data_7053 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C and 15N resonance assigned of a first cysteine catalytic half-domain of mouse ubiquitin-activating enzyme E1. ; _BMRB_accession_number 7053 _BMRB_flat_file_name bmr7053.str _Entry_type original _Submission_date 2006-04-04 _Accession_date 2006-04-04 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Comprise residues 202 to 312 of the full length ubiquitin E1 sequence (SWISSPROT Q02053)' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Zhukov Igor . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 553 "13C chemical shifts" 437 "15N chemical shifts" 108 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-02-08 update BMRB 'complete entry citation' 2006-06-28 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_E1_fcch _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR assignment of a structurally uncharacterised fragment of recombinant mouse ubiquitin-activating enzyme ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16738783 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Jaremko Lukasz . . 2 Jaremko Mariusz . . 3 Filipek Renata . . 4 Wojciechowski Marek . . 5 Szczepanowski Roman H. . 6 Bochtler Matthias . . 7 Zhukov Igor . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 36 _Journal_issue 'Suppl. 5' _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 43 _Page_last 43 _Year 2006 _Details . loop_ _Keyword 'E1 protein' NMR stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'cysteine catalytic half-domain of mouse E1 protein' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'mouse E1 protein' $mouse_E1 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state protein _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_mouse_E1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'first cysteine catalytic half-domain' _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 111 _Mol_residue_sequence ; FGEEMVLTDSNGEQPLSAMV SMVTKDNPGVVTCLDEARHG FETGDFVSFSEVQGMIQLNG CQPMEIKVLGPYTFSICDTS NFSDYIRGGIVSQVKVPKKI SFKSLPASLVE ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 202 PHE 2 203 GLY 3 204 GLU 4 205 GLU 5 206 MET 6 207 VAL 7 208 LEU 8 209 THR 9 210 ASP 10 211 SER 11 212 ASN 12 213 GLY 13 214 GLU 14 215 GLN 15 216 PRO 16 217 LEU 17 218 SER 18 219 ALA 19 220 MET 20 221 VAL 21 222 SER 22 223 MET 23 224 VAL 24 225 THR 25 226 LYS 26 227 ASP 27 228 ASN 28 229 PRO 29 230 GLY 30 231 VAL 31 232 VAL 32 233 THR 33 234 CYS 34 235 LEU 35 236 ASP 36 237 GLU 37 238 ALA 38 239 ARG 39 240 HIS 40 241 GLY 41 242 PHE 42 243 GLU 43 244 THR 44 245 GLY 45 246 ASP 46 247 PHE 47 248 VAL 48 249 SER 49 250 PHE 50 251 SER 51 252 GLU 52 253 VAL 53 254 GLN 54 255 GLY 55 256 MET 56 257 ILE 57 258 GLN 58 259 LEU 59 260 ASN 60 261 GLY 61 262 CYS 62 263 GLN 63 264 PRO 64 265 MET 65 266 GLU 66 267 ILE 67 268 LYS 68 269 VAL 69 270 LEU 70 271 GLY 71 272 PRO 72 273 TYR 73 274 THR 74 275 PHE 75 276 SER 76 277 ILE 77 278 CYS 78 279 ASP 79 280 THR 80 281 SER 81 282 ASN 82 283 PHE 83 284 SER 84 285 ASP 85 286 TYR 86 287 ILE 87 288 ARG 88 289 GLY 89 290 GLY 90 291 ILE 91 292 VAL 92 293 SER 93 294 GLN 94 295 VAL 95 296 LYS 96 297 VAL 97 298 PRO 98 299 LYS 99 300 LYS 100 301 ILE 101 302 SER 102 303 PHE 103 304 LYS 104 305 SER 105 306 LEU 106 307 PRO 107 308 ALA 108 309 SER 109 310 LEU 110 311 VAL 111 312 GLU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 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 18758 entity 100.00 112 100.00 100.00 2.87e-74 PDB 2LZJ "Refined Solution Structure And Dynamics Of First Catalytic Cysteine Half-domain From Mouse E1 Enzyme" 100.00 112 100.00 100.00 2.87e-74 PDB 2V31 "Structure Of First Catalytic Cysteine Half-domain Of Mouse Ubiquitin-activating Enzyme" 100.00 112 100.00 100.00 2.87e-74 DBJ BAA01433 "ubiquitin activating enzyme E1 [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 DBJ BAC40121 "unnamed protein product [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 DBJ BAC40405 "unnamed protein product [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 DBJ BAE25369 "unnamed protein product [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 DBJ BAE42599 "unnamed protein product [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 GB AAH58630 "Uba1 protein [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 GB AAH85791 "Ubiquitin-like modifier activating enzyme 1 [Rattus norvegicus]" 100.00 1058 97.30 99.10 1.36e-66 GB AAI38201 "Ubiquitin-like modifier activating enzyme 1 [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 GB AAI45985 "Ubiquitin-like modifier activating enzyme 1 [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 GB EDL00743 "ubiquitin-activating enzyme E1, Chr X [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 REF NP_001014102 "ubiquitin-like modifier-activating enzyme 1 [Rattus norvegicus]" 100.00 1058 97.30 99.10 1.36e-66 REF NP_001129557 "ubiquitin-like modifier-activating enzyme 1 isoform 2 [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 REF NP_001263245 "ubiquitin-like modifier-activating enzyme 1 isoform 2 [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 REF NP_001263246 "ubiquitin-like modifier-activating enzyme 1 isoform 2 [Mus musculus]" 100.00 1058 100.00 100.00 6.05e-68 REF NP_033483 "ubiquitin-like modifier-activating enzyme 1 isoform 1 [Mus musculus]" 100.00 1118 100.00 100.00 1.09e-67 SP Q02053 "RecName: Full=Ubiquitin-like modifier-activating enzyme 1; AltName: Full=Ubiquitin-activating enzyme E1; AltName: Full=Ubiquiti" 100.00 1058 100.00 100.00 6.05e-68 SP Q5U300 "RecName: Full=Ubiquitin-like modifier-activating enzyme 1; AltName: Full=Ubiquitin-activating enzyme E1 [Rattus norvegicus]" 100.00 1058 97.30 99.10 1.36e-66 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $mouse_E1 Mouse 10090 Eukaryota Metazoa Mus musculus 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 $mouse_E1 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $mouse_E1 1.0 mM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Unity+ _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N HSQC' _Sample_label $sample_1 save_ save_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label $sample_1 save_ save_HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CO)CA _Sample_label $sample_1 save_ save_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label $sample_1 save_ save_CBCA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name CBCA(CO)NH _Sample_label $sample_1 save_ save_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label $sample_1 save_ save_HBHA(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name HBHA(CO)NH _Sample_label $sample_1 save_ save_HNHA_8 _Saveframe_category NMR_applied_experiment _Experiment_name HNHA _Sample_label $sample_1 save_ save_C(CO)NH_9 _Saveframe_category NMR_applied_experiment _Experiment_name C(CO)NH _Sample_label $sample_1 save_ save_HCCH-TOCSY_10 _Saveframe_category NMR_applied_experiment _Experiment_name HCCH-TOCSY _Sample_label $sample_1 save_ save_NOESY-HSQC_15N-edited_11 _Saveframe_category NMR_applied_experiment _Experiment_name 'NOESY-HSQC 15N-edited' _Sample_label $sample_1 save_ save_NOESY-HSQC_13C-edited_12 _Saveframe_category NMR_applied_experiment _Experiment_name 'NOESY-HSQC 13C-edited' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 0.1 pH temperature 303 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _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 _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $E1_fcch $E1_fcch DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $E1_fcch $E1_fcch DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $E1_fcch $E1_fcch 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'mouse E1 protein' _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 1 202 1 PHE H H 8.29 0.02 1 2 202 1 PHE HA H 4.61 0.02 1 3 202 1 PHE HB2 H 3.17 0.02 2 4 202 1 PHE HB3 H 2.98 0.02 2 5 202 1 PHE C C 176.2 0.2 1 6 202 1 PHE CA C 57.8 0.2 1 7 202 1 PHE CB C 39.5 0.2 1 8 202 1 PHE N N 120.5 0.2 1 9 203 2 GLY H H 8.26 0.02 1 10 203 2 GLY HA2 H 3.89 0.02 1 11 203 2 GLY HA3 H 3.89 0.02 1 12 203 2 GLY C C 174.3 0.2 1 13 203 2 GLY CA C 45.4 0.2 1 14 203 2 GLY N N 110.4 0.2 1 15 204 3 GLU H H 8.39 0.02 1 16 204 3 GLU HA H 4.28 0.02 1 17 204 3 GLU HB2 H 2.04 0.02 2 18 204 3 GLU HB3 H 1.89 0.02 2 19 204 3 GLU C C 176.5 0.2 1 20 204 3 GLU CA C 56.6 0.2 1 21 204 3 GLU CB C 30.5 0.2 1 22 204 3 GLU CG C 36.3 0.2 1 23 204 3 GLU N N 120.5 0.2 1 24 205 4 GLU H H 8.51 0.02 1 25 205 4 GLU HA H 4.23 0.02 1 26 205 4 GLU HB2 H 2.00 0.02 2 27 205 4 GLU HB3 H 1.90 0.02 2 28 205 4 GLU C C 176.3 0.2 1 29 205 4 GLU CA C 56.7 0.2 1 30 205 4 GLU CB C 30.2 0.2 1 31 205 4 GLU CG C 36.3 0.2 1 32 205 4 GLU N N 121.4 0.2 1 33 206 5 MET H H 8.28 0.02 1 34 206 5 MET HA H 4.43 0.02 1 35 206 5 MET HB2 H 1.95 0.02 1 36 206 5 MET HB3 H 1.95 0.02 1 37 206 5 MET C C 175.7 0.2 1 38 206 5 MET CA C 55.6 0.2 1 39 206 5 MET CB C 33.0 0.2 1 40 206 5 MET CG C 32.1 0.2 1 41 206 5 MET N N 121.6 0.2 1 42 207 6 VAL H H 8.13 0.02 1 43 207 6 VAL HA H 4.09 0.02 1 44 207 6 VAL HB H 2.01 0.02 1 45 207 6 VAL HG1 H 0.88 0.02 2 46 207 6 VAL HG2 H 0.90 0.02 2 47 207 6 VAL C C 175.9 0.2 1 48 207 6 VAL CA C 62.3 0.2 1 49 207 6 VAL CB C 32.8 0.2 1 50 207 6 VAL CG1 C 21.2 0.2 1 51 207 6 VAL CG2 C 20.6 0.2 1 52 207 6 VAL N N 122.3 0.2 1 53 208 7 LEU H H 8.37 0.02 1 54 208 7 LEU HA H 4.45 0.02 1 55 208 7 LEU HB2 H 1.60 0.02 1 56 208 7 LEU HB3 H 1.60 0.02 1 57 208 7 LEU HD1 H 0.91 0.02 2 58 208 7 LEU HD2 H 0.85 0.02 2 59 208 7 LEU C C 177.3 0.2 1 60 208 7 LEU CA C 55.0 0.2 1 61 208 7 LEU CB C 42.4 0.2 1 62 208 7 LEU CG C 27.1 0.2 1 63 208 7 LEU CD1 C 25.1 0.2 1 64 208 7 LEU CD2 C 23.5 0.2 1 65 208 7 LEU N N 126.5 0.2 1 66 209 8 THR H H 8.09 0.02 1 67 209 8 THR HA H 4.35 0.02 1 68 209 8 THR HG2 H 1.17 0.02 1 69 209 8 THR C C 174.2 0.2 1 70 209 8 THR CA C 61.6 0.2 1 71 209 8 THR CB C 70.0 0.2 1 72 209 8 THR CG2 C 21.5 0.2 1 73 209 8 THR N N 114.9 0.2 1 74 210 9 ASP H H 8.33 0.02 1 75 210 9 ASP HA H 4.64 0.02 1 76 210 9 ASP HB2 H 2.68 0.02 1 77 210 9 ASP HB3 H 2.68 0.02 1 78 210 9 ASP C C 176.5 0.2 1 79 210 9 ASP CA C 54.3 0.2 1 80 210 9 ASP CB C 41.4 0.2 1 81 210 9 ASP N N 122.6 0.2 1 82 211 10 SER H H 8.29 0.02 1 83 211 10 SER HA H 4.43 0.02 1 84 211 10 SER HB2 H 3.88 0.02 1 85 211 10 SER HB3 H 3.88 0.02 1 86 211 10 SER C C 174.7 0.2 1 87 211 10 SER CA C 58.6 0.2 1 88 211 10 SER CB C 63.7 0.2 1 89 211 10 SER N N 116.3 0.2 1 90 212 11 ASN H H 8.51 0.02 1 91 212 11 ASN HA H 4.73 0.02 1 92 212 11 ASN HB2 H 2.81 0.02 1 93 212 11 ASN HB3 H 2.81 0.02 1 94 212 11 ASN C C 175.8 0.2 1 95 212 11 ASN CA C 53.6 0.2 1 96 212 11 ASN CB C 39.0 0.2 1 97 212 11 ASN N N 120.7 0.2 1 98 213 12 GLY H H 8.28 0.02 1 99 213 12 GLY HA2 H 3.93 0.02 1 100 213 12 GLY HA3 H 3.93 0.02 1 101 213 12 GLY C C 174.1 0.2 1 102 213 12 GLY CA C 45.4 0.2 1 103 213 12 GLY N N 108.9 0.2 1 104 214 13 GLU H H 8.17 0.02 1 105 214 13 GLU HA H 4.27 0.02 1 106 214 13 GLU HB2 H 2.00 0.02 2 107 214 13 GLU HB3 H 1.92 0.02 2 108 214 13 GLU C C 176.3 0.2 1 109 214 13 GLU CA C 56.4 0.2 1 110 214 13 GLU CB C 30.5 0.2 1 111 214 13 GLU N N 120.3 0.2 1 112 215 14 GLN H H 8.41 0.02 1 113 215 14 GLN HA H 4.59 0.02 1 114 215 14 GLN CA C 53.6 0.2 1 115 215 14 GLN CB C 29.0 0.2 1 116 215 14 GLN N N 122.4 0.2 1 117 216 15 PRO HA H 4.43 0.02 1 118 216 15 PRO HB2 H 2.30 0.02 2 119 216 15 PRO HB3 H 1.97 0.02 2 120 216 15 PRO HG2 H 2.29 0.02 1 121 216 15 PRO HG3 H 2.29 0.02 1 122 216 15 PRO HD2 H 3.80 0.02 2 123 216 15 PRO HD3 H 3.71 0.02 2 124 216 15 PRO C C 176.7 0.2 1 125 216 15 PRO CA C 62.8 0.2 1 126 216 15 PRO CB C 32.7 0.2 1 127 216 15 PRO CG C 27.5 0.2 1 128 216 15 PRO CD C 50.8 0.2 1 129 217 16 LEU H H 8.57 0.02 1 130 217 16 LEU HA H 4.50 0.02 1 131 217 16 LEU HB2 H 1.71 0.02 2 132 217 16 LEU HB3 H 1.62 0.02 2 133 217 16 LEU HG H 1.69 0.02 1 134 217 16 LEU HD1 H 0.97 0.02 2 135 217 16 LEU HD2 H 0.88 0.02 2 136 217 16 LEU C C 176.2 0.2 1 137 217 16 LEU CA C 55.3 0.2 1 138 217 16 LEU CB C 43.1 0.2 1 139 217 16 LEU CG C 27.1 0.2 1 140 217 16 LEU CD1 C 25.3 0.2 1 141 217 16 LEU CD2 C 23.5 0.2 1 142 217 16 LEU N N 124.3 0.2 1 143 218 17 SER H H 8.26 0.02 1 144 218 17 SER HA H 5.79 0.02 1 145 218 17 SER HB2 H 3.75 0.02 1 146 218 17 SER HB3 H 3.75 0.02 1 147 218 17 SER C C 172.9 0.2 1 148 218 17 SER CA C 57.2 0.2 1 149 218 17 SER CB C 67.3 0.2 1 150 218 17 SER N N 115.3 0.2 1 151 219 18 ALA H H 9.36 0.02 1 152 219 18 ALA HA H 4.78 0.02 1 153 219 18 ALA HB H 1.40 0.02 1 154 219 18 ALA C C 175.3 0.2 1 155 219 18 ALA CA C 51.2 0.2 1 156 219 18 ALA CB C 22.9 0.2 1 157 219 18 ALA N N 123.4 0.2 1 158 220 19 MET H H 8.75 0.02 1 159 220 19 MET HA H 5.08 0.02 1 160 220 19 MET HB2 H 2.25 0.02 2 161 220 19 MET HB3 H 2.09 0.02 2 162 220 19 MET HG2 H 2.77 0.02 2 163 220 19 MET HG3 H 2.63 0.02 2 164 220 19 MET HE H 2.09 0.02 1 165 220 19 MET C C 176.3 0.2 1 166 220 19 MET CA C 54.7 0.2 1 167 220 19 MET CB C 32.9 0.2 1 168 220 19 MET CG C 32.7 0.2 1 169 220 19 MET N N 119.0 0.2 1 170 221 20 VAL H H 8.12 0.02 1 171 221 20 VAL HA H 3.92 0.02 1 172 221 20 VAL HB H 2.30 0.02 1 173 221 20 VAL HG1 H 0.94 0.02 2 174 221 20 VAL HG2 H 1.01 0.02 2 175 221 20 VAL C C 175.1 0.2 1 176 221 20 VAL CA C 64.0 0.2 1 177 221 20 VAL CB C 33.5 0.2 1 178 221 20 VAL CG1 C 23.0 0.2 1 179 221 20 VAL CG2 C 22.6 0.2 1 180 221 20 VAL N N 124.3 0.2 1 181 222 21 SER H H 9.34 0.02 1 182 222 21 SER HA H 4.72 0.02 1 183 222 21 SER HB2 H 3.44 0.02 2 184 222 21 SER HB3 H 3.76 0.02 2 185 222 21 SER C C 173.6 0.2 1 186 222 21 SER CA C 58.2 0.2 1 187 222 21 SER CB C 65.7 0.2 1 188 222 21 SER N N 119.2 0.2 1 189 223 22 MET H H 7.45 0.02 1 190 223 22 MET HA H 4.04 0.02 1 191 223 22 MET HB2 H 2.12 0.02 1 192 223 22 MET HB3 H 2.12 0.02 1 193 223 22 MET HG2 H 1.69 0.02 1 194 223 22 MET HG3 H 1.69 0.02 1 195 223 22 MET HE H 2.12 0.02 1 196 223 22 MET C C 173.1 0.2 1 197 223 22 MET CA C 55.1 0.2 1 198 223 22 MET CB C 32.7 0.2 1 199 223 22 MET CG C 32.8 0.2 1 200 223 22 MET CE C 16.2 0.2 1 201 223 22 MET N N 119.5 0.2 1 202 224 23 VAL H H 5.91 0.02 1 203 224 23 VAL HA H 4.65 0.02 1 204 224 23 VAL HB H 1.73 0.02 1 205 224 23 VAL HG1 H 0.88 0.02 2 206 224 23 VAL HG2 H 0.56 0.02 2 207 224 23 VAL C C 175.6 0.2 1 208 224 23 VAL CA C 61.9 0.2 1 209 224 23 VAL CB C 34.7 0.2 1 210 224 23 VAL CG1 C 21.4 0.2 1 211 224 23 VAL CG2 C 21.2 0.2 1 212 224 23 VAL N N 121.0 0.2 1 213 225 24 THR H H 8.44 0.02 1 214 225 24 THR HA H 4.25 0.02 1 215 225 24 THR HB H 4.23 0.02 1 216 225 24 THR HG2 H 1.14 0.02 1 217 225 24 THR C C 173.6 0.2 1 218 225 24 THR CA C 60.9 0.2 1 219 225 24 THR CB C 70.7 0.2 1 220 225 24 THR CG2 C 23.3 0.2 1 221 225 24 THR N N 115.8 0.2 1 222 226 25 LYS H H 8.28 0.02 1 223 226 25 LYS HA H 4.29 0.02 1 224 226 25 LYS HB2 H 1.65 0.02 2 225 226 25 LYS HB3 H 1.49 0.02 2 226 226 25 LYS HG2 H 1.11 0.02 1 227 226 25 LYS HG3 H 1.11 0.02 1 228 226 25 LYS HD2 H 1.58 0.02 1 229 226 25 LYS HD3 H 1.58 0.02 1 230 226 25 LYS HE2 H 3.00 0.02 1 231 226 25 LYS HE3 H 3.00 0.02 1 232 226 25 LYS C C 174.2 0.2 1 233 226 25 LYS CA C 54.7 0.2 1 234 226 25 LYS CB C 32.1 0.2 1 235 226 25 LYS CG C 25.1 0.2 1 236 226 25 LYS CD C 29.7 0.2 1 237 226 25 LYS CE C 42.3 0.2 1 238 226 25 LYS N N 122.8 0.2 1 239 227 26 ASP H H 8.39 0.02 1 240 227 26 ASP HA H 4.40 0.02 1 241 227 26 ASP HB2 H 2.30 0.02 2 242 227 26 ASP HB3 H 2.50 0.02 2 243 227 26 ASP C C 172.1 0.2 1 244 227 26 ASP CA C 52.8 0.2 1 245 227 26 ASP CB C 43.4 0.2 1 246 227 26 ASP N N 123.9 0.2 1 247 228 27 ASN H H 8.82 0.02 1 248 228 27 ASN HA H 5.29 0.02 1 249 228 27 ASN HB2 H 2.91 0.02 1 250 228 27 ASN HB3 H 2.91 0.02 1 251 228 27 ASN HD21 H 7.26 0.02 2 252 228 27 ASN HD22 H 6.51 0.02 2 253 228 27 ASN CA C 48.6 0.2 1 254 228 27 ASN CB C 39.5 0.2 1 255 228 27 ASN N N 114.0 0.2 1 256 228 27 ASN ND2 N 108.7 0.2 1 257 229 28 PRO HA H 4.68 0.02 1 258 229 28 PRO HB2 H 2.18 0.02 1 259 229 28 PRO HB3 H 2.18 0.02 1 260 229 28 PRO HG2 H 1.59 0.02 2 261 229 28 PRO HG3 H 1.94 0.02 2 262 229 28 PRO HD2 H 3.54 0.02 2 263 229 28 PRO HD3 H 3.30 0.02 2 264 229 28 PRO C C 175.7 0.2 1 265 229 28 PRO CA C 63.5 0.2 1 266 229 28 PRO CB C 35.2 0.2 1 267 229 28 PRO CG C 24.2 0.2 1 268 229 28 PRO CD C 50.0 0.2 1 269 230 29 GLY H H 8.48 0.02 1 270 230 29 GLY HA2 H 3.62 0.02 2 271 230 29 GLY HA3 H 3.35 0.02 2 272 230 29 GLY C C 173.2 0.2 1 273 230 29 GLY CA C 46.5 0.2 1 274 230 29 GLY N N 105.8 0.2 1 275 231 30 VAL H H 8.18 0.02 1 276 231 30 VAL HA H 4.22 0.02 1 277 231 30 VAL HB H 1.75 0.02 1 278 231 30 VAL HG1 H 0.67 0.02 2 279 231 30 VAL HG2 H 0.60 0.02 2 280 231 30 VAL C C 175.8 0.2 1 281 231 30 VAL CA C 62.5 0.2 1 282 231 30 VAL CB C 33.4 0.2 1 283 231 30 VAL CG1 C 21.8 0.2 1 284 231 30 VAL CG2 C 21.1 0.2 1 285 231 30 VAL N N 121.6 0.2 1 286 232 31 VAL H H 9.26 0.02 1 287 232 31 VAL HA H 4.51 0.02 1 288 232 31 VAL HB H 0.55 0.02 1 289 232 31 VAL HG1 H 0.88 0.02 2 290 232 31 VAL HG2 H 0.73 0.02 2 291 232 31 VAL C C 174.5 0.2 1 292 232 31 VAL CA C 60.6 0.2 1 293 232 31 VAL CB C 32.6 0.2 1 294 232 31 VAL CG1 C 23.4 0.2 1 295 232 31 VAL CG2 C 22.6 0.2 1 296 232 31 VAL N N 131.6 0.2 1 297 233 32 THR H H 8.71 0.02 1 298 233 32 THR HA H 4.92 0.02 1 299 233 32 THR HB H 3.75 0.02 1 300 233 32 THR HG2 H 1.25 0.02 1 301 233 32 THR C C 174.9 0.2 1 302 233 32 THR CA C 61.4 0.2 1 303 233 32 THR CB C 70.3 0.2 1 304 233 32 THR CG2 C 21.4 0.2 1 305 233 32 THR N N 121.2 0.2 1 306 234 33 CYS H H 8.96 0.02 1 307 234 33 CYS HA H 5.07 0.02 1 308 234 33 CYS HB2 H 3.27 0.02 2 309 234 33 CYS HB3 H 3.23 0.02 2 310 234 33 CYS C C 173.7 0.2 1 311 234 33 CYS CA C 59.2 0.2 1 312 234 33 CYS CB C 29.9 0.2 1 313 234 33 CYS N N 125.8 0.2 1 314 235 34 LEU H H 8.21 0.02 1 315 235 34 LEU HA H 4.03 0.02 1 316 235 34 LEU HB2 H 1.29 0.02 2 317 235 34 LEU HB3 H 1.77 0.02 2 318 235 34 LEU HG H 1.51 0.02 1 319 235 34 LEU HD1 H 0.92 0.02 2 320 235 34 LEU HD2 H 0.94 0.02 2 321 235 34 LEU C C 177.0 0.2 1 322 235 34 LEU CA C 56.0 0.2 1 323 235 34 LEU CB C 43.2 0.2 1 324 235 34 LEU CG C 27.2 0.2 1 325 235 34 LEU CD1 C 24.7 0.2 1 326 235 34 LEU CD2 C 24.5 0.2 1 327 235 34 LEU N N 122.4 0.2 1 328 236 35 ASP H H 8.41 0.02 1 329 236 35 ASP HA H 4.02 0.02 1 330 236 35 ASP HB2 H 2.41 0.02 1 331 236 35 ASP HB3 H 2.41 0.02 1 332 236 35 ASP C C 175.6 0.2 1 333 236 35 ASP CA C 55.4 0.2 1 334 236 35 ASP CB C 39.3 0.2 1 335 236 35 ASP N N 122.0 0.2 1 336 237 36 GLU H H 7.66 0.02 1 337 237 36 GLU HA H 3.54 0.02 1 338 237 36 GLU HB2 H 1.87 0.02 2 339 237 36 GLU HB3 H 1.76 0.02 2 340 237 36 GLU HG2 H 2.02 0.02 2 341 237 36 GLU HG3 H 1.81 0.02 2 342 237 36 GLU C C 175.4 0.2 1 343 237 36 GLU CA C 57.6 0.2 1 344 237 36 GLU CB C 28.3 0.2 1 345 237 36 GLU CG C 36.3 0.2 1 346 237 36 GLU N N 115.0 0.2 1 347 238 37 ALA H H 7.47 0.02 1 348 238 37 ALA HA H 4.38 0.02 1 349 238 37 ALA HB H 1.36 0.02 1 350 238 37 ALA C C 176.1 0.2 1 351 238 37 ALA CA C 51.9 0.2 1 352 238 37 ALA CB C 20.3 0.2 1 353 238 37 ALA N N 121.1 0.2 1 354 239 38 ARG H H 8.13 0.02 1 355 239 38 ARG HA H 4.00 0.02 1 356 239 38 ARG HB2 H 1.58 0.02 1 357 239 38 ARG HB3 H 1.58 0.02 1 358 239 38 ARG HG2 H 1.26 0.02 1 359 239 38 ARG HG3 H 1.26 0.02 1 360 239 38 ARG HD2 H 3.09 0.02 1 361 239 38 ARG HD3 H 3.09 0.02 1 362 239 38 ARG C C 177.5 0.2 1 363 239 38 ARG CA C 55.9 0.2 1 364 239 38 ARG CB C 29.6 0.2 1 365 239 38 ARG CG C 27.9 0.2 1 366 239 38 ARG CD C 43.5 0.2 1 367 239 38 ARG N N 120.0 0.2 1 368 240 39 HIS H H 7.09 0.02 1 369 240 39 HIS HA H 4.02 0.02 1 370 240 39 HIS HB2 H 2.85 0.02 2 371 240 39 HIS HB3 H 1.69 0.02 2 372 240 39 HIS C C 175.7 0.2 1 373 240 39 HIS CA C 57.3 0.2 1 374 240 39 HIS CB C 29.2 0.2 1 375 240 39 HIS N N 120.7 0.2 1 376 241 40 GLY H H 8.03 0.02 1 377 241 40 GLY HA2 H 3.84 0.02 2 378 241 40 GLY HA3 H 3.61 0.02 2 379 241 40 GLY C C 175.4 0.2 1 380 241 40 GLY CA C 45.6 0.2 1 381 241 40 GLY N N 107.0 0.2 1 382 242 41 PHE H H 10.74 0.02 1 383 242 41 PHE HA H 4.67 0.02 1 384 242 41 PHE HB2 H 3.11 0.02 2 385 242 41 PHE HB3 H 2.19 0.02 2 386 242 41 PHE HD1 H 6.16 0.02 1 387 242 41 PHE HD2 H 6.16 0.02 1 388 242 41 PHE HE1 H 6.73 0.02 1 389 242 41 PHE HE2 H 6.73 0.02 1 390 242 41 PHE HZ H 6.85 0.02 1 391 242 41 PHE C C 175.1 0.2 1 392 242 41 PHE CA C 54.2 0.2 1 393 242 41 PHE CB C 39.3 0.2 1 394 242 41 PHE CD1 C 130.3 0.2 1 395 242 41 PHE CE1 C 130.5 0.2 1 396 242 41 PHE CZ C 129.8 0.2 1 397 242 41 PHE N N 124.0 0.2 1 398 243 42 GLU H H 8.86 0.02 1 399 243 42 GLU HA H 4.69 0.02 1 400 243 42 GLU HB2 H 1.96 0.02 2 401 243 42 GLU HB3 H 1.73 0.02 2 402 243 42 GLU HG2 H 2.30 0.02 2 403 243 42 GLU HG3 H 2.19 0.02 2 404 243 42 GLU C C 175.8 0.2 1 405 243 42 GLU CA C 54.4 0.2 1 406 243 42 GLU CB C 33.1 0.2 1 407 243 42 GLU CG C 36.1 0.2 1 408 243 42 GLU N N 119.3 0.2 1 409 244 43 THR H H 8.98 0.02 1 410 244 43 THR HA H 3.76 0.02 1 411 244 43 THR HB H 4.13 0.02 1 412 244 43 THR HG2 H 1.39 0.02 1 413 244 43 THR C C 175.3 0.2 1 414 244 43 THR CA C 65.7 0.2 1 415 244 43 THR CB C 69.3 0.2 1 416 244 43 THR CG2 C 23.3 0.2 1 417 244 43 THR N N 120.3 0.2 1 418 245 44 GLY H H 8.58 0.02 1 419 245 44 GLY HA2 H 4.46 0.02 2 420 245 44 GLY HA3 H 3.70 0.02 2 421 245 44 GLY C C 174.5 0.2 1 422 245 44 GLY CA C 44.6 0.2 1 423 245 44 GLY N N 117.1 0.2 1 424 246 45 ASP H H 7.97 0.02 1 425 246 45 ASP HA H 4.51 0.02 1 426 246 45 ASP HB2 H 2.50 0.02 2 427 246 45 ASP HB3 H 2.23 0.02 2 428 246 45 ASP C C 174.1 0.2 1 429 246 45 ASP CA C 55.3 0.2 1 430 246 45 ASP CB C 41.3 0.2 1 431 246 45 ASP N N 121.1 0.2 1 432 247 46 PHE H H 8.77 0.02 1 433 247 46 PHE HA H 5.16 0.02 1 434 247 46 PHE HB2 H 3.02 0.02 2 435 247 46 PHE HB3 H 2.37 0.02 2 436 247 46 PHE HD1 H 7.03 0.02 1 437 247 46 PHE HD2 H 7.03 0.02 1 438 247 46 PHE HE1 H 7.34 0.02 1 439 247 46 PHE HE2 H 7.34 0.02 1 440 247 46 PHE HZ H 7.21 0.02 1 441 247 46 PHE C C 176.5 0.2 1 442 247 46 PHE CA C 56.3 0.2 1 443 247 46 PHE CB C 41.8 0.2 1 444 247 46 PHE CD1 C 131.8 0.2 1 445 247 46 PHE CE1 C 131.4 0.2 1 446 247 46 PHE N N 118.0 0.2 1 447 248 47 VAL H H 8.72 0.02 1 448 248 47 VAL HA H 5.37 0.02 1 449 248 47 VAL HB H 1.62 0.02 1 450 248 47 VAL HG1 H -0.16 0.02 2 451 248 47 VAL HG2 H 0.45 0.02 2 452 248 47 VAL C C 175.2 0.2 1 453 248 47 VAL CA C 58.0 0.2 1 454 248 47 VAL CB C 35.8 0.2 1 455 248 47 VAL CG1 C 20.1 0.2 1 456 248 47 VAL CG2 C 18.1 0.2 1 457 248 47 VAL N N 110.8 0.2 1 458 249 48 SER H H 8.45 0.02 1 459 249 48 SER HA H 4.74 0.02 1 460 249 48 SER HB2 H 3.80 0.02 2 461 249 48 SER HB3 H 3.49 0.02 2 462 249 48 SER C C 172.5 0.2 1 463 249 48 SER CA C 56.5 0.2 1 464 249 48 SER CB C 65.7 0.2 1 465 249 48 SER N N 112.5 0.2 1 466 250 49 PHE H H 8.50 0.02 1 467 250 49 PHE HA H 5.74 0.02 1 468 250 49 PHE HB2 H 3.16 0.02 2 469 250 49 PHE HB3 H 2.83 0.02 2 470 250 49 PHE HD1 H 7.27 0.02 1 471 250 49 PHE HD2 H 7.27 0.02 1 472 250 49 PHE C C 175.4 0.2 1 473 250 49 PHE CA C 57.1 0.2 1 474 250 49 PHE CB C 43.6 0.2 1 475 250 49 PHE N N 119.6 0.2 1 476 251 50 SER H H 8.84 0.02 1 477 251 50 SER HA H 4.79 0.02 1 478 251 50 SER HB2 H 3.92 0.02 2 479 251 50 SER HB3 H 3.85 0.02 2 480 251 50 SER C C 173.3 0.2 1 481 251 50 SER CA C 57.9 0.2 1 482 251 50 SER CB C 66.3 0.2 1 483 251 50 SER N N 113.1 0.2 1 484 252 51 GLU H H 8.85 0.02 1 485 252 51 GLU HA H 3.80 0.02 1 486 252 51 GLU HB2 H 2.39 0.02 2 487 252 51 GLU HB3 H 2.32 0.02 2 488 252 51 GLU HG2 H 2.26 0.02 2 489 252 51 GLU HG3 H 2.19 0.02 2 490 252 51 GLU C C 175.1 0.2 1 491 252 51 GLU CA C 57.9 0.2 1 492 252 51 GLU CB C 27.5 0.2 1 493 252 51 GLU CG C 36.5 0.2 1 494 252 51 GLU N N 112.9 0.2 1 495 253 52 VAL H H 9.50 0.02 1 496 253 52 VAL HA H 3.43 0.02 1 497 253 52 VAL HB H 2.00 0.02 1 498 253 52 VAL HG1 H 0.87 0.02 2 499 253 52 VAL HG2 H 1.11 0.02 2 500 253 52 VAL C C 177.6 0.2 1 501 253 52 VAL CA C 65.3 0.2 1 502 253 52 VAL CB C 31.7 0.2 1 503 253 52 VAL CG1 C 23.5 0.2 1 504 253 52 VAL CG2 C 23.1 0.2 1 505 253 52 VAL N N 122.0 0.2 1 506 254 53 GLN H H 8.33 0.02 1 507 254 53 GLN HA H 4.50 0.02 1 508 254 53 GLN HB2 H 1.91 0.02 1 509 254 53 GLN HB3 H 1.91 0.02 1 510 254 53 GLN HG2 H 2.34 0.02 1 511 254 53 GLN HG3 H 2.34 0.02 1 512 254 53 GLN C C 178.1 0.2 1 513 254 53 GLN CA C 54.8 0.2 1 514 254 53 GLN CB C 28.9 0.2 1 515 254 53 GLN CG C 33.6 0.2 1 516 254 53 GLN N N 124.3 0.2 1 517 255 54 GLY H H 9.55 0.02 1 518 255 54 GLY HA2 H 4.78 0.02 2 519 255 54 GLY HA3 H 3.40 0.02 2 520 255 54 GLY C C 175.2 0.2 1 521 255 54 GLY CA C 46.5 0.2 1 522 255 54 GLY N N 116.7 0.2 1 523 256 55 MET H H 6.53 0.02 1 524 256 55 MET HA H 4.44 0.02 1 525 256 55 MET HB2 H 1.94 0.02 1 526 256 55 MET HB3 H 1.94 0.02 1 527 256 55 MET HG2 H 3.14 0.02 1 528 256 55 MET HG3 H 3.14 0.02 1 529 256 55 MET HE H 2.12 0.02 1 530 256 55 MET C C 176.5 0.2 1 531 256 55 MET CA C 54.5 0.2 1 532 256 55 MET CB C 34.2 0.2 1 533 256 55 MET CG C 32.7 0.2 1 534 256 55 MET CE C 16.8 0.2 1 535 256 55 MET N N 127.6 0.2 1 536 257 56 ILE H H 7.60 0.02 1 537 257 56 ILE HA H 3.67 0.02 1 538 257 56 ILE HB H 2.13 0.02 1 539 257 56 ILE HG12 H 1.03 0.02 1 540 257 56 ILE HG13 H 1.03 0.02 1 541 257 56 ILE HG2 H 0.91 0.02 1 542 257 56 ILE HD1 H 0.82 0.02 1 543 257 56 ILE C C 178.1 0.2 1 544 257 56 ILE CA C 63.7 0.2 1 545 257 56 ILE CB C 37.2 0.2 1 546 257 56 ILE CG1 C 25.8 0.2 1 547 257 56 ILE CG2 C 19.0 0.2 1 548 257 56 ILE CD1 C 13.8 0.2 1 549 257 56 ILE N N 114.2 0.2 1 550 258 57 GLN H H 8.42 0.02 1 551 258 57 GLN HA H 3.64 0.02 1 552 258 57 GLN HB2 H 0.83 0.02 2 553 258 57 GLN HB3 H 0.47 0.02 2 554 258 57 GLN HG2 H 2.19 0.02 2 555 258 57 GLN HG3 H 2.38 0.02 2 556 258 57 GLN HE21 H 7.61 0.02 2 557 258 57 GLN HE22 H 7.21 0.02 2 558 258 57 GLN C C 177.8 0.2 1 559 258 57 GLN CA C 59.6 0.2 1 560 258 57 GLN CB C 24.4 0.2 1 561 258 57 GLN CG C 34.6 0.2 1 562 258 57 GLN N N 121.6 0.2 1 563 258 57 GLN NE2 N 111.3 0.2 1 564 259 58 LEU H H 7.10 0.02 1 565 259 58 LEU HA H 3.95 0.02 1 566 259 58 LEU HB2 H 1.28 0.02 2 567 259 58 LEU HB3 H 1.00 0.02 2 568 259 58 LEU HG H 1.32 0.02 1 569 259 58 LEU HD1 H 0.33 0.02 2 570 259 58 LEU HD2 H 0.51 0.02 2 571 259 58 LEU C C 178.1 0.2 1 572 259 58 LEU CA C 56.2 0.2 1 573 259 58 LEU CB C 42.0 0.2 1 574 259 58 LEU CG C 26.8 0.2 1 575 259 58 LEU CD1 C 25.8 0.2 1 576 259 58 LEU CD2 C 22.7 0.2 1 577 259 58 LEU N N 113.6 0.2 1 578 260 59 ASN H H 7.09 0.02 1 579 260 59 ASN HA H 4.62 0.02 1 580 260 59 ASN HB2 H 2.81 0.02 2 581 260 59 ASN HB3 H 2.76 0.02 2 582 260 59 ASN HD21 H 7.78 0.02 2 583 260 59 ASN HD22 H 7.24 0.02 2 584 260 59 ASN C C 177.2 0.2 1 585 260 59 ASN CA C 54.3 0.2 1 586 260 59 ASN CB C 37.8 0.2 1 587 260 59 ASN N N 115.4 0.2 1 588 260 59 ASN ND2 N 111.1 0.2 1 589 261 60 GLY H H 8.59 0.02 1 590 261 60 GLY HA2 H 4.18 0.02 2 591 261 60 GLY HA3 H 3.89 0.02 2 592 261 60 GLY C C 174.9 0.2 1 593 261 60 GLY CA C 45.9 0.2 1 594 261 60 GLY N N 110.6 0.2 1 595 262 61 CYS H H 7.40 0.02 1 596 262 61 CYS HA H 4.57 0.02 1 597 262 61 CYS HB2 H 3.00 0.02 2 598 262 61 CYS HB3 H 3.37 0.02 2 599 262 61 CYS C C 175.1 0.2 1 600 262 61 CYS CA C 58.0 0.2 1 601 262 61 CYS CB C 29.1 0.2 1 602 262 61 CYS N N 116.8 0.2 1 603 263 62 GLN H H 8.67 0.02 1 604 263 62 GLN HA H 4.45 0.02 1 605 263 62 GLN HB2 H 2.19 0.02 2 606 263 62 GLN HB3 H 2.05 0.02 2 607 263 62 GLN HG2 H 2.56 0.02 1 608 263 62 GLN HG3 H 2.56 0.02 1 609 263 62 GLN HE21 H 7.72 0.02 2 610 263 62 GLN HE22 H 6.92 0.02 2 611 263 62 GLN CA C 54.9 0.2 1 612 263 62 GLN CB C 27.3 0.2 1 613 263 62 GLN CG C 33.8 0.2 1 614 263 62 GLN N N 122.5 0.2 1 615 263 62 GLN NE2 N 113.0 0.2 1 616 264 63 PRO HA H 4.54 0.02 1 617 264 63 PRO HB2 H 1.92 0.02 2 618 264 63 PRO HB3 H 1.85 0.02 2 619 264 63 PRO HG2 H 2.09 0.02 2 620 264 63 PRO HG3 H 1.91 0.02 2 621 264 63 PRO HD2 H 3.94 0.02 2 622 264 63 PRO HD3 H 3.57 0.02 2 623 264 63 PRO C C 176.0 0.2 1 624 264 63 PRO CA C 63.8 0.2 1 625 264 63 PRO CB C 32.2 0.2 1 626 264 63 PRO CG C 28.5 0.2 1 627 264 63 PRO CD C 50.3 0.2 1 628 265 64 MET H H 9.11 0.02 1 629 265 64 MET HA H 4.96 0.02 1 630 265 64 MET HB2 H 2.13 0.02 1 631 265 64 MET HB3 H 2.13 0.02 1 632 265 64 MET HG2 H 2.73 0.02 2 633 265 64 MET HG3 H 2.62 0.02 2 634 265 64 MET HE H 2.45 0.02 1 635 265 64 MET C C 173.6 0.2 1 636 265 64 MET CA C 53.9 0.2 1 637 265 64 MET CB C 36.1 0.2 1 638 265 64 MET CG C 30.7 0.2 1 639 265 64 MET CE C 18.4 0.2 1 640 265 64 MET N N 122.0 0.2 1 641 266 65 GLU H H 8.37 0.02 1 642 266 65 GLU HA H 3.85 0.02 1 643 266 65 GLU HB2 H 1.42 0.02 2 644 266 65 GLU HB3 H 1.33 0.02 2 645 266 65 GLU HG2 H 1.83 0.02 2 646 266 65 GLU HG3 H 1.50 0.02 2 647 266 65 GLU C C 177.8 0.2 1 648 266 65 GLU CA C 55.8 0.2 1 649 266 65 GLU CB C 30.7 0.2 1 650 266 65 GLU CG C 36.3 0.2 1 651 266 65 GLU N N 125.7 0.2 1 652 267 66 ILE H H 7.95 0.02 1 653 267 66 ILE HA H 5.44 0.02 1 654 267 66 ILE HB H 1.87 0.02 1 655 267 66 ILE HG12 H 1.05 0.02 2 656 267 66 ILE HG13 H 0.95 0.02 2 657 267 66 ILE HG2 H 0.63 0.02 1 658 267 66 ILE HD1 H -0.05 0.02 1 659 267 66 ILE C C 177.0 0.2 1 660 267 66 ILE CA C 59.4 0.2 1 661 267 66 ILE CB C 41.7 0.2 1 662 267 66 ILE CG1 C 25.2 0.2 1 663 267 66 ILE CG2 C 20.4 0.2 1 664 267 66 ILE CD1 C 14.6 0.2 1 665 267 66 ILE N N 117.3 0.2 1 666 268 67 LYS H H 7.92 0.02 1 667 268 67 LYS HA H 4.67 0.02 1 668 268 67 LYS HB2 H 1.85 0.02 2 669 268 67 LYS HB3 H 1.77 0.02 2 670 268 67 LYS HD2 H 1.57 0.02 2 671 268 67 LYS HD3 H 1.52 0.02 2 672 268 67 LYS C C 175.6 0.2 1 673 268 67 LYS CA C 55.8 0.2 1 674 268 67 LYS CB C 34.0 0.2 1 675 268 67 LYS CG C 25.0 0.2 1 676 268 67 LYS CD C 29.6 0.2 1 677 268 67 LYS CE C 42.2 0.2 1 678 268 67 LYS N N 121.5 0.2 1 679 269 68 VAL H H 8.90 0.02 1 680 269 68 VAL HA H 3.94 0.02 1 681 269 68 VAL HB H 2.15 0.02 1 682 269 68 VAL HG1 H 0.79 0.02 2 683 269 68 VAL HG2 H 1.24 0.02 2 684 269 68 VAL C C 175.8 0.2 1 685 269 68 VAL CA C 65.5 0.2 1 686 269 68 VAL CB C 31.8 0.2 1 687 269 68 VAL CG1 C 23.6 0.2 1 688 269 68 VAL CG2 C 22.4 0.2 1 689 269 68 VAL N N 126.4 0.2 1 690 270 69 LEU H H 8.10 0.02 1 691 270 69 LEU HA H 4.57 0.02 1 692 270 69 LEU HB2 H 1.52 0.02 2 693 270 69 LEU HB3 H 1.57 0.02 2 694 270 69 LEU HG H 1.69 0.02 1 695 270 69 LEU HD1 H 0.83 0.02 2 696 270 69 LEU HD2 H 0.81 0.02 2 697 270 69 LEU C C 176.3 0.2 1 698 270 69 LEU CA C 54.8 0.2 1 699 270 69 LEU CB C 43.3 0.2 1 700 270 69 LEU CG C 27.1 0.2 1 701 270 69 LEU CD1 C 26.6 0.2 1 702 270 69 LEU CD2 C 22.3 0.2 1 703 270 69 LEU N N 129.2 0.2 1 704 271 70 GLY H H 8.16 0.02 1 705 271 70 GLY HA2 H 4.12 0.02 1 706 271 70 GLY HA3 H 4.12 0.02 1 707 271 70 GLY CA C 45.0 0.2 1 708 271 70 GLY N N 109.9 0.2 1 709 272 71 PRO HA H 4.01 0.02 1 710 272 71 PRO HB2 H 1.99 0.02 2 711 272 71 PRO HB3 H 1.12 0.02 2 712 272 71 PRO HG2 H 1.86 0.02 1 713 272 71 PRO HG3 H 1.86 0.02 1 714 272 71 PRO HD2 H 3.67 0.02 2 715 272 71 PRO HD3 H 3.52 0.02 2 716 272 71 PRO CA C 64.2 0.2 1 717 272 71 PRO CB C 31.6 0.2 1 718 272 71 PRO CG C 27.0 0.2 1 719 272 71 PRO CD C 50.9 0.2 1 720 273 72 TYR H H 8.28 0.02 1 721 273 72 TYR HA H 5.07 0.02 1 722 273 72 TYR HB2 H 3.25 0.02 2 723 273 72 TYR HB3 H 2.96 0.02 2 724 273 72 TYR HD1 H 7.04 0.02 1 725 273 72 TYR HD2 H 7.04 0.02 1 726 273 72 TYR HE1 H 6.67 0.02 1 727 273 72 TYR HE2 H 6.67 0.02 1 728 273 72 TYR C C 175.7 0.2 1 729 273 72 TYR CA C 56.5 0.2 1 730 273 72 TYR CB C 39.9 0.2 1 731 273 72 TYR CD1 C 134.0 0.2 1 732 273 72 TYR CE1 C 118.2 0.2 1 733 273 72 TYR N N 110.2 0.2 1 734 274 73 THR H H 7.32 0.02 1 735 274 73 THR HA H 5.99 0.02 1 736 274 73 THR HB H 3.79 0.02 1 737 274 73 THR HG2 H 1.20 0.02 1 738 274 73 THR C C 175.4 0.2 1 739 274 73 THR CA C 59.5 0.2 1 740 274 73 THR CB C 73.4 0.2 1 741 274 73 THR CG2 C 23.4 0.2 1 742 274 73 THR N N 109.8 0.2 1 743 275 74 PHE H H 8.45 0.02 1 744 275 74 PHE HA H 5.23 0.02 1 745 275 74 PHE HB2 H 2.96 0.02 2 746 275 74 PHE HB3 H 3.15 0.02 2 747 275 74 PHE HD1 H 6.52 0.02 1 748 275 74 PHE HD2 H 6.52 0.02 1 749 275 74 PHE HE1 H 6.85 0.02 1 750 275 74 PHE HE2 H 6.85 0.02 1 751 275 74 PHE HZ H 6.74 0.02 1 752 275 74 PHE C C 171.6 0.2 1 753 275 74 PHE CA C 56.6 0.2 1 754 275 74 PHE CB C 41.4 0.2 1 755 275 74 PHE CD1 C 133.0 0.2 1 756 275 74 PHE CE1 C 127.3 0.2 1 757 275 74 PHE CZ C 130.5 0.2 1 758 275 74 PHE N N 117.6 0.2 1 759 276 75 SER H H 10.23 0.02 1 760 276 75 SER HA H 5.75 0.02 1 761 276 75 SER HB2 H 3.64 0.02 2 762 276 75 SER HB3 H 4.08 0.02 2 763 276 75 SER C C 175.0 0.2 1 764 276 75 SER CA C 56.4 0.2 1 765 276 75 SER CB C 66.7 0.2 1 766 276 75 SER N N 117.0 0.2 1 767 277 76 ILE H H 8.37 0.02 1 768 277 76 ILE HA H 4.88 0.02 1 769 277 76 ILE HB H 2.52 0.02 1 770 277 76 ILE HG12 H 1.88 0.02 1 771 277 76 ILE HG13 H 1.88 0.02 1 772 277 76 ILE HG2 H 1.23 0.02 1 773 277 76 ILE HD1 H 0.86 0.02 1 774 277 76 ILE C C 174.7 0.2 1 775 277 76 ILE CA C 59.9 0.2 1 776 277 76 ILE CB C 39.4 0.2 1 777 277 76 ILE CG1 C 26.1 0.2 1 778 277 76 ILE CG2 C 20.5 0.2 1 779 277 76 ILE CD1 C 15.1 0.2 1 780 277 76 ILE N N 112.5 0.2 1 781 278 77 CYS H H 6.89 0.02 1 782 278 77 CYS HA H 4.87 0.02 1 783 278 77 CYS HB2 H 3.61 0.02 2 784 278 77 CYS HB3 H 3.00 0.02 2 785 278 77 CYS C C 172.7 0.2 1 786 278 77 CYS CA C 56.1 0.2 1 787 278 77 CYS CB C 31.0 0.2 1 788 278 77 CYS N N 117.2 0.2 1 789 279 78 ASP H H 8.39 0.02 1 790 279 78 ASP HA H 4.68 0.02 1 791 279 78 ASP HB2 H 2.67 0.02 1 792 279 78 ASP HB3 H 2.67 0.02 1 793 279 78 ASP C C 177.2 0.2 1 794 279 78 ASP CA C 55.7 0.2 1 795 279 78 ASP CB C 40.0 0.2 1 796 279 78 ASP N N 117.3 0.2 1 797 280 79 THR H H 8.85 0.02 1 798 280 79 THR HA H 3.27 0.02 1 799 280 79 THR HB H 4.67 0.02 1 800 280 79 THR HG2 H 1.11 0.02 1 801 280 79 THR C C 176.4 0.2 1 802 280 79 THR CA C 60.3 0.2 1 803 280 79 THR CB C 68.6 0.2 1 804 280 79 THR CG2 C 23.4 0.2 1 805 280 79 THR N N 121.6 0.2 1 806 281 80 SER H H 8.30 0.02 1 807 281 80 SER HA H 4.29 0.02 1 808 281 80 SER HB2 H 3.41 0.02 1 809 281 80 SER HB3 H 3.41 0.02 1 810 281 80 SER C C 174.3 0.2 1 811 281 80 SER CA C 62.9 0.2 1 812 281 80 SER CB C 63.0 0.2 1 813 281 80 SER N N 118.4 0.2 1 814 282 81 ASN H H 8.18 0.02 1 815 282 81 ASN HA H 5.02 0.02 1 816 282 81 ASN HB2 H 2.89 0.02 2 817 282 81 ASN HB3 H 2.46 0.02 2 818 282 81 ASN HD21 H 7.41 0.02 2 819 282 81 ASN HD22 H 6.79 0.02 2 820 282 81 ASN C C 175.7 0.2 1 821 282 81 ASN CA C 52.3 0.2 1 822 282 81 ASN CB C 39.1 0.2 1 823 282 81 ASN N N 116.4 0.2 1 824 282 81 ASN ND2 N 113.5 0.2 1 825 283 82 PHE H H 7.60 0.02 1 826 283 82 PHE HA H 4.76 0.02 1 827 283 82 PHE HB2 H 3.42 0.02 1 828 283 82 PHE HB3 H 3.42 0.02 1 829 283 82 PHE HD1 H 7.09 0.02 1 830 283 82 PHE HD2 H 7.09 0.02 1 831 283 82 PHE C C 174.8 0.2 1 832 283 82 PHE CA C 53.0 0.2 1 833 283 82 PHE CB C 37.8 0.2 1 834 283 82 PHE CD1 C 129.8 0.2 1 835 283 82 PHE N N 121.2 0.2 1 836 284 83 SER H H 8.08 0.02 1 837 284 83 SER HA H 4.54 0.02 1 838 284 83 SER HB2 H 4.12 0.02 2 839 284 83 SER HB3 H 3.99 0.02 2 840 284 83 SER C C 172.2 0.2 1 841 284 83 SER CA C 59.2 0.2 1 842 284 83 SER CB C 63.8 0.2 1 843 284 83 SER N N 115.4 0.2 1 844 285 84 ASP H H 7.91 0.02 1 845 285 84 ASP HA H 4.13 0.02 1 846 285 84 ASP HB2 H 2.48 0.02 2 847 285 84 ASP HB3 H 2.40 0.02 2 848 285 84 ASP C C 176.1 0.2 1 849 285 84 ASP CA C 55.7 0.2 1 850 285 84 ASP CB C 40.7 0.2 1 851 285 84 ASP N N 117.5 0.2 1 852 286 85 TYR H H 9.20 0.02 1 853 286 85 TYR HA H 3.87 0.02 1 854 286 85 TYR HB2 H 3.14 0.02 1 855 286 85 TYR HB3 H 3.14 0.02 1 856 286 85 TYR HD1 H 6.86 0.02 1 857 286 85 TYR HD2 H 6.86 0.02 1 858 286 85 TYR HE1 H 6.99 0.02 1 859 286 85 TYR HE2 H 6.99 0.02 1 860 286 85 TYR C C 175.1 0.2 1 861 286 85 TYR CA C 61.2 0.2 1 862 286 85 TYR CB C 39.9 0.2 1 863 286 85 TYR N N 121.7 0.2 1 864 287 86 ILE H H 7.18 0.02 1 865 287 86 ILE HA H 4.04 0.02 1 866 287 86 ILE HB H 0.82 0.02 1 867 287 86 ILE HG12 H 1.44 0.02 1 868 287 86 ILE HG13 H 1.44 0.02 1 869 287 86 ILE HG2 H 0.74 0.02 1 870 287 86 ILE HD1 H 0.77 0.02 1 871 287 86 ILE C C 173.8 0.2 1 872 287 86 ILE CA C 63.1 0.2 1 873 287 86 ILE CB C 41.0 0.2 1 874 287 86 ILE CG1 C 27.5 0.2 1 875 287 86 ILE CG2 C 16.6 0.2 1 876 287 86 ILE CD1 C 13.1 0.2 1 877 287 86 ILE N N 126.1 0.2 1 878 288 87 ARG H H 6.31 0.02 1 879 288 87 ARG HA H 4.51 0.02 1 880 288 87 ARG HB2 H 2.11 0.02 2 881 288 87 ARG HB3 H 1.72 0.02 2 882 288 87 ARG HG2 H 1.16 0.02 1 883 288 87 ARG HG3 H 1.16 0.02 1 884 288 87 ARG HD2 H 3.19 0.02 2 885 288 87 ARG HD3 H 3.06 0.02 2 886 288 87 ARG C C 173.8 0.2 1 887 288 87 ARG CA C 56.0 0.2 1 888 288 87 ARG CB C 31.0 0.2 1 889 288 87 ARG CG C 25.4 0.2 1 890 288 87 ARG CD C 43.0 0.2 1 891 288 87 ARG N N 111.2 0.2 1 892 289 88 GLY H H 8.54 0.02 1 893 289 88 GLY HA2 H 4.30 0.02 2 894 289 88 GLY HA3 H 4.11 0.02 2 895 289 88 GLY C C 174.0 0.2 1 896 289 88 GLY CA C 44.9 0.2 1 897 289 88 GLY N N 105.1 0.2 1 898 290 89 GLY H H 8.17 0.02 1 899 290 89 GLY HA2 H 4.68 0.02 2 900 290 89 GLY HA3 H 4.12 0.02 2 901 290 89 GLY C C 173.4 0.2 1 902 290 89 GLY CA C 44.6 0.2 1 903 290 89 GLY N N 105.8 0.2 1 904 291 90 ILE H H 9.40 0.02 1 905 291 90 ILE HA H 4.93 0.02 1 906 291 90 ILE HB H 1.76 0.02 1 907 291 90 ILE HG12 H 1.53 0.02 1 908 291 90 ILE HG13 H 1.53 0.02 1 909 291 90 ILE HG2 H 0.85 0.02 1 910 291 90 ILE HD1 H 0.82 0.02 1 911 291 90 ILE C C 175.4 0.2 1 912 291 90 ILE CA C 60.5 0.2 1 913 291 90 ILE CB C 41.0 0.2 1 914 291 90 ILE CG1 C 27.7 0.2 1 915 291 90 ILE CG2 C 17.2 0.2 1 916 291 90 ILE CD1 C 13.4 0.2 1 917 291 90 ILE N N 126.3 0.2 1 918 292 91 VAL H H 9.43 0.02 1 919 292 91 VAL HA H 4.96 0.02 1 920 292 91 VAL HB H 1.62 0.02 1 921 292 91 VAL HG1 H 1.11 0.02 2 922 292 91 VAL HG2 H 0.34 0.02 2 923 292 91 VAL C C 173.1 0.2 1 924 292 91 VAL CA C 57.8 0.2 1 925 292 91 VAL CB C 34.4 0.2 1 926 292 91 VAL CG1 C 19.3 0.2 1 927 292 91 VAL CG2 C 22.3 0.2 1 928 292 91 VAL N N 127.9 0.2 1 929 293 92 SER H H 8.62 0.02 1 930 293 92 SER HA H 5.38 0.02 1 931 293 92 SER HB2 H 3.66 0.02 2 932 293 92 SER HB3 H 3.40 0.02 2 933 293 92 SER C C 173.3 0.2 1 934 293 92 SER CA C 56.7 0.2 1 935 293 92 SER CB C 66.0 0.2 1 936 293 92 SER N N 121.0 0.2 1 937 294 93 GLN H H 8.40 0.02 1 938 294 93 GLN HA H 4.25 0.02 1 939 294 93 GLN HB2 H 1.99 0.02 2 940 294 93 GLN HB3 H 1.89 0.02 2 941 294 93 GLN HG2 H 2.01 0.02 2 942 294 93 GLN HG3 H 1.75 0.02 2 943 294 93 GLN HE21 H 7.95 0.02 2 944 294 93 GLN HE22 H 6.80 0.02 2 945 294 93 GLN C C 175.6 0.2 1 946 294 93 GLN CA C 56.2 0.2 1 947 294 93 GLN CB C 30.7 0.2 1 948 294 93 GLN CG C 34.3 0.2 1 949 294 93 GLN N N 122.5 0.2 1 950 294 93 GLN NE2 N 114.7 0.2 1 951 295 94 VAL H H 8.58 0.02 1 952 295 94 VAL HA H 4.11 0.02 1 953 295 94 VAL HB H 1.70 0.02 1 954 295 94 VAL HG1 H 0.75 0.02 2 955 295 94 VAL HG2 H 0.73 0.02 2 956 295 94 VAL C C 175.5 0.2 1 957 295 94 VAL CA C 61.4 0.2 1 958 295 94 VAL CB C 33.6 0.2 1 959 295 94 VAL CG1 C 21.0 0.2 1 960 295 94 VAL CG2 C 20.6 0.2 1 961 295 94 VAL N N 124.5 0.2 1 962 296 95 LYS H H 8.51 0.02 1 963 296 95 LYS HA H 4.35 0.02 1 964 296 95 LYS HB2 H 1.67 0.02 1 965 296 95 LYS HB3 H 1.67 0.02 1 966 296 95 LYS HG2 H 1.38 0.02 1 967 296 95 LYS HG3 H 1.38 0.02 1 968 296 95 LYS HD2 H 1.57 0.02 1 969 296 95 LYS HD3 H 1.57 0.02 1 970 296 95 LYS C C 175.8 0.2 1 971 296 95 LYS CA C 55.7 0.2 1 972 296 95 LYS CB C 32.3 0.2 1 973 296 95 LYS CG C 24.7 0.2 1 974 296 95 LYS CD C 28.9 0.2 1 975 296 95 LYS CE C 42.1 0.2 1 976 296 95 LYS N N 126.4 0.2 1 977 297 96 VAL H H 8.04 0.02 1 978 297 96 VAL HA H 4.28 0.02 1 979 297 96 VAL HB H 1.81 0.02 1 980 297 96 VAL HG1 H 0.68 0.02 2 981 297 96 VAL HG2 H 0.67 0.02 2 982 297 96 VAL CA C 59.5 0.2 1 983 297 96 VAL CB C 32.6 0.2 1 984 297 96 VAL CG1 C 20.8 0.2 1 985 297 96 VAL CG2 C 20.8 0.2 1 986 297 96 VAL N N 123.1 0.2 1 987 298 97 PRO HA H 4.31 0.02 1 988 298 97 PRO HB2 H 2.18 0.02 2 989 298 97 PRO HB3 H 1.80 0.02 2 990 298 97 PRO HG2 H 1.93 0.02 2 991 298 97 PRO HG3 H 1.85 0.02 2 992 298 97 PRO HD2 H 3.68 0.02 2 993 298 97 PRO HD3 H 3.50 0.02 2 994 298 97 PRO C C 176.6 0.2 1 995 298 97 PRO CA C 63.1 0.2 1 996 298 97 PRO CB C 32.1 0.2 1 997 298 97 PRO CG C 27.4 0.2 1 998 298 97 PRO CD C 51.0 0.2 1 999 299 98 LYS H H 8.27 0.02 1 1000 299 98 LYS CA C 56.3 0.2 1 1001 299 98 LYS CB C 32.4 0.2 1 1002 299 98 LYS N N 121.7 0.2 1 1003 300 99 LYS HA H 4.30 0.02 1 1004 300 99 LYS HB2 H 1.73 0.02 1 1005 300 99 LYS HB3 H 1.73 0.02 1 1006 300 99 LYS C C 176.3 0.2 1 1007 300 99 LYS CA C 56.2 0.2 1 1008 300 99 LYS CB C 33.2 0.2 1 1009 300 99 LYS CG C 24.8 0.2 1 1010 300 99 LYS CD C 29.2 0.2 1 1011 300 99 LYS CE C 42.1 0.2 1 1012 301 100 ILE H H 8.14 0.02 1 1013 301 100 ILE HG2 H 0.77 0.02 1 1014 301 100 ILE HD1 H 0.80 0.02 1 1015 301 100 ILE CA C 60.9 0.2 1 1016 301 100 ILE CB C 39.0 0.2 1 1017 301 100 ILE CG2 C 17.6 0.2 1 1018 301 100 ILE CD1 C 12.9 0.2 1 1019 301 100 ILE N N 122.5 0.2 1 1020 302 101 SER C C 173.0 0.2 1 1021 302 101 SER CA C 58.2 0.2 1 1022 302 101 SER CB C 64.0 0.2 1 1023 303 102 PHE H H 8.00 0.02 1 1024 303 102 PHE CA C 52.7 0.2 1 1025 303 102 PHE CB C 43.1 0.2 1 1026 303 102 PHE N N 123.1 0.2 1 1027 304 103 LYS HA H 4.29 0.02 1 1028 304 103 LYS C C 176.0 0.2 1 1029 304 103 LYS CA C 56.2 0.2 1 1030 304 103 LYS CB C 33.3 0.2 1 1031 304 103 LYS CG C 24.7 0.2 1 1032 304 103 LYS CD C 29.1 0.2 1 1033 304 103 LYS CE C 42.0 0.2 1 1034 305 104 SER H H 8.17 0.02 1 1035 305 104 SER HA H 4.41 0.02 1 1036 305 104 SER HB2 H 3.82 0.02 1 1037 305 104 SER HB3 H 3.82 0.02 1 1038 305 104 SER C C 173.9 0.2 1 1039 305 104 SER CA C 58.1 0.2 1 1040 305 104 SER CB C 63.9 0.2 1 1041 305 104 SER N N 117.1 0.2 1 1042 306 105 LEU H H 8.22 0.02 1 1043 306 105 LEU HA H 4.60 0.02 1 1044 306 105 LEU CA C 53.2 0.2 1 1045 306 105 LEU CB C 41.9 0.2 1 1046 306 105 LEU N N 125.3 0.2 1 1047 307 106 PRO HA H 4.38 0.02 1 1048 307 106 PRO HB2 H 2.28 0.02 2 1049 307 106 PRO HB3 H 1.90 0.02 2 1050 307 106 PRO C C 176.7 0.2 1 1051 307 106 PRO CA C 63.2 0.2 1 1052 307 106 PRO CB C 32.0 0.2 1 1053 307 106 PRO CG C 27.4 0.2 1 1054 307 106 PRO CD C 50.5 0.2 1 1055 308 107 ALA H H 8.32 0.02 1 1056 308 107 ALA HA H 4.26 0.02 1 1057 308 107 ALA HB H 1.38 0.02 1 1058 308 107 ALA C C 177.9 0.2 1 1059 308 107 ALA CA C 52.8 0.2 1 1060 308 107 ALA CB C 19.2 0.2 1 1061 308 107 ALA N N 123.9 0.2 1 1062 309 108 SER H H 8.15 0.02 1 1063 309 108 SER HA H 4.38 0.02 1 1064 309 108 SER HB2 H 3.84 0.02 1 1065 309 108 SER HB3 H 3.84 0.02 1 1066 309 108 SER C C 174.3 0.2 1 1067 309 108 SER CA C 58.2 0.2 1 1068 309 108 SER CB C 63.8 0.2 1 1069 309 108 SER N N 114.3 0.2 1 1070 310 109 LEU H H 8.19 0.02 1 1071 310 109 LEU HA H 4.40 0.02 1 1072 310 109 LEU HB2 H 1.62 0.02 1 1073 310 109 LEU HB3 H 1.62 0.02 1 1074 310 109 LEU HD1 H 0.91 0.02 2 1075 310 109 LEU HD2 H 0.86 0.02 2 1076 310 109 LEU C C 176.9 0.2 1 1077 310 109 LEU CA C 55.3 0.2 1 1078 310 109 LEU CB C 42.4 0.2 1 1079 310 109 LEU CG C 27.1 0.2 1 1080 310 109 LEU CD1 C 24.9 0.2 1 1081 310 109 LEU CD2 C 23.6 0.2 1 1082 310 109 LEU N N 124.0 0.2 1 1083 311 110 VAL H H 8.00 0.02 1 1084 311 110 VAL HA H 4.13 0.02 1 1085 311 110 VAL HB H 2.07 0.02 1 1086 311 110 VAL HG1 H 0.93 0.02 2 1087 311 110 VAL HG2 H 0.91 0.02 2 1088 311 110 VAL C C 175.1 0.2 1 1089 311 110 VAL CA C 62.2 0.2 1 1090 311 110 VAL CB C 32.9 0.2 1 1091 311 110 VAL CG1 C 21.2 0.2 1 1092 311 110 VAL CG2 C 20.7 0.2 1 1093 311 110 VAL N N 121.0 0.2 1 1094 312 111 GLU H H 7.94 0.02 1 1095 312 111 GLU HA H 4.10 0.02 1 1096 312 111 GLU CA C 58.0 0.2 1 1097 312 111 GLU CB C 31.4 0.2 1 1098 312 111 GLU N N 129.8 0.2 1 stop_ save_