data_5373 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Sequence-specific NMR resonance assignments for Human Interleukin-5 ; _BMRB_accession_number 5373 _BMRB_flat_file_name bmr5373.str _Entry_type original _Submission_date 2002-05-10 _Accession_date 2002-05-10 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Feng Hanqiao . . 2 Banville Debra L. . 3 Guiles Ronald D. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 644 "13C chemical shifts" 450 "15N chemical shifts" 115 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2002-09-25 original BMRB . stop_ _Original_release_date 2002-05-10 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Letter to the Editor: Sequence-specific NMR resonance assignments for Human Interleukin-5 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Feng Hanqiao . . 2 Banville Debra L. . 3 Guiles Ronald D. . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 23 _Journal_issue 4 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 329 _Page_last 330 _Year 2002 _Details . loop_ _Keyword Interleukin-5 asthma eosinophils 'heteroneuclear NMR' stop_ save_ ################################## # Molecular system description # ################################## save_system_IL5 _Saveframe_category molecular_system _Mol_system_name 'IL5 dimer' _Abbreviation_common IL5 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Il5 subunit 1' $IL5 'Il5 subunit 2' $IL5 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state dimer _System_paramagnetic no _System_thiol_state 'all disulfide bound' loop_ _Magnetic_equivalence_ID _Magnetically_equivalent_system_component 1 'Il5 subunit 1' 1 'Il5 subunit 2' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_IL5 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Interleukin-5 _Abbreviation_common IL-5 _Molecular_mass . _Mol_thiol_state 'all disulfide bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 115 _Mol_residue_sequence ; MPTEIPTSALVKETLALLST HRTLLIANETLRIPVPVHKN HQLCTEEIFQGIGTLESQTV QGGTVERLFKNLSLIKKYID GQKKKCGEERRRVNQFLDYL QEFLGVMNTEWIIES ; loop_ _Residue_seq_code _Residue_label 1 MET 2 PRO 3 THR 4 GLU 5 ILE 6 PRO 7 THR 8 SER 9 ALA 10 LEU 11 VAL 12 LYS 13 GLU 14 THR 15 LEU 16 ALA 17 LEU 18 LEU 19 SER 20 THR 21 HIS 22 ARG 23 THR 24 LEU 25 LEU 26 ILE 27 ALA 28 ASN 29 GLU 30 THR 31 LEU 32 ARG 33 ILE 34 PRO 35 VAL 36 PRO 37 VAL 38 HIS 39 LYS 40 ASN 41 HIS 42 GLN 43 LEU 44 CYS 45 THR 46 GLU 47 GLU 48 ILE 49 PHE 50 GLN 51 GLY 52 ILE 53 GLY 54 THR 55 LEU 56 GLU 57 SER 58 GLN 59 THR 60 VAL 61 GLN 62 GLY 63 GLY 64 THR 65 VAL 66 GLU 67 ARG 68 LEU 69 PHE 70 LYS 71 ASN 72 LEU 73 SER 74 LEU 75 ILE 76 LYS 77 LYS 78 TYR 79 ILE 80 ASP 81 GLY 82 GLN 83 LYS 84 LYS 85 LYS 86 CYS 87 GLY 88 GLU 89 GLU 90 ARG 91 ARG 92 ARG 93 VAL 94 ASN 95 GLN 96 PHE 97 LEU 98 ASP 99 TYR 100 LEU 101 GLN 102 GLU 103 PHE 104 LEU 105 GLY 106 VAL 107 MET 108 ASN 109 THR 110 GLU 111 TRP 112 ILE 113 ILE 114 GLU 115 SER stop_ _Sequence_homology_query_date 2008-08-19 _Sequence_homology_query_revised_last_date 2008-08-19 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 1HUL 'A Novel Dimer Configuration Revealed By The Crystal Structure At 2.4 Angstroms Resolution Of Human Interleukin- 5' 93.91 108 100.00 100.00 1.15e-56 EMBL CAA28390 'unnamed protein product [Homo sapiens]' 100.00 134 99.13 100.00 7.42e-61 EMBL CAA31210 'B cell differentiation factor I [Homo sapiens]' 100.00 134 98.26 99.13 3.71e-60 EMBL CAA31211 'B cell differentiation factor I [Homo sapiens]' 100.00 134 99.13 100.00 7.42e-61 GenBank AAA72829 'synthetic human interleukin (IL-5)' 100.00 134 99.13 100.00 7.42e-61 GenBank AAA74469 'interleukin 5' 100.00 134 99.13 100.00 7.42e-61 GenBank AAA98620 'interleukin 5' 100.00 134 99.13 100.00 7.42e-61 GenBank AAH66282 'Interleukin 5, precursor [Homo sapiens]' 100.00 134 99.13 100.00 7.42e-61 GenBank AAK19759 'interleukin 5 [Homo sapiens]' 100.00 134 99.13 100.00 7.42e-61 REF NP_000870 'interleukin 5 precursor [Homo sapiens]' 100.00 134 99.13 100.00 7.42e-61 REF XP_001163452 'PREDICTED: interleukin 5 [Pan troglodytes]' 100.00 134 99.13 100.00 7.42e-61 SWISS-PROT P05113 ; Interleukin-5 precursor (IL-5) (T-cell replacing factor) (TRF) (Eosinophil differentiation factor) (B-cell differentiation factor I) ; 100.00 134 99.13 100.00 7.42e-61 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $IL5 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 $IL5 '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 _Concentration_min_value _Concentration_max_value _Isotopic_labeling $IL5 0.8 mM 0.70 0.90 . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMXAvance _Field_strength 600 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model UNITYPlus _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 . save_ save_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label . save_ save_HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CO)CA _Sample_label . save_ save_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label . save_ save_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label . save_ save_CBCA(CO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name CBCA(CO)NH _Sample_label . save_ save_HBHA(CBCACO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name HBHA(CBCACO)NH _Sample_label . save_ save_HCCHTOCSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name HCCHTOCSY _Sample_label . save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.0 0.1 n/a temperature 303 0.2 K 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 _Indirect_shift_ratio TSP C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 TSP H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 TSP N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_set_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '1H-15N HSQC' HNCA HN(CO)CA HNCACB HNCO CBCA(CO)NH HBHA(CBCACO)NH HCCHTOCSY stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Ex-cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Il5 subunit 1' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 4 GLU H H 8.01 0.02 1 2 . 4 GLU HA H 4.84 0.02 1 3 . 4 GLU HB2 H 3.33 0.02 1 4 . 4 GLU HB3 H 3.33 0.02 1 5 . 4 GLU CA C 57.52 0.4 1 6 . 4 GLU CB C 29.76 0.4 1 7 . 4 GLU N N 122.92 0.1 1 8 . 5 ILE H H 8.24 0.02 1 9 . 5 ILE HA H 4.25 0.02 1 10 . 5 ILE HB H 1.88 0.02 1 11 . 5 ILE HG12 H 1.51 0.02 1 12 . 5 ILE HG13 H 1.51 0.02 1 13 . 5 ILE HG2 H 1.20 0.02 1 14 . 5 ILE HD1 H 0.88 0.02 1 15 . 5 ILE CA C 60.87 0.4 1 16 . 5 ILE CB C 38.46 0.4 1 17 . 5 ILE CG1 C 27.69 0.4 1 18 . 5 ILE CG2 C 16.04 0.4 1 19 . 5 ILE CD1 C 13.20 0.4 1 20 . 5 ILE N N 123.99 0.1 1 21 . 6 PRO HA H 4.45 0.02 1 22 . 6 PRO HB2 H 2.03 0.02 1 23 . 6 PRO HB3 H 2.03 0.02 1 24 . 6 PRO HG2 H 2.29 0.02 1 25 . 6 PRO HG3 H 2.29 0.02 1 26 . 6 PRO HD2 H 3.21 0.02 1 27 . 6 PRO HD3 H 3.21 0.02 1 28 . 6 PRO CA C 59.59 0.4 1 29 . 6 PRO CB C 32.25 0.4 1 30 . 7 THR H H 8.02 0.02 1 31 . 7 THR HA H 3.92 0.02 1 32 . 7 THR HG2 H 0.73 0.02 1 33 . 7 THR C C 175.65 0.1 1 34 . 7 THR CA C 64.86 0.4 1 35 . 7 THR CG2 C 21.89 0.4 1 36 . 7 THR N N 123.34 0.1 1 37 . 8 SER H H 8.77 0.02 1 38 . 8 SER HA H 4.09 0.02 1 39 . 8 SER HB2 H 3.87 0.02 1 40 . 8 SER HB3 H 3.87 0.02 1 41 . 8 SER C C 176.68 0.1 1 42 . 8 SER CA C 60.67 0.4 1 43 . 8 SER CB C 62.16 0.4 1 44 . 8 SER N N 117.07 0.1 1 45 . 9 ALA H H 7.53 0.02 1 46 . 9 ALA HA H 4.17 0.02 1 47 . 9 ALA HB H 1.50 0.02 1 48 . 9 ALA C C 179.94 0.1 1 49 . 9 ALA CA C 54.7 0.4 1 50 . 9 ALA CB C 17.91 0.4 1 51 . 9 ALA N N 125.93 0.1 1 52 . 10 LEU H H 7.95 0.02 1 53 . 10 LEU HA H 3.84 0.02 1 54 . 10 LEU HB2 H 1.92 0.02 1 55 . 10 LEU HB3 H 1.92 0.02 1 56 . 10 LEU HG H 1.72 0.02 1 57 . 10 LEU HD1 H 0.96 0.02 2 58 . 10 LEU HD2 H 0.88 0.02 2 59 . 10 LEU C C 181.06 0.1 1 60 . 10 LEU CA C 57.69 0.4 1 61 . 10 LEU CB C 42.27 0.4 1 62 . 10 LEU N N 122.47 0.1 1 63 . 11 VAL H H 8.56 0.02 1 64 . 11 VAL HA H 3.37 0.02 1 65 . 11 VAL HB H 2.17 0.02 1 66 . 11 VAL HG1 H 0.92 0.02 2 67 . 11 VAL HG2 H 0.85 0.02 2 68 . 11 VAL C C 177.24 0.1 1 69 . 11 VAL CA C 68.13 0.02 1 70 . 11 VAL CB C 31.33 0.4 1 71 . 11 VAL CG1 C 22.70 0.4 1 72 . 11 VAL CG2 C 23.50 0.4 1 73 . 11 VAL N N 124.85 0.1 1 74 . 12 LYS H H 8.02 0.02 1 75 . 12 LYS HA H 3.94 0.02 1 76 . 12 LYS HB2 H 1.93 0.02 1 77 . 12 LYS HB3 H 1.93 0.02 1 78 . 12 LYS HG2 H 1.61 0.02 2 79 . 12 LYS HG3 H 1.44 0.02 2 80 . 12 LYS HD2 H 1.70 0.02 1 81 . 12 LYS HD3 H 1.70 0.02 1 82 . 12 LYS HE2 H 2.99 0.02 1 83 . 12 LYS HE3 H 2.99 0.02 1 84 . 12 LYS C C 179.84 0.1 1 85 . 12 LYS CA C 60.67 0.4 1 86 . 12 LYS CB C 32.33 0.4 1 87 . 12 LYS CG C 26.01 0.4 1 88 . 12 LYS CD C 29.76 0.4 1 89 . 12 LYS CE C 41.29 0.4 1 90 . 12 LYS N N 121.28 0.1 1 91 . 13 GLU H H 8.45 0.02 1 92 . 13 GLU HA H 4.19 0.02 1 93 . 13 GLU HB2 H 2.12 0.02 2 94 . 13 GLU HB3 H 2.16 0.02 2 95 . 13 GLU HG2 H 2.38 0.02 1 96 . 13 GLU HG3 H 2.38 0.02 1 97 . 13 GLU C C 178.64 0.1 1 98 . 13 GLU CA C 59.18 0.4 1 99 . 13 GLU CB C 29.84 0.4 1 100 . 13 GLU CG C 36.38 0.4 1 101 . 13 GLU N N 120.96 0.1 1 102 . 14 THR H H 8.16 0.02 1 103 . 14 THR HA H 4.37 0.02 1 104 . 14 THR HG2 H 1.30 0.02 1 105 . 14 THR C C 175.65 0.1 1 106 . 14 THR CA C 68.63 0.4 1 107 . 14 THR CB C 67.63 0.4 1 108 . 14 THR CG2 C 22.72 0.4 1 109 . 14 THR N N 118.15 0.1 1 110 . 15 LEU H H 8.45 0.02 1 111 . 15 LEU HA H 3.94 0.02 1 112 . 15 LEU HB2 H 1.98 0.02 1 113 . 15 LEU HB3 H 1.98 0.02 1 114 . 15 LEU HG H 1.53 0.02 1 115 . 15 LEU HD1 H 0.97 0.02 2 116 . 15 LEU HD2 H 0.80 0.02 2 117 . 15 LEU C C 179.29 0.1 1 118 . 15 LEU CA C 58.68 0.4 1 119 . 15 LEU CB C 41.77 0.4 1 120 . 15 LEU CD1 C 25.62 0.4 1 121 . 15 LEU CD2 C 25.62 0.4 1 122 . 15 LEU N N 123.34 0.1 1 123 . 16 ALA H H 7.66 0.02 1 124 . 16 ALA HA H 4.28 0.02 1 125 . 16 ALA HB H 1.56 0.02 1 126 . 16 ALA C C 181.06 0.1 1 127 . 16 ALA CA C 55.20 0.4 1 128 . 16 ALA CB C 17.41 0.4 1 129 . 16 ALA N N 123.98 0.1 1 130 . 17 LEU H H 8.47 0.02 1 131 . 17 LEU HA H 4.16 0.02 1 132 . 17 LEU HB2 H 2.17 0.02 1 133 . 17 LEU HB3 H 2.17 0.02 1 134 . 17 LEU HG H 2.01 0.02 1 135 . 17 LEU HD1 H 1.01 0.02 2 136 . 17 LEU HD2 H 0.83 0.02 1 137 . 17 LEU C C 179.19 0.1 1 138 . 17 LEU CA C 57.69 0.4 1 139 . 17 LEU CB C 44.26 0.4 1 140 . 17 LEU CG C 25.67 0.4 1 141 . 17 LEU CD1 C 23.55 0.4 2 142 . 17 LEU CD2 C 24.01 0.4 2 143 . 17 LEU N N 121.39 0.1 1 144 . 18 LEU H H 8.58 0.02 1 145 . 18 LEU HA H 3.91 0.02 1 146 . 18 LEU HB2 H 1.74 0.02 1 147 . 18 LEU HB3 H 1.74 0.02 1 148 . 18 LEU HG H 1.66 0.02 1 149 . 18 LEU HD1 H 0.95 0.02 2 150 . 18 LEU HD2 H 0.82 0.02 2 151 . 18 LEU C C 178.07 0.1 1 152 . 18 LEU CA C 58.18 0.4 1 153 . 18 LEU CB C 41.77 0.4 1 154 . 18 LEU CG C 25.67 0.4 1 155 . 18 LEU CD1 C 24.8 0.4 1 156 . 18 LEU N N 122.47 0.1 1 157 . 19 SER H H 7.56 0.02 1 158 . 19 SER HA H 4.35 0.02 1 159 . 19 SER HB2 H 4.06 0.02 2 160 . 19 SER HB3 H 4.09 0.02 2 161 . 19 SER C C 177.79 0.1 1 162 . 19 SER CA C 61.66 0.4 1 163 . 19 SER CB C 62.66 0.4 1 164 . 19 SER N N 112.97 0.1 1 165 . 20 THR H H 8.30 0.02 1 166 . 20 THR HA H 4.00 0.02 1 167 . 20 THR HG2 H 0.82 0.02 1 168 . 20 THR C C 176.12 0.1 1 169 . 20 THR CA C 66.14 0.4 1 170 . 20 THR CB C 69.12 0.4 1 171 . 20 THR CG2 C 21.00 0.4 1 172 . 20 THR N N 118.15 0.1 1 173 . 21 HIS H H 7.97 0.02 1 174 . 21 HIS HA H 5.06 0.02 1 175 . 21 HIS HB2 H 3.42 0.02 2 176 . 21 HIS HB3 H 2.76 0.02 2 177 . 21 HIS HD2 H 7.09 0.02 1 178 . 21 HIS HE1 H 7.97 0.02 1 179 . 21 HIS C C 174.81 0.1 1 180 . 21 HIS CA C 56.69 0.4 1 181 . 21 HIS CB C 29.84 0.4 1 182 . 21 HIS N N 117.29 0.1 1 183 . 22 ARG H H 7.44 0.02 1 184 . 22 ARG HA H 3.81 0.02 1 185 . 22 ARG HB2 H 2.26 0.02 2 186 . 22 ARG HB3 H 1.97 0.02 2 187 . 22 ARG HG2 H 1.63 0.02 1 188 . 22 ARG HG3 H 1.63 0.02 1 189 . 22 ARG HD2 H 3.32 0.02 1 190 . 22 ARG HD3 H 3.32 0.02 1 191 . 22 ARG HH21 H 6.79 0.02 2 192 . 22 ARG HH22 H 7.19 0.02 2 193 . 22 ARG C C 177.14 0.1 1 194 . 22 ARG CA C 61.17 0.4 1 195 . 22 ARG CB C 29.84 0.4 1 196 . 22 ARG CG C 28.53 0.4 1 197 . 22 ARG CD C 43.02 0.4 1 198 . 22 ARG N N 123.77 0.1 1 199 . 23 THR H H 8.44 0.02 1 200 . 23 THR HA H 4.33 0.02 1 201 . 23 THR HB H 3.97 0.02 1 202 . 23 THR HG2 H 1.18 0.02 1 203 . 23 THR C C 176.58 0.1 1 204 . 23 THR CA C 66.14 0.4 1 205 . 23 THR CB C 68.13 0.4 1 206 . 23 THR CG2 C 22.72 0.4 1 207 . 23 THR N N 111.67 0.1 1 208 . 24 LEU H H 8.11 0.02 1 209 . 24 LEU HA H 4.26 0.02 1 210 . 24 LEU HB2 H 1.94 0.02 1 211 . 24 LEU HB3 H 1.94 0.02 1 212 . 24 LEU HG H 1.60 0.02 1 213 . 24 LEU HD1 H 1.01 0.02 2 214 . 24 LEU HD2 H 0.96 0.02 2 215 . 24 LEU C C 179.18 0.1 1 216 . 24 LEU CA C 58.18 0.4 1 217 . 24 LEU CB C 42.27 0.4 1 218 . 24 LEU CG C 28.50 0.4 1 219 . 24 LEU CD1 C 26.00 0.4 2 220 . 24 LEU CD2 C 23.55 0.4 2 221 . 24 LEU N N 123.55 0.1 1 222 . 25 LEU H H 7.98 0.02 1 223 . 25 LEU HA H 4.26 0.02 1 224 . 25 LEU HB2 H 2.06 0.02 1 225 . 25 LEU HB3 H 2.06 0.02 1 226 . 25 LEU HG H 1.50 0.02 1 227 . 25 LEU HD1 H 1.03 0.02 2 228 . 25 LEU HD2 H 0.97 0.02 2 229 . 25 LEU C C 178.45 0.1 1 230 . 25 LEU CA C 57.19 0.4 1 231 . 25 LEU CB C 42.77 0.4 1 232 . 25 LEU CG C 27.71 0.4 1 233 . 25 LEU CD1 C 26.45 0.4 2 234 . 25 LEU CD2 C 23.60 0.4 2 235 . 25 LEU N N 119.03 0.1 1 236 . 26 ILE H H 7.92 0.02 1 237 . 26 ILE HA H 4.28 0.02 1 238 . 26 ILE HB H 2.28 0.02 1 239 . 26 ILE HG12 H 1.54 0.02 1 240 . 26 ILE HG13 H 1.54 0.02 1 241 . 26 ILE HG2 H 1.11 0.02 1 242 . 26 ILE HD1 H 0.91 0.02 1 243 . 26 ILE C C 176.30 0.1 1 244 . 26 ILE CA C 62.16 0.4 1 245 . 26 ILE CB C 37.80 0.4 1 246 . 26 ILE CD1 C 18.1 0.4 1 247 . 26 ILE N N 111.24 0.1 1 248 . 27 ALA H H 7.30 0.02 1 249 . 27 ALA HA H 4.31 0.02 1 250 . 27 ALA HB H 1.63 0.02 1 251 . 27 ALA C C 177.79 0.1 1 252 . 27 ALA CA C 54.21 0.4 1 253 . 27 ALA CB C 18.40 0.4 1 254 . 27 ALA N N 125.06 0.1 1 255 . 28 ASN H H 7.75 0.02 1 256 . 28 ASN HA H 4.92 0.02 1 257 . 28 ASN HB2 H 3.13 0.02 2 258 . 28 ASN HB3 H 2.85 0.02 2 259 . 28 ASN HD21 H 6.82 0.02 2 260 . 28 ASN HD22 H 7.63 0.02 2 261 . 28 ASN C C 175.65 0.1 1 262 . 28 ASN CA C 52.21 0.4 1 263 . 28 ASN CB C 37.30 0.4 1 264 . 28 ASN N N 116.86 0.1 1 265 . 29 GLU H H 8.56 0.02 1 266 . 29 GLU HA H 4.40 0.02 1 267 . 29 GLU HB2 H 2.16 0.02 1 268 . 29 GLU HB3 H 2.16 0.02 1 269 . 29 GLU HG2 H 2.28 0.02 1 270 . 29 GLU HG3 H 2.28 0.02 1 271 . 29 GLU C C 177.33 0.1 1 272 . 29 GLU CA C 58.18 0.4 1 273 . 29 GLU CB C 31.33 0.4 1 274 . 29 GLU CG C 36.28 0.4 1 275 . 29 GLU N N 124.85 0.1 1 276 . 30 THR H H 8.19 0.02 1 277 . 30 THR HA H 4.31 0.02 1 278 . 30 THR HB H 3.91 0.02 1 279 . 30 THR HG2 H 1.31 0.02 1 280 . 30 THR C C 175.09 0.1 1 281 . 30 THR CA C 62.66 0.4 1 282 . 30 THR CB C 69.62 0.4 1 283 . 30 THR CG2 C 22.72 0.4 1 284 . 30 THR N N 110.81 0.1 1 285 . 31 LEU H H 7.17 0.02 1 286 . 31 LEU HA H 4.26 0.02 1 287 . 31 LEU HB2 H 1.50 0.02 1 288 . 31 LEU HB3 H 1.50 0.02 1 289 . 31 LEU HG H 1.39 0.02 1 290 . 31 LEU HD1 H 0.86 0.02 2 291 . 31 LEU HD2 H 0.78 0.02 2 292 . 31 LEU C C 176.68 0.1 1 293 . 31 LEU CA C 55.70 0.4 1 294 . 31 LEU CB C 42.77 0.4 1 295 . 31 LEU CG C 27.28 0.4 1 296 . 31 LEU CD1 C 24.38 0.4 2 297 . 31 LEU CD2 C 25.62 0.4 2 298 . 31 LEU N N 124.85 0.1 1 299 . 32 ARG H H 8.30 0.02 1 300 . 32 ARG HA H 4.93 0.02 1 301 . 32 ARG HB2 H 1.73 0.02 1 302 . 32 ARG HB3 H 1.73 0.02 1 303 . 32 ARG HG2 H 1.60 0.02 1 304 . 32 ARG HG3 H 1.60 0.02 1 305 . 32 ARG HD2 H 3.27 0.02 2 306 . 32 ARG HD3 H 3.07 0.02 2 307 . 32 ARG HH21 H 6.71 0.02 1 308 . 32 ARG HH22 H 7.03 0.02 1 309 . 32 ARG C C 174.91 0.1 1 310 . 32 ARG CA C 53.21 0.4 1 311 . 32 ARG CB C 32.82 0.4 1 312 . 32 ARG CG C 28.11 0.4 1 313 . 32 ARG CD C 43.02 0.4 1 314 . 32 ARG N N 125.71 0.1 1 315 . 33 ILE H H 9.03 0.02 1 316 . 33 ILE HA H 4.58 0.02 1 317 . 33 ILE HB H 1.29 0.02 1 318 . 33 ILE HG12 H 1.19 0.02 1 319 . 33 ILE HG13 H 1.19 0.02 1 320 . 33 ILE HG2 H 0.84 0.02 1 321 . 33 ILE HD1 H 0.42 0.02 1 322 . 33 ILE CA C 57.69 0.4 1 323 . 33 ILE CB C 42.77 0.4 1 324 . 33 ILE CG1 C 27.69 0.4 1 325 . 33 ILE CG2 C 14.19 0.4 1 326 . 33 ILE CD1 C 13.79 0.4 1 327 . 33 ILE N N 123.55 0.1 1 328 . 34 PRO HA H 4.83 0.02 1 329 . 34 PRO HB2 H 2.03 0.02 2 330 . 34 PRO HB3 H 2.18 0.02 2 331 . 34 PRO HG2 H 1.72 0.02 2 332 . 34 PRO HG3 H 1.90 0.02 2 333 . 34 PRO HD2 H 3.69 0.02 2 334 . 34 PRO HD3 H 3.63 0.02 2 335 . 34 PRO C C 175.56 0.1 1 336 . 34 PRO CA C 63.4 0.4 1 337 . 34 PRO CB C 31.50 0.4 1 338 . 34 PRO CG C 31.8 0.4 1 339 . 34 PRO CD C 51.72 0.4 1 340 . 35 VAL H H 8.19 0.02 1 341 . 35 VAL HA H 4.50 0.02 1 342 . 35 VAL HB H 1.78 0.02 1 343 . 35 VAL HG1 H 1.05 0.02 2 344 . 35 VAL HG2 H 0.77 0.02 2 345 . 35 VAL CA C 58.18 0.4 1 346 . 35 VAL CB C 35.81 0.4 1 347 . 35 VAL CG1 C 23.96 0.4 2 348 . 35 VAL CG2 C 21.89 0.4 2 349 . 35 VAL N N 123.12 0.1 1 350 . 36 PRO HA H 4.50 0.02 1 351 . 36 PRO HB2 H 2.28 0.02 1 352 . 36 PRO HB3 H 2.28 0.02 1 353 . 36 PRO HG2 H 2.00 0.02 1 354 . 36 PRO HG3 H 2.00 0.02 1 355 . 36 PRO HD2 H 3.51 0.02 1 356 . 36 PRO HD3 H 3.51 0.02 1 357 . 36 PRO C C 176.49 0.1 1 358 . 36 PRO CA C 62.16 0.4 1 359 . 36 PRO CB C 33.33 0.4 1 360 . 36 PRO CG C 32.25 0.4 1 361 . 36 PRO CD C 50.89 0.4 1 362 . 37 VAL H H 6.91 0.02 1 363 . 37 VAL HA H 4.31 0.02 1 364 . 37 VAL HB H 2.44 0.02 1 365 . 37 VAL HG1 H 1.10 0.02 2 366 . 37 VAL HG2 H 1.00 0.02 2 367 . 37 VAL C C 174.72 0.1 1 368 . 37 VAL CA C 61.17 0.4 1 369 . 37 VAL CB C 31.33 0.4 1 370 . 37 VAL CG1 C 26.89 0.4 2 371 . 37 VAL N N 113.44 0.1 1 372 . 38 HIS H H 6.58 0.02 1 373 . 38 HIS HA H 5.03 0.02 1 374 . 38 HIS HB2 H 3.34 0.02 2 375 . 38 HIS HB3 H 2.90 0.02 2 376 . 38 HIS HD2 H 7.03 0.02 1 377 . 38 HIS HE1 H 7.80 0.02 1 378 . 38 HIS C C 174.81 0.1 1 379 . 38 HIS CA C 53.21 0.4 1 380 . 38 HIS CB C 33.82 0.4 1 381 . 38 HIS N N 116.43 0.1 1 382 . 39 LYS H H 8.80 0.02 1 383 . 39 LYS HA H 4.06 0.02 1 384 . 39 LYS HB2 H 2.16 0.02 1 385 . 39 LYS HB3 H 2.16 0.02 1 386 . 39 LYS HG2 H 1.54 0.02 1 387 . 39 LYS HG3 H 1.54 0.02 1 388 . 39 LYS HD2 H 1.72 0.02 1 389 . 39 LYS HD3 H 1.72 0.02 1 390 . 39 LYS HE2 H 3.04 0.02 1 391 . 39 LYS C C 175.65 0.1 1 392 . 39 LYS CA C 54.7 0.4 1 393 . 39 LYS CB C 31.32 0.4 1 394 . 39 LYS CG C 25.21 0.4 1 395 . 39 LYS CD C 29.35 0.4 1 396 . 39 LYS CE C 42.62 0.4 1 397 . 39 LYS N N 119.02 0.1 1 398 . 40 ASN H H 10.19 0.02 1 399 . 40 ASN HA H 5.19 0.02 1 400 . 40 ASN HB2 H 2.72 0.02 2 401 . 40 ASN HB3 H 2.53 0.02 2 402 . 40 ASN HD21 H 7.19 0.02 1 403 . 40 ASN HD22 H 7.89 0.02 1 404 . 40 ASN C C 174.60 0.1 1 405 . 40 ASN CA C 51.72 0.4 1 406 . 40 ASN CB C 36.60 0.4 1 407 . 40 ASN N N 125.5 0.1 1 408 . 41 HIS H H 7.67 0.02 1 409 . 41 HIS HA H 4.31 0.02 1 410 . 41 HIS HB2 H 3.00 0.02 1 411 . 41 HIS HB3 H 3.00 0.02 1 412 . 41 HIS HD2 H 6.98 0.02 1 413 . 41 HIS HE1 H 7.77 0.02 1 414 . 41 HIS C C 178.82 0.1 1 415 . 41 HIS CA C 60.67 0.4 1 416 . 41 HIS CB C 32.32 0.4 1 417 . 41 HIS N N 118.59 0.1 1 418 . 42 GLN H H 8.98 0.02 1 419 . 42 GLN HA H 4.09 0.02 1 420 . 42 GLN HB2 H 2.08 0.02 1 421 . 42 GLN HB3 H 2.08 0.02 1 422 . 42 GLN HG2 H 2.55 0.02 1 423 . 42 GLN HG3 H 2.55 0.02 1 424 . 42 GLN HE21 H 7.14 0.02 1 425 . 42 GLN HE22 H 7.78 0.02 1 426 . 42 GLN C C 177.42 0.1 1 427 . 42 GLN CA C 58.68 0.4 1 428 . 42 GLN CB C 28.85 0.4 1 429 . 42 GLN CG C 32.00 0.4 1 430 . 42 GLN N N 113.19 0.1 1 431 . 42 GLN NE2 N 113.81 0.1 1 432 . 43 LEU H H 7.83 0.02 1 433 . 43 LEU HA H 4.50 0.02 1 434 . 43 LEU HB2 H 1.87 0.02 2 435 . 43 LEU HB3 H 1.82 0.02 2 436 . 43 LEU HD1 H 1.08 0.02 2 437 . 43 LEU HD2 H 1.00 0.02 2 438 . 43 LEU C C 177.98 0.1 1 439 . 43 LEU CA C 56.19 0.4 1 440 . 43 LEU CB C 43.76 0.4 1 441 . 43 LEU CD1 C 24.19 0.4 2 442 . 43 LEU CD2 C 26.45 0.4 2 443 . 43 LEU N N 118.59 0.1 1 444 . 44 CYS H H 7.78 0.02 1 445 . 44 CYS HA H 5.72 0.02 1 446 . 44 CYS HB2 H 3.87 0.02 2 447 . 44 CYS HB3 H 2.78 0.02 2 448 . 44 CYS C C 175.93 0.1 1 449 . 44 CYS CA C 50.73 0.4 1 450 . 44 CYS CB C 36.30 0.4 1 451 . 44 CYS N N 114.05 0.1 1 452 . 45 THR H H 7.69 0.02 1 453 . 45 THR HA H 4.44 0.02 1 454 . 45 THR HB H 3.82 0.02 1 455 . 45 THR HG2 H 1.63 0.02 1 456 . 45 THR C C 176.02 0.1 1 457 . 45 THR CA C 68.13 0.4 1 458 . 45 THR CB C 68.13 0.4 1 459 . 45 THR CG2 C 23.13 0.4 1 460 . 45 THR N N 114.05 0.1 1 461 . 46 GLU H H 9.06 0.02 1 462 . 46 GLU HA H 4.22 0.02 1 463 . 46 GLU HB2 H 2.10 0.02 1 464 . 46 GLU HB3 H 2.10 0.02 1 465 . 46 GLU HG2 H 2.41 0.02 1 466 . 46 GLU HG3 H 2.41 0.02 1 467 . 46 GLU C C 179.29 0.1 1 468 . 46 GLU CA C 60.17 0.4 1 469 . 46 GLU CB C 28.85 0.4 1 470 . 46 GLU CG C 35.90 0.4 1 471 . 46 GLU N N 122.47 0.1 1 472 . 47 GLU H H 9.19 0.02 1 473 . 47 GLU HA H 4.00 0.02 1 474 . 47 GLU HB2 H 2.16 0.02 1 475 . 47 GLU HB3 H 2.16 0.02 1 476 . 47 GLU HG2 H 2.27 0.02 1 477 . 47 GLU HG3 H 2.27 0.02 1 478 . 47 GLU C C 180.50 0.1 1 479 . 47 GLU CA C 61.66 0.4 1 480 . 47 GLU CB C 28.35 0.4 1 481 . 47 GLU CG C 38.04 0.4 1 482 . 47 GLU N N 122.69 0.1 1 483 . 48 ILE H H 8.55 0.02 1 484 . 48 ILE HA H 3.91 0.02 1 485 . 48 ILE HB H 1.64 0.02 1 486 . 48 ILE HG12 H 0.96 0.02 1 487 . 48 ILE HG13 H 0.96 0.02 1 488 . 48 ILE HG2 H 0.45 0.02 1 489 . 48 ILE HD1 H 0.21 0.02 1 490 . 48 ILE C C 178.17 0.1 1 491 . 48 ILE CA C 65.64 0.4 1 492 . 48 ILE CB C 37.80 0.4 1 493 . 48 ILE CG1 C 29.36 0.4 1 494 . 48 ILE CG2 C 13.69 0.4 1 495 . 48 ILE CD1 C 17.33 0.4 1 496 . 48 ILE N N 123.12 0.1 1 497 . 49 PHE H H 8.30 0.02 1 498 . 49 PHE HA H 4.45 0.02 1 499 . 49 PHE HB2 H 3.33 0.02 2 500 . 49 PHE HB3 H 3.19 0.02 2 501 . 49 PHE HD1 H 7.14 0.02 1 502 . 49 PHE HD2 H 7.14 0.02 1 503 . 49 PHE HE1 H 7.16 0.02 1 504 . 49 PHE HE2 H 7.16 0.02 1 505 . 49 PHE HZ H 7.41 0.02 1 506 . 49 PHE C C 179.66 0.1 1 507 . 49 PHE CA C 63.16 0.4 1 508 . 49 PHE CB C 37.3 0.4 1 509 . 49 PHE N N 117.72 0.1 1 510 . 50 GLN H H 8.66 0.02 1 511 . 50 GLN HA H 4.31 0.02 1 512 . 50 GLN HB2 H 2.21 0.02 2 513 . 50 GLN HB3 H 2.34 0.02 2 514 . 50 GLN HG2 H 2.52 0.02 2 515 . 50 GLN HG3 H 2.63 0.02 2 516 . 50 GLN HE21 H 6.84 0.02 1 517 . 50 GLN HE22 H 7.52 0.02 1 518 . 50 GLN C C 179.38 0.1 1 519 . 50 GLN CA C 59.18 0.4 1 520 . 50 GLN CB C 27.85 0.4 1 521 . 50 GLN CG C 34.31 0.4 1 522 . 50 GLN N N 125.71 0.1 1 523 . 50 GLN NE2 N 112.52 0.1 1 524 . 51 GLY H H 8.14 0.02 1 525 . 51 GLY HA2 H 3.64 0.02 2 526 . 51 GLY HA3 H 3.51 0.02 2 527 . 51 GLY C C 175.74 0.1 1 528 . 51 GLY CA C 47.74 0.4 1 529 . 51 GLY N N 111.24 0.1 1 530 . 52 ILE H H 8.22 0.02 1 531 . 52 ILE HA H 3.72 0.02 1 532 . 52 ILE HB H 2.17 0.02 1 533 . 52 ILE HG12 H 1.31 0.02 1 534 . 52 ILE HG13 H 1.31 0.02 1 535 . 52 ILE HG2 H 1.09 0.02 1 536 . 52 ILE HD1 H 0.71 0.02 1 537 . 52 ILE C C 177.33 0.1 1 538 . 52 ILE CA C 66.14 0.4 1 539 . 52 ILE CB C 38.29 0.4 1 540 . 52 ILE CG1 C 29.3 0.4 1 541 . 52 ILE CD1 C 15.67 0.4 1 542 . 52 ILE N N 122.69 0.1 1 543 . 53 GLY H H 8.14 0.02 1 544 . 53 GLY HA2 H 4.05 0.02 1 545 . 53 GLY HA3 H 4.05 0.02 1 546 . 53 GLY C C 177.24 0.1 1 547 . 53 GLY CA C 46.74 0.4 1 548 . 53 GLY N N 108.65 0.1 1 549 . 54 THR H H 8.22 0.02 1 550 . 54 THR HA H 4.31 0.02 1 551 . 54 THR HB H 3.87 0.02 1 552 . 54 THR HG2 H 1.36 0.02 1 553 . 54 THR C C 175.93 0.1 1 554 . 54 THR CA C 66.14 0.4 1 555 . 54 THR CB C 68.13 0.4 1 556 . 54 THR CG2 C 21.89 0.4 1 557 . 54 THR N N 122.47 0.1 1 558 . 55 LEU H H 7.53 0.02 1 559 . 55 LEU HA H 3.94 0.02 1 560 . 55 LEU HB2 H 1.97 0.02 1 561 . 55 LEU HB3 H 1.97 0.02 1 562 . 55 LEU HG H 1.83 0.02 1 563 . 55 LEU HD1 H 1.04 0.02 2 564 . 55 LEU HD2 H 0.96 0.02 2 565 . 55 LEU C C 179.1 0.1 1 566 . 55 LEU CA C 57.69 0.4 1 567 . 55 LEU CB C 42.27 0.4 1 568 . 55 LEU CG C 27.2 0.02 1 569 . 55 LEU CD1 C 25.2 0.02 2 570 . 55 LEU N N 122.90 0.1 1 571 . 56 GLU H H 9.11 0.02 1 572 . 56 GLU HA H 2.64 0.02 1 573 . 56 GLU HB2 H 1.31 0.02 1 574 . 56 GLU HB3 H 1.31 0.02 1 575 . 56 GLU HG2 H 1.69 0.02 2 576 . 56 GLU HG3 H 1.87 0.02 2 577 . 56 GLU C C 178.45 0.1 1 578 . 56 GLU CA C 59.68 0.4 1 579 . 56 GLU CB C 29.24 0.4 1 580 . 56 GLU CG C 35.16 0.4 1 581 . 56 GLU N N 123.77 0.1 1 582 . 57 SER H H 7.67 0.02 1 583 . 57 SER HA H 4.25 0.02 1 584 . 57 SER HB2 H 4.06 0.02 1 585 . 57 SER HB3 H 4.06 0.02 1 586 . 57 SER C C 175.18 0.1 1 587 . 57 SER CA C 60.17 0.4 1 588 . 57 SER CB C 63.65 0.4 1 589 . 57 SER N N 112.54 0.1 1 590 . 58 GLN H H 7.37 0.02 1 591 . 58 GLN HA H 4.53 0.02 1 592 . 58 GLN HB2 H 1.84 0.02 1 593 . 58 GLN HB3 H 1.84 0.02 1 594 . 58 GLN HG2 H 2.47 0.02 1 595 . 58 GLN HG3 H 2.47 0.02 1 596 . 58 GLN HE21 H 6.81 0.02 1 597 . 58 GLN HE22 H 7.39 0.02 1 598 . 58 GLN C C 175.28 0.1 1 599 . 58 GLN CA C 55.2 0.4 1 600 . 58 GLN CB C 29.34 0.4 1 601 . 58 GLN CG C 30.18 0.4 1 602 . 58 GLN N N 118.59 0.1 1 603 . 58 GLN NE2 N 112.95 0.1 1 604 . 59 THR H H 7.41 0.02 1 605 . 59 THR HA H 4.55 0.02 1 606 . 59 THR HB H 3.97 0.02 1 607 . 59 THR HG2 H 1.31 0.02 1 608 . 59 THR C C 173.88 0.1 1 609 . 59 THR CA C 62.16 0.4 1 610 . 59 THR CB C 70.19 0.4 1 611 . 59 THR CG2 C 21.89 0.4 1 612 . 59 THR N N 117.94 0.1 1 613 . 60 VAL H H 8.44 0.02 1 614 . 60 VAL HA H 4.01 0.02 1 615 . 60 VAL HB H 2.14 0.02 1 616 . 60 VAL HG1 H 1.08 0.02 2 617 . 60 VAL HG2 H 1.04 0.02 2 618 . 60 VAL C C 176.12 0.1 1 619 . 60 VAL CA C 63.15 0.4 1 620 . 60 VAL CB C 31.33 0.4 1 621 . 60 VAL CG1 C 21.48 0.4 1 622 . 60 VAL CG2 C 21.06 0.4 1 623 . 60 VAL N N 127.44 0.1 1 624 . 61 GLN H H 8.47 0.02 1 625 . 61 GLN HA H 4.32 0.02 1 626 . 61 GLN HB2 H 2.00 0.02 2 627 . 61 GLN HB3 H 2.15 0.02 2 628 . 61 GLN HG2 H 2.40 0.02 1 629 . 61 GLN HG3 H 2.40 0.02 1 630 . 61 GLN HE21 H 6.31 0.02 1 631 . 61 GLN HE22 H 7.39 0.02 1 632 . 61 GLN C C 176.02 0.1 1 633 . 61 GLN CA C 55.70 0.4 1 634 . 61 GLN CB C 28.85 0.4 1 635 . 61 GLN CG C 33.9 0.4 1 636 . 61 GLN N N 126.14 0.1 1 637 . 61 GLN NE2 N 112.95 0.1 1 638 . 62 GLY H H 7.92 0.02 1 639 . 62 GLY HA2 H 4.12 0.02 1 640 . 62 GLY HA3 H 4.12 0.02 1 641 . 62 GLY C C 174.44 0.1 1 642 . 62 GLY CA C 44.76 0.4 1 643 . 62 GLY N N 110.38 0.1 1 644 . 63 GLY H H 8.72 0.02 1 645 . 63 GLY HA2 H 4.40 0.02 1 646 . 63 GLY HA3 H 3.65 0.02 1 647 . 63 GLY C C 175.46 0.1 1 648 . 63 GLY CA C 45.75 0.4 1 649 . 63 GLY N N 110.60 0.1 1 650 . 64 THR H H 8.02 0.02 1 651 . 64 THR HA H 4.59 0.02 1 652 . 64 THR HB H 4.32 0.02 1 653 . 64 THR HG2 H 1.32 0.02 1 654 . 64 THR C C 176.4 0.1 1 655 . 64 THR CA C 64.15 0.4 1 656 . 64 THR CB C 68.62 0.4 1 657 . 64 THR CG2 C 22.3 0.4 1 658 . 64 THR N N 123.53 0.1 1 659 . 65 VAL H H 8.02 0.02 1 660 . 65 VAL HA H 3.34 0.02 1 661 . 65 VAL HB H 2.12 0.02 1 662 . 65 VAL HG1 H 1.02 0.02 2 663 . 65 VAL HG2 H 0.76 0.02 2 664 . 65 VAL C C 176.68 0.1 1 665 . 65 VAL CA C 65.15 0.4 1 666 . 65 VAL CB C 31.33 0.4 1 667 . 65 VAL CG1 C 21.89 0.4 2 668 . 65 VAL CG2 C 22.72 0.4 2 669 . 65 VAL N N 123.12 0.1 1 670 . 66 GLU H H 7.66 0.02 1 671 . 66 GLU HA H 4.40 0.02 1 672 . 66 GLU HB2 H 2.16 0.02 1 673 . 66 GLU HB3 H 2.16 0.02 1 674 . 66 GLU HG2 H 2.28 0.02 1 675 . 66 GLU HG3 H 2.28 0.02 1 676 . 66 GLU C C 178.73 0.1 1 677 . 66 GLU CA C 59.18 0.4 1 678 . 66 GLU CB C 29.34 0.4 1 679 . 66 GLU CG C 32.25 0.4 1 680 . 66 GLU N N 121.82 0.1 1 681 . 67 ARG H H 7.56 0.02 1 682 . 67 ARG HA H 4.03 0.02 1 683 . 67 ARG HB2 H 1.97 0.02 1 684 . 67 ARG HB3 H 1.97 0.02 1 685 . 67 ARG HG2 H 1.69 0.02 2 686 . 67 ARG HD3 H 3.27 0.02 2 687 . 67 ARG HH21 H 6.77 0.02 1 688 . 67 ARG HH22 H 7.04 0.02 1 689 . 67 ARG C C 177.79 0.1 1 690 . 67 ARG CA C 58.68 0.4 1 691 . 67 ARG CB C 29.80 0.4 1 692 . 67 ARG CG C 26.67 0.4 1 693 . 67 ARG CD C 43.02 0.4 1 694 . 67 ARG N N 119.88 0.1 1 695 . 68 LEU H H 7.45 0.02 1 696 . 68 LEU HA H 3.94 0.02 1 697 . 68 LEU HB2 H 2.14 0.02 1 698 . 68 LEU HB3 H 2.14 0.02 1 699 . 68 LEU HG H 1.24 0.02 1 700 . 68 LEU HD1 H 0.84 0.02 2 701 . 68 LEU HD2 H 0.50 0.02 2 702 . 68 LEU C C 178.73 0.1 1 703 . 68 LEU CA C 58.68 0.4 1 704 . 68 LEU CB C 40.28 0.4 1 705 . 68 LEU CD1 C 24.38 0.4 2 706 . 68 LEU CD2 C 26.45 0.4 2 707 . 68 LEU N N 120.1 0.1 1 708 . 69 PHE H H 7.41 0.02 1 709 . 69 PHE HA H 4.38 0.02 1 710 . 69 PHE HB2 H 3.41 0.02 2 711 . 69 PHE HB3 H 3.03 0.02 2 712 . 69 PHE HD1 H 6.97 0.02 2 713 . 69 PHE HE1 H 7.09 0.02 2 714 . 69 PHE HZ H 7.12 0.02 2 715 . 69 PHE C C 179.19 0.1 1 716 . 69 PHE CA C 63.16 0.4 1 717 . 69 PHE CB C 37.8 0.4 1 718 . 69 PHE N N 117.07 0.1 1 719 . 70 LYS H H 8.84 0.02 1 720 . 70 LYS HA H 4.31 0.02 1 721 . 70 LYS HB2 H 2.03 0.02 2 722 . 70 LYS HG2 H 1.57 0.02 2 723 . 70 LYS HG3 H 1.66 0.02 2 724 . 70 LYS HD3 H 1.76 0.02 2 725 . 70 LYS HE3 H 3.03 0.02 2 726 . 70 LYS C C 180.03 0.1 1 727 . 70 LYS CA C 59.68 0.4 1 728 . 70 LYS CB C 31.83 0.4 1 729 . 70 LYS CG C 25.63 0.4 1 730 . 70 LYS CD C 29.76 0.4 1 731 . 70 LYS CE C 42.60 0.4 1 732 . 70 LYS N N 125.06 0.1 1 733 . 71 ASN H H 8.72 0.02 1 734 . 71 ASN HA H 4.41 0.02 1 735 . 71 ASN HB2 H 3.10 0.02 2 736 . 71 ASN HD21 H 7.38 0.02 1 737 . 71 ASN HD22 H 7.75 0.02 1 738 . 71 ASN C C 178.91 0.1 1 739 . 71 ASN CA C 55.7 0.4 1 740 . 71 ASN CB C 37.3 0.4 1 741 . 71 ASN N N 123.34 0.1 1 742 . 72 LEU H H 8.37 0.02 1 743 . 72 LEU HA H 4.31 0.02 1 744 . 72 LEU HB2 H 1.95 0.02 2 745 . 72 LEU HG H 1.78 0.02 1 746 . 72 LEU HD1 H 1.08 0.02 2 747 . 72 LEU HD2 H 1.02 0.02 2 748 . 72 LEU C C 178.73 0.1 1 749 . 72 LEU CA C 58.68 0.4 1 750 . 72 LEU CB C 41.28 0.4 1 751 . 72 LEU CG C 27.69 0.4 1 752 . 72 LEU CD1 C 24.19 0.4 1 753 . 72 LEU CD2 C 25.62 0.4 1 754 . 72 LEU N N 120.31 0.1 1 755 . 73 SER H H 8.28 0.02 1 756 . 73 SER HA H 4.50 0.02 1 757 . 73 SER HB2 H 4.25 0.02 2 758 . 73 SER C C 177.24 0.1 1 759 . 73 SER CA C 61.17 0.4 1 760 . 73 SER CB C 62.66 0.4 1 761 . 73 SER N N 118.15 0.1 1 762 . 74 LEU H H 7.95 0.02 1 763 . 74 LEU HA H 4.26 0.02 1 764 . 74 LEU HB2 H 2.24 0.02 2 765 . 74 LEU HG H 1.60 0.02 1 766 . 74 LEU HD1 H 1.02 0.02 2 767 . 74 LEU HD2 H 0.95 0.02 2 768 . 74 LEU C C 180.31 0.1 1 769 . 74 LEU CA C 58.18 0.4 1 770 . 74 LEU CB C 41.77 0.4 1 771 . 74 LEU CD1 C 25.7 0.4 2 772 . 74 LEU CD2 C 23.13 0.4 2 773 . 74 LEU N N 126.14 0.1 1 774 . 75 ILE H H 8.39 0.02 1 775 . 75 ILE HA H 3.70 0.02 1 776 . 75 ILE HB H 2.32 0.02 1 777 . 75 ILE HG12 H 1.13 0.02 2 778 . 75 ILE HG2 H 0.91 0.02 1 779 . 75 ILE HD1 H 0.71 0.02 1 780 . 75 ILE C C 177.42 0.1 1 781 . 75 ILE CA C 66.14 0.4 1 782 . 75 ILE CB C 37.8 0.4 1 783 . 75 ILE CG1 C 18.15 0.4 1 784 . 75 ILE CG2 C 14.85 0.4 1 785 . 75 ILE N N 123.98 0.1 1 786 . 76 LYS H H 8.39 0.02 1 787 . 76 LYS HA H 3.25 0.02 1 788 . 76 LYS HB2 H 1.95 0.02 2 789 . 76 LYS HG2 H 1.39 0.02 2 790 . 76 LYS HD3 H 1.54 0.02 2 791 . 76 LYS HE2 H 2.87 0.02 2 792 . 76 LYS C C 177.61 0.1 1 793 . 76 LYS CA C 59.18 0.4 1 794 . 76 LYS CB C 31.33 0.4 1 795 . 76 LYS N N 123.12 0.1 1 796 . 77 LYS H H 7.78 0.02 1 797 . 77 LYS HA H 4.12 0.02 1 798 . 77 LYS HB2 H 2.04 0.02 2 799 . 77 LYS HG2 H 1.58 0.02 2 800 . 77 LYS HG3 H 1.64 0.02 2 801 . 77 LYS HD3 H 1.78 0.02 2 802 . 77 LYS HE2 H 3.05 0.02 2 803 . 77 LYS C C 179.94 0.1 1 804 . 77 LYS CA C 59.68 0.4 1 805 . 77 LYS CB C 31.83 0.4 1 806 . 77 LYS CG C 25.2 0.4 1 807 . 77 LYS CD C 26.03 0.4 1 808 . 77 LYS CE C 42.60 0.4 1 809 . 77 LYS N N 119.45 0.1 1 810 . 78 TYR H H 7.94 0.02 1 811 . 78 TYR HA H 4.40 0.02 1 812 . 78 TYR HB2 H 3.21 0.02 2 813 . 78 TYR HB3 H 3.31 0.02 2 814 . 78 TYR HD1 H 7.04 0.02 2 815 . 78 TYR HE2 H 6.76 0.02 2 816 . 78 TYR C C 178.45 0.1 1 817 . 78 TYR CA C 61.17 0.4 1 818 . 78 TYR CB C 37.3 0.4 1 819 . 78 TYR N N 122.9 0.1 1 820 . 79 ILE H H 8.55 0.02 1 821 . 79 ILE HA H 3.44 0.02 1 822 . 79 ILE HB H 2.14 0.02 1 823 . 79 ILE HG12 H 1.53 0.02 2 824 . 79 ILE HG2 H 1.20 0.02 1 825 . 79 ILE HD1 H 0.95 0.02 1 826 . 79 ILE C C 177.79 0.1 1 827 . 79 ILE CA C 65.64 0.4 1 828 . 79 ILE CB C 37.3 0.4 1 829 . 79 ILE CG1 C 18.16 0.4 1 830 . 79 ILE N N 123.98 0.1 1 831 . 80 ASP H H 9.28 0.02 1 832 . 80 ASP HA H 4.45 0.02 1 833 . 80 ASP HB2 H 2.62 0.02 2 834 . 80 ASP HB3 H 2.84 0.02 2 835 . 80 ASP C C 180.12 0.1 1 836 . 80 ASP CA C 57.19 0.4 1 837 . 80 ASP CB C 39.29 0.4 1 838 . 80 ASP N N 122.9 0.1 1 839 . 81 GLY H H 8.11 0.02 1 840 . 81 GLY HA2 H 4.26 0.02 1 841 . 81 GLY HA3 H 4.08 0.02 1 842 . 81 GLY C C 176.77 0.1 1 843 . 81 GLY CA C 46.75 0.4 1 844 . 81 GLY N N 109.95 0.1 1 845 . 82 GLN H H 7.91 0.02 1 846 . 82 GLN HA H 3.91 0.02 1 847 . 82 GLN HB2 H 2.02 0.02 2 848 . 82 GLN HB3 H 2.12 0.02 2 849 . 82 GLN HG2 H 2.42 0.02 2 850 . 82 GLN HE21 H 6.77 0.02 1 851 . 82 GLN HE22 H 7.59 0.02 1 852 . 82 GLN C C 179.66 0.1 1 853 . 82 GLN CA C 58.68 0.4 1 854 . 82 GLN CB C 28.35 0.4 1 855 . 82 GLN CG C 36.39 0.4 1 856 . 82 GLN N N 123.12 0.1 1 857 . 83 LYS H H 8.89 0.02 1 858 . 83 LYS HA H 4.44 0.02 1 859 . 83 LYS HB2 H 2.05 0.02 2 860 . 83 LYS HB3 H 2.22 0.02 2 861 . 83 LYS HG2 H 1.72 0.02 2 862 . 83 LYS HD3 H 1.83 0.02 2 863 . 83 LYS HE2 H 3.20 0.02 2 864 . 83 LYS C C 180.87 0.1 1 865 . 83 LYS CA C 59.18 0.4 1 866 . 83 LYS CB C 31.83 0.4 1 867 . 83 LYS CG C 26.45 0.4 1 868 . 83 LYS CD C 29.76 0.4 1 869 . 83 LYS CE C 43.43 0.4 1 870 . 83 LYS N N 123.98 0.1 1 871 . 84 LYS H H 8.06 0.02 1 872 . 84 LYS HA H 4.15 0.02 1 873 . 84 LYS HB2 H 2.06 0.02 2 874 . 84 LYS HG2 H 1.54 0.02 2 875 . 84 LYS HG3 H 1.66 0.02 2 876 . 84 LYS HD3 H 1.77 0.02 2 877 . 84 LYS HE2 H 3.05 0.02 2 878 . 84 LYS C C 177.61 0.1 1 879 . 84 LYS CA C 59.18 0.4 1 880 . 84 LYS CB C 31.83 0.4 1 881 . 84 LYS CG C 25.62 0.4 1 882 . 84 LYS CD C 29.6 0.4 1 883 . 84 LYS CE C 42.60 0.4 1 884 . 84 LYS N N 123.12 0.1 1 885 . 85 LYS H H 7.41 0.02 1 886 . 85 LYS HA H 4.31 0.02 1 887 . 85 LYS HB2 H 2.12 0.02 2 888 . 85 LYS HG2 H 1.64 0.02 2 889 . 85 LYS HG3 H 1.74 0.02 2 890 . 85 LYS HD2 H 1.93 0.02 2 891 . 85 LYS HE3 H 3.08 0.02 2 892 . 85 LYS C C 177.89 0.1 1 893 . 85 LYS CA C 57.19 0.4 1 894 . 85 LYS CB C 32.82 0.4 1 895 . 85 LYS CG C 26.57 0.4 1 896 . 85 LYS CD C 26.97 0.4 1 897 . 85 LYS CE C 42.19 0.4 1 898 . 85 LYS N N 117.07 0.1 1 899 . 86 CYS H H 8.06 0.02 1 900 . 86 CYS HA H 4.18 0.02 1 901 . 86 CYS HB2 H 2.79 0.02 2 902 . 86 CYS HB3 H 2.88 0.02 2 903 . 86 CYS C C 173.97 0.1 1 904 . 86 CYS CA C 57.69 0.4 1 905 . 86 CYS CB C 37.3 0.4 1 906 . 86 CYS N N 120.1 0.1 1 907 . 87 GLY H H 7.44 0.02 1 908 . 87 GLY HA2 H 4.40 0.02 2 909 . 87 GLY HA3 H 3.56 0.02 2 910 . 87 GLY C C 173.88 0.1 1 911 . 87 GLY CA C 45.26 0.4 1 912 . 87 GLY N N 103.04 0.1 1 913 . 88 GLU H H 7.06 0.02 1 914 . 88 GLU HA H 4.22 0.02 1 915 . 88 GLU HB2 H 2.01 0.02 2 916 . 88 GLU HB3 H 2.12 0.02 2 917 . 88 GLU HG2 H 2.24 0.02 2 918 . 88 GLU HG3 H 2.40 0.02 2 919 . 88 GLU C C 176.12 0.1 1 920 . 88 GLU CA C 58.68 0.4 1 921 . 88 GLU CB C 31.83 0.4 1 922 . 88 GLU CG C 36.39 0.4 1 923 . 88 GLU N N 121.39 0.1 1 924 . 89 GLU H H 8.83 0.02 1 925 . 89 GLU HA H 4.55 0.02 2 926 . 89 GLU HB2 H 1.87 0.02 2 927 . 89 GLU HB3 H 1.92 0.02 2 928 . 89 GLU HG2 H 2.14 0.02 2 929 . 89 GLU HG3 H 2.25 0.02 2 930 . 89 GLU C C 174.81 0.1 1 931 . 89 GLU CA C 55.7 0.4 1 932 . 89 GLU CB C 30.83 0.4 1 933 . 89 GLU CG C 36.39 0.4 2 934 . 89 GLU N N 120.74 0.1 1 935 . 90 ARG H H 8.53 0.02 1 936 . 90 ARG HA H 4.40 0.02 1 937 . 90 ARG HB2 H 1.66 0.02 2 938 . 90 ARG HG3 H 1.30 0.02 2 939 . 90 ARG HD3 H 3.09 0.02 2 940 . 90 ARG HH21 H 6.93 0.02 1 941 . 90 ARG HH22 H 7.14 0.02 1 942 . 90 ARG C C 176.12 0.1 1 943 . 90 ARG CA C 55.2 0.4 1 944 . 90 ARG CB C 30.83 0.4 1 945 . 90 ARG CG C 31.42 0.4 1 946 . 90 ARG CD C 43.43 0.4 1 947 . 90 ARG N N 123.34 0.1 1 948 . 91 ARG H H 8.52 0.02 1 949 . 91 ARG HA H 4.91 0.02 1 950 . 91 ARG HB2 H 1.73 0.02 2 951 . 91 ARG HG3 H 1.59 0.02 2 952 . 91 ARG HD2 H 3.28 0.02 2 953 . 91 ARG HH21 H 6.48 0.02 1 954 . 91 ARG HH22 H 6.75 0.02 1 955 . 91 ARG C C 175.0 0.1 1 956 . 91 ARG CA C 53.21 0.4 1 957 . 91 ARG CB C 34.32 0.4 1 958 . 91 ARG CD C 43.02 0.4 1 959 . 91 ARG N N 123.98 0.1 1 960 . 92 ARG H H 8.36 0.02 1 961 . 92 ARG HA H 4.46 0.02 1 962 . 92 ARG HB2 H 1.97 0.02 2 963 . 92 ARG HG3 H 1.80 0.02 2 964 . 92 ARG HD2 H 3.36 0.02 2 965 . 92 ARG HH21 H 6.51 0.02 1 966 . 92 ARG HH22 H 6.81 0.02 1 967 . 92 ARG C C 177.79 0.1 1 968 . 92 ARG CA C 56.69 0.4 1 969 . 92 ARG CB C 31.33 0.4 1 970 . 92 ARG CG C 28.90 0.4 1 971 . 92 ARG CD C 43.43 0.4 2 972 . 92 ARG N N 118.36 0.1 1 973 . 93 VAL H H 9.09 0.02 1 974 . 93 VAL HA H 3.56 0.02 1 975 . 93 VAL HB H 2.20 0.02 1 976 . 93 VAL HG1 H 1.20 0.02 2 977 . 93 VAL HG2 H 1.09 0.02 2 978 . 93 VAL C C 177.33 0.1 1 979 . 93 VAL CA C 67.13 0.4 1 980 . 93 VAL CB C 32.25 0.4 1 981 . 93 VAL CG1 C 24.38 0.4 2 982 . 93 VAL CG2 C 22.72 0.4 2 983 . 93 VAL N N 121.18 0.1 1 984 . 94 ASN H H 9.22 0.02 1 985 . 94 ASN HA H 4.12 0.02 1 986 . 94 ASN HB2 H 2.78 0.02 2 987 . 94 ASN HB3 H 2.88 0.02 2 988 . 94 ASN HD21 H 7.23 0.02 1 989 . 94 ASN HD22 H 7.51 0.02 1 990 . 94 ASN C C 176.02 0.1 1 991 . 94 ASN CA C 57.69 0.4 1 992 . 94 ASN CB C 36.3 0.4 1 993 . 94 ASN N N 117.07 0.1 1 994 . 95 GLN H H 7.16 0.02 1 995 . 95 GLN HA H 4.31 0.02 1 996 . 95 GLN HB2 H 2.19 0.02 2 997 . 95 GLN HB3 H 2.37 0.02 2 998 . 95 GLN HG2 H 2.51 0.02 2 999 . 95 GLN HG3 H 2.63 0.02 2 1000 . 95 GLN HE21 H 7.02 0.02 1 1001 . 95 GLN HE22 H 7.78 0.02 1 1002 . 95 GLN C C 179.38 0.1 1 1003 . 95 GLN CA C 58.56 0.4 1 1004 . 95 GLN CB C 28.35 0.4 1 1005 . 95 GLN CG C 34.21 0.4 1 1006 . 95 GLN N N 118.15 0.1 1 1007 . 95 GLN NE2 N 113.81 0.1 1 1008 . 96 PHE H H 7.91 0.02 1 1009 . 96 PHE HA H 4.36 0.02 1 1010 . 96 PHE HB2 H 3.01 0.02 2 1011 . 96 PHE HD1 H 7.14 0.02 2 1012 . 96 PHE HE2 H 7.16 0.02 2 1013 . 96 PHE HZ H 7.20 0.02 1 1014 . 96 PHE C C 176.40 0.1 1 1015 . 96 PHE CA C 62.16 0.4 1 1016 . 96 PHE CB C 38.79 0.4 1 1017 . 96 PHE N N 123.34 0.1 1 1018 . 97 LEU H H 8.92 0.02 1 1019 . 97 LEU HA H 3.84 0.02 1 1020 . 97 LEU HB2 H 2.10 0.02 2 1021 . 97 LEU HG H 1.44 0.02 1 1022 . 97 LEU HD1 H 0.96 0.02 2 1023 . 97 LEU HD2 H 0.86 0.02 2 1024 . 97 LEU C C 176.96 0.1 1 1025 . 97 LEU CA C 57.69 0.4 1 1026 . 97 LEU CB C 40.28 0.4 1 1027 . 97 LEU CD1 C 22.4 0.4 2 1028 . 97 LEU N N 119.88 0.1 1 1029 . 98 ASP H H 7.89 0.02 1 1030 . 98 ASP HA H 4.40 0.02 1 1031 . 98 ASP HB2 H 2.83 0.02 2 1032 . 98 ASP C C 178.26 0.1 1 1033 . 98 ASP CA C 57.69 0.4 1 1034 . 98 ASP CB C 39.29 0.4 1 1035 . 98 ASP N N 121.18 0.1 1 1036 . 99 TYR H H 7.62 0.02 1 1037 . 99 TYR HA H 4.06 0.02 1 1038 . 99 TYR HB2 H 3.06 0.02 2 1039 . 99 TYR HD1 H 6.94 0.02 1 1040 . 99 TYR HD2 H 6.88 0.02 1 1041 . 99 TYR HE1 H 6.77 0.02 1 1042 . 99 TYR HE2 H 6.68 0.02 1 1043 . 99 TYR C C 177.61 0.1 1 1044 . 99 TYR CA C 62.16 0.4 1 1045 . 99 TYR CB C 39.29 0.4 1 1046 . 99 TYR N N 124.42 0.1 1 1047 . 100 LEU H H 8.70 0.02 1 1048 . 100 LEU HA H 3.84 0.02 1 1049 . 100 LEU HB2 H 1.75 0.02 1 1050 . 100 LEU HG H 1.44 0.02 1 1051 . 100 LEU HD1 H 0.96 0.02 1 1052 . 100 LEU HD2 H 0.76 0.02 1 1053 . 100 LEU C C 178.07 0.1 1 1054 . 100 LEU CA C 57.69 0.4 1 1055 . 100 LEU CB C 41.28 0.4 1 1056 . 100 LEU CG C 26.86 0.4 1 1057 . 100 LEU CD1 C 24.87 0.4 2 1058 . 100 LEU CD2 C 23.55 0.4 2 1059 . 100 LEU N N 121.39 0.1 1 1060 . 101 GLN H H 8.45 0.02 1 1061 . 101 GLN HA H 3.70 0.02 1 1062 . 101 GLN HB2 H 2.18 0.02 2 1063 . 101 GLN HG3 H 2.27 0.02 2 1064 . 101 GLN HE21 H 6.81 0.02 1 1065 . 101 GLN HE22 H 7.36 0.02 1 1066 . 101 GLN C C 178.63 0.1 1 1067 . 101 GLN CA C 59.68 0.4 1 1068 . 101 GLN CB C 28.35 0.4 1 1069 . 101 GLN CG C 34.73 0.4 1 1070 . 101 GLN N N 119.03 0.1 1 1071 . 101 GLN NE2 N 111.65 0.1 1 1072 . 102 GLU H H 7.55 0.02 1 1073 . 102 GLU HA H 3.94 0.02 1 1074 . 102 GLU HB2 H 1.88 0.02 2 1075 . 102 GLU HG3 H 2.06 0.02 2 1076 . 102 GLU C C 178.35 0.1 1 1077 . 102 GLU CA C 59.18 0.4 1 1078 . 102 GLU CB C 29.84 0.4 1 1079 . 102 GLU CG C 30.18 0.4 1 1080 . 102 GLU N N 122.26 0.1 1 1081 . 103 PHE H H 8.39 0.02 1 1082 . 103 PHE HA H 3.47 0.02 1 1083 . 103 PHE HB2 H 2.82 0.02 2 1084 . 103 PHE HD1 H 7.14 0.02 2 1085 . 103 PHE HE1 H 7.20 0.02 2 1086 . 103 PHE HZ H 7.22 0.02 2 1087 . 103 PHE C C 176.58 0.1 1 1088 . 103 PHE CA C 59.68 0.4 1 1089 . 103 PHE CB C 38.79 0.4 1 1090 . 103 PHE N N 121.61 0.1 1 1091 . 104 LEU H H 8.45 0.02 1 1092 . 104 LEU HA H 3.62 0.02 1 1093 . 104 LEU HB2 H 1.90 0.02 1 1094 . 104 LEU HB3 H 1.90 0.02 1 1095 . 104 LEU HG H 1.18 0.02 1 1096 . 104 LEU HD1 H 0.85 0.02 2 1097 . 104 LEU HD2 H 0.74 0.02 2 1098 . 104 LEU C C 178.35 0.1 1 1099 . 104 LEU CA C 57.69 0.4 1 1100 . 104 LEU CB C 41.77 0.4 1 1101 . 104 LEU CG C 27.01 0.4 1 1102 . 104 LEU CD1 C 26.86 0.4 2 1103 . 104 LEU CD2 C 23.13 0.4 2 1104 . 104 LEU N N 119.23 0.1 1 1105 . 105 GLY H H 7.81 0.02 1 1106 . 105 GLY HA2 H 3.84 0.02 1 1107 . 105 GLY HA3 H 3.92 0.02 1 1108 . 105 GLY C C 178.73 0.1 1 1109 . 105 GLY CA C 46.75 0.4 1 1110 . 105 GLY N N 106.49 0.1 1 1111 . 106 VAL H H 7.56 0.02 1 1112 . 106 VAL HA H 4.08 0.02 1 1113 . 106 VAL HB H 2.15 0.02 1 1114 . 106 VAL HG1 H 1.06 0.02 2 1115 . 106 VAL HG2 H 1.02 0.02 2 1116 . 106 VAL C C 177.49 0.1 1 1117 . 106 VAL CA C 63.80 0.4 1 1118 . 106 VAL CB C 31.78 0.4 1 1119 . 106 VAL CG1 C 21.06 0.4 1 1120 . 106 VAL CG2 C 21.47 0.4 1 1121 . 106 VAL N N 119.44 0.1 1 1122 . 107 MET H H 7.42 0.02 1 1123 . 107 MET HA H 4.21 0.02 1 1124 . 107 MET HB2 H 2.00 0.02 2 1125 . 107 MET HB3 H 2.15 0.02 2 1126 . 107 MET HG2 H 2.24 0.02 2 1127 . 107 MET HG3 H 2.40 0.02 2 1128 . 107 MET C C 176.12 0.1 1 1129 . 107 MET CA C 57.69 0.4 1 1130 . 107 MET CB C 32.33 0.4 1 1131 . 107 MET CG C 36.80 0.4 1 1132 . 107 MET N N 122.26 0.1 1 1133 . 108 ASN H H 8.82 0.02 1 1134 . 108 ASN HA H 4.66 0.02 1 1135 . 108 ASN HB2 H 2.74 0.02 2 1136 . 108 ASN HB3 H 2.84 0.02 2 1137 . 108 ASN HD21 H 7.25 0.02 1 1138 . 108 ASN HD22 H 7.81 0.02 1 1139 . 108 ASN C C 176.21 0.1 1 1140 . 108 ASN CA C 54.21 0.4 1 1141 . 108 ASN CB C 39.29 0.4 1 1142 . 108 ASN N N 120.52 0.1 1 1143 . 109 THR H H 8.06 0.02 1 1144 . 109 THR HA H 4.40 0.02 1 1145 . 109 THR HB H 4.26 0.02 1 1146 . 109 THR HG2 H 1.16 0.02 1 1147 . 109 THR C C 175.28 0.1 1 1148 . 109 THR CA C 62.66 0.4 1 1149 . 109 THR CB C 69.62 0.4 1 1150 . 109 THR CG2 C 22.30 0.4 1 1151 . 109 THR N N 112.54 0.1 1 1152 . 110 GLU H H 8.42 0.02 1 1153 . 110 GLU HA H 4.46 0.02 1 1154 . 110 GLU HB2 H 2.05 0.02 2 1155 . 110 GLU HB3 H 2.15 0.02 2 1156 . 110 GLU HG2 H 2.24 0.02 2 1157 . 110 GLU C C 177.05 0.1 1 1158 . 110 GLU CA C 57.19 0.4 1 1159 . 110 GLU CB C 31.01 0.4 1 1160 . 110 GLU N N 121.61 0.1 1 1161 . 111 TRP H H 7.84 0.02 1 1162 . 111 TRP HA H 4.84 0.02 1 1163 . 111 TRP HB2 H 3.35 0.02 2 1164 . 111 TRP HD1 H 7.21 0.02 1 1165 . 111 TRP HE1 H 10.24 0.02 1 1166 . 111 TRP HE3 H 7.61 0.02 1 1167 . 111 TRP HZ2 H 7.39 0.02 1 1168 . 111 TRP HZ3 H 7.02 0.02 1 1169 . 111 TRP HH2 H 7.17 0.02 1 1170 . 111 TRP C C 175.93 0.1 1 1171 . 111 TRP CA C 57.19 0.4 1 1172 . 111 TRP CB C 29.84 0.4 1 1173 . 111 TRP N N 120.96 0.1 1 1174 . 112 ILE H H 8.23 0.02 1 1175 . 112 ILE HA H 4.25 0.02 1 1176 . 112 ILE HB H 1.90 0.02 1 1177 . 112 ILE HG12 H 1.50 0.02 2 1178 . 112 ILE HG2 H 1.19 0.02 1 1179 . 112 ILE HD1 H 0.84 0.02 1 1180 . 112 ILE C C 175.56 0.1 1 1181 . 112 ILE CA C 60.67 0.4 1 1182 . 112 ILE CB C 37.80 0.4 1 1183 . 112 ILE CG1 C 27.60 0.4 1 1184 . 112 ILE CD1 C 13.19 0.4 1 1185 . 112 ILE N N 123.98 0.1 1 1186 . 113 ILE H H 8.25 0.02 1 1187 . 113 ILE HA H 4.25 0.02 1 1188 . 113 ILE HB H 1.87 0.02 1 1189 . 113 ILE HG12 H 1.50 0.02 1 1190 . 113 ILE HG2 H 1.19 0.02 1 1191 . 113 ILE HD1 H 0.88 0.02 1 1192 . 113 ILE C C 173.88 0.1 1 1193 . 113 ILE CA C 60.67 0.4 1 1194 . 113 ILE CB C 39.28 0.4 1 1195 . 113 ILE CD1 C 13.60 0.4 1 1196 . 113 ILE N N 127.66 0.1 1 1197 . 114 GLU H H 8.45 0.02 1 1198 . 114 GLU HA H 4.47 0.02 1 1199 . 114 GLU HB2 H 2.05 0.02 2 1200 . 114 GLU HG3 H 2.18 0.02 2 1201 . 114 GLU C C 175.84 0.1 1 1202 . 114 GLU CA C 56.69 0.4 1 1203 . 114 GLU CB C 30.34 0.4 1 1204 . 114 GLU CG C 31.01 0.4 1 1205 . 114 GLU N N 127.22 0.1 1 1206 . 115 SER H H 8.30 0.02 1 1207 . 115 SER HA H 4.36 0.02 1 1208 . 115 SER CA C 58.58 0.4 1 1209 . 115 SER N N 124.2 0.1 1 stop_ save_