLY C C 174.08 0.05 1 87 33 21 GLY CA C 44.96 0.05 1 88 33 21 GLY N N 109.216 0.1 1 89 34 22 ASN H H 8.265 0.01 1 90 34 22 ASN C C 175.11 0.05 1 91 34 22 ASN CA C 53.19 0.05 1 92 34 22 ASN CB C 38.42 0.05 1 93 34 22 ASN N N 118.831 0.1 1 94 35 23 ASP H H 8.368 0.01 1 95 35 23 ASP C C 176.31 0.05 1 96 35 23 ASP CA C 54.39 0.05 1 97 35 23 ASP CB C 40.24 0.05 1 98 35 23 ASP N N 120.745 0.1 1 99 36 24 ALA H H 8.183 0.01 1 100 36 24 ALA C C 178.12 0.05 1 101 36 24 ALA CA C 52.76 0.05 1 102 36 24 ALA CB C 18.06 0.05 1 103 36 24 ALA N N 124.081 0.1 1 104 37 25 GLN H H 8.24 0.01 1 105 37 25 GLN C C 176.35 0.05 1 106 37 25 GLN CA C 55.97 0.05 1 107 37 25 GLN CB C 28.13 0.05 1 108 37 25 GLN N N 118.537 0.1 1 109 38 26 GLN H H 8.229 0.01 1 110 38 26 GLN C C 175.92 0.05 1 111 38 26 GLN CA C 55.66 0.05 1 112 38 26 GLN CB C 28.17 0.05 1 113 38 26 GLN N N 120.745 0.1 1 114 39 27 ALA H H 8.301 0.01 1 115 39 27 ALA C C 178.35 0.05 1 116 39 27 ALA CA C 52.59 0.05 1 117 39 27 ALA CB C 18.23 0.05 1 118 39 27 ALA N N 125.062 0.1 1 119 40 28 GLY H H 8.342 0.01 1 120 40 28 GLY C C 174.57 0.05 1 121 40 28 GLY CA C 45.15 0.05 1 122 40 28 GLY N N 107.94 0.1 1 123 41 29 THR H H 7.988 0.01 1 124 41 29 THR C C 174.82 0.05 1 125 41 29 THR CA C 61.73 0.05 1 126 41 29 THR CB C 69.21 0.05 1 127 41 29 THR N N 113.14 0.1 1 128 42 30 GLN H H 8.435 0.01 1 129 42 30 GLN C C 176.03 0.05 1 130 42 30 GLN CA C 55.74 0.05 1 131 42 30 GLN CB C 28.21 0.05 1 132 42 30 GLN N N 122.56 0.1 1 133 43 31 GLN H H 8.44 0.01 1 134 43 31 GLN C C 176.55 0.05 1 135 43 31 GLN CA C 55.8 0.05 1 136 43 31 GLN CB C 28.38 0.05 1 137 43 31 GLN N N 121.726 0.1 1 138 44 32 GLY H H 8.44 0.01 1 139 44 32 GLY C C 174.65 0.05 1 140 44 32 GLY CA C 45.11 0.05 1 141 44 32 GLY N N 110.295 0.1 1 142 45 33 GLY H H 8.25 0.01 1 143 45 33 GLY C C 174.2 0.05 1 144 45 33 GLY CA C 44.88 0.05 1 145 45 33 GLY N N 108.774 0.1 1 146 46 34 ALA H H 8.291 0.01 1 147 46 34 ALA C C 177.76 0.05 1 148 46 34 ALA CA C 52.55 0.05 1 149 46 34 ALA CB C 18.08 0.05 1 150 46 34 ALA N N 123.885 0.1 1 151 47 35 ASN H H 8.404 0.01 1 152 47 35 ASN C C 176.32 0.05 1 153 47 35 ASN CA C 53.08 0.05 1 154 47 35 ASN CB C 41.63 0.05 1 155 47 35 ASN N N 117.36 0.1 1 156 48 36 SER H H 8.142 0.01 1 157 48 36 SER C C 174.46 0.05 1 158 48 36 SER CA C 58.42 0.05 1 159 48 36 SER CB C 63.04 0.05 1 160 48 36 SER N N 116.133 0.1 1 161 49 37 LYS H H 8.27 0.01 1 162 49 37 LYS C C 176.51 0.05 1 163 49 37 LYS CA C 55.93 0.05 1 164 49 37 LYS CB C 31.8 0.05 1 165 49 37 LYS N N 122.756 0.1 1 166 50 38 SER H H 8.234 0.01 1 167 50 38 SER C C 174.08 0.05 1 168 50 38 SER CA C 58.09 0.05 1 169 50 38 SER CB C 63.06 0.05 1 170 50 38 SER N N 117.114 0.1 1 171 51 39 VAL H H 8.075 0.01 1 172 51 39 VAL CA C 59.63 0.05 1 173 51 39 VAL CB C 31.69 0.05 1 174 51 39 VAL N N 122.609 0.1 1 175 52 40 PRO C C 176.96 0.05 1 176 52 40 PRO CA C 63.11 0.05 1 177 52 40 PRO CB C 31.01 0.05 1 178 53 41 GLU H H 8.461 0.01 1 179 53 41 GLU CA C 56.53 0.05 1 180 53 41 GLU CB C 29.15 0.05 1 181 53 41 GLU N N 120.745 0.1 1 182 54 42 GLN H H 8.306 0.01 1 183 54 42 GLN C C 175.67 0.05 1 184 54 42 GLN CA C 55.4 0.05 1 185 54 42 GLN CB C 28.66 0.05 1 186 54 42 GLN N N 121.039 0.1 1 187 55 43 GLN H H 8.389 0.01 1 188 55 43 GLN C C 181.89 0.05 1 189 55 43 GLN CA C 53.55 0.05 1 190 55 43 GLN CB C 27.95 0.05 1 191 55 43 GLN N N 122.805 0.1 1 192 56 44 PRO C C 176.96 0.05 1 193 56 44 PRO CA C 63.05 0.05 1 194 56 44 PRO CB C 31.01 0.05 1 195 57 45 GLN H H 8.491 0.01 1 196 57 45 GLN C C 176.03 0.05 1 197 57 45 GLN CA C 55.68 0.05 1 198 57 45 GLN CB C 28.43 0.05 1 199 57 45 GLN N N 120.598 0.1 1 200 58 46 GLN H H 8.353 0.01 1 201 58 46 GLN C C 175.59 0.05 1 202 58 46 GLN CA C 55.53 0.05 1 203 58 46 GLN CB C 28.55 0.05 1 204 58 46 GLN N N 121.726 0.1 1 205 59 47 ALA H H 8.358 0.01 1 206 59 47 ALA C C 177.37 0.05 1 207 59 47 ALA CA C 52.14 0.05 1 208 59 47 ALA CB C 18.24 0.05 1 209 59 47 ALA N N 125.847 0.1 1 210 60 48 ALA H H 8.286 0.01 1 211 60 48 ALA C C 178.27 0.05 1 212 60 48 ALA CA C 52.38 0.05 1 213 60 48 ALA CB C 18.24 0.05 1 214 60 48 ALA N N 123.737 0.1 1 215 61 49 GLY H H 8.291 0.01 1 216 61 49 GLY C C 174.11 0.05 1 217 61 49 GLY CA C 44.92 0.05 1 218 61 49 GLY N N 108.087 0.1 1 219 62 50 GLU H H 8.245 0.01 1 220 62 50 GLU C C 176.9 0.05 1 221 62 50 GLU CA C 56.31 0.05 1 222 62 50 GLU CB C 29.43 0.05 1 223 62 50 GLU N N 120.647 0.1 1 224 63 51 THR H H 8.27 0.01 1 225 63 51 THR C C 174.71 0.05 1 226 63 51 THR CA C 62.33 0.05 1 227 63 51 THR CB C 69.13 0.05 1 228 63 51 THR N N 115.201 0.1 1 229 64 52 THR H H 8.126 0.01 1 230 64 52 THR C C 174.17 0.05 1 231 64 52 THR CA C 61.67 0.05 1 232 64 52 THR CB C 69.11 0.05 1 233 64 52 THR N N 116.575 0.1 1 234 65 53 ALA H H 8.281 0.01 1 235 65 53 ALA C C 177.65 0.05 1 236 65 53 ALA CA C 52.26 0.05 1 237 65 53 ALA CB C 18.31 0.05 1 238 65 53 ALA N N 126.681 0.1 1 239 66 54 THR H H 8.106 0.01 1 240 66 54 THR C C 176.32 0.05 1 241 66 54 THR CA C 61.84 0.05 1 242 66 54 THR CB C 69.13 0.05 1 243 66 54 THR N N 114.661 0.1 1 244 67 55 VAL H H 8.111 0.01 1 245 67 55 VAL C C 175.67 0.05 1 246 67 55 VAL CA C 61.93 0.05 1 247 67 55 VAL CB C 31.85 0.05 1 248 67 55 VAL N N 123.737 0.1 1 249 68 56 VAL H H 8.26 0.01 1 250 68 56 VAL C C 175.82 0.05 1 251 68 56 VAL CA C 61.94 0.05 1 252 68 56 VAL CB C 31.71 0.05 1 253 68 56 VAL N N 125.7 0.1 1 254 69 57 VAL H H 8.183 0.01 1 255 69 57 VAL HA H 4.079 0.01 1 256 69 57 VAL HB H 2.002 0.01 1 257 69 57 VAL HG2 H 0.902 0.01 2 258 69 57 VAL C C 175.9 0.05 1 259 69 57 VAL CA C 61.89 0.05 1 260 69 57 VAL CB C 31.71 0.05 1 261 69 57 VAL N N 125.7 0.1 1 262 70 58 LYS H H 8.538 0.01 1 263 70 58 LYS HA H 4.366 0.01 1 264 70 58 LYS HB2 H 1.731 0.01 1 265 70 58 LYS HB3 H 1.731 0.01 1 266 70 58 LYS HG2 H 1.434 0.01 1 267 70 58 LYS HG3 H 1.434 0.01 1 268 70 58 LYS HD2 H 1.621 0.01 1 269 70 58 LYS HD3 H 1.621 0.01 1 270 70 58 LYS HE2 H 2.952 0.01 1 271 70 58 LYS HE3 H 2.952 0.01 1 272 70 58 LYS C C 176.07 0.05 1 273 70 58 LYS CA C 56.01 0.05 1 274 70 58 LYS CB C 31.59 0.05 1 275 70 58 LYS N N 127.319 0.1 1 276 71 59 THR H H 7.545 0.01 1 277 71 59 THR HA H 4.637 0.01 1 278 71 59 THR HB H 4.385 0.01 1 279 71 59 THR HG2 H 1.321 0.01 1 280 71 59 THR C C 175.31 0.05 1 281 71 59 THR CA C 60.6 0.05 1 282 71 59 THR CB C 70.14 0.05 1 283 71 59 THR N N 113.631 0.1 1 284 72 60 LEU H H 8.805 0.01 1 285 72 60 LEU HA H 4.058 0.01 1 286 72 60 LEU HB2 H 1.845 0.01 1 287 72 60 LEU HB3 H 1.845 0.01 1 288 72 60 LEU HG H 1.484 0.01 1 289 72 60 LEU HD1 H 0.953 0.01 2 290 72 60 LEU HD2 H 0.953 0.01 2 291 72 60 LEU C C 177.89 0.05 1 292 72 60 LEU CA C 58.0 0.05 1 293 72 60 LEU CB C 40.15 0.05 1 294 72 60 LEU N N 121.628 0.1 1 295 73 61 ASP H H 8.255 0.01 1 296 73 61 ASP HA H 4.474 0.01 1 297 73 61 ASP HB2 H 2.573 0.01 2 298 73 61 ASP HB3 H 2.722 0.01 2 299 73 61 ASP C C 179.43 0.05 1 300 73 61 ASP CA C 52.26 0.05 1 301 73 61 ASP CB C 39.43 0.05 1 302 73 61 ASP N N 116.133 0.1 1 303 74 62 VAL H H 7.53 0.01 1 304 74 62 VAL HA H 3.756 0.01 1 305 74 62 VAL HB H 2.079 0.01 1 306 74 62 VAL HG1 H 0.968 0.01 2 307 74 62 VAL HG2 H 1.054 0.01 2 308 74 62 VAL CA C 65.87 0.05 1 309 74 62 VAL CB C 30.79 0.05 1 310 74 62 VAL CG1 C 20.854 0.05 1 311 74 62 VAL CG2 C 20.854 0.05 1 312 74 62 VAL N N 122.56 0.1 1 313 75 63 LEU H H 8.378 0.01 1 314 75 63 LEU HA H 4.168 0.01 1 315 75 63 LEU HB2 H 2.076 0.01 2 316 75 63 LEU HB3 H 1.547 0.01 2 317 75 63 LEU HG H 1.969 0.01 1 318 75 63 LEU HD1 H 1.036 0.01 2 319 75 63 LEU HD2 H 0.956 0.01 2 320 75 63 LEU C C 178.78 0.05 1 321 75 63 LEU CA C 57.91 0.05 1 322 75 63 LEU CB C 40.62 0.05 1 323 75 63 LEU N N 121.873 0.1 1 324 76 64 ARG H H 8.851 0.01 1 325 76 64 ARG HA H 3.793 0.01 1 326 76 64 ARG HB2 H 2.143 0.01 2 327 76 64 ARG HB3 H 2.031 0.01 2 328 76 64 ARG HG2 H 1.88 0.01 1 329 76 64 ARG HG3 H 1.88 0.01 1 330 76 64 ARG HD2 H 3.389 0.01 2 331 76 64 ARG HD3 H 3.216 0.01 2 332 76 64 ARG C C 178.48 0.05 1 333 76 64 ARG CA C 60.9 0.05 1 334 76 64 ARG CB C 29.35 0.05 1 335 76 64 ARG N N 115.888 0.1 1 336 77 65 GLY H H 7.869 0.01 1 337 77 65 GLY HA2 H 4.027 0.01 2 338 77 65 GLY HA3 H 3.867 0.01 2 339 77 65 GLY C C 177.04 0.05 1 340 77 65 GLY CA C 47.11 0.05 1 341 77 65 GLY N N 105.291 0.1 1 342 78 66 GLU H H 8.327 0.01 1 343 78 66 GLU HA H 4.151 0.01 1 344 78 66 GLU HB2 H 2.225 0.01 2 345 78 66 GLU HB3 H 2.094 0.01 2 346 78 66 GLU HG2 H 2.48 0.01 2 347 78 66 GLU HG3 H 2.336 0.01 2 348 78 66 GLU C C 179.08 0.05 1 349 78 66 GLU CA C 59.07 0.05 1 350 78 66 GLU CB C 28.52 0.05 1 351 78 66 GLU N N 124.522 0.1 1 352 79 67 LEU H H 8.666 0.01 1 353 79 67 LEU HA H 4.171 0.01 1 354 79 67 LEU HB2 H 2.07 0.01 2 355 79 67 LEU HG H 1.968 0.01 1 356 79 67 LEU HD1 H 0.892 0.01 2 357 79 67 LEU HD2 H 0.795 0.01 2 358 79 67 LEU C C 180.35 0.05 1 359 79 67 LEU CA C 57.84 0.05 1 360 79 67 LEU CB C 40.46 0.05 1 361 79 67 LEU N N 119.665 0.1 1 362 80 68 ARG H H 8.769 0.01 1 363 80 68 ARG HA H 3.844 0.01 1 364 80 68 ARG HB2 H 1.988 0.01 2 365 80 68 ARG HG2 H 1.86 0.01 2 366 80 68 ARG HG3 H 1.708 0.01 2 367 80 68 ARG HD2 H 3.314 0.01 2 368 80 68 ARG HD3 H 3.224 0.01 2 369 80 68 ARG C C 178.62 0.05 1 370 80 68 ARG CA C 60.17 0.05 1 371 80 68 ARG CB C 29.48 0.05 1 372 80 68 ARG N N 119.126 0.1 1 373 81 69 GLY H H 8.173 0.01 1 374 81 69 GLY HA2 H 4.073 0.01 2 375 81 69 GLY HA3 H 3.882 0.01 2 376 81 69 GLY C C 177.22 0.05 1 377 81 69 GLY CA C 47.13 0.05 1 378 81 69 GLY N N 106.076 0.1 1 379 82 70 GLN H H 8.034 0.01 1 380 82 70 GLN HA H 4.278 0.01 1 381 82 70 GLN HB2 H 2.076 0.01 2 382 82 70 GLN HB3 H 1.814 0.01 2 383 82 70 GLN HG2 H 2.24 0.01 1 384 82 70 GLN HG3 H 2.24 0.01 1 385 82 70 GLN HE21 H 7.584 0.01 2 386 82 70 GLN HE22 H 6.725 0.01 2 387 82 70 GLN C C 179.65 0.05 1 388 82 70 GLN CA C 58.38 0.05 1 389 82 70 GLN CB C 27.75 0.05 1 390 82 70 GLN N N 122.413 0.1 1 391 83 71 ARG H H 8.234 0.01 1 392 83 71 ARG HA H 3.934 0.01 1 393 83 71 ARG HB2 H 1.703 0.01 2 394 83 71 ARG HB3 H 1.59 0.01 2 395 83 71 ARG HG2 H 1.396 0.01 1 396 83 71 ARG HG3 H 1.396 0.01 1 397 83 71 ARG C C 178.4 0.05 1 398 83 71 ARG CA C 59.92 0.05 1 399 83 71 ARG CB C 29.5 0.05 1 400 83 71 ARG N N 119.224 0.1 1 401 84 72 GLU H H 9.119 0.01 1 402 84 72 GLU HA H 3.89 0.01 1 403 84 72 GLU HB2 H 2.237 0.01 2 404 84 72 GLU HB3 H 2.04 0.01 2 405 84 72 GLU HG2 H 2.84 0.01 1 406 84 72 GLU HG3 H 2.84 0.01 1 407 84 72 GLU C C 178.87 0.05 1 408 84 72 GLU CA C 60.47 0.05 1 409 84 72 GLU CB C 27.92 0.05 1 410 84 72 GLU N N 119.518 0.1 1 411 85 73 ALA H H 8.044 0.01 1 412 85 73 ALA HA H 4.236 0.01 1 413 85 73 ALA HB H 1.587 0.01 1 414 85 73 ALA C C 180.45 0.05 1 415 85 73 ALA CA C 55.18 0.05 1 416 85 73 ALA CB C 16.82 0.05 1 417 85 73 ALA N N 123.639 0.1 1 418 86 74 PHE H H 7.633 0.01 1 419 86 74 PHE HA H 4.505 0.01 1 420 86 74 PHE HB2 H 3.229 0.01 1 421 86 74 PHE HB3 H 3.229 0.01 1 422 86 74 PHE HD1 H 7.146 0.01 3 423 86 74 PHE HE1 H 7.057 0.01 3 424 86 74 PHE HZ H 8.011 0.01 1 425 86 74 PHE C C 177.08 0.05 1 426 86 74 PHE CA C 59.95 0.05 1 427 86 74 PHE CB C 38.02 0.05 1 428 86 74 PHE N N 120.549 0.1 1 429 87 75 LEU H H 8.63 0.01 1 430 87 75 LEU HA H 3.572 0.01 1 431 87 75 LEU HB2 H 2.307 0.01 1 432 87 75 LEU HB3 H 2.307 0.01 1 433 87 75 LEU HG H 2.01 0.01 1 434 87 75 LEU HD1 H 0.981 0.01 2 435 87 75 LEU HD2 H 0.812 0.01 2 436 87 75 LEU C C 179.13 0.05 1 437 87 75 LEU CA C 57.46 0.05 1 438 87 75 LEU CB C 40.44 0.05 1 439 87 75 LEU N N 118.979 0.1 1 440 88 76 SER H H 8.265 0.01 1 441 88 76 SER HA H 4.123 0.01 1 442 88 76 SER HB2 H 3.929 0.01 2 443 88 76 SER C C 175.73 0.05 1 444 88 76 SER CA C 62.46 0.05 1 445 88 76 SER CB C 61.05 0.05 1 446 88 76 SER N N 109.265 0.1 1 447 89 77 GLU H H 7.474 0.01 1 448 89 77 GLU HA H 4.022 0.01 1 449 89 77 GLU HB2 H 2.251 0.01 2 450 89 77 GLU HB3 H 2.147 0.01 2 451 89 77 GLU HG2 H 2.414 0.01 2 452 89 77 GLU HG3 H 2.283 0.01 2 453 89 77 GLU C C 179.01 0.05 1 454 89 77 GLU CA C 58.86 0.05 1 455 89 77 GLU CB C 28.18 0.05 1 456 89 77 GLU N N 121.235 0.1 1 457 90 78 ILE H H 7.222 0.01 1 458 90 78 ILE HA H 3.639 0.01 1 459 90 78 ILE HB H 1.854 0.01 1 460 90 78 ILE HG12 H 0.595 0.01 1 461 90 78 ILE HG13 H 1.767 0.01 1 462 90 78 ILE HG2 H 0.368 0.01 1 463 90 78 ILE HD1 H 0.239 0.01 1 464 90 78 ILE C C 177.04 0.05 1 465 90 78 ILE CA C 63.69 0.05 1 466 90 78 ILE CB C 35.46 0.05 1 467 90 78 ILE CG2 C 18.015 0.05 1 468 90 78 ILE CD1 C 11.707 0.05 1 469 90 78 ILE N N 119.96 0.1 1 470 91 79 ILE H H 7.88 0.01 1 471 91 79 ILE HA H 3.369 0.01 1 472 91 79 ILE HB H 1.767 0.01 1 473 91 79 ILE HG12 H 0.929 0.01 1 474 91 79 ILE HG2 H 0.929 0.01 1 475 91 79 ILE HD1 H 1.037 0.01 1 476 91 79 ILE C C 176.75 0.05 1 477 91 79 ILE CA C 65.29 0.05 1 478 91 79 ILE CB C 37.62 0.05 1 479 91 79 ILE CG2 C 17.44 0.05 1 480 91 79 ILE CD1 C 14.374 0.05 1 481 91 79 ILE N N 116.329 0.1 1 482 92 80 LYS H H 7.18 0.01 1 483 92 80 LYS HA H 4.187 0.01 1 484 92 80 LYS HB2 H 1.91 0.01 2 485 92 80 LYS HB3 H 1.838 0.01 2 486 92 80 LYS HG2 H 1.547 0.01 1 487 92 80 LYS HG3 H 1.547 0.01 1 488 92 80 LYS HD2 H 1.774 0.01 2 489 92 80 LYS HD3 H 1.67 0.01 2 490 92 80 LYS C C 176.09 0.05 1 491 92 80 LYS CA C 56.88 0.05 1 492 92 80 LYS CB C 31.91 0.05 1 493 92 80 LYS N N 115.446 0.1 1 494 93 81 SER H H 7.849 0.01 1 495 93 81 SER HA H 4.633 0.01 1 496 93 81 SER HB2 H 3.907 0.01 1 497 93 81 SER HB3 H 3.907 0.01 1 498 93 81 SER CA C 56.58 0.05 1 499 93 81 SER CB C 64.54 0.05 1 500 93 81 SER N N 115.152 0.1 1 501 94 82 ASP H H 8.322 0.01 1 502 94 82 ASP HA H 5.058 0.01 1 503 94 82 ASP HB2 H 2.902 0.01 2 504 94 82 ASP HB3 H 2.45 0.01 2 505 94 82 ASP C C 176.56 0.05 1 506 94 82 ASP CA C 53.95 0.05 1 507 94 82 ASP CB C 41.14 0.05 1 508 94 82 ASP N N 121.235 0.1 1 509 95 83 GLY H H 8.24 0.01 1 510 95 83 GLY HA3 H 3.307 0.01 2 511 95 83 GLY CA C 42.21 0.05 1 512 95 83 GLY N N 109.755 0.1 1 513 96 84 PRO C C 181.89 0.05 1 514 97 85 PHE H H 7.859 0.01 1 515 97 85 PHE HA H 5.136 0.01 1 516 97 85 PHE HB2 H 3.002 0.01 2 517 97 85 PHE HB3 H 2.122 0.01 2 518 97 85 PHE HD1 H 6.937 0.01 3 519 97 85 PHE HE1 H 7.078 0.01 3 520 97 85 PHE HZ H 7.133 0.01 1 521 97 85 PHE C C 175.05 0.05 1 522 97 85 PHE CA C 56.06 0.05 1 523 97 85 PHE CB C 40.4 0.05 1 524 98 86 THR H H 9.042 0.01 1 525 98 86 THR HA H 4.973 0.01 1 526 98 86 THR HB H 4.595 0.01 1 527 98 86 THR HG2 H 1.378 0.01 1 528 98 86 THR C C 176.54 0.05 1 529 98 86 THR CA C 59.93 0.05 1 530 98 86 THR CB C 70.84 0.05 1 531 98 86 THR N N 112.552 0.1 1 532 99 87 ILE H H 9.468 0.01 1 533 99 87 ILE HA H 3.881 0.01 1 534 99 87 ILE HB H 1.82 0.01 1 535 99 87 ILE HG12 H 1.656 0.01 1 536 99 87 ILE HG13 H 1.343 0.01 1 537 99 87 ILE HG2 H 1.068 0.01 1 538 99 87 ILE HD1 H 0.692 0.01 1 539 99 87 ILE C C 175.71 0.05 1 540 99 87 ILE CA C 59.52 0.05 1 541 99 87 ILE CB C 35.69 0.05 1 542 99 87 ILE CG2 C 17.98 0.05 1 543 99 87 ILE CD1 C 13.819 0.05 1 544 99 87 ILE N N 119.175 0.1 1 545 100 88 LEU H H 7.109 0.01 1 546 100 88 LEU HA H 4.243 0.01 1 547 100 88 LEU HB2 H 1.815 0.01 2 548 100 88 LEU HB3 H 1.776 0.01 2 549 100 88 LEU HG H 1.608 0.01 1 550 100 88 LEU HD1 H 0.956 0.01 2 551 100 88 LEU HD2 H 0.956 0.01 2 552 100 88 LEU C C 181.53 0.05 1 553 100 88 LEU CA C 56.9 0.05 1 554 100 88 LEU CB C 38.34 0.05 1 555 100 88 LEU N N 118.782 0.1 1 556 101 89 GLN H H 7.844 0.01 1 557 101 89 GLN HA H 4.281 0.01 1 558 101 89 GLN HB2 H 2.455 0.01 1 559 101 89 GLN HB3 H 2.455 0.01 1 560 101 89 GLN HG2 H 2.675 0.01 2 561 101 89 GLN HG3 H 2.657 0.01 2 562 101 89 GLN C C 177.46 0.05 1 563 101 89 GLN CA C 59.34 0.05 1 564 101 89 GLN CB C 29.17 0.05 1 565 101 89 GLN N N 121.873 0.1 1 566 102 90 LEU H H 8.065 0.01 1 567 102 90 LEU HA H 3.879 0.01 1 568 102 90 LEU HB2 H 1.827 0.01 1 569 102 90 LEU HB3 H 1.827 0.01 1 570 102 90 LEU HD1 H 0.7 0.01 2 571 102 90 LEU HD2 H 0.814 0.01 2 572 102 90 LEU C C 178.06 0.05 1 573 102 90 LEU CA C 58.25 0.05 1 574 102 90 LEU CB C 39.98 0.05 1 575 102 90 LEU CD1 C 25.866 0.05 1 576 102 90 LEU N N 119.371 0.1 1 577 103 91 VAL H H 8.764 0.01 1 578 103 91 VAL HA H 3.549 0.01 1 579 103 91 VAL HB H 1.946 0.01 1 580 103 91 VAL HG1 H 0.879 0.01 2 581 103 91 VAL HG2 H 0.625 0.01 2 582 103 91 VAL C C 177.38 0.05 1 583 103 91 VAL CA C 65.03 0.05 1 584 103 91 VAL CB C 30.23 0.05 1 585 103 91 VAL N N 117.654 0.1 1 586 104 92 GLY H H 7.797 0.01 1 587 104 92 GLY HA2 H 3.378 0.01 2 588 104 92 GLY HA3 H 3.495 0.01 2 589 104 92 GLY C C 174.52 0.05 1 590 104 92 GLY CA C 47.22 0.05 1 591 104 92 GLY N N 109.265 0.1 1 592 105 93 TYR H H 8.168 0.01 1 593 105 93 TYR HA H 3.91 0.01 1 594 105 93 TYR HB2 H 2.837 0.01 2 595 105 93 TYR HB3 H 3.081 0.01 2 596 105 93 TYR HD1 H 6.723 0.01 3 597 105 93 TYR HE1 H 6.571 0.01 3 598 105 93 TYR C C 175.99 0.05 1 599 105 93 TYR CA C 63.35 0.05 1 600 105 93 TYR CB C 36.84 0.05 1 601 105 93 TYR N N 121.432 0.1 1 602 106 94 LEU H H 7.756 0.01 1 603 106 94 LEU HA H 3.721 0.01 1 604 106 94 LEU HD1 H 0.114 0.01 2 605 106 94 LEU HD2 H 0.624 0.01 2 606 106 94 LEU C C 177.49 0.05 1 607 106 94 LEU CA C 57.69 0.05 1 608 106 94 LEU CB C 40.37 0.05 1 609 106 94 LEU CD1 C 25.601 0.05 1 610 106 94 LEU CD2 C 22.14 0.05 1 611 106 94 LEU N N 120.45 0.1 1 612 107 95 ARG H H 8.728 0.01 1 613 107 95 ARG HA H 4.064 0.01 1 614 107 95 ARG HD2 H 3.064 0.01 1 615 107 95 ARG HD3 H 3.064 0.01 1 616 107 95 ARG C C 179.96 0.05 1 617 107 95 ARG CA C 59.27 0.05 1 618 107 95 ARG CB C 29.72 0.05 1 619 107 95 ARG N N 117.556 0.1 1 620 108 96 VAL H H 8.039 0.01 1 621 108 96 VAL HA H 3.381 0.01 1 622 108 96 VAL HB H 2.302 0.01 1 623 108 96 VAL HG1 H 1.041 0.01 2 624 108 96 VAL HG2 H 0.881 0.01 2 625 108 96 VAL C C 177.79 0.05 1 626 108 96 VAL CA C 66.52 0.05 1 627 108 96 VAL CB C 29.6 0.05 1 628 108 96 VAL N N 121.922 0.1 1 629 109 97 VAL H H 7.628 0.01 1 630 109 97 VAL HA H 3.692 0.01 1 631 109 97 VAL HB H 2.01 0.01 1 632 109 97 VAL HG1 H 0.687 0.01 2 633 109 97 VAL HG2 H 0.718 0.01 2 634 109 97 VAL C C 179.09 0.05 1 635 109 97 VAL CA C 65.28 0.05 1 636 109 97 VAL CB C 30.75 0.05 1 637 109 97 VAL CG1 C 20.924 0.05 1 638 109 97 VAL CG2 C 22.057 0.05 1 639 109 97 VAL N N 115.888 0.1 1 640 110 98 ASP H H 9.021 0.01 1 641 110 98 ASP HA H 4.664 0.01 1 642 110 98 ASP HB2 H 2.953 0.01 2 643 110 98 ASP HB3 H 2.807 0.01 2 644 110 98 ASP C C 178.16 0.05 1 645 110 98 ASP CA C 56.37 0.05 1 646 110 98 ASP CB C 43.08 0.05 1 647 110 98 ASP N N 120.058 0.1 1 648 111 99 THR H H 7.612 0.01 1 649 111 99 THR HA H 5.098 0.01 1 650 111 99 THR HB H 4.825 0.01 1 651 111 99 THR HG2 H 5.176 0.01 1 652 111 99 THR C C 175.6 0.05 1 653 111 99 THR CA C 60.68 0.05 1 654 111 99 THR CB C 69.13 0.05 1 655 111 99 THR N N 103.966 0.1 1 656 112 100 ASP H H 7.037 0.01 1 657 112 100 ASP HA H 4.808 0.01 1 658 112 100 ASP HB2 H 3.203 0.01 2 659 112 100 ASP HB3 H 2.406 0.01 2 660 112 100 ASP C C 178.36 0.05 1 661 112 100 ASP CA C 56.77 0.05 1 662 112 100 ASP CB C 30.94 0.05 1 663 112 100 ASP N N 121.235 0.1 1 664 113 101 LEU H H 8.851 0.01 1 665 113 101 LEU HA H 3.945 0.01 1 666 113 101 LEU HB2 H 1.559 0.01 2 667 113 101 LEU HB3 H 1.497 0.01 2 668 113 101 LEU HG H 0.977 0.01 1 669 113 101 LEU HD1 H 0.648 0.01 2 670 113 101 LEU HD2 H 0.441 0.01 2 671 113 101 LEU C C 181.89 0.05 1 672 113 101 LEU CA C 59.61 0.05 1 673 113 101 LEU CB C 40.77 0.05 1 674 113 101 LEU CD1 C 25.91 0.05 1 675 113 101 LEU N N 121.137 0.1 1 676 114 102 LEU H H 8.45 0.01 1 677 114 102 LEU HA H 4.358 0.01 1 678 114 102 LEU HB2 H 1.805 0.01 2 679 114 102 LEU HB3 H 1.964 0.01 2 680 114 102 LEU HD1 H 0.995 0.01 2 681 114 102 LEU HD2 H 1.032 0.01 2 682 114 102 LEU C C 176.15 0.05 1 683 114 102 LEU CB C 40.01 0.05 1 684 114 102 LEU N N 109.804 0.1 1 685 115 103 LEU H H 7.885 0.01 1 686 115 103 LEU HA H 4.478 0.01 1 687 115 103 LEU HB2 H 1.596 0.01 2 688 115 103 LEU HB3 H 1.39 0.01 2 689 115 103 LEU HG H 1.268 0.01 1 690 115 103 LEU HD1 H 0.856 0.01 2 691 115 103 LEU HD2 H 0.856 0.01 2 692 115 103 LEU C C 175.51 0.05 1 693 115 103 LEU CA C 55.43 0.05 1 694 115 103 LEU CB C 43.54 0.05 1 695 115 103 LEU N N 119.764 0.1 1 696 116 104 LYS H H 8.764 0.01 1 697 116 104 LYS HA H 4.304 0.01 1 698 116 104 LYS HB2 H 1.957 0.01 2 699 116 104 LYS HG2 H 1.381 0.01 1 700 116 104 LYS HG3 H 1.381 0.01 1 701 116 104 LYS HD2 H 1.737 0.01 2 702 116 104 LYS C C 176.61 0.05 1 703 116 104 LYS CA C 55.91 0.05 1 704 116 104 LYS CB C 28.66 0.05 1 705 116 104 LYS N N 119.665 0.1 1 706 117 105 VAL H H 9.684 0.01 1 707 117 105 VAL HA H 4.017 0.01 1 708 117 105 VAL HB H 2.166 0.01 1 709 117 105 VAL HG1 H 1.023 0.01 2 710 117 105 VAL HG2 H 0.863 0.01 2 711 117 105 VAL C C 175.59 0.05 1 712 117 105 VAL CA C 61.49 0.05 1 713 117 105 VAL CB C 31.67 0.05 1 714 117 105 VAL N N 121.334 0.1 1 715 118 106 ASP H H 8.759 0.01 1 716 118 106 ASP HA H 4.314 0.01 1 717 118 106 ASP HB2 H 2.815 0.01 2 718 118 106 ASP HB3 H 2.481 0.01 2 719 118 106 ASP C C 177.96 0.05 1 720 118 106 ASP CA C 55.42 0.05 1 721 118 106 ASP CB C 41.59 0.05 1 722 118 106 ASP N N 121.432 0.1 1 723 119 107 SER H H 8.661 0.01 1 724 119 107 SER HA H 4.588 0.01 1 725 119 107 SER HB2 H 4.536 0.01 1 726 119 107 SER HB3 H 4.536 0.01 1 727 119 107 SER CA C 61.52 0.05 1 728 119 107 SER CB C 62.28 0.05 1 729 119 107 SER N N 124.424 0.1 1 730 120 108 THR H H 8.342 0.01 1 731 120 108 THR HA H 4.35 0.01 1 732 120 108 THR HB H 4.229 0.01 1 733 120 108 THR HG2 H 1.302 0.01 1 734 120 108 THR C C 177.12 0.05 1 735 120 108 THR CA C 65.84 0.05 1 736 120 108 THR CB C 67.41 0.05 1 737 120 108 THR N N 119.567 0.1 1 738 121 109 LYS H H 7.746 0.01 1 739 121 109 LYS HA H 3.966 0.01 1 740 121 109 LYS HB2 H 1.977 0.01 1 741 121 109 LYS HB3 H 1.977 0.01 1 742 121 109 LYS HG2 H 1.661 0.01 1 743 121 109 LYS HG3 H 1.661 0.01 1 744 121 109 LYS HD2 H 1.892 0.01 1 745 121 109 LYS HD3 H 1.892 0.01 1 746 121 109 LYS C C 178.98 0.05 1 747 121 109 LYS CA C 59.09 0.05 1 748 121 109 LYS CB C 32.27 0.05 1 749 121 109 LYS N N 121.922 0.1 1 750 122 110 VAL H H 7.854 0.01 1 751 122 110 VAL HA H 3.56 0.01 1 752 122 110 VAL HB H 2.15 0.01 1 753 122 110 VAL HG1 H 0.933 0.01 2 754 122 110 VAL HG2 H 0.83 0.01 2 755 122 110 VAL C C 180.21 0.05 1 756 122 110 VAL CA C 67.54 0.05 1 757 122 110 VAL CB C 28.63 0.05 1 758 122 110 VAL N N 119.764 0.1 1 759 123 111 ASP H H 8.342 0.01 1 760 123 111 ASP HA H 4.518 0.01 1 761 123 111 ASP HB2 H 2.903 0.01 2 762 123 111 ASP HB3 H 2.82 0.01 2 763 123 111 ASP C C 178.92 0.05 1 764 123 111 ASP CA C 57.31 0.05 1 765 123 111 ASP CB C 40.49 0.05 1 766 123 111 ASP N N 123.59 0.1 1 767 124 112 GLU H H 8.666 0.01 1 768 124 112 GLU HA H 4.13 0.01 1 769 124 112 GLU HB2 H 2.028 0.01 2 770 124 112 GLU HB3 H 1.963 0.01 2 771 124 112 GLU HG2 H 2.1 0.01 2 772 124 112 GLU HG3 H 2.039 0.01 2 773 124 112 GLU C C 180.0 0.05 1 774 124 112 GLU CA C 59.45 0.05 1 775 124 112 GLU CB C 28.24 0.05 1 776 124 112 GLU N N 119.665 0.1 1 777 125 113 ALA H H 8.461 0.01 1 778 125 113 ALA HA H 3.79 0.01 1 779 125 113 ALA HB H 1.44 0.01 1 780 125 113 ALA C C 178.82 0.05 1 781 125 113 ALA CA C 54.85 0.05 1 782 125 113 ALA CB C 18.42 0.05 1 783 125 113 ALA N N 120.745 0.1 1 784 126 114 GLY H H 8.024 0.01 1 785 126 114 GLY HA2 H 4.136 0.01 2 786 126 114 GLY HA3 H 3.059 0.01 2 787 126 114 GLY C C 175.54 0.05 1 788 126 114 GLY CA C 46.68 0.05 1 789 126 114 GLY N N 106.076 0.1 1 790 127 115 LYS H H 7.731 0.01 1 791 127 115 LYS HA H 3.981 0.01 1 792 127 115 LYS HB2 H 1.939 0.01 2 793 127 115 LYS HB3 H 1.893 0.01 2 794 127 115 LYS HG2 H 1.46 0.01 1 795 127 115 LYS HG3 H 1.46 0.01 1 796 127 115 LYS HD2 H 1.69 0.01 1 797 127 115 LYS HD3 H 1.69 0.01 1 798 127 115 LYS C C 180.47 0.05 1 799 127 115 LYS CA C 59.62 0.05 1 800 127 115 LYS CB C 31.47 0.05 1 801 127 115 LYS N N 120.45 0.1 1 802 128 116 LYS H H 7.109 0.01 1 803 128 116 LYS HA H 4.205 0.01 1 804 128 116 LYS HB2 H 1.993 0.01 2 805 128 116 LYS HB3 H 1.931 0.01 2 806 128 116 LYS HG2 H 1.667 0.01 1 807 128 116 LYS HG3 H 1.667 0.01 1 808 128 116 LYS HD2 H 1.835 0.01 1 809 128 116 LYS HD3 H 1.835 0.01 1 810 128 116 LYS HE2 H 3.304 0.01 2 811 128 116 LYS HE3 H 3.16 0.01 2 812 128 116 LYS CA C 57.36 0.05 1 813 128 116 LYS CB C 30.87 0.05 1 814 128 116 LYS N N 117.801 0.1 1 815 129 117 VAL H H 7.89 0.01 1 816 129 117 VAL HA H 3.282 0.01 1 817 129 117 VAL HB H 1.555 0.01 1 818 129 117 VAL HG1 H 0.588 0.01 2 819 129 117 VAL HG2 H 0.071 0.01 2 820 129 117 VAL C C 177.25 0.05 1 821 129 117 VAL CA C 66.61 0.05 1 822 129 117 VAL CB C 30.39 0.05 1 823 129 117 VAL CG1 C 21.52 0.05 1 824 129 117 VAL CG2 C 21.48 0.05 1 825 129 117 VAL N N 120.892 0.1 1 826 130 118 LYS H H 8.527 0.01 1 827 130 118 LYS HA H 3.725 0.01 1 828 130 118 LYS HB2 H 2.004 0.01 2 829 130 118 LYS HB3 H 1.806 0.01 2 830 130 118 LYS HG2 H 1.299 0.01 2 831 130 118 LYS HG3 H 1.004 0.01 2 832 130 118 LYS HD2 H 1.537 0.01 2 833 130 118 LYS HD3 H 1.451 0.01 2 834 130 118 LYS C C 178.09 0.05 1 835 130 118 LYS CA C 59.42 0.05 1 836 130 118 LYS CB C 31.99 0.05 1 837 130 118 LYS N N 120.107 0.1 1 838 131 119 ALA H H 7.669 0.01 1 839 131 119 ALA HA H 4.222 0.01 1 840 131 119 ALA HB H 1.587 0.01 1 841 131 119 ALA C C 180.54 0.05 1 842 131 119 ALA CA C 54.69 0.05 1 843 131 119 ALA CB C 17.0 0.05 1 844 131 119 ALA N N 119.175 0.1 1 845 132 120 TYR H H 7.88 0.01 1 846 132 120 TYR HA H 4.529 0.01 1 847 132 120 TYR HB2 H 3.491 0.01 2 848 132 120 TYR HB3 H 3.19 0.01 2 849 132 120 TYR HD1 H 7.314 0.01 3 850 132 120 TYR HE1 H 7.065 0.01 3 851 132 120 TYR C C 176.41 0.05 1 852 132 120 TYR CA C 61.15 0.05 1 853 132 120 TYR CB C 37.78 0.05 1 854 132 120 TYR N N 120.107 0.1 1 855 133 121 LEU H H 8.342 0.01 1 856 133 121 LEU HA H 3.872 0.01 1 857 133 121 LEU HB2 H 2.072 0.01 1 858 133 121 LEU HB3 H 2.072 0.01 1 859 133 121 LEU HG H 1.93 0.01 1 860 133 121 LEU HD1 H 0.768 0.01 2 861 133 121 LEU HD2 H 0.944 0.01 2 862 133 121 LEU C C 178.68 0.05 1 863 133 121 LEU CA C 57.28 0.05 1 864 133 121 LEU CB C 38.83 0.05 1 865 133 121 LEU N N 117.85 0.1 1 866 134 122 GLU H H 8.461 0.01 1 867 134 122 GLU HA H 3.913 0.01 1 868 134 122 GLU HB2 H 2.189 0.01 2 869 134 122 GLU HB3 H 2.047 0.01 2 870 134 122 GLU HG2 H 2.393 0.01 2 871 134 122 GLU HG3 H 2.287 0.01 2 872 134 122 GLU C C 180.14 0.05 1 873 134 122 GLU CA C 59.17 0.05 1 874 134 122 GLU CB C 28.36 0.05 1 875 134 122 GLU N N 118.635 0.1 1 876 135 123 LYS H H 7.772 0.01 1 877 135 123 LYS HA H 4.028 0.01 1 878 135 123 LYS HB2 H 2.051 0.01 1 879 135 123 LYS HB3 H 2.051 0.01 1 880 135 123 LYS HG2 H 1.584 0.01 2 881 135 123 LYS HG3 H 1.456 0.01 2 882 135 123 LYS HD2 H 1.752 0.01 1 883 135 123 LYS HD3 H 1.752 0.01 1 884 135 123 LYS C C 179.1 0.05 1 885 135 123 LYS CA C 59.14 0.05 1 886 135 123 LYS CB C 30.91 0.05 1 887 135 123 LYS N N 121.383 0.1 1 888 136 124 ILE H H 7.489 0.01 1 889 136 124 ILE HA H 4.297 0.01 1 890 136 124 ILE HB H 1.371 0.01 1 891 136 124 ILE HG12 H 1.249 0.01 1 892 136 124 ILE HG13 H 0.932 0.01 1 893 136 124 ILE HG2 H 0.772 0.01 1 894 136 124 ILE HD1 H 0.598 0.01 1 895 136 124 ILE C C 175.75 0.05 1 896 136 124 ILE CA C 62.24 0.05 1 897 136 124 ILE CB C 36.67 0.05 1 898 136 124 ILE CG2 C 13.728 0.05 1 899 136 124 ILE CD1 C 17.03 0.05 1 900 136 124 ILE N N 110.099 0.1 1 901 137 125 GLY H H 7.468 0.01 1 902 137 125 GLY HA2 H 3.641 0.01 2 903 137 125 GLY HA3 H 4.443 0.01 2 904 137 125 GLY C C 176.48 0.05 1 905 137 125 GLY CA C 45.05 0.05 1 906 137 125 GLY N N 106.763 0.1 1 907 138 126 ILE H H 8.389 0.01 1 908 138 126 ILE HA H 4.219 0.01 1 909 138 126 ILE HB H 1.921 0.01 1 910 138 126 ILE HG12 H 1.465 0.01 1 911 138 126 ILE HG13 H 1.382 0.01 1 912 138 126 ILE HG2 H 1.035 0.01 1 913 138 126 ILE HD1 H 0.818 0.01 1 914 138 126 ILE C C 174.63 0.05 1 915 138 126 ILE CA C 58.46 0.05 1 916 138 126 ILE CB C 35.12 0.05 1 917 138 126 ILE CG2 C 18.437 0.05 1 918 138 126 ILE CD1 C 10.705 0.05 1 919 138 126 ILE N N 123.983 0.1 1 920 139 127 ARG H H 8.425 0.01 1 921 139 127 ARG HA H 4.52 0.01 1 922 139 127 ARG HB2 H 1.817 0.01 2 923 139 127 ARG HB3 H 1.683 0.01 2 924 139 127 ARG HG2 H 1.603 0.01 1 925 139 127 ARG HG3 H 1.603 0.01 1 926 139 127 ARG HD2 H 3.168 0.01 1 927 139 127 ARG HD3 H 3.168 0.01 1 928 139 127 ARG C C 175.86 0.05 1 929 139 127 ARG CA C 54.67 0.05 1 930 139 127 ARG CB C 30.89 0.05 1 931 139 127 ARG N N 126.485 0.1 1 932 140 128 GLY H H 8.024 0.01 1 933 140 128 GLY HA2 H 3.94 0.01 2 934 140 128 GLY HA3 H 3.875 0.01 2 935 140 128 GLY C C 173.2 0.05 1 936 140 128 GLY CA C 44.66 0.05 1 937 140 128 GLY N N 105.978 0.1 1 938 141 129 ASP H H 8.82 0.01 1 939 141 129 ASP HA H 4.573 0.01 1 940 141 129 ASP HB2 H 2.81 0.01 2 941 141 129 ASP HB3 H 2.618 0.01 2 942 141 129 ASP C C 174.97 0.05 1 943 141 129 ASP CA C 55.8 0.05 1 944 141 129 ASP CB C 39.76 0.05 1 945 141 129 ASP N N 121.726 0.1 1 946 142 130 SER H H 7.571 0.01 1 947 142 130 SER HA H 4.742 0.01 1 948 142 130 SER HB2 H 4.334 0.01 2 949 142 130 SER HB3 H 3.943 0.01 2 950 142 130 SER C C 174.84 0.05 1 951 142 130 SER CA C 55.36 0.05 1 952 142 130 SER CB C 65.76 0.05 1 953 142 130 SER N N 110.687 0.1 1 954 143 131 VAL H H 9.484 0.01 1 955 143 131 VAL HA H 3.772 0.01 1 956 143 131 VAL HG1 H 1.122 0.01 2 957 143 131 VAL HG2 H 1.007 0.01 2 958 143 131 VAL C C 175.82 0.05 1 959 143 131 VAL CA C 65.79 0.05 1 960 143 131 VAL CB C 30.15 0.05 1 961 143 131 VAL CG1 C 20.6 0.05 1 962 143 131 VAL N N 123.247 0.1 1 963 144 132 GLU H H 9.139 0.01 1 964 144 132 GLU HA H 3.822 0.01 1 965 144 132 GLU HB2 H 2.019 0.01 2 966 144 132 GLU HB3 H 1.962 0.01 2 967 144 132 GLU HG2 H 2.41 0.01 2 968 144 132 GLU HG3 H 2.125 0.01 2 969 144 132 GLU C C 177.99 0.05 1 970 144 132 GLU CA C 60.83 0.05 1 971 144 132 GLU CB C 27.41 0.05 1 972 144 132 GLU N N 122.364 0.1 1 973 145 133 ALA H H 7.844 0.01 1 974 145 133 ALA HA H 4.234 0.01 1 975 145 133 ALA HB H 1.509 0.01 1 976 145 133 ALA C C 180.23 0.05 1 977 145 133 ALA CA C 54.44 0.05 1 978 145 133 ALA CB C 17.91 0.05 1 979 145 133 ALA N N 121.873 0.1 1 980 146 134 ALA H H 8.09 0.01 1 981 146 134 ALA HA H 4.219 0.01 1 982 146 134 ALA HB H 1.309 0.01 1 983 146 134 ALA C C 179.09 0.05 1 984 146 134 ALA CA C 54.59 0.05 1 985 146 134 ALA CB C 17.53 0.05 1 986 146 134 ALA N N 120.549 0.1 1 987 147 135 LEU H H 8.368 0.01 1 988 147 135 LEU HA H 3.845 0.01 1 989 147 135 LEU HB2 H 2.005 0.01 2 990 147 135 LEU HB3 H 1.672 0.01 2 991 147 135 LEU HG H 0.994 0.01 1 992 147 135 LEU HD1 H 0.765 0.01 2 993 147 135 LEU HD2 H 0.825 0.01 2 994 147 135 LEU C C 181.89 0.05 1 995 147 135 LEU CA C 57.65 0.05 1 996 147 135 LEU CB C 41.42 0.05 1 997 147 135 LEU N N 118.488 0.1 1 998 148 136 ASP H H 8.152 0.01 1 999 148 136 ASP HA H 4.327 0.01 1 1000 148 136 ASP HB2 H 2.779 0.01 2 1001 148 136 ASP HB3 H 2.668 0.01 2 1002 148 136 ASP C C 178.1 0.05 1 1003 148 136 ASP CA C 57.36 0.05 1 1004 148 136 ASP CB C 39.54 0.05 1 1005 148 136 ASP N N 120.303 0.1 1 1006 149 137 ASN H H 8.018 0.01 1 1007 149 137 ASN HA H 4.504 0.01 1 1008 149 137 ASN HB2 H 3.076 0.01 2 1009 149 137 ASN HB3 H 2.845 0.01 2 1010 149 137 ASN HD21 H 7.436 0.01 2 1011 149 137 ASN HD22 H 6.928 0.01 2 1012 149 137 ASN CA C 55.84 0.05 1 1013 149 137 ASN CB C 37.33 0.05 1 1014 149 137 ASN N N 117.311 0.1 1 1015 150 138 LEU H H 8.347 0.01 1 1016 150 138 LEU HA H 4.058 0.01 1 1017 150 138 LEU HB2 H 2.334 0.01 2 1018 150 138 LEU HB3 H 1.58 0.01 2 1019 150 138 LEU HG H 1.58 0.01 1 1020 150 138 LEU HD1 H 0.828 0.01 2 1021 150 138 LEU HD2 H 1.027 0.01 2 1022 150 138 LEU C C 177.74 0.05 1 1023 150 138 LEU CA C 58.38 0.05 1 1024 150 138 LEU CB C 40.44 0.05 1 1025 150 138 LEU N N 120.009 0.1 1 1026 151 139 MET H H 8.414 0.01 1 1027 151 139 MET HA H 4.582 0.01 1 1028 151 139 MET HB2 H 2.133 0.01 2 1029 151 139 MET HB3 H 1.755 0.01 2 1030 151 139 MET HG2 H 2.755 0.01 2 1031 151 139 MET HG3 H 2.354 0.01 2 1032 151 139 MET HE H 1.923 0.01 1 1033 151 139 MET C C 180.27 0.05 1 1034 151 139 MET CA C 55.96 0.05 1 1035 151 139 MET CB C 26.81 0.05 1 1036 151 139 MET N N 115.054 0.1 1 1037 152 140 ILE H H 8.548 0.01 1 1038 152 140 ILE HA H 4.193 0.01 1 1039 152 140 ILE HB H 1.975 0.01 1 1040 152 140 ILE HG12 H 1.901 0.01 1 1041 152 140 ILE HG13 H 1.138 0.01 1 1042 152 140 ILE HG2 H 1.011 0.01 1 1043 152 140 ILE HD1 H 0.886 0.01 1 1044 152 140 ILE C C 179.1 0.05 1 1045 152 140 ILE CA C 65.34 0.05 1 1046 152 140 ILE CB C 37.79 0.05 1 1047 152 140 ILE CG2 C 17.011 0.05 1 1048 152 140 ILE CD1 C 13.931 0.05 1 1049 152 140 ILE N N 123.394 0.1 1 1050 153 141 LYS H H 7.602 0.01 1 1051 153 141 LYS HA H 4.246 0.01 1 1052 153 141 LYS HB2 H 2.189 0.01 2 1053 153 141 LYS HB3 H 1.968 0.01 2 1054 153 141 LYS HG2 H 1.664 0.01 1 1055 153 141 LYS HG3 H 1.664 0.01 1 1056 153 141 LYS HD2 H 1.799 0.01 1 1057 153 141 LYS HD3 H 1.799 0.01 1 1058 153 141 LYS HE2 H 3.112 0.01 2 1059 153 141 LYS HE3 H 2.993 0.01 2 1060 153 141 LYS C C 180.15 0.05 1 1061 153 141 LYS CA C 59.43 0.05 1 1062 153 141 LYS CB C 32.16 0.05 1 1063 153 141 LYS N N 119.028 0.1 1 1064 154 142 VAL H H 8.733 0.01 1 1065 154 142 VAL HA H 3.708 0.01 1 1066 154 142 VAL HB H 2.323 0.01 1 1067 154 142 VAL HG1 H 1.323 0.01 2 1068 154 142 VAL HG2 H 1.024 0.01 2 1069 154 142 VAL C C 178.19 0.05 1 1070 154 142 VAL CA C 66.52 0.05 1 1071 154 142 VAL CB C 31.34 0.05 1 1072 154 142 VAL CG1 C 24.874 0.05 1 1073 154 142 VAL N N 119.616 0.1 1 1074 155 143 TYR H H 9.062 0.01 1 1075 155 143 TYR HA H 4.156 0.01 1 1076 155 143 TYR HB2 H 3.336 0.01 2 1077 155 143 TYR HB3 H 3.296 0.01 2 1078 155 143 TYR HD1 H 7.075 0.01 3 1079 155 143 TYR HE1 H 6.792 0.01 3 1080 155 143 TYR C C 177.93 0.05 1 1081 155 143 TYR CA C 62.2 0.05 1 1082 155 143 TYR CB C 37.7 0.05 1 1083 155 143 TYR N N 124.719 0.1 1 1084 156 144 GLU H H 8.476 0.01 1 1085 156 144 GLU HA H 3.979 0.01 1 1086 156 144 GLU HB2 H 2.296 0.01 2 1087 156 144 GLU HB3 H 2.093 0.01 2 1088 156 144 GLU HG2 H 2.793 0.01 2 1089 156 144 GLU HG3 H 2.419 0.01 2 1090 156 144 GLU C C 179.66 0.05 1 1091 156 144 GLU CA C 59.09 0.05 1 1092 156 144 GLU CB C 28.69 0.05 1 1093 156 144 GLU N N 117.605 0.1 1 1094 157 145 ILE H H 7.767 0.01 1 1095 157 145 ILE HA H 3.992 0.01 1 1096 157 145 ILE HB H 2.106 0.01 1 1097 157 145 ILE HG12 H 1.757 0.01 1 1098 157 145 ILE HG13 H 1.37 0.01 1 1099 157 145 ILE HG2 H 1.074 0.01 1 1100 157 145 ILE HD1 H 0.932 0.01 1 1101 157 145 ILE C C 178.4 0.05 1 1102 157 145 ILE CA C 63.56 0.05 1 1103 157 145 ILE CB C 37.01 0.05 1 1104 157 145 ILE CG2 C 18.205 0.05 1 1105 157 145 ILE CD1 C 14.365 0.05 1 1106 157 145 ILE N N 119.126 0.1 1 1107 158 146 THR H H 8.106 0.01 1 1108 158 146 THR HA H 4.314 0.01 1 1109 158 146 THR HB H 3.997 0.01 1 1110 158 146 THR HG2 H 1.274 0.01 1 1111 158 146 THR C C 175.89 0.05 1 1112 158 146 THR CA C 65.08 0.05 1 1113 158 146 THR CB C 68.37 0.05 1 1114 158 146 THR N N 115.888 0.1 1 1115 159 147 LYS H H 7.972 0.01 1 1116 159 147 LYS HA H 4.242 0.01 1 1117 159 147 LYS HB2 H 1.778 0.01 2 1118 159 147 LYS HB3 H 1.527 0.01 2 1119 159 147 LYS HG2 H 1.066 0.01 1 1120 159 147 LYS HG3 H 1.066 0.01 1 1121 159 147 LYS HD2 H 1.462 0.01 1 1122 159 147 LYS HD3 H 1.462 0.01 1 1123 159 147 LYS C C 177.43 0.05 1 1124 159 147 LYS CA C 55.47 0.05 1 1125 159 147 LYS CB C 31.06 0.05 1 1126 159 147 LYS N N 119.126 0.1 1 1127 160 148 GLY H H 7.803 0.01 1 1128 160 148 GLY HA2 H 4.076 0.01 2 1129 160 148 GLY HA3 H 4.022 0.01 2 1130 160 148 GLY C C 174.57 0.05 1 1131 160 148 GLY CA C 45.62 0.05 1 1132 160 148 GLY N N 108.529 0.1 1 1133 161 149 THR H H 8.106 0.01 1 1134 161 149 THR HA H 4.417 0.01 1 1135 161 149 THR HB H 4.3 0.01 1 1136 161 149 THR HG2 H 1.195 0.01 1 1137 161 149 THR C C 174.78 0.05 1 1138 161 149 THR CA C 61.32 0.05 1 1139 161 149 THR CB C 68.92 0.05 1 1140 161 149 THR N N 113.386 0.1 1 1141 162 150 VAL H H 8.07 0.01 1 1142 162 150 VAL HA H 4.12 0.01 1 1143 162 150 VAL HB H 2.085 0.01 1 1144 162 150 VAL HG1 H 0.964 0.01 2 1145 162 150 VAL HG2 H 0.964 0.01 2 1146 162 150 VAL C C 176.3 0.05 1 1147 162 150 VAL CA C 62.34 0.05 1 1148 162 150 VAL CB C 31.73 0.05 1 1149 162 150 VAL CG1 C 20.854 0.05 1 1150 162 150 VAL CG2 C 20.854 0.05 1 1151 162 150 VAL N N 121.922 0.1 1 1152 163 151 GLU H H 8.558 0.01 1 1153 163 151 GLU HA H 4.341 0.01 1 1154 163 151 GLU HB2 H 2.089 0.01 2 1155 163 151 GLU HB3 H 1.985 0.01 2 1156 163 151 GLU HG2 H 2.3 0.01 1 1157 163 151 GLU HG3 H 2.3 0.01 1 1158 163 151 GLU C C 176.88 0.05 1 1159 163 151 GLU CA C 56.55 0.05 1 1160 163 151 GLU CB C 29.01 0.05 1 1161 163 151 GLU N N 124.621 0.1 1 1162 164 152 SER H H 8.409 0.01 1 1163 164 152 SER HA H 4.442 0.01 1 1164 164 152 SER HB2 H 3.962 0.01 2 1165 164 152 SER HB3 H 3.885 0.01 2 1166 164 152 SER C C 175.14 0.05 1 1167 164 152 SER CA C 58.74 0.05 1 1168 164 152 SER CB C 63.02 0.05 1 1169 164 152 SER N N 117.36 0.1 1 1170 165 153 SER H H 8.378 0.01 1 1171 165 153 SER HA H 4.467 0.01 1 1172 165 153 SER HB2 H 3.972 0.01 2 1173 165 153 SER HB3 H 3.888 0.01 2 1174 165 153 SER C C 174.67 0.05 1 1175 165 153 SER CA C 58.59 0.05 1 1176 165 153 SER CB C 63.1 0.05 1 1177 165 153 SER N N 117.85 0.1 1 1178 166 154 ALA H H 8.214 0.01 1 1179 166 154 ALA HA H 4.369 0.01 1 1180 166 154 ALA HB H 1.431 0.01 1 1181 166 154 ALA C C 177.79 0.05 1 1182 166 154 ALA CA C 52.53 0.05 1 1183 166 154 ALA CB C 18.12 0.05 1 1184 166 154 ALA N N 125.651 0.1 1 1185 167 155 GLN H H 8.214 0.01 1 1186 167 155 GLN HB2 H 2.032 0.01 1 1187 167 155 GLN HB3 H 2.032 0.01 1 1188 167 155 GLN HG2 H 2.401 0.01 2 1189 167 155 GLN HG3 H 2.168 0.01 2 1190 167 155 GLN C C 176.67 0.05 1 1191 167 155 GLN CA C 55.82 0.05 1 1192 167 155 GLN CB C 28.44 0.05 1 1193 167 155 GLN N N 118.782 0.1 1 1194 168 156 GLY H H 8.301 0.01 1 1195 168 156 GLY HA2 H 4.071 0.01 1 1196 168 156 GLY HA3 H 4.071 0.01 1 1197 168 156 GLY C C 174.42 0.05 1 1198 168 156 GLY CA C 45.17 0.05 1 1199 168 156 GLY N N 109.706 0.1 1 1200 169 157 THR H H 8.121 0.01 1 1201 169 157 THR HA H 4.394 0.01 1 1202 169 157 THR HB H 4.306 0.01 1 1203 169 157 THR HG2 H 1.19 0.01 1 1204 169 157 THR C C 174.65 0.05 1 1205 169 157 THR CA C 61.57 0.05 1 1206 169 157 THR CB C 69.06 0.05 1 1207 169 157 THR N N 112.65 0.1 1 1208 170 158 ASP H H 8.168 0.01 1 1209 170 158 ASP HA H 4.723 0.01 1 1210 170 158 ASP HB2 H 2.568 0.01 1 1211 170 158 ASP HB3 H 2.568 0.01 1 1212 170 158 ASP C C 175.97 0.05 1 1213 170 158 ASP CA C 54.38 0.05 1 1214 170 158 ASP CB C 41.15 0.05 1 1215 170 158 ASP N N 123.345 0.1 1 1216 171 159 SER H H 8.522 0.01 1 1217 171 159 SER HA H 4.457 0.01 1 1218 171 159 SER HB2 H 4.345 0.01 2 1219 171 159 SER HB3 H 4.095 0.01 2 1220 171 159 SER C C 174.55 0.05 1 1221 171 159 SER CA C 57.45 0.05 1 1222 171 159 SER CB C 63.83 0.05 1 1223 171 159 SER N N 117.311 0.1 1 1224 172 160 GLU H H 8.918 0.01 1 1225 172 160 GLU HA H 4.027 0.01 1 1226 172 160 GLU HB2 H 2.074 0.01 1 1227 172 160 GLU HB3 H 2.074 0.01 1 1228 172 160 GLU HG2 H 2.36 0.01 1 1229 172 160 GLU HG3 H 2.36 0.01 1 1230 172 160 GLU C C 176.29 0.05 1 1231 172 160 GLU CA C 59.19 0.05 1 1232 172 160 GLU CB C 28.23 0.05 1 1233 172 160 GLU N N 122.903 0.1 1 1234 173 161 GLU H H 8.666 0.01 1 1235 173 161 GLU HA H 4.024 0.01 1 1236 173 161 GLU C C 178.98 0.05 1 1237 173 161 GLU CA C 59.59 0.05 1 1238 173 161 GLU CB C 28.18 0.05 1 1239 173 161 GLU N N 119.665 0.1 1 1240 174 162 LEU H H 7.946 0.01 1 1241 174 162 LEU HA H 4.221 0.01 1 1242 174 162 LEU HB2 H 1.932 0.01 1 1243 174 162 LEU HB3 H 1.932 0.01 1 1244 174 162 LEU HD1 H 1.578 0.01 2 1245 174 162 LEU HD2 H 1.488 0.01 2 1246 174 162 LEU C C 178.24 0.05 1 1247 174 162 LEU CA C 57.38 0.05 1 1248 174 162 LEU CB C 39.46 0.05 1 1249 174 162 LEU N N 122.266 0.1 1 1250 175 163 LYS H H 8.45 0.01 1 1251 175 163 LYS HA H 3.81 0.01 1 1252 175 163 LYS HB2 H 1.921 0.01 1 1253 175 163 LYS HB3 H 1.921 0.01 1 1254 175 163 LYS HG2 H 1.6 0.01 2 1255 175 163 LYS HG3 H 1.469 0.01 2 1256 175 163 LYS HD2 H 1.711 0.01 1 1257 175 163 LYS HD3 H 1.711 0.01 1 1258 175 163 LYS C C 178.91 0.05 1 1259 175 163 LYS CA C 60.62 0.05 1 1260 175 163 LYS CB C 30.91 0.05 1 1261 175 163 LYS N N 119.126 0.1 1 1262 176 164 THR H H 8.003 0.01 1 1263 176 164 THR HA H 3.87 0.01 1 1264 176 164 THR HB H 4.238 0.01 1 1265 176 164 THR HG2 H 1.251 0.01 1 1266 176 164 THR C C 176.52 0.05 1 1267 176 164 THR CA C 66.47 0.05 1 1268 176 164 THR CB C 68.23 0.05 1 1269 176 164 THR N N 114.023 0.1 1 1270 177 165 LEU H H 7.525 0.01 1 1271 177 165 LEU HA H 3.872 0.01 1 1272 177 165 LEU HB2 H 1.579 0.01 2 1273 177 165 LEU HB3 H 1.356 0.01 2 1274 177 165 LEU HD1 H 0.781 0.01 2 1275 177 165 LEU HD2 H 0.94 0.01 2 1276 177 165 LEU C C 177.61 0.05 1 1277 177 165 LEU CA C 57.45 0.05 1 1278 177 165 LEU CB C 40.59 0.05 1 1279 177 165 LEU N N 124.817 0.1 1 1280 178 166 LEU H H 8.728 0.01 1 1281 178 166 LEU HA H 3.877 0.01 1 1282 178 166 LEU HB2 H 1.34 0.01 2 1283 178 166 LEU HB3 H 1.276 0.01 2 1284 178 166 LEU HD1 H 0.877 0.01 2 1285 178 166 LEU HD2 H 0.929 0.01 2 1286 178 166 LEU C C 178.21 0.05 1 1287 178 166 LEU CA C 57.92 0.05 1 1288 178 166 LEU CB C 40.74 0.05 1 1289 178 166 LEU N N 117.556 0.1 1 1290 179 167 LEU H H 7.921 0.01 1 1291 179 167 LEU HA H 4.132 0.01 1 1292 179 167 LEU HB2 H 1.822 0.01 2 1293 179 167 LEU HB3 H 1.758 0.01 2 1294 179 167 LEU HG H 1.758 0.01 1 1295 179 167 LEU HD1 H 0.875 0.01 2 1296 179 167 LEU HD2 H 0.953 0.01 2 1297 179 167 LEU C C 179.43 0.05 1 1298 179 167 LEU CA C 57.95 0.05 1 1299 179 167 LEU CB C 40.46 0.05 1 1300 179 167 LEU N N 119.175 0.1 1 1301 180 168 LYS H H 7.545 0.01 1 1302 180 168 LYS HA H 4.212 0.01 1 1303 180 168 LYS HB2 H 2.164 0.01 1 1304 180 168 LYS HB3 H 2.164 0.01 1 1305 180 168 LYS HG2 H 1.587 0.01 1 1306 180 168 LYS HG3 H 1.587 0.01 1 1307 180 168 LYS HD2 H 1.936 0.01 1 1308 180 168 LYS HD3 H 1.936 0.01 1 1309 180 168 LYS C C 178.77 0.05 1 1310 180 168 LYS CA C 58.87 0.05 1 1311 180 168 LYS CB C 30.2 0.05 1 1312 180 168 LYS N N 122.462 0.1 1 1313 181 169 PHE H H 9.129 0.01 1 1314 181 169 PHE HA H 4.816 0.01 1 1315 181 169 PHE HB2 H 3.742 0.01 2 1316 181 169 PHE HB3 H 3.071 0.01 2 1317 181 169 PHE HD1 H 7.425 0.01 3 1318 181 169 PHE HE1 H 7.579 0.01 3 1319 181 169 PHE C C 178.66 0.05 1 1320 181 169 PHE CA C 56.62 0.05 1 1321 181 169 PHE CB C 36.69 0.05 1 1322 181 169 PHE N N 118.586 0.1 1 1323 182 170 SER H H 8.548 0.01 1 1324 182 170 SER HA H 4.216 0.01 1 1325 182 170 SER HB2 H 4.119 0.01 1 1326 182 170 SER HB3 H 4.119 0.01 1 1327 182 170 SER CA C 61.68 0.05 1 1328 182 170 SER CB C 62.25 0.05 1 1329 182 170 SER N N 113.484 0.1 1 1330 183 171 GLU H H 8.383 0.01 1 1331 183 171 GLU HA H 4.112 0.01 1 1332 183 171 GLU HB2 H 2.38 0.01 2 1333 183 171 GLU HB3 H 2.24 0.01 2 1334 183 171 GLU HG2 H 2.545 0.01 2 1335 183 171 GLU HG3 H 2.38 0.01 2 1336 183 171 GLU C C 179.83 0.05 1 1337 183 171 GLU CA C 59.2 0.05 1 1338 183 171 GLU CB C 28.62 0.05 1 1339 183 171 GLU N N 121.726 0.1 1 1340 184 172 ASP H H 9.103 0.01 1 1341 184 172 ASP HA H 4.576 0.01 1 1342 184 172 ASP HB2 H 3.165 0.01 2 1343 184 172 ASP HB3 H 2.639 0.01 2 1344 184 172 ASP C C 179.92 0.05 1 1345 184 172 ASP CA C 57.14 0.05 1 1346 184 172 ASP CB C 39.77 0.05 1 1347 184 172 ASP N N 122.56 0.1 1 1348 185 173 LEU H H 8.358 0.01 1 1349 185 173 LEU HA H 4.223 0.01 1 1350 185 173 LEU HB2 H 1.947 0.01 2 1351 185 173 LEU HB3 H 1.868 0.01 2 1352 185 173 LEU HD1 H 1.35 0.01 2 1353 185 173 LEU HD2 H 1.102 0.01 2 1354 185 173 LEU C C 179.11 0.05 1 1355 185 173 LEU CA C 58.02 0.05 1 1356 185 173 LEU CB C 40.64 0.05 1 1357 185 173 LEU CD2 C 24.937 0.05 1 1358 185 173 LEU N N 122.315 0.1 1 1359 186 174 LYS H H 8.101 0.01 1 1360 186 174 LYS HA H 4.078 0.01 1 1361 186 174 LYS HB2 H 1.977 0.01 1 1362 186 174 LYS HB3 H 1.977 0.01 1 1363 186 174 LYS HG2 H 1.673 0.01 2 1364 186 174 LYS HG3 H 1.503 0.01 2 1365 186 174 LYS HD2 H 1.872 0.01 1 1366 186 174 LYS HD3 H 1.872 0.01 1 1367 186 174 LYS CA C 59.31 0.05 1 1368 186 174 LYS CB C 31.25 0.05 1 1369 186 174 LYS N N 120.058 0.1 1 1370 187 175 ALA H H 8.26 0.01 1 1371 187 175 ALA HA H 4.17 0.01 1 1372 187 175 ALA HB H 1.582 0.01 1 1373 187 175 ALA C C 180.45 0.05 1 1374 187 175 ALA CA C 54.61 0.05 1 1375 187 175 ALA CB C 17.1 0.05 1 1376 187 175 ALA N N 120.647 0.1 1 1377 188 176 GLU H H 7.741 0.01 1 1378 188 176 GLU HA H 4.16 0.01 1 1379 188 176 GLU HB2 H 2.28 0.01 2 1380 188 176 GLU HB3 H 2.108 0.01 2 1381 188 176 GLU HG2 H 2.43 0.01 1 1382 188 176 GLU HG3 H 2.43 0.01 1 1383 188 176 GLU C C 178.29 0.05 1 1384 188 176 GLU CA C 58.13 0.05 1 1385 188 176 GLU CB C 27.86 0.05 1 1386 188 176 GLU N N 119.126 0.1 1 1387 189 177 GLN H H 7.952 0.01 1 1388 189 177 GLN HA H 4.053 0.01 1 1389 189 177 GLN HB2 H 2.3 0.01 1 1390 189 177 GLN HB3 H 2.3 0.01 1 1391 189 177 GLN HG2 H 2.73 0.01 2 1392 189 177 GLN HG3 H 2.578 0.01 2 1393 189 177 GLN HE21 H 7.555 0.01 2 1394 189 177 GLN HE22 H 6.856 0.01 2 1395 189 177 GLN C C 179.7 0.05 1 1396 189 177 GLN CA C 58.89 0.05 1 1397 189 177 GLN CB C 26.76 0.05 1 1398 189 177 GLN N N 117.605 0.1 1 1399 190 178 GLU H H 8.245 0.01 1 1400 190 178 GLU HA H 4.098 0.01 1 1401 190 178 GLU HB2 H 2.109 0.01 1 1402 190 178 GLU HB3 H 2.109 0.01 1 1403 190 178 GLU HG2 H 2.475 0.01 2 1404 190 178 GLU HG3 H 2.293 0.01 2 1405 190 178 GLU C C 178.52 0.05 1 1406 190 178 GLU CA C 58.44 0.05 1 1407 190 178 GLU CB C 28.44 0.05 1 1408 190 178 GLU N N 119.665 0.1 1 1409 191 179 LEU H H 7.751 0.01 1 1410 191 179 LEU HA H 4.059 0.01 1 1411 191 179 LEU HB2 H 1.626 0.01 2 1412 191 179 LEU HB3 H 1.395 0.01 2 1413 191 179 LEU HG H 1.494 0.01 1 1414 191 179 LEU HD1 H 0.82 0.01 2 1415 191 179 LEU HD2 H 0.82 0.01 2 1416 191 179 LEU C C 178.4 0.05 1 1417 191 179 LEU CA C 56.97 0.05 1 1418 191 179 LEU CB C 40.75 0.05 1 1419 191 179 LEU N N 119.813 0.1 1 1420 192 180 HIS H H 7.689 0.01 1 1421 192 180 HIS HA H 4.659 0.01 1 1422 192 180 HIS HB2 H 3.345 0.01 2 1423 192 180 HIS HB3 H 3.288 0.01 2 1424 192 180 HIS HD2 H 7.184 0.01 1 1425 192 180 HIS C C 175.19 0.05 1 1426 192 180 HIS CA C 55.86 0.05 1 1427 192 180 HIS CB C 28.28 0.05 1 1428 192 180 HIS N N 115.299 0.1 1 1429 193 181 SER H H 7.782 0.01 1 1430 193 181 SER HA H 4.319 0.01 1 1431 193 181 SER HB2 H 4.08 0.01 2 1432 193 181 SER HB3 H 3.987 0.01 2 1433 193 181 SER C C 175.82 0.05 1 1434 193 181 SER CA C 59.34 0.05 1 1435 193 181 SER CB C 63.49 0.05 1 1436 193 181 SER N N 114.171 0.1 1 1437 194 182 GLU H H 8.548 0.01 1 1438 194 182 GLU HA H 4.121 0.01 1 1439 194 182 GLU HB2 H 2.1 0.01 1 1440 194 182 GLU HB3 H 2.1 0.01 1 1441 194 182 GLU HG2 H 2.33 0.01 2 1442 194 182 GLU HG3 H 2.294 0.01 2 1443 194 182 GLU C C 177.72 0.05 1 1444 194 182 GLU CA C 57.9 0.05 1 1445 194 182 GLU CB C 28.58 0.05 1 1446 194 182 GLU N N 122.168 0.1 1 1447 195 183 ALA H H 8.085 0.01 1 1448 195 183 ALA HA H 4.241 0.01 1 1449 195 183 ALA HB H 1.453 0.01 1 1450 195 183 ALA C C 178.51 0.05 1 1451 195 183 ALA CA C 53.29 0.05 1 1452 195 183 ALA CB C 17.91 0.05 1 1453 195 183 ALA N N 122.217 0.1 1 1454 196 184 LYS H H 7.859 0.01 1 1455 196 184 LYS HA H 4.371 0.01 1 1456 196 184 LYS HB2 H 1.961 0.01 2 1457 196 184 LYS HB3 H 1.743 0.01 2 1458 196 184 LYS HG2 H 1.344 0.01 1 1459 196 184 LYS HG3 H 1.344 0.01 1 1460 196 184 LYS HD2 H 1.64 0.01 1 1461 196 184 LYS HD3 H 1.64 0.01 1 1462 196 184 LYS CA C 55.79 0.05 1 1463 196 184 LYS CB C 31.28 0.05 1 1464 196 184 LYS N N 117.654 0.1 1 1465 197 185 GLY H H 8.096 0.01 1 1466 197 185 GLY HA2 H 4.192 0.01 2 1467 197 185 GLY HA3 H 3.958 0.01 2 1468 197 185 GLY C C 175.63 0.05 1 1469 197 185 GLY CA C 45.46 0.05 1 1470 197 185 GLY N N 108.136 0.1 1 1471 198 186 GLY H H 8.363 0.01 1 1472 198 186 GLY HA2 H 3.956 0.01 2 1473 198 186 GLY HA3 H 3.897 0.01 2 1474 198 186 GLY C C 175.02 0.05 1 1475 198 186 GLY CA C 45.96 0.05 1 1476 198 186 GLY N N 109.363 0.1 1 1477 199 187 GLU H H 8.671 0.01 1 1478 199 187 GLU HA H 4.1 0.01 1 1479 199 187 GLU HB2 H 2.088 0.01 1 1480 199 187 GLU HB3 H 2.088 0.01 1 1481 199 187 GLU HG2 H 2.356 0.01 2 1482 199 187 GLU HG3 H 2.298 0.01 2 1483 199 187 GLU C C 177.94 0.05 1 1484 199 187 GLU CA C 58.55 0.05 1 1485 199 187 GLU CB C 28.44 0.05 1 1486 199 187 GLU N N 122.511 0.1 1 1487 200 188 ALA H H 8.24 0.01 1 1488 200 188 ALA HA H 4.241 0.01 1 1489 200 188 ALA HB H 1.463 0.01 1 1490 200 188 ALA C C 179.87 0.05 1 1491 200 188 ALA CA C 54.01 0.05 1 1492 200 188 ALA CB C 17.26 0.05 1 1493 200 188 ALA N N 122.756 0.1 1 1494 201 189 LEU H H 7.813 0.01 1 1495 201 189 LEU HA H 4.218 0.01 1 1496 201 189 LEU HB2 H 1.737 0.01 2 1497 201 189 LEU HB3 H 1.673 0.01 2 1498 201 189 LEU HG H 1.606 0.01 1 1499 201 189 LEU HD1 H 0.897 0.01 2 1500 201 189 LEU HD2 H 0.897 0.01 2 1501 201 189 LEU C C 178.87 0.05 1 1502 201 189 LEU CA C 57.13 0.05 1 1503 201 189 LEU CB C 40.57 0.05 1 1504 201 189 LEU N N 120.99 0.1 1 1505 202 190 LEU H H 7.967 0.01 1 1506 202 190 LEU HA H 4.101 0.01 1 1507 202 190 LEU HB2 H 1.794 0.01 2 1508 202 190 LEU HB3 H 1.722 0.01 2 1509 202 190 LEU HG H 1.601 0.01 1 1510 202 190 LEU HD1 H 0.89 0.01 2 1511 202 190 LEU HD2 H 0.89 0.01 2 1512 202 190 LEU C C 180.12 0.05 1 1513 202 190 LEU CA C 57.51 0.05 1 1514 202 190 LEU CB C 39.94 0.05 1 1515 202 190 LEU N N 119.371 0.1 1 1516 203 191 SER H H 8.245 0.01 1 1517 203 191 SER HA H 4.284 0.01 1 1518 203 191 SER HB2 H 4.012 0.01 1 1519 203 191 SER HB3 H 4.012 0.01 1 1520 203 191 SER C C 177.05 0.05 1 1521 203 191 SER CA C 61.06 0.05 1 1522 203 191 SER CB C 62.46 0.05 1 1523 203 191 SER N N 115.054 0.1 1 1524 204 192 SER H H 8.096 0.01 1 1525 204 192 SER HA H 4.355 0.01 1 1526 204 192 SER HB2 H 4.082 0.01 1 1527 204 192 SER HB3 H 4.082 0.01 1 1528 204 192 SER C C 176.96 0.05 1 1529 204 192 SER CA C 61.21 0.05 1 1530 204 192 SER CB C 62.14 0.05 1 1531 204 192 SER N N 118.586 0.1 1 1532 205 193 MET H H 8.245 0.01 1 1533 205 193 MET HA H 4.297 0.01 1 1534 205 193 MET HB2 H 2.167 0.01 1 1535 205 193 MET HB3 H 2.167 0.01 1 1536 205 193 MET HG2 H 2.706 0.01 2 1537 205 193 MET HG3 H 2.463 0.01 2 1538 205 193 MET HE H 1.967 0.01 1 1539 205 193 MET C C 177.93 0.05 1 1540 205 193 MET CA C 58.49 0.05 1 1541 205 193 MET CB C 32.08 0.05 1 1542 205 193 MET N N 121.971 0.1 1 1543 206 194 LYS H H 7.859 0.01 1 1544 206 194 LYS HA H 4.115 0.01 1 1545 206 194 LYS HB2 H 2.017 0.01 1 1546 206 194 LYS HB3 H 2.017 0.01 1 1547 206 194 LYS HG2 H 1.486 0.01 1 1548 206 194 LYS HG3 H 1.486 0.01 1 1549 206 194 LYS HD2 H 1.55 0.01 1 1550 206 194 LYS HD3 H 1.55 0.01 1 1551 206 194 LYS C C 175.33 0.05 1 1552 206 194 LYS CA C 59.38 0.05 1 1553 206 194 LYS CB C 54.73 0.05 1 1554 206 194 LYS N N 121.137 0.1 1 1555 207 195 THR H H 8.157 0.01 1 1556 207 195 THR HA H 4.322 0.01 1 1557 207 195 THR HB H 4.089 0.01 1 1558 207 195 THR HG2 H 1.324 0.01 1 1559 207 195 THR C C 176.51 0.05 1 1560 207 195 THR CA C 66.43 0.05 1 1561 207 195 THR CB C 68.05 0.05 1 1562 207 195 THR N N 116.231 0.1 1 1563 208 196 GLN H H 8.234 0.01 1 1564 208 196 GLN HA H 4.193 0.01 1 1565 208 196 GLN HB2 H 2.251 0.01 2 1566 208 196 GLN HB3 H 2.186 0.01 2 1567 208 196 GLN HG2 H 2.563 0.01 2 1568 208 196 GLN HG3 H 2.443 0.01 2 1569 208 196 GLN HE21 H 7.747 0.01 2 1570 208 196 GLN HE22 H 6.982 0.01 2 1571 208 196 GLN C C 178.58 0.05 1 1572 208 196 GLN CA C 59.0 0.05 1 1573 208 196 GLN CB C 27.62 0.05 1 1574 208 196 GLN N N 121.432 0.1 1 1575 209 197 HIS H H 8.502 0.01 1 1576 209 197 HIS HA H 4.009 0.01 1 1577 209 197 HIS HB2 H 3.609 0.01 2 1578 209 197 HIS HB3 H 3.239 0.01 2 1579 209 197 HIS HD2 H 6.845 0.01 1 1580 209 197 HIS HE2 H 7.916 0.01 1 1581 209 197 HIS C C 176.28 0.05 1 1582 209 197 HIS CA C 59.05 0.05 1 1583 209 197 HIS CB C 28.88 0.05 1 1584 209 197 HIS N N 120.549 0.1 1 1585 210 198 ASP H H 8.558 0.01 1 1586 210 198 ASP HA H 4.342 0.01 1 1587 210 198 ASP HB2 H 2.959 0.01 2 1588 210 198 ASP HB3 H 2.717 0.01 2 1589 210 198 ASP C C 179.62 0.05 1 1590 210 198 ASP CA C 57.52 0.05 1 1591 210 198 ASP CB C 39.18 0.05 1 1592 210 198 ASP N N 119.715 0.1 1 1593 211 199 GLU H H 8.543 0.01 1 1594 211 199 GLU HA H 4.113 0.01 1 1595 211 199 GLU HB2 H 2.208 0.01 2 1596 211 199 GLU HB3 H 2.082 0.01 2 1597 211 199 GLU HG2 H 2.422 0.01 1 1598 211 199 GLU HG3 H 2.422 0.01 1 1599 211 199 GLU CA C 58.84 0.05 1 1600 211 199 GLU CB C 28.85 0.05 1 1601 211 199 GLU N N 120.058 0.1 1 1602 212 200 LEU H H 8.445 0.01 1 1603 212 200 LEU HA H 4.187 0.01 1 1604 212 200 LEU HB2 H 2.054 0.01 2 1605 212 200 LEU HB3 H 1.75 0.01 2 1606 212 200 LEU HG H 1.95 0.01 1 1607 212 200 LEU HD1 H 1.057 0.01 2 1608 212 200 LEU HD2 H 1.057 0.01 2 1609 212 200 LEU C C 179.6 0.05 1 1610 212 200 LEU CB C 40.74 0.05 1 1611 212 200 LEU CD1 C 25.716 0.05 1 1612 212 200 LEU CD2 C 25.716 0.05 1 1613 212 200 LEU N N 122.168 0.1 1 1614 213 201 LEU H H 8.219 0.01 1 1615 213 201 LEU HA H 4.099 0.01 1 1616 213 201 LEU HB2 H 2.039 0.01 2 1617 213 201 LEU HB3 H 1.81 0.01 2 1618 213 201 LEU HG H 1.519 0.01 1 1619 213 201 LEU HD1 H 0.844 0.01 2 1620 213 201 LEU HD2 H 0.91 0.01 2 1621 213 201 LEU C C 180.74 0.05 1 1622 213 201 LEU CA C 58.6 0.05 1 1623 213 201 LEU CB C 40.39 0.05 1 1624 213 201 LEU N N 119.224 0.1 1 1625 214 202 LYS H H 7.443 0.01 1 1626 214 202 LYS HA H 4.069 0.01 1 1627 214 202 LYS HB2 H 2.038 0.01 2 1628 214 202 LYS HB3 H 1.961 0.01 2 1629 214 202 LYS HG2 H 1.527 0.01 2 1630 214 202 LYS HG3 H 1.445 0.01 2 1631 214 202 LYS HD2 H 1.695 0.01 1 1632 214 202 LYS HD3 H 1.695 0.01 1 1633 214 202 LYS C C 179.68 0.05 1 1634 214 202 LYS CA C 59.43 0.05 1 1635 214 202 LYS CB C 31.12 0.05 1 1636 214 202 LYS N N 119.028 0.1 1 1637 215 203 LYS H H 8.296 0.01 1 1638 215 203 LYS HA H 4.052 0.01 1 1639 215 203 LYS HB2 H 1.946 0.01 2 1640 215 203 LYS HB3 H 1.856 0.01 2 1641 215 203 LYS HG2 H 1.587 0.01 2 1642 215 203 LYS HG3 H 1.451 0.01 2 1643 215 203 LYS HD2 H 1.767 0.01 1 1644 215 203 LYS HD3 H 1.767 0.01 1 1645 215 203 LYS C C 180.69 0.05 1 1646 215 203 LYS CA C 59.94 0.05 1 1647 215 203 LYS CB C 31.93 0.05 1 1648 215 203 LYS N N 120.107 0.1 1 1649 216 204 PHE H H 8.605 0.01 1 1650 216 204 PHE HA H 4.222 0.01 1 1651 216 204 PHE HB2 H 3.172 0.01 2 1652 216 204 PHE HB3 H 2.997 0.01 2 1653 216 204 PHE HD1 H 7.659 0.01 3 1654 216 204 PHE HE1 H 7.166 0.01 3 1655 216 204 PHE HZ H 6.89 0.01 1 1656 216 204 PHE C C 179.41 0.05 1 1657 216 204 PHE CA C 62.49 0.05 1 1658 216 204 PHE CB C 37.87 0.05 1 1659 216 204 PHE N N 117.36 0.1 1 1660 217 205 ALA H H 7.946 0.01 1 1661 217 205 ALA HA H 4.41 0.01 1 1662 217 205 ALA HB H 1.575 0.01 1 1663 217 205 ALA C C 177.95 0.05 1 1664 217 205 ALA CA C 54.01 0.05 1 1665 217 205 ALA CB C 16.92 0.05 1 1666 217 205 ALA N N 122.266 0.1 1 1667 218 206 ALA H H 7.134 0.01 1 1668 218 206 ALA HA H 4.357 0.01 1 1669 218 206 ALA HB H 1.484 0.01 1 1670 218 206 ALA C C 177.76 0.05 1 1671 218 206 ALA CA C 51.81 0.05 1 1672 218 206 ALA CB C 18.08 0.05 1 1673 218 206 ALA N N 118.096 0.1 1 1674 219 207 LEU H H 7.175 0.01 1 1675 219 207 LEU HA H 4.239 0.01 1 1676 219 207 LEU HB2 H 1.911 0.01 2 1677 219 207 LEU HB3 H 1.852 0.01 2 1678 219 207 LEU HG H 1.653 0.01 1 1679 219 207 LEU HD1 H 1.025 0.01 2 1680 219 207 LEU HD2 H 0.837 0.01 2 1681 219 207 LEU C C 175.33 0.05 1 1682 219 207 LEU CA C 55.32 0.05 1 1683 219 207 LEU CB C 41.66 0.05 1 1684 219 207 LEU N N 119.813 0.1 1 1685 220 208 THR H H 8.142 0.01 1 1686 220 208 THR HA H 4.532 0.01 1 1687 220 208 THR HB H 4.03 0.01 1 1688 220 208 THR HG2 H 1.193 0.01 1 1689 220 208 THR CA C 58.19 0.05 1 1690 220 208 THR CB C 70.68 0.05 1 1691 220 208 THR N N 116.231 0.1 1 1692 221 209 PRO HA H 4.897 0.01 1 1693 221 209 PRO HB2 H 2.484 0.01 2 1694 221 209 PRO HB3 H 2.159 0.01 2 1695 221 209 PRO HG2 H 1.993 0.01 2 1696 221 209 PRO HG3 H 1.84 0.01 2 1697 221 209 PRO C C 175.74 0.05 1 1698 221 209 PRO CA C 62.91 0.05 1 1699 221 209 PRO CB C 33.53 0.05 1 1700 222 210 THR H H 8.394 0.01 1 1701 222 210 THR HA H 4.039 0.01 1 1702 222 210 THR HB H 3.954 0.01 1 1703 222 210 THR HG2 H 1.178 0.01 1 1704 222 210 THR C C 174.21 0.05 1 1705 222 210 THR CA C 64.24 0.05 1 1706 222 210 THR CB C 69.02 0.05 1 1707 222 210 THR N N 115.79 0.1 1 1708 223 211 PHE H H 8.97 0.01 1 1709 223 211 PHE HA H 5.101 0.01 1 1710 223 211 PHE HB2 H 3.593 0.01 2 1711 223 211 PHE HB3 H 2.98 0.01 2 1712 223 211 PHE HD1 H 7.346 0.01 3 1713 223 211 PHE HE1 H 7.172 0.01 3 1714 223 211 PHE HZ H 7.031 0.01 1 1715 223 211 PHE C C 173.16 0.05 1 1716 223 211 PHE CA C 56.89 0.05 1 1717 223 211 PHE CB C 39.49 0.05 1 1718 223 211 PHE N N 127.27 0.1 1 1719 224 212 LEU H H 6.492 0.01 1 1720 224 212 LEU HA H 4.641 0.01 1 1721 224 212 LEU HB2 H 1.168 0.01 2 1722 224 212 LEU HB3 H 1.014 0.01 2 1723 224 212 LEU HG H 0.567 0.01 1 1724 224 212 LEU HD1 H 0.104 0.01 2 1725 224 212 LEU HD2 H 0.302 0.01 2 1726 224 212 LEU C C 177.1 0.05 1 1727 224 212 LEU CA C 52.7 0.05 1 1728 224 212 LEU CB C 42.98 0.05 1 1729 224 212 LEU CD1 C 25.609 0.05 1 1730 224 212 LEU CD2 C 22.902 0.05 1 1731 224 212 LEU N N 116.673 0.1 1 1732 225 213 THR H H 9.545 0.01 1 1733 225 213 THR HA H 4.728 0.01 1 1734 225 213 THR HB H 4.432 0.01 1 1735 225 213 THR HG2 H 1.309 0.01 1 1736 225 213 THR C C 175.37 0.05 1 1737 225 213 THR CA C 60.59 0.05 1 1738 225 213 THR CB C 71.03 0.05 1 1739 225 213 THR N N 115.446 0.1 1 1740 226 214 SER H H 8.97 0.01 1 1741 226 214 SER HA H 4.098 0.01 1 1742 226 214 SER HB2 H 3.955 0.01 1 1743 226 214 SER HB3 H 3.955 0.01 1 1744 226 214 SER C C 176.51 0.05 1 1745 226 214 SER CA C 61.76 0.05 1 1746 226 214 SER CB C 63.4 0.05 1 1747 226 214 SER N N 116.378 0.1 1 1748 227 215 GLU H H 8.204 0.01 1 1749 227 215 GLU HA H 4.014 0.01 1 1750 227 215 GLU HB2 H 1.997 0.01 2 1751 227 215 GLU HB3 H 1.889 0.01 2 1752 227 215 GLU HG2 H 2.26 0.01 1 1753 227 215 GLU HG3 H 2.26 0.01 1 1754 227 215 GLU C C 179.54 0.05 1 1755 227 215 GLU CA C 59.2 0.05 1 1756 227 215 GLU CB C 28.17 0.05 1 1757 227 215 GLU N N 121.383 0.1 1 1758 228 216 ASP H H 7.756 0.01 1 1759 228 216 ASP HA H 4.321 0.01 1 1760 228 216 ASP HB2 H 2.88 0.01 2 1761 228 216 ASP HB3 H 2.39 0.01 2 1762 228 216 ASP C C 178.03 0.05 1 1763 228 216 ASP CA C 57.06 0.05 1 1764 228 216 ASP CB C 40.82 0.05 1 1765 228 216 ASP N N 122.217 0.1 1 1766 229 217 ILE H H 7.957 0.01 1 1767 229 217 ILE HA H 3.298 0.01 1 1768 229 217 ILE HB H 1.759 0.01 1 1769 229 217 ILE HG12 H 0.337 0.01 1 1770 229 217 ILE HG13 H 1.25 0.01 1 1771 229 217 ILE HG2 H 0.686 0.01 1 1772 229 217 ILE HD1 H 0.235 0.01 1 1773 229 217 ILE C C 177.46 0.05 1 1774 229 217 ILE CA C 65.4 0.05 1 1775 229 217 ILE CB C 36.39 0.05 1 1776 229 217 ILE CG2 C 17.682 0.05 1 1777 229 217 ILE CD1 C 14.603 0.05 1 1778 229 217 ILE N N 120.99 0.1 1 1779 230 218 SER H H 8.281 0.01 1 1780 230 218 SER HA H 4.171 0.01 1 1781 230 218 SER HB2 H 3.985 0.01 2 1782 230 218 SER HB3 H 3.941 0.01 2 1783 230 218 SER C C 176.9 0.05 1 1784 230 218 SER CA C 61.68 0.05 1 1785 230 218 SER N N 113.876 0.1 1 1786 231 219 GLY H H 8.162 0.01 1 1787 231 219 GLY HA2 H 3.838 0.01 2 1788 231 219 GLY HA3 H 3.757 0.01 2 1789 231 219 GLY CA C 46.88 0.05 1 1790 231 219 GLY N N 109.412 0.1 1 1791 232 220 TYR H H 8.461 0.01 1 1792 232 220 TYR HA H 4.444 0.01 1 1793 232 220 TYR HB2 H 3.163 0.01 2 1794 232 220 TYR HB3 H 3.007 0.01 2 1795 232 220 TYR HD1 H 7.024 0.01 3 1796 232 220 TYR HE1 H 6.726 0.01 3 1797 232 220 TYR C C 175.96 0.05 1 1798 232 220 TYR CA C 61.66 0.05 1 1799 232 220 TYR CB C 37.85 0.05 1 1800 232 220 TYR N N 122.217 0.1 1 1801 233 221 LEU H H 7.715 0.01 1 1802 233 221 LEU HA H 3.978 0.01 1 1803 233 221 LEU HB2 H 1.9 0.01 2 1804 233 221 LEU HB3 H 1.658 0.01 2 1805 233 221 LEU HG H 1.601 0.01 1 1806 233 221 LEU HD1 H 0.559 0.01 2 1807 233 221 LEU HD2 H 0.806 0.01 2 1808 233 221 LEU C C 175.53 0.05 1 1809 233 221 LEU CA C 53.32 0.05 1 1810 233 221 LEU CB C 39.04 0.05 1 1811 233 221 LEU CD1 C 26.12 0.05 1 1812 233 221 LEU CD2 C 26.904 0.05 1 1813 233 221 LEU N N 114.71 0.1 1 1814 234 222 THR H H 7.381 0.01 1 1815 234 222 THR HA H 4.377 0.01 1 1816 234 222 THR HB H 4.172 0.01 1 1817 234 222 THR HG2 H 1.188 0.01 1 1818 234 222 THR CA C 62.48 0.05 1 1819 234 222 THR N N 116.673 0.1 1 1820 235 223 VAL H H 8.173 0.01 1 1821 235 223 VAL HA H 4.173 0.01 1 1822 235 223 VAL HB H 1.845 0.01 1 1823 235 223 VAL HG1 H 0.548 0.01 2 1824 235 223 VAL HG2 H 0.548 0.01 2 1825 235 223 VAL N N 124.277 0.1 1 1826 236 224 PRO C C 181.89 0.05 1 1827 237 225 GLU C C 176.63 0.05 1 1828 237 225 GLU CA C 55.08 0.05 1 1829 237 225 GLU CB C 28.76 0.05 1 1830 238 226 TYR H H 7.777 0.01 1 1831 238 226 TYR HA H 4.366 0.01 1 1832 238 226 TYR HB2 H 2.861 0.01 2 1833 238 226 TYR HB3 H 2.504 0.01 2 1834 238 226 TYR HD1 H 6.886 0.01 3 1835 238 226 TYR HE1 H 6.444 0.01 3 1836 238 226 TYR C C 176.4 0.05 1 1837 238 226 TYR CA C 59.92 0.05 1 1838 238 226 TYR CB C 37.93 0.05 1 1839 238 226 TYR N N 123.836 0.1 1 1840 239 227 GLY H H 8.733 0.01 1 1841 239 227 GLY HA2 H 3.352 0.01 2 1842 239 227 GLY HA3 H 4.222 0.01 2 1843 239 227 GLY C C 171.66 0.05 1 1844 239 227 GLY CA C 44.17 0.05 1 1845 239 227 GLY N N 111.816 0.1 1 1846 240 228 ALA H H 7.324 0.01 1 1847 240 228 ALA HA H 3.274 0.01 1 1848 240 228 ALA HB H 1.084 0.01 1 1849 240 228 ALA C C 181.89 0.05 1 1850 240 228 ALA CA C 49.48 0.05 1 1851 240 228 ALA CB C 17.32 0.05 1 1852 240 228 ALA N N 121.628 0.1 1 1853 241 229 PRO HB2 H 2.196 0.01 2 1854 241 229 PRO HB3 H 1.969 0.01 2 1855 241 229 PRO HG2 H 2.079 0.01 2 1856 241 229 PRO HG3 H 2.061 0.01 2 1857 241 229 PRO HD2 H 3.525 0.01 2 1858 241 229 PRO HD3 H 3.446 0.01 2 1859 241 229 PRO C C 176.77 0.05 1 1860 241 229 PRO CA C 63.24 0.05 1 1861 241 229 PRO CB C 29.89 0.05 1 1862 242 230 MET H H 8.168 0.01 1 1863 242 230 MET CA C 55.2 0.05 1 1864 242 230 MET N N 120.058 0.1 1 1865 243 231 ASN HA H 4.706 0.01 1 1866 243 231 ASN HB2 H 2.862 0.01 2 1867 243 231 ASN HB3 H 2.775 0.01 2 1868 243 231 ASN C C 175.04 0.05 1 1869 243 231 ASN CA C 52.97 0.05 1 1870 243 231 ASN CB C 37.96 0.05 1 1871 244 232 ALA H H 8.409 0.01 1 1872 244 232 ALA HB H 1.386 0.01 1 1873 244 232 ALA C C 176.9 0.05 1 1874 244 232 ALA CA C 52.3 0.05 1 1875 244 232 ALA N N 126.19 0.1 1 1876 245 233 ALA H H 8.126 0.01 1 1877 245 233 ALA HB H 1.288 0.01 1 1878 245 233 ALA C C 178.79 0.05 1 1879 245 233 ALA CA C 52.83 0.05 1 1880 245 233 ALA CB C 17.16 0.05 1 1881 245 233 ALA N N 121.432 0.1 1 1882 246 234 LYS H H 7.972 0.01 1 1883 246 234 LYS HA H 4.007 0.01 1 1884 246 234 LYS HB2 H 1.884 0.01 1 1885 246 234 LYS HB3 H 1.884 0.01 1 1886 246 234 LYS HG2 H 1.593 0.01 2 1887 246 234 LYS HG3 H 1.5 0.01 2 1888 246 234 LYS HD2 H 1.739 0.01 1 1889 246 234 LYS HD3 H 1.739 0.01 1 1890 246 234 LYS N N 119.862 0.1 1 1891 247 235 TRP HD1 H 7.407 0.01 1 1892 247 235 TRP HE3 H 7.333 0.01 1 1893 247 235 TRP HZ2 H 7.556 0.01 1 1894 247 235 TRP HZ3 H 7.11 0.01 1 1895 247 235 TRP HH2 H 7.18 0.01 1 1896 248 236 LYS H H 6.882 0.01 1 1897 248 236 LYS C C 180.09 0.05 1 1898 248 236 LYS N N 122.609 0.1 1 1899 249 237 LYS H H 7.767 0.01 1 1900 249 237 LYS HA H 4.047 0.01 1 1901 249 237 LYS HB2 H 1.975 0.01 2 1902 249 237 LYS HB3 H 1.866 0.01 2 1903 249 237 LYS HG2 H 1.274 0.01 1 1904 249 237 LYS HG3 H 1.274 0.01 1 1905 249 237 LYS HD2 H 1.481 0.01 1 1906 249 237 LYS HD3 H 1.481 0.01 1 1907 249 237 LYS C C 179.64 0.05 1 1908 249 237 LYS CA C 58.75 0.05 1 1909 249 237 LYS CB C 30.94 0.05 1 1910 249 237 LYS N N 120.794 0.1 1 1911 250 238 VAL H H 7.222 0.01 1 1912 250 238 VAL HA H 3.813 0.01 1 1913 250 238 VAL HB H 2.255 0.01 1 1914 250 238 VAL HG1 H 1.274 0.01 2 1915 250 238 VAL HG2 H 0.903 0.01 2 1916 250 238 VAL C C 177.9 0.05 1 1917 250 238 VAL CA C 65.43 0.05 1 1918 250 238 VAL CB C 30.76 0.05 1 1919 250 238 VAL CG1 C 21.552 0.05 1 1920 250 238 VAL N N 119.96 0.1 1 1921 251 239 GLU H H 8.743 0.01 1 1922 251 239 GLU HA H 3.842 0.01 1 1923 251 239 GLU HB2 H 2.393 0.01 2 1924 251 239 GLU HB3 H 2.253 0.01 2 1925 251 239 GLU HG2 H 2.429 0.01 1 1926 251 239 GLU HG3 H 2.429 0.01 1 1927 251 239 GLU C C 178.6 0.05 1 1928 251 239 GLU CA C 60.31 0.05 1 1929 251 239 GLU CB C 29.4 0.05 1 1930 251 239 GLU N N 122.756 0.1 1 1931 252 240 GLY H H 7.977 0.01 1 1932 252 240 GLY HA2 H 3.992 0.01 2 1933 252 240 GLY HA3 H 3.809 0.01 2 1934 252 240 GLY C C 176.85 0.05 1 1935 252 240 GLY CA C 46.89 0.05 1 1936 252 240 GLY N N 104.064 0.1 1 1937 253 241 MET H H 7.767 0.01 1 1938 253 241 MET HA H 4.242 0.01 1 1939 253 241 MET HB2 H 2.344 0.01 2 1940 253 241 MET HB3 H 2.156 0.01 2 1941 253 241 MET HG2 H 2.733 0.01 2 1942 253 241 MET HG3 H 2.526 0.01 2 1943 253 241 MET HE H 1.988 0.01 1 1944 253 241 MET C C 179.67 0.05 1 1945 253 241 MET CA C 58.77 0.05 1 1946 253 241 MET CB C 32.29 0.05 1 1947 253 241 MET N N 123.639 0.1 1 1948 254 242 ILE H H 8.548 0.01 1 1949 254 242 ILE HA H 3.582 0.01 1 1950 254 242 ILE HB H 2.032 0.01 1 1951 254 242 ILE HG12 H 1.867 0.01 1 1952 254 242 ILE HG13 H 0.662 0.01 1 1953 254 242 ILE HG2 H 0.947 0.01 1 1954 254 242 ILE HD1 H 0.305 0.01 1 1955 254 242 ILE C C 176.88 0.05 1 1956 254 242 ILE CA C 66.34 0.05 1 1957 254 242 ILE CB C 36.92 0.05 1 1958 254 242 ILE CG2 C 19.099 0.05 1 1959 254 242 ILE CD1 C 13.226 0.05 1 1960 254 242 ILE N N 120.892 0.1 1 1961 255 243 HIS H H 8.538 0.01 1 1962 255 243 HIS HA H 4.017 0.01 1 1963 255 243 HIS HB2 H 3.231 0.01 2 1964 255 243 HIS HB3 H 3.061 0.01 2 1965 255 243 HIS HD2 H 6.985 0.01 1 1966 255 243 HIS HE2 H 7.676 0.01 1 1967 255 243 HIS C C 177.06 0.05 1 1968 255 243 HIS CA C 60.16 0.05 1 1969 255 243 HIS CB C 29.94 0.05 1 1970 255 243 HIS N N 119.028 0.1 1 1971 256 244 GLY H H 8.219 0.01 1 1972 256 244 GLY HA2 H 3.916 0.01 2 1973 256 244 GLY HA3 H 3.717 0.01 2 1974 256 244 GLY C C 176.77 0.05 1 1975 256 244 GLY CA C 46.66 0.05 1 1976 256 244 GLY N N 103.083 0.1 1 1977 257 245 LYS H H 7.808 0.01 1 1978 257 245 LYS HA H 4.117 0.01 1 1979 257 245 LYS HB2 H 1.861 0.01 1 1980 257 245 LYS HB3 H 1.861 0.01 1 1981 257 245 LYS HD2 H 1.364 0.01 2 1982 257 245 LYS HD3 H 1.126 0.01 2 1983 257 245 LYS C C 179.31 0.05 1 1984 257 245 LYS CA C 57.58 0.05 1 1985 257 245 LYS CB C 31.25 0.05 1 1986 257 245 LYS N N 121.824 0.1 1 1987 258 246 LEU H H 8.142 0.01 1 1988 258 246 LEU HA H 4.105 0.01 1 1989 258 246 LEU HB2 H 1.998 0.01 2 1990 258 246 LEU HB3 H 1.863 0.01 2 1991 258 246 LEU HG H 1.57 0.01 1 1992 258 246 LEU HD1 H 0.808 0.01 2 1993 258 246 LEU HD2 H 0.933 0.01 2 1994 258 246 LEU C C 178.48 0.05 1 1995 258 246 LEU CA C 56.59 0.05 1 1996 258 246 LEU CB C 40.18 0.05 1 1997 258 246 LEU CD1 C 22.11 0.05 1 1998 258 246 LEU N N 116.869 0.1 1 1999 259 247 GLU H H 7.545 0.01 1 2000 259 247 GLU HA H 4.201 0.01 1 2001 259 247 GLU HB2 H 1.897 0.01 2 2002 259 247 GLU HB3 H 1.748 0.01 2 2003 259 247 GLU HG2 H 2.048 0.01 2 2004 259 247 GLU HG3 H 1.997 0.01 2 2005 259 247 GLU C C 177.23 0.05 1 2006 259 247 GLU CA C 56.44 0.05 1 2007 259 247 GLU CB C 28.82 0.05 1 2008 259 247 GLU N N 116.084 0.1 1 2009 260 248 SER H H 7.458 0.01 1 2010 260 248 SER HA H 4.522 0.01 1 2011 260 248 SER HB2 H 4.055 0.01 2 2012 260 248 SER HB3 H 3.965 0.01 2 2013 260 248 SER C C 174.13 0.05 1 2014 260 248 SER CA C 58.49 0.05 1 2015 260 248 SER CB C 63.57 0.05 1 2016 260 248 SER N N 113.729 0.1 1 2017 261 249 SER H H 8.178 0.01 1 2018 261 249 SER C C 173.9 0.05 1 2019 261 249 SER CA C 58.55 0.05 1 2020 261 249 SER CB C 63.5 0.05 1 2021 261 249 SER N N 116.329 0.1 1 2022 262 250 GLU H H 8.209 0.01 1 2023 262 250 GLU HA H 4.412 0.01 1 2024 262 250 GLU HB2 H 2.033 0.01 2 2025 262 250 GLU HB3 H 1.889 0.01 2 2026 262 250 GLU HG2 H 2.173 0.01 1 2027 262 250 GLU HG3 H 2.173 0.01 1 2028 262 250 GLU C C 175.51 0.05 1 2029 262 250 GLU CA C 55.49 0.05 1 2030 262 250 GLU CB C 28.45 0.05 1 2031 262 250 GLU N N 120.45 0.1 1 2032 263 251 VAL H H 7.993 0.01 1 2033 263 251 VAL HA H 4.353 0.01 1 2034 263 251 VAL HB H 1.988 0.01 1 2035 263 251 VAL HG1 H 0.929 0.01 2 2036 263 251 VAL HG2 H 0.888 0.01 2 2037 263 251 VAL CA C 59.49 0.05 1 2038 263 251 VAL CB C 31.94 0.05 1 2039 263 251 VAL N N 124.768 0.1 1 2040 264 252 PRO HA H 4.529 0.01 1 2041 264 252 PRO HB2 H 2.495 0.01 2 2042 264 252 PRO HB3 H 2.153 0.01 2 2043 264 252 PRO HG2 H 2.122 0.01 1 2044 264 252 PRO HG3 H 2.122 0.01 1 2045 264 252 PRO HD2 H 3.559 0.01 1 2046 264 252 PRO HD3 H 3.559 0.01 1 2047 264 252 PRO C C 177.68 0.05 1 2048 264 252 PRO CA C 62.56 0.05 1 2049 264 252 PRO CB C 31.8 0.05 1 2050 265 253 ALA H H 8.872 0.01 1 2051 265 253 ALA HB H 1.539 0.01 1 2052 265 253 ALA C C 180.24 0.05 1 2053 265 253 ALA CA C 55.51 0.05 1 2054 265 253 ALA CB C 17.28 0.05 1 2055 265 253 ALA N N 125.111 0.1 1 2056 266 254 ASN H H 8.928 0.01 1 2057 266 254 ASN HA H 4.402 0.01 1 2058 266 254 ASN HB2 H 2.834 0.01 1 2059 266 254 ASN HB3 H 2.834 0.01 1 2060 266 254 ASN HD21 H 7.61 0.01 2 2061 266 254 ASN HD22 H 6.897 0.01 2 2062 266 254 ASN C C 177.07 0.05 1 2063 266 254 ASN CA C 55.71 0.05 1 2064 266 254 ASN CB C 35.39 0.05 1 2065 266 254 ASN N N 115.397 0.1 1 2066 267 255 LEU H H 7.206 0.01 1 2067 267 255 LEU HA H 4.048 0.01 1 2068 267 255 LEU HB2 H 2.126 0.01 2 2069 267 255 LEU HB3 H 1.533 0.01 2 2070 267 255 LEU HG H 1.445 0.01 1 2071 267 255 LEU HD1 H 0.604 0.01 2 2072 267 255 LEU HD2 H 0.798 0.01 2 2073 267 255 LEU C C 178.62 0.05 1 2074 267 255 LEU CA C 57.61 0.05 1 2075 267 255 LEU CB C 40.49 0.05 1 2076 267 255 LEU CD1 C 24.592 0.05 1 2077 267 255 LEU N N 122.658 0.1 1 2078 268 256 LYS H H 7.818 0.01 1 2079 268 256 LYS HA H 3.653 0.01 1 2080 268 256 LYS HB2 H 1.984 0.01 2 2081 268 256 LYS HB3 H 1.918 0.01 2 2082 268 256 LYS HG2 H 1.549 0.01 1 2083 268 256 LYS HG3 H 1.549 0.01 1 2084 268 256 LYS HD2 H 1.742 0.01 1 2085 268 256 LYS HD3 H 1.742 0.01 1 2086 268 256 LYS C C 177.82 0.05 1 2087 268 256 LYS CA C 61.25 0.05 1 2088 268 256 LYS CB C 31.34 0.05 1 2089 268 256 LYS N N 118.831 0.1 1 2090 269 257 ALA H H 7.751 0.01 1 2091 269 257 ALA HA H 4.203 0.01 1 2092 269 257 ALA HB H 1.497 0.01 1 2093 269 257 ALA C C 180.41 0.05 1 2094 269 257 ALA CA C 54.69 0.05 1 2095 269 257 ALA CB C 17.07 0.05 1 2096 269 257 ALA N N 119.469 0.1 1 2097 270 258 LEU H H 7.345 0.01 1 2098 270 258 LEU HA H 4.105 0.01 1 2099 270 258 LEU HB2 H 1.653 0.01 2 2100 270 258 LEU HB3 H 1.543 0.01 2 2101 270 258 LEU HG H 1.012 0.01 1 2102 270 258 LEU HD1 H 0.325 0.01 2 2103 270 258 LEU HD2 H 0.521 0.01 2 2104 270 258 LEU C C 179.33 0.05 1 2105 270 258 LEU CA C 57.29 0.05 1 2106 270 258 LEU CB C 40.55 0.05 1 2107 270 258 LEU CD1 C 25.48 0.05 1 2108 270 258 LEU CD2 C 23.66 0.05 1 2109 270 258 LEU N N 119.469 0.1 1 2110 271 259 VAL H H 8.296 0.01 1 2111 271 259 VAL HA H 3.748 0.01 1 2112 271 259 VAL HB H 2.359 0.01 1 2113 271 259 VAL HG1 H 1.188 0.01 2 2114 271 259 VAL HG2 H 1.045 0.01 2 2115 271 259 VAL C C 177.22 0.05 1 2116 271 259 VAL CA C 66.78 0.05 1 2117 271 259 VAL CB C 29.9 0.05 1 2118 271 259 VAL CG1 C 24.053 0.05 1 2119 271 259 VAL N N 118.831 0.1 1 2120 272 260 ALA H H 8.301 0.01 1 2121 272 260 ALA HA H 3.93 0.01 1 2122 272 260 ALA HB H 1.48 0.01 1 2123 272 260 ALA C C 178.65 0.05 1 2124 272 260 ALA CA C 55.34 0.05 1 2125 272 260 ALA CB C 16.24 0.05 1 2126 272 260 ALA N N 121.775 0.1 1 2127 273 261 GLU H H 7.587 0.01 1 2128 273 261 GLU HA H 4.061 0.01 1 2129 273 261 GLU HB2 H 2.304 0.01 2 2130 273 261 GLU HB3 H 2.209 0.01 2 2131 273 261 GLU HG2 H 2.599 0.01 1 2132 273 261 GLU HG3 H 2.599 0.01 1 2133 273 261 GLU C C 178.85 0.05 1 2134 273 261 GLU CA C 59.78 0.05 1 2135 273 261 GLU CB C 29.18 0.05 1 2136 273 261 GLU N N 117.163 0.1 1 2137 274 262 LEU H H 8.152 0.01 1 2138 274 262 LEU HA H 4.098 0.01 1 2139 274 262 LEU HB2 H 1.853 0.01 1 2140 274 262 LEU HB3 H 1.853 0.01 1 2141 274 262 LEU HG H 1.056 0.01 1 2142 274 262 LEU HD1 H 0.541 0.01 2 2143 274 262 LEU HD2 H 0.976 0.01 2 2144 274 262 LEU C C 177.9 0.05 1 2145 274 262 LEU CA C 59.97 0.05 1 2146 274 262 LEU CB C 41.58 0.05 1 2147 274 262 LEU N N 121.432 0.1 1 2148 275 263 ILE H H 8.605 0.01 1 2149 275 263 ILE HA H 4.085 0.01 1 2150 275 263 ILE HB H 1.842 0.01 1 2151 275 263 ILE HG12 H 1.264 0.01 1 2152 275 263 ILE HG13 H 1.039 0.01 1 2153 275 263 ILE HG2 H 0.871 0.01 1 2154 275 263 ILE HD1 H 0.748 0.01 1 2155 275 263 ILE C C 178.86 0.05 1 2156 275 263 ILE CA C 64.87 0.05 1 2157 275 263 ILE CB C 37.69 0.05 1 2158 275 263 ILE N N 118.782 0.1 1 2159 276 264 GLU H H 8.342 0.01 1 2160 276 264 GLU HA H 3.81 0.01 1 2161 276 264 GLU HB2 H 2.173 0.01 1 2162 276 264 GLU HB3 H 2.173 0.01 1 2163 276 264 GLU HG2 H 2.344 0.01 2 2164 276 264 GLU HG3 H 2.241 0.01 2 2165 276 264 GLU CA C 59.72 0.05 1 2166 276 264 GLU N N 119.126 0.1 1 2167 277 265 LEU H H 8.168 0.01 1 2168 277 265 LEU HA H 4.261 0.01 1 2169 277 265 LEU C C 178.28 0.05 1 2170 277 265 LEU CA C 57.5 0.05 1 2171 277 265 LEU CB C 40.17 0.05 1 2172 277 265 LEU N N 120.058 0.1 1 2173 278 266 ARG H H 8.054 0.01 1 2174 278 266 ARG HA H 3.654 0.01 1 2175 278 266 ARG HB2 H 1.927 0.01 1 2176 278 266 ARG HB3 H 1.927 0.01 1 2177 278 266 ARG HG2 H 1.661 0.01 2 2178 278 266 ARG HG3 H 1.524 0.01 2 2179 278 266 ARG CA C 60.39 0.05 1 2180 278 266 ARG N N 120.401 0.1 1 2181 279 267 GLU H H 8.193 0.01 1 2182 279 267 GLU HA H 3.689 0.01 1 2183 279 267 GLU C C 178.6 0.05 1 2184 279 267 GLU CA C 58.63 0.05 1 2185 279 267 GLU N N 120.549 0.1 1 2186 280 268 GLN H H 8.111 0.01 1 2187 280 268 GLN HA H 3.995 0.01 1 2188 280 268 GLN HB2 H 2.378 0.01 2 2189 280 268 GLN HB3 H 2.135 0.01 2 2190 280 268 GLN HG2 H 2.622 0.01 1 2191 280 268 GLN HG3 H 2.622 0.01 1 2192 280 268 GLN HE21 H 7.147 0.01 2 2193 280 268 GLN HE22 H 6.793 0.01 2 2194 280 268 GLN C C 181.89 0.05 1 2195 280 268 GLN CA C 58.9 0.05 1 2196 280 268 GLN N N 119.077 0.1 1 2197 281 269 MET H H 8.183 0.01 1 2198 281 269 MET HA H 3.852 0.01 1 2199 281 269 MET HB2 H 2.39 0.01 2 2200 281 269 MET HB3 H 2.227 0.01 2 2201 281 269 MET HG2 H 2.86 0.01 2 2202 281 269 MET HG3 H 2.39 0.01 2 2203 281 269 MET HE H 1.93 0.01 1 2204 281 269 MET C C 179.24 0.05 1 2205 281 269 MET CA C 61.72 0.05 1 2206 281 269 MET N N 119.322 0.1 1 2207 282 270 MET H H 8.003 0.01 1 2208 282 270 MET HA H 4.024 0.01 1 2209 282 270 MET HB2 H 2.225 0.01 2 2210 282 270 MET HB3 H 2.084 0.01 2 2211 282 270 MET HG2 H 2.592 0.01 2 2212 282 270 MET HG3 H 2.359 0.01 2 2213 282 270 MET HE H 2.087 0.01 1 2214 282 270 MET C C 178.51 0.05 1 2215 282 270 MET CA C 58.86 0.05 1 2216 282 270 MET CB C 29.86 0.05 1 2217 282 270 MET N N 119.028 0.1 1 2218 283 271 ASP H H 8.471 0.01 1 2219 283 271 ASP HA H 4.085 0.01 1 2220 283 271 ASP HB2 H 2.836 0.01 2 2221 283 271 ASP HB3 H 2.205 0.01 2 2222 283 271 ASP C C 179.01 0.05 1 2223 283 271 ASP CA C 56.05 0.05 1 2224 283 271 ASP CB C 38.7 0.05 1 2225 283 271 ASP N N 121.432 0.1 1 2226 284 272 LEU H H 7.33 0.01 1 2227 284 272 LEU HA H 3.814 0.01 1 2228 284 272 LEU HB2 H 1.83 0.01 2 2229 284 272 LEU HB3 H 1.795 0.01 2 2230 284 272 LEU HG H 1.462 0.01 1 2231 284 272 LEU HD1 H 0.777 0.01 2 2232 284 272 LEU HD2 H 0.871 0.01 2 2233 284 272 LEU C C 177.66 0.05 1 2234 284 272 LEU CA C 56.8 0.05 1 2235 284 272 LEU CB C 40.52 0.05 1 2236 284 272 LEU N N 118.635 0.1 1 2237 285 273 LEU H H 6.851 0.01 1 2238 285 273 LEU HA H 4.042 0.01 1 2239 285 273 LEU HB2 H 1.173 0.01 1 2240 285 273 LEU HB3 H 1.173 0.01 1 2241 285 273 LEU HG H 0.587 0.01 1 2242 285 273 LEU HD1 H 0.591 0.01 2 2243 285 273 LEU HD2 H 0.535 0.01 2 2244 285 273 LEU C C 181.89 0.05 1 2245 285 273 LEU CA C 56.11 0.05 1 2246 285 273 LEU CB C 41.92 0.05 1 2247 285 273 LEU CD1 C 25.039 0.05 1 2248 285 273 LEU CD2 C 23.55 0.05 1 2249 285 273 LEU N N 116.673 0.1 1 2250 286 274 TYR H H 7.509 0.01 1 2251 286 274 TYR HA H 4.847 0.01 1 2252 286 274 TYR HB2 H 2.513 0.01 2 2253 286 274 TYR HB3 H 1.792 0.01 2 2254 286 274 TYR HD1 H 7.024 0.01 3 2255 286 274 TYR HE1 H 6.725 0.01 3 2256 286 274 TYR C C 176.29 0.05 1 2257 286 274 TYR CA C 57.06 0.05 1 2258 286 274 TYR CB C 40.32 0.05 1 2259 286 274 TYR N N 112.65 0.1 1 2260 287 275 GLY H H 7.89 0.01 1 2261 287 275 GLY HA2 H 4.315 0.01 2 2262 287 275 GLY HA3 H 3.726 0.01 2 2263 287 275 GLY CA C 44.42 0.05 1 2264 287 275 GLY N N 108.234 0.1 1 2265 288 276 PRO HA H 4.518 0.01 1 2266 288 276 PRO HB2 H 1.835 0.01 1 2267 288 276 PRO HB3 H 1.835 0.01 1 2268 288 276 PRO HG2 H 2.043 0.01 1 2269 288 276 PRO HG3 H 2.043 0.01 1 2270 288 276 PRO HD2 H 3.387 0.01 2 2271 288 276 PRO HD3 H 3.233 0.01 2 2272 288 276 PRO C C 178.0 0.05 1 2273 288 276 PRO CA C 61.6 0.05 1 2274 288 276 PRO CB C 30.8 0.05 1 2275 289 277 ILE H H 8.82 0.01 1 2276 289 277 ILE HA H 3.49 0.01 1 2277 289 277 ILE HB H 1.496 0.01 1 2278 289 277 ILE HG12 H 1.438 0.01 1 2279 289 277 ILE HG13 H 1.438 0.01 1 2280 289 277 ILE HG2 H 0.113 0.01 1 2281 289 277 ILE HD1 H 0.6 0.01 1 2282 289 277 ILE C C 177.0 0.05 1 2283 289 277 ILE CA C 61.97 0.05 1 2284 289 277 ILE CB C 36.61 0.05 1 2285 289 277 ILE CG2 C 17.268 0.05 1 2286 289 277 ILE CD1 C 13.288 0.05 1 2287 289 277 ILE N N 123.394 0.1 1 2288 290 278 GLY H H 8.065 0.01 1 2289 290 278 GLY HA2 H 4.098 0.01 2 2290 290 278 GLY HA3 H 3.806 0.01 2 2291 290 278 GLY C C 173.09 0.05 1 2292 290 278 GLY CA C 45.14 0.05 1 2293 290 278 GLY N N 113.974 0.1 1 2294 291 279 HIS H H 8.049 0.01 1 2295 291 279 HIS HA H 4.527 0.01 1 2296 291 279 HIS HB2 H 3.118 0.01 2 2297 291 279 HIS HB3 H 3.049 0.01 2 2298 291 279 HIS CA C 55.83 0.05 1 2299 291 279 HIS CB C 29.43 0.05 1 2300 291 279 HIS N N 118.145 0.1 1 2301 292 280 HIS H H 8.034 0.01 1 2302 292 280 HIS C C 174.04 0.05 1 2303 292 280 HIS CA C 55.13 0.05 1 2304 292 280 HIS CB C 29.18 0.05 1 2305 292 280 HIS N N 122.315 0.1 1 2306 293 281 ASP H H 8.517 0.01 1 2307 293 281 ASP C C 176.23 0.05 1 2308 293 281 ASP CA C 54.14 0.05 1 2309 293 281 ASP CB C 40.75 0.05 1 2310 293 281 ASP N N 122.217 0.1 1 2311 294 282 CYS H H 8.543 0.01 1 2312 294 282 CYS C C 174.46 0.05 1 2313 294 282 CYS CA C 55.44 0.05 1 2314 294 282 CYS CB C 40.28 0.05 1 2315 294 282 CYS N N 119.715 0.1 1 2316 295 283 ALA H H 8.903 0.01 1 2317 295 283 ALA C C 177.41 0.05 1 2318 295 283 ALA CA C 52.39 0.05 1 2319 295 283 ALA CB C 18.28 0.05 1 2320 295 283 ALA N N 125.406 0.1 1 2321 296 284 ALA H H 8.07 0.01 1 2322 296 284 ALA C C 178.33 0.05 1 2323 296 284 ALA CA C 52.43 0.05 1 2324 296 284 ALA CB C 18.24 0.05 1 2325 296 284 ALA N N 121.922 0.1 1 2326 297 285 GLY H H 8.301 0.01 1 2327 297 285 GLY C C 174.32 0.05 1 2328 297 285 GLY CA C 45.04 0.05 1 2329 297 285 GLY N N 108.087 0.1 1 2330 298 286 SER H H 8.224 0.01 1 2331 298 286 SER C C 175.26 0.05 1 2332 298 286 SER CA C 58.38 0.05 1 2333 298 286 SER CB C 63.34 0.05 1 2334 298 286 SER N N 115.495 0.1 1 2335 299 287 GLY H H 8.497 0.01 1 2336 299 287 GLY C C 174.32 0.05 1 2337 299 287 GLY CA C 45.21 0.05 1 2338 299 287 GLY N N 110.786 0.1 1 2339 300 288 GLN H H 8.26 0.01 1 2340 300 288 GLN C C 176.63 0.05 1 2341 300 288 GLN CA C 55.76 0.05 1 2342 300 288 GLN CB C 28.38 0.05 1 2343 300 288 GLN N N 119.862 0.1 1 2344 301 289 GLY H H 8.486 0.01 1 2345 301 289 GLY C C 174.58 0.05 1 2346 301 289 GLY CA C 45.13 0.05 1 2347 301 289 GLY N N 110.148 0.1 1 2348 302 290 SER H H 8.322 0.01 1 2349 302 290 SER CA C 58.41 0.05 1 2350 302 290 SER CB C 63.26 0.05 1 2351 302 290 SER N N 115.692 0.1 1 2352 303 291 SER H H 8.193 0.01 1 2353 303 291 SER C C 174.22 0.05 1 2354 303 291 SER CA C 58.29 0.05 1 2355 303 291 SER CB C 63.1 0.05 1 2356 303 291 SER N N 118.243 0.1 1 2357 304 292 LYS H H 8.255 0.01 1 2358 304 292 LYS C C 176.14 0.05 1 2359 304 292 LYS CA C 55.99 0.05 1 2360 304 292 LYS CB C 31.81 0.05 1 2361 304 292 LYS N N 123.198 0.1 1 2362 305 293 LEU H H 8.255 0.01 1 2363 305 293 LEU CA C 54.99 0.05 1 2364 305 293 LEU CB C 41.33 0.05 1 2365 305 293 LEU N N 123.885 0.1 1 2366 306 294 ASN H H 7.885 0.01 1 2367 306 294 ASN CA C 54.54 0.05 1 2368 306 294 ASN N N 124.277 0.1 1 stop_ save_