data_6883 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Ufd1 ; _BMRB_accession_number 6883 _BMRB_flat_file_name bmr6883.str _Entry_type original _Submission_date 2005-11-02 _Accession_date 2005-11-02 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Park sunghyouk . . 2 Isaacson Rivka . . 3 Silver Pamela . . 4 Wagner Gerhard . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 991 "13C chemical shifts" 755 "15N chemical shifts" 187 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-11-29 original author . stop_ _Original_release_date 2007-11-29 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'Ufd1 exhibits the AAA-ATPase fold with two distinct ubiquitin interaction sites' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16004872 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Park Sunghyouk . . 2 Isaacson Rivka . . 3 Kim P. . . 4 Silver Pamela . . 5 Wagner Gerhard . . stop_ _Journal_abbreviation Structure _Journal_volume 13 _Journal_issue 7 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 995 _Page_last 1005 _Year 2005 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Ufd1 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Ufd1 $Ufd1 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Ufd1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Ufd1 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 208 _Mol_residue_sequence ; MFSGFSSFGGGNGFVNMPQT FEEFFRCYPIAMMNDRIRKD DANFGGKIFLPPSALSKLSM LNIRYPMLFKLTANETGRVT HGGVLEFIAEEGRVYLPQWM METLGIQPGSLLQISSTDVP LGQFVKLEPQSVDFLDISDP KAVLENVLRNFSTLTVDDVI EISYNGKTFKIKILEVKPES SSKSICVIETDLVTDFAPPV GYVEPDYK ; loop_ _Residue_seq_code _Residue_label 1 MET 2 PHE 3 SER 4 GLY 5 PHE 6 SER 7 SER 8 PHE 9 GLY 10 GLY 11 GLY 12 ASN 13 GLY 14 PHE 15 VAL 16 ASN 17 MET 18 PRO 19 GLN 20 THR 21 PHE 22 GLU 23 GLU 24 PHE 25 PHE 26 ARG 27 CYS 28 TYR 29 PRO 30 ILE 31 ALA 32 MET 33 MET 34 ASN 35 ASP 36 ARG 37 ILE 38 ARG 39 LYS 40 ASP 41 ASP 42 ALA 43 ASN 44 PHE 45 GLY 46 GLY 47 LYS 48 ILE 49 PHE 50 LEU 51 PRO 52 PRO 53 SER 54 ALA 55 LEU 56 SER 57 LYS 58 LEU 59 SER 60 MET 61 LEU 62 ASN 63 ILE 64 ARG 65 TYR 66 PRO 67 MET 68 LEU 69 PHE 70 LYS 71 LEU 72 THR 73 ALA 74 ASN 75 GLU 76 THR 77 GLY 78 ARG 79 VAL 80 THR 81 HIS 82 GLY 83 GLY 84 VAL 85 LEU 86 GLU 87 PHE 88 ILE 89 ALA 90 GLU 91 GLU 92 GLY 93 ARG 94 VAL 95 TYR 96 LEU 97 PRO 98 GLN 99 TRP 100 MET 101 MET 102 GLU 103 THR 104 LEU 105 GLY 106 ILE 107 GLN 108 PRO 109 GLY 110 SER 111 LEU 112 LEU 113 GLN 114 ILE 115 SER 116 SER 117 THR 118 ASP 119 VAL 120 PRO 121 LEU 122 GLY 123 GLN 124 PHE 125 VAL 126 LYS 127 LEU 128 GLU 129 PRO 130 GLN 131 SER 132 VAL 133 ASP 134 PHE 135 LEU 136 ASP 137 ILE 138 SER 139 ASP 140 PRO 141 LYS 142 ALA 143 VAL 144 LEU 145 GLU 146 ASN 147 VAL 148 LEU 149 ARG 150 ASN 151 PHE 152 SER 153 THR 154 LEU 155 THR 156 VAL 157 ASP 158 ASP 159 VAL 160 ILE 161 GLU 162 ILE 163 SER 164 TYR 165 ASN 166 GLY 167 LYS 168 THR 169 PHE 170 LYS 171 ILE 172 LYS 173 ILE 174 LEU 175 GLU 176 VAL 177 LYS 178 PRO 179 GLU 180 SER 181 SER 182 SER 183 LYS 184 SER 185 ILE 186 CYS 187 VAL 188 ILE 189 GLU 190 THR 191 ASP 192 LEU 193 VAL 194 THR 195 ASP 196 PHE 197 ALA 198 PRO 199 PRO 200 VAL 201 GLY 202 TYR 203 VAL 204 GLU 205 PRO 206 ASP 207 TYR 208 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-10-25 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 1ZC1 "Ufd1 Exhibits The Aaa-Atpase Fold With Two Distinct Ubiquitin Interaction Sites" 100.00 208 100.00 100.00 7.01e-149 DBJ GAA23430 "K7_Ufd1p [Saccharomyces cerevisiae Kyokai no. 7]" 100.00 361 100.00 100.00 1.92e-148 EMBL CAA97047 "UFD1 [Saccharomyces cerevisiae]" 100.00 361 100.00 100.00 1.92e-148 EMBL CAY79809 "Ufd1p [Saccharomyces cerevisiae EC1118]" 100.00 361 100.00 100.00 1.92e-148 GB AAB46627 "Pip3p [Saccharomyces cerevisiae]" 100.00 361 100.00 100.00 1.92e-148 GB AAC49023 "Ufd1p [Saccharomyces cerevisiae]" 100.00 361 100.00 100.00 1.92e-148 GB AAT92825 "YGR048W [Saccharomyces cerevisiae]" 100.00 361 100.00 100.00 1.92e-148 GB AAZ22463 "Ufd1p [Saccharomyces cerevisiae]" 100.00 361 100.00 100.00 1.92e-148 GB AHY79412 "Ufd1p [Saccharomyces cerevisiae YJM993]" 99.52 361 100.00 100.00 1.19e-147 REF NP_011562 "polyubiquitin-binding protein UFD1 [Saccharomyces cerevisiae S288c]" 100.00 361 100.00 100.00 1.92e-148 SP P53044 "RecName: Full=Ubiquitin fusion degradation protein 1; Short=UB fusion protein 1; AltName: Full=Polymerase-interacting protein 3" 100.00 361 100.00 100.00 1.92e-148 TPG DAA08146 "TPA: polyubiquitin-binding protein UFD1 [Saccharomyces cerevisiae S288c]" 100.00 361 100.00 100.00 1.92e-148 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Ufd1 'Baker's yeast' 4932 Eukaryota Fungi Saccharomyces cerevisiae 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 $Ufd1 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Ufd1 0.2 mM '[U-13C; U-15N]' stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Varian_500MHz _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Inova _Field_strength 500 _Details . save_ save_Varian_600MHz _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Inova _Field_strength 600 _Details . save_ save_Bruker_500MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model ARX _Field_strength 500 _Details . save_ save_Bruker_600MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model ARX _Field_strength 600 _Details . save_ save_Varian_750MHz _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Unity` _Field_strength 750 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H15N HSQC' _Sample_label $sample_1 save_ save_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label $sample_1 save_ save_HNCACO_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACO _Sample_label $sample_1 save_ save_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label $sample_1 save_ save_HNCOCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNCOCA _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units temperature 307 1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.0 external indirect . . . 0.25144952 $citation_1 $citation_1 DSS H 1 'methyl protons' ppm 0.0 external direct . . . 1.0 $citation_1 $citation_1 DSS N 15 'methyl protons' ppm 0.0 external indirect . . . 0.10132905 $citation_1 $citation_1 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '1H15N HSQC' HNCA HNCACO HNCO HNCOCA stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name Ufd1 _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 4 4 GLY H H 7.842 0.020 1 2 4 4 GLY HA2 H 3.942 0.020 2 3 4 4 GLY N N 110.849 0.400 1 4 6 6 SER H H 8.064 0.020 1 5 6 6 SER HA H 4.167 0.020 1 6 6 6 SER N N 122.252 0.400 1 7 8 8 PHE H H 8.294 0.020 1 8 8 8 PHE HB2 H 3.193 0.020 2 9 8 8 PHE C C 176.575 0.400 1 10 8 8 PHE CA C 57.480 0.400 1 11 8 8 PHE N N 122.879 0.400 1 12 9 9 GLY H H 8.321 0.020 1 13 9 9 GLY HA2 H 3.989 0.020 2 14 9 9 GLY C C 174.865 0.400 1 15 9 9 GLY CA C 44.873 0.400 1 16 9 9 GLY N N 111.754 0.400 1 17 10 10 GLY H H 8.029 0.020 1 18 10 10 GLY HA2 H 4.035 0.020 2 19 10 10 GLY C C 175.029 0.400 1 20 10 10 GLY CA C 44.801 0.400 1 21 10 10 GLY N N 109.385 0.400 1 22 11 11 GLY H H 8.305 0.020 1 23 11 11 GLY HA2 H 4.048 0.020 2 24 11 11 GLY C C 174.428 0.400 1 25 11 11 GLY CA C 44.797 0.400 1 26 11 11 GLY N N 109.664 0.400 1 27 12 12 ASN H H 8.374 0.020 1 28 12 12 ASN C C 175.951 0.400 1 29 12 12 ASN CA C 52.850 0.400 1 30 12 12 ASN N N 119.494 0.400 1 31 13 13 GLY H H 8.379 0.020 1 32 13 13 GLY HA2 H 3.929 0.020 2 33 13 13 GLY C C 174.078 0.400 1 34 13 13 GLY CA C 44.829 0.400 1 35 13 13 GLY N N 109.859 0.400 1 36 14 14 PHE H H 8.250 0.020 1 37 14 14 PHE HA H 4.720 0.020 1 38 14 14 PHE HB2 H 3.201 0.020 2 39 14 14 PHE HB3 H 3.082 0.020 2 40 14 14 PHE C C 175.990 0.400 1 41 14 14 PHE CA C 57.222 0.400 1 42 14 14 PHE N N 115.332 0.400 1 43 15 15 VAL H H 8.018 0.020 1 44 15 15 VAL HA H 4.137 0.020 1 45 15 15 VAL HB H 2.089 0.020 1 46 15 15 VAL HG1 H 0.985 0.020 1 47 15 15 VAL C C 175.625 0.400 1 48 15 15 VAL CA C 61.633 0.400 1 49 15 15 VAL CB C 32.300 0.400 1 50 15 15 VAL CG1 C 20.353 0.400 1 51 15 15 VAL N N 122.159 0.400 1 52 16 16 ASN H H 8.424 0.020 1 53 16 16 ASN HA H 4.780 0.020 1 54 16 16 ASN HB2 H 2.851 0.020 2 55 16 16 ASN HB3 H 2.781 0.020 2 56 16 16 ASN C C 174.844 0.400 1 57 16 16 ASN CA C 52.650 0.400 1 58 16 16 ASN CB C 38.400 0.400 1 59 16 16 ASN N N 122.793 0.400 1 60 17 17 MET H H 8.235 0.020 1 61 17 17 MET HA H 4.857 0.020 1 62 17 17 MET HB2 H 2.022 0.020 2 63 17 17 MET HB3 H 2.144 0.020 2 64 17 17 MET HG2 H 2.687 0.020 2 65 17 17 MET HG3 H 2.602 0.020 2 66 17 17 MET C C 174.325 0.400 1 67 17 17 MET CA C 52.790 0.400 1 68 17 17 MET CB C 32.122 0.400 1 69 17 17 MET N N 122.942 0.400 1 70 18 18 PRO HA H 4.540 0.020 1 71 18 18 PRO HB2 H 2.408 0.020 2 72 18 18 PRO HB3 H 2.049 0.020 2 73 18 18 PRO HG2 H 2.122 0.020 2 74 18 18 PRO HG3 H 2.076 0.020 2 75 18 18 PRO HD2 H 3.767 0.020 2 76 18 18 PRO HD3 H 3.888 0.020 2 77 18 18 PRO C C 177.059 0.400 1 78 18 18 PRO CA C 62.665 0.400 1 79 18 18 PRO CB C 31.480 0.400 1 80 18 18 PRO CG C 26.919 0.400 1 81 18 18 PRO CD C 50.076 0.400 1 82 19 19 GLN H H 8.566 0.020 1 83 19 19 GLN HA H 4.516 0.020 1 84 19 19 GLN HB2 H 2.077 0.020 2 85 19 19 GLN HB3 H 2.272 0.020 2 86 19 19 GLN HG2 H 2.508 0.020 2 87 19 19 GLN C C 175.592 0.400 1 88 19 19 GLN CA C 55.057 0.400 1 89 19 19 GLN CB C 29.704 0.400 1 90 19 19 GLN CG C 33.820 0.400 1 91 19 19 GLN N N 120.791 0.400 1 92 20 20 THR H H 8.030 0.020 1 93 20 20 THR HA H 4.547 0.020 1 94 20 20 THR HB H 4.198 0.020 1 95 20 20 THR HG2 H 1.281 0.020 1 96 20 20 THR C C 173.374 0.400 1 97 20 20 THR CA C 60.374 0.400 1 98 20 20 THR CB C 70.200 0.400 1 99 20 20 THR CG2 C 21.137 0.400 1 100 20 20 THR N N 114.582 0.400 1 101 21 21 PHE H H 8.382 0.020 1 102 21 21 PHE HA H 4.739 0.020 1 103 21 21 PHE HB2 H 3.210 0.020 2 104 21 21 PHE HB3 H 2.928 0.020 2 105 21 21 PHE HD1 H 7.316 0.020 1 106 21 21 PHE HE1 H 7.378 0.020 1 107 21 21 PHE C C 174.208 0.400 1 108 21 21 PHE CA C 56.817 0.400 1 109 21 21 PHE CB C 41.200 0.400 1 110 21 21 PHE N N 125.699 0.400 1 111 22 22 GLU H H 8.264 0.020 1 112 22 22 GLU HA H 5.015 0.020 1 113 22 22 GLU HB2 H 1.850 0.020 2 114 22 22 GLU HB3 H 1.903 0.020 2 115 22 22 GLU HG2 H 1.914 0.020 2 116 22 22 GLU HG3 H 1.951 0.020 2 117 22 22 GLU C C 174.208 0.400 1 118 22 22 GLU CA C 55.464 0.400 1 119 22 22 GLU CB C 31.430 0.400 1 120 22 22 GLU CG C 36.050 0.400 1 121 22 22 GLU N N 130.272 0.400 1 122 23 23 GLU H H 8.393 0.020 1 123 23 23 GLU HA H 4.437 0.020 1 124 23 23 GLU HB2 H 1.381 0.020 2 125 23 23 GLU HB3 H 1.560 0.020 2 126 23 23 GLU HG2 H 1.800 0.020 2 127 23 23 GLU HG3 H 1.555 0.020 2 128 23 23 GLU C C 173.731 0.400 1 129 23 23 GLU CA C 53.869 0.400 1 130 23 23 GLU CB C 34.280 0.400 1 131 23 23 GLU CG C 35.320 0.400 1 132 23 23 GLU N N 125.678 0.400 1 133 24 24 PHE H H 8.495 0.020 1 134 24 24 PHE HA H 5.453 0.020 1 135 24 24 PHE HB2 H 2.774 0.020 2 136 24 24 PHE HB3 H 2.815 0.020 2 137 24 24 PHE HD1 H 7.114 0.020 1 138 24 24 PHE HE1 H 7.370 0.020 1 139 24 24 PHE C C 175.661 0.400 1 140 24 24 PHE CA C 56.279 0.400 1 141 24 24 PHE CB C 40.925 0.400 1 142 24 24 PHE N N 120.192 0.400 1 143 25 25 PHE H H 8.927 0.020 1 144 25 25 PHE HA H 4.673 0.020 1 145 25 25 PHE HB2 H 2.833 0.020 2 146 25 25 PHE HB3 H 2.905 0.020 2 147 25 25 PHE HD1 H 6.918 0.020 1 148 25 25 PHE HE1 H 6.918 0.020 1 149 25 25 PHE C C 175.088 0.400 1 150 25 25 PHE CA C 55.941 0.400 1 151 25 25 PHE CB C 38.802 0.400 1 152 25 25 PHE N N 118.475 0.400 1 153 26 26 ARG H H 8.548 0.020 1 154 26 26 ARG HA H 4.833 0.020 1 155 26 26 ARG HB2 H 2.052 0.020 2 156 26 26 ARG HG2 H 1.600 0.020 2 157 26 26 ARG HG3 H 1.980 0.020 2 158 26 26 ARG HD2 H 3.264 0.020 2 159 26 26 ARG HD3 H 3.213 0.020 2 160 26 26 ARG C C 175.512 0.400 1 161 26 26 ARG CA C 55.125 0.400 1 162 26 26 ARG CB C 31.100 0.400 1 163 26 26 ARG CG C 27.100 0.400 1 164 26 26 ARG CD C 42.900 0.400 1 165 26 26 ARG N N 122.233 0.400 1 166 27 27 CYS H H 8.693 0.020 1 167 27 27 CYS HA H 5.280 0.020 1 168 27 27 CYS HB2 H 2.559 0.020 2 169 27 27 CYS HB3 H 2.385 0.020 2 170 27 27 CYS C C 172.740 0.400 1 171 27 27 CYS CA C 55.416 0.400 1 172 27 27 CYS CB C 30.396 0.400 1 173 27 27 CYS N N 122.593 0.400 1 174 28 28 TYR H H 8.684 0.020 1 175 28 28 TYR HA H 4.727 0.020 1 176 28 28 TYR HB2 H 2.554 0.020 2 177 28 28 TYR HB3 H 2.396 0.020 2 178 28 28 TYR HD1 H 7.080 0.020 1 179 28 28 TYR HE1 H 6.645 0.020 1 180 28 28 TYR CA C 55.376 0.400 1 181 28 28 TYR N N 124.524 0.400 1 182 29 29 PRO HA H 5.556 0.020 1 183 29 29 PRO HB2 H 2.576 0.020 2 184 29 29 PRO HG3 H 1.750 0.020 2 185 29 29 PRO HD3 H 4.459 0.020 2 186 29 29 PRO C C 178.791 0.400 1 187 29 29 PRO CA C 61.452 0.400 1 188 29 29 PRO CB C 31.232 0.400 1 189 29 29 PRO CG C 27.282 0.400 1 190 29 29 PRO CD C 50.147 0.400 1 191 30 30 ILE H H 7.920 0.020 1 192 30 30 ILE HA H 3.444 0.020 1 193 30 30 ILE HB H 1.739 0.020 1 194 30 30 ILE HG12 H 1.505 0.020 2 195 30 30 ILE HG13 H 1.429 0.020 2 196 30 30 ILE HG2 H 0.900 0.020 1 197 30 30 ILE HD1 H 0.857 0.020 1 198 30 30 ILE C C 176.650 0.400 1 199 30 30 ILE CA C 63.942 0.400 1 200 30 30 ILE CB C 38.044 0.400 1 201 30 30 ILE CG1 C 29.551 0.400 1 202 30 30 ILE CG2 C 16.884 0.400 1 203 30 30 ILE CD1 C 12.832 0.400 1 204 30 30 ILE N N 124.112 0.400 1 205 31 31 ALA H H 8.901 0.020 1 206 31 31 ALA HA H 4.150 0.020 1 207 31 31 ALA HB H 1.489 0.020 1 208 31 31 ALA C C 179.223 0.400 1 209 31 31 ALA CA C 53.958 0.400 1 210 31 31 ALA CB C 18.856 0.400 1 211 31 31 ALA N N 119.565 0.400 1 212 32 32 MET H H 8.057 0.020 1 213 32 32 MET HA H 4.398 0.020 1 214 32 32 MET C C 176.618 0.400 1 215 32 32 MET CA C 56.055 0.400 1 216 32 32 MET N N 113.597 0.400 1 217 33 33 MET H H 7.943 0.020 1 218 33 33 MET HB3 H 1.427 0.020 2 219 33 33 MET HG3 H 0.066 0.020 2 220 33 33 MET HE H 0.603 0.020 1 221 33 33 MET C C 176.444 0.400 1 222 33 33 MET CA C 56.258 0.400 1 223 33 33 MET CG C 32.446 0.400 1 224 33 33 MET CE C 15.500 0.400 1 225 33 33 MET N N 122.138 0.400 1 226 34 34 ASN H H 8.540 0.020 1 227 34 34 ASN HA H 4.419 0.020 1 228 34 34 ASN HB2 H 2.705 0.020 2 229 34 34 ASN HB3 H 3.035 0.020 2 230 34 34 ASN C C 175.256 0.400 1 231 34 34 ASN CA C 53.247 0.400 1 232 34 34 ASN CB C 38.366 0.400 1 233 34 34 ASN N N 121.694 0.400 1 234 35 35 ASP H H 8.660 0.020 1 235 35 35 ASP HA H 4.178 0.020 1 236 35 35 ASP HB2 H 2.802 0.020 2 237 35 35 ASP HB3 H 2.656 0.020 2 238 35 35 ASP C C 177.537 0.400 1 239 35 35 ASP CA C 56.564 0.400 1 240 35 35 ASP CB C 40.496 0.400 1 241 35 35 ASP N N 121.056 0.400 1 242 36 36 ARG H H 8.468 0.020 1 243 36 36 ARG HA H 4.179 0.020 1 244 36 36 ARG HB2 H 1.927 0.020 2 245 36 36 ARG HB3 H 1.905 0.020 2 246 36 36 ARG HG2 H 1.712 0.020 2 247 36 36 ARG HG3 H 1.671 0.020 2 248 36 36 ARG HD2 H 3.259 0.020 2 249 36 36 ARG C C 177.934 0.400 1 250 36 36 ARG CA C 57.769 0.400 1 251 36 36 ARG CB C 29.500 0.400 1 252 36 36 ARG CG C 26.800 0.400 1 253 36 36 ARG CD C 42.100 0.400 1 254 36 36 ARG N N 118.349 0.400 1 255 37 37 ILE H H 7.169 0.020 1 256 37 37 ILE HA H 4.443 0.020 1 257 37 37 ILE HB H 1.799 0.020 1 258 37 37 ILE HG2 H 0.873 0.020 1 259 37 37 ILE HD1 H 0.678 0.020 1 260 37 37 ILE C C 175.615 0.400 1 261 37 37 ILE CA C 60.132 0.400 1 262 37 37 ILE CB C 39.700 0.400 1 263 37 37 ILE CG2 C 17.127 0.400 1 264 37 37 ILE CD1 C 13.253 0.400 1 265 37 37 ILE N N 109.733 0.400 1 266 38 38 ARG H H 7.649 0.020 1 267 38 38 ARG HA H 3.763 0.020 1 268 38 38 ARG HB2 H 1.441 0.020 2 269 38 38 ARG HB3 H 1.591 0.020 2 270 38 38 ARG HG2 H 1.591 0.020 2 271 38 38 ARG C C 176.208 0.400 1 272 38 38 ARG CA C 57.576 0.400 1 273 38 38 ARG N N 123.251 0.400 1 274 39 39 LYS H H 5.952 0.020 1 275 39 39 LYS HA H 4.723 0.020 1 276 39 39 LYS HB2 H 2.006 0.020 2 277 39 39 LYS HB3 H 1.801 0.020 2 278 39 39 LYS HG3 H 1.796 0.020 2 279 39 39 LYS HD2 H 1.555 0.020 2 280 39 39 LYS HD3 H 1.464 0.020 2 281 39 39 LYS HE2 H 3.098 0.020 2 282 39 39 LYS C C 176.153 0.400 1 283 39 39 LYS CA C 53.361 0.400 1 284 39 39 LYS CB C 32.100 0.400 1 285 39 39 LYS CG C 28.340 0.400 1 286 39 39 LYS CD C 23.800 0.400 1 287 39 39 LYS CE C 41.700 0.400 1 288 39 39 LYS N N 126.038 0.400 1 289 40 40 ASP H H 8.696 0.020 1 290 40 40 ASP HA H 4.155 0.020 1 291 40 40 ASP HB2 H 2.826 0.020 2 292 40 40 ASP HB3 H 2.608 0.020 2 293 40 40 ASP C C 179.186 0.400 1 294 40 40 ASP CA C 57.844 0.400 1 295 40 40 ASP CB C 40.200 0.400 1 296 40 40 ASP N N 125.309 0.400 1 297 41 41 ASP H H 8.941 0.020 1 298 41 41 ASP HA H 4.669 0.020 1 299 41 41 ASP HB2 H 2.827 0.020 2 300 41 41 ASP HB3 H 2.926 0.020 2 301 41 41 ASP C C 178.918 0.400 1 302 41 41 ASP CA C 55.742 0.400 1 303 41 41 ASP CB C 39.151 0.400 1 304 41 41 ASP N N 117.518 0.400 1 305 42 42 ALA H H 7.957 0.020 1 306 42 42 ALA HA H 4.380 0.020 1 307 42 42 ALA HB H 1.741 0.020 1 308 42 42 ALA C C 179.793 0.400 1 309 42 42 ALA CA C 52.945 0.400 1 310 42 42 ALA CB C 17.969 0.400 1 311 42 42 ALA N N 123.590 0.400 1 312 43 43 ASN H H 7.972 0.020 1 313 43 43 ASN HA H 4.479 0.020 1 314 43 43 ASN HB2 H 2.079 0.020 2 315 43 43 ASN HB3 H 2.336 0.020 2 316 43 43 ASN C C 174.234 0.400 1 317 43 43 ASN CA C 55.502 0.400 1 318 43 43 ASN CB C 39.674 0.400 1 319 43 43 ASN N N 117.719 0.400 1 320 44 44 PHE H H 7.385 0.020 1 321 44 44 PHE HA H 5.743 0.020 1 322 44 44 PHE HB2 H 3.055 0.020 2 323 44 44 PHE HB3 H 3.976 0.020 2 324 44 44 PHE HD1 H 7.377 0.020 1 325 44 44 PHE HE1 H 7.115 0.020 1 326 44 44 PHE C C 175.062 0.400 1 327 44 44 PHE CA C 55.015 0.400 1 328 44 44 PHE CB C 37.954 0.400 1 329 44 44 PHE N N 118.615 0.400 1 330 45 45 GLY H H 7.082 0.020 1 331 45 45 GLY HA2 H 3.616 0.020 2 332 45 45 GLY HA3 H 4.161 0.020 2 333 45 45 GLY C C 173.192 0.400 1 334 45 45 GLY CA C 43.500 0.400 1 335 45 45 GLY N N 105.607 0.400 1 336 46 46 GLY H H 7.544 0.020 1 337 46 46 GLY HA2 H 3.983 0.020 2 338 46 46 GLY HA3 H 4.950 0.020 2 339 46 46 GLY C C 175.359 0.400 1 340 46 46 GLY CA C 43.545 0.400 1 341 46 46 GLY N N 104.757 0.400 1 342 47 47 LYS H H 8.286 0.020 1 343 47 47 LYS HA H 4.837 0.020 1 344 47 47 LYS C C 174.980 0.400 1 345 47 47 LYS CA C 53.760 0.400 1 346 47 47 LYS N N 121.647 0.400 1 347 48 48 ILE H H 8.360 0.020 1 348 48 48 ILE HA H 4.785 0.020 1 349 48 48 ILE HB H 2.123 0.020 1 350 48 48 ILE HG13 H 1.329 0.020 2 351 48 48 ILE HG2 H 0.738 0.020 1 352 48 48 ILE HD1 H 0.262 0.020 1 353 48 48 ILE CA C 58.900 0.400 1 354 48 48 ILE CB C 38.323 0.400 1 355 48 48 ILE CG1 C 23.120 0.400 1 356 48 48 ILE CG2 C 17.413 0.400 1 357 48 48 ILE CD1 C 12.369 0.400 1 358 48 48 ILE N N 115.433 0.400 1 359 49 49 PHE H H 8.494 0.020 1 360 49 49 PHE HA H 5.329 0.020 1 361 49 49 PHE HB2 H 2.892 0.020 2 362 49 49 PHE HB3 H 3.201 0.020 2 363 49 49 PHE HD1 H 7.315 0.020 1 364 49 49 PHE HE1 H 7.243 0.020 1 365 49 49 PHE HZ H 7.384 0.020 1 366 49 49 PHE CA C 56.600 0.400 1 367 49 49 PHE CB C 40.950 0.400 1 368 49 49 PHE N N 116.908 0.400 1 369 50 50 LEU H H 6.769 0.020 1 370 50 50 LEU HA H 4.808 0.020 1 371 50 50 LEU HB2 H 1.177 0.020 2 372 50 50 LEU HB3 H 1.398 0.020 2 373 50 50 LEU HD1 H 0.084 0.020 1 374 50 50 LEU HD2 H 0.185 0.020 1 375 50 50 LEU CA C 51.400 0.400 1 376 50 50 LEU CB C 45.018 0.400 1 377 50 50 LEU CD1 C 24.698 0.400 1 378 50 50 LEU CD2 C 23.241 0.400 1 379 50 50 LEU N N 123.216 0.400 1 380 51 51 PRO HA H 5.467 0.020 1 381 51 51 PRO HD3 H 3.327 0.020 2 382 51 51 PRO CA C 61.488 0.400 1 383 51 51 PRO CD C 50.828 0.400 1 384 52 52 PRO HA H 4.546 0.020 1 385 52 52 PRO HB2 H 2.394 0.020 2 386 52 52 PRO HB3 H 2.161 0.020 2 387 52 52 PRO HG2 H 2.394 0.020 2 388 52 52 PRO HG3 H 2.562 0.020 2 389 52 52 PRO HD2 H 4.130 0.020 2 390 52 52 PRO HD3 H 4.048 0.020 2 391 52 52 PRO C C 180.437 0.400 1 392 52 52 PRO CA C 65.437 0.400 1 393 52 52 PRO CB C 31.410 0.400 1 394 52 52 PRO CG C 27.150 0.400 1 395 52 52 PRO CD C 50.793 0.400 1 396 53 53 SER H H 8.949 0.020 1 397 53 53 SER HA H 4.286 0.020 1 398 53 53 SER HB2 H 4.043 0.020 2 399 53 53 SER C C 177.891 0.400 1 400 53 53 SER CA C 60.594 0.400 1 401 53 53 SER CB C 60.339 0.400 1 402 53 53 SER N N 114.479 0.400 1 403 54 54 ALA H H 8.013 0.020 1 404 54 54 ALA HA H 4.513 0.020 1 405 54 54 ALA HB H 1.856 0.020 1 406 54 54 ALA C C 178.801 0.400 1 407 54 54 ALA CA C 54.497 0.400 1 408 54 54 ALA CB C 17.785 0.400 1 409 54 54 ALA N N 126.187 0.400 1 410 55 55 LEU H H 6.803 0.020 1 411 55 55 LEU HA H 3.558 0.020 1 412 55 55 LEU HB2 H 1.628 0.020 2 413 55 55 LEU HB3 H 1.884 0.020 2 414 55 55 LEU HG H -0.089 0.020 1 415 55 55 LEU HD1 H 0.537 0.020 1 416 55 55 LEU HD2 H 0.719 0.020 1 417 55 55 LEU C C 179.304 0.400 1 418 55 55 LEU CA C 57.114 0.400 1 419 55 55 LEU CB C 39.017 0.400 1 420 55 55 LEU CG C 38.621 0.400 1 421 55 55 LEU CD1 C 21.162 0.400 1 422 55 55 LEU CD2 C 24.602 0.400 1 423 55 55 LEU N N 120.068 0.400 1 424 56 56 SER H H 7.503 0.020 1 425 56 56 SER HA H 4.203 0.020 1 426 56 56 SER HB3 H 4.043 0.020 2 427 56 56 SER C C 177.195 0.400 1 428 56 56 SER CA C 61.137 0.400 1 429 56 56 SER CB C 61.281 0.400 1 430 56 56 SER N N 115.133 0.400 1 431 57 57 LYS H H 7.601 0.020 1 432 57 57 LYS HA H 4.244 0.020 1 433 57 57 LYS HB3 H 2.222 0.020 2 434 57 57 LYS HG2 H 1.814 0.020 2 435 57 57 LYS HG3 H 1.717 0.020 2 436 57 57 LYS HD2 H 2.235 0.020 2 437 57 57 LYS HE2 H 3.080 0.020 2 438 57 57 LYS C C 179.185 0.400 1 439 57 57 LYS CA C 59.165 0.400 1 440 57 57 LYS CB C 32.200 0.400 1 441 57 57 LYS CG C 25.500 0.400 1 442 57 57 LYS CE C 41.715 0.400 1 443 57 57 LYS N N 122.025 0.400 1 444 58 58 LEU H H 8.631 0.020 1 445 58 58 LEU HA H 3.971 0.020 1 446 58 58 LEU HB2 H 1.848 0.020 2 447 58 58 LEU HG H 1.456 0.020 1 448 58 58 LEU HD1 H 0.856 0.020 1 449 58 58 LEU HD2 H 0.708 0.020 1 450 58 58 LEU C C 179.669 0.400 1 451 58 58 LEU CA C 57.971 0.400 1 452 58 58 LEU CB C 41.280 0.400 1 453 58 58 LEU CD1 C 25.778 0.400 1 454 58 58 LEU CD2 C 23.616 0.400 1 455 58 58 LEU N N 120.783 0.400 1 456 59 59 SER H H 8.366 0.020 1 457 59 59 SER HA H 4.384 0.020 1 458 59 59 SER HB2 H 4.008 0.020 2 459 59 59 SER C C 177.269 0.400 1 460 59 59 SER CA C 60.877 0.400 1 461 59 59 SER CB C 62.100 0.400 1 462 59 59 SER N N 113.987 0.400 1 463 60 60 MET H H 7.713 0.020 1 464 60 60 MET HA H 4.453 0.020 1 465 60 60 MET HB2 H 2.328 0.020 2 466 60 60 MET HB3 H 2.792 0.020 2 467 60 60 MET HG2 H 2.803 0.020 2 468 60 60 MET C C 177.408 0.400 1 469 60 60 MET CA C 56.809 0.400 1 470 60 60 MET CB C 31.674 0.400 1 471 60 60 MET N N 122.141 0.400 1 472 61 61 LEU H H 7.598 0.020 1 473 61 61 LEU HA H 4.443 0.020 1 474 61 61 LEU HB2 H 1.969 0.020 2 475 61 61 LEU HG H 1.686 0.020 1 476 61 61 LEU HD1 H 1.017 0.020 1 477 61 61 LEU HD2 H 0.911 0.020 1 478 61 61 LEU C C 176.405 0.400 1 479 61 61 LEU CA C 54.152 0.400 1 480 61 61 LEU CB C 42.400 0.400 1 481 61 61 LEU CD1 C 26.007 0.400 1 482 61 61 LEU CD2 C 22.218 0.400 1 483 61 61 LEU N N 119.360 0.400 1 484 62 62 ASN H H 8.187 0.020 1 485 62 62 ASN HA H 4.535 0.020 1 486 62 62 ASN HB2 H 2.831 0.020 2 487 62 62 ASN HB3 H 3.094 0.020 2 488 62 62 ASN C C 174.556 0.400 1 489 62 62 ASN CA C 53.269 0.400 1 490 62 62 ASN CB C 36.830 0.400 1 491 62 62 ASN N N 117.418 0.400 1 492 63 63 ILE H H 7.630 0.020 1 493 63 63 ILE HA H 4.131 0.020 1 494 63 63 ILE HB H 1.807 0.020 1 495 63 63 ILE HG12 H 1.368 0.020 2 496 63 63 ILE HG13 H 1.503 0.020 2 497 63 63 ILE HG2 H 0.949 0.020 1 498 63 63 ILE HD1 H 0.945 0.020 1 499 63 63 ILE C C 175.949 0.400 1 500 63 63 ILE CA C 59.948 0.400 1 501 63 63 ILE CB C 37.400 0.400 1 502 63 63 ILE CG1 C 27.300 0.400 1 503 63 63 ILE CG2 C 17.319 0.400 1 504 63 63 ILE CD1 C 12.282 0.400 1 505 63 63 ILE N N 120.439 0.400 1 506 64 64 ARG H H 8.205 0.020 1 507 64 64 ARG HA H 4.371 0.020 1 508 64 64 ARG HB2 H 1.871 0.020 2 509 64 64 ARG HB3 H 1.917 0.020 2 510 64 64 ARG HG2 H 1.731 0.020 1 511 64 64 ARG HG3 H 1.731 0.020 1 512 64 64 ARG HD3 H 3.257 0.020 2 513 64 64 ARG C C 174.898 0.400 1 514 64 64 ARG CA C 55.021 0.400 1 515 64 64 ARG CB C 30.900 0.400 1 516 64 64 ARG CG C 26.450 0.400 1 517 64 64 ARG CD C 42.831 0.400 1 518 64 64 ARG N N 126.842 0.400 1 519 65 65 TYR H H 8.195 0.020 1 520 65 65 TYR HA H 4.520 0.020 1 521 65 65 TYR HB2 H 2.987 0.020 2 522 65 65 TYR HB3 H 3.051 0.020 2 523 65 65 TYR HD1 H 7.299 0.020 1 524 65 65 TYR HE1 H 7.284 0.020 1 525 65 65 TYR CA C 55.368 0.400 1 526 65 65 TYR CB C 38.590 0.400 1 527 65 65 TYR N N 121.210 0.400 1 528 66 66 PRO HA H 4.150 0.020 1 529 66 66 PRO HB2 H 2.056 0.020 2 530 66 66 PRO HB3 H 1.829 0.020 2 531 66 66 PRO HG2 H 1.927 0.020 2 532 66 66 PRO HG3 H 1.906 0.020 2 533 66 66 PRO HD2 H 3.492 0.020 2 534 66 66 PRO HD3 H 3.690 0.020 2 535 66 66 PRO C C 175.200 0.400 1 536 66 66 PRO CA C 61.530 0.400 1 537 66 66 PRO CB C 33.454 0.400 1 538 66 66 PRO CG C 24.228 0.400 1 539 66 66 PRO CD C 49.626 0.400 1 540 67 67 MET H H 8.319 0.020 1 541 67 67 MET HA H 4.162 0.020 1 542 67 67 MET HB2 H 2.360 0.020 2 543 67 67 MET HB3 H 2.313 0.020 2 544 67 67 MET HG2 H 1.956 0.020 2 545 67 67 MET HG3 H 1.820 0.020 2 546 67 67 MET HE H 0.937 0.020 1 547 67 67 MET C C 174.225 0.400 1 548 67 67 MET CA C 56.128 0.400 1 549 67 67 MET CB C 32.353 0.400 1 550 67 67 MET CE C 16.721 0.400 1 551 67 67 MET N N 122.136 0.400 1 552 68 68 LEU H H 8.096 0.020 1 553 68 68 LEU HA H 4.839 0.020 1 554 68 68 LEU HB2 H 1.905 0.020 2 555 68 68 LEU HG H 1.747 0.020 1 556 68 68 LEU HD1 H 0.964 0.020 1 557 68 68 LEU HD2 H 0.815 0.020 1 558 68 68 LEU C C 175.919 0.400 1 559 68 68 LEU CA C 52.519 0.400 1 560 68 68 LEU CB C 43.560 0.400 1 561 68 68 LEU CD1 C 25.978 0.400 1 562 68 68 LEU CD2 C 23.048 0.400 1 563 68 68 LEU N N 124.258 0.400 1 564 69 69 PHE H H 8.695 0.020 1 565 69 69 PHE HA H 5.452 0.020 1 566 69 69 PHE HB2 H 2.338 0.020 2 567 69 69 PHE HB3 H 2.952 0.020 2 568 69 69 PHE HD1 H 6.913 0.020 1 569 69 69 PHE HE1 H 7.298 0.020 1 570 69 69 PHE HZ H 7.382 0.020 1 571 69 69 PHE C C 174.451 0.400 1 572 69 69 PHE CA C 56.097 0.400 1 573 69 69 PHE CB C 42.366 0.400 1 574 69 69 PHE N N 116.985 0.400 1 575 70 70 LYS H H 9.669 0.020 1 576 70 70 LYS HA H 4.632 0.020 1 577 70 70 LYS HB2 H 1.728 0.020 2 578 70 70 LYS HB3 H 1.159 0.020 2 579 70 70 LYS HG2 H 1.171 0.020 2 580 70 70 LYS HD2 H 1.720 0.020 2 581 70 70 LYS HE2 H 3.006 0.020 2 582 70 70 LYS C C 175.195 0.400 1 583 70 70 LYS CA C 54.782 0.400 1 584 70 70 LYS CG C 23.862 0.400 1 585 70 70 LYS CD C 28.761 0.400 1 586 70 70 LYS CE C 40.603 0.400 1 587 70 70 LYS N N 123.940 0.400 1 588 71 71 LEU H H 9.181 0.020 1 589 71 71 LEU HA H 5.095 0.020 1 590 71 71 LEU HB2 H 1.531 0.020 2 591 71 71 LEU HB3 H 1.264 0.020 2 592 71 71 LEU HG H 1.264 0.020 1 593 71 71 LEU HD1 H 0.737 0.020 1 594 71 71 LEU HD2 H 0.729 0.020 1 595 71 71 LEU C C 174.413 0.400 1 596 71 71 LEU CA C 53.777 0.400 1 597 71 71 LEU CB C 41.600 0.400 1 598 71 71 LEU CD1 C 25.400 0.400 1 599 71 71 LEU CD2 C 27.308 0.400 1 600 71 71 LEU N N 131.690 0.400 1 601 72 72 THR H H 8.955 0.020 1 602 72 72 THR HA H 4.943 0.020 1 603 72 72 THR HB H 4.030 0.020 1 604 72 72 THR HG2 H 1.038 0.020 1 605 72 72 THR C C 174.497 0.400 1 606 72 72 THR CA C 60.954 0.400 1 607 72 72 THR CB C 70.029 0.400 1 608 72 72 THR CG2 C 20.100 0.400 1 609 72 72 THR N N 118.403 0.400 1 610 73 73 ALA H H 8.976 0.020 1 611 73 73 ALA HA H 4.750 0.020 1 612 73 73 ALA HB H 1.538 0.020 1 613 73 73 ALA C C 177.194 0.400 1 614 73 73 ALA CA C 50.426 0.400 1 615 73 73 ALA CB C 19.593 0.400 1 616 73 73 ALA N N 132.074 0.400 1 617 74 74 ASN H H 8.450 0.020 1 618 74 74 ASN HA H 4.470 0.020 1 619 74 74 ASN HB2 H 2.844 0.020 2 620 74 74 ASN C C 177.490 0.400 1 621 74 74 ASN CA C 56.350 0.400 1 622 74 74 ASN CB C 38.926 0.400 1 623 74 74 ASN N N 125.590 0.400 1 624 75 75 GLU H H 9.324 0.020 1 625 75 75 GLU HA H 4.226 0.020 1 626 75 75 GLU HB2 H 2.148 0.020 2 627 75 75 GLU HB3 H 2.209 0.020 2 628 75 75 GLU HG2 H 2.460 0.020 2 629 75 75 GLU HG3 H 2.412 0.020 2 630 75 75 GLU C C 177.832 0.400 1 631 75 75 GLU CA C 58.859 0.400 1 632 75 75 GLU CB C 30.029 0.400 1 633 75 75 GLU CG C 36.758 0.400 1 634 75 75 GLU N N 117.279 0.400 1 635 76 76 THR H H 6.969 0.020 1 636 76 76 THR HA H 4.653 0.020 1 637 76 76 THR HB H 4.498 0.020 1 638 76 76 THR HG2 H 1.338 0.020 1 639 76 76 THR C C 176.439 0.400 1 640 76 76 THR CA C 60.226 0.400 1 641 76 76 THR CB C 70.794 0.400 1 642 76 76 THR CG2 C 21.808 0.400 1 643 76 76 THR N N 104.140 0.400 1 644 77 77 GLY H H 8.436 0.020 1 645 77 77 GLY HA2 H 4.220 0.020 2 646 77 77 GLY HA3 H 3.814 0.020 2 647 77 77 GLY C C 174.177 0.400 1 648 77 77 GLY CA C 45.195 0.400 1 649 77 77 GLY N N 112.540 0.400 1 650 78 78 ARG H H 7.550 0.020 1 651 78 78 ARG HA H 4.456 0.020 1 652 78 78 ARG HB2 H 1.909 0.020 2 653 78 78 ARG HB3 H 1.972 0.020 2 654 78 78 ARG HG3 H 1.778 0.020 2 655 78 78 ARG HD2 H 3.422 0.020 2 656 78 78 ARG HD3 H 3.392 0.020 2 657 78 78 ARG C C 174.266 0.400 1 658 78 78 ARG CA C 55.552 0.400 1 659 78 78 ARG CB C 31.393 0.400 1 660 78 78 ARG CG C 26.919 0.400 1 661 78 78 ARG CD C 42.002 0.400 1 662 78 78 ARG N N 121.123 0.400 1 663 79 79 VAL H H 8.043 0.020 1 664 79 79 VAL HA H 5.365 0.020 1 665 79 79 VAL HB H 1.837 0.020 1 666 79 79 VAL HG1 H 0.775 0.020 1 667 79 79 VAL HG2 H 1.031 0.020 1 668 79 79 VAL C C 177.534 0.400 1 669 79 79 VAL CA C 59.591 0.400 1 670 79 79 VAL CB C 35.754 0.400 1 671 79 79 VAL CG1 C 21.732 0.400 1 672 79 79 VAL CG2 C 21.315 0.400 1 673 79 79 VAL N N 121.168 0.400 1 674 80 80 THR H H 8.661 0.020 1 675 80 80 THR HA H 4.569 0.020 1 676 80 80 THR HB H 4.374 0.020 1 677 80 80 THR HG2 H 1.116 0.020 1 678 80 80 THR C C 171.917 0.400 1 679 80 80 THR CA C 60.441 0.400 1 680 80 80 THR CB C 67.008 0.400 1 681 80 80 THR CG2 C 19.600 0.400 1 682 80 80 THR N N 121.049 0.400 1 683 81 81 HIS H H 9.424 0.020 1 684 81 81 HIS HA H 5.982 0.020 1 685 81 81 HIS HB2 H 2.736 0.020 2 686 81 81 HIS HB3 H 3.164 0.020 2 687 81 81 HIS HD2 H 6.922 0.020 1 688 81 81 HIS C C 175.178 0.400 1 689 81 81 HIS CA C 54.521 0.400 1 690 81 81 HIS CB C 32.990 0.400 1 691 81 81 HIS N N 119.059 0.400 1 692 82 82 GLY H H 8.828 0.020 1 693 82 82 GLY HA2 H 3.942 0.020 2 694 82 82 GLY HA3 H 4.915 0.020 2 695 82 82 GLY C C 171.795 0.400 1 696 82 82 GLY CA C 45.393 0.400 1 697 82 82 GLY N N 106.392 0.400 1 698 83 83 GLY H H 7.273 0.020 1 699 83 83 GLY HA2 H 4.129 0.020 2 700 83 83 GLY HA3 H 5.294 0.020 2 701 83 83 GLY C C 172.526 0.400 1 702 83 83 GLY CA C 42.504 0.400 1 703 83 83 GLY N N 105.764 0.400 1 704 84 84 VAL H H 9.111 0.020 1 705 84 84 VAL HA H 4.582 0.020 1 706 84 84 VAL HB H 1.626 0.020 1 707 84 84 VAL HG1 H 0.830 0.020 1 708 84 84 VAL HG2 H 0.128 0.020 1 709 84 84 VAL C C 173.219 0.400 1 710 84 84 VAL CA C 58.726 0.400 1 711 84 84 VAL CB C 34.390 0.400 1 712 84 84 VAL CG1 C 19.484 0.400 1 713 84 84 VAL CG2 C 20.655 0.400 1 714 84 84 VAL N N 118.441 0.400 1 715 85 85 LEU H H 8.813 0.020 1 716 85 85 LEU HA H 4.372 0.020 1 717 85 85 LEU HB2 H 0.861 0.020 2 718 85 85 LEU HB3 H 0.705 0.020 2 719 85 85 LEU HG H 1.463 0.020 1 720 85 85 LEU HD1 H 0.886 0.020 1 721 85 85 LEU HD2 H 0.932 0.020 1 722 85 85 LEU C C 175.813 0.400 1 723 85 85 LEU CA C 55.277 0.400 1 724 85 85 LEU CB C 41.700 0.400 1 725 85 85 LEU CG C 27.500 0.400 1 726 85 85 LEU CD1 C 24.021 0.400 1 727 85 85 LEU CD2 C 24.620 0.400 1 728 85 85 LEU N N 129.706 0.400 1 729 86 86 GLU H H 6.440 0.020 1 730 86 86 GLU HA H 4.743 0.020 1 731 86 86 GLU HB2 H 2.030 0.020 2 732 86 86 GLU HG2 H 2.478 0.020 2 733 86 86 GLU HG3 H 2.366 0.020 2 734 86 86 GLU C C 175.944 0.400 1 735 86 86 GLU CA C 54.272 0.400 1 736 86 86 GLU CB C 36.129 0.400 1 737 86 86 GLU CG C 36.790 0.400 1 738 86 86 GLU N N 113.629 0.400 1 739 87 87 PHE H H 9.478 0.020 1 740 87 87 PHE HA H 5.427 0.020 1 741 87 87 PHE HB2 H 2.938 0.020 2 742 87 87 PHE HB3 H 2.958 0.020 2 743 87 87 PHE HD1 H 7.378 0.020 1 744 87 87 PHE HE1 H 7.112 0.020 1 745 87 87 PHE HZ H 7.178 0.020 1 746 87 87 PHE C C 177.211 0.400 1 747 87 87 PHE CA C 56.531 0.400 1 748 87 87 PHE CB C 36.200 0.400 1 749 87 87 PHE N N 125.802 0.400 1 750 88 88 ILE H H 6.441 0.020 1 751 88 88 ILE HA H 4.845 0.020 1 752 88 88 ILE HB H 2.320 0.020 1 753 88 88 ILE HG12 H 1.530 0.020 2 754 88 88 ILE HG2 H 0.997 0.020 1 755 88 88 ILE HD1 H 0.768 0.020 1 756 88 88 ILE C C 176.148 0.400 1 757 88 88 ILE CA C 59.363 0.400 1 758 88 88 ILE CB C 39.050 0.400 1 759 88 88 ILE CG2 C 17.141 0.400 1 760 88 88 ILE CD1 C 13.711 0.400 1 761 88 88 ILE N N 108.862 0.400 1 762 89 89 ALA H H 7.957 0.020 1 763 89 89 ALA HA H 4.117 0.020 1 764 89 89 ALA HB H 1.212 0.020 1 765 89 89 ALA C C 177.261 0.400 1 766 89 89 ALA CA C 52.044 0.400 1 767 89 89 ALA CB C 19.794 0.400 1 768 89 89 ALA N N 125.058 0.400 1 769 90 90 GLU H H 8.889 0.020 1 770 90 90 GLU HA H 4.250 0.020 1 771 90 90 GLU HB2 H 2.315 0.020 2 772 90 90 GLU HG2 H 2.404 0.020 2 773 90 90 GLU HG3 H 2.600 0.020 2 774 90 90 GLU C C 176.198 0.400 1 775 90 90 GLU CA C 57.797 0.400 1 776 90 90 GLU CB C 28.905 0.400 1 777 90 90 GLU CG C 35.799 0.400 1 778 90 90 GLU N N 119.591 0.400 1 779 91 91 GLU H H 8.408 0.020 1 780 91 91 GLU HA H 4.120 0.020 1 781 91 91 GLU HB2 H 2.215 0.020 2 782 91 91 GLU HB3 H 2.007 0.020 2 783 91 91 GLU HG2 H 2.608 0.020 2 784 91 91 GLU HG3 H 2.602 0.020 2 785 91 91 GLU C C 178.439 0.400 1 786 91 91 GLU CA C 57.654 0.400 1 787 91 91 GLU CB C 28.300 0.400 1 788 91 91 GLU CG C 35.180 0.400 1 789 91 91 GLU N N 118.486 0.400 1 790 92 92 GLY H H 8.847 0.020 1 791 92 92 GLY HA2 H 4.120 0.020 2 792 92 92 GLY HA3 H 4.545 0.020 2 793 92 92 GLY C C 174.730 0.400 1 794 92 92 GLY CA C 44.650 0.400 1 795 92 92 GLY N N 111.301 0.400 1 796 93 93 ARG H H 8.451 0.020 1 797 93 93 ARG HA H 5.796 0.020 1 798 93 93 ARG HB2 H 2.077 0.020 2 799 93 93 ARG C C 172.391 0.400 1 800 93 93 ARG CA C 54.961 0.400 1 801 93 93 ARG CB C 33.951 0.400 1 802 93 93 ARG CD C 43.569 0.400 1 803 93 93 ARG N N 122.238 0.400 1 804 94 94 VAL H H 8.072 0.020 1 805 94 94 VAL HA H 4.839 0.020 1 806 94 94 VAL HB H 1.460 0.020 1 807 94 94 VAL HG1 H 0.683 0.020 1 808 94 94 VAL HG2 H 0.670 0.020 1 809 94 94 VAL CA C 57.240 0.400 1 810 94 94 VAL CB C 34.470 0.400 1 811 94 94 VAL CG1 C 20.948 0.400 1 812 94 94 VAL CG2 C 21.842 0.400 1 813 94 94 VAL N N 113.583 0.400 1 814 95 95 TYR H H 8.135 0.020 1 815 95 95 TYR HA H 6.200 0.020 1 816 95 95 TYR HB2 H 2.926 0.020 2 817 95 95 TYR HB3 H 2.786 0.020 2 818 95 95 TYR HD1 H 6.927 0.020 1 819 95 95 TYR HE1 H 6.509 0.020 1 820 95 95 TYR CA C 55.650 0.400 1 821 95 95 TYR CB C 41.590 0.400 1 822 95 95 TYR N N 122.545 0.400 1 823 96 96 LEU H H 8.778 0.020 1 824 96 96 LEU HA H 4.780 0.020 1 825 96 96 LEU HG H 1.675 0.020 1 826 96 96 LEU HD1 H 0.661 0.020 1 827 96 96 LEU HD2 H 0.586 0.020 1 828 96 96 LEU CA C 55.950 0.400 1 829 96 96 LEU CG C 28.604 0.400 1 830 96 96 LEU CD1 C 24.855 0.400 1 831 96 96 LEU CD2 C 25.020 0.400 1 832 96 96 LEU N N 123.362 0.400 1 833 97 97 PRO HA H 4.625 0.020 1 834 97 97 PRO HB2 H 1.265 0.020 2 835 97 97 PRO HB3 H 2.945 0.020 2 836 97 97 PRO HG2 H 1.898 0.020 2 837 97 97 PRO HG3 H 2.136 0.020 2 838 97 97 PRO HD2 H 2.975 0.020 2 839 97 97 PRO HD3 H 3.625 0.020 2 840 97 97 PRO C C 177.652 0.400 1 841 97 97 PRO CA C 62.322 0.400 1 842 97 97 PRO CB C 33.046 0.400 1 843 97 97 PRO CG C 27.691 0.400 1 844 97 97 PRO CD C 50.118 0.400 1 845 98 98 GLN H H 8.827 0.020 1 846 98 98 GLN HA H 4.006 0.020 1 847 98 98 GLN HB2 H 2.507 0.020 2 848 98 98 GLN HB3 H 2.709 0.020 2 849 98 98 GLN HG2 H 2.507 0.020 2 850 98 98 GLN HG3 H 2.709 0.020 2 851 98 98 GLN C C 179.951 0.400 1 852 98 98 GLN CA C 58.944 0.400 1 853 98 98 GLN CB C 32.385 0.400 1 854 98 98 GLN CG C 32.385 0.400 1 855 98 98 GLN N N 128.389 0.400 1 856 99 99 TRP H H 10.051 0.020 1 857 99 99 TRP HA H 4.692 0.020 1 858 99 99 TRP HB2 H 3.586 0.020 2 859 99 99 TRP HB3 H 2.720 0.020 2 860 99 99 TRP HD1 H 8.228 0.020 1 861 99 99 TRP HE1 H 10.730 0.020 1 862 99 99 TRP HZ2 H 7.833 0.020 1 863 99 99 TRP HZ3 H 7.153 0.020 1 864 99 99 TRP HH2 H 7.627 0.020 1 865 99 99 TRP C C 179.969 0.400 1 866 99 99 TRP CA C 59.139 0.400 1 867 99 99 TRP CB C 26.432 0.400 1 868 99 99 TRP N N 119.374 0.400 1 869 100 100 MET H H 6.682 0.020 1 870 100 100 MET HA H 3.378 0.020 1 871 100 100 MET HB2 H 1.043 0.020 2 872 100 100 MET HB3 H 1.340 0.020 2 873 100 100 MET HG2 H 1.305 0.020 2 874 100 100 MET HG3 H 1.109 0.020 2 875 100 100 MET HE H 0.568 0.020 1 876 100 100 MET C C 178.170 0.400 1 877 100 100 MET CA C 59.480 0.400 1 878 100 100 MET CB C 33.300 0.400 1 879 100 100 MET CG C 31.500 0.400 1 880 100 100 MET CE C 19.800 0.400 1 881 100 100 MET N N 125.686 0.400 1 882 101 101 MET H H 7.231 0.020 1 883 101 101 MET HA H 3.902 0.020 1 884 101 101 MET HB2 H 2.228 0.020 2 885 101 101 MET HB3 H 2.501 0.020 2 886 101 101 MET C C 178.957 0.400 1 887 101 101 MET CA C 57.519 0.400 1 888 101 101 MET CB C 31.700 0.400 1 889 101 101 MET CG C 30.400 0.400 1 890 101 101 MET N N 119.280 0.400 1 891 102 102 GLU H H 8.121 0.020 1 892 102 102 GLU HA H 4.257 0.020 1 893 102 102 GLU HB2 H 2.318 0.020 2 894 102 102 GLU HG2 H 2.609 0.020 2 895 102 102 GLU HG3 H 2.412 0.020 2 896 102 102 GLU C C 180.652 0.400 1 897 102 102 GLU CA C 58.579 0.400 1 898 102 102 GLU CB C 28.932 0.400 1 899 102 102 GLU CG C 36.400 0.400 1 900 102 102 GLU N N 118.623 0.400 1 901 103 103 THR H H 8.660 0.020 1 902 103 103 THR HA H 4.280 0.020 1 903 103 103 THR HB H 4.560 0.020 1 904 103 103 THR HG2 H 1.732 0.020 1 905 103 103 THR C C 174.756 0.400 1 906 103 103 THR CA C 67.283 0.400 1 907 103 103 THR CB C 69.577 0.400 1 908 103 103 THR CG2 C 21.138 0.400 1 909 103 103 THR N N 120.414 0.400 1 910 104 104 LEU H H 7.907 0.020 1 911 104 104 LEU HA H 4.032 0.020 1 912 104 104 LEU HB2 H 1.329 0.020 2 913 104 104 LEU HB3 H 1.700 0.020 2 914 104 104 LEU HG H 1.660 0.020 1 915 104 104 LEU HD1 H 0.584 0.020 1 916 104 104 LEU HD2 H 0.750 0.020 1 917 104 104 LEU C C 176.552 0.400 1 918 104 104 LEU CA C 55.490 0.400 1 919 104 104 LEU CB C 42.780 0.400 1 920 104 104 LEU CG C 25.700 0.400 1 921 104 104 LEU CD1 C 25.552 0.400 1 922 104 104 LEU CD2 C 22.222 0.400 1 923 104 104 LEU N N 119.567 0.400 1 924 105 105 GLY H H 7.853 0.020 1 925 105 105 GLY HA2 H 3.998 0.020 2 926 105 105 GLY C C 175.205 0.400 1 927 105 105 GLY CA C 45.861 0.400 1 928 105 105 GLY N N 109.443 0.400 1 929 106 106 ILE H H 7.470 0.020 1 930 106 106 ILE HA H 4.800 0.020 1 931 106 106 ILE HB H 2.052 0.020 1 932 106 106 ILE HG12 H 1.273 0.020 2 933 106 106 ILE HG2 H 0.917 0.020 1 934 106 106 ILE HD1 H 0.840 0.020 1 935 106 106 ILE C C 174.582 0.400 1 936 106 106 ILE CA C 58.886 0.400 1 937 106 106 ILE CB C 40.710 0.400 1 938 106 106 ILE CG1 C 25.100 0.400 1 939 106 106 ILE CG2 C 18.572 0.400 1 940 106 106 ILE CD1 C 14.985 0.400 1 941 106 106 ILE N N 111.856 0.400 1 942 107 107 GLN H H 8.033 0.020 1 943 107 107 GLN HA H 4.780 0.020 1 944 107 107 GLN HB2 H 2.240 0.020 2 945 107 107 GLN HB3 H 1.794 0.020 2 946 107 107 GLN HG2 H 2.425 0.020 2 947 107 107 GLN C C 174.000 0.400 1 948 107 107 GLN CA C 52.410 0.400 1 949 107 107 GLN CB C 28.235 0.400 1 950 107 107 GLN CG C 32.794 0.400 1 951 107 107 GLN N N 119.708 0.400 1 952 108 108 PRO HA H 4.323 0.020 1 953 108 108 PRO HB2 H 1.744 0.020 2 954 108 108 PRO HB3 H 2.161 0.020 2 955 108 108 PRO HG2 H 2.002 0.020 2 956 108 108 PRO HG3 H 2.440 0.020 2 957 108 108 PRO HD3 H 4.463 0.020 2 958 108 108 PRO C C 177.441 0.400 1 959 108 108 PRO CA C 63.126 0.400 1 960 108 108 PRO CB C 31.000 0.400 1 961 108 108 PRO CG C 27.600 0.400 1 962 108 108 PRO CD C 49.920 0.400 1 963 109 109 GLY H H 9.021 0.020 1 964 109 109 GLY HA2 H 3.058 0.020 2 965 109 109 GLY C C 174.317 0.400 1 966 109 109 GLY CA C 44.158 0.400 1 967 109 109 GLY N N 114.921 0.400 1 968 110 110 SER H H 7.648 0.020 1 969 110 110 SER HA H 4.410 0.020 1 970 110 110 SER HB2 H 3.951 0.020 2 971 110 110 SER C C 173.007 0.400 1 972 110 110 SER CA C 59.029 0.400 1 973 110 110 SER CB C 63.800 0.400 1 974 110 110 SER N N 117.840 0.400 1 975 111 111 LEU H H 8.655 0.020 1 976 111 111 LEU HA H 4.764 0.020 1 977 111 111 LEU HB2 H 1.594 0.020 2 978 111 111 LEU HG H 1.488 0.020 1 979 111 111 LEU HD1 H 0.831 0.020 1 980 111 111 LEU HD2 H 0.764 0.020 1 981 111 111 LEU C C 176.511 0.400 1 982 111 111 LEU CA C 54.702 0.400 1 983 111 111 LEU CB C 43.510 0.400 1 984 111 111 LEU CG C 26.980 0.400 1 985 111 111 LEU CD1 C 23.761 0.400 1 986 111 111 LEU CD2 C 24.187 0.400 1 987 111 111 LEU N N 124.187 0.400 1 988 112 112 LEU H H 9.387 0.020 1 989 112 112 LEU HA H 4.909 0.020 1 990 112 112 LEU HB2 H 1.330 0.020 2 991 112 112 LEU HB3 H 1.632 0.020 2 992 112 112 LEU HG H 1.514 0.020 1 993 112 112 LEU HD1 H 0.790 0.020 1 994 112 112 LEU HD2 H 0.819 0.020 1 995 112 112 LEU C C 174.668 0.400 1 996 112 112 LEU CA C 52.873 0.400 1 997 112 112 LEU CB C 46.400 0.400 1 998 112 112 LEU CG C 26.087 0.400 1 999 112 112 LEU CD1 C 24.794 0.400 1 1000 112 112 LEU CD2 C 26.503 0.400 1 1001 112 112 LEU N N 128.217 0.400 1 1002 113 113 GLN H H 8.659 0.020 1 1003 113 113 GLN HA H 4.299 0.020 1 1004 113 113 GLN HB2 H 1.667 0.020 2 1005 113 113 GLN HG2 H 1.781 0.020 2 1006 113 113 GLN HG3 H 1.226 0.020 2 1007 113 113 GLN C C 175.109 0.400 1 1008 113 113 GLN CA C 54.341 0.400 1 1009 113 113 GLN CB C 30.085 0.400 1 1010 113 113 GLN CG C 32.847 0.400 1 1011 113 113 GLN N N 127.253 0.400 1 1012 114 114 ILE H H 9.190 0.020 1 1013 114 114 ILE HA H 5.216 0.020 1 1014 114 114 ILE HB H 2.070 0.020 1 1015 114 114 ILE HG12 H 1.660 0.020 2 1016 114 114 ILE HG13 H 1.165 0.020 2 1017 114 114 ILE HG2 H 0.800 0.020 1 1018 114 114 ILE HD1 H 0.610 0.020 1 1019 114 114 ILE C C 174.458 0.400 1 1020 114 114 ILE CA C 59.832 0.400 1 1021 114 114 ILE CB C 38.440 0.400 1 1022 114 114 ILE CG1 C 27.171 0.400 1 1023 114 114 ILE CG2 C 17.232 0.400 1 1024 114 114 ILE CD1 C 13.764 0.400 1 1025 114 114 ILE N N 130.211 0.400 1 1026 115 115 SER H H 9.125 0.020 1 1027 115 115 SER HA H 6.203 0.020 1 1028 115 115 SER HB2 H 4.073 0.020 2 1029 115 115 SER HB3 H 3.992 0.020 2 1030 115 115 SER C C 175.987 0.400 1 1031 115 115 SER CA C 55.096 0.400 1 1032 115 115 SER CB C 65.390 0.400 1 1033 115 115 SER N N 120.531 0.400 1 1034 116 116 SER H H 9.225 0.020 1 1035 116 116 SER HA H 4.692 0.020 1 1036 116 116 SER HB2 H 3.958 0.020 2 1037 116 116 SER HB3 H 4.218 0.020 2 1038 116 116 SER C C 174.538 0.400 1 1039 116 116 SER CA C 59.249 0.400 1 1040 116 116 SER CB C 63.210 0.400 1 1041 116 116 SER N N 121.630 0.400 1 1042 117 117 THR H H 7.944 0.020 1 1043 117 117 THR HA H 4.794 0.020 1 1044 117 117 THR HB H 4.023 0.020 1 1045 117 117 THR HG2 H 0.996 0.020 1 1046 117 117 THR C C 170.825 0.400 1 1047 117 117 THR CA C 59.962 0.400 1 1048 117 117 THR CB C 69.650 0.400 1 1049 117 117 THR CG2 C 18.670 0.400 1 1050 117 117 THR N N 117.755 0.400 1 1051 118 118 ASP H H 7.936 0.020 1 1052 118 118 ASP HA H 4.951 0.020 1 1053 118 118 ASP HB2 H 2.558 0.020 2 1054 118 118 ASP C C 175.201 0.400 1 1055 118 118 ASP CA C 53.211 0.400 1 1056 118 118 ASP CB C 43.420 0.400 1 1057 118 118 ASP N N 121.928 0.400 1 1058 119 119 VAL H H 7.493 0.020 1 1059 119 119 VAL HA H 4.678 0.020 1 1060 119 119 VAL HB H 1.890 0.020 1 1061 119 119 VAL HG1 H 0.531 0.020 1 1062 119 119 VAL HG2 H 0.510 0.020 1 1063 119 119 VAL C C 172.790 0.400 1 1064 119 119 VAL CA C 57.450 0.400 1 1065 119 119 VAL CB C 32.659 0.400 1 1066 119 119 VAL CG1 C 20.781 0.400 1 1067 119 119 VAL CG2 C 19.068 0.400 1 1068 119 119 VAL N N 119.179 0.400 1 1069 120 120 PRO HB2 H 2.143 0.020 2 1070 120 120 PRO HG2 H 2.367 0.020 2 1071 120 120 PRO HD2 H 3.637 0.020 2 1072 120 120 PRO HD3 H 3.935 0.020 2 1073 120 120 PRO C C 176.798 0.400 1 1074 120 120 PRO CA C 62.600 0.400 1 1075 120 120 PRO CB C 31.600 0.400 1 1076 120 120 PRO CG C 27.000 0.400 1 1077 120 120 PRO CD C 49.550 0.400 1 1078 121 121 LEU H H 8.466 0.020 1 1079 121 121 LEU HA H 4.268 0.020 1 1080 121 121 LEU HB2 H 1.710 0.020 2 1081 121 121 LEU HG H 1.716 0.020 1 1082 121 121 LEU HD1 H 1.061 0.020 1 1083 121 121 LEU HD2 H 1.008 0.020 1 1084 121 121 LEU C C 178.759 0.400 1 1085 121 121 LEU CA C 55.322 0.400 1 1086 121 121 LEU CB C 41.300 0.400 1 1087 121 121 LEU CG C 26.630 0.400 1 1088 121 121 LEU CD1 C 24.249 0.400 1 1089 121 121 LEU CD2 C 23.950 0.400 1 1090 121 121 LEU N N 122.931 0.400 1 1091 122 122 GLY H H 9.100 0.020 1 1092 122 122 GLY HA2 H 3.337 0.020 2 1093 122 122 GLY HA3 H 4.103 0.020 2 1094 122 122 GLY C C 172.116 0.400 1 1095 122 122 GLY CA C 46.957 0.400 1 1096 122 122 GLY N N 110.431 0.400 1 1097 123 123 GLN H H 9.045 0.020 1 1098 123 123 GLN HA H 4.833 0.020 1 1099 123 123 GLN HB2 H 1.760 0.020 2 1100 123 123 GLN HB3 H 2.190 0.020 2 1101 123 123 GLN HG2 H 2.537 0.020 2 1102 123 123 GLN HG3 H 2.373 0.020 2 1103 123 123 GLN C C 176.433 0.400 1 1104 123 123 GLN CA C 55.740 0.400 1 1105 123 123 GLN CB C 31.390 0.400 1 1106 123 123 GLN CG C 33.284 0.400 1 1107 123 123 GLN N N 118.575 0.400 1 1108 124 124 PHE H H 8.004 0.020 1 1109 124 124 PHE HA H 5.648 0.020 1 1110 124 124 PHE HB2 H 3.249 0.020 2 1111 124 124 PHE HB3 H 2.520 0.020 2 1112 124 124 PHE HD1 H 6.874 0.020 1 1113 124 124 PHE HE1 H 7.224 0.020 1 1114 124 124 PHE HZ H 6.914 0.020 1 1115 124 124 PHE C C 172.549 0.400 1 1116 124 124 PHE CA C 55.935 0.400 1 1117 124 124 PHE CB C 43.048 0.400 1 1118 124 124 PHE N N 123.055 0.400 1 1119 125 125 VAL H H 7.773 0.020 1 1120 125 125 VAL HA H 4.701 0.020 1 1121 125 125 VAL HB H 1.788 0.020 1 1122 125 125 VAL HG1 H 0.598 0.020 1 1123 125 125 VAL HG2 H 0.857 0.020 1 1124 125 125 VAL C C 170.015 0.400 1 1125 125 125 VAL CA C 58.463 0.400 1 1126 125 125 VAL CB C 34.270 0.400 1 1127 125 125 VAL CG1 C 19.736 0.400 1 1128 125 125 VAL CG2 C 22.218 0.400 1 1129 125 125 VAL N N 124.787 0.400 1 1130 126 126 LYS H H 8.030 0.020 1 1131 126 126 LYS HA H 4.975 0.020 1 1132 126 126 LYS HB3 H 1.314 0.020 2 1133 126 126 LYS HG3 H 1.754 0.020 2 1134 126 126 LYS HD3 H 1.734 0.020 2 1135 126 126 LYS HE2 H 2.962 0.020 2 1136 126 126 LYS C C 175.325 0.400 1 1137 126 126 LYS CA C 53.321 0.400 1 1138 126 126 LYS CB C 25.237 0.400 1 1139 126 126 LYS CG C 29.018 0.400 1 1140 126 126 LYS CD C 35.430 0.400 1 1141 126 126 LYS CE C 41.430 0.400 1 1142 126 126 LYS N N 127.226 0.400 1 1143 127 127 LEU H H 8.682 0.020 1 1144 127 127 LEU HA H 4.993 0.020 1 1145 127 127 LEU HB2 H 1.097 0.020 2 1146 127 127 LEU HB3 H 1.309 0.020 2 1147 127 127 LEU HG H 1.218 0.020 1 1148 127 127 LEU HD1 H 0.302 0.020 1 1149 127 127 LEU HD2 H 0.494 0.020 1 1150 127 127 LEU C C 174.838 0.400 1 1151 127 127 LEU CA C 53.175 0.400 1 1152 127 127 LEU CB C 43.500 0.400 1 1153 127 127 LEU CG C 26.390 0.400 1 1154 127 127 LEU CD1 C 25.865 0.400 1 1155 127 127 LEU CD2 C 25.190 0.400 1 1156 127 127 LEU N N 128.172 0.400 1 1157 128 128 GLU H H 9.694 0.020 1 1158 128 128 GLU HA H 5.059 0.020 1 1159 128 128 GLU HB2 H 2.147 0.020 2 1160 128 128 GLU C C 174.746 0.400 1 1161 128 128 GLU CA C 51.578 0.400 1 1162 128 128 GLU N N 123.447 0.400 1 1163 129 129 PRO HD2 H 3.610 0.020 2 1164 129 129 PRO HD3 H 3.946 0.020 2 1165 129 129 PRO C C 176.874 0.400 1 1166 129 129 PRO CA C 62.885 0.400 1 1167 129 129 PRO CD C 51.713 0.400 1 1168 130 130 GLN H H 8.592 0.020 1 1169 130 130 GLN HA H 4.478 0.020 1 1170 130 130 GLN HB2 H 1.860 0.020 2 1171 130 130 GLN HB3 H 2.620 0.020 2 1172 130 130 GLN HG2 H 2.252 0.020 2 1173 130 130 GLN HG3 H 2.175 0.020 2 1174 130 130 GLN C C 173.952 0.400 1 1175 130 130 GLN CA C 54.449 0.400 1 1176 130 130 GLN CB C 29.300 0.400 1 1177 130 130 GLN CG C 34.500 0.400 1 1178 130 130 GLN N N 120.476 0.400 1 1179 131 131 SER H H 8.132 0.020 1 1180 131 131 SER HA H 5.109 0.020 1 1181 131 131 SER HB2 H 4.332 0.020 2 1182 131 131 SER HB3 H 4.043 0.020 2 1183 131 131 SER C C 175.328 0.400 1 1184 131 131 SER CA C 56.278 0.400 1 1185 131 131 SER CB C 64.600 0.400 1 1186 131 131 SER N N 112.747 0.400 1 1187 132 132 VAL H H 8.735 0.020 1 1188 132 132 VAL HA H 3.937 0.020 1 1189 132 132 VAL HB H 2.377 0.020 1 1190 132 132 VAL HG1 H 1.155 0.020 1 1191 132 132 VAL HG2 H 1.165 0.020 1 1192 132 132 VAL C C 177.926 0.400 1 1193 132 132 VAL CA C 63.970 0.400 1 1194 132 132 VAL CB C 31.498 0.400 1 1195 132 132 VAL CG1 C 20.776 0.400 1 1196 132 132 VAL CG2 C 20.581 0.400 1 1197 132 132 VAL N N 121.010 0.400 1 1198 133 133 ASP H H 8.808 0.020 1 1199 133 133 ASP HA H 4.452 0.020 1 1200 133 133 ASP HB2 H 3.008 0.020 2 1201 133 133 ASP HB3 H 2.691 0.020 2 1202 133 133 ASP C C 178.143 0.400 1 1203 133 133 ASP CA C 55.422 0.400 1 1204 133 133 ASP CB C 38.400 0.400 1 1205 133 133 ASP N N 123.891 0.400 1 1206 134 134 PHE H H 7.891 0.020 1 1207 134 134 PHE HA H 3.742 0.020 1 1208 134 134 PHE HB2 H 2.684 0.020 2 1209 134 134 PHE HD1 H 6.697 0.020 1 1210 134 134 PHE HE1 H 6.629 0.020 1 1211 134 134 PHE HZ H 6.552 0.020 1 1212 134 134 PHE C C 177.270 0.400 1 1213 134 134 PHE CA C 60.486 0.400 1 1214 134 134 PHE CB C 40.615 0.400 1 1215 134 134 PHE N N 123.352 0.400 1 1216 135 135 LEU H H 7.863 0.020 1 1217 135 135 LEU HA H 4.159 0.020 1 1218 135 135 LEU HB2 H 1.935 0.020 2 1219 135 135 LEU HB3 H 1.675 0.020 2 1220 135 135 LEU HG H 1.780 0.020 1 1221 135 135 LEU HD1 H 0.880 0.020 1 1222 135 135 LEU HD2 H 0.909 0.020 1 1223 135 135 LEU C C 177.416 0.400 1 1224 135 135 LEU CA C 55.434 0.400 1 1225 135 135 LEU CB C 40.237 0.400 1 1226 135 135 LEU CG C 25.091 0.400 1 1227 135 135 LEU CD1 C 24.932 0.400 1 1228 135 135 LEU CD2 C 21.473 0.400 1 1229 135 135 LEU N N 115.132 0.400 1 1230 136 136 ASP H H 7.562 0.020 1 1231 136 136 ASP HA H 4.503 0.020 1 1232 136 136 ASP HB2 H 2.830 0.020 2 1233 136 136 ASP HB3 H 2.831 0.020 2 1234 136 136 ASP C C 177.214 0.400 1 1235 136 136 ASP CA C 54.793 0.400 1 1236 136 136 ASP CB C 40.147 0.400 1 1237 136 136 ASP N N 118.662 0.400 1 1238 137 137 ILE H H 7.201 0.020 1 1239 137 137 ILE HA H 3.639 0.020 1 1240 137 137 ILE HB H 1.073 0.020 1 1241 137 137 ILE HG12 H 0.420 0.020 2 1242 137 137 ILE HG13 H 0.897 0.020 2 1243 137 137 ILE HG2 H 0.114 0.020 1 1244 137 137 ILE HD1 H -0.507 0.020 1 1245 137 137 ILE C C 176.470 0.400 1 1246 137 137 ILE CA C 61.220 0.400 1 1247 137 137 ILE CB C 36.821 0.400 1 1248 137 137 ILE CG1 C 26.423 0.400 1 1249 137 137 ILE CG2 C 16.141 0.400 1 1250 137 137 ILE CD1 C 11.493 0.400 1 1251 137 137 ILE N N 122.029 0.400 1 1252 138 138 SER H H 8.270 0.020 1 1253 138 138 SER HA H 4.203 0.020 1 1254 138 138 SER HB2 H 3.896 0.020 2 1255 138 138 SER CA C 59.931 0.400 1 1256 138 138 SER CB C 62.393 0.400 1 1257 138 138 SER N N 124.511 0.400 1 1258 140 140 PRO HA H 3.667 0.020 1 1259 140 140 PRO HB2 H 1.449 0.020 2 1260 140 140 PRO HB3 H 1.228 0.020 2 1261 140 140 PRO HG2 H 1.671 0.020 2 1262 140 140 PRO HG3 H 1.233 0.020 2 1263 140 140 PRO HD2 H 3.183 0.020 2 1264 140 140 PRO C C 178.293 0.400 1 1265 140 140 PRO CA C 64.063 0.400 1 1266 140 140 PRO CB C 30.797 0.400 1 1267 140 140 PRO CG C 26.391 0.400 1 1268 140 140 PRO CD C 49.588 0.400 1 1269 141 141 LYS H H 8.081 0.020 1 1270 141 141 LYS HA H 4.076 0.020 1 1271 141 141 LYS HB2 H 1.975 0.020 2 1272 141 141 LYS HB3 H 2.037 0.020 2 1273 141 141 LYS HG2 H 1.642 0.020 2 1274 141 141 LYS HG3 H 1.536 0.020 2 1275 141 141 LYS HD2 H 1.891 0.020 2 1276 141 141 LYS HD3 H 2.020 0.020 2 1277 141 141 LYS HE2 H 3.180 0.020 2 1278 141 141 LYS C C 178.891 0.400 1 1279 141 141 LYS CA C 59.784 0.400 1 1280 141 141 LYS CB C 31.760 0.400 1 1281 141 141 LYS CG C 25.436 0.400 1 1282 141 141 LYS CD C 29.000 0.400 1 1283 141 141 LYS CE C 41.558 0.400 1 1284 141 141 LYS N N 119.590 0.400 1 1285 142 142 ALA H H 7.369 0.020 1 1286 142 142 ALA HA H 4.200 0.020 1 1287 142 142 ALA HB H 1.460 0.020 1 1288 142 142 ALA C C 181.477 0.400 1 1289 142 142 ALA CA C 53.912 0.400 1 1290 142 142 ALA CB C 18.078 0.400 1 1291 142 142 ALA N N 123.300 0.400 1 1292 143 143 VAL H H 7.544 0.020 1 1293 143 143 VAL HA H 3.532 0.020 1 1294 143 143 VAL HB H 1.786 0.020 1 1295 143 143 VAL HG1 H 0.550 0.020 1 1296 143 143 VAL HG2 H 0.487 0.020 1 1297 143 143 VAL C C 178.731 0.400 1 1298 143 143 VAL CA C 65.617 0.400 1 1299 143 143 VAL CB C 30.850 0.400 1 1300 143 143 VAL CG1 C 19.779 0.400 1 1301 143 143 VAL CG2 C 21.850 0.400 1 1302 143 143 VAL N N 119.679 0.400 1 1303 144 144 LEU H H 8.341 0.020 1 1304 144 144 LEU HA H 4.051 0.020 1 1305 144 144 LEU HB2 H 1.760 0.020 2 1306 144 144 LEU HB3 H 2.114 0.020 2 1307 144 144 LEU HG H 1.889 0.020 1 1308 144 144 LEU HD1 H 0.739 0.020 1 1309 144 144 LEU HD2 H 0.910 0.020 1 1310 144 144 LEU C C 178.549 0.400 1 1311 144 144 LEU CA C 55.324 0.400 1 1312 144 144 LEU CB C 39.160 0.400 1 1313 144 144 LEU CG C 27.440 0.400 1 1314 144 144 LEU CD1 C 22.662 0.400 1 1315 144 144 LEU CD2 C 22.704 0.400 1 1316 144 144 LEU N N 122.133 0.400 1 1317 145 145 GLU H H 8.210 0.020 1 1318 145 145 GLU HA H 3.931 0.020 1 1319 145 145 GLU HB2 H 2.238 0.020 2 1320 145 145 GLU HB3 H 2.137 0.020 2 1321 145 145 GLU HG2 H 2.311 0.020 2 1322 145 145 GLU HG3 H 2.547 0.020 2 1323 145 145 GLU C C 178.947 0.400 1 1324 145 145 GLU CA C 59.342 0.400 1 1325 145 145 GLU CB C 28.729 0.400 1 1326 145 145 GLU CG C 35.832 0.400 1 1327 145 145 GLU N N 119.491 0.400 1 1328 146 146 ASN H H 7.480 0.020 1 1329 146 146 ASN HA H 4.629 0.020 1 1330 146 146 ASN HB2 H 3.107 0.020 2 1331 146 146 ASN C C 178.830 0.400 1 1332 146 146 ASN CA C 56.012 0.400 1 1333 146 146 ASN CB C 38.978 0.400 1 1334 146 146 ASN N N 116.373 0.400 1 1335 147 147 VAL H H 8.522 0.020 1 1336 147 147 VAL HA H 4.214 0.020 1 1337 147 147 VAL HB H 2.640 0.020 1 1338 147 147 VAL HG1 H 1.236 0.020 1 1339 147 147 VAL HG2 H 1.275 0.020 1 1340 147 147 VAL C C 179.885 0.400 1 1341 147 147 VAL CA C 64.888 0.400 1 1342 147 147 VAL CB C 31.516 0.400 1 1343 147 147 VAL CG1 C 21.354 0.400 1 1344 147 147 VAL CG2 C 21.270 0.400 1 1345 147 147 VAL N N 119.210 0.400 1 1346 148 148 LEU H H 8.737 0.020 1 1347 148 148 LEU HA H 4.276 0.020 1 1348 148 148 LEU HB2 H 1.495 0.020 2 1349 148 148 LEU HB3 H 2.046 0.020 2 1350 148 148 LEU HG H 1.852 0.020 1 1351 148 148 LEU HD1 H 0.658 0.020 1 1352 148 148 LEU HD2 H 0.395 0.020 1 1353 148 148 LEU C C 179.088 0.400 1 1354 148 148 LEU CA C 57.014 0.400 1 1355 148 148 LEU CB C 40.237 0.400 1 1356 148 148 LEU CG C 26.307 0.400 1 1357 148 148 LEU CD1 C 24.810 0.400 1 1358 148 148 LEU CD2 C 21.835 0.400 1 1359 148 148 LEU N N 119.869 0.400 1 1360 149 149 ARG H H 7.569 0.020 1 1361 149 149 ARG HA H 4.486 0.020 1 1362 149 149 ARG HB2 H 2.106 0.020 2 1363 149 149 ARG HB3 H 1.917 0.020 2 1364 149 149 ARG HG2 H 2.106 0.020 2 1365 149 149 ARG HG3 H 1.917 0.020 2 1366 149 149 ARG HD2 H 3.457 0.020 2 1367 149 149 ARG C C 177.983 0.400 1 1368 149 149 ARG CA C 58.270 0.400 1 1369 149 149 ARG CB C 29.960 0.400 1 1370 149 149 ARG CG C 27.290 0.400 1 1371 149 149 ARG CD C 43.060 0.400 1 1372 149 149 ARG N N 119.227 0.400 1 1373 150 150 ASN H H 8.313 0.020 1 1374 150 150 ASN HA H 5.139 0.020 1 1375 150 150 ASN HB2 H 3.208 0.020 2 1376 150 150 ASN HB3 H 3.306 0.020 2 1377 150 150 ASN C C 174.691 0.400 1 1378 150 150 ASN CA C 52.750 0.400 1 1379 150 150 ASN CB C 38.889 0.400 1 1380 150 150 ASN N N 115.309 0.400 1 1381 151 151 PHE H H 8.480 0.020 1 1382 151 151 PHE HA H 4.417 0.020 1 1383 151 151 PHE HB2 H 3.300 0.020 2 1384 151 151 PHE HB3 H 3.068 0.020 2 1385 151 151 PHE HD1 H 7.780 0.020 1 1386 151 151 PHE HE1 H 7.400 0.020 1 1387 151 151 PHE HZ H 6.997 0.020 1 1388 151 151 PHE C C 173.159 0.400 1 1389 151 151 PHE CA C 57.264 0.400 1 1390 151 151 PHE CB C 41.184 0.400 1 1391 151 151 PHE N N 123.743 0.400 1 1392 152 152 SER H H 9.351 0.020 1 1393 152 152 SER HA H 4.793 0.020 1 1394 152 152 SER HB2 H 3.980 0.020 2 1395 152 152 SER HB3 H 3.578 0.020 2 1396 152 152 SER C C 174.739 0.400 1 1397 152 152 SER CA C 60.174 0.400 1 1398 152 152 SER CB C 63.830 0.400 1 1399 152 152 SER N N 116.170 0.400 1 1400 153 153 THR H H 8.879 0.020 1 1401 153 153 THR HA H 5.783 0.020 1 1402 153 153 THR HB H 4.072 0.020 1 1403 153 153 THR HG2 H 0.836 0.020 1 1404 153 153 THR C C 173.700 0.400 1 1405 153 153 THR CA C 59.162 0.400 1 1406 153 153 THR CB C 71.600 0.400 1 1407 153 153 THR CG2 C 21.536 0.400 1 1408 153 153 THR N N 114.784 0.400 1 1409 154 154 LEU H H 8.373 0.020 1 1410 154 154 LEU HA H 4.807 0.020 1 1411 154 154 LEU HB2 H 1.494 0.020 2 1412 154 154 LEU HG H 1.194 0.020 1 1413 154 154 LEU HD1 H 0.616 0.020 1 1414 154 154 LEU HD2 H 0.753 0.020 1 1415 154 154 LEU C C 175.469 0.400 1 1416 154 154 LEU CA C 54.350 0.400 1 1417 154 154 LEU CD1 C 26.130 0.400 1 1418 154 154 LEU CD2 C 21.647 0.400 1 1419 154 154 LEU N N 117.698 0.400 1 1420 155 155 THR H H 8.531 0.020 1 1421 155 155 THR HA H 5.248 0.020 1 1422 155 155 THR HB H 4.710 0.020 1 1423 155 155 THR HG2 H 1.777 0.020 1 1424 155 155 THR C C 173.808 0.400 1 1425 155 155 THR CA C 60.605 0.400 1 1426 155 155 THR CB C 70.087 0.400 1 1427 155 155 THR CG2 C 20.579 0.400 1 1428 155 155 THR N N 120.977 0.400 1 1429 156 156 VAL H H 8.870 0.020 1 1430 156 156 VAL HA H 3.335 0.020 1 1431 156 156 VAL HB H 2.098 0.020 1 1432 156 156 VAL HG1 H 1.095 0.020 1 1433 156 156 VAL HG2 H 1.177 0.020 1 1434 156 156 VAL C C 177.077 0.400 1 1435 156 156 VAL CA C 65.934 0.400 1 1436 156 156 VAL CB C 31.426 0.400 1 1437 156 156 VAL CG1 C 21.118 0.400 1 1438 156 156 VAL CG2 C 24.031 0.400 1 1439 156 156 VAL N N 127.695 0.400 1 1440 157 157 ASP H H 9.029 0.020 1 1441 157 157 ASP HA H 4.244 0.020 1 1442 157 157 ASP HB2 H 2.697 0.020 2 1443 157 157 ASP HB3 H 3.591 0.020 2 1444 157 157 ASP C C 176.300 0.400 1 1445 157 157 ASP CA C 57.588 0.400 1 1446 157 157 ASP CB C 38.529 0.400 1 1447 157 157 ASP N N 121.257 0.400 1 1448 158 158 ASP H H 8.757 0.020 1 1449 158 158 ASP HA H 4.781 0.020 1 1450 158 158 ASP HB2 H 2.579 0.020 2 1451 158 158 ASP HB3 H 3.039 0.020 2 1452 158 158 ASP C C 177.089 0.400 1 1453 158 158 ASP CA C 56.002 0.400 1 1454 158 158 ASP CB C 41.496 0.400 1 1455 158 158 ASP N N 123.348 0.400 1 1456 159 159 VAL H H 7.549 0.020 1 1457 159 159 VAL HA H 4.620 0.020 1 1458 159 159 VAL HB H 2.239 0.020 1 1459 159 159 VAL HG1 H 1.000 0.020 1 1460 159 159 VAL HG2 H 0.860 0.020 1 1461 159 159 VAL C C 176.388 0.400 1 1462 159 159 VAL CA C 61.062 0.400 1 1463 159 159 VAL CB C 30.437 0.400 1 1464 159 159 VAL CG1 C 20.534 0.400 1 1465 159 159 VAL CG2 C 22.198 0.400 1 1466 159 159 VAL N N 123.377 0.400 1 1467 160 160 ILE H H 7.974 0.020 1 1468 160 160 ILE HA H 3.374 0.020 1 1469 160 160 ILE HB H 0.849 0.020 1 1470 160 160 ILE HG12 H 0.871 0.020 2 1471 160 160 ILE HG13 H 0.932 0.020 2 1472 160 160 ILE HG2 H -0.202 0.020 1 1473 160 160 ILE HD1 H 0.035 0.020 1 1474 160 160 ILE CA C 59.650 0.400 1 1475 160 160 ILE CB C 38.204 0.400 1 1476 160 160 ILE CG2 C 16.256 0.400 1 1477 160 160 ILE CD1 C 11.561 0.400 1 1478 160 160 ILE N N 119.131 0.400 1 1479 161 161 GLU H H 6.060 0.020 1 1480 161 161 GLU HA H 5.405 0.020 1 1481 161 161 GLU HB2 H 2.696 0.020 2 1482 161 161 GLU HB3 H 2.006 0.020 2 1483 161 161 GLU HG2 H 2.346 0.020 2 1484 161 161 GLU HG3 H 2.470 0.020 2 1485 161 161 GLU C C 174.455 0.400 1 1486 161 161 GLU CA C 53.920 0.400 1 1487 161 161 GLU CB C 33.314 0.400 1 1488 161 161 GLU CG C 37.270 0.400 1 1489 161 161 GLU N N 121.395 0.400 1 1490 162 162 ILE H H 8.715 0.020 1 1491 162 162 ILE HA H 5.226 0.020 1 1492 162 162 ILE HB H 2.207 0.020 1 1493 162 162 ILE HG12 H 1.687 0.020 2 1494 162 162 ILE HG13 H 1.242 0.020 2 1495 162 162 ILE HG2 H 0.910 0.020 1 1496 162 162 ILE HD1 H 0.849 0.020 1 1497 162 162 ILE CA C 57.620 0.400 1 1498 162 162 ILE CG1 C 26.130 0.400 1 1499 162 162 ILE CG2 C 18.532 0.400 1 1500 162 162 ILE CD1 C 14.066 0.400 1 1501 162 162 ILE N N 115.564 0.400 1 1502 163 163 SER H H 8.785 0.020 1 1503 163 163 SER HA H 5.170 0.020 1 1504 163 163 SER HB2 H 2.549 0.020 2 1505 163 163 SER HB3 H 3.345 0.020 2 1506 163 163 SER C C 174.545 0.400 1 1507 163 163 SER CA C 54.918 0.400 1 1508 163 163 SER CB C 63.370 0.400 1 1509 163 163 SER N N 116.717 0.400 1 1510 164 164 TYR H H 9.221 0.020 1 1511 164 164 TYR HA H 4.687 0.020 1 1512 164 164 TYR HB2 H 2.753 0.020 2 1513 164 164 TYR HB3 H 2.972 0.020 2 1514 164 164 TYR HD1 H 7.095 0.020 1 1515 164 164 TYR HE1 H 6.844 0.020 1 1516 164 164 TYR C C 174.765 0.400 1 1517 164 164 TYR CA C 57.503 0.400 1 1518 164 164 TYR CB C 40.281 0.400 1 1519 164 164 TYR N N 128.232 0.400 1 1520 165 165 ASN H H 8.837 0.020 1 1521 165 165 ASN HA H 4.140 0.020 1 1522 165 165 ASN HB2 H 1.915 0.020 2 1523 165 165 ASN HB3 H 2.991 0.020 2 1524 165 165 ASN C C 175.260 0.400 1 1525 165 165 ASN CA C 52.735 0.400 1 1526 165 165 ASN CB C 36.785 0.400 1 1527 165 165 ASN N N 128.389 0.400 1 1528 166 166 GLY H H 8.620 0.020 1 1529 166 166 GLY HA2 H 3.579 0.020 2 1530 166 166 GLY HA3 H 4.094 0.020 2 1531 166 166 GLY C C 173.808 0.400 1 1532 166 166 GLY CA C 44.954 0.400 1 1533 166 166 GLY N N 104.745 0.400 1 1534 167 167 LYS H H 7.787 0.020 1 1535 167 167 LYS HA H 4.609 0.020 1 1536 167 167 LYS HB2 H 1.739 0.020 2 1537 167 167 LYS HG2 H 1.215 0.020 2 1538 167 167 LYS HD2 H 1.350 0.020 2 1539 167 167 LYS HE2 H 2.976 0.020 2 1540 167 167 LYS C C 174.886 0.400 1 1541 167 167 LYS CA C 54.007 0.400 1 1542 167 167 LYS N N 122.762 0.400 1 1543 168 168 THR H H 7.773 0.020 1 1544 168 168 THR HA H 5.508 0.020 1 1545 168 168 THR HB H 4.160 0.020 1 1546 168 168 THR HG2 H 0.937 0.020 1 1547 168 168 THR C C 174.236 0.400 1 1548 168 168 THR CA C 58.942 0.400 1 1549 168 168 THR CB C 69.616 0.400 1 1550 168 168 THR CG2 C 21.811 0.400 1 1551 168 168 THR N N 113.122 0.400 1 1552 169 169 PHE H H 8.862 0.020 1 1553 169 169 PHE HA H 4.919 0.020 1 1554 169 169 PHE HB2 H 2.705 0.020 2 1555 169 169 PHE HB3 H 3.409 0.020 2 1556 169 169 PHE HD1 H 7.253 0.020 1 1557 169 169 PHE HE1 H 7.333 0.020 1 1558 169 169 PHE C C 175.021 0.400 1 1559 169 169 PHE CA C 56.403 0.400 1 1560 169 169 PHE CB C 41.950 0.400 1 1561 169 169 PHE N N 119.679 0.400 1 1562 170 170 LYS H H 9.181 0.020 1 1563 170 170 LYS HA H 5.744 0.020 1 1564 170 170 LYS HG2 H 1.479 0.020 2 1565 170 170 LYS HD2 H 1.752 0.020 2 1566 170 170 LYS HE2 H 3.076 0.020 2 1567 170 170 LYS C C 177.945 0.400 1 1568 170 170 LYS CA C 54.305 0.400 1 1569 170 170 LYS N N 122.164 0.400 1 1570 171 171 ILE H H 8.923 0.020 1 1571 171 171 ILE HA H 4.425 0.020 1 1572 171 171 ILE HG13 H 1.384 0.020 2 1573 171 171 ILE HG2 H 0.576 0.020 1 1574 171 171 ILE HD1 H 0.623 0.020 1 1575 171 171 ILE CA C 59.746 0.400 1 1576 171 171 ILE CG1 C 26.510 0.400 1 1577 171 171 ILE CG2 C 19.252 0.400 1 1578 171 171 ILE CD1 C 13.923 0.400 1 1579 171 171 ILE N N 123.978 0.400 1 1580 172 172 LYS H H 8.808 0.020 1 1581 172 172 LYS HA H 5.553 0.020 1 1582 172 172 LYS HB2 H 1.790 0.020 2 1583 172 172 LYS HB3 H 1.535 0.020 2 1584 172 172 LYS HG2 H 1.790 0.020 2 1585 172 172 LYS HG3 H 1.535 0.020 2 1586 172 172 LYS HD3 H 3.089 0.020 2 1587 172 172 LYS C C 175.913 0.400 1 1588 172 172 LYS CA C 53.784 0.400 1 1589 172 172 LYS CD C 41.432 0.400 1 1590 172 172 LYS N N 128.685 0.400 1 1591 173 173 ILE H H 8.889 0.020 1 1592 173 173 ILE HA H 4.177 0.020 1 1593 173 173 ILE HB H 2.624 0.020 1 1594 173 173 ILE HG13 H 1.389 0.020 2 1595 173 173 ILE HG2 H 0.575 0.020 1 1596 173 173 ILE HD1 H 0.580 0.020 1 1597 173 173 ILE C C 175.973 0.400 1 1598 173 173 ILE CA C 59.029 0.400 1 1599 173 173 ILE CB C 28.400 0.400 1 1600 173 173 ILE CG1 C 26.443 0.400 1 1601 173 173 ILE CG2 C 18.792 0.400 1 1602 173 173 ILE CD1 C 11.349 0.400 1 1603 173 173 ILE N N 128.838 0.400 1 1604 174 174 LEU H H 8.795 0.020 1 1605 174 174 LEU HA H 4.563 0.020 1 1606 174 174 LEU HB2 H 1.660 0.020 2 1607 174 174 LEU HB3 H 1.522 0.020 2 1608 174 174 LEU HD1 H 0.867 0.020 1 1609 174 174 LEU HD2 H 0.827 0.020 1 1610 174 174 LEU C C 177.420 0.400 1 1611 174 174 LEU CA C 55.766 0.400 1 1612 174 174 LEU CB C 43.279 0.400 1 1613 174 174 LEU CD1 C 25.424 0.400 1 1614 174 174 LEU CD2 C 21.128 0.400 1 1615 174 174 LEU N N 128.858 0.400 1 1616 175 175 GLU H H 7.300 0.020 1 1617 175 175 GLU HA H 4.647 0.020 1 1618 175 175 GLU HB2 H 2.058 0.020 2 1619 175 175 GLU HG2 H 2.271 0.020 2 1620 175 175 GLU HG3 H 2.233 0.020 2 1621 175 175 GLU C C 174.386 0.400 1 1622 175 175 GLU CA C 55.025 0.400 1 1623 175 175 GLU CB C 34.060 0.400 1 1624 175 175 GLU CG C 35.740 0.400 1 1625 175 175 GLU N N 115.653 0.400 1 1626 176 176 VAL H H 8.358 0.020 1 1627 176 176 VAL HA H 5.292 0.020 1 1628 176 176 VAL HB H 2.072 0.020 1 1629 176 176 VAL HG1 H 0.728 0.020 1 1630 176 176 VAL HG2 H 0.597 0.020 1 1631 176 176 VAL C C 174.755 0.400 1 1632 176 176 VAL CA C 58.350 0.400 1 1633 176 176 VAL CB C 34.799 0.400 1 1634 176 176 VAL CG1 C 20.748 0.400 1 1635 176 176 VAL CG2 C 17.681 0.400 1 1636 176 176 VAL N N 115.341 0.400 1 1637 177 177 LYS H H 8.697 0.020 1 1638 177 177 LYS HA H 4.609 0.020 1 1639 177 177 LYS HG2 H 1.434 0.020 2 1640 177 177 LYS HD2 H 1.758 0.020 2 1641 177 177 LYS C C 174.898 0.400 1 1642 177 177 LYS CA C 53.115 0.400 1 1643 177 177 LYS N N 118.588 0.400 1 1644 178 178 PRO HA H 4.572 0.020 1 1645 178 178 PRO HB2 H 2.499 0.020 2 1646 178 178 PRO HB3 H 2.104 0.020 2 1647 178 178 PRO HG2 H 1.946 0.020 2 1648 178 178 PRO HD2 H 3.785 0.020 2 1649 178 178 PRO HD3 H 3.669 0.020 2 1650 178 178 PRO C C 175.336 0.400 1 1651 178 178 PRO CA C 62.153 0.400 1 1652 178 178 PRO CB C 34.084 0.400 1 1653 178 178 PRO CD C 51.245 0.400 1 1654 179 179 GLU H H 8.951 0.020 1 1655 179 179 GLU HA H 4.466 0.020 1 1656 179 179 GLU HB2 H 2.136 0.020 2 1657 179 179 GLU HB3 H 2.076 0.020 2 1658 179 179 GLU HG2 H 2.461 0.020 1 1659 179 179 GLU HG3 H 2.461 0.020 1 1660 179 179 GLU C C 176.127 0.400 1 1661 179 179 GLU CA C 56.194 0.400 1 1662 179 179 GLU CB C 30.032 0.400 1 1663 179 179 GLU CG C 36.388 0.400 1 1664 179 179 GLU N N 123.126 0.400 1 1665 180 180 SER H H 8.157 0.020 1 1666 180 180 SER HA H 4.569 0.020 1 1667 180 180 SER HB3 H 3.434 0.020 2 1668 180 180 SER C C 176.231 0.400 1 1669 180 180 SER CA C 57.885 0.400 1 1670 180 180 SER CB C 69.909 0.400 1 1671 180 180 SER N N 117.505 0.400 1 1672 181 181 SER HA H 4.371 0.020 1 1673 181 181 SER HB2 H 4.089 0.020 2 1674 181 181 SER C C 176.013 0.400 1 1675 181 181 SER CA C 60.688 0.400 1 1676 181 181 SER CB C 62.209 0.400 1 1677 182 182 SER H H 7.951 0.020 1 1678 182 182 SER HA H 4.378 0.020 1 1679 182 182 SER HB2 H 3.800 0.020 2 1680 182 182 SER HB3 H 4.017 0.020 2 1681 182 182 SER C C 175.178 0.400 1 1682 182 182 SER CA C 59.713 0.400 1 1683 182 182 SER CB C 63.798 0.400 1 1684 182 182 SER N N 116.388 0.400 1 1685 183 183 LYS H H 7.798 0.020 1 1686 183 183 LYS HA H 4.196 0.020 1 1687 183 183 LYS HB3 H 1.850 0.020 2 1688 183 183 LYS HG2 H 1.568 0.020 2 1689 183 183 LYS HD2 H 2.315 0.020 2 1690 183 183 LYS HD3 H 2.031 0.020 2 1691 183 183 LYS HE2 H 3.142 0.020 2 1692 183 183 LYS C C 173.307 0.400 1 1693 183 183 LYS CA C 56.560 0.400 1 1694 183 183 LYS CB C 28.778 0.400 1 1695 183 183 LYS CG C 24.440 0.400 1 1696 183 183 LYS CD C 29.284 0.400 1 1697 183 183 LYS CE C 41.890 0.400 1 1698 183 183 LYS N N 116.440 0.400 1 1699 184 184 SER H H 7.183 0.020 1 1700 184 184 SER HA H 5.504 0.020 1 1701 184 184 SER HB2 H 3.240 0.020 2 1702 184 184 SER HB3 H 2.680 0.020 2 1703 184 184 SER C C 174.622 0.400 1 1704 184 184 SER CA C 54.892 0.400 1 1705 184 184 SER CB C 65.069 0.400 1 1706 184 184 SER N N 110.181 0.400 1 1707 185 185 ILE H H 8.432 0.020 1 1708 185 185 ILE HA H 5.082 0.020 1 1709 185 185 ILE HB H 1.533 0.020 1 1710 185 185 ILE HG13 H 1.557 0.020 2 1711 185 185 ILE HG2 H 0.868 0.020 1 1712 185 185 ILE HD1 H 0.761 0.020 1 1713 185 185 ILE C C 174.662 0.400 1 1714 185 185 ILE CA C 57.688 0.400 1 1715 185 185 ILE CB C 41.966 0.400 1 1716 185 185 ILE CG2 C 19.234 0.400 1 1717 185 185 ILE CD1 C 13.923 0.400 1 1718 185 185 ILE N N 116.575 0.400 1 1719 186 186 CYS H H 9.085 0.020 1 1720 186 186 CYS HA H 5.040 0.020 1 1721 186 186 CYS HB2 H 2.739 0.020 2 1722 186 186 CYS HB3 H 2.615 0.020 2 1723 186 186 CYS C C 176.310 0.400 1 1724 186 186 CYS CA C 56.150 0.400 1 1725 186 186 CYS CB C 26.919 0.400 1 1726 186 186 CYS N N 121.983 0.400 1 1727 187 187 VAL H H 8.312 0.020 1 1728 187 187 VAL HA H 4.467 0.020 1 1729 187 187 VAL HB H 2.471 0.020 1 1730 187 187 VAL HG1 H 0.644 0.020 1 1731 187 187 VAL HG2 H 0.670 0.020 1 1732 187 187 VAL C C 174.568 0.400 1 1733 187 187 VAL CA C 60.326 0.400 1 1734 187 187 VAL CB C 29.873 0.400 1 1735 187 187 VAL CG1 C 18.004 0.400 1 1736 187 187 VAL CG2 C 21.716 0.400 1 1737 187 187 VAL N N 121.740 0.400 1 1738 188 188 ILE H H 7.707 0.020 1 1739 188 188 ILE HA H 4.094 0.020 1 1740 188 188 ILE HB H 1.757 0.020 1 1741 188 188 ILE HG12 H 1.925 0.020 2 1742 188 188 ILE HG2 H 1.091 0.020 1 1743 188 188 ILE HD1 H 1.002 0.020 1 1744 188 188 ILE C C 175.331 0.400 1 1745 188 188 ILE CA C 61.481 0.400 1 1746 188 188 ILE CB C 38.861 0.400 1 1747 188 188 ILE CG1 C 27.093 0.400 1 1748 188 188 ILE CG2 C 16.858 0.400 1 1749 188 188 ILE CD1 C 13.773 0.400 1 1750 188 188 ILE N N 126.515 0.400 1 1751 189 189 GLU H H 8.960 0.020 1 1752 189 189 GLU HA H 3.916 0.020 1 1753 189 189 GLU HB2 H 2.376 0.020 2 1754 189 189 GLU HG2 H 2.079 0.020 2 1755 189 189 GLU HG3 H 2.091 0.020 2 1756 189 189 GLU C C 174.918 0.400 1 1757 189 189 GLU CA C 56.677 0.400 1 1758 189 189 GLU CB C 36.468 0.400 1 1759 189 189 GLU CG C 27.013 0.400 1 1760 189 189 GLU N N 124.550 0.400 1 1761 190 190 THR H H 7.472 0.020 1 1762 190 190 THR HA H 4.689 0.020 1 1763 190 190 THR HB H 3.952 0.020 1 1764 190 190 THR HG2 H 1.109 0.020 1 1765 190 190 THR C C 172.950 0.400 1 1766 190 190 THR CA C 58.707 0.400 1 1767 190 190 THR CB C 69.916 0.400 1 1768 190 190 THR CG2 C 19.193 0.400 1 1769 190 190 THR N N 111.262 0.400 1 1770 191 191 ASP H H 8.101 0.020 1 1771 191 191 ASP HA H 4.855 0.020 1 1772 191 191 ASP HB2 H 2.594 0.020 2 1773 191 191 ASP HB3 H 2.759 0.020 2 1774 191 191 ASP C C 174.729 0.400 1 1775 191 191 ASP CA C 52.925 0.400 1 1776 191 191 ASP CB C 40.281 0.400 1 1777 191 191 ASP N N 127.233 0.400 1 1778 192 192 LEU H H 8.045 0.020 1 1779 192 192 LEU HA H 4.137 0.020 1 1780 192 192 LEU HB2 H 1.470 0.020 2 1781 192 192 LEU HB3 H 1.217 0.020 2 1782 192 192 LEU HG H 1.283 0.020 1 1783 192 192 LEU HD1 H 0.510 0.020 1 1784 192 192 LEU HD2 H 0.538 0.020 1 1785 192 192 LEU C C 176.743 0.400 1 1786 192 192 LEU CA C 53.611 0.400 1 1787 192 192 LEU CB C 44.015 0.400 1 1788 192 192 LEU CG C 25.497 0.400 1 1789 192 192 LEU CD1 C 24.210 0.400 1 1790 192 192 LEU CD2 C 25.012 0.400 1 1791 192 192 LEU N N 124.556 0.400 1 1792 193 193 VAL H H 7.896 0.020 1 1793 193 193 VAL HA H 4.150 0.020 1 1794 193 193 VAL HB H 2.345 0.020 1 1795 193 193 VAL HG1 H 1.130 0.020 1 1796 193 193 VAL HG2 H 1.203 0.020 1 1797 193 193 VAL C C 175.067 0.400 1 1798 193 193 VAL CA C 62.408 0.400 1 1799 193 193 VAL CB C 32.257 0.400 1 1800 193 193 VAL CG1 C 21.049 0.400 1 1801 193 193 VAL CG2 C 21.253 0.400 1 1802 193 193 VAL N N 128.717 0.400 1 1803 194 194 THR H H 8.159 0.020 1 1804 194 194 THR HA H 4.560 0.020 1 1805 194 194 THR HB H 3.439 0.020 1 1806 194 194 THR HG2 H 0.692 0.020 1 1807 194 194 THR C C 173.940 0.400 1 1808 194 194 THR CA C 57.942 0.400 1 1809 194 194 THR CB C 69.850 0.400 1 1810 194 194 THR CG2 C 20.481 0.400 1 1811 194 194 THR N N 117.966 0.400 1 1812 195 195 ASP H H 7.951 0.020 1 1813 195 195 ASP HA H 4.895 0.020 1 1814 195 195 ASP HB2 H 2.517 0.020 2 1815 195 195 ASP HB3 H 2.432 0.020 2 1816 195 195 ASP C C 174.582 0.400 1 1817 195 195 ASP CA C 52.226 0.400 1 1818 195 195 ASP CB C 44.651 0.400 1 1819 195 195 ASP N N 124.591 0.400 1 1820 196 196 PHE H H 8.580 0.020 1 1821 196 196 PHE HA H 5.160 0.020 1 1822 196 196 PHE HB2 H 2.986 0.020 2 1823 196 196 PHE HB3 H 2.952 0.020 2 1824 196 196 PHE HD1 H 7.120 0.020 1 1825 196 196 PHE HE1 H 7.023 0.020 1 1826 196 196 PHE HZ H 6.969 0.020 1 1827 196 196 PHE C C 176.307 0.400 1 1828 196 196 PHE CA C 56.815 0.400 1 1829 196 196 PHE CB C 40.202 0.400 1 1830 196 196 PHE N N 123.070 0.400 1 1831 197 197 ALA H H 8.896 0.020 1 1832 197 197 ALA HA H 4.735 0.020 1 1833 197 197 ALA HB H 1.413 0.020 1 1834 197 197 ALA CA C 49.315 0.400 1 1835 197 197 ALA CB C 21.617 0.400 1 1836 197 197 ALA N N 129.693 0.400 1 1837 198 198 PRO HA H 4.695 0.020 1 1838 198 198 PRO CA C 60.600 0.400 1 1839 199 199 PRO HA H 4.745 0.020 1 1840 199 199 PRO HB2 H 2.058 0.020 2 1841 199 199 PRO HB3 H 1.673 0.020 2 1842 199 199 PRO HG2 H 1.885 0.020 2 1843 199 199 PRO HG3 H 2.029 0.020 2 1844 199 199 PRO HD2 H 4.102 0.020 2 1845 199 199 PRO HD3 H 3.400 0.020 2 1846 199 199 PRO C C 177.331 0.400 1 1847 199 199 PRO CA C 61.160 0.400 1 1848 199 199 PRO CB C 31.621 0.400 1 1849 199 199 PRO CG C 27.447 0.400 1 1850 199 199 PRO CD C 49.021 0.400 1 1851 200 200 VAL H H 7.589 0.020 1 1852 200 200 VAL HA H 3.827 0.020 1 1853 200 200 VAL HB H 1.890 0.020 1 1854 200 200 VAL HG1 H 1.005 0.020 1 1855 200 200 VAL HG2 H 1.092 0.020 1 1856 200 200 VAL C C 176.729 0.400 1 1857 200 200 VAL CA C 63.278 0.400 1 1858 200 200 VAL CB C 31.462 0.400 1 1859 200 200 VAL CG1 C 20.331 0.400 1 1860 200 200 VAL CG2 C 21.298 0.400 1 1861 200 200 VAL N N 123.100 0.400 1 1862 201 201 GLY H H 8.625 0.020 1 1863 201 201 GLY HA2 H 3.824 0.020 2 1864 201 201 GLY HA3 H 4.242 0.020 2 1865 201 201 GLY C C 174.557 0.400 1 1866 201 201 GLY CA C 44.448 0.400 1 1867 201 201 GLY N N 114.125 0.400 1 1868 202 202 TYR H H 7.950 0.020 1 1869 202 202 TYR HA H 4.473 0.020 1 1870 202 202 TYR HB2 H 3.016 0.020 2 1871 202 202 TYR HD1 H 7.120 0.020 1 1872 202 202 TYR HE1 H 7.027 0.020 1 1873 202 202 TYR C C 175.215 0.400 1 1874 202 202 TYR CA C 58.170 0.400 1 1875 202 202 TYR CB C 39.248 0.400 1 1876 202 202 TYR N N 122.181 0.400 1 1877 203 203 VAL H H 7.703 0.020 1 1878 203 203 VAL HA H 4.080 0.020 1 1879 203 203 VAL HB H 1.893 0.020 1 1880 203 203 VAL HG1 H 0.885 0.020 1 1881 203 203 VAL HG2 H 0.904 0.020 1 1882 203 203 VAL C C 174.770 0.400 1 1883 203 203 VAL CA C 60.409 0.400 1 1884 203 203 VAL CB C 33.449 0.400 1 1885 203 203 VAL CG1 C 20.583 0.400 1 1886 203 203 VAL CG2 C 20.029 0.400 1 1887 203 203 VAL N N 127.424 0.400 1 1888 204 204 GLU H H 8.345 0.020 1 1889 204 204 GLU HA H 4.393 0.020 1 1890 204 204 GLU HB2 H 2.083 0.020 2 1891 204 204 GLU HB3 H 1.994 0.020 2 1892 204 204 GLU HG2 H 2.427 0.020 2 1893 204 204 GLU C C 175.038 0.400 1 1894 204 204 GLU CA C 53.901 0.400 1 1895 204 204 GLU CB C 29.098 0.400 1 1896 204 204 GLU CG C 35.528 0.400 1 1897 204 204 GLU N N 127.824 0.400 1 1898 205 205 PRO HA H 4.380 0.020 1 1899 205 205 PRO HB2 H 2.254 0.020 2 1900 205 205 PRO HB3 H 1.769 0.020 2 1901 205 205 PRO HG2 H 2.070 0.020 2 1902 205 205 PRO HD2 H 3.913 0.020 2 1903 205 205 PRO HD3 H 3.811 0.020 2 1904 205 205 PRO C C 176.547 0.400 1 1905 205 205 PRO CA C 62.546 0.400 1 1906 205 205 PRO CB C 31.701 0.400 1 1907 205 205 PRO CG C 26.854 0.400 1 1908 205 205 PRO CD C 50.451 0.400 1 1909 206 206 ASP H H 8.257 0.020 1 1910 206 206 ASP HA H 4.594 0.020 1 1911 206 206 ASP HB2 H 2.643 0.020 2 1912 206 206 ASP C C 176.121 0.400 1 1913 206 206 ASP CA C 53.662 0.400 1 1914 206 206 ASP CB C 40.678 0.400 1 1915 206 206 ASP N N 120.740 0.400 1 1916 207 207 TYR H H 7.964 0.020 1 1917 207 207 TYR HA H 4.646 0.020 1 1918 207 207 TYR HB2 H 3.029 0.020 2 1919 207 207 TYR HB3 H 3.159 0.020 2 1920 207 207 TYR HD1 H 7.210 0.020 1 1921 207 207 TYR HE1 H 6.918 0.020 1 1922 207 207 TYR C C 175.037 0.400 1 1923 207 207 TYR CA C 57.164 0.400 1 1924 207 207 TYR CB C 38.216 0.400 1 1925 207 207 TYR N N 121.235 0.400 1 1926 208 208 LYS H H 7.748 0.020 1 1927 208 208 LYS HA H 4.211 0.020 1 1928 208 208 LYS HB2 H 1.819 0.020 1 1929 208 208 LYS HB3 H 1.819 0.020 1 1930 208 208 LYS HG2 H 1.426 0.020 2 1931 208 208 LYS C C 175.062 0.400 1 1932 208 208 LYS CA C 57.147 0.400 1 1933 208 208 LYS N N 128.796 0.400 1 stop_ save_