data_4716 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 15N, and 13C NMR Backbone Assignments and Secondary Structure of the C-terminal Recombinant Fragment of Auxilin Including the J-domain ; _BMRB_accession_number 4716 _BMRB_flat_file_name bmr4716.str _Entry_type original _Submission_date 2000-04-11 _Accession_date 2000-04-17 _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 Han Chae J . 2 Gruschus James M . 3 Greener Tsvika . . 4 Greene Lois E . 5 Ferretti James . . 6 Eisenberg Evan . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 567 "13C chemical shifts" 361 "15N chemical shifts" 154 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2000-07-24 original author . stop_ _Original_release_date 2000-07-24 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Letter to the Editor: 1H, 15N, and 13C NMR backbone assignments and secondary structure of the C-terminal recombinant fragment of auxilin including the J-domain ; _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 Han Chae J . 2 Gruschus James M . 3 Greener Tsvika . . 4 Greene Lois E . 5 Ferretti James . . 6 Eisenberg Evan . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 17 _Journal_issue 3 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 281 _Page_last 282 _Year 2000 _Details . loop_ _Keyword Auxilin J-domain stop_ save_ ################################## # Molecular system description # ################################## save_system_auxilin _Saveframe_category molecular_system _Mol_system_name auxilin _Abbreviation_common auxilin _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label auxilin $auxilin stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' loop_ _Biological_function endocytosis 'molecular chaperone' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_auxilin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common auxilin _Abbreviation_common auxilin _Molecular_mass 20563 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 182 _Mol_residue_sequence ; GPLGSPEFSMPHSSPQNRPN YNVSFSSMPGGQNERGKAAA NLEGKQKAADFEDLLSGQGF NAHKDKKGPRTIAEMRKEEM AKEMDPEKLKILEWIEGKER NIRALLSTMHTVLWAGETKW KPVGMADLVTPEQVKKVYRK AVLVVHPDKATGQPYEQYAK MIFMELNDAWSEFENQGQKP LY ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 PRO 3 LEU 4 GLY 5 SER 6 PRO 7 GLU 8 PHE 9 SER 10 MET 11 PRO 12 HIS 13 SER 14 SER 15 PRO 16 GLN 17 ASN 18 ARG 19 PRO 20 ASN 21 TYR 22 ASN 23 VAL 24 SER 25 PHE 26 SER 27 SER 28 MET 29 PRO 30 GLY 31 GLY 32 GLN 33 ASN 34 GLU 35 ARG 36 GLY 37 LYS 38 ALA 39 ALA 40 ALA 41 ASN 42 LEU 43 GLU 44 GLY 45 LYS 46 GLN 47 LYS 48 ALA 49 ALA 50 ASP 51 PHE 52 GLU 53 ASP 54 LEU 55 LEU 56 SER 57 GLY 58 GLN 59 GLY 60 PHE 61 ASN 62 ALA 63 HIS 64 LYS 65 ASP 66 LYS 67 LYS 68 GLY 69 PRO 70 ARG 71 THR 72 ILE 73 ALA 74 GLU 75 MET 76 ARG 77 LYS 78 GLU 79 GLU 80 MET 81 ALA 82 LYS 83 GLU 84 MET 85 ASP 86 PRO 87 GLU 88 LYS 89 LEU 90 LYS 91 ILE 92 LEU 93 GLU 94 TRP 95 ILE 96 GLU 97 GLY 98 LYS 99 GLU 100 ARG 101 ASN 102 ILE 103 ARG 104 ALA 105 LEU 106 LEU 107 SER 108 THR 109 MET 110 HIS 111 THR 112 VAL 113 LEU 114 TRP 115 ALA 116 GLY 117 GLU 118 THR 119 LYS 120 TRP 121 LYS 122 PRO 123 VAL 124 GLY 125 MET 126 ALA 127 ASP 128 LEU 129 VAL 130 THR 131 PRO 132 GLU 133 GLN 134 VAL 135 LYS 136 LYS 137 VAL 138 TYR 139 ARG 140 LYS 141 ALA 142 VAL 143 LEU 144 VAL 145 VAL 146 HIS 147 PRO 148 ASP 149 LYS 150 ALA 151 THR 152 GLY 153 GLN 154 PRO 155 TYR 156 GLU 157 GLN 158 TYR 159 ALA 160 LYS 161 MET 162 ILE 163 PHE 164 MET 165 GLU 166 LEU 167 ASN 168 ASP 169 ALA 170 TRP 171 SER 172 GLU 173 PHE 174 GLU 175 ASN 176 GLN 177 GLY 178 GLN 179 LYS 180 PRO 181 LEU 182 TYR stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-14 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 1N4C "Nmr Structure Of The J-Domain And Clathrin Substrate Binding Domain Of Bovine Auxilin" 99.45 182 100.00 100.00 9.06e-130 PDB 1XI5 "Clathrin D6 Coat With Auxilin J-Domain" 62.64 114 100.00 100.00 2.17e-76 PDB 2QWN "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-386aa)r171c And Bovine Auxilin (810-910aa)d876c In T" 51.65 94 98.94 98.94 2.82e-60 PDB 2QWO "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" 50.55 92 98.91 98.91 1.21e-58 PDB 2QWP "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" 50.55 92 98.91 98.91 1.21e-58 PDB 2QWQ "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" 50.55 92 98.91 98.91 1.21e-58 PDB 2QWR "Crystal Structure Of Disulfide-Bond-Crosslinked Complex Of Bovine Hsc70 (1-394aa)r171c And Bovine Auxilin (810-910aa)d876c In T" 50.55 92 98.91 98.91 1.21e-58 DBJ BAA32318 "KIAA0473 protein [Homo sapiens]" 95.60 937 97.70 99.43 2.32e-114 DBJ BAG11195 "DnaJ homolog, subfamily C, member 6 [synthetic construct]" 95.60 913 97.70 99.43 1.61e-114 DBJ BAH12344 "unnamed protein product [Homo sapiens]" 95.60 900 97.70 99.43 1.35e-114 GB AAA79037 "auxilin [Bos taurus]" 97.25 910 98.87 99.44 1.65e-117 GB AAI09280 "DNAJC6 protein [Homo sapiens]" 95.60 970 97.70 99.43 2.68e-114 GB AAI09281 "DNAJC6 protein [Homo sapiens]" 95.60 970 97.70 99.43 2.68e-114 GB AIC59549 "DNAJC6, partial [synthetic construct]" 95.60 970 97.70 99.43 2.68e-114 GB EAX06533 "DnaJ (Hsp40) homolog, subfamily C, member 6, isoform CRA_a [Homo sapiens]" 95.60 913 97.70 99.43 1.61e-114 REF NP_001243793 "putative tyrosine-protein phosphatase auxilin isoform 1 [Homo sapiens]" 95.60 970 97.70 99.43 2.68e-114 REF NP_001243794 "putative tyrosine-protein phosphatase auxilin isoform 3 [Homo sapiens]" 95.60 900 97.70 99.43 1.48e-114 REF NP_055602 "putative tyrosine-protein phosphatase auxilin isoform 2 [Homo sapiens]" 95.60 913 97.70 99.43 1.61e-114 REF NP_777261 "putative tyrosine-protein phosphatase auxilin [Bos taurus]" 97.25 910 98.87 99.44 1.65e-117 REF XP_001089936 "PREDICTED: putative tyrosine-protein phosphatase auxilin isoform 2 [Macaca mulatta]" 95.60 900 97.70 99.43 1.50e-114 SP O75061 "RecName: Full=Putative tyrosine-protein phosphatase auxilin; AltName: Full=DnaJ homolog subfamily C member 6" 95.60 913 97.70 99.43 1.61e-114 SP Q27974 "RecName: Full=Putative tyrosine-protein phosphatase auxilin; AltName: Full=DnaJ homolog subfamily C member 6" 97.25 910 98.87 99.44 1.65e-117 TPG DAA31275 "TPA: DnaJ (Hsp40) homolog, subfamily C, member 6 [Bos taurus]" 97.25 910 98.87 99.44 1.65e-117 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $auxilin cow 9913 Eukaryota Metazoa Bos taurus 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 $auxilin 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_auxilin_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $auxilin . mM 1.0 2.0 . stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_15N-HSQC_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-HSQC NOESY' _Sample_label . save_ save_15N-HSQC_TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-HSQC TOCSY' _Sample_label . save_ save_CBCACONH_3 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _Sample_label . save_ save_CBCANH_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCANH _Sample_label . save_ save_NMR_spec_expt__0_1 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-HSQC NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_2 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-HSQC TOCSY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCANH _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_condition_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.0 0.2 n/a temperature 298 1 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 H 1 'methyl protons' ppm 0.00 internal direct cylindrical internal parallel_to_Bo . DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 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_ _Sample_label $auxilin_1 stop_ _Sample_conditions_label $condition_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name auxilin _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 . 2 PRO CA C 62.3 0.2 1 2 . 2 PRO CB C 32.5 0.2 1 3 . 3 LEU H H 8.50 0.01 1 4 . 3 LEU CA C 55.5 0.2 1 5 . 3 LEU CB C 42.1 0.2 1 6 . 3 LEU N N 123.6 0.2 1 7 . 4 GLY H H 8.38 0.01 1 8 . 4 GLY CA C 45.1 0.2 1 9 . 4 GLY N N 110.6 0.2 1 10 . 5 SER H H 8.10 0.01 1 11 . 5 SER CA C 56.4 0.2 1 12 . 5 SER CB C 63.4 0.2 1 13 . 5 SER N N 117.8 0.2 1 14 . 7 GLU CA C 57.1 0.2 1 15 . 7 GLU CB C 30.2 0.2 1 16 . 8 PHE H H 8.09 0.01 1 17 . 8 PHE CA C 57.7 0.2 1 18 . 8 PHE CB C 39.6 0.2 1 19 . 8 PHE N N 121.3 0.2 1 20 . 9 SER H H 8.18 0.01 1 21 . 9 SER CA C 58.2 0.2 1 22 . 9 SER CB C 63.9 0.2 1 23 . 9 SER N N 117.3 0.2 1 24 . 10 MET H H 8.25 0.01 1 25 . 10 MET CA C 53.5 0.2 1 26 . 10 MET CB C 32.5 0.2 1 27 . 10 MET N N 124.0 0.2 1 28 . 11 PRO CA C 63.7 0.2 1 29 . 11 PRO CB C 32.0 0.2 1 30 . 12 HIS H H 8.39 0.02 1 31 . 12 HIS CA C 56.0 0.2 1 32 . 12 HIS CB C 29.3 0.2 1 33 . 12 HIS N N 119.9 0.2 1 34 . 13 SER H H 8.15 0.01 1 35 . 13 SER CA C 58.3 0.2 1 36 . 13 SER CB C 63.7 0.2 1 37 . 13 SER N N 117.6 0.2 1 38 . 14 SER H H 8.21 0.01 1 39 . 14 SER CA C 58.2 0.2 1 40 . 14 SER CB C 63.8 0.2 1 41 . 14 SER N N 118.4 0.2 1 42 . 16 GLN CA C 56.3 0.2 1 43 . 16 GLN CB C 29.4 0.2 1 44 . 17 ASN H H 8.50 0.01 1 45 . 17 ASN CA C 53.5 0.2 1 46 . 17 ASN CB C 38.9 0.2 1 47 . 17 ASN N N 120.0 0.2 1 48 . 18 ARG H H 8.39 0.01 1 49 . 18 ARG CA C 57.0 0.2 1 50 . 18 ARG CB C 30.0 0.2 1 51 . 18 ARG N N 122.4 0.2 1 52 . 19 PRO CA C 63.2 0.2 1 53 . 19 PRO CB C 32.0 0.2 1 54 . 20 ASN H H 8.41 0.01 1 55 . 20 ASN CA C 53.0 0.2 1 56 . 20 ASN CB C 38.7 0.2 1 57 . 20 ASN N N 119.1 0.2 1 58 . 26 SER CA C 58.2 0.2 1 59 . 26 SER CB C 64.1 0.2 1 60 . 27 SER H H 8.38 0.01 1 61 . 27 SER CA C 56.5 0.2 1 62 . 27 SER CB C 63.5 0.2 1 63 . 27 SER N N 119.8 0.2 1 64 . 29 PRO CA C 63.6 0.2 1 65 . 29 PRO CB C 32.0 0.2 1 66 . 30 GLY H H 8.55 0.01 1 67 . 30 GLY CA C 45.4 0.2 1 68 . 30 GLY N N 110.9 0.2 1 69 . 31 GLY H H 8.30 0.01 1 70 . 31 GLY CA C 45.3 0.2 1 71 . 31 GLY N N 109.5 0.2 1 72 . 32 GLN H H 8.38 0.01 1 73 . 32 GLN CA C 56.2 0.2 1 74 . 32 GLN CB C 29.3 0.2 1 75 . 32 GLN N N 120.6 0.2 1 76 . 34 GLU H H 8.13 0.01 1 77 . 34 GLU CA C 54.0 0.2 1 78 . 34 GLU CB C 30.3 0.2 1 79 . 34 GLU N N 122.9 0.2 1 80 . 35 ARG CA C 57.0 0.2 1 81 . 35 ARG CB C 30.6 0.2 1 82 . 36 GLY H H 8.39 0.2 1 83 . 36 GLY HA2 H 3.91 0.03 1 84 . 36 GLY HA3 H 3.91 0.03 1 85 . 36 GLY CA C 45.4 0.2 1 86 . 36 GLY N N 110.2 0.2 1 87 . 37 LYS H H 8.07 0.01 1 88 . 37 LYS HA H 4.14 0.01 1 89 . 37 LYS CA C 56.4 0.2 1 90 . 37 LYS CB C 33.1 0.2 1 91 . 37 LYS N N 121.8 0.2 1 92 . 38 ALA H H 8.27 0.01 1 93 . 38 ALA HA H 4.26 0.02 1 94 . 38 ALA HB H 1.40 0.02 1 95 . 38 ALA CA C 52.7 0.2 1 96 . 38 ALA CB C 19.3 0.2 1 97 . 38 ALA N N 125.8 0.2 1 98 . 39 ALA CA C 52.7 0.2 1 99 . 39 ALA CB C 20.8 0.2 1 100 . 40 ALA H H 8.19 0.01 1 101 . 40 ALA HA H 4.25 0.02 1 102 . 40 ALA HB H 1.37 0.02 1 103 . 40 ALA CA C 52.6 0.2 1 104 . 40 ALA CB C 19.3 0.2 1 105 . 40 ALA N N 124.0 0.2 1 106 . 41 ASN H H 8.30 0.01 1 107 . 41 ASN CA C 53.2 0.2 1 108 . 41 ASN CB C 38.7 0.2 1 109 . 41 ASN N N 118.1 0.2 1 110 . 42 LEU HA H 4.28 0.03 1 111 . 42 LEU CA C 55.5 0.2 1 112 . 42 LEU CB C 42.3 0.2 1 113 . 43 GLU H H 8.32 0.01 1 114 . 43 GLU HA H 4.20 0.02 1 115 . 43 GLU HB2 H 1.98 0.02 1 116 . 43 GLU HB3 H 2.09 0.02 1 117 . 43 GLU HG2 H 2.28 0.02 1 118 . 43 GLU CA C 57.1 0.2 1 119 . 43 GLU CB C 30.1 0.2 1 120 . 43 GLU N N 121.6 0.2 1 121 . 44 GLY H H 8.35 0.01 1 122 . 44 GLY HA2 H 3.91 0.02 1 123 . 44 GLY HA3 H 3.91 0.02 1 124 . 44 GLY CA C 45.5 0.2 1 125 . 44 GLY N N 110.4 0.2 1 126 . 46 GLN CA C 56.0 0.2 1 127 . 46 GLN CB C 29.6 0.2 1 128 . 47 LYS H H 8.35 0.01 1 129 . 47 LYS CA C 56.2 0.2 1 130 . 47 LYS CB C 33.2 0.2 1 131 . 47 LYS N N 123.8 0.2 1 132 . 48 ALA H H 8.38 0.01 1 133 . 48 ALA HA H 4.25 0.02 1 134 . 48 ALA HB H 1.39 0.02 1 135 . 48 ALA CA C 52.7 0.2 1 136 . 48 ALA CB C 19.5 0.2 1 137 . 48 ALA N N 126.9 0.2 1 138 . 49 ALA H H 8.30 0.01 1 139 . 49 ALA HA H 4.24 0.02 1 140 . 49 ALA HB H 1.32 0.02 1 141 . 49 ALA CA C 52.7 0.2 1 142 . 49 ALA CB C 19.4 0.2 1 143 . 49 ALA N N 124.0 0.2 1 144 . 50 ASP H H 8.19 0.01 1 145 . 50 ASP HA H 4.49 0.02 1 146 . 50 ASP HB2 H 2.56 0.02 2 147 . 50 ASP CA C 54.5 0.2 1 148 . 50 ASP CB C 41.1 0.2 1 149 . 50 ASP N N 120.0 0.2 1 150 . 51 PHE H H 8.02 0.01 1 151 . 51 PHE HA H 4.52 0.02 1 152 . 51 PHE HB2 H 3.10 0.03 2 153 . 51 PHE HD1 H 7.21 0.02 2 154 . 51 PHE CA C 58.3 0.2 1 155 . 51 PHE CB C 39.5 0.2 1 156 . 51 PHE N N 120.7 0.2 1 157 . 52 GLU H H 8.22 0.01 1 158 . 52 GLU HA H 4.13 0.02 1 159 . 52 GLU HB2 H 1.94 0.03 2 160 . 52 GLU HB3 H 2.16 0.03 2 161 . 52 GLU CA C 57.1 0.2 1 162 . 52 GLU CB C 30.4 0.2 1 163 . 52 GLU N N 122.7 0.2 1 164 . 53 ASP H H 8.25 0.01 1 165 . 53 ASP HA H 4.52 0.02 1 166 . 53 ASP HB2 H 2.59 0.02 2 167 . 53 ASP HB3 H 2.71 0.02 2 168 . 53 ASP CA C 54.6 0.2 1 169 . 53 ASP CB C 41.1 0.2 1 170 . 53 ASP N N 122.2 0.2 1 171 . 54 LEU H H 8.16 0.01 1 172 . 54 LEU HA H 4.23 0.02 1 173 . 54 LEU HB2 H 1.64 0.03 2 174 . 54 LEU CA C 56.0 0.2 1 175 . 54 LEU CB C 42.1 0.2 1 176 . 54 LEU N N 123.6 0.2 1 177 . 55 LEU H H 8.14 0.01 1 178 . 55 LEU HA H 4.27 0.02 1 179 . 55 LEU HB2 H 1.57 0.02 2 180 . 55 LEU HB3 H 1.69 0.02 2 181 . 55 LEU CA C 55.7 0.2 1 182 . 55 LEU CB C 42.0 0.2 1 183 . 55 LEU N N 121.6 0.2 1 184 . 56 SER H H 8.05 0.01 1 185 . 56 SER HA H 3.88 0.02 4 186 . 56 SER HB2 H 4.04 0.02 4 187 . 56 SER CA C 59.0 0.2 1 188 . 56 SER CB C 63.7 0.2 1 189 . 56 SER N N 116.2 0.2 1 190 . 57 GLY H H 8.32 0.01 1 191 . 57 GLY HA2 H 3.95 0.03 1 192 . 57 GLY HA3 H 3.95 0.03 1 193 . 57 GLY CA C 45.6 0.2 1 194 . 57 GLY N N 111.3 0.2 1 195 . 58 GLN H H 8.16 0.01 1 196 . 58 GLN CA C 56.0 0.2 1 197 . 58 GLN CB C 29.5 0.2 1 198 . 58 GLN N N 120.2 0.2 1 199 . 59 GLY H H 8.40 0.01 1 200 . 59 GLY HA2 H 3.88 0.02 1 201 . 59 GLY HA3 H 3.88 0.02 1 202 . 59 GLY CA C 45.4 0.2 1 203 . 59 GLY N N 110.2 0.2 1 204 . 60 PHE H H 8.12 0.01 1 205 . 60 PHE HB2 H 3.08 0.03 2 206 . 60 PHE CA C 58.1 0.2 1 207 . 60 PHE CB C 39.5 0.2 1 208 . 60 PHE N N 121.1 0.2 1 209 . 61 ASN CA C 53.2 0.2 1 210 . 61 ASN CB C 39.0 0.2 1 211 . 62 ALA H H 8.09 0.01 1 212 . 62 ALA HA H 4.15 0.02 1 213 . 62 ALA HB H 1.28 0.02 1 214 . 62 ALA CA C 52.9 0.2 1 215 . 62 ALA CB C 19.5 0.2 1 216 . 62 ALA N N 125.1 0.2 1 217 . 63 HIS H H 8.17 0.01 1 218 . 63 HIS HA H 4.53 0.02 1 219 . 63 HIS HB2 H 3.06 0.02 2 220 . 63 HIS CA C 56.3 0.2 1 221 . 63 HIS CB C 30.5 0.2 1 222 . 63 HIS N N 118.9 0.2 1 223 . 64 LYS H H 8.37 0.01 1 224 . 64 LYS HA H 4.26 0.02 1 225 . 64 LYS CA C 56.7 0.2 1 226 . 64 LYS CB C 30.4 0.2 1 227 . 64 LYS N N 122.7 0.2 1 228 . 65 ASP HA H 4.56 0.02 1 229 . 65 ASP HB2 H 2.56 0.02 2 230 . 65 ASP CA C 54.6 0.2 1 231 . 65 ASP CB C 41.4 0.2 1 232 . 66 LYS H H 8.15 0.01 1 233 . 66 LYS HA H 4.26 0.02 1 234 . 66 LYS HB2 H 1.70 0.02 2 235 . 66 LYS HB3 H 1.72 0.02 2 236 . 66 LYS CA C 56.4 0.02 1 237 . 66 LYS CB C 32.9 0.02 1 238 . 66 LYS N N 122.4 0.2 1 239 . 67 LYS H H 8.34 0.01 1 240 . 67 LYS HA H 4.31 0.02 1 241 . 67 LYS HB2 H 1.71 0.02 2 242 . 67 LYS HB3 H 1.85 0.02 2 243 . 67 LYS CA C 56.3 0.2 1 244 . 67 LYS CB C 33.1 0.2 1 245 . 67 LYS N N 123.1 0.2 1 246 . 68 GLY H H 8.24 0.01 1 247 . 68 GLY HA2 H 4.00 0.02 2 248 . 68 GLY HA3 H 4.12 0.02 2 249 . 68 GLY CA C 44.6 0.2 1 250 . 68 GLY N N 110.9 0.2 1 251 . 69 PRO HA H 4.41 0.02 1 252 . 69 PRO HD2 H 3.61 0.02 1 253 . 69 PRO HD3 H 3.80 0.02 1 254 . 69 PRO CA C 63.4 0.2 1 255 . 69 PRO CB C 32.5 0.2 1 256 . 70 ARG H H 8.50 0.01 1 257 . 70 ARG HA H 4.42 0.02 1 258 . 70 ARG CA C 56.1 0.2 1 259 . 70 ARG CB C 31.4 0.2 1 260 . 70 ARG N N 122.2 0.2 1 261 . 71 THR H H 8.27 0.01 1 262 . 71 THR HA H 4.40 0.02 1 263 . 71 THR HB H 4.41 0.02 1 264 . 71 THR HG2 H 1.23 0.02 1 265 . 71 THR CA C 61.3 0.2 1 266 . 71 THR CB C 70.6 0.2 1 267 . 71 THR N N 115.3 0.2 1 268 . 72 ILE H H 8.46 0.01 1 269 . 72 ILE HA H 4.40 0.02 1 270 . 72 ILE HB H 1.87 0.02 2 271 . 72 ILE HG12 H 1.51 0.02 2 272 . 72 ILE HG13 H 1.25 0.02 2 273 . 72 ILE HG2 H 0.90 0.02 1 274 . 72 ILE CA C 61.3 0.2 1 275 . 72 ILE CB C 37.9 0.2 1 276 . 72 ILE N N 123.3 0.2 1 277 . 73 ALA H H 8.29 0.01 1 278 . 73 ALA HA H 4.14 0.02 1 279 . 73 ALA HB H 1.39 0.02 1 280 . 73 ALA CA C 54.3 0.2 1 281 . 73 ALA CB C 18.9 0.2 1 282 . 73 ALA N N 125.1 0.2 1 283 . 74 GLU H H 7.98 0.01 1 284 . 74 GLU HA H 4.09 0.02 1 285 . 74 GLU HB2 H 2.11 0.02 2 286 . 74 GLU HB3 H 2.02 0.02 2 287 . 74 GLU HG2 H 2.28 0.02 2 288 . 74 GLU CA C 58.0 0.2 1 289 . 74 GLU CB C 30.1 0.2 1 290 . 74 GLU N N 119.8 0.2 1 291 . 75 MET H H 8.24 0.01 1 292 . 75 MET HA H 4.24 0.02 1 293 . 75 MET HB2 H 2.11 0.02 2 294 . 75 MET HG2 H 2.63 0.02 1 295 . 75 MET CA C 57.6 0.2 1 296 . 75 MET CB C 32.7 0.2 1 297 . 75 MET N N 121.6 0.2 1 298 . 76 ARG H H 8.36 0.02 1 299 . 76 ARG HA H 4.21 0.02 1 300 . 76 ARG HB2 H 1.85 0.02 2 301 . 76 ARG HG2 H 1.72 0.02 2 302 . 76 ARG CA C 57.8 0.2 1 303 . 76 ARG CB C 30.3 0.2 1 304 . 76 ARG N N 121.8 0.2 1 305 . 77 LYS H H 8.04 0.01 1 306 . 77 LYS HA H 4.10 0.02 1 307 . 77 LYS HB2 H 1.86 0.02 2 308 . 77 LYS HG2 H 1.44 0.03 2 309 . 77 LYS HG3 H 1.52 0.03 2 310 . 77 LYS HD2 H 1.67 0.02 2 311 . 77 LYS CA C 58.5 0.2 1 312 . 77 LYS CB C 32.6 0.2 1 313 . 77 LYS N N 122.0 0.2 1 314 . 78 GLU H H 8.20 0.01 1 315 . 78 GLU HA H 4.14 0.02 1 316 . 78 GLU HB2 H 1.86 0.02 2 317 . 78 GLU HB3 H 2.06 0.02 2 318 . 78 GLU HG2 H 2.26 0.02 2 319 . 78 GLU HG3 H 2.32 0.02 2 320 . 78 GLU CA C 58.2 0.2 1 321 . 78 GLU CB C 29.8 0.2 1 322 . 78 GLU N N 121.3 0.2 1 323 . 79 GLU H H 8.16 0.01 1 324 . 79 GLU HA H 4.14 0.02 1 325 . 79 GLU HB2 H 1.86 0.02 2 326 . 79 GLU HB3 H 2.06 0.02 2 327 . 79 GLU HG2 H 2.29 0.03 2 328 . 79 GLU CA C 58.0 0.2 1 329 . 79 GLU CB C 29.9 0.2 1 330 . 79 GLU N N 121.1 0.2 1 331 . 80 MET H H 8.18 0.01 1 332 . 80 MET HA H 4.24 0.02 1 333 . 80 MET HB2 H 2.09 0.03 2 334 . 80 MET HG2 H 2.54 0.02 2 335 . 80 MET HG3 H 2.67 0.02 2 336 . 80 MET CA C 57.2 0.2 1 337 . 80 MET CB C 33.0 0.2 1 338 . 80 MET N N 120.2 0.2 1 339 . 81 ALA H H 7.92 0.01 1 340 . 81 ALA HA H 4.24 0.02 1 341 . 81 ALA HB H 1.44 0.02 1 342 . 81 ALA CA C 53.3 0.2 1 343 . 81 ALA CB C 19.0 0.2 1 344 . 81 ALA N N 123.3 0.2 1 345 . 82 LYS H H 7.77 0.01 1 346 . 82 LYS HA H 4.26 0.02 1 347 . 82 LYS HB2 H 1.84 0.02 2 348 . 82 LYS HG2 H 1.44 0.02 2 349 . 82 LYS CA C 56.6 0.2 1 350 . 82 LYS CB C 33.2 0.2 1 351 . 82 LYS N N 119.1 0.2 1 352 . 83 GLU H H 7.95 0.01 1 353 . 83 GLU HA H 4.25 0.02 1 354 . 83 GLU HB2 H 1.86 0.02 2 355 . 83 GLU HB3 H 2.04 0.02 2 356 . 83 GLU HG2 H 2.21 0.03 2 357 . 83 GLU CA C 56.6 0.2 1 358 . 83 GLU CB C 30.1 0.2 1 359 . 83 GLU N N 121.8 0.2 1 360 . 84 MET H H 8.21 0.01 1 361 . 84 MET HA H 4.51 0.02 1 362 . 84 MET HB2 H 2.05 0.02 2 363 . 84 MET HG2 H 2.57 0.02 2 364 . 84 MET CA C 55.4 0.2 1 365 . 84 MET CB C 33.2 0.2 1 366 . 84 MET N N 123.3 0.2 1 367 . 85 ASP H H 8.82 0.02 1 368 . 85 ASP HA H 4.95 0.02 1 369 . 85 ASP HB2 H 2.82 0.02 2 370 . 85 ASP HB3 H 3.03 0.02 2 371 . 85 ASP CA C 51.7 0.2 1 372 . 85 ASP CB C 41.5 0.2 1 373 . 85 ASP N N 124.9 0.2 1 374 . 86 PRO CA C 65.1 0.2 1 375 . 86 PRO CB C 32.7 0.2 1 376 . 87 GLU H H 8.29 0.01 1 377 . 87 GLU HA H 4.00 0.02 1 378 . 87 GLU HB2 H 1.82 0.02 2 379 . 87 GLU HB3 H 2.00 0.02 2 380 . 87 GLU HG2 H 2.13 0.02 2 381 . 87 GLU CA C 58.6 0.2 1 382 . 87 GLU CB C 28.3 0.2 1 383 . 87 GLU N N 119.3 0.2 1 384 . 88 LYS H H 7.33 0.01 1 385 . 88 LYS HA H 3.97 0.02 1 386 . 88 LYS HB2 H 1.83 0.02 2 387 . 88 LYS HB3 H 2.08 0.02 2 388 . 88 LYS HG2 H 1.69 0.02 2 389 . 88 LYS HE2 H 3.04 0.02 2 390 . 88 LYS CA C 59.9 0.2 1 391 . 88 LYS CB C 33.0 0.2 1 392 . 88 LYS N N 120.0 0.2 1 393 . 89 LEU H H 8.05 0.01 1 394 . 89 LEU HA H 4.00 0.02 1 395 . 89 LEU HB2 H 1.63 0.02 2 396 . 89 LEU HD1 H 0.92 0.02 2 397 . 89 LEU CA C 58.4 0.2 1 398 . 89 LEU CB C 41.3 0.2 1 399 . 89 LEU N N 119.8 0.2 1 400 . 90 LYS H H 7.59 0.01 1 401 . 90 LYS HB2 H 1.90 0.02 2 402 . 90 LYS HD2 H 1.66 0.02 2 403 . 90 LYS CA C 59.5 0.2 1 404 . 90 LYS CB C 32.3 0.2 1 405 . 90 LYS N N 118.9 0.2 1 406 . 91 ILE H H 7.42 0.01 1 407 . 91 ILE HA H 3.91 0.02 1 408 . 91 ILE HB H 2.16 0.02 1 409 . 91 ILE HG12 H 1.88 0.02 2 410 . 91 ILE HG2 H 1.21 0.02 1 411 . 91 ILE HD1 H 1.05 0.02 1 412 . 91 ILE CA C 65.2 0.2 1 413 . 91 ILE CB C 37.9 0.2 1 414 . 91 ILE N N 121.6 0.2 1 415 . 92 LEU H H 8.47 0.01 1 416 . 92 LEU HA H 4.08 0.02 1 417 . 92 LEU HB2 H 1.84 0.02 2 418 . 92 LEU HB3 H 2.01 0.02 2 419 . 92 LEU HG H 1.55 0.02 1 420 . 92 LEU HD1 H 0.90 0.02 2 421 . 92 LEU CA C 58.7 0.2 1 422 . 92 LEU CB C 41.6 0.2 1 423 . 92 LEU N N 121.8 0.2 1 424 . 93 GLU H H 8.47 0.01 1 425 . 93 GLU HA H 4.01 0.02 1 426 . 93 GLU HB2 H 2.03 0.02 2 427 . 93 GLU HB3 H 2.16 0.02 2 428 . 93 GLU CA C 59.4 0.2 1 429 . 93 GLU CB C 29.9 0.2 1 430 . 93 GLU N N 119.6 0.2 1 431 . 94 TRP H H 7.76 0.01 1 432 . 94 TRP HA H 4.33 0.02 1 433 . 94 TRP HB2 H 3.13 0.02 2 434 . 94 TRP HD1 H 7.03 0.02 1 435 . 94 TRP HE1 H 10.14 0.01 1 436 . 94 TRP HE3 H 7.77 0.01 1 437 . 94 TRP HZ2 H 7.30 0.01 1 438 . 94 TRP HZ3 H 6.73 0.01 1 439 . 94 TRP HH2 H 6.73 0.01 1 440 . 94 TRP CA C 60.2 0.2 1 441 . 94 TRP CB C 28.8 0.2 1 442 . 94 TRP CD1 C 127.4 0.2 1 443 . 94 TRP CE3 C 122.3 0.2 1 444 . 94 TRP CZ2 C 114.6 0.2 1 445 . 94 TRP CZ3 C 121.0 0.2 1 446 . 94 TRP CH2 C 123.7 0.2 1 447 . 94 TRP N N 124.2 0.2 1 448 . 94 TRP NE1 N 130.9 0.2 1 449 . 95 ILE H H 8.26 0.01 1 450 . 95 ILE HA H 2.92 0.02 1 451 . 95 ILE HB H 2.05 0.02 1 452 . 95 ILE HG12 H 1.78 0.02 2 453 . 95 ILE HG2 H 0.87 0.02 1 454 . 95 ILE HD1 H 0.74 0.02 1 455 . 95 ILE CA C 64.8 0.2 1 456 . 95 ILE N N 117.3 0.2 1 457 . 96 GLU H H 7.61 0.01 1 458 . 96 GLU HA H 3.95 0.02 1 459 . 96 GLU HB2 H 2.03 0.02 2 460 . 96 GLU CA C 58.7 0.2 1 461 . 96 GLU CB C 29.4 0.2 1 462 . 96 GLU N N 119.8 0.2 1 463 . 97 GLY H H 8.51 0.01 1 464 . 97 GLY HA2 H 4.07 0.02 2 465 . 97 GLY HA3 H 3.94 0.02 2 466 . 97 GLY CA C 45.9 0.2 1 467 . 97 GLY N N 111.8 0.2 1 468 . 98 LYS H H 7.97 0.01 1 469 . 98 LYS HA H 4.24 0.02 1 470 . 98 LYS CA C 58.1 0.2 1 471 . 98 LYS N N 119.6 0.2 1 472 . 99 GLU H H 8.14 0.01 1 473 . 99 GLU HA H 3.78 0.02 1 474 . 99 GLU CA C 59.3 0.2 1 475 . 99 GLU CB C 29.3 0.2 1 476 . 99 GLU N N 117.5 0.2 1 477 . 100 ARG H H 9.63 0.01 1 478 . 100 ARG HA H 3.32 0.02 1 479 . 100 ARG HB2 H 1.91 0.02 2 480 . 100 ARG CA C 57.7 0.2 1 481 . 100 ARG CB C 28.7 0.2 1 482 . 100 ARG N N 118.0 0.2 1 483 . 101 ASN H H 7.68 0.01 1 484 . 101 ASN HA H 4.70 0.02 1 485 . 101 ASN HB2 H 2.57 0.02 2 486 . 101 ASN HB3 H 3.13 0.02 2 487 . 101 ASN CA C 52.1 0.2 1 488 . 101 ASN CB C 38.5 0.2 1 489 . 101 ASN N N 118.4 0.2 1 490 . 102 ILE H H 8.81 0.01 1 491 . 102 ILE HA H 3.98 0.02 1 492 . 102 ILE HB H 1.62 0.02 1 493 . 102 ILE HG12 H 1.28 0.02 2 494 . 102 ILE HG2 H 0.62 0.02 1 495 . 102 ILE CA C 62.0 0.2 1 496 . 102 ILE CB C 38.1 0.2 1 497 . 102 ILE N N 124.7 0.2 1 498 . 103 ARG H H 7.76 0.01 1 499 . 103 ARG HA H 3.97 0.02 1 500 . 103 ARG HB2 H 1.89 0.02 2 501 . 103 ARG HB3 H 1.76 0.02 2 502 . 103 ARG HG2 H 1.38 0.02 2 503 . 103 ARG CA C 60.3 0.2 1 504 . 103 ARG CB C 29.9 0.2 1 505 . 103 ARG N N 121.8 0.2 1 506 . 104 ALA H H 7.48 0.01 1 507 . 104 ALA HA H 3.93 0.02 1 508 . 104 ALA HB H 1.39 0.02 1 509 . 104 ALA CA C 54.9 0.2 1 510 . 104 ALA CB C 18.5 0.2 1 511 . 104 ALA N N 124.2 0.2 1 512 . 105 LEU H H 8.09 0.01 1 513 . 105 LEU HA H 3.75 0.02 1 514 . 105 LEU HB2 H 1.65 0.02 2 515 . 105 LEU CA C 58.1 0.2 1 516 . 105 LEU CB C 42.3 0.2 1 517 . 105 LEU N N 118.7 0.2 1 518 . 106 LEU H H 8.51 0.01 1 519 . 106 LEU HA H 4.19 0.02 1 520 . 106 LEU HB2 H 2.14 0.02 2 521 . 106 LEU CA C 58.8 0.2 1 522 . 106 LEU CB C 42.4 0.2 1 523 . 106 LEU N N 118.4 0.2 1 524 . 107 SER H H 8.11 0.01 1 525 . 107 SER HA H 5.00 0.02 1 526 . 107 SER HB2 H 3.88 0.02 2 527 . 107 SER HB3 H 4.27 0.02 2 528 . 107 SER CA C 60.2 0.2 1 529 . 107 SER CB C 63.8 0.2 1 530 . 107 SER N N 111.1 0.2 1 531 . 108 THR H H 7.39 0.01 1 532 . 108 THR HA H 4.94 0.02 1 533 . 108 THR HB H 4.62 0.02 1 534 . 108 THR HG2 H 1.37 0.02 1 535 . 108 THR CA C 61.7 0.2 1 536 . 108 THR CB C 71.0 0.2 1 537 . 108 THR N N 108.4 0.2 1 538 . 109 MET H H 7.96 0.01 1 539 . 109 MET HA H 3.54 0.02 1 540 . 109 MET HB2 H 1.84 0.02 2 541 . 109 MET HG2 H 2.22 0.02 2 542 . 109 MET CA C 59.2 0.2 1 543 . 109 MET CB C 34.2 0.2 1 544 . 109 MET N N 128.7 0.2 1 545 . 110 HIS H H 8.55 0.01 1 546 . 110 HIS HA H 4.16 0.02 1 547 . 110 HIS HB2 H 2.90 0.02 2 548 . 110 HIS HB3 H 3.42 0.02 2 549 . 110 HIS HD2 H 7.08 0.02 2 550 . 110 HIS CA C 58.7 0.2 1 551 . 110 HIS CB C 30.2 0.2 1 552 . 110 HIS CD2 C 119.6 0.2 1 553 . 110 HIS N N 113.1 0.2 1 554 . 111 THR H H 7.07 0.01 1 555 . 111 THR HA H 4.04 0.02 1 556 . 111 THR HB H 4.15 0.02 1 557 . 111 THR HG2 H 0.74 0.02 1 558 . 111 THR CA C 63.3 0.2 1 559 . 111 THR CB C 69.6 0.2 1 560 . 111 THR N N 111.1 0.2 1 561 . 112 VAL H H 6.71 0.01 1 562 . 112 VAL HA H 4.25 0.02 1 563 . 112 VAL HB H 1.73 0.02 1 564 . 112 VAL CA C 60.3 0.2 1 565 . 112 VAL CB C 32.6 0.2 1 566 . 112 VAL N N 112.9 0.2 1 567 . 113 LEU H H 6.09 0.01 1 568 . 113 LEU HA H 3.49 0.02 1 569 . 113 LEU HB2 H 1.28 0.02 2 570 . 113 LEU HD1 H 0.31 0.02 2 571 . 113 LEU CA C 54.6 0.2 1 572 . 113 LEU CB C 42.6 0.2 1 573 . 113 LEU N N 119.6 0.2 1 574 . 114 TRP H H 6.04 0.01 1 575 . 114 TRP HA H 4.50 0.02 1 576 . 114 TRP HB2 H 3.27 0.02 2 577 . 114 TRP HB3 H 3.49 0.02 2 578 . 114 TRP HD1 H 6.66 0.01 1 579 . 114 TRP HE1 H 9.91 0.01 1 580 . 114 TRP HE3 H 7.58 0.01 1 581 . 114 TRP HZ2 H 7.09 0.01 1 582 . 114 TRP HZ3 H 6.73 0.01 1 583 . 114 TRP HH2 H 6.91 0.01 1 584 . 114 TRP CA C 56.2 0.2 1 585 . 114 TRP CB C 28.7 0.2 1 586 . 114 TRP CD1 C 128.8 0.2 1 587 . 114 TRP CE3 C 119.1 0.2 1 588 . 114 TRP CZ2 C 115.9 0.2 1 589 . 114 TRP CZ3 C 121.4 0.2 1 590 . 114 TRP CH2 C 124.2 0.2 1 591 . 114 TRP N N 119.3 0.2 1 592 . 114 TRP NE1 N 133.6 0.2 1 593 . 115 ALA H H 8.63 0.01 1 594 . 115 ALA HA H 4.11 0.02 1 595 . 115 ALA HB H 1.41 0.02 1 596 . 115 ALA CA C 53.4 0.2 1 597 . 115 ALA CB C 18.6 0.2 1 598 . 115 ALA N N 124.2 0.2 1 599 . 116 GLY H H 8.67 0.02 1 600 . 116 GLY HA2 H 3.78 0.03 2 601 . 116 GLY HA3 H 4.26 0.03 2 602 . 116 GLY CA C 45.0 0.2 1 603 . 116 GLY N N 109.3 0.2 1 604 . 117 GLU H H 7.44 0.01 1 605 . 117 GLU HA H 4.24 0.02 1 606 . 117 GLU HB2 H 1.75 0.02 2 607 . 117 GLU CA C 58.6 0.2 1 608 . 117 GLU CB C 28.7 0.2 1 609 . 117 GLU N N 124.7 0.2 1 610 . 118 THR HA H 4.57 0.02 1 611 . 118 THR HB H 4.41 0.02 1 612 . 118 THR CA C 62.3 0.2 1 613 . 118 THR CB C 69.2 0.2 1 614 . 119 LYS H H 9.71 0.01 1 615 . 119 LYS HA H 4.31 0.02 1 616 . 119 LYS HB2 H 1.89 0.02 2 617 . 119 LYS HB3 H 2.06 0.02 2 618 . 119 LYS HG2 H 1.43 0.02 2 619 . 119 LYS HG3 H 1.56 0.02 2 620 . 119 LYS HD2 H 1.70 0.02 2 621 . 119 LYS CA C 57.2 0.2 1 622 . 119 LYS CB C 33.0 0.2 1 623 . 119 LYS N N 124.4 0.2 1 624 . 120 TRP H H 9.58 0.01 1 625 . 120 TRP HA H 4.47 0.02 1 626 . 120 TRP HB2 H 2.72 0.02 2 627 . 120 TRP HB3 H 2.93 0.02 2 628 . 120 TRP HD1 H 6.84 0.02 1 629 . 120 TRP HE1 H 10.7 0.01 1 630 . 120 TRP HE3 H 7.43 0.01 1 631 . 120 TRP HZ2 H 7.71 0.01 1 632 . 120 TRP HZ3 H 6.84 0.01 1 633 . 120 TRP HH2 H 7.21 0.01 1 634 . 120 TRP CA C 57.2 0.2 1 635 . 120 TRP CB C 30.7 0.2 1 636 . 120 TRP CD1 C 126.9 0.2 1 637 . 120 TRP CE3 C 121.0 0.2 1 638 . 120 TRP CZ2 C 115.9 0.2 1 639 . 120 TRP CZ3 C 120.5 0.2 1 640 . 120 TRP CH2 C 124.6 0.2 1 641 . 120 TRP N N 124.2 0.2 1 642 . 120 TRP NE1 N 130.7 0.2 1 643 . 121 LYS H H 6.73 0.01 1 644 . 121 LYS HA H 4.47 0.02 1 645 . 121 LYS HB2 H 1.23 0.02 2 646 . 121 LYS HB3 H 1.36 0.02 2 647 . 121 LYS CA C 51.9 0.2 1 648 . 121 LYS CB C 32.9 0.2 1 649 . 121 LYS N N 129.6 0.2 1 650 . 122 PRO CA C 63.3 0.2 1 651 . 122 PRO CB C 31.5 0.2 1 652 . 123 VAL H H 7.77 0.01 1 653 . 123 VAL HA H 4.28 0.01 1 654 . 123 VAL HB H 2.04 0.01 1 655 . 123 VAL HG1 H 0.87 0.02 2 656 . 123 VAL CA C 59.7 0.2 1 657 . 123 VAL CB C 34.7 0.2 1 658 . 123 VAL N N 121.1 0.2 1 659 . 124 GLY H H 8.89 0.01 1 660 . 124 GLY HA2 H 4.65 0.02 2 661 . 124 GLY HA3 H 3.75 0.02 2 662 . 124 GLY CA C 43.5 0.2 1 663 . 124 GLY N N 111.3 0.2 1 664 . 125 MET H H 8.69 0.01 1 665 . 125 MET HA H 4.23 0.01 1 666 . 125 MET HB2 H 2.04 0.02 2 667 . 125 MET HG2 H 2.66 0.02 2 668 . 125 MET HG3 H 2.77 0.02 2 669 . 125 MET CA C 57.4 0.2 1 670 . 125 MET CB C 30.7 0.2 1 671 . 125 MET N N 119.6 0.2 1 672 . 126 ALA H H 8.58 0.01 1 673 . 126 ALA HA H 4.10 0.02 1 674 . 126 ALA HB H 1.37 0.02 1 675 . 126 ALA CA C 54.3 0.2 1 676 . 126 ALA CB C 18.5 0.2 1 677 . 126 ALA N N 120.7 0.2 1 678 . 127 ASP H H 7.53 0.01 1 679 . 127 ASP HA H 4.80 0.02 9 680 . 127 ASP HB2 H 2.82 0.02 2 681 . 127 ASP CA C 54.5 0.2 1 682 . 127 ASP CB C 42.2 0.2 1 683 . 127 ASP N N 116.0 0.2 1 684 . 128 LEU H H 7.50 0.01 1 685 . 128 LEU HA H 4.49 0.02 1 686 . 128 LEU HD1 H 0.89 0.02 2 687 . 128 LEU CA C 53.0 0.2 1 688 . 128 LEU CB C 44.1 0.2 1 689 . 128 LEU N N 119.3 0.2 1 690 . 129 VAL H H 7.45 0.01 1 691 . 129 VAL HA H 3.69 0.02 1 692 . 129 VAL HB H 2.34 0.02 1 693 . 129 VAL HG1 H 0.91 0.02 2 694 . 129 VAL HG2 H 1.13 0.02 2 695 . 129 VAL CA C 67.1 0.2 1 696 . 129 VAL CB C 32.6 0.2 1 697 . 129 VAL N N 122.9 0.2 1 698 . 130 THR H H 8.81 0.01 1 699 . 130 THR HA H 4.88 0.02 2 700 . 130 THR HB H 4.88 0.02 2 701 . 130 THR HG2 H 1.34 0.02 1 702 . 130 THR CA C 59.5 0.2 1 703 . 130 THR CB C 68.8 0.2 1 704 . 130 THR N N 112.4 0.2 1 705 . 131 PRO CA C 66.2 0.2 1 706 . 131 PRO CB C 32.1 0.2 1 707 . 132 GLU H H 8.53 0.01 1 708 . 132 GLU HA H 4.13 0.02 1 709 . 132 GLU HB2 H 2.00 0.02 2 710 . 132 GLU HB3 H 2.15 0.02 2 711 . 132 GLU HG2 H 2.35 0.02 2 712 . 132 GLU HG3 H 2.45 0.02 2 713 . 132 GLU CA C 60.3 0.2 1 714 . 132 GLU CB C 29.2 0.2 1 715 . 132 GLU N N 118.2 0.2 1 716 . 133 GLN H H 7.92 0.01 1 717 . 133 GLN HA H 4.04 0.02 1 718 . 133 GLN HB2 H 2.01 0.02 2 719 . 133 GLN HB3 H 2.16 0.02 2 720 . 133 GLN HG2 H 2.31 0.02 2 721 . 133 GLN HG3 H 2.49 0.02 2 722 . 133 GLN CA C 59.7 0.2 1 723 . 133 GLN CB C 29.0 0.2 1 724 . 133 GLN N N 121.6 0.2 1 725 . 134 VAL H H 8.19 0.2 1 726 . 134 VAL HA H 3.36 0.02 1 727 . 134 VAL HB H 2.04 0.02 1 728 . 134 VAL HG1 H 0.82 0.02 2 729 . 134 VAL CA C 67.1 0.2 1 730 . 134 VAL CB C 32.2 0.2 1 731 . 134 VAL N N 118.2 0.2 1 732 . 135 LYS H H 8.43 0.01 1 733 . 135 LYS HA H 3.82 0.02 1 734 . 135 LYS HB2 H 2.04 0.02 2 735 . 135 LYS HB3 H 2.22 0.02 2 736 . 135 LYS CA C 60.7 0.2 1 737 . 135 LYS CB C 32.9 0.2 1 738 . 135 LYS N N 119.3 0.2 1 739 . 136 LYS H H 7.80 0.01 1 740 . 136 LYS HA H 3.98 0.02 1 741 . 136 LYS HB2 H 2.02 0.02 2 742 . 136 LYS HG2 H 1.41 0.02 2 743 . 136 LYS HG3 H 1.66 0.02 2 744 . 136 LYS CA C 60.0 0.2 1 745 . 136 LYS CB C 32.7 0.2 1 746 . 136 LYS N N 118.7 0.2 1 747 . 137 VAL H H 8.28 0.01 1 748 . 137 VAL HA H 3.71 0.02 1 749 . 137 VAL HB H 2.08 0.02 2 750 . 137 VAL HG1 H 1.15 0.02 2 751 . 137 VAL HG2 H 1.44 0.02 2 752 . 137 VAL CA C 66.1 0.2 1 753 . 137 VAL CB C 31.5 0.2 1 754 . 137 VAL N N 121.3 0.2 1 755 . 138 TYR H H 9.22 0.01 1 756 . 138 TYR HA H 4.23 0.02 1 757 . 138 TYR HB2 H 2.98 0.02 2 758 . 138 TYR HD1 H 6.33 0.02 3 759 . 138 TYR HE1 H 6.06 0.02 3 760 . 138 TYR CA C 61.3 0.2 1 761 . 138 TYR CB C 38.2 0.2 1 762 . 138 TYR CD1 C 132.4 0.2 3 763 . 138 TYR CE1 C 118.7 0.2 3 764 . 138 TYR N N 123.6 0.2 1 765 . 139 ARG H H 8.16 0.2 1 766 . 139 ARG HA H 3.45 0.02 1 767 . 139 ARG HB2 H 2.12 0.02 2 768 . 139 ARG HG2 H 1.80 0.02 2 769 . 139 ARG HD2 H 3.00 0.02 2 770 . 139 ARG CA C 59.3 0.2 1 771 . 139 ARG CB C 29.5 0.2 1 772 . 139 ARG N N 117.8 0.2 1 773 . 140 LYS H H 7.47 0.01 1 774 . 140 LYS HA H 4.10 0.02 1 775 . 140 LYS HB2 H 2.24 0.02 2 776 . 140 LYS HG2 H 1.79 0.02 2 777 . 140 LYS CA C 59.5 0.2 1 778 . 140 LYS CB C 32.9 0.2 1 779 . 140 LYS N N 119.1 0.2 1 780 . 141 ALA H H 8.70 0.01 1 781 . 141 ALA HA H 3.69 0.02 1 782 . 141 ALA HB H 1.23 0.02 1 783 . 141 ALA CA C 55.5 0.2 1 784 . 141 ALA CB C 19.4 0.2 1 785 . 141 ALA N N 124.9 0.2 1 786 . 142 VAL H H 8.22 0.01 1 787 . 142 VAL HA H 3.52 0.02 1 788 . 142 VAL HB H 1.99 0.02 1 789 . 142 VAL HG1 H 0.58 0.02 2 790 . 142 VAL HG2 H 0.91 0.02 2 791 . 142 VAL CA C 65.9 0.2 1 792 . 142 VAL CB C 31.7 0.2 1 793 . 142 VAL N N 116.0 0.2 1 794 . 143 LEU H H 7.08 0.01 1 795 . 143 LEU HA H 4.15 0.02 1 796 . 143 LEU HB2 H 1.98 0.02 2 797 . 143 LEU HD1 H 0.91 0.02 2 798 . 143 LEU CA C 57.6 0.2 1 799 . 143 LEU CB C 41.8 0.2 1 800 . 143 LEU N N 117.3 0.2 1 801 . 144 VAL H H 7.48 0.01 1 802 . 144 VAL HA H 3.85 0.02 1 803 . 144 VAL HB H 2.23 0.02 1 804 . 144 VAL HG1 H 1.20 0.02 2 805 . 144 VAL CA C 65.9 0.2 1 806 . 144 VAL CB C 32.2 0.2 1 807 . 144 VAL N N 118.7 0.2 1 808 . 145 VAL H H 7.41 0.01 1 809 . 145 VAL HA H 4.66 0.02 1 810 . 145 VAL HG1 H 0.99 0.02 2 811 . 145 VAL CA C 60.9 0.2 1 812 . 145 VAL CB C 31.4 0.2 1 813 . 145 VAL N N 109.1 0.2 1 814 . 146 HIS H H 7.29 0.01 1 815 . 146 HIS HA H 4.16 0.02 1 816 . 146 HIS HB2 H 3.55 0.02 2 817 . 146 HIS HB3 H 3.64 0.02 2 818 . 146 HIS HD2 H 6.88 0.02 2 819 . 146 HIS HE2 H 7.63 0.02 2 820 . 146 HIS CA C 57.4 0.2 1 821 . 146 HIS CB C 31.4 0.2 1 822 . 146 HIS CD2 C 117.8 0.2 1 823 . 146 HIS CE1 C 139.8 0.2 1 824 . 146 HIS N N 122.9 0.2 1 825 . 147 PRO CA C 65.3 0.2 1 826 . 147 PRO CB C 32.0 0.2 1 827 . 148 ASP H H 11.05 0.01 1 828 . 148 ASP HA H 4.40 0.01 1 829 . 148 ASP HB2 H 2.65 0.02 2 830 . 148 ASP CA C 57.5 0.2 1 831 . 148 ASP CB C 39.8 0.2 1 832 . 148 ASP N N 124.2 0.2 1 833 . 149 LYS H H 7.55 0.01 1 834 . 149 LYS HA H 4.37 0.01 1 835 . 149 LYS HB2 H 1.99 0.02 2 836 . 149 LYS HG2 H 1.44 0.02 2 837 . 149 LYS CA C 56.2 0.2 1 838 . 149 LYS CB C 32.7 0.2 1 839 . 149 LYS N N 118.0 0.2 1 840 . 150 ALA H H 7.56 0.01 1 841 . 150 ALA HA H 4.05 0.03 1 842 . 150 ALA HB H 1.19 0.02 1 843 . 150 ALA CA C 52.0 0.2 1 844 . 150 ALA CB C 20.8 0.2 1 845 . 150 ALA N N 121.1 0.2 1 846 . 151 THR H H 7.26 0.01 1 847 . 151 THR HA H 3.72 0.01 1 848 . 151 THR HB H 4.01 0.02 1 849 . 151 THR HG2 H 1.17 0.02 1 850 . 151 THR CA C 64.8 0.2 1 851 . 151 THR CB C 68.8 0.2 1 852 . 151 THR N N 114.9 0.2 1 853 . 152 GLY H H 8.98 0.01 1 854 . 152 GLY HA2 H 4.05 0.02 2 855 . 152 GLY HA3 H 3.62 0.02 2 856 . 152 GLY CA C 45.5 0.2 1 857 . 152 GLY N N 116.9 0.2 1 858 . 153 GLN H H 7.68 0.01 1 859 . 153 GLN HA H 4.46 0.02 1 860 . 153 GLN HB2 H 1.89 0.02 2 861 . 153 GLN HG2 H 2.17 0.02 2 862 . 153 GLN HG3 H 2.34 0.02 2 863 . 153 GLN CA C 52.4 0.2 1 864 . 153 GLN N N 118.7 0.2 1 865 . 154 PRO CA C 65.0 0.2 1 866 . 154 PRO CB C 31.8 0.2 1 867 . 155 TYR H H 5.78 0.01 1 868 . 155 TYR HA H 4.61 0.02 1 869 . 155 TYR HB2 H 2.34 0.02 2 870 . 155 TYR HB3 H 2.76 0.02 2 871 . 155 TYR HD1 H 6.16 0.02 3 872 . 155 TYR HE1 H 6.47 0.02 3 873 . 155 TYR CA C 54.2 0.2 1 874 . 155 TYR CB C 36.4 0.2 1 875 . 155 TYR CD1 C 132.9 0.2 3 876 . 155 TYR CE1 C 118.7 0.2 3 877 . 155 TYR N N 109.5 0.2 1 878 . 156 GLU H H 7.23 0.01 1 879 . 156 GLU HA H 3.36 0.02 1 880 . 156 GLU HB2 H 1.73 0.02 2 881 . 156 GLU HG2 H 2.34 0.02 2 882 . 156 GLU CA C 61.0 0.2 1 883 . 156 GLU CB C 30.0 0.2 1 884 . 156 GLU N N 126.2 0.2 1 885 . 157 GLN H H 8.70 0.01 1 886 . 157 GLN HA H 3.94 0.02 1 887 . 157 GLN HB2 H 1.73 0.02 2 888 . 157 GLN HG2 H 2.11 0.02 2 889 . 157 GLN CA C 58.4 0.2 1 890 . 157 GLN CB C 27.8 0.2 1 891 . 157 GLN N N 116.0 0.2 1 892 . 158 TYR H H 6.77 0.01 1 893 . 158 TYR HA H 4.52 0.02 1 894 . 158 TYR HB2 H 3.09 0.02 2 895 . 158 TYR HB3 H 3.61 0.02 2 896 . 158 TYR HD1 H 6.97 0.02 3 897 . 158 TYR HE1 H 6.86 0.02 3 898 . 158 TYR CA C 58.3 0.2 1 899 . 158 TYR CB C 37.2 0.2 1 900 . 158 TYR CD1 C 132.4 0.2 3 901 . 158 TYR CE1 C 119.1 0.2 3 902 . 158 TYR N N 122.0 0.2 1 903 . 159 ALA H H 8.29 0.01 1 904 . 159 ALA HA H 4.16 0.02 1 905 . 159 ALA HB H 1.44 0.02 1 906 . 159 ALA CA C 56.3 0.2 1 907 . 159 ALA CB C 19.2 0.2 1 908 . 159 ALA N N 121.6 0.2 1 909 . 160 LYS H H 7.69 0.01 1 910 . 160 LYS HA H 4.05 0.02 1 911 . 160 LYS HB2 H 1.94 0.02 2 912 . 160 LYS HG2 H 1.44 0.02 2 913 . 160 LYS HD2 H 1.59 0.02 2 914 . 160 LYS HD3 H 1.71 0.02 2 915 . 160 LYS CA C 60.5 0.2 1 916 . 160 LYS CB C 32.4 0.2 1 917 . 160 LYS N N 116.2 0.2 1 918 . 161 MET H H 7.61 0.01 1 919 . 161 MET HA H 4.15 0.02 1 920 . 161 MET HB2 H 2.54 0.02 4 921 . 161 MET HB3 H 2.67 0.02 4 922 . 161 MET HG2 H 3.11 0.02 4 923 . 161 MET HE H 2.36 0.02 4 924 . 161 MET CA C 59.7 0.2 1 925 . 161 MET CB C 35.3 0.2 1 926 . 161 MET N N 117.5 0.2 1 927 . 162 ILE H H 8.09 0.01 1 928 . 162 ILE HA H 3.79 0.02 1 929 . 162 ILE HB H 1.91 0.02 4 930 . 162 ILE CA C 66.6 0.2 1 931 . 162 ILE CB C 39.5 0.2 1 932 . 162 ILE N N 120.2 0.2 1 933 . 163 PHE H H 9.17 0.01 1 934 . 163 PHE HA H 3.95 0.02 1 935 . 163 PHE HB2 H 3.18 0.02 2 936 . 163 PHE HB3 H 3.38 0.02 2 937 . 163 PHE HD1 H 7.07 0.02 3 938 . 163 PHE HE1 H 7.28 0.02 3 939 . 163 PHE HZ H 7.19 0.02 1 940 . 163 PHE CA C 61.9 0.2 1 941 . 163 PHE CB C 40.0 0.2 1 942 . 163 PHE CD1 C 132.4 0.2 3 943 . 163 PHE CE1 C 132.4 0.2 3 944 . 163 PHE CZ C 130.6 0.2 1 945 . 163 PHE N N 120.4 0.2 1 946 . 164 MET H H 8.36 0.01 1 947 . 164 MET HA H 4.02 0.02 1 948 . 164 MET HB2 H 2.27 0.02 2 949 . 164 MET HG2 H 2.77 0.02 2 950 . 164 MET HG3 H 2.98 0.02 2 951 . 164 MET CA C 58.4 0.2 1 952 . 164 MET CB C 32.3 0.2 1 953 . 164 MET N N 116.4 0.2 1 954 . 165 GLU H H 7.51 0.01 1 955 . 165 GLU HA H 4.28 0.02 1 956 . 165 GLU HB2 H 1.92 0.02 4 957 . 165 GLU HB3 H 2.12 0.02 4 958 . 165 GLU HG2 H 2.27 0.02 4 959 . 165 GLU CA C 58.7 0.2 1 960 . 165 GLU CB C 28.6 0.2 1 961 . 165 GLU N N 119.8 0.2 1 962 . 166 LEU H H 8.76 0.01 1 963 . 166 LEU HA H 3.92 0.02 1 964 . 166 LEU HB2 H 2.12 0.02 2 965 . 166 LEU HD1 H 0.84 0.02 2 966 . 166 LEU CA C 58.2 0.2 1 967 . 166 LEU CB C 42.2 0.2 1 968 . 166 LEU N N 119.6 0.2 1 969 . 167 ASN H H 8.26 0.01 1 970 . 167 ASN HA H 4.58 0.02 1 971 . 167 ASN HB2 H 2.54 0.02 2 972 . 167 ASN HB3 H 2.69 0.02 2 973 . 167 ASN CA C 56.3 0.2 1 974 . 167 ASN CB C 37.7 0.2 1 975 . 167 ASN N N 118.0 0.2 1 976 . 168 ASP H H 8.12 0.01 1 977 . 168 ASP HA H 4.50 0.02 1 978 . 168 ASP HB2 H 2.53 0.02 2 979 . 168 ASP HB3 H 2.70 0.02 2 980 . 168 ASP CA C 57.7 0.2 1 981 . 168 ASP CB C 40.4 0.2 1 982 . 168 ASP N N 123.3 0.2 1 983 . 169 ALA H H 8.58 0.01 1 984 . 169 ALA HA H 3.98 0.02 1 985 . 169 ALA HB H 1.28 0.02 1 986 . 169 ALA CA C 54.8 0.2 1 987 . 169 ALA CB C 18.9 0.2 1 988 . 169 ALA N N 123.8 0.2 1 989 . 170 TRP H H 9.11 0.01 1 990 . 170 TRP HA H 4.04 0.02 1 991 . 170 TRP HB2 H 3.05 0.02 2 992 . 170 TRP HD1 H 7.03 0.02 1 993 . 170 TRP HE1 H 9.78 0.01 1 994 . 170 TRP HE3 H 6.58 0.01 1 995 . 170 TRP HZ2 H 7.48 0.01 1 996 . 170 TRP HZ3 H 6.58 0.01 1 997 . 170 TRP HH2 H 7.15 0.01 1 998 . 170 TRP CA C 60.4 0.2 1 999 . 170 TRP CB C 28.8 0.2 1 1000 . 170 TRP CD1 C 127.4 0.2 1 1001 . 170 TRP CE3 C 120.5 0.2 1 1002 . 170 TRP CZ2 C 114.6 0.2 1 1003 . 170 TRP CZ3 C 121.0 0.2 1 1004 . 170 TRP CH2 C 123.3 0.2 1 1005 . 170 TRP N N 125.1 0.2 1 1006 . 170 TRP NE1 N 128.9 0.2 1 1007 . 171 SER H H 8.06 0.01 1 1008 . 171 SER HA H 4.50 0.02 1 1009 . 171 SER HB2 H 4.04 0.02 2 1010 . 171 SER CA C 61.9 0.2 1 1011 . 171 SER CB C 62.8 0.2 1 1012 . 171 SER N N 114.9 0.2 1 1013 . 172 GLU H H 7.56 0.01 1 1014 . 172 GLU HA H 4.13 0.02 1 1015 . 172 GLU HB2 H 2.06 0.02 2 1016 . 172 GLU CA C 58.8 0.2 1 1017 . 172 GLU CB C 29.3 0.2 1 1018 . 172 GLU N N 120.9 0.2 1 1019 . 173 PHE H H 7.72 0.01 1 1020 . 173 PHE HA H 4.12 0.02 1 1021 . 173 PHE HB2 H 2.76 0.02 2 1022 . 173 PHE HB3 H 3.02 0.02 2 1023 . 173 PHE HD1 H 6.70 0.02 3 1024 . 173 PHE HE1 H 7.24 0.02 3 1025 . 173 PHE HZ H 6.93 0.02 1 1026 . 173 PHE CA C 60.7 0.2 1 1027 . 173 PHE CB C 39.2 0.2 1 1028 . 173 PHE CD1 C 133.3 0.2 3 1029 . 173 PHE CE1 C 131.5 0.2 3 1030 . 173 PHE CZ C 128.8 0.2 1 1031 . 173 PHE N N 122.4 0.2 1 1032 . 174 GLU H H 8.20 0.01 1 1033 . 174 GLU HA H 4.49 0.01 1 1034 . 174 GLU HB2 H 1.64 0.02 2 1035 . 174 GLU CA C 59.1 0.2 1 1036 . 174 GLU CB C 29.7 0.2 1 1037 . 174 GLU N N 119.8 0.2 1 1038 . 175 ASN H H 8.01 0.01 1 1039 . 175 ASN HA H 4.45 0.02 1 1040 . 175 ASN HB2 H 2.81 0.02 2 1041 . 175 ASN CA C 54.9 0.2 1 1042 . 175 ASN CB C 38.7 0.2 1 1043 . 175 ASN N N 119.3 0.2 1 1044 . 176 GLN H H 7.75 0.01 1 1045 . 176 GLN HA H 4.17 0.02 1 1046 . 176 GLN HB2 H 1.96 0.02 2 1047 . 176 GLN HB3 H 2.16 0.02 2 1048 . 176 GLN HG2 H 2.38 0.02 2 1049 . 176 GLN HG3 H 2.49 0.02 2 1050 . 176 GLN CA C 56.4 0.2 1 1051 . 176 GLN CB C 28.6 0.2 1 1052 . 176 GLN N N 118.7 0.2 1 1053 . 177 GLY H H 7.83 0.01 1 1054 . 177 GLY HA2 H 3.73 0.02 2 1055 . 177 GLY HA3 H 3.90 0.02 2 1056 . 177 GLY CA C 45.4 0.2 1 1057 . 177 GLY N N 108.2 0.2 1 1058 . 178 GLN H H 7.84 0.01 1 1059 . 178 GLN HA H 3.16 0.02 1 1060 . 178 GLN CA C 55.6 0.2 1 1061 . 178 GLN CB C 28.2 0.2 1 1062 . 178 GLN N N 119.1 0.2 1 1063 . 179 LYS H H 8.05 0.01 1 1064 . 179 LYS HA H 4.46 0.02 1 1065 . 179 LYS HB2 H 1.80 0.02 2 1066 . 179 LYS HG2 H 1.44 0.02 2 1067 . 179 LYS HD2 H 1.67 0.02 2 1068 . 179 LYS CA C 54.6 0.2 1 1069 . 179 LYS CB C 32.3 0.2 1 1070 . 179 LYS N N 122.4 0.2 1 1071 . 180 PRO CA C 62.8 0.2 1 1072 . 180 PRO CB C 32.7 0.2 1 1073 . 181 LEU H H 8.28 0.01 1 1074 . 181 LEU HA H 4.15 0.02 1 1075 . 181 LEU CA C 55.9 0.2 1 1076 . 181 LEU CB C 43.2 0.2 1 1077 . 181 LEU N N 123.1 0.2 1 1078 . 182 TYR H H 7.36 0.01 1 1079 . 182 TYR HA H 4.35 0.02 1 1080 . 182 TYR CA C 58.4 0.2 1 1081 . 182 TYR CB C 39.2 0.2 1 1082 . 182 TYR N N 123.6 0.2 1 stop_ save_