data_7137 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR assignments of the C-terminal domain of insulin-like growth factor binding protein 2 (IGFBP-2) ; _BMRB_accession_number 7137 _BMRB_flat_file_name bmr7137.str _Entry_type original _Submission_date 2006-06-02 _Accession_date 2006-06-02 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 KUANG ZHIHE . . 2 YAO SHENGGEN . . 3 KEIZER DAVID W. . 4 WANG CHUNXIAO C. . 5 BACH LEON A. . 6 FORBES BRIONY E. . 7 WALLACE JOHN C. . 8 NORTON RAYMOND S. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 544 "13C chemical shifts" 427 "15N chemical shifts" 94 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2008-07-16 update BMRB 'complete entry citation' 2006-10-30 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structure, Dynamics and Heparin Binding of the C-terminal Domain of Insulin-like Growth Factor-binding Protein-2 (IGFBP-2)' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 17020769 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 KUANG ZHIHE . . 2 YAO SHENGGEN . . 3 KEIZER DAVID W. . 4 WANG CHUNXIAO C. . 5 BACH LEON A. . 6 FORBES BRIONY E. . 7 WALLACE JOHN C. . 8 NORTON RAYMOND S. . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 364 _Journal_issue 4 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 690 _Page_last 701 _Year 2006 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'C-TERMINAL DOMAIN OF INSULIN-LIKE GROWTH FACTOR BINDING PROTEIN 2' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'C-TERMINAL DOMAIN OF INSULIN-LIKE GROWTH FACTOR BINDING PROTEIN 2' $IGFBP-2 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'all disulfide bound' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_IGFBP-2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common IGFBP-2 _Molecular_mass . _Mol_thiol_state 'all disulfide bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 107 _Mol_residue_sequence ; GPPPARTPCQQELDQVLERI STMRLPDERGPLEHLYSLHI PNCDKHGLYNLKQCKMSLNG QRGECWCVNPNTGKLIQGAP TIRGDPECHLFYNEQQEARG VHTQRMQ ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 183 GLY 2 184 PRO 3 185 PRO 4 186 PRO 5 187 ALA 6 188 ARG 7 189 THR 8 190 PRO 9 191 CYS 10 192 GLN 11 193 GLN 12 194 GLU 13 195 LEU 14 196 ASP 15 197 GLN 16 198 VAL 17 199 LEU 18 200 GLU 19 201 ARG 20 202 ILE 21 203 SER 22 204 THR 23 205 MET 24 206 ARG 25 207 LEU 26 208 PRO 27 209 ASP 28 210 GLU 29 211 ARG 30 212 GLY 31 213 PRO 32 214 LEU 33 215 GLU 34 216 HIS 35 217 LEU 36 218 TYR 37 219 SER 38 220 LEU 39 221 HIS 40 222 ILE 41 223 PRO 42 224 ASN 43 225 CYS 44 226 ASP 45 227 LYS 46 228 HIS 47 229 GLY 48 230 LEU 49 231 TYR 50 232 ASN 51 233 LEU 52 234 LYS 53 235 GLN 54 236 CYS 55 237 LYS 56 238 MET 57 239 SER 58 240 LEU 59 241 ASN 60 242 GLY 61 243 GLN 62 244 ARG 63 245 GLY 64 246 GLU 65 247 CYS 66 248 TRP 67 249 CYS 68 250 VAL 69 251 ASN 70 252 PRO 71 253 ASN 72 254 THR 73 255 GLY 74 256 LYS 75 257 LEU 76 258 ILE 77 259 GLN 78 260 GLY 79 261 ALA 80 262 PRO 81 263 THR 82 264 ILE 83 265 ARG 84 266 GLY 85 267 ASP 86 268 PRO 87 269 GLU 88 270 CYS 89 271 HIS 90 272 LEU 91 273 PHE 92 274 TYR 93 275 ASN 94 276 GLU 95 277 GLN 96 278 GLN 97 279 GLU 98 280 ALA 99 281 ARG 100 282 GLY 101 283 VAL 102 284 HIS 103 285 THR 104 286 GLN 105 287 ARG 106 288 MET 107 289 GLN 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 PDB 2H7T "Solution Structure Of The C-Terminal Domain Of Insulin-Like Growth Factor Binding Protein 2 (Igfbp-2)" 100.00 107 100.00 100.00 9.93e-73 EMBL CAA34373 "unnamed protein product [Homo sapiens]" 99.07 328 99.06 99.06 2.37e-68 GB AAA03246 "insulin-like growth factor binding protein 2 [Homo sapiens]" 99.07 328 100.00 100.00 9.50e-70 GB AAA36048 "insulin-like growth factor binding protein 2 [Homo sapiens]" 99.07 328 99.06 99.06 1.38e-68 GB AAB22308 "insulin-like growth factor binding protein-2 [Homo sapiens]" 99.07 328 100.00 100.00 9.50e-70 GB AAB23135 "insulin-like growth factor-binding protein-2 [Ovis aries]" 99.07 317 99.06 99.06 9.42e-69 GB AAC48728 "IGF binding protein-2 [Sus scrofa]" 99.07 316 98.11 98.11 1.64e-68 PRF 1812291A "insulin-like growth factor-binding protein 2" 99.07 317 99.06 99.06 1.03e-68 REF NP_000588 "insulin-like growth factor-binding protein 2 precursor [Homo sapiens]" 99.07 328 100.00 100.00 9.50e-70 REF NP_001009436 "insulin-like growth factor-binding protein 2 precursor [Ovis aries]" 99.07 317 99.06 99.06 9.42e-69 REF NP_776980 "insulin-like growth factor-binding protein 2 precursor [Bos taurus]" 99.07 317 99.06 99.06 1.03e-68 REF NP_999168 "insulin-like growth factor-binding protein 2 precursor [Sus scrofa]" 99.07 316 98.11 98.11 1.64e-68 REF XP_001087071 "PREDICTED: insulin-like growth factor binding protein 2, 36kDa [Macaca mulatta]" 99.07 326 99.06 99.06 6.92e-69 SP P13384 "RecName: Full=Insulin-like growth factor-binding protein 2; Short=IBP-2; Short=IGF-binding protein 2; Short=IGFBP-2; Flags: Pre" 99.07 317 99.06 99.06 1.03e-68 SP P18065 "RecName: Full=Insulin-like growth factor-binding protein 2; Short=IBP-2; Short=IGF-binding protein 2; Short=IGFBP-2; Flags: Pre" 99.07 325 100.00 100.00 8.01e-70 SP P24853 "RecName: Full=Insulin-like growth factor-binding protein 2; Short=IBP-2; Short=IGF-binding protein 2; Short=IGFBP-2; Short=pIGF" 99.07 316 98.11 98.11 1.64e-68 SP Q29400 "RecName: Full=Insulin-like growth factor-binding protein 2; Short=IBP-2; Short=IGF-binding protein 2; Short=IGFBP-2; Flags: Pre" 99.07 317 99.06 99.06 9.42e-69 TPG DAA32390 "TPA: insulin-like growth factor-binding protein 2 precursor [Bos taurus]" 69.16 285 100.00 100.00 1.54e-44 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $IGFBP-2 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $IGFBP-2 'recombinant technology' 'E. coli' Escherichia coli BL21(DE3) plasmid pET32a 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 $IGFBP-2 0.8 mM '[U-95% 15N]' 'Na acetate' 10 mM . azide 0.02 % . D2O 5 % . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $IGFBP-2 0.5 mM '[U-95% 13C; U-90% 15N]' 'Na acetate' 10 mM . azide 0.02 % . D2O 5 % . stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name xwinnmr _Version 3.5 _Details . save_ save_software_2 _Saveframe_category software _Name XEASY _Version 1.3 _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer BRUKER _Model AVANCE _Field_strength 500 _Details CRYOPROBE save_ save_600MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer BRUKER _Model DRX _Field_strength 600 _Details 'TRIPLE-RESONANCE PROBE AND TRIPLE-AXIS GRADIENTS' save_ ############################# # NMR applied experiments # ############################# save_1H15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name 1H15N_HSQC _Sample_label . save_ save_1H13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name 1H13C_HSQC _Sample_label . save_ save_1H15N_NOESY-HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name 1H15N_NOESY-HSQC _Sample_label . save_ save_1H13C_NOESY-HSQC_4 _Saveframe_category NMR_applied_experiment _Experiment_name 1H13C_NOESY-HSQC _Sample_label . save_ save_HNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label . save_ save_HN(CO)CA_6 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CO)CA _Sample_label . save_ save_HNCO_7 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label . save_ save_CBCA(CO)NH_8 _Saveframe_category NMR_applied_experiment _Experiment_name CBCA(CO)NH _Sample_label . save_ save_HNCACB_9 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label . save_ save_HNHA_10 _Saveframe_category NMR_applied_experiment _Experiment_name HNHA _Sample_label . save_ save_HBHA(CO)NH_11 _Saveframe_category NMR_applied_experiment _Experiment_name HBHA(CO)NH _Sample_label . save_ save_HCCH-TOCSY_12 _Saveframe_category NMR_applied_experiment _Experiment_name HCCH-TOCSY _Sample_label . save_ save_CNH-NOESY-HSQC_13 _Saveframe_category NMR_applied_experiment _Experiment_name CNH-NOESY-HSQC _Sample_label . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.01 0.002 M pH 6.0 0.1 pH temperature 298 0.2 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 TMS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $entry_citation $entry_citation TMS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $entry_citation $entry_citation TMS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $entry_citation $entry_citation 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_CBP2_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'C-TERMINAL DOMAIN OF INSULIN-LIKE GROWTH FACTOR BINDING PROTEIN 2' _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 1 186 4 PRO HA H 4.37 0.02 1 2 186 4 PRO HB2 H 1.87 0.02 2 3 186 4 PRO HB3 H 2.26 0.02 2 4 186 4 PRO HG2 H 1.99 0.02 1 5 186 4 PRO HG3 H 1.99 0.02 1 6 186 4 PRO C C 176.5 0.5 1 7 186 4 PRO CA C 62.7 0.5 1 8 186 4 PRO CB C 31.9 0.5 1 9 186 4 PRO CG C 27.3 0.5 1 10 186 4 PRO CD C 50.3 0.5 1 11 187 5 ALA H H 8.39 0.02 1 12 187 5 ALA HA H 4.26 0.02 1 13 187 5 ALA HB H 1.36 0.02 1 14 187 5 ALA C C 177.9 0.5 1 15 187 5 ALA CA C 52.3 0.5 1 16 187 5 ALA CB C 19.1 0.5 1 17 187 5 ALA N N 124.6 0.5 1 18 188 6 ARG H H 8.30 0.02 1 19 188 6 ARG HA H 4.64 0.02 1 20 188 6 ARG HB2 H 1.84 0.02 1 21 188 6 ARG HB3 H 1.84 0.02 1 22 188 6 ARG HG2 H 1.73 0.02 1 23 188 6 ARG HG3 H 1.73 0.02 1 24 188 6 ARG HD2 H 3.10 0.02 1 25 188 6 ARG HD3 H 3.10 0.02 1 26 188 6 ARG C C 177.0 0.5 1 27 188 6 ARG CA C 54.6 0.5 1 28 188 6 ARG CB C 31.2 0.5 1 29 188 6 ARG CG C 26.4 0.5 1 30 188 6 ARG CD C 42.6 0.5 1 31 188 6 ARG N N 120.7 0.5 1 32 189 7 THR H H 8.66 0.02 1 33 189 7 THR HA H 4.24 0.02 1 34 189 7 THR HB H 4.67 0.02 1 35 189 7 THR HG2 H 1.29 0.02 1 36 189 7 THR CA C 60.7 0.5 1 37 189 7 THR CB C 67.5 0.5 1 38 189 7 THR CG2 C 22.2 0.5 1 39 189 7 THR N N 116.2 0.5 1 40 190 8 PRO HA H 4.19 0.02 1 41 190 8 PRO HB2 H 2.56 0.02 1 42 190 8 PRO HB3 H 2.56 0.02 1 43 190 8 PRO C C 178.8 0.5 1 44 190 8 PRO CA C 66.8 0.5 1 45 190 8 PRO CB C 31.9 0.5 1 46 190 8 PRO CG C 28.2 0.5 1 47 190 8 PRO CD C 49.4 0.5 1 48 191 9 CYS H H 8.82 0.02 1 49 191 9 CYS HA H 3.49 0.02 1 50 191 9 CYS HB2 H 0.97 0.02 2 51 191 9 CYS HB3 H 2.14 0.02 2 52 191 9 CYS C C 176.1 0.5 1 53 191 9 CYS CA C 61.4 0.5 1 54 191 9 CYS CB C 39.0 0.5 1 55 191 9 CYS N N 118.0 0.5 1 56 192 10 GLN H H 7.20 0.02 1 57 192 10 GLN HA H 3.65 0.02 1 58 192 10 GLN HB2 H 1.82 0.02 2 59 192 10 GLN HB3 H 2.32 0.02 2 60 192 10 GLN HE21 H 7.63 0.02 2 61 192 10 GLN HE22 H 6.76 0.02 2 62 192 10 GLN C C 178.4 0.5 1 63 192 10 GLN CA C 58.4 0.5 1 64 192 10 GLN CB C 27.8 0.5 1 65 192 10 GLN CG C 34.4 0.5 1 66 192 10 GLN N N 117.7 0.5 1 67 192 10 GLN NE2 N 110.2 0.5 1 68 193 11 GLN H H 8.93 0.02 1 69 193 11 GLN HA H 4.05 0.02 1 70 193 11 GLN HB2 H 2.10 0.02 1 71 193 11 GLN HB3 H 2.10 0.02 1 72 193 11 GLN HG2 H 2.30 0.02 1 73 193 11 GLN HG3 H 2.30 0.02 1 74 193 11 GLN C C 178.8 0.5 1 75 193 11 GLN CA C 58.8 0.5 1 76 193 11 GLN CB C 28.7 0.5 1 77 193 11 GLN CG C 36.2 0.5 1 78 193 11 GLN N N 118.7 0.5 1 79 194 12 GLU H H 8.18 0.02 1 80 194 12 GLU HA H 4.28 0.02 1 81 194 12 GLU HB2 H 2.18 0.02 1 82 194 12 GLU HB3 H 2.18 0.02 1 83 194 12 GLU C C 178.6 0.5 1 84 194 12 GLU CA C 59.7 0.5 1 85 194 12 GLU CB C 28.9 0.5 1 86 194 12 GLU CG C 36.2 0.5 1 87 194 12 GLU N N 121.5 0.5 1 88 195 13 LEU H H 8.61 0.02 1 89 195 13 LEU HA H 3.83 0.02 1 90 195 13 LEU HB2 H 1.51 0.02 2 91 195 13 LEU HB3 H 1.97 0.02 2 92 195 13 LEU HD1 H 0.86 0.02 1 93 195 13 LEU HD2 H 0.86 0.02 1 94 195 13 LEU C C 177.6 0.5 1 95 195 13 LEU CA C 58.6 0.5 1 96 195 13 LEU CB C 41.9 0.5 1 97 195 13 LEU CG C 27.2 0.5 1 98 195 13 LEU CD1 C 23.6 0.5 2 99 195 13 LEU CD2 C 25.7 0.5 2 100 195 13 LEU N N 122.1 0.5 1 101 196 14 ASP H H 8.52 0.02 1 102 196 14 ASP HA H 4.26 0.02 1 103 196 14 ASP HB2 H 2.61 0.02 2 104 196 14 ASP HB3 H 2.80 0.02 2 105 196 14 ASP C C 179.1 0.5 1 106 196 14 ASP CA C 57.2 0.5 1 107 196 14 ASP CB C 39.4 0.5 1 108 196 14 ASP N N 118.9 0.5 1 109 197 15 GLN H H 7.92 0.02 1 110 197 15 GLN HA H 4.06 0.02 1 111 197 15 GLN HB2 H 2.27 0.02 1 112 197 15 GLN HB3 H 2.27 0.02 1 113 197 15 GLN HG2 H 2.62 0.02 1 114 197 15 GLN HG3 H 2.62 0.02 1 115 197 15 GLN C C 179.1 0.5 1 116 197 15 GLN CA C 59.0 0.5 1 117 197 15 GLN CB C 28.5 0.5 1 118 197 15 GLN CG C 34.1 0.5 1 119 197 15 GLN N N 118.8 0.5 1 120 198 16 VAL H H 8.45 0.02 1 121 198 16 VAL HA H 3.78 0.02 1 122 198 16 VAL HB H 2.27 0.02 1 123 198 16 VAL HG1 H 1.12 0.02 1 124 198 16 VAL HG2 H 1.25 0.02 1 125 198 16 VAL C C 178.0 0.5 1 126 198 16 VAL CA C 66.8 0.5 1 127 198 16 VAL CB C 31.7 0.5 1 128 198 16 VAL CG1 C 21.8 0.5 1 129 198 16 VAL CG2 C 23.6 0.5 1 130 198 16 VAL N N 122.4 0.5 1 131 199 17 LEU H H 8.68 0.02 1 132 199 17 LEU HA H 4.05 0.02 1 133 199 17 LEU HB2 H 1.46 0.02 2 134 199 17 LEU HB3 H 1.94 0.02 2 135 199 17 LEU HD1 H 0.85 0.02 1 136 199 17 LEU HD2 H 0.85 0.02 1 137 199 17 LEU C C 180.6 0.5 1 138 199 17 LEU CA C 58.1 0.5 1 139 199 17 LEU CB C 40.6 0.5 1 140 199 17 LEU CG C 26.9 0.5 1 141 199 17 LEU CD1 C 25.5 0.5 1 142 199 17 LEU CD2 C 25.5 0.5 1 143 199 17 LEU N N 119.7 0.5 1 144 200 18 GLU H H 7.97 0.02 1 145 200 18 GLU HA H 4.06 0.02 1 146 200 18 GLU HB2 H 2.13 0.02 1 147 200 18 GLU HB3 H 2.13 0.02 1 148 200 18 GLU HG2 H 2.47 0.02 1 149 200 18 GLU HG3 H 2.47 0.02 1 150 200 18 GLU C C 178.9 0.5 1 151 200 18 GLU CA C 59.5 0.5 1 152 200 18 GLU CB C 28.0 0.5 1 153 200 18 GLU CG C 33.9 0.5 1 154 200 18 GLU N N 120.2 0.5 1 155 201 19 ARG H H 7.93 0.02 1 156 201 19 ARG HA H 4.06 0.02 1 157 201 19 ARG HB2 H 2.01 0.02 1 158 201 19 ARG HB3 H 2.01 0.02 1 159 201 19 ARG HG2 H 1.73 0.02 1 160 201 19 ARG HG3 H 1.73 0.02 1 161 201 19 ARG HD2 H 3.17 0.02 1 162 201 19 ARG HD3 H 3.17 0.02 1 163 201 19 ARG C C 179.1 0.5 1 164 201 19 ARG CA C 59.3 0.5 1 165 201 19 ARG CB C 29.9 0.5 1 166 201 19 ARG CG C 27.2 0.5 1 167 201 19 ARG CD C 43.6 0.5 1 168 201 19 ARG N N 120.9 0.5 1 169 202 20 ILE H H 8.43 0.02 1 170 202 20 ILE HA H 3.81 0.02 1 171 202 20 ILE HB H 1.95 0.02 1 172 202 20 ILE HG12 H 1.14 0.02 1 173 202 20 ILE HG13 H 1.14 0.02 1 174 202 20 ILE HG2 H 0.93 0.02 1 175 202 20 ILE HD1 H 0.83 0.02 1 176 202 20 ILE C C 175.9 0.5 1 177 202 20 ILE CA C 65.1 0.5 1 178 202 20 ILE CB C 38.3 0.5 1 179 202 20 ILE CG1 C 28.9 0.5 1 180 202 20 ILE CG2 C 17.3 0.5 1 181 202 20 ILE CD1 C 14.5 0.5 1 182 202 20 ILE N N 118.4 0.5 1 183 203 21 SER H H 7.93 0.02 1 184 203 21 SER HA H 4.30 0.02 1 185 203 21 SER HB2 H 4.02 0.02 1 186 203 21 SER HB3 H 4.02 0.02 1 187 203 21 SER C C 175.9 0.5 1 188 203 21 SER CA C 60.8 0.5 1 189 203 21 SER CB C 63.3 0.5 1 190 203 21 SER N N 114.4 0.5 1 191 204 22 THR H H 7.62 0.02 1 192 204 22 THR HA H 4.35 0.02 1 193 204 22 THR HB H 4.42 0.02 1 194 204 22 THR HG2 H 1.26 0.02 1 195 204 22 THR C C 175.1 0.5 1 196 204 22 THR CA C 62.4 0.5 1 197 204 22 THR CB C 69.7 0.5 1 198 204 22 THR CG2 C 21.6 0.5 1 199 204 22 THR N N 111.5 0.5 1 200 205 23 MET H H 7.79 0.02 1 201 205 23 MET HA H 4.32 0.02 1 202 205 23 MET HB2 H 2.08 0.02 1 203 205 23 MET HB3 H 2.08 0.02 1 204 205 23 MET HG2 H 2.58 0.02 1 205 205 23 MET HG3 H 2.58 0.02 1 206 205 23 MET HE H 2.02 0.02 1 207 205 23 MET C C 177.1 0.5 1 208 205 23 MET CA C 56.5 0.5 1 209 205 23 MET CB C 32.8 0.5 1 210 205 23 MET CG C 32.5 0.5 1 211 205 23 MET CE C 17.1 0.5 1 212 205 23 MET N N 121.8 0.5 1 213 206 24 ARG H H 8.12 0.02 1 214 206 24 ARG HA H 4.35 0.02 1 215 206 24 ARG HB2 H 1.83 0.02 1 216 206 24 ARG HB3 H 1.83 0.02 1 217 206 24 ARG HG2 H 1.64 0.02 1 218 206 24 ARG HG3 H 1.64 0.02 1 219 206 24 ARG HD2 H 3.14 0.02 1 220 206 24 ARG HD3 H 3.14 0.02 1 221 206 24 ARG C C 176.0 0.5 1 222 206 24 ARG CA C 55.9 0.5 1 223 206 24 ARG CB C 30.4 0.5 1 224 206 24 ARG CG C 27.0 0.5 1 225 206 24 ARG CD C 43.1 0.5 1 226 206 24 ARG N N 121.1 0.5 1 227 207 25 LEU H H 8.33 0.02 1 228 207 25 LEU HA H 4.53 0.02 1 229 207 25 LEU HB2 H 1.64 0.02 1 230 207 25 LEU HB3 H 1.64 0.02 1 231 207 25 LEU HD1 H 0.87 0.02 1 232 207 25 LEU HD2 H 0.87 0.02 1 233 207 25 LEU CA C 53.5 0.5 1 234 207 25 LEU CB C 41.3 0.5 1 235 207 25 LEU CG C 27.0 0.5 1 236 207 25 LEU CD1 C 25.1 0.5 1 237 207 25 LEU CD2 C 23.0 0.5 1 238 207 25 LEU N N 124.4 0.5 1 239 208 26 PRO HA H 4.35 0.02 1 240 208 26 PRO HB2 H 1.95 0.02 2 241 208 26 PRO HB3 H 2.28 0.02 2 242 208 26 PRO HD2 H 3.63 0.02 1 243 208 26 PRO HD3 H 3.63 0.02 1 244 208 26 PRO C C 176.7 0.5 1 245 208 26 PRO CA C 63.6 0.5 1 246 208 26 PRO CB C 31.9 0.5 1 247 208 26 PRO CG C 27.4 0.5 1 248 208 26 PRO CD C 50.4 0.5 1 249 209 27 ASP H H 8.26 0.02 1 250 209 27 ASP HA H 4.53 0.02 1 251 209 27 ASP HB2 H 2.67 0.02 1 252 209 27 ASP HB3 H 2.67 0.02 1 253 209 27 ASP C C 176.1 0.5 1 254 209 27 ASP CA C 54.4 0.5 1 255 209 27 ASP CB C 40.1 0.5 1 256 209 27 ASP N N 118.9 0.5 1 257 210 28 GLU H H 8.27 0.02 1 258 210 28 GLU HA H 4.28 0.02 1 259 210 28 GLU HB2 H 2.04 0.02 1 260 210 28 GLU HB3 H 2.04 0.02 1 261 210 28 GLU C C 176.0 0.5 1 262 210 28 GLU CA C 56.3 0.5 1 263 210 28 GLU CB C 29.0 0.5 1 264 210 28 GLU CG C 38.6 0.5 1 265 210 28 GLU N N 120.3 0.5 1 266 211 29 ARG H H 8.35 0.02 1 267 211 29 ARG HA H 4.23 0.02 1 268 211 29 ARG HB2 H 1.90 0.02 1 269 211 29 ARG HB3 H 1.90 0.02 1 270 211 29 ARG HG2 H 1.67 0.02 1 271 211 29 ARG HG3 H 1.67 0.02 1 272 211 29 ARG HD2 H 3.17 0.02 1 273 211 29 ARG HD3 H 3.17 0.02 1 274 211 29 ARG C C 176.6 0.5 1 275 211 29 ARG CA C 56.3 0.5 1 276 211 29 ARG CB C 30.8 0.5 1 277 211 29 ARG CG C 27.0 0.5 1 278 211 29 ARG CD C 43.3 0.5 1 279 211 29 ARG N N 120.8 0.5 1 280 212 30 GLY H H 8.15 0.02 1 281 212 30 GLY HA2 H 3.69 0.02 2 282 212 30 GLY HA3 H 4.03 0.02 2 283 212 30 GLY CA C 44.2 0.5 1 284 212 30 GLY N N 108.3 0.5 1 285 215 33 GLU HA H 4.05 0.02 1 286 215 33 GLU HB2 H 1.96 0.02 1 287 215 33 GLU HB3 H 1.96 0.02 1 288 215 33 GLU C C 178.6 0.5 1 289 215 33 GLU CA C 57.2 0.5 1 290 215 33 GLU CB C 29.1 0.5 1 291 216 34 HIS H H 8.17 0.02 1 292 216 34 HIS HA H 4.55 0.02 1 293 216 34 HIS HB2 H 3.15 0.02 2 294 216 34 HIS HB3 H 3.22 0.02 2 295 216 34 HIS HD2 H 7.24 0.02 1 296 216 34 HIS HE1 H 8.63 0.02 1 297 216 34 HIS C C 174.6 0.5 1 298 216 34 HIS CA C 55.7 0.5 1 299 216 34 HIS CB C 28.6 0.5 1 300 216 34 HIS CD2 C 119.1 0.5 1 301 216 34 HIS CE1 C 136.3 0.5 1 302 216 34 HIS N N 117.5 0.5 1 303 217 35 LEU H H 7.95 0.02 1 304 217 35 LEU HA H 4.06 0.02 1 305 217 35 LEU HB2 H 1.50 0.02 1 306 217 35 LEU HB3 H 1.50 0.02 1 307 217 35 LEU HD1 H 0.81 0.02 1 308 217 35 LEU HD2 H 0.81 0.02 1 309 217 35 LEU C C 177.1 0.5 1 310 217 35 LEU CA C 55.9 0.5 1 311 217 35 LEU CB C 42.2 0.5 1 312 217 35 LEU CG C 27.0 0.5 1 313 217 35 LEU CD1 C 25.0 0.5 2 314 217 35 LEU CD2 C 23.6 0.5 2 315 217 35 LEU N N 121.4 0.5 1 316 218 36 TYR HA H 4.55 0.02 1 317 218 36 TYR HB2 H 2.95 0.02 2 318 218 36 TYR HB3 H 3.10 0.02 2 319 218 36 TYR HD1 H 7.10 0.02 1 320 218 36 TYR HD2 H 7.10 0.02 1 321 218 36 TYR HE1 H 6.77 0.02 1 322 218 36 TYR HE2 H 6.77 0.02 1 323 218 36 TYR C C 175.8 0.5 1 324 218 36 TYR CA C 58.1 0.5 1 325 218 36 TYR CB C 38.6 0.5 1 326 218 36 TYR CD1 C 133.1 0.5 1 327 218 36 TYR CD2 C 133.1 0.5 1 328 218 36 TYR CE1 C 118.1 0.5 1 329 218 36 TYR CE2 C 118.1 0.5 1 330 219 37 SER H H 7.86 0.02 1 331 219 37 SER HA H 4.53 0.02 1 332 219 37 SER HB2 H 3.82 0.02 1 333 219 37 SER HB3 H 3.82 0.02 1 334 219 37 SER C C 173.7 0.5 1 335 219 37 SER CA C 58.3 0.5 1 336 219 37 SER CB C 63.9 0.5 1 337 219 37 SER N N 115.2 0.5 1 338 220 38 LEU HA H 4.57 0.02 1 339 220 38 LEU HB2 H 1.57 0.02 1 340 220 38 LEU HB3 H 1.57 0.02 1 341 220 38 LEU HD1 H 0.85 0.02 1 342 220 38 LEU HD2 H 0.85 0.02 1 343 220 38 LEU C C 175.7 0.5 1 344 220 38 LEU CA C 54.9 0.5 1 345 220 38 LEU CB C 43.5 0.5 1 346 220 38 LEU CG C 27.4 0.5 1 347 220 38 LEU CD1 C 23.7 0.5 2 348 220 38 LEU CD2 C 25.2 0.5 2 349 221 39 HIS H H 8.70 0.02 1 350 221 39 HIS HA H 5.01 0.02 1 351 221 39 HIS HB2 H 3.25 0.02 2 352 221 39 HIS HB3 H 3.43 0.02 2 353 221 39 HIS HD2 H 7.54 0.02 1 354 221 39 HIS HE1 H 9.02 0.02 1 355 221 39 HIS C C 172.9 0.5 1 356 221 39 HIS CA C 54.7 0.5 1 357 221 39 HIS CB C 31.0 0.5 1 358 221 39 HIS CD2 C 120.7 0.5 1 359 221 39 HIS CE1 C 136.8 0.5 1 360 221 39 HIS N N 122.1 0.5 1 361 222 40 ILE HA H 4.30 0.02 1 362 222 40 ILE HB H 1.77 0.02 1 363 222 40 ILE HG2 H 0.80 0.02 1 364 222 40 ILE HD1 H 0.78 0.02 1 365 222 40 ILE CA C 58.5 0.5 1 366 222 40 ILE CB C 38.1 0.5 1 367 222 40 ILE CG2 C 17.4 0.5 1 368 222 40 ILE CD1 C 13.1 0.5 1 369 223 41 PRO HA H 4.15 0.02 1 370 223 41 PRO HB2 H 1.94 0.02 2 371 223 41 PRO HB3 H 2.33 0.02 2 372 223 41 PRO HD2 H 2.96 0.02 2 373 223 41 PRO HD3 H 3.01 0.02 2 374 223 41 PRO C C 174.0 0.5 1 375 223 41 PRO CA C 63.2 0.5 1 376 223 41 PRO CB C 32.2 0.5 1 377 223 41 PRO CD C 51.3 0.5 1 378 224 42 ASN H H 8.96 0.02 1 379 224 42 ASN HA H 4.89 0.02 1 380 224 42 ASN HB2 H 2.92 0.02 1 381 224 42 ASN HB3 H 2.92 0.02 1 382 224 42 ASN C C 175.3 0.5 1 383 224 42 ASN CA C 52.1 0.5 1 384 224 42 ASN CB C 39.4 0.5 1 385 224 42 ASN N N 120.5 0.5 1 386 225 43 CYS H H 8.73 0.02 1 387 225 43 CYS HA H 5.35 0.02 1 388 225 43 CYS HB2 H 2.52 0.02 2 389 225 43 CYS HB3 H 2.78 0.02 2 390 225 43 CYS C C 174.8 0.5 1 391 225 43 CYS CA C 51.6 0.5 1 392 225 43 CYS CB C 39.0 0.5 1 393 225 43 CYS N N 126.4 0.5 1 394 226 44 ASP H H 9.22 0.02 1 395 226 44 ASP HA H 4.62 0.02 1 396 226 44 ASP HB2 H 2.55 0.02 2 397 226 44 ASP HB3 H 3.33 0.02 2 398 226 44 ASP C C 178.6 0.5 1 399 226 44 ASP CA C 52.4 0.5 1 400 226 44 ASP CB C 41.6 0.5 1 401 226 44 ASP N N 123.9 0.5 1 402 227 45 LYS H H 8.30 0.02 1 403 227 45 LYS HA H 4.05 0.02 1 404 227 45 LYS HB2 H 1.65 0.02 2 405 227 45 LYS HB3 H 1.73 0.02 2 406 227 45 LYS HG2 H 1.21 0.02 1 407 227 45 LYS HG3 H 1.21 0.02 1 408 227 45 LYS HD2 H 1.60 0.02 1 409 227 45 LYS HD3 H 1.60 0.02 1 410 227 45 LYS C C 177.6 0.5 1 411 227 45 LYS CA C 58.3 0.5 1 412 227 45 LYS CB C 31.6 0.5 1 413 227 45 LYS CG C 24.1 0.5 1 414 227 45 LYS CD C 28.7 0.5 1 415 227 45 LYS N N 116.7 0.5 1 416 228 46 HIS H H 8.31 0.02 1 417 228 46 HIS HA H 4.60 0.02 1 418 228 46 HIS HB2 H 3.13 0.02 2 419 228 46 HIS HB3 H 3.40 0.02 2 420 228 46 HIS HD2 H 7.35 0.02 1 421 228 46 HIS HE1 H 8.64 0.02 1 422 228 46 HIS C C 174.5 0.5 1 423 228 46 HIS CA C 55.1 0.5 1 424 228 46 HIS CB C 28.7 0.5 1 425 228 46 HIS CD2 C 119.8 0.5 1 426 228 46 HIS CE1 C 136.5 0.5 1 427 228 46 HIS N N 117.6 0.5 1 428 229 47 GLY H H 8.33 0.02 1 429 229 47 GLY HA2 H 3.46 0.02 2 430 229 47 GLY HA3 H 4.01 0.02 2 431 229 47 GLY C C 174.8 0.5 1 432 229 47 GLY CA C 45.3 0.5 1 433 229 47 GLY N N 107.9 0.5 1 434 230 48 LEU H H 8.51 0.02 1 435 230 48 LEU HA H 4.47 0.02 1 436 230 48 LEU HB2 H 2.04 0.02 1 437 230 48 LEU HB3 H 2.04 0.02 1 438 230 48 LEU HD1 H 0.89 0.02 1 439 230 48 LEU HD2 H 0.89 0.02 1 440 230 48 LEU C C 177.5 0.5 1 441 230 48 LEU CA C 54.6 0.5 1 442 230 48 LEU CB C 40.1 0.5 1 443 230 48 LEU CG C 25.4 0.5 1 444 230 48 LEU CD1 C 22.3 0.5 2 445 230 48 LEU CD2 C 22.8 0.5 2 446 230 48 LEU N N 124.7 0.5 1 447 231 49 TYR H H 8.91 0.02 1 448 231 49 TYR HA H 4.55 0.02 1 449 231 49 TYR HB2 H 2.67 0.02 2 450 231 49 TYR HB3 H 2.85 0.02 2 451 231 49 TYR HD1 H 7.00 0.02 1 452 231 49 TYR HD2 H 7.00 0.02 1 453 231 49 TYR HE1 H 6.61 0.02 1 454 231 49 TYR HE2 H 6.61 0.02 1 455 231 49 TYR C C 178.2 0.5 1 456 231 49 TYR CA C 59.8 0.5 1 457 231 49 TYR CB C 38.2 0.5 1 458 231 49 TYR CD1 C 133.4 0.5 1 459 231 49 TYR CD2 C 133.4 0.5 1 460 231 49 TYR CE1 C 117.9 0.5 1 461 231 49 TYR CE2 C 117.9 0.5 1 462 231 49 TYR N N 118.8 0.5 1 463 232 50 ASN HA H 4.49 0.02 1 464 232 50 ASN HB2 H 2.28 0.02 2 465 232 50 ASN HB3 H 2.67 0.02 2 466 232 50 ASN HD21 H 7.67 0.02 2 467 232 50 ASN HD22 H 6.99 0.02 2 468 232 50 ASN C C 175.5 0.5 1 469 232 50 ASN CA C 53.2 0.5 1 470 232 50 ASN CB C 38.9 0.5 1 471 232 50 ASN ND2 N 113.8 0.5 1 472 233 51 LEU H H 8.12 0.02 1 473 233 51 LEU HA H 4.15 0.02 1 474 233 51 LEU HB2 H 1.68 0.02 1 475 233 51 LEU HB3 H 1.68 0.02 1 476 233 51 LEU HD1 H 0.81 0.02 1 477 233 51 LEU HD2 H 0.81 0.02 1 478 233 51 LEU C C 175.6 0.5 1 479 233 51 LEU CA C 57.9 0.5 1 480 233 51 LEU CB C 43.0 0.5 1 481 233 51 LEU CG C 27.2 0.5 1 482 233 51 LEU CD1 C 23.6 0.5 2 483 233 51 LEU CD2 C 25.2 0.5 2 484 233 51 LEU N N 122.1 0.5 1 485 234 52 LYS H H 7.54 0.02 1 486 234 52 LYS HA H 4.96 0.02 1 487 234 52 LYS HB2 H 1.66 0.02 1 488 234 52 LYS HB3 H 1.66 0.02 1 489 234 52 LYS HG2 H 1.19 0.02 1 490 234 52 LYS HG3 H 1.19 0.02 1 491 234 52 LYS CA C 55.5 0.5 1 492 234 52 LYS CB C 34.2 0.5 1 493 234 52 LYS CG C 25.4 0.5 1 494 234 52 LYS CD C 27.1 0.5 1 495 234 52 LYS N N 114.1 0.5 1 496 235 53 GLN H H 8.41 0.02 1 497 235 53 GLN HA H 4.23 0.02 1 498 235 53 GLN HB2 H 0.16 0.02 2 499 235 53 GLN HB3 H 1.42 0.02 2 500 235 53 GLN HG2 H 2.14 0.02 2 501 235 53 GLN HG3 H 2.36 0.02 2 502 235 53 GLN C C 173.5 0.5 1 503 235 53 GLN CA C 52.4 0.5 1 504 235 53 GLN CB C 30.2 0.5 1 505 235 53 GLN CG C 33.9 0.5 1 506 235 53 GLN N N 126.3 0.5 1 507 236 54 CYS H H 8.42 0.02 1 508 236 54 CYS HA H 5.19 0.02 1 509 236 54 CYS HB2 H 2.80 0.02 2 510 236 54 CYS HB3 H 2.93 0.02 2 511 236 54 CYS C C 174.8 0.5 1 512 236 54 CYS CA C 55.4 0.5 1 513 236 54 CYS CB C 50.3 0.5 1 514 236 54 CYS N N 114.2 0.5 1 515 237 55 LYS H H 9.02 0.02 1 516 237 55 LYS HA H 4.82 0.02 1 517 237 55 LYS HB2 H 1.99 0.02 2 518 237 55 LYS HB3 H 2.06 0.02 2 519 237 55 LYS HG2 H 1.66 0.02 1 520 237 55 LYS HG3 H 1.66 0.02 1 521 237 55 LYS HD2 H 1.76 0.02 1 522 237 55 LYS HD3 H 1.76 0.02 1 523 237 55 LYS C C 175.7 0.5 1 524 237 55 LYS CA C 55.7 0.5 1 525 237 55 LYS CB C 34.9 0.5 1 526 237 55 LYS CG C 25.8 0.5 1 527 237 55 LYS CD C 29.1 0.5 1 528 237 55 LYS N N 122.5 0.5 1 529 238 56 MET H H 8.74 0.02 1 530 238 56 MET HA H 4.81 0.02 1 531 238 56 MET HB2 H 2.04 0.02 1 532 238 56 MET HB3 H 2.04 0.02 1 533 238 56 MET HG2 H 2.58 0.02 1 534 238 56 MET HG3 H 2.58 0.02 1 535 238 56 MET HE H 1.87 0.02 1 536 238 56 MET C C 176.0 0.5 1 537 238 56 MET CA C 55.4 0.5 1 538 238 56 MET CB C 34.1 0.5 1 539 238 56 MET CG C 31.8 0.5 1 540 238 56 MET CE C 16.9 0.5 1 541 238 56 MET N N 120.9 0.5 1 542 239 57 SER H H 8.61 0.02 1 543 239 57 SER HA H 4.60 0.02 1 544 239 57 SER HB2 H 3.92 0.02 1 545 239 57 SER HB3 H 3.92 0.02 1 546 239 57 SER C C 175.0 0.5 1 547 239 57 SER CA C 57.4 0.5 1 548 239 57 SER CB C 64.4 0.5 1 549 239 57 SER N N 117.7 0.5 1 550 240 58 LEU H H 8.61 0.02 1 551 240 58 LEU HA H 4.17 0.02 1 552 240 58 LEU HB2 H 1.68 0.02 1 553 240 58 LEU HB3 H 1.68 0.02 1 554 240 58 LEU HG H 1.73 0.02 1 555 240 58 LEU HD1 H 0.89 0.02 2 556 240 58 LEU HD2 H 0.83 0.02 2 557 240 58 LEU C C 177.2 0.5 1 558 240 58 LEU CA C 56.2 0.5 1 559 240 58 LEU CB C 42.4 0.5 1 560 240 58 LEU CG C 27.1 0.5 1 561 240 58 LEU CD1 C 24.9 0.5 2 562 240 58 LEU CD2 C 23.6 0.5 2 563 240 58 LEU N N 123.3 0.5 1 564 241 59 ASN H H 8.35 0.02 1 565 241 59 ASN HA H 4.60 0.02 1 566 241 59 ASN HB2 H 2.87 0.02 1 567 241 59 ASN HB3 H 2.87 0.02 1 568 241 59 ASN C C 175.9 0.5 1 569 241 59 ASN CA C 53.0 0.5 1 570 241 59 ASN CB C 37.9 0.5 1 571 241 59 ASN N N 116.3 0.5 1 572 242 60 GLY H H 8.32 0.02 1 573 242 60 GLY HA2 H 3.67 0.02 2 574 242 60 GLY HA3 H 4.10 0.02 2 575 242 60 GLY C C 174.3 0.5 1 576 242 60 GLY CA C 45.3 0.5 1 577 242 60 GLY N N 107.8 0.5 1 578 243 61 GLN H H 7.72 0.02 1 579 243 61 GLN HA H 4.37 0.02 1 580 243 61 GLN HB2 H 2.03 0.02 1 581 243 61 GLN HB3 H 2.03 0.02 1 582 243 61 GLN HG2 H 2.26 0.02 1 583 243 61 GLN HG3 H 2.26 0.02 1 584 243 61 GLN C C 175.7 0.5 1 585 243 61 GLN CA C 54.9 0.5 1 586 243 61 GLN CB C 29.5 0.5 1 587 243 61 GLN CG C 33.8 0.5 1 588 243 61 GLN N N 118.7 0.5 1 589 244 62 ARG H H 8.63 0.02 1 590 244 62 ARG HA H 4.37 0.02 1 591 244 62 ARG HB2 H 1.75 0.02 1 592 244 62 ARG HB3 H 1.75 0.02 1 593 244 62 ARG HG2 H 1.67 0.02 1 594 244 62 ARG HG3 H 1.67 0.02 1 595 244 62 ARG HD2 H 3.20 0.02 1 596 244 62 ARG HD3 H 3.20 0.02 1 597 244 62 ARG C C 176.7 0.5 1 598 244 62 ARG CA C 56.8 0.5 1 599 244 62 ARG CB C 31.1 0.5 1 600 244 62 ARG CG C 27.1 0.5 1 601 244 62 ARG CD C 43.6 0.5 1 602 244 62 ARG N N 123.7 0.5 1 603 245 63 GLY H H 8.54 0.02 1 604 245 63 GLY HA2 H 3.64 0.02 2 605 245 63 GLY HA3 H 4.33 0.02 2 606 245 63 GLY C C 172.7 0.5 1 607 245 63 GLY CA C 44.8 0.5 1 608 245 63 GLY N N 113.0 0.5 1 609 246 64 GLU H H 8.54 0.02 1 610 246 64 GLU HA H 4.55 0.02 1 611 246 64 GLU HB2 H 2.04 0.02 1 612 246 64 GLU HB3 H 2.04 0.02 1 613 246 64 GLU HG2 H 2.30 0.02 1 614 246 64 GLU HG3 H 2.30 0.02 1 615 246 64 GLU C C 175.1 0.5 1 616 246 64 GLU CA C 56.4 0.5 1 617 246 64 GLU CB C 30.8 0.5 1 618 246 64 GLU CG C 35.0 0.5 1 619 246 64 GLU N N 121.4 0.5 1 620 247 65 CYS H H 8.90 0.02 1 621 247 65 CYS HA H 5.62 0.02 1 622 247 65 CYS HB2 H 2.78 0.02 1 623 247 65 CYS HB3 H 2.95 0.02 1 624 247 65 CYS C C 172.5 0.5 1 625 247 65 CYS CA C 56.4 0.5 1 626 247 65 CYS CB C 48.1 0.5 1 627 247 65 CYS N N 118.2 0.5 1 628 248 66 TRP H H 9.19 0.02 1 629 248 66 TRP HA H 5.05 0.02 1 630 248 66 TRP HB2 H 3.26 0.02 2 631 248 66 TRP HB3 H 3.43 0.02 2 632 248 66 TRP HD1 H 6.81 0.02 1 633 248 66 TRP HE1 H 9.98 0.02 1 634 248 66 TRP HE3 H 7.17 0.02 1 635 248 66 TRP HZ2 H 6.51 0.02 1 636 248 66 TRP HZ3 H 6.85 0.02 1 637 248 66 TRP HH2 H 6.37 0.02 1 638 248 66 TRP C C 172.6 0.5 1 639 248 66 TRP CA C 56.6 0.5 1 640 248 66 TRP CB C 30.9 0.5 1 641 248 66 TRP CD1 C 127.5 0.5 1 642 248 66 TRP CE3 C 119.6 0.5 1 643 248 66 TRP CZ2 C 113.5 0.5 1 644 248 66 TRP CZ3 C 118.3 0.5 1 645 248 66 TRP CH2 C 122.0 0.5 1 646 248 66 TRP N N 121.0 0.5 1 647 248 66 TRP NE1 N 129.2 0.5 1 648 249 67 CYS H H 8.83 0.02 1 649 249 67 CYS HA H 6.05 0.02 1 650 249 67 CYS HB2 H 2.55 0.02 2 651 249 67 CYS HB3 H 3.03 0.02 2 652 249 67 CYS C C 175.5 0.5 1 653 249 67 CYS CA C 52.3 0.5 1 654 249 67 CYS CB C 39.4 0.5 1 655 249 67 CYS N N 116.9 0.5 1 656 250 68 VAL H H 9.57 0.02 1 657 250 68 VAL HA H 4.98 0.02 1 658 250 68 VAL HB H 1.43 0.02 1 659 250 68 VAL HG1 H 0.74 0.02 1 660 250 68 VAL HG2 H 0.65 0.02 1 661 250 68 VAL CA C 58.0 0.5 1 662 250 68 VAL CB C 35.5 0.5 1 663 250 68 VAL CG1 C 22.8 0.5 1 664 250 68 VAL CG2 C 19.5 0.5 1 665 250 68 VAL N N 115.7 0.5 1 666 251 69 ASN H H 7.96 0.02 1 667 251 69 ASN HA H 4.35 0.02 1 668 251 69 ASN HB2 H 2.64 0.02 2 669 251 69 ASN HB3 H 3.01 0.02 2 670 251 69 ASN CA C 51.1 0.5 1 671 251 69 ASN N N 118.2 0.5 1 672 252 70 PRO HA H 4.53 0.02 1 673 252 70 PRO HB2 H 1.91 0.02 2 674 252 70 PRO HB3 H 2.42 0.02 2 675 252 70 PRO HD2 H 3.49 0.02 1 676 252 70 PRO HD3 H 3.49 0.02 1 677 252 70 PRO C C 176.8 0.5 1 678 252 70 PRO CA C 64.8 0.5 1 679 252 70 PRO CB C 32.9 0.5 1 680 252 70 PRO CG C 27.1 0.5 1 681 252 70 PRO CD C 50.3 0.5 1 682 253 71 ASN H H 8.40 0.02 1 683 253 71 ASN HA H 4.87 0.02 1 684 253 71 ASN HB2 H 2.92 0.02 1 685 253 71 ASN HB3 H 2.92 0.02 1 686 253 71 ASN HD21 H 7.67 0.02 2 687 253 71 ASN HD22 H 7.13 0.02 2 688 253 71 ASN C C 177.2 0.5 1 689 253 71 ASN CA C 55.3 0.5 1 690 253 71 ASN CB C 39.9 0.5 1 691 253 71 ASN N N 111.8 0.5 1 692 253 71 ASN ND2 N 114.3 0.5 1 693 254 72 THR H H 7.86 0.02 1 694 254 72 THR HA H 4.51 0.02 1 695 254 72 THR HB H 4.31 0.02 1 696 254 72 THR HG2 H 1.17 0.02 1 697 254 72 THR C C 175.9 0.5 1 698 254 72 THR CA C 61.4 0.5 1 699 254 72 THR CB C 71.3 0.5 1 700 254 72 THR CG2 C 20.9 0.5 1 701 254 72 THR N N 106.6 0.5 1 702 255 73 GLY H H 8.64 0.02 1 703 255 73 GLY HA2 H 2.40 0.02 2 704 255 73 GLY HA3 H 2.65 0.02 2 705 255 73 GLY C C 173.1 0.5 1 706 255 73 GLY CA C 44.4 0.5 1 707 255 73 GLY N N 113.5 0.5 1 708 256 74 LYS H H 7.51 0.02 1 709 256 74 LYS HA H 4.19 0.02 1 710 256 74 LYS HB2 H 1.57 0.02 2 711 256 74 LYS HB3 H 1.76 0.02 2 712 256 74 LYS HG2 H 1.38 0.02 1 713 256 74 LYS HG3 H 1.38 0.02 1 714 256 74 LYS HD2 H 1.65 0.02 1 715 256 74 LYS HD3 H 1.65 0.02 1 716 256 74 LYS C C 176.0 0.5 1 717 256 74 LYS CA C 55.1 0.5 1 718 256 74 LYS CB C 33.0 0.5 1 719 256 74 LYS CG C 24.9 0.5 1 720 256 74 LYS CD C 28.5 0.5 1 721 256 74 LYS N N 118.9 0.5 1 722 257 75 LEU H H 8.20 0.02 1 723 257 75 LEU HA H 4.39 0.02 1 724 257 75 LEU HB2 H 1.48 0.02 1 725 257 75 LEU HB3 H 1.48 0.02 1 726 257 75 LEU HD1 H 0.71 0.02 2 727 257 75 LEU HD2 H 0.84 0.02 2 728 257 75 LEU CA C 56.2 0.5 1 729 257 75 LEU CB C 42.9 0.5 1 730 257 75 LEU CG C 27.1 0.5 1 731 257 75 LEU CD1 C 22.9 0.5 2 732 257 75 LEU CD2 C 24.8 0.5 2 733 257 75 LEU N N 123.5 0.5 1 734 258 76 ILE H H 8.34 0.02 1 735 258 76 ILE HA H 4.06 0.02 1 736 258 76 ILE HB H 1.48 0.02 1 737 258 76 ILE HG12 H 1.49 0.02 1 738 258 76 ILE HG13 H 1.49 0.02 1 739 258 76 ILE HG2 H 0.94 0.02 1 740 258 76 ILE HD1 H 0.76 0.02 1 741 258 76 ILE C C 175.5 0.5 1 742 258 76 ILE CA C 60.9 0.5 1 743 258 76 ILE CB C 39.0 0.5 1 744 258 76 ILE CG1 C 27.1 0.5 1 745 258 76 ILE CG2 C 17.3 0.5 1 746 258 76 ILE CD1 C 13.5 0.5 1 747 258 76 ILE N N 125.7 0.5 1 748 259 77 GLN H H 8.68 0.02 1 749 259 77 GLN HA H 4.06 0.02 1 750 259 77 GLN HB2 H 1.99 0.02 1 751 259 77 GLN HB3 H 1.99 0.02 1 752 259 77 GLN HG2 H 2.35 0.02 1 753 259 77 GLN HG3 H 2.35 0.02 1 754 259 77 GLN C C 176.2 0.5 1 755 259 77 GLN CA C 57.3 0.5 1 756 259 77 GLN CB C 29.4 0.5 1 757 259 77 GLN CG C 33.8 0.5 1 758 259 77 GLN N N 128.5 0.5 1 759 260 78 GLY H H 8.65 0.02 1 760 260 78 GLY HA2 H 3.70 0.02 2 761 260 78 GLY HA3 H 3.81 0.02 2 762 260 78 GLY C C 173.4 0.5 1 763 260 78 GLY CA C 45.0 0.5 1 764 260 78 GLY N N 111.9 0.5 1 765 261 79 ALA H H 7.52 0.02 1 766 261 79 ALA HA H 4.06 0.02 1 767 261 79 ALA HB H 1.03 0.02 1 768 261 79 ALA CA C 49.7 0.5 1 769 261 79 ALA CB C 18.0 0.5 1 770 261 79 ALA N N 123.9 0.5 1 771 262 80 PRO HA H 4.46 0.02 1 772 262 80 PRO HB2 H 1.76 0.02 2 773 262 80 PRO HB3 H 2.20 0.02 2 774 262 80 PRO C C 176.1 0.5 1 775 262 80 PRO CA C 63.0 0.5 1 776 262 80 PRO CB C 32.1 0.5 1 777 262 80 PRO CG C 27.0 0.5 1 778 263 81 THR H H 8.12 0.02 1 779 263 81 THR HA H 4.94 0.02 1 780 263 81 THR HB H 4.04 0.02 1 781 263 81 THR HG2 H 1.08 0.02 1 782 263 81 THR C C 174.6 0.5 1 783 263 81 THR CA C 61.8 0.5 1 784 263 81 THR CB C 70.4 0.5 1 785 263 81 THR CG2 C 21.1 0.5 1 786 263 81 THR N N 115.3 0.5 1 787 264 82 ILE H H 8.54 0.02 1 788 264 82 ILE HA H 4.55 0.02 1 789 264 82 ILE HB H 1.72 0.02 1 790 264 82 ILE HG12 H 1.40 0.02 1 791 264 82 ILE HG13 H 1.40 0.02 1 792 264 82 ILE HG2 H 0.86 0.02 1 793 264 82 ILE HD1 H 0.82 0.02 1 794 264 82 ILE C C 175.8 0.5 1 795 264 82 ILE CA C 59.7 0.5 1 796 264 82 ILE CB C 40.4 0.5 1 797 264 82 ILE CG1 C 27.5 0.5 1 798 264 82 ILE CG2 C 17.3 0.5 1 799 264 82 ILE CD1 C 13.0 0.5 1 800 264 82 ILE N N 122.2 0.5 1 801 265 83 ARG H H 8.67 0.02 1 802 265 83 ARG HA H 4.55 0.02 1 803 265 83 ARG HB2 H 1.73 0.02 1 804 265 83 ARG HB3 H 1.73 0.02 1 805 265 83 ARG HG2 H 1.45 0.02 1 806 265 83 ARG HG3 H 1.45 0.02 1 807 265 83 ARG HD2 H 3.21 0.02 1 808 265 83 ARG HD3 H 3.21 0.02 1 809 265 83 ARG C C 176.1 0.5 1 810 265 83 ARG CA C 55.9 0.5 1 811 265 83 ARG CB C 28.5 0.5 1 812 265 83 ARG CG C 27.5 0.5 1 813 265 83 ARG CD C 43.5 0.5 1 814 265 83 ARG N N 125.4 0.5 1 815 266 84 GLY H H 7.95 0.02 1 816 266 84 GLY HA2 H 3.74 0.02 2 817 266 84 GLY HA3 H 4.02 0.02 2 818 266 84 GLY C C 172.3 0.5 1 819 266 84 GLY CA C 45.0 0.5 1 820 266 84 GLY N N 110.8 0.5 1 821 267 85 ASP H H 8.35 0.02 1 822 267 85 ASP HA H 4.94 0.02 1 823 267 85 ASP HB2 H 2.49 0.02 2 824 267 85 ASP HB3 H 2.84 0.02 2 825 267 85 ASP CA C 51.2 0.5 1 826 267 85 ASP CB C 41.6 0.5 1 827 267 85 ASP N N 121.4 0.5 1 828 268 86 PRO HA H 4.37 0.02 1 829 268 86 PRO HB2 H 1.90 0.02 1 830 268 86 PRO HB3 H 1.90 0.02 1 831 268 86 PRO HD2 H 3.67 0.02 2 832 268 86 PRO HD3 H 3.93 0.02 2 833 268 86 PRO C C 176.1 0.5 1 834 268 86 PRO CA C 62.9 0.5 1 835 268 86 PRO CB C 32.0 0.5 1 836 268 86 PRO CG C 27.1 0.5 1 837 268 86 PRO CD C 50.6 0.5 1 838 269 87 GLU H H 8.60 0.02 1 839 269 87 GLU HA H 4.37 0.02 1 840 269 87 GLU HB2 H 2.17 0.02 1 841 269 87 GLU HB3 H 2.17 0.02 1 842 269 87 GLU C C 176.3 0.5 1 843 269 87 GLU CA C 55.1 0.5 1 844 269 87 GLU CB C 27.2 0.5 1 845 269 87 GLU CG C 34.2 0.5 1 846 269 87 GLU N N 117.4 0.5 1 847 270 88 CYS H H 8.39 0.02 1 848 270 88 CYS HA H 4.55 0.02 1 849 270 88 CYS HB2 H 2.72 0.02 2 850 270 88 CYS HB3 H 3.01 0.02 2 851 270 88 CYS C C 176.5 0.5 1 852 270 88 CYS CA C 55.5 0.5 1 853 270 88 CYS CB C 37.6 0.5 1 854 270 88 CYS N N 116.5 0.5 1 855 271 89 HIS H H 8.71 0.02 1 856 271 89 HIS HA H 4.55 0.02 1 857 271 89 HIS HB2 H 3.17 0.02 1 858 271 89 HIS HB3 H 3.17 0.02 1 859 271 89 HIS HD2 H 7.37 0.02 1 860 271 89 HIS HE1 H 8.65 0.02 1 861 271 89 HIS CA C 58.1 0.5 1 862 271 89 HIS CB C 28.1 0.5 1 863 271 89 HIS CD2 C 120.1 0.5 1 864 271 89 HIS CE1 C 136.7 0.5 1 865 271 89 HIS N N 117.5 0.5 1 866 272 90 LEU H H 7.77 0.02 1 867 272 90 LEU HA H 4.00 0.02 1 868 272 90 LEU HB2 H 1.30 0.02 1 869 272 90 LEU HB3 H 1.30 0.02 1 870 272 90 LEU HD1 H 1.02 0.02 2 871 272 90 LEU HD2 H 0.73 0.02 2 872 272 90 LEU C C 177.8 0.5 1 873 272 90 LEU CA C 55.7 0.5 1 874 272 90 LEU CB C 41.6 0.5 1 875 272 90 LEU CG C 27.1 0.5 1 876 272 90 LEU CD1 C 25.5 0.5 2 877 272 90 LEU CD2 C 23.6 0.5 2 878 272 90 LEU N N 119.8 0.5 1 879 273 91 PHE H H 7.72 0.02 1 880 273 91 PHE HA H 4.53 0.02 1 881 273 91 PHE HB2 H 2.79 0.02 2 882 273 91 PHE HB3 H 3.29 0.02 2 883 273 91 PHE HD1 H 7.22 0.02 1 884 273 91 PHE HD2 H 7.22 0.02 1 885 273 91 PHE HE1 H 7.32 0.02 1 886 273 91 PHE HE2 H 7.32 0.02 1 887 273 91 PHE C C 175.7 0.5 1 888 273 91 PHE CA C 58.0 0.5 1 889 273 91 PHE CB C 40.4 0.5 1 890 273 91 PHE CD1 C 131.7 0.5 1 891 273 91 PHE CD2 C 131.7 0.5 1 892 273 91 PHE CE1 C 131.7 0.5 1 893 273 91 PHE CE2 C 131.7 0.5 1 894 273 91 PHE CZ C 130.2 0.5 1 895 273 91 PHE N N 116.5 0.5 1 896 274 92 TYR H H 7.66 0.02 1 897 274 92 TYR HA H 4.56 0.02 1 898 274 92 TYR HB2 H 2.85 0.02 1 899 274 92 TYR HB3 H 2.85 0.02 1 900 274 92 TYR HD1 H 7.10 0.02 1 901 274 92 TYR HD2 H 7.10 0.02 1 902 274 92 TYR HE1 H 6.81 0.02 1 903 274 92 TYR HE2 H 6.81 0.02 1 904 274 92 TYR C C 175.3 0.5 1 905 274 92 TYR CA C 58.2 0.5 1 906 274 92 TYR CB C 39.9 0.5 1 907 274 92 TYR CD1 C 133.1 0.5 1 908 274 92 TYR CD2 C 133.1 0.5 1 909 274 92 TYR CE1 C 118.1 0.5 1 910 274 92 TYR CE2 C 118.1 0.5 1 911 274 92 TYR N N 120.6 0.5 1 912 275 93 ASN H H 8.09 0.02 1 913 275 93 ASN HA H 4.57 0.02 1 914 275 93 ASN HB2 H 2.70 0.02 1 915 275 93 ASN HB3 H 2.70 0.02 1 916 275 93 ASN C C 176.0 0.5 1 917 275 93 ASN CA C 52.8 0.5 1 918 275 93 ASN CB C 38.6 0.5 1 919 275 93 ASN N N 123.3 0.5 1 920 276 94 GLU H H 8.41 0.02 1 921 276 94 GLU HA H 4.02 0.02 1 922 276 94 GLU HB2 H 2.02 0.02 1 923 276 94 GLU HB3 H 2.02 0.02 1 924 276 94 GLU HG2 H 2.28 0.02 1 925 276 94 GLU HG3 H 2.28 0.02 1 926 276 94 GLU C C 177.3 0.5 1 927 276 94 GLU CA C 57.7 0.5 1 928 276 94 GLU CB C 28.9 0.5 1 929 276 94 GLU CG C 34.3 0.5 1 930 276 94 GLU N N 122.5 0.5 1 931 277 95 GLN H H 8.27 0.02 1 932 277 95 GLN HA H 4.21 0.02 1 933 277 95 GLN HB2 H 2.01 0.02 1 934 277 95 GLN HB3 H 2.01 0.02 1 935 277 95 GLN HG2 H 2.31 0.02 1 936 277 95 GLN HG3 H 2.31 0.02 1 937 277 95 GLN C C 177.1 0.5 1 938 277 95 GLN CA C 56.6 0.5 1 939 277 95 GLN CB C 28.9 0.5 1 940 277 95 GLN CG C 34.1 0.5 1 941 277 95 GLN N N 119.8 0.5 1 942 278 96 GLN H H 8.13 0.02 1 943 278 96 GLN HA H 4.19 0.02 1 944 278 96 GLN HB2 H 1.98 0.02 1 945 278 96 GLN HB3 H 1.98 0.02 1 946 278 96 GLN HG2 H 2.27 0.02 1 947 278 96 GLN HG3 H 2.27 0.02 1 948 278 96 GLN C C 177.0 0.5 1 949 278 96 GLN CA C 56.6 0.5 1 950 278 96 GLN CB C 29.1 0.5 1 951 278 96 GLN CG C 34.0 0.5 1 952 278 96 GLN N N 120.2 0.5 1 953 279 97 GLU H H 8.29 0.02 1 954 279 97 GLU HA H 4.23 0.02 1 955 279 97 GLU HB2 H 1.98 0.02 1 956 279 97 GLU HB3 H 1.98 0.02 1 957 279 97 GLU HG2 H 2.25 0.02 1 958 279 97 GLU HG3 H 2.25 0.02 1 959 279 97 GLU C C 176.9 0.5 1 960 279 97 GLU CA C 56.9 0.5 1 961 279 97 GLU CB C 29.0 0.5 1 962 279 97 GLU CG C 34.4 0.5 1 963 279 97 GLU N N 121.1 0.5 1 964 280 98 ALA H H 8.21 0.02 1 965 280 98 ALA HA H 4.29 0.02 1 966 280 98 ALA HB H 1.38 0.02 1 967 280 98 ALA C C 178.0 0.5 1 968 280 98 ALA CA C 52.8 0.5 1 969 280 98 ALA CB C 18.7 0.5 1 970 280 98 ALA N N 124.5 0.5 1 971 281 99 ARG H H 8.15 0.02 1 972 281 99 ARG HA H 4.32 0.02 1 973 281 99 ARG HB2 H 1.88 0.02 1 974 281 99 ARG HB3 H 1.88 0.02 1 975 281 99 ARG HG2 H 1.62 0.02 1 976 281 99 ARG HG3 H 1.62 0.02 1 977 281 99 ARG HD2 H 3.15 0.02 1 978 281 99 ARG HD3 H 3.15 0.02 1 979 281 99 ARG C C 177.0 0.5 1 980 281 99 ARG CA C 56.3 0.5 1 981 281 99 ARG CB C 30.7 0.5 1 982 281 99 ARG CG C 27.1 0.5 1 983 281 99 ARG CD C 43.5 0.5 1 984 281 99 ARG N N 119.4 0.5 1 985 282 100 GLY H H 8.29 0.02 1 986 282 100 GLY HA2 H 3.94 0.02 1 987 282 100 GLY HA3 H 3.94 0.02 1 988 282 100 GLY C C 174.0 0.5 1 989 282 100 GLY CA C 45.2 0.5 1 990 282 100 GLY N N 109.3 0.5 1 991 283 101 VAL H H 7.91 0.02 1 992 283 101 VAL HA H 4.04 0.02 1 993 283 101 VAL HB H 1.98 0.02 1 994 283 101 VAL HG1 H 0.85 0.02 1 995 283 101 VAL HG2 H 0.85 0.02 1 996 283 101 VAL C C 176.1 0.5 1 997 283 101 VAL CA C 62.6 0.5 1 998 283 101 VAL CB C 32.4 0.5 1 999 283 101 VAL CG1 C 20.4 0.5 2 1000 283 101 VAL CG2 C 20.8 0.5 2 1001 283 101 VAL N N 119.3 0.5 1 1002 284 102 HIS H H 8.58 0.02 1 1003 284 102 HIS HA H 4.85 0.02 1 1004 284 102 HIS HB2 H 3.17 0.02 1 1005 284 102 HIS HB3 H 3.17 0.02 1 1006 284 102 HIS HD2 H 7.29 0.02 1 1007 284 102 HIS HE1 H 8.64 0.02 1 1008 284 102 HIS C C 174.5 0.5 1 1009 284 102 HIS CA C 55.4 0.5 1 1010 284 102 HIS CB C 28.9 0.5 1 1011 284 102 HIS CD2 C 120.1 0.5 1 1012 284 102 HIS CE1 C 136.4 0.5 1 1013 284 102 HIS N N 122.5 0.5 1 1014 285 103 THR H H 8.12 0.02 1 1015 285 103 THR HA H 4.28 0.02 1 1016 285 103 THR HB H 4.20 0.02 1 1017 285 103 THR HG2 H 1.17 0.02 1 1018 285 103 THR C C 174.3 0.5 1 1019 285 103 THR CA C 62.0 0.5 1 1020 285 103 THR CB C 69.8 0.5 1 1021 285 103 THR CG2 C 21.6 0.5 1 1022 285 103 THR N N 116.0 0.5 1 1023 286 104 GLN H H 8.47 0.02 1 1024 286 104 GLN HA H 4.32 0.02 1 1025 286 104 GLN HB2 H 2.00 0.02 1 1026 286 104 GLN HB3 H 2.00 0.02 1 1027 286 104 GLN HG2 H 2.33 0.02 1 1028 286 104 GLN HG3 H 2.33 0.02 1 1029 286 104 GLN C C 175.6 0.5 1 1030 286 104 GLN CA C 55.9 0.5 1 1031 286 104 GLN CB C 29.5 0.5 1 1032 286 104 GLN CG C 33.8 0.5 1 1033 286 104 GLN N N 123.1 0.5 1 1034 287 105 ARG H H 8.42 0.02 1 1035 287 105 ARG HA H 4.33 0.02 1 1036 287 105 ARG HB2 H 1.78 0.02 1 1037 287 105 ARG HB3 H 1.78 0.02 1 1038 287 105 ARG HG2 H 1.62 0.02 1 1039 287 105 ARG HG3 H 1.62 0.02 1 1040 287 105 ARG HD2 H 3.20 0.02 1 1041 287 105 ARG HD3 H 3.20 0.02 1 1042 287 105 ARG C C 176.2 0.5 1 1043 287 105 ARG CA C 56.0 0.5 1 1044 287 105 ARG CB C 30.8 0.5 1 1045 287 105 ARG CG C 27.1 0.5 1 1046 287 105 ARG CD C 43.8 0.5 1 1047 287 105 ARG N N 122.9 0.5 1 1048 288 106 MET H H 8.51 0.02 1 1049 288 106 MET HA H 4.48 0.02 1 1050 288 106 MET HB2 H 1.92 0.02 1 1051 288 106 MET HB3 H 1.92 0.02 1 1052 288 106 MET HG2 H 2.58 0.02 1 1053 288 106 MET HG3 H 2.58 0.02 1 1054 288 106 MET HE H 2.10 0.02 1 1055 288 106 MET C C 175.4 0.5 1 1056 288 106 MET CA C 55.5 0.5 1 1057 288 106 MET CB C 32.6 0.5 1 1058 288 106 MET CG C 30.9 0.5 1 1059 288 106 MET CE C 16.9 0.5 1 1060 288 106 MET N N 122.9 0.5 1 1061 289 107 GLN H H 7.97 0.02 1 1062 289 107 GLN HA H 4.15 0.02 1 1063 289 107 GLN CA C 57.4 0.5 1 1064 289 107 GLN CB C 30.3 0.5 1 1065 289 107 GLN N N 126.3 0.5 1 stop_ save_