data_19108 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR structure of human restriction factor APOBEC3A ; _BMRB_accession_number 19108 _BMRB_flat_file_name bmr19108.str _Entry_type original _Submission_date 2013-03-21 _Accession_date 2013-03-21 _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 Byeon In-Ja L. . 2 Byeon Chang-Hyeock . . 3 Ahn Jinwoo M. . 4 Gronenborn Angela M. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 950 "13C chemical shifts" 502 "15N chemical shifts" 203 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-05-28 update BMRB 'update entry citation' 2013-05-20 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'NMR structure of human restriction factor APOBEC3A reveals substrate binding and enzyme specificity.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 23695684 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Byeon In-Ja L. . 2 Ahn Jinwoo . . 3 Mitra Mithun . . 4 Byeon Chang-Hyeock . . 5 Hercik Kamil . . 6 Hritz Jozef . . 7 Charlton Lisa M. . 8 Levin Judith G. . 9 Gronenborn Angela M. . stop_ _Journal_abbreviation 'Nat. Commun.' _Journal_name_full 'Nature communications' _Journal_volume 4 _Journal_issue 1890 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1890 _Page_last 1890 _Year 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'human restriction factor APOBEC3A' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'human restriction factor APOBEC3A' $entity_1 'ZINC ION' $entity_ZN stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass 23041.172 _Mol_thiol_state . _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 199 _Mol_residue_sequence ; MEASPASGPRHLMDPHIFTS NFNNGIGRHKTYLCYEVERL DNGTSVKMDQHRGFLHNQAK NLLCGFYGRHAELRFLDLVP SLQLDPAQIYRVTWFISWSP CFSWGCAGEVRAFLQENTHV RLRIFAARIYDYDPLYKEAL QMLRDAGAQVSIMTYDEFKH CWDTFVDHQGCPFQPWDGLD EHSQALSGRLRAILQNQGN ; loop_ _Residue_seq_code _Residue_label 1 MET 2 GLU 3 ALA 4 SER 5 PRO 6 ALA 7 SER 8 GLY 9 PRO 10 ARG 11 HIS 12 LEU 13 MET 14 ASP 15 PRO 16 HIS 17 ILE 18 PHE 19 THR 20 SER 21 ASN 22 PHE 23 ASN 24 ASN 25 GLY 26 ILE 27 GLY 28 ARG 29 HIS 30 LYS 31 THR 32 TYR 33 LEU 34 CYS 35 TYR 36 GLU 37 VAL 38 GLU 39 ARG 40 LEU 41 ASP 42 ASN 43 GLY 44 THR 45 SER 46 VAL 47 LYS 48 MET 49 ASP 50 GLN 51 HIS 52 ARG 53 GLY 54 PHE 55 LEU 56 HIS 57 ASN 58 GLN 59 ALA 60 LYS 61 ASN 62 LEU 63 LEU 64 CYS 65 GLY 66 PHE 67 TYR 68 GLY 69 ARG 70 HIS 71 ALA 72 GLU 73 LEU 74 ARG 75 PHE 76 LEU 77 ASP 78 LEU 79 VAL 80 PRO 81 SER 82 LEU 83 GLN 84 LEU 85 ASP 86 PRO 87 ALA 88 GLN 89 ILE 90 TYR 91 ARG 92 VAL 93 THR 94 TRP 95 PHE 96 ILE 97 SER 98 TRP 99 SER 100 PRO 101 CYS 102 PHE 103 SER 104 TRP 105 GLY 106 CYS 107 ALA 108 GLY 109 GLU 110 VAL 111 ARG 112 ALA 113 PHE 114 LEU 115 GLN 116 GLU 117 ASN 118 THR 119 HIS 120 VAL 121 ARG 122 LEU 123 ARG 124 ILE 125 PHE 126 ALA 127 ALA 128 ARG 129 ILE 130 TYR 131 ASP 132 TYR 133 ASP 134 PRO 135 LEU 136 TYR 137 LYS 138 GLU 139 ALA 140 LEU 141 GLN 142 MET 143 LEU 144 ARG 145 ASP 146 ALA 147 GLY 148 ALA 149 GLN 150 VAL 151 SER 152 ILE 153 MET 154 THR 155 TYR 156 ASP 157 GLU 158 PHE 159 LYS 160 HIS 161 CYS 162 TRP 163 ASP 164 THR 165 PHE 166 VAL 167 ASP 168 HIS 169 GLN 170 GLY 171 CYS 172 PRO 173 PHE 174 GLN 175 PRO 176 TRP 177 ASP 178 GLY 179 LEU 180 ASP 181 GLU 182 HIS 183 SER 184 GLN 185 ALA 186 LEU 187 SER 188 GLY 189 ARG 190 LEU 191 ARG 192 ALA 193 ILE 194 LEU 195 GLN 196 ASN 197 GLN 198 GLY 199 ASN stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-26 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 2M65 "Nmr Structure Of Human Restriction Factor Apobec3a" 100.00 207 100.00 100.00 1.95e-147 PDB 4XXO "Crystal Structure Of Human Apobec3a" 100.00 203 98.99 98.99 1.41e-145 DBJ BAI46227 "apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3A [synthetic construct]" 100.00 199 100.00 100.00 1.11e-147 EMBL CAG30279 "bK150C2.1 [Homo sapiens]" 100.00 199 100.00 100.00 1.11e-147 EMBL CAK54381 "APOBEC3A [synthetic construct]" 100.00 199 100.00 100.00 1.11e-147 EMBL CAK54680 "APOBEC3A [synthetic construct]" 100.00 199 100.00 100.00 1.11e-147 GB AAA03706 "phorbolin I [Homo sapiens]" 100.00 199 100.00 100.00 1.11e-147 GB AAI26417 "Apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3A [Homo sapiens]" 100.00 199 100.00 100.00 1.11e-147 GB ADO85886 "apolipoprotein B mRNA editing enzyme catalytic polypeptide-like 3A [Gorilla gorilla]" 100.00 199 96.98 98.49 2.10e-142 GB ADR82854 "apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3A (APOBEC3A) [synthetic construct]" 100.00 199 100.00 100.00 1.11e-147 GB AIC53372 "APOBEC3A, partial [synthetic construct]" 100.00 199 100.00 100.00 1.11e-147 REF NP_001180218 "probable DNA dC->dU-editing enzyme APOBEC-3A [Homo sapiens]" 100.00 199 100.00 100.00 1.11e-147 REF NP_663745 "DNA dC->dU-editing enzyme APOBEC-3A isoform a [Homo sapiens]" 100.00 199 100.00 100.00 1.11e-147 REF XP_001149270 "PREDICTED: DNA dC->dU-editing enzyme APOBEC-3A [Pan troglodytes]" 93.97 187 98.40 99.47 5.21e-136 REF XP_011545340 "PREDICTED: probable DNA dC->dU-editing enzyme APOBEC-3A isoform X1 [Homo sapiens]" 78.89 207 100.00 100.00 1.75e-113 REF XP_011545341 "PREDICTED: probable DNA dC->dU-editing enzyme APOBEC-3A isoform X1 [Homo sapiens]" 78.89 207 100.00 100.00 1.75e-113 SP P31941 "RecName: Full=DNA dC->dU-editing enzyme APOBEC-3A; Short=A3A; AltName: Full=Phorbolin-1" 100.00 199 100.00 100.00 1.11e-147 stop_ save_ ############# # Ligands # ############# save_ZN _Saveframe_category ligand _Mol_type "non-polymer (NON-POLYMER)" _Name_common "entity_ZN (ZINC ION)" _BMRB_code ZN _PDB_code ZN _Molecular_mass 65.409 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons ZN ZN ZN . 2 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 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 $entity_1 'recombinant technology' . Escherichia coli . pET21 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '13C,15N-APOBEC3A at pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 . mM '[U-13C; U-15N]' $entity_ZN . mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details '13C,15N-APOBEC3A at pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 . mM '[U-13C; U-15N]' $entity_ZN . mM 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details '13C,15N-APOBEC3A at pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 . mM '[U-13C; U-15N]' $entity_ZN . mM 'natural abundance' stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type solution _Details '13C,15N-APOBEC3A at pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 . mM '[U-13C; U-15N]' $entity_ZN . mM 'natural abundance' stop_ save_ save_sample_5 _Saveframe_category sample _Sample_type solution _Details '13C,15N-APOBEC3A at pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 . mM '[U-13C; U-15N]' $entity_ZN . mM 'natural abundance' stop_ save_ save_sample_6 _Saveframe_category sample _Sample_type solution _Details '13C,15N-APOBEC3A at pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 . mM '[U-13C; U-15N]' $entity_ZN . mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.3 _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ save_spectrometer_4 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CACB' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_simulaneous_1H-13C_and_1H-15N_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D simulaneous 1H-13C and 1H-15N NOESY' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_8 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_2 save_ save_3D_HNCA_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_2 save_ save_3D_HN(CO)CA_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_2 save_ save_3D_HCCH-TOCSY_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_2 save_ save_3D_simultaneous_1H-13C_and_1H-15N_NOESY_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D simultaneous 1H-13C and 1H-15N NOESY' _Sample_label $sample_2 save_ save_2D_1H-15N_HSQC_13 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_3 save_ save_3D_HCCH-TOCSY_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_3 save_ save_3D_simulaneous_1H-13C_and_1H-15N_NOESY_15 _Saveframe_category NMR_applied_experiment _Experiment_name '3D simulaneous 1H-13C and 1H-15N NOESY' _Sample_label $sample_3 save_ save_2D_1H-15N_HSQC_16 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_4 save_ save_3D_HNCACB_17 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_4 save_ save_3D_HN(CO)CACB_18 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CACB' _Sample_label $sample_4 save_ save_3D_simultaneous_1H-13C_and_1H-15N_NOESY_19 _Saveframe_category NMR_applied_experiment _Experiment_name '3D simultaneous 1H-13C and 1H-15N NOESY' _Sample_label $sample_4 save_ save_2D_1H-13C_HSQC_aliphatic_20 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aliphatic' _Sample_label $sample_4 save_ save_2D_1H-15N_HSQC_21 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_5 save_ save_3D_simultaneous_1H-13C_and_1H-15N_NOESY_22 _Saveframe_category NMR_applied_experiment _Experiment_name '3D simultaneous 1H-13C and 1H-15N NOESY' _Sample_label $sample_5 save_ save_2D_1H-13C_HSQC_aliphatic_23 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aliphatic' _Sample_label $sample_5 save_ save_2D_1H-1H_NOESY_24 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $sample_6 save_ save_2D_1H-1H_TOCSY_25 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $sample_6 save_ save_NMR_spectrometer_expt _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 . pH pressure 1 . atm temperature . . K stop_ save_ save_sample_conditions_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 . pH pressure 1 . atm temperature . . K stop_ save_ save_sample_conditions_3 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 . pH pressure 1 . atm temperature . . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCA' '3D HN(CO)CA' '3D HNCACB' '3D HN(CO)CACB' '3D HCCH-TOCSY' '3D simulaneous 1H-13C and 1H-15N NOESY' '3D simultaneous 1H-13C and 1H-15N NOESY' '2D 1H-13C HSQC aliphatic' '2D 1H-1H NOESY' '2D 1H-1H TOCSY' stop_ loop_ _Sample_label $sample_1 $sample_4 $sample_5 $sample_6 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'human restriction factor APOBEC3A' _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 1 MET HA H 4.097 . . 2 1 1 MET HB3 H 2.148 . . 3 1 1 MET HG3 H 2.613 . . 4 1 1 MET CA C 55.208 . . 5 1 1 MET CB C 33.214 . . 6 1 1 MET CG C 30.850 . . 7 2 2 GLU HA H 4.374 . . 8 2 2 GLU HB2 H 1.955 . . 9 2 2 GLU HB3 H 2.081 . . 10 2 2 GLU HG3 H 2.309 . . 11 2 2 GLU CA C 56.348 . . 12 2 2 GLU CB C 30.453 . . 13 2 2 GLU CG C 36.183 . . 14 3 3 ALA H H 8.526 . . 15 3 3 ALA HA H 4.350 . . 16 3 3 ALA HB H 1.399 . . 17 3 3 ALA CA C 52.407 . . 18 3 3 ALA CB C 19.580 . . 19 3 3 ALA N N 125.932 . . 20 4 4 SER H H 8.397 . . 21 4 4 SER HA H 4.766 . . 22 4 4 SER HB2 H 3.840 . . 23 4 4 SER HB3 H 3.881 . . 24 4 4 SER CA C 56.283 . . 25 4 4 SER CB C 63.278 . . 26 4 4 SER N N 116.729 . . 27 5 5 PRO HA H 4.446 . . 28 5 5 PRO HB2 H 1.954 . . 29 5 5 PRO HB3 H 2.316 . . 30 5 5 PRO HG2 H 1.879 . . 31 5 5 PRO HG3 H 2.021 . . 32 5 5 PRO HD2 H 3.725 . . 33 5 5 PRO HD3 H 3.825 . . 34 5 5 PRO CA C 63.306 . . 35 5 5 PRO CB C 32.097 . . 36 5 5 PRO CG C 27.356 . . 37 5 5 PRO CD C 50.856 . . 38 6 6 ALA H H 8.411 . . 39 6 6 ALA HA H 4.333 . . 40 6 6 ALA HB H 1.397 . . 41 6 6 ALA CA C 52.563 . . 42 6 6 ALA CB C 19.334 . . 43 6 6 ALA N N 124.236 . . 44 7 7 SER H H 8.195 . . 45 7 7 SER HA H 4.475 . . 46 7 7 SER HB2 H 3.858 . . 47 7 7 SER HB3 H 3.895 . . 48 7 7 SER CA C 58.258 . . 49 7 7 SER CB C 64.174 . . 50 7 7 SER N N 114.497 . . 51 8 8 GLY H H 8.226 . . 52 8 8 GLY HA2 H 4.155 . . 53 8 8 GLY HA3 H 4.185 . . 54 8 8 GLY CA C 44.846 . . 55 8 8 GLY N N 110.497 . . 56 9 9 PRO HA H 4.449 . . 57 9 9 PRO HB2 H 1.875 . . 58 9 9 PRO HB3 H 2.288 . . 59 9 9 PRO HG3 H 2.024 . . 60 9 9 PRO HD2 H 3.631 . . 61 9 9 PRO HD3 H 3.648 . . 62 9 9 PRO CA C 63.434 . . 63 9 9 PRO CB C 32.193 . . 64 9 9 PRO CG C 27.314 . . 65 9 9 PRO CD C 49.877 . . 66 10 10 ARG H H 8.469 . . 67 10 10 ARG HA H 4.341 . . 68 10 10 ARG HB2 H 1.744 . . 69 10 10 ARG HB3 H 1.853 . . 70 10 10 ARG HG2 H 1.639 . . 71 10 10 ARG HG3 H 1.688 . . 72 10 10 ARG HD3 H 3.246 . . 73 10 10 ARG HE H 6.308 . . 74 10 10 ARG CA C 56.016 . . 75 10 10 ARG CB C 30.809 . . 76 10 10 ARG CG C 27.229 . . 77 10 10 ARG CD C 43.466 . . 78 10 10 ARG N N 120.534 . . 79 11 11 HIS HA H 4.825 . . 80 11 11 HIS HB2 H 3.138 . . 81 11 11 HIS HB3 H 3.257 . . 82 11 11 HIS CA C 55.461 . . 83 11 11 HIS CB C 30.191 . . 84 12 12 LEU H H 8.250 . . 85 12 12 LEU HB2 H 1.010 . . 86 12 12 LEU HB3 H 1.459 . . 87 12 12 LEU HG H 1.326 . . 88 12 12 LEU HD1 H 0.596 . . 89 12 12 LEU HD2 H 0.568 . . 90 12 12 LEU CA C 53.609 . . 91 12 12 LEU CB C 45.030 . . 92 12 12 LEU CG C 26.309 . . 93 12 12 LEU CD1 C 25.716 . . 94 12 12 LEU CD2 C 22.565 . . 95 12 12 LEU N N 122.284 . . 96 13 13 MET H H 8.955 . . 97 13 13 MET HA H 4.038 . . 98 13 13 MET HB2 H 1.684 . . 99 13 13 MET HB3 H 2.064 . . 100 13 13 MET HG2 H 2.551 . . 101 13 13 MET HE H 1.360 . . 102 13 13 MET CA C 54.449 . . 103 13 13 MET CB C 35.015 . . 104 13 13 MET CE C 16.662 . . 105 13 13 MET N N 121.493 . . 106 14 14 ASP H H 8.514 . . 107 14 14 ASP HA H 4.100 . . 108 14 14 ASP HB2 H 2.043 . . 109 14 14 ASP HB3 H 2.712 . . 110 14 14 ASP CA C 52.456 . . 111 14 14 ASP CB C 42.510 . . 112 14 14 ASP N N 127.113 . . 113 15 15 PRO HA H 3.853 . . 114 15 15 PRO HB2 H 2.056 . . 115 15 15 PRO HB3 H 2.171 . . 116 15 15 PRO HG3 H 1.693 . . 117 15 15 PRO HD3 H 3.198 . . 118 15 15 PRO CA C 66.654 . . 119 15 15 PRO CB C 31.651 . . 120 15 15 PRO CG C 27.424 . . 121 16 16 HIS H H 8.591 . . 122 16 16 HIS HA H 4.278 . . 123 16 16 HIS HB2 H 2.661 . . 124 16 16 HIS HB3 H 3.231 . . 125 16 16 HIS HD2 H 7.190 . . 126 16 16 HIS CA C 58.918 . . 127 16 16 HIS CB C 29.208 . . 128 16 16 HIS CD2 C 119.970 . . 129 16 16 HIS N N 115.776 . . 130 17 17 ILE H H 7.558 . . 131 17 17 ILE HA H 3.484 . . 132 17 17 ILE HB H 2.055 . . 133 17 17 ILE HG12 H 1.286 . . 134 17 17 ILE HG13 H 1.599 . . 135 17 17 ILE HG2 H 0.453 . . 136 17 17 ILE HD1 H 0.862 . . 137 17 17 ILE CA C 63.226 . . 138 17 17 ILE CB C 36.097 . . 139 17 17 ILE CG1 C 27.972 . . 140 17 17 ILE CG2 C 17.058 . . 141 17 17 ILE CD1 C 10.713 . . 142 17 17 ILE N N 122.675 . . 143 18 18 PHE H H 7.831 . . 144 18 18 PHE HA H 4.003 . . 145 18 18 PHE HB2 H 3.023 . . 146 18 18 PHE HB3 H 3.253 . . 147 18 18 PHE HD1 H 7.277 . . 148 18 18 PHE HE1 H 7.626 . . 149 18 18 PHE HZ H 7.277 . . 150 18 18 PHE CA C 62.804 . . 151 18 18 PHE CB C 39.640 . . 152 18 18 PHE N N 120.513 . . 153 19 19 THR H H 9.036 . . 154 19 19 THR HA H 3.657 . . 155 19 19 THR HB H 4.328 . . 156 19 19 THR HG2 H 1.627 . . 157 19 19 THR CA C 66.485 . . 158 19 19 THR CB C 68.345 . . 159 19 19 THR CG2 C 22.799 . . 160 19 19 THR N N 114.555 . . 161 20 20 SER H H 7.809 . . 162 20 20 SER HA H 4.062 . . 163 20 20 SER HB2 H 3.708 . . 164 20 20 SER HB3 H 4.041 . . 165 20 20 SER CA C 60.610 . . 166 20 20 SER CB C 63.843 . . 167 20 20 SER N N 113.030 . . 168 21 21 ASN H H 7.362 . . 169 21 21 ASN HA H 4.411 . . 170 21 21 ASN HB2 H 2.708 . . 171 21 21 ASN HB3 H 2.996 . . 172 21 21 ASN HD21 H 7.648 . . 173 21 21 ASN HD22 H 6.887 . . 174 21 21 ASN CA C 56.989 . . 175 21 21 ASN CB C 41.580 . . 176 21 21 ASN N N 115.629 . . 177 21 21 ASN ND2 N 113.149 . . 178 22 22 PHE H H 8.296 . . 179 22 22 PHE HA H 4.273 . . 180 22 22 PHE HB3 H 3.216 . . 181 22 22 PHE HD2 H 6.821 . . 182 22 22 PHE HE2 H 6.975 . . 183 22 22 PHE HZ H 6.819 . . 184 22 22 PHE CA C 56.460 . . 185 22 22 PHE CB C 37.830 . . 186 22 22 PHE N N 117.773 . . 187 23 23 ASN H H 6.097 . . 188 23 23 ASN HA H 4.529 . . 189 23 23 ASN HB2 H 1.855 . . 190 23 23 ASN HB3 H 2.303 . . 191 23 23 ASN CA C 53.642 . . 192 23 23 ASN CB C 36.623 . . 193 23 23 ASN N N 115.026 . . 194 24 24 ASN H H 7.083 . . 195 24 24 ASN HA H 4.433 . . 196 24 24 ASN HB2 H 2.723 . . 197 24 24 ASN HB3 H 3.003 . . 198 24 24 ASN HD21 H 7.650 . . 199 24 24 ASN HD22 H 6.880 . . 200 24 24 ASN CA C 53.273 . . 201 24 24 ASN CB C 37.892 . . 202 24 24 ASN N N 122.900 . . 203 25 25 GLY H H 8.520 . . 204 25 25 GLY HA2 H 3.578 . . 205 25 25 GLY CA C 44.865 . . 206 25 25 GLY N N 105.587 . . 207 26 26 ILE H H 6.944 . . 208 26 26 ILE HA H 4.174 . . 209 26 26 ILE HB H 1.470 . . 210 26 26 ILE HG12 H 0.904 . . 211 26 26 ILE HG13 H 1.228 . . 212 26 26 ILE HG2 H 0.739 . . 213 26 26 ILE HD1 H 0.748 . . 214 26 26 ILE CA C 60.443 . . 215 26 26 ILE CB C 40.515 . . 216 26 26 ILE CG1 C 27.010 . . 217 26 26 ILE CG2 C 16.804 . . 218 26 26 ILE CD1 C 13.337 . . 219 26 26 ILE N N 120.182 . . 220 27 27 GLY H H 8.457 . . 221 27 27 GLY HA2 H 3.747 . . 222 27 27 GLY HA3 H 4.157 . . 223 27 27 GLY CA C 45.319 . . 224 27 27 GLY N N 111.665 . . 225 28 28 ARG H H 6.741 . . 226 28 28 ARG HE H 7.248 . . 227 28 28 ARG CA C 53.565 . . 228 28 28 ARG N N 117.565 . . 229 28 28 ARG NE N 84.843 . . 230 29 29 HIS H H 8.636 . . 231 29 29 HIS HB3 H 3.138 . . 232 29 29 HIS CA C 58.003 . . 233 29 29 HIS CB C 29.044 . . 234 30 30 LYS H H 7.870 . . 235 30 30 LYS HA H 4.421 . . 236 30 30 LYS HB3 H 1.799 . . 237 30 30 LYS HG3 H 1.555 . . 238 30 30 LYS HE2 H 2.839 . . 239 30 30 LYS CA C 56.864 . . 240 30 30 LYS CB C 35.191 . . 241 30 30 LYS N N 119.344 . . 242 31 31 THR H H 8.436 . . 243 31 31 THR HA H 4.125 . . 244 31 31 THR HB H 3.569 . . 245 31 31 THR HG2 H 0.790 . . 246 31 31 THR CA C 63.175 . . 247 31 31 THR N N 118.233 . . 248 32 32 TYR H H 8.244 . . 249 32 32 TYR HA H 4.936 . . 250 32 32 TYR HB2 H 2.519 . . 251 32 32 TYR HB3 H 3.065 . . 252 32 32 TYR HD2 H 6.834 . . 253 32 32 TYR HE2 H 6.655 . . 254 32 32 TYR CA C 57.501 . . 255 32 32 TYR CB C 44.404 . . 256 32 32 TYR N N 124.026 . . 257 33 33 LEU H H 9.232 . . 258 33 33 LEU HA H 5.079 . . 259 33 33 LEU HB2 H 1.021 . . 260 33 33 LEU HB3 H 1.547 . . 261 33 33 LEU HG H 0.956 . . 262 33 33 LEU HD1 H -0.065 . . 263 33 33 LEU HD2 H -0.277 . . 264 33 33 LEU CA C 54.838 . . 265 33 33 LEU CB C 46.984 . . 266 33 33 LEU CG C 28.773 . . 267 33 33 LEU CD1 C 24.193 . . 268 33 33 LEU CD2 C 25.229 . . 269 33 33 LEU N N 125.428 . . 270 34 34 CYS H H 9.640 . . 271 34 34 CYS HA H 5.006 . . 272 34 34 CYS HB2 H 1.136 . . 273 34 34 CYS HB3 H 2.716 . . 274 34 34 CYS CA C 57.145 . . 275 34 34 CYS CB C 28.302 . . 276 34 34 CYS N N 125.975 . . 277 35 35 TYR H H 9.094 . . 278 35 35 TYR HA H 6.488 . . 279 35 35 TYR HB2 H 2.494 . . 280 35 35 TYR HB3 H 2.932 . . 281 35 35 TYR HD1 H 6.790 . . 282 35 35 TYR HE1 H 6.515 . . 283 35 35 TYR CA C 54.782 . . 284 35 35 TYR CB C 43.090 . . 285 35 35 TYR N N 121.183 . . 286 36 36 GLU H H 8.977 . . 287 36 36 GLU HA H 5.435 . . 288 36 36 GLU HB2 H 2.081 . . 289 36 36 GLU HB3 H 2.296 . . 290 36 36 GLU HG2 H 2.502 . . 291 36 36 GLU HG3 H 2.639 . . 292 36 36 GLU CA C 55.391 . . 293 36 36 GLU CB C 34.544 . . 294 36 36 GLU N N 115.538 . . 295 37 37 VAL H H 9.271 . . 296 37 37 VAL HA H 5.159 . . 297 37 37 VAL HB H 2.409 . . 298 37 37 VAL HG1 H 1.319 . . 299 37 37 VAL HG2 H 1.186 . . 300 37 37 VAL CA C 62.048 . . 301 37 37 VAL CB C 35.070 . . 302 37 37 VAL CG1 C 21.448 . . 303 37 37 VAL CG2 C 22.277 . . 304 37 37 VAL N N 121.600 . . 305 38 38 GLU H H 9.114 . . 306 38 38 GLU HA H 5.218 . . 307 38 38 GLU HB2 H 2.093 . . 308 38 38 GLU HB3 H 2.143 . . 309 38 38 GLU HG2 H 2.036 . . 310 38 38 GLU HG3 H 2.181 . . 311 38 38 GLU CA C 54.252 . . 312 38 38 GLU CB C 34.927 . . 313 38 38 GLU N N 125.227 . . 314 39 39 ARG H H 9.215 . . 315 39 39 ARG HA H 5.365 . . 316 39 39 ARG HB2 H 1.905 . . 317 39 39 ARG HB3 H 2.103 . . 318 39 39 ARG HG2 H 1.228 . . 319 39 39 ARG HG3 H 1.424 . . 320 39 39 ARG CA C 55.247 . . 321 39 39 ARG CB C 32.565 . . 322 39 39 ARG N N 124.872 . . 323 40 40 LEU H H 8.659 . . 324 40 40 LEU HA H 4.753 . . 325 40 40 LEU HB2 H 1.248 . . 326 40 40 LEU HB3 H 1.543 . . 327 40 40 LEU HG H 1.445 . . 328 40 40 LEU HD1 H 0.742 . . 329 40 40 LEU HD2 H 0.661 . . 330 40 40 LEU CA C 54.323 . . 331 40 40 LEU CB C 40.843 . . 332 40 40 LEU CD1 C 25.242 . . 333 40 40 LEU CD2 C 23.002 . . 334 40 40 LEU N N 126.510 . . 335 41 41 ASP H H 8.575 . . 336 41 41 ASP HA H 4.793 . . 337 41 41 ASP HB2 H 2.471 . . 338 41 41 ASP HB3 H 2.669 . . 339 41 41 ASP CA C 53.218 . . 340 41 41 ASP CB C 41.733 . . 341 41 41 ASP N N 124.410 . . 342 42 42 ASN H H 9.048 . . 343 42 42 ASN HA H 4.420 . . 344 42 42 ASN HB2 H 2.713 . . 345 42 42 ASN HB3 H 2.989 . . 346 42 42 ASN CA C 54.173 . . 347 42 42 ASN CB C 37.847 . . 348 42 42 ASN N N 123.319 . . 349 43 43 GLY H H 8.548 . . 350 43 43 GLY HA2 H 3.688 . . 351 43 43 GLY HA3 H 4.191 . . 352 43 43 GLY CA C 45.394 . . 353 43 43 GLY N N 106.044 . . 354 44 44 THR H H 7.833 . . 355 44 44 THR HA H 4.524 . . 356 44 44 THR HB H 4.220 . . 357 44 44 THR HG2 H 1.216 . . 358 44 44 THR CA C 61.285 . . 359 44 44 THR CB C 70.572 . . 360 44 44 THR CG2 C 21.314 . . 361 44 44 THR N N 115.893 . . 362 45 45 SER H H 8.590 . . 363 45 45 SER HA H 4.804 . . 364 45 45 SER HB2 H 3.697 . . 365 45 45 SER HB3 H 3.747 . . 366 45 45 SER CA C 58.080 . . 367 45 45 SER CB C 64.265 . . 368 45 45 SER N N 119.589 . . 369 46 46 VAL H H 9.034 . . 370 46 46 VAL HA H 4.293 . . 371 46 46 VAL HB H 2.107 . . 372 46 46 VAL HG1 H 1.007 . . 373 46 46 VAL HG2 H 0.973 . . 374 46 46 VAL CA C 61.843 . . 375 46 46 VAL CB C 33.517 . . 376 46 46 VAL CG1 C 21.025 . . 377 46 46 VAL CG2 C 20.841 . . 378 46 46 VAL N N 125.827 . . 379 47 47 LYS H H 8.738 . . 380 47 47 LYS HA H 4.285 . . 381 47 47 LYS HB2 H 1.865 . . 382 47 47 LYS HB3 H 1.909 . . 383 47 47 LYS HG2 H 1.509 . . 384 47 47 LYS HG3 H 1.603 . . 385 47 47 LYS HD2 H 1.768 . . 386 47 47 LYS HD3 H 1.767 . . 387 47 47 LYS HE2 H 3.046 . . 388 47 47 LYS HZ H 6.509 . . 389 47 47 LYS CA C 57.665 . . 390 47 47 LYS CB C 32.792 . . 391 47 47 LYS CG C 25.087 . . 392 47 47 LYS CD C 29.055 . . 393 47 47 LYS CE C 42.184 . . 394 47 47 LYS N N 126.528 . . 395 48 48 MET H H 8.334 . . 396 48 48 MET HA H 5.195 . . 397 48 48 MET HB2 H 1.914 . . 398 48 48 MET HB3 H 2.110 . . 399 48 48 MET HG2 H 2.597 . . 400 48 48 MET HG3 H 2.622 . . 401 48 48 MET HE H 2.092 . . 402 48 48 MET CA C 54.747 . . 403 48 48 MET CB C 32.379 . . 404 48 48 MET CE C 16.994 . . 405 48 48 MET N N 122.645 . . 406 49 49 ASP H H 8.575 . . 407 49 49 ASP HA H 4.424 . . 408 49 49 ASP HB2 H 2.650 . . 409 49 49 ASP HB3 H 2.736 . . 410 49 49 ASP CA C 56.610 . . 411 49 49 ASP CB C 41.034 . . 412 49 49 ASP N N 123.713 . . 413 50 50 GLN H H 9.110 . . 414 50 50 GLN N N 117.540 . . 415 51 51 HIS H H 8.031 . . 416 51 51 HIS HA H 5.151 . . 417 51 51 HIS HB2 H 3.197 . . 418 51 51 HIS HB3 H 3.433 . . 419 51 51 HIS HD2 H 6.932 . . 420 51 51 HIS HE1 H 7.944 . . 421 51 51 HIS CA C 54.834 . . 422 52 52 ARG H H 7.685 . . 423 52 52 ARG HA H 5.237 . . 424 52 52 ARG HB2 H 2.057 . . 425 52 52 ARG HB3 H 2.088 . . 426 52 52 ARG HG3 H 1.767 . . 427 52 52 ARG HD3 H 2.862 . . 428 52 52 ARG CA C 55.055 . . 429 52 52 ARG CB C 33.054 . . 430 52 52 ARG N N 117.888 . . 431 53 53 GLY H H 7.529 . . 432 53 53 GLY HA2 H 4.009 . . 433 53 53 GLY HA3 H 4.302 . . 434 53 53 GLY CA C 45.708 . . 435 53 53 GLY N N 108.573 . . 436 54 54 PHE H H 8.287 . . 437 54 54 PHE HA H 5.995 . . 438 54 54 PHE HB2 H 3.039 . . 439 54 54 PHE HB3 H 3.126 . . 440 54 54 PHE HD1 H 7.195 . . 441 54 54 PHE HE1 H 7.357 . . 442 54 54 PHE HZ H 7.243 . . 443 54 54 PHE CA C 55.856 . . 444 54 54 PHE CB C 44.363 . . 445 54 54 PHE N N 113.146 . . 446 55 55 LEU H H 9.452 . . 447 55 55 LEU HA H 4.695 . . 448 55 55 LEU HB2 H 1.528 . . 449 55 55 LEU HB3 H 1.755 . . 450 55 55 LEU HG H 1.760 . . 451 55 55 LEU HD1 H 0.844 . . 452 55 55 LEU HD2 H 0.798 . . 453 55 55 LEU CA C 53.712 . . 454 55 55 LEU CB C 46.628 . . 455 55 55 LEU CD1 C 25.338 . . 456 55 55 LEU CD2 C 26.172 . . 457 55 55 LEU N N 119.389 . . 458 56 56 HIS H H 7.709 . . 459 56 56 HIS HA H 5.439 . . 460 56 56 HIS HB3 H 2.890 . . 461 56 56 HIS HD2 H 6.800 . . 462 56 56 HIS CA C 53.465 . . 463 56 56 HIS CB C 31.467 . . 464 56 56 HIS N N 114.176 . . 465 57 57 ASN H H 8.684 . . 466 57 57 ASN HA H 4.415 . . 467 57 57 ASN HB3 H 2.317 . . 468 57 57 ASN HD21 H 7.426 . . 469 57 57 ASN HD22 H 6.678 . . 470 57 57 ASN CA C 54.184 . . 471 57 57 ASN CB C 38.662 . . 472 57 57 ASN N N 116.522 . . 473 57 57 ASN ND2 N 111.475 . . 474 58 58 GLN H H 9.099 . . 475 58 58 GLN HA H 4.389 . . 476 58 58 GLN HB2 H 2.082 . . 477 58 58 GLN HB3 H 2.122 . . 478 58 58 GLN HG2 H 2.307 . . 479 58 58 GLN HG3 H 2.372 . . 480 58 58 GLN CA C 54.853 . . 481 58 58 GLN CB C 30.382 . . 482 58 58 GLN N N 122.850 . . 483 59 59 ALA HA H 4.300 . . 484 59 59 ALA HB H 1.409 . . 485 59 59 ALA CA C 52.504 . . 486 59 59 ALA CB C 19.421 . . 487 60 60 LYS H H 8.344 . . 488 60 60 LYS HA H 3.776 . . 489 60 60 LYS HB3 H 1.669 . . 490 60 60 LYS HG3 H 1.363 . . 491 60 60 LYS HD3 H 1.645 . . 492 60 60 LYS HE2 H 2.961 . . 493 60 60 LYS HZ H 6.599 . . 494 60 60 LYS CA C 56.301 . . 495 60 60 LYS CB C 32.816 . . 496 60 60 LYS CE C 42.023 . . 497 60 60 LYS N N 119.998 . . 498 61 61 ASN H H 8.643 . . 499 61 61 ASN HA H 4.455 . . 500 61 61 ASN HB3 H 2.590 . . 501 61 61 ASN CA C 52.904 . . 502 61 61 ASN CB C 38.537 . . 503 61 61 ASN N N 119.688 . . 504 62 62 LEU H H 8.873 . . 505 62 62 LEU HA H 3.934 . . 506 62 62 LEU HB2 H 1.569 . . 507 62 62 LEU HB3 H 1.660 . . 508 62 62 LEU HD1 H 0.900 . . 509 62 62 LEU HD2 H 0.720 . . 510 62 62 LEU CA C 57.245 . . 511 62 62 LEU CB C 40.943 . . 512 62 62 LEU CD1 C 24.986 . . 513 62 62 LEU CD2 C 22.869 . . 514 62 62 LEU N N 124.761 . . 515 63 63 LEU H H 8.145 . . 516 63 63 LEU HA H 4.199 . . 517 63 63 LEU HB2 H 1.658 . . 518 63 63 LEU HB3 H 1.827 . . 519 63 63 LEU HG H 1.690 . . 520 63 63 LEU HD1 H 0.937 . . 521 63 63 LEU HD2 H 0.882 . . 522 63 63 LEU CA C 57.077 . . 523 63 63 LEU CB C 41.257 . . 524 63 63 LEU CD1 C 24.737 . . 525 63 63 LEU CD2 C 23.471 . . 526 63 63 LEU N N 120.312 . . 527 64 64 CYS H H 7.376 . . 528 64 64 CYS HA H 4.171 . . 529 64 64 CYS HB3 H 2.894 . . 530 64 64 CYS CA C 57.784 . . 531 64 64 CYS CB C 28.718 . . 532 64 64 CYS N N 113.898 . . 533 65 65 GLY H H 7.789 . . 534 65 65 GLY HA2 H 3.655 . . 535 65 65 GLY HA3 H 3.945 . . 536 65 65 GLY CA C 45.983 . . 537 65 65 GLY N N 108.894 . . 538 66 66 PHE H H 7.699 . . 539 66 66 PHE HA H 3.917 . . 540 66 66 PHE HB3 H 2.915 . . 541 66 66 PHE CA C 55.940 . . 542 66 66 PHE CB C 40.268 . . 543 66 66 PHE N N 118.711 . . 544 67 67 TYR H H 8.568 . . 545 67 67 TYR HA H 4.300 . . 546 67 67 TYR HB2 H 2.814 . . 547 67 67 TYR HB3 H 3.162 . . 548 67 67 TYR HD2 H 7.091 . . 549 67 67 TYR HE2 H 6.777 . . 550 67 67 TYR CA C 58.764 . . 551 67 67 TYR CB C 38.153 . . 552 67 67 TYR CD2 C 132.874 . . 553 67 67 TYR CE2 C 118.275 . . 554 67 67 TYR N N 124.623 . . 555 69 69 ARG H H 8.313 . . 556 69 69 ARG CA C 57.057 . . 557 69 69 ARG CB C 32.296 . . 558 69 69 ARG N N 121.427 . . 559 70 70 HIS H H 9.182 . . 560 70 70 HIS HA H 4.782 . . 561 70 70 HIS CA C 56.716 . . 562 70 70 HIS CB C 31.776 . . 563 70 70 HIS N N 128.351 . . 564 71 71 ALA H H 8.968 . . 565 71 71 ALA HA H 3.357 . . 566 71 71 ALA HB H 1.008 . . 567 71 71 ALA CA C 55.782 . . 568 71 71 ALA CB C 18.010 . . 569 71 71 ALA N N 125.649 . . 570 72 72 GLU H H 12.692 . . 571 72 72 GLU HA H 2.977 . . 572 72 72 GLU HB2 H 1.801 . . 573 72 72 GLU HB3 H 2.472 . . 574 72 72 GLU CA C 60.956 . . 575 72 72 GLU CB C 28.006 . . 576 72 72 GLU N N 119.941 . . 577 73 73 LEU H H 6.637 . . 578 73 73 LEU HA H 3.585 . . 579 73 73 LEU HB2 H 1.723 . . 580 73 73 LEU HB3 H 1.924 . . 581 73 73 LEU HG H 0.985 . . 582 73 73 LEU HD1 H 0.801 . . 583 73 73 LEU HD2 H 0.793 . . 584 73 73 LEU CA C 56.661 . . 585 73 73 LEU CB C 39.245 . . 586 73 73 LEU CD2 C 26.617 . . 587 73 73 LEU N N 114.882 . . 588 74 74 ARG H H 7.556 . . 589 74 74 ARG HB3 H 1.906 . . 590 74 74 ARG CA C 59.042 . . 591 74 74 ARG CB C 29.175 . . 592 74 74 ARG N N 117.799 . . 593 75 75 PHE H H 8.233 . . 594 75 75 PHE HA H 3.561 . . 595 75 75 PHE HB2 H 2.317 . . 596 75 75 PHE HB3 H 3.036 . . 597 75 75 PHE HD2 H 6.589 . . 598 75 75 PHE HE2 H 6.524 . . 599 75 75 PHE HZ H 6.781 . . 600 75 75 PHE CA C 61.674 . . 601 75 75 PHE CB C 38.038 . . 602 75 75 PHE N N 119.783 . . 603 76 76 LEU H H 7.629 . . 604 76 76 LEU HA H 3.558 . . 605 76 76 LEU HB2 H 1.312 . . 606 76 76 LEU HB3 H 2.047 . . 607 76 76 LEU HG H 2.093 . . 608 76 76 LEU HD1 H 0.829 . . 609 76 76 LEU HD2 H 0.264 . . 610 76 76 LEU CA C 58.039 . . 611 76 76 LEU CB C 39.016 . . 612 76 76 LEU CG C 26.047 . . 613 76 76 LEU CD1 C 25.863 . . 614 76 76 LEU CD2 C 21.182 . . 615 76 76 LEU N N 119.526 . . 616 77 77 ASP H H 8.190 . . 617 77 77 ASP HA H 4.158 . . 618 77 77 ASP HB2 H 2.588 . . 619 77 77 ASP HB3 H 2.825 . . 620 77 77 ASP CA C 56.400 . . 621 77 77 ASP CB C 40.368 . . 622 77 77 ASP N N 118.215 . . 623 78 78 LEU H H 7.252 . . 624 78 78 LEU HA H 4.290 . . 625 78 78 LEU HB2 H 1.412 . . 626 78 78 LEU HB3 H 1.447 . . 627 78 78 LEU HG H 1.625 . . 628 78 78 LEU HD1 H 0.564 . . 629 78 78 LEU HD2 H 0.380 . . 630 78 78 LEU CA C 54.985 . . 631 78 78 LEU CB C 42.401 . . 632 78 78 LEU CG C 25.588 . . 633 78 78 LEU CD1 C 25.556 . . 634 78 78 LEU CD2 C 23.940 . . 635 78 78 LEU N N 117.496 . . 636 79 79 VAL H H 7.179 . . 637 79 79 VAL HA H 3.223 . . 638 79 79 VAL HB H 2.174 . . 639 79 79 VAL HG1 H 0.595 . . 640 79 79 VAL HG2 H 0.971 . . 641 79 79 VAL CA C 68.528 . . 642 79 79 VAL CB C 29.120 . . 643 79 79 VAL CG1 C 24.716 . . 644 79 79 VAL CG2 C 21.550 . . 645 79 79 VAL N N 120.915 . . 646 80 80 PRO HA H 3.975 . . 647 80 80 PRO HG3 H 1.831 . . 648 80 80 PRO HD3 H 3.597 . . 649 80 80 PRO CA C 66.787 . . 650 80 80 PRO CB C 29.808 . . 651 81 81 SER H H 7.828 . . 652 81 81 SER HA H 4.314 . . 653 81 81 SER HB3 H 4.011 . . 654 81 81 SER CA C 60.618 . . 655 81 81 SER CB C 63.450 . . 656 81 81 SER N N 112.727 . . 657 82 82 LEU H H 7.912 . . 658 82 82 LEU HA H 3.874 . . 659 82 82 LEU HB2 H 0.942 . . 660 82 82 LEU HG H 1.565 . . 661 82 82 LEU HD1 H 0.515 . . 662 82 82 LEU HD2 H 0.474 . . 663 82 82 LEU CA C 55.492 . . 664 82 82 LEU CB C 40.211 . . 665 82 82 LEU CG C 25.750 . . 666 82 82 LEU CD1 C 25.262 . . 667 82 82 LEU CD2 C 20.931 . . 668 82 82 LEU N N 120.918 . . 669 83 83 GLN H H 7.458 . . 670 83 83 GLN HA H 3.808 . . 671 83 83 GLN HB2 H 2.115 . . 672 83 83 GLN HB3 H 2.252 . . 673 83 83 GLN HG3 H 2.265 . . 674 83 83 GLN HE21 H 7.480 . . 675 83 83 GLN HE22 H 6.831 . . 676 83 83 GLN CA C 56.166 . . 677 83 83 GLN CB C 26.668 . . 678 83 83 GLN N N 111.397 . . 679 83 83 GLN NE2 N 112.027 . . 680 84 84 LEU H H 8.736 . . 681 84 84 LEU HA H 3.719 . . 682 84 84 LEU HB2 H 0.631 . . 683 84 84 LEU HB3 H 1.579 . . 684 84 84 LEU HG H 1.345 . . 685 84 84 LEU HD1 H 0.371 . . 686 84 84 LEU HD2 H -0.127 . . 687 84 84 LEU CA C 54.742 . . 688 84 84 LEU CB C 39.245 . . 689 84 84 LEU CG C 25.536 . . 690 84 84 LEU CD1 C 24.100 . . 691 84 84 LEU CD2 C 20.374 . . 692 84 84 LEU N N 118.520 . . 693 85 85 ASP H H 8.415 . . 694 85 85 ASP HA H 4.883 . . 695 85 85 ASP HB2 H 2.744 . . 696 85 85 ASP HB3 H 3.182 . . 697 85 85 ASP CA C 51.346 . . 698 85 85 ASP CB C 42.948 . . 699 85 85 ASP N N 126.187 . . 700 86 86 PRO HA H 3.928 . . 701 86 86 PRO HB3 H 1.837 . . 702 86 86 PRO HD2 H 3.707 . . 703 86 86 PRO HD3 H 3.946 . . 704 86 86 PRO CA C 63.638 . . 705 86 86 PRO CB C 31.286 . . 706 87 87 ALA H H 8.504 . . 707 87 87 ALA HA H 4.418 . . 708 87 87 ALA HB H 1.434 . . 709 87 87 ALA CA C 52.172 . . 710 87 87 ALA CB C 19.348 . . 711 87 87 ALA N N 121.030 . . 712 88 88 GLN H H 8.125 . . 713 88 88 GLN HA H 4.522 . . 714 88 88 GLN HB2 H 1.891 . . 715 88 88 GLN HB3 H 2.131 . . 716 88 88 GLN HG2 H 2.185 . . 717 88 88 GLN HG3 H 2.280 . . 718 88 88 GLN HE21 H 7.649 . . 719 88 88 GLN HE22 H 6.810 . . 720 88 88 GLN CA C 53.434 . . 721 88 88 GLN CB C 30.049 . . 722 88 88 GLN N N 119.601 . . 723 88 88 GLN NE2 N 112.740 . . 724 89 89 ILE H H 8.099 . . 725 89 89 ILE HA H 4.969 . . 726 89 89 ILE HB H 1.742 . . 727 89 89 ILE HG12 H 1.155 . . 728 89 89 ILE HG13 H 1.516 . . 729 89 89 ILE HG2 H 0.840 . . 730 89 89 ILE HD1 H 0.851 . . 731 89 89 ILE CA C 59.541 . . 732 89 89 ILE CB C 39.252 . . 733 89 89 ILE CG1 C 27.443 . . 734 89 89 ILE CG2 C 17.926 . . 735 89 89 ILE CD1 C 12.427 . . 736 89 89 ILE N N 118.195 . . 737 90 90 TYR H H 8.892 . . 738 90 90 TYR HA H 5.361 . . 739 90 90 TYR HB2 H 2.581 . . 740 90 90 TYR HB3 H 2.878 . . 741 90 90 TYR HD2 H 7.023 . . 742 90 90 TYR HE2 H 7.033 . . 743 90 90 TYR CA C 56.040 . . 744 90 90 TYR CB C 42.826 . . 745 90 90 TYR N N 122.421 . . 746 91 91 ARG H H 9.327 . . 747 91 91 ARG HA H 5.243 . . 748 91 91 ARG HB3 H 1.429 . . 749 91 91 ARG CA C 54.535 . . 750 91 91 ARG CB C 33.132 . . 751 91 91 ARG N N 121.043 . . 752 92 92 VAL H H 9.668 . . 753 92 92 VAL HA H 4.924 . . 754 92 92 VAL HB H 1.861 . . 755 92 92 VAL HG1 H 1.067 . . 756 92 92 VAL HG2 H 0.757 . . 757 92 92 VAL CA C 60.905 . . 758 92 92 VAL CB C 32.853 . . 759 92 92 VAL CG1 C 21.602 . . 760 92 92 VAL CG2 C 22.466 . . 761 92 92 VAL N N 132.287 . . 762 93 93 THR H H 9.381 . . 763 93 93 THR HA H 5.264 . . 764 93 93 THR HB H 4.030 . . 765 93 93 THR HG2 H 0.768 . . 766 93 93 THR CA C 61.616 . . 767 93 93 THR CB C 70.082 . . 768 93 93 THR N N 124.468 . . 769 94 94 TRP H H 9.071 . . 770 94 94 TRP HA H 5.666 . . 771 94 94 TRP HB2 H 2.739 . . 772 94 94 TRP HD1 H 6.467 . . 773 94 94 TRP HE1 H 5.544 . . 774 94 94 TRP HE3 H 7.133 . . 775 94 94 TRP HZ2 H 6.978 . . 776 94 94 TRP HZ3 H 6.976 . . 777 94 94 TRP HH2 H 6.825 . . 778 94 94 TRP CA C 52.205 . . 779 94 94 TRP CB C 33.668 . . 780 94 94 TRP N N 124.491 . . 781 94 94 TRP NE1 N 118.865 . . 782 95 95 PHE H H 9.578 . . 783 95 95 PHE HA H 5.670 . . 784 95 95 PHE HB3 H 2.950 . . 785 95 95 PHE HD1 H 6.921 . . 786 95 95 PHE HE1 H 6.828 . . 787 95 95 PHE CA C 56.774 . . 788 95 95 PHE CB C 39.449 . . 789 95 95 PHE N N 122.179 . . 790 96 96 ILE H H 9.816 . . 791 96 96 ILE HA H 5.973 . . 792 96 96 ILE HB H 1.600 . . 793 96 96 ILE HG12 H 0.890 . . 794 96 96 ILE HG13 H 1.912 . . 795 96 96 ILE HG2 H 1.044 . . 796 96 96 ILE HD1 H 0.809 . . 797 96 96 ILE CA C 58.427 . . 798 96 96 ILE CB C 45.073 . . 799 96 96 ILE CG1 C 29.008 . . 800 96 96 ILE CG2 C 13.963 . . 801 96 96 ILE CD1 C 14.896 . . 802 96 96 ILE N N 125.072 . . 803 97 97 SER H H 9.156 . . 804 97 97 SER HA H 3.623 . . 805 97 97 SER HB2 H 2.454 . . 806 97 97 SER HB3 H 4.029 . . 807 97 97 SER HG H 5.473 . . 808 97 97 SER CA C 61.750 . . 809 97 97 SER CB C 63.711 . . 810 97 97 SER N N 124.020 . . 811 98 98 TRP H H 6.619 . . 812 98 98 TRP HA H 5.339 . . 813 98 98 TRP HD1 H 7.686 . . 814 98 98 TRP HE1 H 10.302 . . 815 98 98 TRP HE3 H 6.392 . . 816 98 98 TRP HZ2 H 7.679 . . 817 98 98 TRP HZ3 H 6.224 . . 818 98 98 TRP HH2 H 6.680 . . 819 98 98 TRP CA C 54.671 . . 820 98 98 TRP CB C 34.751 . . 821 98 98 TRP N N 114.829 . . 822 98 98 TRP NE1 N 129.263 . . 823 99 99 SER H H 8.590 . . 824 99 99 SER HB3 H 3.731 . . 825 99 99 SER CA C 58.045 . . 826 99 99 SER CB C 61.927 . . 827 99 99 SER N N 115.444 . . 828 100 100 PRO CA C 61.925 . . 829 100 100 PRO CB C 34.796 . . 830 101 101 CYS H H 8.686 . . 831 101 101 CYS CA C 58.659 . . 832 101 101 CYS CB C 30.189 . . 833 101 101 CYS N N 121.768 . . 834 102 102 PHE H H 9.318 . . 835 102 102 PHE HD2 H 6.938 . . 836 102 102 PHE HE2 H 7.260 . . 837 102 102 PHE CA C 58.960 . . 838 102 102 PHE CB C 40.157 . . 839 102 102 PHE CD2 C 131.780 . . 840 102 102 PHE CE2 C 131.785 . . 841 102 102 PHE N N 115.031 . . 842 103 103 SER H H 10.858 . . 843 103 103 SER HA H 3.713 . . 844 103 103 SER HB2 H 4.101 . . 845 103 103 SER HB3 H 4.115 . . 846 103 103 SER CA C 63.368 . . 847 103 103 SER CB C 60.539 . . 848 103 103 SER N N 119.552 . . 849 104 104 TRP H H 7.880 . . 850 104 104 TRP HA H 3.776 . . 851 104 104 TRP HB3 H 3.180 . . 852 104 104 TRP HD1 H 7.274 . . 853 104 104 TRP HE1 H 10.233 . . 854 104 104 TRP HE3 H 6.380 . . 855 104 104 TRP HZ2 H 7.615 . . 856 104 104 TRP HH2 H 7.211 . . 857 104 104 TRP CA C 59.214 . . 858 104 104 TRP CB C 27.886 . . 859 104 104 TRP CD1 C 127.366 . . 860 104 104 TRP N N 117.909 . . 861 104 104 TRP NE1 N 130.528 . . 862 105 105 GLY H H 7.468 . . 863 105 105 GLY HA2 H 3.693 . . 864 105 105 GLY HA3 H 4.311 . . 865 105 105 GLY CA C 46.081 . . 866 105 105 GLY N N 106.359 . . 867 106 106 CYS H H 7.366 . . 868 106 106 CYS HA H 3.859 . . 869 106 106 CYS HB2 H 2.708 . . 870 106 106 CYS HB3 H 3.617 . . 871 106 106 CYS CA C 67.102 . . 872 106 106 CYS CB C 28.718 . . 873 106 106 CYS N N 120.359 . . 874 107 107 ALA H H 8.719 . . 875 107 107 ALA HA H 3.865 . . 876 107 107 ALA HB H 1.664 . . 877 107 107 ALA CA C 56.934 . . 878 107 107 ALA CB C 18.443 . . 879 107 107 ALA N N 119.725 . . 880 108 108 GLY H H 8.555 . . 881 108 108 GLY HA2 H 3.744 . . 882 108 108 GLY HA3 H 3.868 . . 883 108 108 GLY CA C 46.894 . . 884 108 108 GLY N N 103.829 . . 885 109 109 GLU H H 8.023 . . 886 109 109 GLU HA H 4.266 . . 887 109 109 GLU HB2 H 1.982 . . 888 109 109 GLU HB3 H 2.311 . . 889 109 109 GLU HG3 H 2.347 . . 890 109 109 GLU CA C 59.292 . . 891 109 109 GLU CB C 30.382 . . 892 109 109 GLU N N 123.162 . . 893 110 110 VAL H H 8.942 . . 894 110 110 VAL HA H 3.699 . . 895 110 110 VAL HB H 2.169 . . 896 110 110 VAL HG1 H 1.150 . . 897 110 110 VAL HG2 H 0.688 . . 898 110 110 VAL CA C 67.043 . . 899 110 110 VAL CB C 31.006 . . 900 110 110 VAL CG1 C 23.657 . . 901 110 110 VAL CG2 C 22.565 . . 902 110 110 VAL N N 121.866 . . 903 111 111 ARG H H 8.653 . . 904 111 111 ARG HA H 3.786 . . 905 111 111 ARG HB3 H 1.708 . . 906 111 111 ARG CA C 60.081 . . 907 111 111 ARG CB C 29.175 . . 908 111 111 ARG N N 120.587 . . 909 112 112 ALA H H 7.875 . . 910 112 112 ALA HA H 4.134 . . 911 112 112 ALA HB H 1.541 . . 912 112 112 ALA CA C 55.418 . . 913 112 112 ALA CB C 17.991 . . 914 112 112 ALA N N 120.687 . . 915 113 113 PHE H H 8.139 . . 916 113 113 PHE HA H 4.337 . . 917 113 113 PHE HB2 H 3.446 . . 918 113 113 PHE HB3 H 3.706 . . 919 113 113 PHE HD1 H 7.235 . . 920 113 113 PHE HE1 H 7.141 . . 921 113 113 PHE HZ H 6.980 . . 922 113 113 PHE CA C 61.376 . . 923 113 113 PHE CB C 39.387 . . 924 113 113 PHE N N 118.950 . . 925 114 114 LEU H H 8.639 . . 926 114 114 LEU HA H 3.800 . . 927 114 114 LEU HB2 H 1.547 . . 928 114 114 LEU HB3 H 1.583 . . 929 114 114 LEU HG H 1.739 . . 930 114 114 LEU HD1 H 0.745 . . 931 114 114 LEU HD2 H 0.802 . . 932 114 114 LEU CA C 57.133 . . 933 114 114 LEU CB C 40.909 . . 934 114 114 LEU CD1 C 25.558 . . 935 114 114 LEU CD2 C 21.182 . . 936 114 114 LEU N N 120.595 . . 937 115 115 GLN H H 8.167 . . 938 115 115 GLN HA H 4.023 . . 939 115 115 GLN HB2 H 2.083 . . 940 115 115 GLN HB3 H 2.295 . . 941 115 115 GLN HG2 H 2.405 . . 942 115 115 GLN HG3 H 2.604 . . 943 115 115 GLN HE21 H 7.526 . . 944 115 115 GLN HE22 H 6.753 . . 945 115 115 GLN CA C 58.386 . . 946 115 115 GLN CB C 28.538 . . 947 115 115 GLN CG C 34.441 . . 948 115 115 GLN N N 117.666 . . 949 115 115 GLN NE2 N 110.955 . . 950 116 116 GLU H H 7.448 . . 951 116 116 GLU HA H 4.322 . . 952 116 116 GLU HB2 H 1.952 . . 953 116 116 GLU HB3 H 2.049 . . 954 116 116 GLU HG2 H 2.304 . . 955 116 116 GLU HG3 H 2.407 . . 956 116 116 GLU CA C 57.062 . . 957 116 116 GLU CB C 30.715 . . 958 116 116 GLU CG C 36.292 . . 959 116 116 GLU N N 115.380 . . 960 117 117 ASN H H 7.632 . . 961 117 117 ASN HA H 5.065 . . 962 117 117 ASN HB2 H 1.955 . . 963 117 117 ASN HB3 H 2.041 . . 964 117 117 ASN CA C 52.185 . . 965 117 117 ASN CB C 38.246 . . 966 117 117 ASN N N 119.831 . . 967 118 118 THR H H 8.054 . . 968 118 118 THR HA H 4.317 . . 969 118 118 THR HB H 4.549 . . 970 118 118 THR HG2 H 1.329 . . 971 118 118 THR CA C 64.081 . . 972 118 118 THR CB C 68.767 . . 973 118 118 THR CG2 C 22.096 . . 974 118 118 THR N N 111.041 . . 975 119 119 HIS H H 9.248 . . 976 119 119 HIS HA H 4.289 . . 977 119 119 HIS HD2 H 8.184 . . 978 119 119 HIS HE1 H 7.626 . . 979 119 119 HIS CA C 56.601 . . 980 119 119 HIS CB C 30.320 . . 981 119 119 HIS N N 120.403 . . 982 120 120 VAL H H 7.379 . . 983 120 120 VAL HA H 4.526 . . 984 120 120 VAL HB H 1.817 . . 985 120 120 VAL HG1 H 0.733 . . 986 120 120 VAL HG2 H 0.227 . . 987 120 120 VAL CA C 61.890 . . 988 120 120 VAL CB C 32.995 . . 989 120 120 VAL CG1 C 21.684 . . 990 120 120 VAL CG2 C 20.957 . . 991 120 120 VAL N N 120.001 . . 992 121 121 ARG H H 8.775 . . 993 121 121 ARG HA H 4.810 . . 994 121 121 ARG HB2 H 1.626 . . 995 121 121 ARG HB3 H 1.828 . . 996 121 121 ARG HD3 H 3.094 . . 997 121 121 ARG CA C 53.067 . . 998 121 121 ARG CB C 30.580 . . 999 121 121 ARG N N 125.312 . . 1000 122 122 LEU H H 9.345 . . 1001 122 122 LEU HA H 5.160 . . 1002 122 122 LEU HB2 H 0.761 . . 1003 122 122 LEU HB3 H 1.533 . . 1004 122 122 LEU HG H 0.678 . . 1005 122 122 LEU HD1 H -0.095 . . 1006 122 122 LEU HD2 H -0.479 . . 1007 122 122 LEU CA C 53.301 . . 1008 122 122 LEU CB C 46.672 . . 1009 122 122 LEU CG C 27.452 . . 1010 122 122 LEU CD1 C 26.583 . . 1011 122 122 LEU CD2 C 21.360 . . 1012 122 122 LEU N N 125.483 . . 1013 123 123 ARG H H 9.053 . . 1014 123 123 ARG HA H 4.736 . . 1015 123 123 ARG HB2 H 1.647 . . 1016 123 123 ARG CA C 54.167 . . 1017 123 123 ARG CB C 32.812 . . 1018 123 123 ARG N N 127.748 . . 1019 124 124 ILE H H 9.019 . . 1020 124 124 ILE HA H 4.442 . . 1021 124 124 ILE HB H 1.733 . . 1022 124 124 ILE HG13 H 1.230 . . 1023 124 124 ILE HG2 H 0.928 . . 1024 124 124 ILE HD1 H 0.649 . . 1025 124 124 ILE CA C 60.759 . . 1026 124 124 ILE CB C 41.893 . . 1027 124 124 ILE CG1 C 26.634 . . 1028 124 124 ILE CG2 C 17.107 . . 1029 124 124 ILE CD1 C 14.960 . . 1030 124 124 ILE N N 123.665 . . 1031 125 125 PHE H H 9.359 . . 1032 125 125 PHE HA H 5.165 . . 1033 125 125 PHE HB2 H 3.041 . . 1034 125 125 PHE HB3 H 3.258 . . 1035 125 125 PHE HD2 H 6.618 . . 1036 125 125 PHE HE2 H 7.055 . . 1037 125 125 PHE HZ H 7.196 . . 1038 125 125 PHE CA C 55.914 . . 1039 125 125 PHE CB C 40.819 . . 1040 125 125 PHE CD2 C 132.156 . . 1041 125 125 PHE CE2 C 131.000 . . 1042 125 125 PHE N N 126.320 . . 1043 126 126 ALA H H 9.091 . . 1044 126 126 ALA HA H 5.816 . . 1045 126 126 ALA HB H 1.223 . . 1046 126 126 ALA CA C 48.870 . . 1047 126 126 ALA CB C 20.334 . . 1048 126 126 ALA N N 124.526 . . 1049 127 127 ALA H H 9.049 . . 1050 127 127 ALA HA H 4.751 . . 1051 127 127 ALA HB H 1.916 . . 1052 127 127 ALA CA C 55.468 . . 1053 127 127 ALA CB C 19.605 . . 1054 127 127 ALA N N 126.272 . . 1055 128 128 ARG H H 6.741 . . 1056 128 128 ARG CA C 54.414 . . 1057 128 128 ARG CB C 37.206 . . 1058 128 128 ARG N N 108.570 . . 1059 129 129 ILE H H 8.340 . . 1060 129 129 ILE HA H 4.291 . . 1061 129 129 ILE HB H 1.776 . . 1062 129 129 ILE HG12 H 1.799 . . 1063 129 129 ILE HG13 H 2.121 . . 1064 129 129 ILE HG2 H 0.759 . . 1065 129 129 ILE HD1 H 1.019 . . 1066 129 129 ILE CA C 60.867 . . 1067 129 129 ILE CB C 38.829 . . 1068 129 129 ILE CG2 C 18.768 . . 1069 129 129 ILE CD1 C 13.232 . . 1070 129 129 ILE N N 121.285 . . 1071 130 130 TYR H H 8.870 . . 1072 130 130 TYR HA H 5.335 . . 1073 130 130 TYR HB3 H 3.383 . . 1074 130 130 TYR HD1 H 7.435 . . 1075 130 130 TYR CA C 56.926 . . 1076 130 130 TYR CB C 38.163 . . 1077 130 130 TYR N N 130.143 . . 1078 131 131 ASP H H 8.123 . . 1079 131 131 ASP HA H 3.667 . . 1080 131 131 ASP HB3 H 2.325 . . 1081 131 131 ASP CA C 54.713 . . 1082 131 131 ASP CB C 38.901 . . 1083 131 131 ASP N N 123.662 . . 1084 132 132 TYR H H 6.448 . . 1085 132 132 TYR HA H 3.915 . . 1086 132 132 TYR HB3 H 3.263 . . 1087 132 132 TYR HD2 H 6.683 . . 1088 132 132 TYR CA C 59.468 . . 1089 132 132 TYR CB C 39.037 . . 1090 132 132 TYR N N 116.852 . . 1091 133 133 ASP H H 7.005 . . 1092 133 133 ASP HB3 H 2.852 . . 1093 133 133 ASP CA C 50.165 . . 1094 133 133 ASP CB C 42.782 . . 1095 133 133 ASP N N 116.930 . . 1096 134 134 PRO HA H 4.103 . . 1097 134 134 PRO HD3 H 3.224 . . 1098 134 134 PRO CA C 63.701 . . 1099 134 134 PRO CB C 32.090 . . 1100 135 135 LEU H H 8.456 . . 1101 135 135 LEU HA H 4.698 . . 1102 135 135 LEU HB3 H 1.891 . . 1103 135 135 LEU HG H 1.346 . . 1104 135 135 LEU HD1 H 0.790 . . 1105 135 135 LEU HD2 H 0.549 . . 1106 135 135 LEU CA C 54.381 . . 1107 135 135 LEU CB C 39.744 . . 1108 135 135 LEU CG C 27.896 . . 1109 135 135 LEU CD1 C 25.833 . . 1110 135 135 LEU CD2 C 23.050 . . 1111 135 135 LEU N N 120.252 . . 1112 136 136 TYR H H 8.028 . . 1113 136 136 TYR HA H 4.061 . . 1114 136 136 TYR HB3 H 2.612 . . 1115 136 136 TYR HE2 H 6.761 . . 1116 136 136 TYR CA C 61.058 . . 1117 136 136 TYR CB C 37.580 . . 1118 136 136 TYR N N 117.432 . . 1119 137 137 LYS H H 7.503 . . 1120 137 137 LYS HB3 H 1.389 . . 1121 137 137 LYS CA C 60.299 . . 1122 137 137 LYS CB C 30.798 . . 1123 137 137 LYS N N 122.000 . . 1124 138 138 GLU H H 8.752 . . 1125 138 138 GLU CA C 59.841 . . 1126 138 138 GLU CB C 27.469 . . 1127 138 138 GLU N N 121.833 . . 1128 139 139 ALA H H 7.682 . . 1129 139 139 ALA HA H 3.846 . . 1130 139 139 ALA HB H 1.711 . . 1131 139 139 ALA CA C 55.140 . . 1132 139 139 ALA CB C 20.255 . . 1133 139 139 ALA N N 119.592 . . 1134 140 140 LEU H H 7.175 . . 1135 140 140 LEU HB2 H 1.320 . . 1136 140 140 LEU HG H 2.320 . . 1137 140 140 LEU HD1 H 1.121 . . 1138 140 140 LEU HD2 H 1.002 . . 1139 140 140 LEU CA C 58.193 . . 1140 140 140 LEU CB C 41.095 . . 1141 140 140 LEU CG C 26.785 . . 1142 140 140 LEU CD1 C 26.305 . . 1143 140 140 LEU CD2 C 22.987 . . 1144 140 140 LEU N N 116.268 . . 1145 141 141 GLN H H 8.322 . . 1146 141 141 GLN HA H 3.719 . . 1147 141 141 GLN HB3 H 2.077 . . 1148 141 141 GLN HG2 H 2.259 . . 1149 141 141 GLN HG3 H 2.396 . . 1150 141 141 GLN HE21 H 7.389 . . 1151 141 141 GLN HE22 H 6.752 . . 1152 141 141 GLN CA C 59.051 . . 1153 141 141 GLN CB C 27.594 . . 1154 141 141 GLN N N 117.550 . . 1155 141 141 GLN NE2 N 109.124 . . 1156 142 142 MET H H 8.241 . . 1157 142 142 MET HA H 4.135 . . 1158 142 142 MET HB3 H 2.123 . . 1159 142 142 MET HG3 H 2.439 . . 1160 142 142 MET CA C 59.051 . . 1161 142 142 MET CB C 33.170 . . 1162 142 142 MET N N 118.520 . . 1163 143 143 LEU H H 7.932 . . 1164 143 143 LEU HA H 4.292 . . 1165 143 143 LEU HB3 H 1.975 . . 1166 143 143 LEU HG H 2.124 . . 1167 143 143 LEU HD1 H 0.810 . . 1168 143 143 LEU HD2 H 0.734 . . 1169 143 143 LEU CA C 58.115 . . 1170 143 143 LEU CB C 41.377 . . 1171 143 143 LEU CD1 C 25.528 . . 1172 143 143 LEU CD2 C 22.429 . . 1173 143 143 LEU N N 118.659 . . 1174 144 144 ARG H H 7.968 . . 1175 144 144 ARG HA H 4.426 . . 1176 144 144 ARG HB2 H 1.908 . . 1177 144 144 ARG HB3 H 2.116 . . 1178 144 144 ARG HG3 H 1.585 . . 1179 144 144 ARG CA C 58.989 . . 1180 144 144 ARG CB C 28.108 . . 1181 144 144 ARG N N 121.294 . . 1182 145 145 ASP H H 8.868 . . 1183 145 145 ASP HA H 4.429 . . 1184 145 145 ASP HB2 H 2.741 . . 1185 145 145 ASP HB3 H 2.866 . . 1186 145 145 ASP CA C 56.578 . . 1187 145 145 ASP CB C 39.590 . . 1188 145 145 ASP N N 122.553 . . 1189 146 146 ALA H H 7.737 . . 1190 146 146 ALA HA H 4.418 . . 1191 146 146 ALA HB H 1.576 . . 1192 146 146 ALA CA C 52.034 . . 1193 146 146 ALA CB C 19.295 . . 1194 146 146 ALA N N 120.102 . . 1195 147 147 GLY H H 7.966 . . 1196 147 147 GLY HA2 H 3.722 . . 1197 147 147 GLY HA3 H 4.382 . . 1198 147 147 GLY CA C 44.864 . . 1199 147 147 GLY N N 105.039 . . 1200 148 148 ALA H H 8.051 . . 1201 148 148 ALA HA H 4.689 . . 1202 148 148 ALA HB H 0.867 . . 1203 148 148 ALA CA C 51.459 . . 1204 148 148 ALA CB C 18.479 . . 1205 148 148 ALA N N 124.181 . . 1206 149 149 GLN H H 7.953 . . 1207 149 149 GLN HA H 4.439 . . 1208 149 149 GLN HB2 H 1.852 . . 1209 149 149 GLN HB3 H 1.884 . . 1210 149 149 GLN HG2 H 2.114 . . 1211 149 149 GLN HG3 H 2.323 . . 1212 149 149 GLN HE21 H 7.393 . . 1213 149 149 GLN HE22 H 6.763 . . 1214 149 149 GLN CA C 54.955 . . 1215 149 149 GLN CB C 29.421 . . 1216 149 149 GLN N N 122.185 . . 1217 149 149 GLN NE2 N 111.641 . . 1218 150 150 VAL H H 8.658 . . 1219 150 150 VAL HA H 4.752 . . 1220 150 150 VAL HB H 1.933 . . 1221 150 150 VAL HG1 H 0.874 . . 1222 150 150 VAL HG2 H 0.785 . . 1223 150 150 VAL CA C 61.439 . . 1224 150 150 VAL CB C 33.178 . . 1225 150 150 VAL CG1 C 21.495 . . 1226 150 150 VAL CG2 C 20.772 . . 1227 150 150 VAL N N 127.399 . . 1228 151 151 SER H H 8.737 . . 1229 151 151 SER HA H 5.179 . . 1230 151 151 SER HB2 H 3.251 . . 1231 151 151 SER HB3 H 3.834 . . 1232 151 151 SER CA C 56.981 . . 1233 151 151 SER CB C 66.538 . . 1234 151 151 SER N N 120.616 . . 1235 152 152 ILE H H 8.672 . . 1236 152 152 ILE HA H 5.147 . . 1237 152 152 ILE HB H 2.225 . . 1238 152 152 ILE HG12 H 1.222 . . 1239 152 152 ILE HG13 H 1.888 . . 1240 152 152 ILE HG2 H 1.414 . . 1241 152 152 ILE HD1 H 0.768 . . 1242 152 152 ILE CA C 56.518 . . 1243 152 152 ILE CB C 37.080 . . 1244 152 152 ILE CG2 C 18.263 . . 1245 152 152 ILE CD1 C 8.297 . . 1246 152 152 ILE N N 123.180 . . 1247 153 153 MET H H 8.314 . . 1248 153 153 MET HA H 3.886 . . 1249 153 153 MET HB3 H 1.561 . . 1250 153 153 MET HG3 H 2.098 . . 1251 153 153 MET HE H 1.530 . . 1252 153 153 MET CA C 59.053 . . 1253 153 153 MET CB C 34.793 . . 1254 153 153 MET CE C 17.742 . . 1255 153 153 MET N N 123.477 . . 1256 154 154 THR H H 9.630 . . 1257 154 154 THR HA H 4.951 . . 1258 154 154 THR HB H 4.647 . . 1259 154 154 THR HG2 H 1.425 . . 1260 154 154 THR CA C 60.436 . . 1261 154 154 THR CB C 72.370 . . 1262 154 154 THR N N 117.621 . . 1263 155 155 TYR H H 9.769 . . 1264 155 155 TYR HA H 4.099 . . 1265 155 155 TYR HB2 H 3.047 . . 1266 155 155 TYR HD1 H 7.163 . . 1267 155 155 TYR HE1 H 6.698 . . 1268 155 155 TYR CA C 64.439 . . 1269 155 155 TYR CB C 39.286 . . 1270 155 155 TYR CD1 C 133.545 . . 1271 155 155 TYR CE1 C 117.901 . . 1272 155 155 TYR N N 121.751 . . 1273 156 156 ASP H H 8.230 . . 1274 156 156 ASP HA H 4.108 . . 1275 156 156 ASP HB2 H 2.318 . . 1276 156 156 ASP HB3 H 2.508 . . 1277 156 156 ASP CA C 58.260 . . 1278 156 156 ASP CB C 40.618 . . 1279 156 156 ASP N N 115.555 . . 1280 157 157 GLU H H 7.470 . . 1281 157 157 GLU HA H 3.870 . . 1282 157 157 GLU HB2 H 1.446 . . 1283 157 157 GLU HB3 H 1.508 . . 1284 157 157 GLU HG2 H 2.088 . . 1285 157 157 GLU HG3 H 2.143 . . 1286 157 157 GLU CA C 60.507 . . 1287 157 157 GLU CB C 31.048 . . 1288 157 157 GLU N N 117.678 . . 1289 158 158 PHE H H 8.077 . . 1290 158 158 PHE HA H 3.829 . . 1291 158 158 PHE HB3 H 2.806 . . 1292 158 158 PHE HD1 H 7.091 . . 1293 158 158 PHE HE1 H 7.138 . . 1294 158 158 PHE CA C 62.776 . . 1295 158 158 PHE CB C 39.907 . . 1296 158 158 PHE N N 119.869 . . 1297 159 159 LYS H H 8.273 . . 1298 159 159 LYS HA H 3.917 . . 1299 159 159 LYS HB2 H 1.259 . . 1300 159 159 LYS HB3 H 1.417 . . 1301 159 159 LYS CA C 59.231 . . 1302 159 159 LYS CB C 31.963 . . 1303 159 159 LYS N N 118.859 . . 1304 160 160 HIS H H 7.695 . . 1305 160 160 HIS HA H 4.159 . . 1306 160 160 HIS HB2 H 2.873 . . 1307 160 160 HIS HB3 H 3.159 . . 1308 160 160 HIS HD2 H 6.340 . . 1309 160 160 HIS HE1 H 8.299 . . 1310 160 160 HIS CA C 59.981 . . 1311 160 160 HIS CB C 27.930 . . 1312 160 160 HIS N N 115.889 . . 1313 161 161 CYS H H 7.885 . . 1314 161 161 CYS HA H 3.789 . . 1315 161 161 CYS HB2 H 2.579 . . 1316 161 161 CYS HB3 H 2.631 . . 1317 161 161 CYS HG H 1.522 . . 1318 161 161 CYS CA C 63.794 . . 1319 161 161 CYS CB C 27.886 . . 1320 161 161 CYS N N 118.188 . . 1321 162 162 TRP H H 8.040 . . 1322 162 162 TRP HA H 3.764 . . 1323 162 162 TRP HB2 H 2.992 . . 1324 162 162 TRP HB3 H 3.173 . . 1325 162 162 TRP HD1 H 7.397 . . 1326 162 162 TRP HE1 H 10.204 . . 1327 162 162 TRP HE3 H 7.326 . . 1328 162 162 TRP HZ2 H 7.251 . . 1329 162 162 TRP HZ3 H 7.056 . . 1330 162 162 TRP HH2 H 7.188 . . 1331 162 162 TRP CA C 59.717 . . 1332 162 162 TRP CB C 28.593 . . 1333 162 162 TRP N N 122.741 . . 1334 162 162 TRP NE1 N 132.469 . . 1335 163 163 ASP H H 8.319 . . 1336 163 163 ASP HA H 4.126 . . 1337 163 163 ASP HB3 H 2.498 . . 1338 163 163 ASP CA C 56.929 . . 1339 163 163 ASP CB C 40.535 . . 1340 163 163 ASP N N 113.796 . . 1341 164 164 THR H H 7.494 . . 1342 164 164 THR HA H 3.803 . . 1343 164 164 THR HB H 2.999 . . 1344 164 164 THR HG2 H 0.196 . . 1345 164 164 THR CA C 65.164 . . 1346 164 164 THR CB C 70.171 . . 1347 164 164 THR CG2 C 20.097 . . 1348 164 164 THR N N 112.008 . . 1349 165 165 PHE H H 8.235 . . 1350 165 165 PHE HA H 4.535 . . 1351 165 165 PHE HB3 H 3.077 . . 1352 165 165 PHE HD1 H 7.249 . . 1353 165 165 PHE HE1 H 7.214 . . 1354 165 165 PHE HZ H 7.347 . . 1355 165 165 PHE CA C 57.969 . . 1356 165 165 PHE CB C 40.368 . . 1357 165 165 PHE N N 115.079 . . 1358 166 166 VAL H H 6.838 . . 1359 166 166 VAL HA H 4.025 . . 1360 166 166 VAL HB H 1.900 . . 1361 166 166 VAL HG1 H 0.131 . . 1362 166 166 VAL HG2 H -0.341 . . 1363 166 166 VAL CA C 61.001 . . 1364 166 166 VAL CB C 31.355 . . 1365 166 166 VAL CG1 C 23.606 . . 1366 166 166 VAL CG2 C 20.026 . . 1367 166 166 VAL N N 118.432 . . 1368 167 167 ASP H H 8.498 . . 1369 167 167 ASP HA H 3.848 . . 1370 167 167 ASP HB3 H 2.747 . . 1371 167 167 ASP CA C 51.630 . . 1372 167 167 ASP CB C 38.080 . . 1373 167 167 ASP N N 126.263 . . 1374 168 168 HIS H H 6.977 . . 1375 168 168 HIS HA H 4.346 . . 1376 168 168 HIS HB3 H 2.353 . . 1377 168 168 HIS HD2 H 7.663 . . 1378 168 168 HIS CA C 56.575 . . 1379 168 168 HIS CB C 32.462 . . 1380 168 168 HIS N N 119.890 . . 1381 169 169 GLN H H 9.126 . . 1382 169 169 GLN HA H 3.723 . . 1383 169 169 GLN HB2 H 2.058 . . 1384 169 169 GLN HB3 H 2.222 . . 1385 169 169 GLN HG2 H 2.079 . . 1386 169 169 GLN HG3 H 2.213 . . 1387 169 169 GLN HE21 H 7.865 . . 1388 169 169 GLN HE22 H 6.678 . . 1389 169 169 GLN CA C 56.770 . . 1390 169 169 GLN CB C 26.521 . . 1391 169 169 GLN CG C 33.836 . . 1392 169 169 GLN N N 119.254 . . 1393 169 169 GLN NE2 N 114.628 . . 1394 170 170 GLY H H 11.556 . . 1395 170 170 GLY HA2 H 3.702 . . 1396 170 170 GLY HA3 H 4.341 . . 1397 170 170 GLY CA C 44.824 . . 1398 170 170 GLY N N 111.911 . . 1399 171 171 CYS H H 8.044 . . 1400 171 171 CYS HA H 4.716 . . 1401 171 171 CYS HB2 H 3.163 . . 1402 171 171 CYS HB3 H 3.359 . . 1403 171 171 CYS CA C 57.785 . . 1404 171 171 CYS CB C 27.904 . . 1405 171 171 CYS N N 123.390 . . 1406 172 172 PRO HA H 4.618 . . 1407 172 172 PRO HB2 H 1.752 . . 1408 172 172 PRO HB3 H 2.250 . . 1409 172 172 PRO CA C 61.858 . . 1410 172 172 PRO CB C 32.529 . . 1411 173 173 PHE H H 8.842 . . 1412 173 173 PHE HA H 2.656 . . 1413 173 173 PHE HB2 H 2.311 . . 1414 173 173 PHE HB3 H 2.334 . . 1415 173 173 PHE HD1 H 6.347 . . 1416 173 173 PHE HE1 H 6.775 . . 1417 173 173 PHE HZ H 5.995 . . 1418 173 173 PHE CA C 57.541 . . 1419 173 173 PHE CB C 38.746 . . 1420 173 173 PHE N N 121.101 . . 1421 174 174 GLN H H 7.250 . . 1422 174 174 GLN HA H 4.317 . . 1423 174 174 GLN HB2 H 1.520 . . 1424 174 174 GLN HB3 H 1.563 . . 1425 174 174 GLN HG2 H 1.992 . . 1426 174 174 GLN HG3 H 2.011 . . 1427 174 174 GLN HE21 H 7.332 . . 1428 174 174 GLN HE22 H 6.808 . . 1429 174 174 GLN CA C 50.795 . . 1430 174 174 GLN CB C 29.097 . . 1431 174 174 GLN CG C 33.111 . . 1432 174 174 GLN N N 129.493 . . 1433 174 174 GLN NE2 N 112.507 . . 1434 175 175 PRO HA H 2.914 . . 1435 175 175 PRO HB2 H 1.646 . . 1436 175 175 PRO HB3 H 1.719 . . 1437 175 175 PRO HG2 H 1.823 . . 1438 175 175 PRO HG3 H 1.862 . . 1439 175 175 PRO HD3 H 3.523 . . 1440 175 175 PRO CA C 62.423 . . 1441 176 176 TRP H H 5.591 . . 1442 176 176 TRP HA H 4.633 . . 1443 176 176 TRP HB2 H 3.283 . . 1444 176 176 TRP HB3 H 3.422 . . 1445 176 176 TRP HD1 H 7.032 . . 1446 176 176 TRP HE1 H 10.022 . . 1447 176 176 TRP HE3 H 7.654 . . 1448 176 176 TRP HZ2 H 6.165 . . 1449 176 176 TRP HZ3 H 7.086 . . 1450 176 176 TRP HH2 H 6.331 . . 1451 176 176 TRP CA C 55.162 . . 1452 176 176 TRP CB C 28.889 . . 1453 176 176 TRP N N 118.133 . . 1454 176 176 TRP NE1 N 128.845 . . 1455 177 177 ASP H H 8.848 . . 1456 177 177 ASP HA H 4.397 . . 1457 177 177 ASP HB2 H 2.649 . . 1458 177 177 ASP HB3 H 2.682 . . 1459 177 177 ASP CA C 56.172 . . 1460 177 177 ASP CB C 40.675 . . 1461 177 177 ASP N N 121.814 . . 1462 178 178 GLY H H 8.987 . . 1463 178 178 GLY HA2 H 3.997 . . 1464 178 178 GLY HA3 H 4.411 . . 1465 178 178 GLY CA C 45.666 . . 1466 178 178 GLY N N 111.875 . . 1467 179 179 LEU H H 7.148 . . 1468 179 179 LEU HA H 4.488 . . 1469 179 179 LEU HB3 H 1.275 . . 1470 179 179 LEU HG H -0.199 . . 1471 179 179 LEU HD1 H 1.124 . . 1472 179 179 LEU HD2 H 1.667 . . 1473 179 179 LEU CA C 60.782 . . 1474 179 179 LEU CB C 42.229 . . 1475 179 179 LEU CG C 27.960 . . 1476 179 179 LEU CD1 C 23.253 . . 1477 179 179 LEU N N 121.470 . . 1478 180 180 ASP H H 8.874 . . 1479 180 180 ASP HA H 4.492 . . 1480 180 180 ASP HB2 H 2.652 . . 1481 180 180 ASP HB3 H 2.693 . . 1482 180 180 ASP CA C 57.939 . . 1483 180 180 ASP CB C 40.713 . . 1484 180 180 ASP N N 119.476 . . 1485 181 181 GLU H H 8.712 . . 1486 181 181 GLU HA H 4.012 . . 1487 181 181 GLU HB2 H 1.860 . . 1488 181 181 GLU HB3 H 2.050 . . 1489 181 181 GLU HG2 H 2.266 . . 1490 181 181 GLU HG3 H 2.316 . . 1491 181 181 GLU CA C 59.969 . . 1492 181 181 GLU CB C 28.926 . . 1493 181 181 GLU CG C 36.665 . . 1494 181 181 GLU N N 122.379 . . 1495 182 182 HIS H H 8.854 . . 1496 182 182 HIS HA H 4.754 . . 1497 182 182 HIS HB2 H 3.017 . . 1498 182 182 HIS HB3 H 3.336 . . 1499 182 182 HIS HD2 H 7.131 . . 1500 182 182 HIS CA C 59.029 . . 1501 182 182 HIS CB C 28.848 . . 1502 182 182 HIS N N 118.572 . . 1503 183 183 SER H H 8.665 . . 1504 183 183 SER HA H 4.554 . . 1505 183 183 SER HB3 H 3.979 . . 1506 183 183 SER CA C 63.604 . . 1507 183 183 SER CB C 65.216 . . 1508 183 183 SER N N 116.329 . . 1509 184 184 GLN H H 8.714 . . 1510 184 184 GLN HA H 4.247 . . 1511 184 184 GLN HB3 H 2.285 . . 1512 184 184 GLN HG2 H 2.531 . . 1513 184 184 GLN HG3 H 2.644 . . 1514 184 184 GLN HE21 H 7.563 . . 1515 184 184 GLN HE22 H 6.904 . . 1516 184 184 GLN CA C 58.960 . . 1517 184 184 GLN CB C 28.935 . . 1518 184 184 GLN CG C 34.074 . . 1519 184 184 GLN N N 122.215 . . 1520 184 184 GLN NE2 N 111.721 . . 1521 185 185 ALA H H 8.258 . . 1522 185 185 ALA HA H 4.284 . . 1523 185 185 ALA HB H 1.726 . . 1524 185 185 ALA CA C 55.469 . . 1525 185 185 ALA CB C 18.374 . . 1526 185 185 ALA N N 124.432 . . 1527 186 186 LEU H H 8.953 . . 1528 186 186 LEU HA H 4.212 . . 1529 186 186 LEU HB2 H 2.258 . . 1530 186 186 LEU HG H 2.274 . . 1531 186 186 LEU HD1 H 1.415 . . 1532 186 186 LEU HD2 H 1.195 . . 1533 186 186 LEU CA C 58.216 . . 1534 186 186 LEU CB C 42.764 . . 1535 186 186 LEU CD1 C 27.135 . . 1536 186 186 LEU CD2 C 24.302 . . 1537 186 186 LEU N N 119.941 . . 1538 187 187 SER H H 8.935 . . 1539 187 187 SER HA H 4.039 . . 1540 187 187 SER HB2 H 4.301 . . 1541 187 187 SER HB3 H 4.284 . . 1542 187 187 SER CA C 63.302 . . 1543 187 187 SER CB C 62.760 . . 1544 187 187 SER N N 116.987 . . 1545 188 188 GLY H H 8.228 . . 1546 188 188 GLY HA2 H 4.147 . . 1547 188 188 GLY HA3 H 4.198 . . 1548 188 188 GLY CA C 47.154 . . 1549 188 188 GLY N N 110.215 . . 1550 189 189 ARG H H 7.838 . . 1551 189 189 ARG HA H 4.237 . . 1552 189 189 ARG HB3 H 2.081 . . 1553 189 189 ARG HG3 H 1.790 . . 1554 189 189 ARG CA C 59.559 . . 1555 189 189 ARG CB C 30.395 . . 1556 189 189 ARG N N 122.994 . . 1557 190 190 LEU H H 8.791 . . 1558 190 190 LEU HA H 4.238 . . 1559 190 190 LEU HD1 H 0.999 . . 1560 190 190 LEU HD2 H 0.980 . . 1561 190 190 LEU CA C 58.219 . . 1562 190 190 LEU CB C 41.242 . . 1563 190 190 LEU CD1 C 26.342 . . 1564 190 190 LEU CD2 C 25.400 . . 1565 190 190 LEU N N 119.765 . . 1566 191 191 ARG H H 8.305 . . 1567 191 191 ARG HA H 4.043 . . 1568 191 191 ARG HB2 H 1.969 . . 1569 191 191 ARG HB3 H 2.037 . . 1570 191 191 ARG HG2 H 1.643 . . 1571 191 191 ARG HG3 H 1.871 . . 1572 191 191 ARG HD2 H 3.277 . . 1573 191 191 ARG HD3 H 3.302 . . 1574 191 191 ARG CA C 59.782 . . 1575 191 191 ARG CB C 30.191 . . 1576 191 191 ARG CG C 27.697 . . 1577 191 191 ARG N N 118.427 . . 1578 192 192 ALA H H 7.414 . . 1579 192 192 ALA HA H 4.217 . . 1580 192 192 ALA HB H 1.593 . . 1581 192 192 ALA CA C 54.716 . . 1582 192 192 ALA CB C 18.165 . . 1583 192 192 ALA N N 119.414 . . 1584 193 193 ILE H H 7.896 . . 1585 193 193 ILE HA H 3.770 . . 1586 193 193 ILE HB H 2.120 . . 1587 193 193 ILE HG12 H 2.130 . . 1588 193 193 ILE HG13 H 2.169 . . 1589 193 193 ILE HG2 H 0.962 . . 1590 193 193 ILE HD1 H 1.081 . . 1591 193 193 ILE CA C 64.838 . . 1592 193 193 ILE CB C 39.446 . . 1593 193 193 ILE CG1 C 29.482 . . 1594 193 193 ILE CG2 C 17.748 . . 1595 193 193 ILE CD1 C 15.453 . . 1596 193 193 ILE N N 118.949 . . 1597 194 194 LEU H H 8.296 . . 1598 194 194 LEU HA H 4.273 . . 1599 194 194 LEU HB2 H 1.586 . . 1600 194 194 LEU HB3 H 1.878 . . 1601 194 194 LEU HD1 H 0.959 . . 1602 194 194 LEU HD2 H 0.725 . . 1603 194 194 LEU CA C 55.713 . . 1604 194 194 LEU CB C 40.471 . . 1605 194 194 LEU CD1 C 26.082 . . 1606 194 194 LEU CD2 C 22.252 . . 1607 194 194 LEU N N 116.435 . . 1608 195 195 GLN H H 7.921 . . 1609 195 195 GLN HA H 4.335 . . 1610 195 195 GLN HB3 H 2.193 . . 1611 195 195 GLN HG3 H 2.468 . . 1612 195 195 GLN HE21 H 7.526 . . 1613 195 195 GLN HE22 H 6.860 . . 1614 195 195 GLN CA C 56.417 . . 1615 195 195 GLN CB C 28.598 . . 1616 195 195 GLN CG C 34.134 . . 1617 195 195 GLN N N 118.580 . . 1618 195 195 GLN NE2 N 111.785 . . 1619 196 196 ASN H H 8.078 . . 1620 196 196 ASN HA H 4.702 . . 1621 196 196 ASN HB2 H 2.820 . . 1622 196 196 ASN HB3 H 2.883 . . 1623 196 196 ASN HD21 H 7.629 . . 1624 196 196 ASN HD22 H 6.927 . . 1625 196 196 ASN CA C 53.450 . . 1626 196 196 ASN CB C 38.825 . . 1627 196 196 ASN N N 118.941 . . 1628 196 196 ASN ND2 N 112.870 . . 1629 197 197 GLN H H 8.526 . . 1630 197 197 GLN HA H 4.356 . . 1631 197 197 GLN HB2 H 1.993 . . 1632 197 197 GLN HB3 H 2.185 . . 1633 197 197 GLN HG3 H 2.389 . . 1634 197 197 GLN HE21 H 7.517 . . 1635 197 197 GLN HE22 H 6.862 . . 1636 197 197 GLN CA C 56.166 . . 1637 197 197 GLN CB C 29.496 . . 1638 197 197 GLN CG C 33.897 . . 1639 197 197 GLN N N 120.984 . . 1640 197 197 GLN NE2 N 112.143 . . 1641 198 198 GLY H H 8.467 . . 1642 198 198 GLY HA2 H 3.936 . . 1643 198 198 GLY HA3 H 3.961 . . 1644 198 198 GLY CA C 45.384 . . 1645 198 198 GLY N N 109.565 . . 1646 199 199 ASN H H 8.361 . . 1647 199 199 ASN HA H 4.725 . . 1648 199 199 ASN HB2 H 2.754 . . 1649 199 199 ASN HB3 H 2.828 . . 1650 199 199 ASN HD21 H 7.607 . . 1651 199 199 ASN HD22 H 6.941 . . 1652 199 199 ASN CA C 53.359 . . 1653 199 199 ASN CB C 38.907 . . 1654 199 199 ASN N N 118.615 . . 1655 199 199 ASN ND2 N 112.888 . . stop_ save_