data_4590 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the human chemokine Eotaxin-2 ; _BMRB_accession_number 4590 _BMRB_flat_file_name bmr4590.str _Entry_type original _Submission_date 2000-05-05 _Accession_date 2000-09-07 _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 Mayer K. L. . 2 Stone M. J. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 coupling_constants 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 395 "13C chemical shifts" 252 "15N chemical shifts" 76 "coupling constants" 51 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2001-03-08 original author . stop_ _Original_release_date 2001-03-08 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR Solution Structure and Receptor Peptide Binding of the CC-CHemokine Eotaxin-2 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code 20374512 _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mayer K. L. . 2 Stone M. J. . stop_ _Journal_abbreviation Biochemistry _Journal_volume 39 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 8382 _Page_last 8395 _Year 2000 _Details . loop_ _Keyword chemokine 'chemotactic cytokine' 'eosinophil chemoattractant' stop_ save_ ################################## # Molecular system description # ################################## save_system_EOTAXIN-2 _Saveframe_category molecular_system _Mol_system_name EOTAXIN-2 _Abbreviation_common EOTAXIN-2 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label EOTAXIN-2 $EOTAXIN-2 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'all disulfide bound' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_EOTAXIN-2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common EOTAXIN-2 _Molecular_mass . _Mol_thiol_state 'all disulfide bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 73 _Mol_residue_sequence ; VVIPSPCCMFFVSKRIPENR VVSYQLSSRSTCLKAGVIFT TKKGQQSCGDPKQEWVQRYM KNLDAKQKKASPR ; loop_ _Residue_seq_code _Residue_label 1 VAL 2 VAL 3 ILE 4 PRO 5 SER 6 PRO 7 CYS 8 CYS 9 MET 10 PHE 11 PHE 12 VAL 13 SER 14 LYS 15 ARG 16 ILE 17 PRO 18 GLU 19 ASN 20 ARG 21 VAL 22 VAL 23 SER 24 TYR 25 GLN 26 LEU 27 SER 28 SER 29 ARG 30 SER 31 THR 32 CYS 33 LEU 34 LYS 35 ALA 36 GLY 37 VAL 38 ILE 39 PHE 40 THR 41 THR 42 LYS 43 LYS 44 GLY 45 GLN 46 GLN 47 SER 48 CYS 49 GLY 50 ASP 51 PRO 52 LYS 53 GLN 54 GLU 55 TRP 56 VAL 57 GLN 58 ARG 59 TYR 60 MET 61 LYS 62 ASN 63 LEU 64 ASP 65 ALA 66 LYS 67 GLN 68 LYS 69 LYS 70 ALA 71 SER 72 PRO 73 ARG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-29 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 1EIG "Solution Structure Of The Human Chemokine Eotaxin-2" 100.00 73 100.00 100.00 2.66e-45 PDB 1EIH "Solution Structure Of The Human Chemokine Eotaxin-2" 100.00 73 100.00 100.00 2.66e-45 DBJ BAG35149 "unnamed protein product [Homo sapiens]" 100.00 119 97.26 98.63 5.59e-44 DBJ BAJ21120 "chemokine (C-C motif) ligand 24 [synthetic construct]" 100.00 119 98.63 98.63 2.32e-44 EMBL CAA11383 "MPIF-2 [Homo sapiens]" 100.00 115 98.63 98.63 2.13e-44 GB AAB51135 "MPIF-2 [Homo sapiens]" 100.00 119 97.26 97.26 9.01e-44 GB AAD15410 "unknown [Homo sapiens]" 100.00 119 98.63 98.63 2.32e-44 GB AAH69072 "Small inducible cytokine A24, precursor [Homo sapiens]" 100.00 119 98.63 98.63 2.32e-44 GB AAH69391 "Chemokine (C-C motif) ligand 24 [Homo sapiens]" 100.00 119 98.63 98.63 2.32e-44 GB ADQ32923 "chemokine (C-C motif) ligand 24 [synthetic construct]" 100.00 119 97.26 97.26 1.60e-43 REF NP_002982 "C-C motif chemokine 24 precursor [Homo sapiens]" 100.00 119 98.63 98.63 2.32e-44 REF XP_001155246 "PREDICTED: C-C motif chemokine 24 [Pan troglodytes]" 100.00 119 97.26 97.26 6.03e-44 REF XP_003808972 "PREDICTED: C-C motif chemokine 24 [Pan paniscus]" 100.00 119 97.26 97.26 6.03e-44 REF XP_004045658 "PREDICTED: c-C motif chemokine 24 [Gorilla gorilla gorilla]" 52.05 64 97.37 100.00 3.75e-17 REF XP_009451649 "PREDICTED: C-C motif chemokine 24 [Pan troglodytes]" 100.00 119 97.26 97.26 6.03e-44 SP O00175 "RecName: Full=C-C motif chemokine 24; AltName: Full=CK-beta-6; AltName: Full=Eosinophil chemotactic protein 2; AltName: Full=Eo" 100.00 119 98.63 98.63 2.32e-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 $EOTAXIN-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_name $EOTAXIN-2 'recombinant technology' Bacteria Escherichia coli plasmid PET28A stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $EOTAXIN-2 1 mM '[U-15N; U-13C]' NaAc 20 mM . H2O 90 % . D2O 10 % . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $EOTAXIN-2 1 mM [U-13C] NaAc 20 mM . H2O 90 % . D2O 10 % . stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $EOTAXIN-2 1 mM '[U-15N; U-13C]' NaAc 20 mM . D2O 100 % . stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $EOTAXIN-2 1 mM '[U-10% 13C]' NaAc 20 mM . D2O 100 % . stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Saveframe_category software _Name VNMR _Version . loop_ _Task collection stop_ _Details . save_ save_FELIX _Saveframe_category software _Name FELIX _Version 98 loop_ _Task processing stop_ _Details . save_ save_X-PLOR _Saveframe_category software _Name X-PLOR _Version 98 loop_ _Task 'structure solution' stop_ _Details Brunger save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model 'Unity INOVA' _Field_strength 500 _Details . save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 4.1 . n/a temperature 298 . K 'ionic strength' 20 . mM pressure 1 . atm stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _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 . H 1 . ppm . . . . . . . N 15 . ppm . . . . . . . C 13 . ppm . . . . . . 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_chemical_shift_set_EOTAXIN-2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name EOTAXIN-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 . 1 VAL CA C 61.17 . 1 2 . 1 VAL HA H 3.85 . 1 3 . 1 VAL CB C 32.9 . 1 4 . 1 VAL HB H 2.19 . 1 5 . 1 VAL CG1 C 20.37 . 1 6 . 1 VAL HG1 H 1.00 . 1 7 . 1 VAL CG2 C 19.9 . 1 8 . 1 VAL HG2 H 1.00 . 1 9 . 2 VAL H H 8.55 . 1 10 . 2 VAL N N 125.39 . 1 11 . 2 VAL CA C 62.24 . 1 12 . 2 VAL HA H 4.16 . 1 13 . 2 VAL CB C 32.67 . 1 14 . 2 VAL HB H 1.99 . 1 15 . 2 VAL CG1 C 21.02 . 1 16 . 2 VAL HG1 H 0.86 . 1 17 . 2 VAL CG2 C 20.84 . 1 18 . 2 VAL HG2 H 0.95 . 1 19 . 3 ILE H H 8.51 . 1 20 . 3 ILE N N 128.61 . 1 21 . 3 ILE CA C 58.01 . 1 22 . 3 ILE HA H 4.49 . 1 23 . 3 ILE CB C 38.49 . 1 24 . 3 ILE HB H 1.85 . 1 25 . 3 ILE CG1 C 26.77 . 1 26 . 3 ILE HG12 H 1.21 . 1 27 . 3 ILE HG13 H 1.52 . 1 28 . 3 ILE CG2 C 17.32 . 1 29 . 3 ILE HG2 H 0.96 . 1 30 . 3 ILE CD1 C 12.60 . 1 31 . 3 ILE HD1 H 0.86 . 1 32 . 4 PRO CA C 62.67 . 1 33 . 4 PRO HA H 4.42 . 1 34 . 4 PRO CB C 31.97 . 1 35 . 4 PRO HB2 H 1.86 . 1 36 . 4 PRO HB3 H 2.28 . 1 37 . 4 PRO CG C 27.22 . 1 38 . 4 PRO HG2 H 1.98 . 2 39 . 4 PRO HG3 H 2.04 . 2 40 . 4 PRO CD C 51.08 . 1 41 . 4 PRO HD2 H 3.72 . 2 42 . 4 PRO HD3 H 3.92 . 2 43 . 5 SER H H 8.40 . 1 44 . 5 SER N N 117.56 . 1 45 . 5 SER CA C 56.06 . 1 46 . 5 SER HA H 4.71 . 1 47 . 5 SER CB C 63.62 . 1 48 . 5 SER HB2 H 3.8 . 1 49 . 5 SER HB3 H 3.88 . 1 50 . 6 PRO CA C 62.91 . 1 51 . 6 PRO HA H 4.46 . 1 52 . 6 PRO CB C 32.03 . 1 53 . 6 PRO HB2 H 1.86 . 1 54 . 6 PRO HB3 H 2.22 . 1 55 . 6 PRO CG C 27.22 . 1 56 . 6 PRO HG2 H 1.94 . 2 57 . 6 PRO CD C 50.84 . 1 58 . 6 PRO HD2 H 3.63 . 2 59 . 6 PRO HD3 H 3.77 . 2 60 . 7 CYS H H 8.44 . 1 61 . 7 CYS N N 118.24 . 1 62 . 7 CYS CA C 53.24 . 1 63 . 7 CYS HA H 4.86 . 1 64 . 7 CYS CB C 39.24 . 1 65 . 7 CYS HB2 H 2.67 . 1 66 . 7 CYS HB3 H 3.16 . 1 67 . 8 CYS H H 8.87 . 1 68 . 8 CYS N N 122.61 . 1 69 . 8 CYS CA C 56.57 . 1 70 . 8 CYS HA H 4.36 . 1 71 . 8 CYS CB C 44.9 . 1 72 . 8 CYS HB2 H 2.7 . 1 73 . 8 CYS HB3 H 2.94 . 1 74 . 9 MET H H 8.94 . 1 75 . 9 MET N N 125.30 . 1 76 . 9 MET CA C 56.03 . 1 77 . 9 MET HA H 4.44 . 1 78 . 9 MET CB C 32.36 . 1 79 . 9 MET HB2 H 2.45 . 1 80 . 9 MET HB3 H 2.64 . 1 81 . 9 MET CG C 32.44 . 1 82 . 9 MET HG2 H 1.99 . 2 83 . 9 MET HG3 H 2.09 . 2 84 . 10 PHE H H 7.27 . 1 85 . 10 PHE N N 114.18 . 1 86 . 10 PHE CA C 55.61 . 1 87 . 10 PHE HA H 4.39 . 1 88 . 10 PHE CB C 40.18 . 1 89 . 10 PHE HB2 H 2.94 . 1 90 . 10 PHE HB3 H 3.27 . 1 91 . 10 PHE CD1 C 133.21 . 2 92 . 10 PHE HD1 H 7.11 . 2 93 . 10 PHE CE1 C 130.97 . 2 94 . 10 PHE HE1 H 7.42 . 2 95 . 10 PHE CZ C 118.29 . 1 96 . 10 PHE HZ H 6.81 . 1 97 . 11 PHE H H 8.80 . 1 98 . 11 PHE N N 121.02 . 1 99 . 11 PHE CA C 54.63 . 1 100 . 11 PHE HA H 5.21 . 1 101 . 11 PHE CB C 39.95 . 1 102 . 11 PHE HB2 H 2.98 . 1 103 . 11 PHE HB3 H 3.36 . 1 104 . 11 PHE CD1 C 130.97 . 2 105 . 11 PHE HD1 H 7.14 . 2 106 . 11 PHE CE1 C 131.71 . 2 107 . 11 PHE HE1 H 7.30 . 2 108 . 12 VAL H H 9.08 . 1 109 . 12 VAL N N 119.23 . 1 110 . 12 VAL CA C 62.47 . 1 111 . 12 VAL HA H 4.53 . 1 112 . 12 VAL CB C 32.56 . 1 113 . 12 VAL HB H 2.56 . 1 114 . 12 VAL CG1 C 19.66 . 1 115 . 12 VAL HG1 H 1.35 . 1 116 . 12 VAL CG2 C 22.5 . 1 117 . 12 VAL HG2 H 1.38 . 1 118 . 13 SER H H 8.81 . 1 119 . 13 SER N N 118.25 . 1 120 . 13 SER CA C 59.41 . 1 121 . 13 SER HA H 4.63 . 1 122 . 13 SER CB C 63.98 . 1 123 . 13 SER HB2 H 4.03 . 1 124 . 13 SER HB3 H 4.08 . 1 125 . 14 LYS H H 7.53 . 1 126 . 14 LYS N N 120.98 . 1 127 . 14 LYS CA C 54.55 . 1 128 . 14 LYS HA H 4.44 . 1 129 . 14 LYS CB C 34.67 . 1 130 . 14 LYS HB2 H 1.65 . 1 131 . 14 LYS CG C 24.62 . 1 132 . 14 LYS HG2 H 1.33 . 2 133 . 14 LYS CD C 29.11 . 1 134 . 14 LYS HD2 H 1.64 . 2 135 . 14 LYS CE C 42.10 . 1 136 . 14 LYS HE2 H 2.97 . 2 137 . 15 ARG H H 7.93 . 1 138 . 15 ARG N N 121.57 . 1 139 . 15 ARG CA C 56.06 . 1 140 . 15 ARG HA H 2.06 . 1 141 . 15 ARG CB C 29.98 . 1 142 . 15 ARG HB2 H 0.55 . 1 143 . 15 ARG HB3 H 0.71 . 1 144 . 15 ARG CG C 25.57 . 1 145 . 15 ARG HG2 H 0.26 . 2 146 . 15 ARG HG3 H 0.59 . 2 147 . 15 ARG CD C 43.76 . 1 148 . 15 ARG HD2 H 2.61 . 2 149 . 15 ARG HD3 H 2.80 . 2 150 . 16 ILE H H 5.13 . 1 151 . 16 ILE N N 125.04 . 1 152 . 16 ILE CA C 58.35 . 1 153 . 16 ILE HA H 4.16 . 1 154 . 16 ILE CB C 40.64 . 1 155 . 16 ILE HB H 1.44 . 1 156 . 16 ILE CG1 C 26.77 . 1 157 . 16 ILE HG12 H 1.15 . 2 158 . 16 ILE HG13 H 1.63 . 2 159 . 16 ILE CG2 C 16.45 . 1 160 . 16 ILE HG2 H 0.95 . 1 161 . 16 ILE CD1 C 14.49 . 1 162 . 16 ILE HD1 H 0.95 . 1 163 . 17 PRO CA C 63.9 . 1 164 . 17 PRO HA H 4.2 . 1 165 . 17 PRO CB C 31.81 . 1 166 . 17 PRO HB2 H 1.81 . 1 167 . 17 PRO HB3 H 2.33 . 1 168 . 17 PRO CG C 28.17 . 1 169 . 17 PRO HG2 H 1.98 . 2 170 . 17 PRO CD C 50.84 . 1 171 . 17 PRO HD2 H 3.44 . 2 172 . 17 PRO HD3 H 3.91 . 2 173 . 18 GLU H H 8.63 . 1 174 . 18 GLU N N 128.09 . 1 175 . 18 GLU CA C 59.93 . 1 176 . 18 GLU HA H 3.22 . 1 177 . 18 GLU CB C 29.45 . 1 178 . 18 GLU HB2 H 1.67 . 1 179 . 18 GLU CG C 35.49 . 1 180 . 18 GLU HG2 H 1.09 . 2 181 . 18 GLU HG3 H 1.94 . 2 182 . 19 ASN H H 8.35 . 1 183 . 19 ASN N N 112.71 . 1 184 . 19 ASN CA C 54.08 . 1 185 . 19 ASN HA H 4.41 . 1 186 . 19 ASN CB C 36.76 . 1 187 . 19 ASN HB2 H 2.77 . 1 188 . 19 ASN HB3 H 3.03 . 1 189 . 19 ASN ND2 N 110.44 . 1 190 . 19 ASN HD21 H 7.55 . 1 191 . 19 ASN HD22 H 6.69 . 1 192 . 20 ARG H H 7.78 . 1 193 . 20 ARG N N 116.33 . 1 194 . 20 ARG CA C 55.83 . 1 195 . 20 ARG HA H 4.39 . 1 196 . 20 ARG CB C 31.15 . 1 197 . 20 ARG HB2 H 1.81 . 1 198 . 20 ARG HB3 H 2.14 . 1 199 . 20 ARG CG C 27.22 . 1 200 . 20 ARG HG2 H 1.75 . 2 201 . 20 ARG CD C 43.52 . 1 202 . 20 ARG HD2 H 3.06 . 2 203 . 20 ARG HD3 H 3.20 . 2 204 . 21 VAL H H 7.45 . 1 205 . 21 VAL N N 117.82 . 1 206 . 21 VAL CA C 63.61 . 1 207 . 21 VAL HA H 4.11 . 1 208 . 21 VAL CB C 32.62 . 1 209 . 21 VAL HB H 2.19 . 1 210 . 21 VAL CG1 C 21.79 . 1 211 . 21 VAL HG1 H 0.86 . 1 212 . 21 VAL CG2 C 23.91 . 1 213 . 21 VAL HG2 H 1.09 . 1 214 . 22 VAL H H 9.00 . 1 215 . 22 VAL N N 120.17 . 1 216 . 22 VAL CA C 62.12 . 1 217 . 22 VAL HA H 4.48 . 1 218 . 22 VAL CB C 33.77 . 1 219 . 22 VAL HB H 2.09 . 1 220 . 22 VAL CG1 C 19.9 . 1 221 . 22 VAL HG1 H 0.81 . 1 222 . 22 VAL CG2 C 21.55 . 1 223 . 22 VAL HG2 H 0.91 . 1 224 . 23 SER H H 7.89 . 1 225 . 23 SER N N 112.65 . 1 226 . 23 SER CA C 58.18 . 1 227 . 23 SER HA H 4.81 . 1 228 . 23 SER CB C 64.95 . 1 229 . 23 SER HB2 H 3.97 . 1 230 . 23 SER HB3 H 4.67 . 1 231 . 24 TYR H H 8.64 . 1 232 . 24 TYR N N 116.93 . 1 233 . 24 TYR CA C 56.06 . 1 234 . 24 TYR HA H 5.89 . 1 235 . 24 TYR CB C 42.66 . 1 236 . 24 TYR HB2 H 2.35 . 1 237 . 24 TYR HB3 H 2.7 . 1 238 . 24 TYR CD1 C 132.46 . 2 239 . 24 TYR HD1 H 6.77 . 2 240 . 24 TYR CE1 C 118.29 . 2 241 . 24 TYR HE1 H 6.86 . 2 242 . 25 GLN H H 8.61 . 1 243 . 25 GLN N N 117.91 . 1 244 . 25 GLN CA C 54.3 . 1 245 . 25 GLN HA H 4.44 . 1 246 . 25 GLN CB C 33.53 . 1 247 . 25 GLN HB2 H 1.95 . 1 248 . 25 GLN HB3 H 2.23 . 1 249 . 25 GLN HG2 H 2.17 . 2 250 . 25 GLN NE2 N 111.12 . 1 251 . 25 GLN HE21 H 7.46 . 2 252 . 25 GLN HE22 H 6.85 . 2 253 . 26 LEU H H 9.07 . 1 254 . 26 LEU N N 124.36 . 1 255 . 26 LEU CA C 55.17 . 1 256 . 26 LEU HA H 4.72 . 1 257 . 26 LEU CB C 42.07 . 1 258 . 26 LEU HB2 H 1.65 . 1 259 . 26 LEU HB3 H 1.76 . 1 260 . 26 LEU CG C 27.69 . 1 261 . 26 LEU HG H 1.98 . 1 262 . 26 LEU CD1 C 23.91 . 1 263 . 26 LEU HD1 H 0.96 . 1 264 . 26 LEU CD2 C 24.86 . 1 265 . 26 LEU HD2 H 1.01 . 1 266 . 27 SER H H 8.50 . 1 267 . 27 SER N N 117.91 . 1 268 . 27 SER CA C 57.51 . 1 269 . 27 SER HA H 4.55 . 1 270 . 27 SER CB C 63.71 . 1 271 . 27 SER HB2 H 3.85 . 1 272 . 28 SER H H 8.53 . 1 273 . 28 SER N N 119.27 . 1 274 . 28 SER CA C 57.51 . 1 275 . 28 SER HA H 4.63 . 1 276 . 28 SER CB C 64.18 . 1 277 . 28 SER HB2 H 3.83 . 1 278 . 28 SER HB3 H 3.97 . 1 279 . 29 ARG H H 8.52 . 1 280 . 29 ARG N N 124.34 . 1 281 . 29 ARG CA C 56.93 . 1 282 . 29 ARG HA H 4.44 . 1 283 . 29 ARG CB C 30.98 . 1 284 . 29 ARG HB2 H 1.84 . 1 285 . 29 ARG HB3 H 1.98 . 1 286 . 29 ARG CG C 27.46 . 1 287 . 29 ARG HG2 H 1.72 . 2 288 . 29 ARG CD C 43.29 . 1 289 . 29 ARG HD2 H 3.25 . 2 290 . 30 SER H H 8.62 . 1 291 . 30 SER N N 116.54 . 1 292 . 30 SER CA C 60.75 . 1 293 . 30 SER HA H 4.3 . 1 294 . 30 SER CB C 63.13 . 1 295 . 30 SER HB2 H 3.94 . 1 296 . 31 THR H H 7.37 . 1 297 . 31 THR N N 109.73 . 1 298 . 31 THR CA C 62.18 . 1 299 . 31 THR HA H 4.34 . 1 300 . 31 THR CB C 69.33 . 1 301 . 31 THR HB H 4.37 . 1 302 . 31 THR CG2 C 22.26 . 1 303 . 31 THR HG2 H 1.19 . 1 304 . 32 CYS H H 7.72 . 1 305 . 32 CYS N N 120.11 . 1 306 . 32 CYS CA C 53.22 . 1 307 . 32 CYS HA H 4.95 . 1 308 . 32 CYS CB C 40 . 1 309 . 32 CYS HB2 H 2.89 . 1 310 . 32 CYS HB3 H 3.27 . 1 311 . 33 LEU H H 8.31 . 1 312 . 33 LEU N N 122.31 . 1 313 . 33 LEU CA C 57.44 . 1 314 . 33 LEU HA H 4.11 . 1 315 . 33 LEU CB C 42.36 . 1 316 . 33 LEU HB2 H 1.53 . 1 317 . 33 LEU HB3 H 1.67 . 1 318 . 33 LEU CG C 27.22 . 1 319 . 33 LEU HG H 1.63 . 1 320 . 33 LEU CD1 C 24.62 . 1 321 . 33 LEU HD1 H 0.83 . 1 322 . 33 LEU CD2 C 23.68 . 1 323 . 33 LEU HD2 H 0.88 . 1 324 . 34 LYS H H 7.89 . 1 325 . 34 LYS N N 117.40 . 1 326 . 34 LYS CA C 55.01 . 1 327 . 34 LYS HA H 4.44 . 1 328 . 34 LYS CB C 34.45 . 1 329 . 34 LYS HB2 H 1.63 . 1 330 . 34 LYS CG C 24.62 . 1 331 . 34 LYS HG2 H 1.21 . 2 332 . 34 LYS CD C 29.11 . 1 333 . 34 LYS HD2 H 1.30 . 2 334 . 34 LYS CE C 41.87 . 1 335 . 34 LYS HE2 H 2.61 . 2 336 . 34 LYS HE3 H 2.69 . 2 337 . 35 ALA H H 8.39 . 1 338 . 35 ALA N N 125.72 . 1 339 . 35 ALA CA C 51.8 . 1 340 . 35 ALA HA H 4.49 . 1 341 . 35 ALA CB C 19.21 . 1 342 . 35 ALA HB H 1.41 . 1 343 . 36 GLY H H 8.17 . 1 344 . 36 GLY N N 105.31 . 1 345 . 36 GLY CA C 45.65 . 1 346 . 36 GLY HA2 H 4.51 . 2 347 . 36 GLY HA3 H 4.03 . 2 348 . 37 VAL H H 8.34 . 1 349 . 37 VAL N N 122.31 . 1 350 . 37 VAL CA C 62.11 . 1 351 . 37 VAL HA H 4.16 . 1 352 . 37 VAL CB C 32.84 . 1 353 . 37 VAL HB H 1.41 . 1 354 . 37 VAL CG1 C 21.32 . 1 355 . 37 VAL HG1 H -0.03 . 1 356 . 37 VAL CG2 C 21.10 . 1 357 . 37 VAL HG2 H 0.63 . 1 358 . 38 ILE H H 9.10 . 1 359 . 38 ILE N N 126.56 . 1 360 . 38 ILE CA C 60.35 . 1 361 . 38 ILE HA H 4.39 . 1 362 . 38 ILE CB C 37.85 . 1 363 . 38 ILE HB H 1.88 . 1 364 . 38 ILE CG1 C 27.69 . 1 365 . 38 ILE HG12 H 1.42 . 2 366 . 38 ILE HG13 H 1.08 . 2 367 . 38 ILE CG2 C 18.27 . 1 368 . 38 ILE HG2 H 0.75 . 1 369 . 38 ILE CD1 C 13.28 . 1 370 . 38 ILE HD1 H 0.72 . 1 371 . 39 PHE H H 9.54 . 1 372 . 39 PHE N N 129.44 . 1 373 . 39 PHE CA C 57.95 . 1 374 . 39 PHE HA H 5.47 . 1 375 . 39 PHE CB C 40.95 . 1 376 . 39 PHE HB2 H 3.1 . 1 377 . 39 PHE CD1 C 133.21 . 2 378 . 39 PHE HD1 H 7.37 . 2 379 . 39 PHE CE1 C 130.97 . 2 380 . 39 PHE HE1 H 6.93 . 2 381 . 39 PHE CZ C 130.22 . 1 382 . 39 PHE HZ H 7.28 . 1 383 . 40 THR H H 8.61 . 1 384 . 40 THR N N 118.23 . 1 385 . 40 THR CA C 62.35 . 1 386 . 40 THR HA H 5.35 . 1 387 . 40 THR CB C 69.76 . 1 388 . 40 THR HB H 4.1 . 1 389 . 40 THR CG2 C 21.55 . 1 390 . 40 THR HG2 H 1.28 . 1 391 . 41 THR H H 8.88 . 1 392 . 41 THR N N 117.04 . 1 393 . 41 THR CA C 59.82 . 1 394 . 41 THR HA H 5.56 . 1 395 . 41 THR CB C 71.66 . 1 396 . 41 THR HB H 4.77 . 1 397 . 41 THR CG2 C 21.32 . 1 398 . 41 THR HG2 H 1.23 . 1 399 . 42 LYS H H 8.67 . 1 400 . 42 LYS N N 121.53 . 1 401 . 42 LYS CA C 59.14 . 1 402 . 42 LYS HA H 4.02 . 1 403 . 42 LYS CB C 32.85 . 1 404 . 42 LYS HB2 H 1.86 . 1 405 . 42 LYS HB3 H 1.95 . 1 406 . 42 LYS CG C 25.8 . 1 407 . 42 LYS HG2 H 1.47 . 2 408 . 42 LYS CD C 29.35 . 1 409 . 42 LYS HD2 H 1.70 . 2 410 . 42 LYS CE C 42.10 . 1 411 . 42 LYS HE2 H 2.97 . 2 412 . 43 LYS H H 8.07 . 1 413 . 43 LYS N N 115.89 . 1 414 . 43 LYS CA C 56.14 . 1 415 . 43 LYS HA H 4.39 . 1 416 . 43 LYS CB C 31.93 . 1 417 . 43 LYS HB2 H 1.76 . 1 418 . 43 LYS HB3 H 2.05 . 1 419 . 43 LYS CG C 25.57 . 1 420 . 43 LYS HG2 H 1.52 . 2 421 . 43 LYS CD C 28.88 . 1 422 . 43 LYS HD2 H 1.70 . 2 423 . 43 LYS CE C 41.87 . 1 424 . 43 LYS HE2 H 3.02 . 2 425 . 44 GLY H H 8.14 . 1 426 . 44 GLY N N 107.91 . 1 427 . 44 GLY CA C 45.51 . 1 428 . 44 GLY HA2 H 4.25 . 2 429 . 44 GLY HA3 H 3.64 . 2 430 . 45 GLN H H 7.26 . 1 431 . 45 GLN N N 118.92 . 1 432 . 45 GLN CA C 55.6 . 1 433 . 45 GLN HA H 4.44 . 1 434 . 45 GLN CB C 29.52 . 1 435 . 45 GLN HB2 H 2 . 1 436 . 45 GLN HB3 H 2.16 . 1 437 . 45 GLN CG C 34.07 . 1 438 . 45 GLN HG2 H 2.36 . 2 439 . 45 GLN NE2 N 112.47 . 1 440 . 45 GLN HE21 H 7.63 . 2 441 . 45 GLN HE22 H 6.89 . 2 442 . 46 GLN H H 8.65 . 1 443 . 46 GLN N N 121.35 . 1 444 . 46 GLN CA C 54.88 . 1 445 . 46 GLN HA H 5.66 . 1 446 . 46 GLN CB C 31.24 . 1 447 . 46 GLN HB2 H 1.76 . 1 448 . 46 GLN HB3 H 2.01 . 1 449 . 46 GLN CG C 34.31 . 1 450 . 46 GLN HG2 H 2.36 . 2 451 . 46 GLN NE2 N 111.12 . 1 452 . 46 GLN HE21 H 7.31 . 2 453 . 46 GLN HE22 H 6.66 . 2 454 . 47 SER H H 8.93 . 1 455 . 47 SER N N 117.73 . 1 456 . 47 SER CA C 57.93 . 1 457 . 47 SER HA H 4.74 . 1 458 . 47 SER CB C 66.93 . 1 459 . 47 SER HB2 H 3.69 . 1 460 . 47 SER HB3 H 3.97 . 1 461 . 48 CYS H H 9.25 . 1 462 . 48 CYS N N 123.15 . 1 463 . 48 CYS CA C 55.11 . 1 464 . 48 CYS HA H 5.77 . 1 465 . 48 CYS CB C 46.08 . 1 466 . 48 CYS HB2 H 3.41 . 1 467 . 48 CYS HB3 H 3.59 . 1 468 . 49 GLY H H 9.99 . 1 469 . 49 GLY N N 111.97 . 1 470 . 49 GLY CA C 43.26 . 1 471 . 49 GLY HA2 H 4.91 . 2 472 . 49 GLY HA3 H 3.13 . 2 473 . 50 ASP H H 8.22 . 1 474 . 50 ASP N N 123.49 . 1 475 . 50 ASP CA C 50.37 . 1 476 . 50 ASP HA H 3.59 . 1 477 . 50 ASP CB C 41.87 . 1 478 . 50 ASP HB2 H 1.62 . 1 479 . 50 ASP HB3 H 2.42 . 1 480 . 51 PRO CA C 63.62 . 1 481 . 51 PRO HA H 3.88 . 1 482 . 51 PRO CB C 31.96 . 1 483 . 51 PRO HB2 H 1.86 . 1 484 . 51 PRO HB3 H 2 . 1 485 . 51 PRO CG C 26.99 . 1 486 . 51 PRO HG2 H 1.83 . 2 487 . 51 PRO CD C 51.32 . 1 488 . 51 PRO HD2 H 3.87 . 2 489 . 52 LYS H H 8.06 . 1 490 . 52 LYS N N 116.44 . 1 491 . 52 LYS CA C 57.01 . 1 492 . 52 LYS HA H 3.97 . 1 493 . 52 LYS CB C 32.17 . 1 494 . 52 LYS HB2 H 1.72 . 1 495 . 52 LYS CG C 25.33 . 1 496 . 52 LYS HG2 H 1.56 . 2 497 . 52 LYS CD C 28.88 . 1 498 . 52 LYS HD2 H 1.98 . 2 499 . 52 LYS CE C 41.87 . 1 500 . 52 LYS HE2 H 3.02 . 2 501 . 53 GLN H H 7.82 . 1 502 . 53 GLN N N 118.52 . 1 503 . 53 GLN CA C 55.11 . 1 504 . 53 GLN HA H 4.16 . 1 505 . 53 GLN CB C 28.65 . 1 506 . 53 GLN HB2 H 1.67 . 1 507 . 53 GLN HB3 H 1.81 . 1 508 . 53 GLN CG C 34.31 . 1 509 . 53 GLN HG2 H 2.36 . 2 510 . 53 GLN NE2 N 112.47 . 1 511 . 53 GLN HE21 H 7.60 . 2 512 . 53 GLN HE22 H 7.09 . 2 513 . 54 GLU H H 8.79 . 1 514 . 54 GLU N N 125.28 . 1 515 . 54 GLU CA C 60.32 . 1 516 . 54 GLU HA H 3.8 . 1 517 . 54 GLU CB C 28.67 . 1 518 . 54 GLU HB2 H 2.16 . 1 519 . 54 GLU CG C 35.96 . 1 520 . 54 GLU HG2 H 2.27 . 2 521 . 54 GLU HG3 H 2.45 . 2 522 . 55 TRP H H 8.16 . 1 523 . 55 TRP N N 116.19 . 1 524 . 55 TRP CA C 59.36 . 1 525 . 55 TRP HA H 4.11 . 1 526 . 55 TRP CB C 26.74 . 1 527 . 55 TRP HB2 H 2.9 . 1 528 . 55 TRP HB3 H 3.08 . 1 529 . 55 TRP CD1 C 122.76 . 1 530 . 55 TRP HD1 H 6.79 . 1 531 . 55 TRP NE1 N 129.78 . 1 532 . 55 TRP HE1 H 10.16 . 1 533 . 55 TRP CZ2 C 115.3 . 1 534 . 55 TRP HZ2 H 7.35 . 1 535 . 55 TRP CH2 C 122.76 . 1 536 . 55 TRP HH2 H 6.79 . 1 537 . 55 TRP CZ3 C 121.27 . 1 538 . 55 TRP HZ3 H 6.20 . 1 539 . 55 TRP CE3 C 122.02 . 1 540 . 55 TRP HE3 H 5.80 . 1 541 . 56 VAL H H 5.56 . 1 542 . 56 VAL N N 122.36 . 1 543 . 56 VAL CA C 65.57 . 1 544 . 56 VAL HA H 2.7 . 1 545 . 56 VAL CB C 30.96 . 1 546 . 56 VAL HB H 1.71 . 1 547 . 56 VAL CG1 C 20.37 . 1 548 . 56 VAL HG1 H -0.83 . 1 549 . 56 VAL CG2 C 21.32 . 1 550 . 56 VAL HG2 H 0.44 . 1 551 . 57 GLN H H 6.95 . 1 552 . 57 GLN N N 116.72 . 1 553 . 57 GLN CA C 58.41 . 1 554 . 57 GLN HA H 3.86 . 1 555 . 57 GLN CB C 27.76 . 1 556 . 57 GLN HB2 H 2.05 . 1 557 . 57 GLN CG C 32.89 . 1 558 . 57 GLN HG2 H 2.27 . 2 559 . 57 GLN HG3 H 2.36 . 2 560 . 57 GLN NE2 N 111.12 . 1 561 . 57 GLN HE21 H 7.56 . 2 562 . 57 GLN HE22 H 6.70 . 2 563 . 58 ARG H H 8.48 . 1 564 . 58 ARG N N 120.62 . 1 565 . 58 ARG CA C 59.09 . 1 566 . 58 ARG HA H 4.06 . 1 567 . 58 ARG CB C 30.07 . 1 568 . 58 ARG HB2 H 2.05 . 1 569 . 58 ARG CG C 26.99 . 1 570 . 58 ARG HG2 H 1.8 . 2 571 . 58 ARG HG3 H 2.03 . 2 572 . 58 ARG CD C 43.29 . 1 573 . 58 ARG HD2 H 3.34 . 2 574 . 59 TYR H H 8.84 . 1 575 . 59 TYR N N 120.21 . 1 576 . 59 TYR CA C 59.41 . 1 577 . 59 TYR HA H 4.44 . 1 578 . 59 TYR CB C 37.11 . 1 579 . 59 TYR HB2 H 2.89 . 1 580 . 59 TYR HB3 H 3.48 . 1 581 . 59 TYR CD1 C 130.97 . 2 582 . 59 TYR HD1 H 6.74 . 2 583 . 59 TYR CE1 C 116.79 . 2 584 . 59 TYR HE1 H 6.79 . 2 585 . 60 MET H H 7.87 . 1 586 . 60 MET N N 117.10 . 1 587 . 60 MET CA C 60.39 . 1 588 . 60 MET HA H 3.64 . 1 589 . 60 MET CB C 34.4 . 1 590 . 60 MET HB2 H 1.68 . 1 591 . 60 MET HB3 H 2.05 . 1 592 . 60 MET CG C 30.29 . 1 593 . 60 MET HG2 H 2.27 . 2 594 . 60 MET HG3 H 0.55 . 2 595 . 60 MET CE C 53.60 . 1 596 . 60 MET HE H 1.82 . 1 597 . 61 LYS H H 7.63 . 1 598 . 61 LYS N N 117.67 . 1 599 . 61 LYS CA C 59.34 . 1 600 . 61 LYS HA H 4.11 . 1 601 . 61 LYS CB C 32.19 . 1 602 . 61 LYS HB2 H 2 . 1 603 . 61 LYS CG C 25.1 . 1 604 . 61 LYS HG2 H 1.52 . 2 605 . 61 LYS CD C 29.35 . 1 606 . 61 LYS HD2 H 1.70 . 2 607 . 61 LYS CE C 42.34 . 1 608 . 61 LYS HE2 H 3.02 . 2 609 . 62 ASN H H 8.50 . 1 610 . 62 ASN N N 119.27 . 1 611 . 62 ASN CA C 55.52 . 1 612 . 62 ASN HA H 4.53 . 1 613 . 62 ASN CB C 37.37 . 1 614 . 62 ASN HB2 H 2.82 . 1 615 . 62 ASN HB3 H 3.05 . 1 616 . 62 ASN ND2 N 112.13 . 1 617 . 62 ASN HD21 H 8.81 . 2 618 . 62 ASN HD22 H 6.60 . 2 619 . 63 LEU H H 8.50 . 1 620 . 63 LEU N N 122.99 . 1 621 . 63 LEU CA C 58.3 . 1 622 . 63 LEU HA H 4.2 . 1 623 . 63 LEU CB C 41.63 . 1 624 . 63 LEU HB2 H 1.77 . 1 625 . 63 LEU HB3 H 2.08 . 1 626 . 63 LEU CG C 27.69 . 1 627 . 63 LEU HG H 1.98 . 1 628 . 63 LEU CD1 C 23.44 . 1 629 . 63 LEU HD1 H 0.91 . 1 630 . 63 LEU CD2 C 26.75 . 1 631 . 63 LEU HD2 H 1.09 . 1 632 . 64 ASP H H 8.82 . 1 633 . 64 ASP N N 121.48 . 1 634 . 64 ASP CA C 57.05 . 1 635 . 64 ASP HA H 4.55 . 1 636 . 64 ASP CB C 39.92 . 1 637 . 64 ASP HB2 H 2.75 . 1 638 . 64 ASP HB3 H 2.94 . 1 639 . 65 ALA H H 7.84 . 1 640 . 65 ALA N N 121.38 . 1 641 . 65 ALA CA C 54.14 . 1 642 . 65 ALA HA H 4.25 . 1 643 . 65 ALA CB C 18.5 . 1 644 . 65 ALA HB H 1.58 . 1 645 . 66 LYS H H 7.62 . 1 646 . 66 LYS N N 117.40 . 1 647 . 66 LYS CA C 57.05 . 1 648 . 66 LYS HA H 4.25 . 1 649 . 66 LYS CB C 32.11 . 1 650 . 66 LYS HB2 H 2 . 1 651 . 66 LYS CG C 25.33 . 1 652 . 66 LYS HG2 H 1.56 . 2 653 . 66 LYS CD C 29.35 . 1 654 . 66 LYS HD2 H 1.70 . 2 655 . 66 LYS CE C 42.1 . 1 656 . 66 LYS HE2 H 3.02 . 2 657 . 67 GLN H H 7.86 . 1 658 . 67 GLN N N 118.49 . 1 659 . 67 GLN CA C 56.54 . 1 660 . 67 GLN HA H 4.34 . 1 661 . 67 GLN CB C 29.14 . 1 662 . 67 GLN HB2 H 2.19 . 1 663 . 67 GLN CG C 33.84 . 1 664 . 67 GLN HG2 H 2.5 . 1 665 . 67 GLN NE2 N 111.46 . 1 666 . 67 GLN HE21 H 7.51 . 1 667 . 67 GLN HE22 H 6.86 . 1 668 . 68 LYS H H 8.03 . 1 669 . 68 LYS N N 121.07 . 1 670 . 68 LYS CA C 56.76 . 1 671 . 68 LYS HA H 4.3 . 1 672 . 68 LYS CB C 32.71 . 1 673 . 68 LYS HB2 H 1.86 . 1 674 . 68 LYS CG C 24.86 . 1 675 . 68 LYS HG2 H 1.52 . 2 676 . 68 LYS CD C 29.11 . 1 677 . 68 LYS HD2 H 1.70 . 2 678 . 68 LYS CE C 41.89 . 1 679 . 68 LYS HE2 H 3.02 . 2 680 . 69 LYS H H 8.15 . 1 681 . 69 LYS N N 122.04 . 1 682 . 69 LYS CA C 56.08 . 1 683 . 69 LYS HA H 4.32 . 1 684 . 69 LYS CB C 33.12 . 1 685 . 69 LYS HB2 H 1.83 . 1 686 . 69 LYS CG C 24.86 . 1 687 . 69 LYS HG2 H 1.47 . 2 688 . 69 LYS CD C 29.11 . 1 689 . 69 LYS HD2 H 1.70 . 2 690 . 69 LYS CE C 41.89 . 1 691 . 69 LYS HE2 H 3.02 . 2 692 . 70 ALA H H 8.27 . 1 693 . 70 ALA N N 125.30 . 1 694 . 70 ALA CA C 52.3 . 1 695 . 70 ALA HA H 4.39 . 1 696 . 70 ALA CB C 19.68 . 1 697 . 70 ALA HB H 1.43 . 1 698 . 71 SER H H 8.28 . 1 699 . 71 SER N N 116.88 . 1 700 . 71 SER CA C 56.33 . 1 701 . 71 SER HA H 4.78 . 1 702 . 71 SER CB C 63.14 . 1 703 . 71 SER HB2 H 3.88 . 1 704 . 72 PRO CA C 63.62 . 1 705 . 72 PRO HA H 4.44 . 1 706 . 72 PRO CB C 31.96 . 1 707 . 72 PRO HB2 H 1.81 . 1 708 . 72 PRO HB3 H 2.30 . 1 709 . 72 PRO CG C 27.46 . 1 710 . 72 PRO HG2 H 1.98 . 2 711 . 72 PRO CD C 50.84 . 1 712 . 72 PRO HD2 H 3.81 . 2 713 . 73 ARG H H 7.90 . 1 714 . 73 ARG N N 125.62 . 1 715 . 73 ARG CA C 57.46 . 1 716 . 73 ARG HA H 4.19 . 1 717 . 73 ARG CB C 31.73 . 1 718 . 73 ARG HB2 H 1.72 . 1 719 . 73 ARG HB3 H 1.86 . 1 720 . 73 ARG CG C 26.77 . 1 721 . 73 ARG HG2 H 1.63 . 2 722 . 73 ARG CD C 43.78 . 1 723 . 73 ARG HD2 H 3.22 . 2 stop_ save_ ######################## # Coupling constants # ######################## save_coupling_constants _Saveframe_category coupling_constants _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_cond_1 _Spectrometer_frequency_1H 500 _Mol_system_component_name EOTAXIN-2 _Text_data_format . _Text_data . loop_ _Coupling_constant_ID _Coupling_constant_code _Atom_one_residue_seq_code _Atom_one_residue_label _Atom_one_name _Atom_two_residue_seq_code _Atom_two_residue_label _Atom_two_name _Coupling_constant_value _Coupling_constant_min_value _Coupling_constant_max_value _Coupling_constant_value_error 1 3JHNHA 2 VAL H 2 VAL HA 8.95 . . . 2 3JHNHA 3 ILE H 3 ILE HA 8.78 . . . 3 3JHNHA 5 SER H 5 SER HA 8.07 . . . 4 3JHNHA 9 MET H 9 MET HA 9.90 . . . 5 3JHNHA 10 PHE H 10 PHE HA 6.41 . . . 6 3JHNHA 11 PHE H 11 PHE HA 8.35 . . . 7 3JHNHA 12 VAL H 12 VAL HA 5.50 . . . 8 3JHNHA 13 SER H 13 SER HA 7.71 . . . 9 3JHNHA 14 LYS H 14 LYS HA 8.89 . . . 10 3JHNHA 15 ARG H 15 ARG HA 2.85 . . . 11 3JHNHA 18 GLU H 18 GLU HA 2.90 . . . 12 3JHNHA 19 ASN H 19 ASN HA 6.33 . . . 13 3JHNHA 20 ARG H 20 ARG HA 9.46 . . . 14 3JHNHA 21 VAL H 21 VAL HA 8.64 . . . 15 3JHNHA 22 VAL H 22 VAL HA 11.87 . . . 16 3JHNHA 23 SER H 23 SER HA 7.00 . . . 17 3JHNHA 24 TYR H 24 TYR HA 9.08 . . . 18 3JHNHA 26 LEU H 26 LEU HA 7.79 . . . 19 3JHNHA 27 SER H 27 SER HA 8.73 . . . 20 3JHNHA 28 SER H 28 SER HA 8.87 . . . 21 3JHNHA 29 ARG H 29 ARG HA 7.24 . . . 22 3JHNHA 31 THR H 31 THR HA 6.23 . . . 23 3JHNHA 32 CYS H 32 CYS HA 9.25 . . . 24 3JHNHA 33 LEU H 33 LEU HA 7.40 . . . 25 3JHNHA 35 ALA H 35 ALA HA 7.24 . . . 26 3JHNHA 38 ILE H 38 ILE HA 9.19 . . . 27 3JHNHA 39 PHE H 39 PHE HA 9.46 . . . 28 3JHNHA 41 THR H 41 THR HA 9.30 . . . 29 3JHNHA 42 LYS H 42 LYS HA 3.31 . . . 30 3JHNHA 43 LYS H 43 LYS HA 8.54 . . . 31 3JHNHA 45 GLN H 45 GLN HA 8.24 . . . 32 3JHNHA 46 GLN H 46 GLN HA 9.88 . . . 33 3JHNHA 47 SER H 47 SER HA 9.23 . . . 34 3JHNHA 48 CYS H 48 CYS HA 8.37 . . . 35 3JHNHA 50 ASP H 50 ASP HA 5.45 . . . 36 3JHNHA 52 LYS H 52 LYS HA 7.74 . . . 37 3JHNHA 54 GLU H 54 GLU HA 2.93 . . . 38 3JHNHA 55 TRP H 55 TRP HA 4.45 . . . 39 3JHNHA 56 VAL H 56 VAL HA 5.45 . . . 40 3JHNHA 57 GLN H 57 GLN HA 5.36 . . . 41 3JHNHA 58 ARG H 58 ARG HA 4.78 . . . 42 3JHNHA 59 TYR H 59 TYR HA 4.19 . . . 43 3JHNHA 60 MET H 60 MET HA 4.66 . . . 44 3JHNHA 63 LEU H 63 LEU HA 3.85 . . . 45 3JHNHA 64 ASP H 64 ASP HA 4.58 . . . 46 3JHNHA 65 ALA H 65 ALA HA 5.14 . . . 47 3JHNHA 68 LYS H 68 LYS HA 6.64 . . . 48 3JHNHA 69 LYS H 69 LYS HA 7.31 . . . 49 3JHNHA 70 ALA H 70 ALA HA 6.34 . . . 50 3JHNHA 71 SER H 71 SER HA 7.71 . . . 51 3JHNHA 73 ARG H 73 ARG HA 8.10 . . . stop_ save_