data_6980 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Chemical Shift Assignment of human allograft inflammatory factor I ; _BMRB_accession_number 6980 _BMRB_flat_file_name bmr6980.str _Entry_type new _Submission_date 2006-02-13 _Accession_date 2006-02-13 _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 Song Jikui . . 2 Tyler Robert C. . 3 'Loushin Newman' Carrie . . 4 Vinarov Dmitriy . . 5 Markley John L. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 724 "13C chemical shifts" 591 "15N chemical shifts" 144 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-06-29 update BMRB 'added time domain data' 2006-03-29 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution Structure of Human Allograft Inflammatory Factor I' _Citation_status 'in preparation' _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 Song Jikui . . 2 Tyler Robert C. . 3 'Loushin Newman' Carrie . . 4 Vinarov Dmitriy . . 5 Markley John L. . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name BC009474 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label BC009474 $BC009474 'CALCIUM (II) ION' $entity_CA_2+ stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'not present' loop_ _Magnetic_equivalence_ID _Magnetically_equivalent_system_component diamagnetic 'CALCIUM (II) ION' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_BC009474 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Allograft inflammatory factor 1' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 150 _Mol_residue_sequence ; GPLESQTRDLQGGKAFGLLK AQQEERLDEINKQFLDDPKY SSDEDLPSKLEGFKEKYMEF DLNGNGDIDIMSLKRMLEKL GVPKTHLELKKLIGEVSSGS GETFSYPDFLRMMLGKRSAI LKMILMYEEKAREKEKPTGP PAKKAISELP ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 PRO 3 LEU 4 GLU 5 SER 6 GLN 7 THR 8 ARG 9 ASP 10 LEU 11 GLN 12 GLY 13 GLY 14 LYS 15 ALA 16 PHE 17 GLY 18 LEU 19 LEU 20 LYS 21 ALA 22 GLN 23 GLN 24 GLU 25 GLU 26 ARG 27 LEU 28 ASP 29 GLU 30 ILE 31 ASN 32 LYS 33 GLN 34 PHE 35 LEU 36 ASP 37 ASP 38 PRO 39 LYS 40 TYR 41 SER 42 SER 43 ASP 44 GLU 45 ASP 46 LEU 47 PRO 48 SER 49 LYS 50 LEU 51 GLU 52 GLY 53 PHE 54 LYS 55 GLU 56 LYS 57 TYR 58 MET 59 GLU 60 PHE 61 ASP 62 LEU 63 ASN 64 GLY 65 ASN 66 GLY 67 ASP 68 ILE 69 ASP 70 ILE 71 MET 72 SER 73 LEU 74 LYS 75 ARG 76 MET 77 LEU 78 GLU 79 LYS 80 LEU 81 GLY 82 VAL 83 PRO 84 LYS 85 THR 86 HIS 87 LEU 88 GLU 89 LEU 90 LYS 91 LYS 92 LEU 93 ILE 94 GLY 95 GLU 96 VAL 97 SER 98 SER 99 GLY 100 SER 101 GLY 102 GLU 103 THR 104 PHE 105 SER 106 TYR 107 PRO 108 ASP 109 PHE 110 LEU 111 ARG 112 MET 113 MET 114 LEU 115 GLY 116 LYS 117 ARG 118 SER 119 ALA 120 ILE 121 LEU 122 LYS 123 MET 124 ILE 125 LEU 126 MET 127 TYR 128 GLU 129 GLU 130 LYS 131 ALA 132 ARG 133 GLU 134 LYS 135 GLU 136 LYS 137 PRO 138 THR 139 GLY 140 PRO 141 PRO 142 ALA 143 LYS 144 LYS 145 ALA 146 ILE 147 SER 148 GLU 149 LEU 150 PRO stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 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 2D58 "Human Microglia-Specific Protein Iba1" 71.33 107 100.00 100.00 7.49e-68 PDB 2G2B "Nmr Structure Of The Human Allograft Inflammatory Factor 1" 100.00 150 100.00 100.00 4.42e-100 DBJ BAA13088 "Iba1 (ionized calcium binding adapter molecule 1) [Homo sapiens]" 97.33 147 100.00 100.00 2.90e-97 DBJ BAB63392 "Allograft inflammatory factor [Homo sapiens]" 97.33 147 100.00 100.00 2.90e-97 DBJ BAD69720 "allograft inflammatory factor 1 [Macaca mulatta]" 97.33 147 99.32 99.32 6.30e-96 DBJ BAF83460 "unnamed protein product [Homo sapiens]" 97.33 147 99.32 99.32 3.38e-96 EMBL CAA75060 "G1, putative splice variant of allograft inflamatory factor-1 [Homo sapiens]" 62.00 93 100.00 100.00 5.19e-57 EMBL CAA75062 "allograft inflamatory factor-1 [Homo sapiens]" 97.33 147 100.00 100.00 2.90e-97 EMBL CAG46950 "AIF1 [Homo sapiens]" 62.00 93 100.00 100.00 5.19e-57 GB AAB05003 "allograft-inflammatory factor-1 [Homo sapiens]" 97.33 147 100.00 100.00 2.90e-97 GB AAD18087 "AIF-1 [Homo sapiens]" 97.33 147 99.32 99.32 3.38e-96 GB AAF98708 "allograft inflammatory factor 1 [Macaca mulatta]" 63.33 95 98.95 98.95 1.02e-57 GB AAG39110 "allograft inflammatory factor-1 splice variant G1 [Homo sapiens]" 62.00 93 100.00 100.00 5.19e-57 GB AAH09474 "Allograft inflammatory factor 1 [Homo sapiens]" 97.33 147 100.00 100.00 2.90e-97 REF NP_001040583 "allograft inflammatory factor 1 [Macaca mulatta]" 97.33 147 99.32 99.32 6.30e-96 REF NP_001614 "allograft inflammatory factor 1 isoform 3 [Homo sapiens]" 97.33 147 100.00 100.00 2.90e-97 REF NP_116573 "allograft inflammatory factor 1 isoform 1 [Homo sapiens]" 62.00 93 100.00 100.00 5.19e-57 REF XP_001154743 "PREDICTED: allograft inflammatory factor 1 isoform X4 [Pan troglodytes]" 97.33 147 99.32 99.32 3.38e-96 REF XP_002816779 "PREDICTED: allograft inflammatory factor 1 isoform X1 [Pongo abelii]" 97.33 147 99.32 100.00 1.03e-96 SP P55008 "RecName: Full=Allograft inflammatory factor 1; Short=AIF-1; AltName: Full=Ionized calcium-binding adapter molecule 1; AltName: " 97.33 147 100.00 100.00 2.90e-97 SP Q5TM25 "RecName: Full=Allograft inflammatory factor 1; Short=AIF-1 [Macaca mulatta]" 97.33 147 99.32 99.32 6.30e-96 stop_ save_ ############# # Ligands # ############# save_CA_2+ _Saveframe_category ligand _Mol_type fragment _Name_common 'CALCIUM (II) ION' _BMRB_code CA_2+ _PDB_code CA _Molecular_mass . _Mol_charge 2+ _Mol_paramagnetic no _Mol_aromatic no _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons CA CA CA . 2+ . ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $BC009474 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $BC009474 'cell free synthesis' . . . . . 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 $BC009474 0.5 mM . MOPS 10 mM . NaCl 100 mM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600III _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Inova _Field_strength 600 _Details . save_ save_500II _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 500 _Details . save_ save_750 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 750 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H,15N-HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name 1H,15N-HSQC _Sample_label . save_ save_1H,13C-HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name 1H,13C-HSQC _Sample_label . save_ save_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label . save_ save_CBCACONH_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _Sample_label . save_ save_HCCHTOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name HCCHTOCSY _Sample_label . save_ save_CCONH_6 _Saveframe_category NMR_applied_experiment _Experiment_name CCONH _Sample_label . save_ save_HCCONH_7 _Saveframe_category NMR_applied_experiment _Experiment_name HCCONH _Sample_label . save_ save_3D_C13NOESY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C13NOESY' _Sample_label . save_ save_3D_N15NOESY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D N15NOESY' _Sample_label . save_ save_HBACONH_10 _Saveframe_category NMR_applied_experiment _Experiment_name HBACONH _Sample_label . save_ save_HBCBCGCDHD_11 _Saveframe_category NMR_applied_experiment _Experiment_name HBCBCGCDHD _Sample_label . save_ save_HBCBCGCDCEHE_12 _Saveframe_category NMR_applied_experiment _Experiment_name HBCBCGCDCEHE _Sample_label . save_ save_NMR_spectrometer_expt_1 _Saveframe_category NMR_applied_experiment _Experiment_name 1H,15N-HSQC _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_2 _Saveframe_category NMR_applied_experiment _Experiment_name 1H,13C-HSQC _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_5 _Saveframe_category NMR_applied_experiment _Experiment_name HCCHTOCSY _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_6 _Saveframe_category NMR_applied_experiment _Experiment_name CCONH _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_7 _Saveframe_category NMR_applied_experiment _Experiment_name HCCONH _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C13NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D N15NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_10 _Saveframe_category NMR_applied_experiment _Experiment_name HBACONH _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_11 _Saveframe_category NMR_applied_experiment _Experiment_name HBCBCGCDHD _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spectrometer_expt_12 _Saveframe_category NMR_applied_experiment _Experiment_name HBCBCGCDCEHE _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.0 0.1 pH temperature 298 0.1 K pressure 1 0.1 atm 'ionic strength' 100 10 mM 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 DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name BC009474 _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 2 PRO HA H 4.436 0.05 1 2 2 2 PRO HB2 H 1.938 0.05 2 3 2 2 PRO HB3 H 2.313 0.05 2 4 2 2 PRO HG3 H 1.973 0.05 2 5 2 2 PRO HD2 H 3.572 0.05 2 6 2 2 PRO C C 177.136 0.15 1 7 2 2 PRO CA C 63.271 0.15 1 8 2 2 PRO CB C 32.344 0.15 1 9 2 2 PRO CG C 27.048 0.15 1 10 2 2 PRO CD C 48.194 0.15 1 11 3 3 LEU H H 8.511 0.05 1 12 3 3 LEU HA H 4.287 0.05 1 13 3 3 LEU HB3 H 1.615 0.05 2 14 3 3 LEU HD2 H 0.915 0.05 2 15 3 3 LEU C C 177.857 0.15 1 16 3 3 LEU CA C 55.697 0.15 1 17 3 3 LEU CB C 42.088 0.15 1 18 3 3 LEU CG C 23.467 0.15 1 19 3 3 LEU N N 121.565 0.15 1 20 4 4 GLU H H 8.353 0.05 1 21 4 4 GLU HA H 4.258 0.05 1 22 4 4 GLU HB3 H 2.026 0.05 2 23 4 4 GLU HG3 H 2.253 0.05 2 24 4 4 GLU C C 176.826 0.15 1 25 4 4 GLU CA C 57.159 0.15 1 26 4 4 GLU CB C 30.032 0.15 1 27 4 4 GLU CG C 36.424 0.15 1 28 4 4 GLU N N 121.397 0.15 1 29 5 5 SER H H 8.265 0.05 1 30 5 5 SER HA H 4.392 0.05 1 31 5 5 SER HB2 H 3.866 0.05 2 32 5 5 SER C C 174.768 0.15 1 33 5 5 SER CA C 58.742 0.15 1 34 5 5 SER CB C 63.592 0.15 1 35 5 5 SER N N 116.061 0.15 1 36 6 6 GLN H H 8.357 0.05 1 37 6 6 GLN HA H 4.395 0.05 1 38 6 6 GLN HB3 H 2.077 0.05 2 39 6 6 GLN C C 176.335 0.15 1 40 6 6 GLN CA C 56.154 0.15 1 41 6 6 GLN CB C 29.467 0.15 1 42 6 6 GLN N N 121.968 0.15 1 43 7 7 THR H H 8.137 0.05 1 44 7 7 THR HG2 H 1.196 0.05 1 45 7 7 THR C C 174.695 0.15 1 46 7 7 THR CA C 62.269 0.15 1 47 7 7 THR CB C 69.581 0.15 1 48 7 7 THR CG2 C 21.680 0.15 1 49 7 7 THR N N 114.993 0.15 1 50 8 8 ARG H H 8.282 0.05 1 51 8 8 ARG HA H 4.282 0.05 1 52 8 8 ARG HB3 H 1.789 0.05 2 53 8 8 ARG HG2 H 1.609 0.05 2 54 8 8 ARG HD3 H 3.184 0.05 2 55 8 8 ARG C C 176.002 0.15 1 56 8 8 ARG CA C 56.457 0.15 1 57 8 8 ARG CB C 30.827 0.15 1 58 8 8 ARG CG C 27.082 0.15 1 59 8 8 ARG N N 123.136 0.15 1 60 9 9 ASP H H 8.329 0.05 1 61 9 9 ASP HA H 4.565 0.05 1 62 9 9 ASP HB3 H 2.626 0.05 2 63 9 9 ASP C C 176.481 0.15 1 64 9 9 ASP CA C 54.432 0.15 1 65 9 9 ASP CB C 41.004 0.15 1 66 9 9 ASP N N 121.071 0.15 1 67 10 10 LEU H H 8.211 0.05 1 68 10 10 LEU HA H 4.272 0.05 1 69 10 10 LEU HB3 H 1.635 0.05 2 70 10 10 LEU HG H 1.627 0.05 1 71 10 10 LEU HD2 H 0.872 0.05 2 72 10 10 LEU C C 177.851 0.15 1 73 10 10 LEU CA C 55.588 0.15 1 74 10 10 LEU CB C 42.057 0.15 1 75 10 10 LEU CG C 27.059 0.15 1 76 10 10 LEU CD1 C 23.136 0.15 2 77 10 10 LEU CD2 C 24.999 0.15 2 78 10 10 LEU N N 122.733 0.15 1 79 11 11 GLN H H 8.371 0.05 1 80 11 11 GLN HA H 4.256 0.05 1 81 11 11 GLN HB3 H 2.059 0.05 2 82 11 11 GLN HG3 H 2.343 0.05 2 83 11 11 GLN C C 176.779 0.15 1 84 11 11 GLN CA C 56.161 0.15 1 85 11 11 GLN CB C 29.106 0.15 1 86 11 11 GLN CG C 33.888 0.15 1 87 11 11 GLN N N 119.854 0.15 1 88 12 12 GLY H H 8.345 0.05 1 89 12 12 GLY HA2 H 3.936 0.05 2 90 12 12 GLY C C 174.923 0.15 1 91 12 12 GLY CA C 45.641 0.15 1 92 12 12 GLY N N 109.387 0.15 1 93 13 13 GLY H H 8.284 0.05 1 94 13 13 GLY HA2 H 3.955 0.05 2 95 13 13 GLY C C 174.499 0.15 1 96 13 13 GLY CA C 45.506 0.15 1 97 13 13 GLY N N 108.657 0.15 1 98 14 14 LYS H H 8.137 0.05 1 99 14 14 LYS HA H 4.253 0.05 1 100 14 14 LYS HB2 H 1.754 0.05 2 101 14 14 LYS HG3 H 1.445 0.05 2 102 14 14 LYS HD2 H 1.680 0.05 2 103 14 14 LYS C C 176.627 0.15 1 104 14 14 LYS CA C 56.570 0.15 1 105 14 14 LYS CB C 32.988 0.15 1 106 14 14 LYS CG C 24.862 0.15 1 107 14 14 LYS CD C 29.107 0.15 1 108 14 14 LYS CE C 42.135 0.15 1 109 14 14 LYS N N 120.776 0.15 1 110 15 15 ALA H H 8.264 0.05 1 111 15 15 ALA HA H 4.241 0.05 1 112 15 15 ALA HB H 1.313 0.05 1 113 15 15 ALA C C 177.790 0.15 1 114 15 15 ALA CA C 52.876 0.15 1 115 15 15 ALA CB C 18.958 0.15 1 116 15 15 ALA N N 124.074 0.15 1 117 16 16 PHE H H 8.166 0.05 1 118 16 16 PHE HA H 4.500 0.05 1 119 16 16 PHE HB3 H 3.102 0.05 2 120 16 16 PHE C C 176.689 0.15 1 121 16 16 PHE CA C 58.668 0.15 1 122 16 16 PHE CB C 39.552 0.15 1 123 16 16 PHE N N 119.524 0.15 1 124 17 17 GLY H H 8.309 0.05 1 125 17 17 GLY HA2 H 3.871 0.05 2 126 17 17 GLY C C 174.826 0.15 1 127 17 17 GLY CA C 45.856 0.15 1 128 17 17 GLY N N 109.156 0.15 1 129 18 18 LEU H H 7.980 0.05 1 130 18 18 LEU HA H 4.251 0.05 1 131 18 18 LEU HB2 H 1.638 0.05 2 132 18 18 LEU HD2 H 0.898 0.05 2 133 18 18 LEU C C 178.166 0.15 1 134 18 18 LEU CA C 56.448 0.15 1 135 18 18 LEU CB C 42.131 0.15 1 136 18 18 LEU CG C 27.031 0.15 1 137 18 18 LEU CD1 C 23.565 0.15 2 138 18 18 LEU CD2 C 24.793 0.15 2 139 18 18 LEU N N 122.078 0.15 1 140 19 19 LEU H H 8.067 0.05 1 141 19 19 LEU HB3 H 1.634 0.05 2 142 19 19 LEU HD1 H 0.908 0.05 2 143 19 19 LEU HD2 H 0.889 0.05 2 144 19 19 LEU C C 178.757 0.15 1 145 19 19 LEU CA C 57.061 0.15 1 146 19 19 LEU CB C 41.875 0.15 1 147 19 19 LEU CG C 27.185 0.15 1 148 19 19 LEU CD1 C 24.609 0.15 2 149 19 19 LEU CD2 C 23.811 0.15 2 150 19 19 LEU N N 121.229 0.15 1 151 20 20 LYS H H 8.161 0.05 1 152 20 20 LYS HA H 4.048 0.05 1 153 20 20 LYS HB2 H 1.760 0.05 2 154 20 20 LYS HD2 H 1.530 0.05 2 155 20 20 LYS HE2 H 2.992 0.05 2 156 20 20 LYS C C 178.139 0.15 1 157 20 20 LYS CA C 58.916 0.15 1 158 20 20 LYS CB C 32.406 0.15 1 159 20 20 LYS CG C 25.114 0.15 1 160 20 20 LYS CD C 29.257 0.15 1 161 20 20 LYS CE C 42.287 0.15 1 162 20 20 LYS N N 121.210 0.15 1 163 21 21 ALA H H 8.099 0.05 1 164 21 21 ALA HA H 4.236 0.05 1 165 21 21 ALA HB H 1.469 0.05 1 166 21 21 ALA C C 180.352 0.15 1 167 21 21 ALA CA C 54.803 0.15 1 168 21 21 ALA CB C 18.327 0.15 1 169 21 21 ALA N N 121.195 0.15 1 170 22 22 GLN H H 7.964 0.05 1 171 22 22 GLN HA H 4.153 0.05 1 172 22 22 GLN HB2 H 2.243 0.05 2 173 22 22 GLN HB3 H 2.111 0.05 2 174 22 22 GLN HG2 H 2.518 0.05 2 175 22 22 GLN HG3 H 2.402 0.05 2 176 22 22 GLN HE21 H 6.781 0.05 2 177 22 22 GLN HE22 H 7.534 0.05 2 178 22 22 GLN C C 178.859 0.15 1 179 22 22 GLN CA C 58.456 0.15 1 180 22 22 GLN CB C 28.734 0.15 1 181 22 22 GLN CG C 34.403 0.15 1 182 22 22 GLN N N 117.827 0.15 1 183 22 22 GLN NE2 N 111.483 0.15 1 184 23 23 GLN H H 8.218 0.05 1 185 23 23 GLN HA H 4.066 0.05 1 186 23 23 GLN HB2 H 2.252 0.05 2 187 23 23 GLN HB3 H 2.001 0.05 2 188 23 23 GLN HG2 H 2.397 0.05 2 189 23 23 GLN HG3 H 2.375 0.05 2 190 23 23 GLN HE21 H 7.131 0.05 2 191 23 23 GLN HE22 H 6.779 0.05 2 192 23 23 GLN C C 178.470 0.15 1 193 23 23 GLN CA C 58.492 0.15 1 194 23 23 GLN CB C 28.128 0.15 1 195 23 23 GLN CG C 33.701 0.15 1 196 23 23 GLN N N 119.534 0.15 1 197 23 23 GLN NE2 N 110.242 0.15 1 198 24 24 GLU H H 8.383 0.05 1 199 24 24 GLU HA H 3.727 0.05 1 200 24 24 GLU HB3 H 2.073 0.05 2 201 24 24 GLU HG3 H 2.315 0.05 2 202 24 24 GLU C C 177.644 0.15 1 203 24 24 GLU CA C 60.532 0.15 1 204 24 24 GLU CB C 29.417 0.15 1 205 24 24 GLU CG C 37.089 0.15 1 206 24 24 GLU N N 119.575 0.15 1 207 25 25 GLU H H 7.873 0.05 1 208 25 25 GLU HA H 4.116 0.05 1 209 25 25 GLU HB3 H 2.127 0.05 2 210 25 25 GLU HG2 H 2.457 0.05 2 211 25 25 GLU HG3 H 2.356 0.05 2 212 25 25 GLU C C 179.287 0.15 1 213 25 25 GLU CA C 59.472 0.15 1 214 25 25 GLU CB C 29.603 0.15 1 215 25 25 GLU CG C 36.499 0.15 1 216 25 25 GLU N N 117.954 0.15 1 217 26 26 ARG H H 7.541 0.05 1 218 26 26 ARG HA H 4.182 0.05 1 219 26 26 ARG HB3 H 2.007 0.05 2 220 26 26 ARG HG2 H 1.713 0.05 2 221 26 26 ARG HG3 H 1.784 0.05 2 222 26 26 ARG HD2 H 3.310 0.05 2 223 26 26 ARG C C 179.131 0.15 1 224 26 26 ARG CA C 58.879 0.15 1 225 26 26 ARG CB C 29.985 0.15 1 226 26 26 ARG CG C 27.310 0.15 1 227 26 26 ARG CD C 43.375 0.15 1 228 26 26 ARG N N 118.958 0.15 1 229 27 27 LEU H H 7.747 0.05 1 230 27 27 LEU HA H 3.891 0.05 1 231 27 27 LEU HB2 H 1.701 0.05 2 232 27 27 LEU HB3 H 0.831 0.05 2 233 27 27 LEU HG H 1.757 0.05 1 234 27 27 LEU HD1 H 0.611 0.05 2 235 27 27 LEU HD2 H 0.164 0.05 2 236 27 27 LEU C C 179.152 0.15 1 237 27 27 LEU CA C 58.169 0.15 1 238 27 27 LEU CB C 39.210 0.15 1 239 27 27 LEU CG C 25.796 0.15 1 240 27 27 LEU CD1 C 26.592 0.15 2 241 27 27 LEU CD2 C 21.642 0.15 2 242 27 27 LEU N N 118.801 0.15 1 243 28 28 ASP H H 8.434 0.05 1 244 28 28 ASP HA H 4.413 0.05 1 245 28 28 ASP HB2 H 2.647 0.05 2 246 28 28 ASP HB3 H 2.910 0.05 2 247 28 28 ASP C C 179.473 0.15 1 248 28 28 ASP CA C 57.947 0.15 1 249 28 28 ASP CB C 40.114 0.15 1 250 28 28 ASP N N 119.759 0.15 1 251 29 29 GLU H H 7.864 0.05 1 252 29 29 GLU HA H 4.109 0.05 1 253 29 29 GLU HB3 H 2.246 0.05 2 254 29 29 GLU HG2 H 2.472 0.05 2 255 29 29 GLU HG3 H 2.339 0.05 2 256 29 29 GLU C C 179.520 0.15 1 257 29 29 GLU CA C 59.457 0.15 1 258 29 29 GLU CB C 29.491 0.15 1 259 29 29 GLU CG C 36.352 0.15 1 260 29 29 GLU N N 120.829 0.15 1 261 30 30 ILE H H 7.878 0.05 1 262 30 30 ILE HA H 3.976 0.05 1 263 30 30 ILE HB H 2.249 0.05 1 264 30 30 ILE HG12 H 1.933 0.05 2 265 30 30 ILE HG2 H 1.063 0.05 1 266 30 30 ILE HD1 H 1.049 0.05 1 267 30 30 ILE C C 178.610 0.15 1 268 30 30 ILE CA C 64.678 0.15 1 269 30 30 ILE CB C 37.317 0.15 1 270 30 30 ILE CG1 C 29.161 0.15 1 271 30 30 ILE CG2 C 19.301 0.15 1 272 30 30 ILE CD1 C 13.347 0.15 1 273 30 30 ILE N N 121.880 0.15 1 274 31 31 ASN H H 8.928 0.05 1 275 31 31 ASN HA H 4.535 0.05 1 276 31 31 ASN HB2 H 3.360 0.05 2 277 31 31 ASN HB3 H 2.701 0.05 2 278 31 31 ASN HD21 H 8.513 0.05 2 279 31 31 ASN C C 177.814 0.15 1 280 31 31 ASN CA C 55.928 0.15 1 281 31 31 ASN CB C 36.902 0.15 1 282 31 31 ASN N N 121.134 0.15 1 283 31 31 ASN ND2 N 105.370 0.15 1 284 32 32 LYS H H 7.888 0.05 1 285 32 32 LYS HA H 3.990 0.05 1 286 32 32 LYS HB2 H 2.019 0.05 2 287 32 32 LYS HG2 H 1.491 0.05 2 288 32 32 LYS HG3 H 1.667 0.05 2 289 32 32 LYS HE2 H 2.974 0.05 2 290 32 32 LYS C C 178.629 0.15 1 291 32 32 LYS CA C 59.792 0.15 1 292 32 32 LYS CB C 32.124 0.15 1 293 32 32 LYS CG C 25.544 0.15 1 294 32 32 LYS CD C 29.232 0.15 1 295 32 32 LYS CE C 42.314 0.15 1 296 32 32 LYS N N 118.484 0.15 1 297 33 33 GLN H H 7.737 0.05 1 298 33 33 GLN HA H 4.161 0.05 1 299 33 33 GLN HB2 H 2.274 0.05 2 300 33 33 GLN HB3 H 2.572 0.05 2 301 33 33 GLN HG2 H 2.688 0.05 2 302 33 33 GLN HG3 H 2.430 0.05 2 303 33 33 GLN HE21 H 7.468 0.05 2 304 33 33 GLN HE22 H 6.729 0.05 2 305 33 33 GLN C C 179.786 0.15 1 306 33 33 GLN CA C 58.843 0.15 1 307 33 33 GLN CB C 28.085 0.15 1 308 33 33 GLN CG C 33.941 0.15 1 309 33 33 GLN N N 118.413 0.15 1 310 33 33 GLN NE2 N 110.685 0.15 1 311 34 34 PHE H H 8.382 0.05 1 312 34 34 PHE HA H 4.130 0.05 1 313 34 34 PHE HB2 H 2.544 0.05 2 314 34 34 PHE HB3 H 3.317 0.05 2 315 34 34 PHE HD1 H 7.049 0.05 4 316 34 34 PHE HD2 H 7.049 0.05 4 317 34 34 PHE C C 177.700 0.15 1 318 34 34 PHE CA C 62.382 0.15 1 319 34 34 PHE CB C 39.915 0.15 1 320 34 34 PHE N N 120.821 0.15 1 321 35 35 LEU H H 8.138 0.05 1 322 35 35 LEU HA H 4.026 0.05 1 323 35 35 LEU HB2 H 1.594 0.05 2 324 35 35 LEU HB3 H 1.844 0.05 2 325 35 35 LEU HD2 H 0.842 0.05 2 326 35 35 LEU C C 177.627 0.15 1 327 35 35 LEU CA C 57.529 0.15 1 328 35 35 LEU CB C 41.934 0.15 1 329 35 35 LEU CG C 26.460 0.15 1 330 35 35 LEU CD1 C 25.078 0.15 2 331 35 35 LEU CD2 C 24.553 0.15 2 332 35 35 LEU N N 117.877 0.15 1 333 36 36 ASP H H 7.173 0.05 1 334 36 36 ASP HA H 4.792 0.05 1 335 36 36 ASP HB2 H 2.534 0.05 2 336 36 36 ASP HB3 H 2.827 0.05 2 337 36 36 ASP C C 175.896 0.15 1 338 36 36 ASP CA C 53.672 0.15 1 339 36 36 ASP CB C 41.909 0.15 1 340 36 36 ASP N N 115.016 0.15 1 341 37 37 ASP H H 7.481 0.05 1 342 37 37 ASP HA H 4.839 0.05 1 343 37 37 ASP HB2 H 3.406 0.05 2 344 37 37 ASP HB3 H 2.650 0.05 2 345 37 37 ASP CA C 51.644 0.15 1 346 37 37 ASP CB C 42.487 0.15 1 347 37 37 ASP N N 124.220 0.15 1 348 38 38 PRO HA H 4.551 0.05 1 349 38 38 PRO HB2 H 2.339 0.05 2 350 38 38 PRO HB3 H 1.962 0.05 2 351 38 38 PRO HD2 H 3.936 0.05 2 352 38 38 PRO HD3 H 4.125 0.05 2 353 38 38 PRO C C 178.364 0.15 1 354 38 38 PRO CA C 64.157 0.15 1 355 38 38 PRO CB C 32.214 0.15 1 356 38 38 PRO CG C 27.158 0.15 1 357 38 38 PRO CD C 51.454 0.15 1 358 39 39 LYS H H 8.683 0.05 1 359 39 39 LYS HA H 3.850 0.05 1 360 39 39 LYS HB2 H 0.974 0.05 2 361 39 39 LYS HB3 H 1.192 0.05 2 362 39 39 LYS HG2 H 0.913 0.05 2 363 39 39 LYS HG3 H 1.099 0.05 2 364 39 39 LYS HD2 H 1.483 0.05 2 365 39 39 LYS HE2 H 2.873 0.05 2 366 39 39 LYS HE3 H 2.885 0.05 2 367 39 39 LYS C C 177.547 0.15 1 368 39 39 LYS CA C 58.785 0.15 1 369 39 39 LYS CB C 31.932 0.15 1 370 39 39 LYS CG C 24.857 0.15 1 371 39 39 LYS CD C 28.946 0.15 1 372 39 39 LYS CE C 41.749 0.15 1 373 39 39 LYS N N 119.257 0.15 1 374 40 40 TYR H H 7.664 0.05 1 375 40 40 TYR HA H 4.966 0.05 1 376 40 40 TYR HB2 H 2.917 0.05 2 377 40 40 TYR HB3 H 3.556 0.05 2 378 40 40 TYR HD1 H 7.191 0.05 4 379 40 40 TYR HD2 H 7.191 0.05 4 380 40 40 TYR HE1 H 6.630 0.05 4 381 40 40 TYR HE2 H 6.630 0.05 4 382 40 40 TYR C C 177.372 0.15 1 383 40 40 TYR CA C 57.498 0.15 1 384 40 40 TYR CB C 40.382 0.15 1 385 40 40 TYR N N 115.114 0.15 1 386 41 41 SER H H 8.063 0.05 1 387 41 41 SER HB2 H 3.868 0.05 2 388 41 41 SER C C 175.135 0.15 1 389 41 41 SER CA C 61.013 0.15 1 390 41 41 SER CB C 63.494 0.15 1 391 41 41 SER N N 113.629 0.15 1 392 42 42 SER H H 8.245 0.05 1 393 42 42 SER HA H 4.433 0.05 1 394 42 42 SER HB2 H 4.023 0.05 2 395 42 42 SER HB3 H 3.931 0.05 2 396 42 42 SER C C 174.148 0.15 1 397 42 42 SER CA C 59.377 0.15 1 398 42 42 SER CB C 63.144 0.15 1 399 42 42 SER N N 116.127 0.15 1 400 43 43 ASP H H 7.643 0.05 1 401 43 43 ASP HA H 4.669 0.05 1 402 43 43 ASP HB2 H 3.062 0.05 2 403 43 43 ASP HB3 H 2.775 0.05 2 404 43 43 ASP C C 177.100 0.15 1 405 43 43 ASP CA C 53.714 0.15 1 406 43 43 ASP CB C 41.113 0.15 1 407 43 43 ASP N N 121.688 0.15 1 408 44 44 GLU H H 9.130 0.05 1 409 44 44 GLU HA H 4.134 0.05 1 410 44 44 GLU HB2 H 2.130 0.05 2 411 44 44 GLU HB3 H 2.059 0.05 2 412 44 44 GLU HG2 H 2.336 0.05 2 413 44 44 GLU C C 176.612 0.15 1 414 44 44 GLU CA C 58.338 0.15 1 415 44 44 GLU CB C 29.654 0.15 1 416 44 44 GLU CG C 36.250 0.15 1 417 44 44 GLU N N 128.109 0.15 1 418 45 45 ASP H H 8.508 0.05 1 419 45 45 ASP HA H 4.953 0.05 1 420 45 45 ASP HB2 H 2.525 0.05 2 421 45 45 ASP HB3 H 2.881 0.05 2 422 45 45 ASP C C 175.863 0.15 1 423 45 45 ASP CA C 53.501 0.15 1 424 45 45 ASP CB C 41.523 0.15 1 425 45 45 ASP N N 117.764 0.15 1 426 46 46 LEU H H 7.592 0.05 1 427 46 46 LEU HA H 4.011 0.05 1 428 46 46 LEU HB2 H 1.772 0.05 2 429 46 46 LEU HB3 H 2.034 0.05 2 430 46 46 LEU HD1 H 1.074 0.05 2 431 46 46 LEU HD2 H 1.007 0.05 2 432 46 46 LEU CA C 59.424 0.15 1 433 46 46 LEU CB C 39.819 0.15 1 434 46 46 LEU CD1 C 27.464 0.15 2 435 46 46 LEU CD2 C 24.128 0.15 2 436 46 46 LEU N N 121.180 0.15 1 437 47 47 PRO HA H 4.101 0.05 1 438 47 47 PRO HB2 H 2.015 0.05 2 439 47 47 PRO HB3 H 2.361 0.05 2 440 47 47 PRO HG2 H 2.210 0.05 2 441 47 47 PRO HD2 H 3.725 0.05 2 442 47 47 PRO C C 179.597 0.15 1 443 47 47 PRO CA C 67.456 0.15 1 444 47 47 PRO CB C 30.463 0.15 1 445 47 47 PRO CG C 28.704 0.15 1 446 48 48 SER H H 7.541 0.05 1 447 48 48 SER HA H 4.186 0.05 1 448 48 48 SER HB3 H 3.859 0.05 2 449 48 48 SER C C 177.861 0.15 1 450 48 48 SER CA C 61.083 0.15 1 451 48 48 SER CB C 62.511 0.15 1 452 48 48 SER N N 111.719 0.15 1 453 49 49 LYS H H 7.974 0.05 1 454 49 49 LYS HA H 3.608 0.05 1 455 49 49 LYS HB2 H 1.328 0.05 2 456 49 49 LYS HG2 H 1.129 0.05 2 457 49 49 LYS HG3 H 1.477 0.05 2 458 49 49 LYS HD2 H 1.754 0.05 2 459 49 49 LYS C C 178.638 0.15 1 460 49 49 LYS CA C 59.518 0.15 1 461 49 49 LYS CB C 32.516 0.15 1 462 49 49 LYS CG C 25.993 0.15 1 463 49 49 LYS CD C 29.779 0.15 1 464 49 49 LYS CE C 42.090 0.15 1 465 49 49 LYS N N 123.951 0.15 1 466 50 50 LEU H H 8.518 0.05 1 467 50 50 LEU HA H 3.872 0.05 1 468 50 50 LEU HB2 H 1.284 0.05 2 469 50 50 LEU HB3 H 1.847 0.05 2 470 50 50 LEU HG H 0.832 0.05 1 471 50 50 LEU HD1 H 0.734 0.05 2 472 50 50 LEU C C 179.377 0.15 1 473 50 50 LEU CA C 58.129 0.15 1 474 50 50 LEU CB C 40.198 0.15 1 475 50 50 LEU CG C 27.832 0.15 1 476 50 50 LEU CD1 C 23.355 0.15 2 477 50 50 LEU N N 116.861 0.15 1 478 51 51 GLU H H 7.522 0.05 1 479 51 51 GLU HA H 3.943 0.05 1 480 51 51 GLU HB3 H 2.068 0.05 2 481 51 51 GLU HG2 H 2.531 0.05 2 482 51 51 GLU HG3 H 2.346 0.05 2 483 51 51 GLU C C 179.028 0.15 1 484 51 51 GLU CA C 59.592 0.15 1 485 51 51 GLU CB C 29.193 0.15 1 486 51 51 GLU CG C 35.548 0.15 1 487 51 51 GLU N N 119.165 0.15 1 488 52 52 GLY H H 7.598 0.05 1 489 52 52 GLY HA2 H 3.826 0.05 2 490 52 52 GLY C C 177.520 0.15 1 491 52 52 GLY CA C 46.922 0.15 1 492 52 52 GLY N N 105.654 0.15 1 493 53 53 PHE H H 8.523 0.05 1 494 53 53 PHE HA H 4.931 0.05 1 495 53 53 PHE HB2 H 3.347 0.05 2 496 53 53 PHE HB3 H 3.194 0.05 2 497 53 53 PHE HD1 H 6.973 0.05 4 498 53 53 PHE HD2 H 6.973 0.05 4 499 53 53 PHE HE1 H 6.570 0.05 4 500 53 53 PHE HE2 H 6.570 0.05 4 501 53 53 PHE C C 177.755 0.15 1 502 53 53 PHE CA C 58.361 0.15 1 503 53 53 PHE CB C 37.331 0.15 1 504 53 53 PHE N N 122.382 0.15 1 505 54 54 LYS H H 8.484 0.05 1 506 54 54 LYS HA H 4.091 0.05 1 507 54 54 LYS HB2 H 2.089 0.05 2 508 54 54 LYS HG2 H 1.142 0.05 2 509 54 54 LYS HD2 H 1.664 0.05 2 510 54 54 LYS C C 177.599 0.15 1 511 54 54 LYS CA C 60.362 0.15 1 512 54 54 LYS CB C 32.214 0.15 1 513 54 54 LYS CG C 25.381 0.15 1 514 54 54 LYS CD C 29.470 0.15 1 515 54 54 LYS CE C 41.861 0.15 1 516 54 54 LYS N N 124.295 0.15 1 517 55 55 GLU H H 7.643 0.05 1 518 55 55 GLU HA H 3.938 0.05 1 519 55 55 GLU HB3 H 2.204 0.05 2 520 55 55 GLU HG3 H 2.532 0.05 2 521 55 55 GLU C C 179.397 0.15 1 522 55 55 GLU CA C 59.518 0.15 1 523 55 55 GLU CB C 29.455 0.15 1 524 55 55 GLU CG C 36.348 0.15 1 525 55 55 GLU N N 117.130 0.15 1 526 56 56 LYS H H 8.018 0.05 1 527 56 56 LYS HA H 4.246 0.05 1 528 56 56 LYS HB2 H 2.361 0.05 2 529 56 56 LYS HB3 H 2.312 0.05 2 530 56 56 LYS HG2 H 1.791 0.05 2 531 56 56 LYS HG3 H 1.894 0.05 2 532 56 56 LYS HE2 H 3.032 0.05 2 533 56 56 LYS C C 178.984 0.15 1 534 56 56 LYS CA C 58.088 0.15 1 535 56 56 LYS CB C 31.701 0.15 1 536 56 56 LYS CG C 24.620 0.15 1 537 56 56 LYS CD C 27.892 0.15 1 538 56 56 LYS CE C 41.379 0.15 1 539 56 56 LYS N N 117.807 0.15 1 540 57 57 TYR H H 8.740 0.05 1 541 57 57 TYR HA H 3.615 0.05 1 542 57 57 TYR HB3 H 2.893 0.05 2 543 57 57 TYR HD1 H 6.539 0.05 4 544 57 57 TYR HD2 H 6.539 0.05 4 545 57 57 TYR HE1 H 6.411 0.05 4 546 57 57 TYR HE2 H 6.411 0.05 4 547 57 57 TYR HH H 8.946 0.05 1 548 57 57 TYR C C 176.710 0.15 1 549 57 57 TYR CA C 62.237 0.15 1 550 57 57 TYR CB C 39.393 0.15 1 551 57 57 TYR N N 121.830 0.15 1 552 58 58 MET H H 7.814 0.05 1 553 58 58 MET HA H 4.172 0.05 1 554 58 58 MET HB2 H 2.255 0.05 2 555 58 58 MET HB3 H 2.300 0.05 2 556 58 58 MET HG2 H 2.872 0.05 2 557 58 58 MET HG3 H 2.292 0.05 2 558 58 58 MET HE H 2.057 0.05 1 559 58 58 MET C C 177.062 0.15 1 560 58 58 MET CA C 57.046 0.15 1 561 58 58 MET CB C 32.412 0.15 1 562 58 58 MET CG C 33.052 0.15 1 563 58 58 MET CE C 16.271 0.15 1 564 58 58 MET N N 110.404 0.15 1 565 59 59 GLU H H 7.599 0.05 1 566 59 59 GLU HA H 4.050 0.05 1 567 59 59 GLU HB3 H 1.903 0.05 2 568 59 59 GLU HG2 H 2.764 0.05 2 569 59 59 GLU HG3 H 2.175 0.05 2 570 59 59 GLU C C 178.343 0.15 1 571 59 59 GLU CA C 58.008 0.15 1 572 59 59 GLU CB C 30.238 0.15 1 573 59 59 GLU CG C 36.960 0.15 1 574 59 59 GLU N N 118.144 0.15 1 575 60 60 PHE H H 7.662 0.05 1 576 60 60 PHE HA H 4.179 0.05 1 577 60 60 PHE HB2 H 2.797 0.05 2 578 60 60 PHE HB3 H 2.488 0.05 2 579 60 60 PHE HD1 H 7.362 0.05 4 580 60 60 PHE HD2 H 7.362 0.05 4 581 60 60 PHE HE1 H 7.033 0.05 4 582 60 60 PHE HE2 H 7.033 0.05 4 583 60 60 PHE C C 175.322 0.15 1 584 60 60 PHE CA C 57.697 0.15 1 585 60 60 PHE CB C 39.865 0.15 1 586 60 60 PHE N N 118.369 0.15 1 587 61 61 ASP H H 8.422 0.05 1 588 61 61 ASP HA H 4.541 0.05 1 589 61 61 ASP HB2 H 2.662 0.05 2 590 61 61 ASP HB3 H 2.494 0.05 2 591 61 61 ASP C C 176.336 0.15 1 592 61 61 ASP CA C 54.350 0.15 1 593 61 61 ASP CB C 40.553 0.15 1 594 61 61 ASP N N 118.398 0.15 1 595 62 62 LEU H H 8.622 0.05 1 596 62 62 LEU HA H 4.431 0.05 1 597 62 62 LEU HB2 H 1.104 0.05 2 598 62 62 LEU HB3 H 1.706 0.05 2 599 62 62 LEU HG H 1.576 0.05 1 600 62 62 LEU HD1 H 0.741 0.05 2 601 62 62 LEU HD2 H 0.177 0.05 2 602 62 62 LEU C C 177.437 0.15 1 603 62 62 LEU CA C 53.972 0.15 1 604 62 62 LEU CB C 43.563 0.15 1 605 62 62 LEU CG C 27.244 0.15 1 606 62 62 LEU CD1 C 24.876 0.15 2 607 62 62 LEU CD2 C 23.454 0.15 2 608 62 62 LEU N N 126.599 0.15 1 609 63 63 ASN H H 8.635 0.05 1 610 63 63 ASN HA H 4.762 0.05 1 611 63 63 ASN HB2 H 2.957 0.05 2 612 63 63 ASN HB3 H 3.470 0.05 2 613 63 63 ASN HD21 H 7.929 0.05 2 614 63 63 ASN HD22 H 8.180 0.05 2 615 63 63 ASN C C 177.859 0.15 1 616 63 63 ASN CA C 50.738 0.15 1 617 63 63 ASN CB C 37.950 0.15 1 618 63 63 ASN N N 120.301 0.15 1 619 63 63 ASN ND2 N 111.628 0.15 1 620 64 64 GLY H H 8.668 0.05 1 621 64 64 GLY HA2 H 3.828 0.05 2 622 64 64 GLY HA3 H 3.954 0.05 2 623 64 64 GLY C C 174.664 0.15 1 624 64 64 GLY CA C 47.081 0.15 1 625 64 64 GLY N N 106.132 0.15 1 626 65 65 ASN H H 7.627 0.05 1 627 65 65 ASN HA H 4.881 0.05 1 628 65 65 ASN HB2 H 2.567 0.05 2 629 65 65 ASN HB3 H 2.885 0.05 2 630 65 65 ASN HD21 H 6.874 0.05 2 631 65 65 ASN HD22 H 8.078 0.05 2 632 65 65 ASN C C 175.175 0.15 1 633 65 65 ASN CA C 52.659 0.15 1 634 65 65 ASN CB C 39.852 0.15 1 635 65 65 ASN N N 116.181 0.15 1 636 65 65 ASN ND2 N 114.925 0.15 1 637 66 66 GLY H H 8.290 0.05 1 638 66 66 GLY HA2 H 3.533 0.05 2 639 66 66 GLY HA3 H 4.233 0.05 2 640 66 66 GLY C C 173.876 0.15 1 641 66 66 GLY CA C 45.564 0.15 1 642 66 66 GLY N N 107.690 0.15 1 643 67 67 ASP H H 7.785 0.05 1 644 67 67 ASP HA H 4.970 0.05 1 645 67 67 ASP HB2 H 2.459 0.05 2 646 67 67 ASP C C 174.553 0.15 1 647 67 67 ASP CA C 53.659 0.15 1 648 67 67 ASP CB C 42.579 0.15 1 649 67 67 ASP N N 122.044 0.15 1 650 68 68 ILE H H 8.335 0.05 1 651 68 68 ILE HA H 3.756 0.05 1 652 68 68 ILE HB H 0.062 0.05 1 653 68 68 ILE HG12 H 0.232 0.05 2 654 68 68 ILE HG13 H 0.430 0.05 2 655 68 68 ILE HG2 H 0.365 0.05 1 656 68 68 ILE HD1 H -0.739 0.05 1 657 68 68 ILE C C 174.368 0.15 1 658 68 68 ILE CA C 61.135 0.15 1 659 68 68 ILE CB C 37.393 0.15 1 660 68 68 ILE CG1 C 28.047 0.15 1 661 68 68 ILE CG2 C 17.613 0.15 1 662 68 68 ILE CD1 C 12.906 0.15 1 663 68 68 ILE N N 121.402 0.15 1 664 69 69 ASP H H 7.797 0.05 1 665 69 69 ASP HA H 5.148 0.05 1 666 69 69 ASP HB2 H 3.359 0.05 2 667 69 69 ASP HB3 H 2.468 0.05 2 668 69 69 ASP C C 176.372 0.15 1 669 69 69 ASP CA C 50.859 0.15 1 670 69 69 ASP CB C 43.353 0.15 1 671 69 69 ASP N N 124.669 0.15 1 672 70 70 ILE H H 7.938 0.05 1 673 70 70 ILE HA H 3.726 0.05 1 674 70 70 ILE HB H 1.833 0.05 1 675 70 70 ILE HG12 H 1.104 0.05 2 676 70 70 ILE HG13 H 1.758 0.05 2 677 70 70 ILE HG2 H 0.979 0.05 1 678 70 70 ILE HD1 H 0.795 0.05 1 679 70 70 ILE C C 176.663 0.15 1 680 70 70 ILE CA C 65.703 0.15 1 681 70 70 ILE CB C 38.313 0.15 1 682 70 70 ILE CG1 C 30.270 0.15 1 683 70 70 ILE CG2 C 16.915 0.15 1 684 70 70 ILE CD1 C 14.165 0.15 1 685 70 70 ILE N N 117.369 0.15 1 686 71 71 MET H H 7.711 0.05 1 687 71 71 MET HA H 4.379 0.05 1 688 71 71 MET HB2 H 2.208 0.05 2 689 71 71 MET HB3 H 2.074 0.05 2 690 71 71 MET HG2 H 2.756 0.05 2 691 71 71 MET HG3 H 2.643 0.05 2 692 71 71 MET HE H 2.123 0.05 1 693 71 71 MET C C 178.559 0.15 1 694 71 71 MET CA C 57.345 0.15 1 695 71 71 MET CB C 30.914 0.15 1 696 71 71 MET CG C 32.746 0.15 1 697 71 71 MET CE C 17.078 0.15 1 698 71 71 MET N N 119.093 0.15 1 699 72 72 SER H H 8.422 0.05 1 700 72 72 SER HA H 4.281 0.05 1 701 72 72 SER HB2 H 4.131 0.05 2 702 72 72 SER C C 178.974 0.15 1 703 72 72 SER CA C 60.796 0.15 1 704 72 72 SER CB C 62.718 0.15 1 705 72 72 SER N N 117.182 0.15 1 706 73 73 LEU H H 8.508 0.05 1 707 73 73 LEU HA H 4.294 0.05 1 708 73 73 LEU HB2 H 2.082 0.05 2 709 73 73 LEU HB3 H 1.506 0.05 2 710 73 73 LEU HG H 1.031 0.05 1 711 73 73 LEU HD1 H 1.172 0.05 2 712 73 73 LEU C C 177.532 0.15 1 713 73 73 LEU CA C 58.052 0.15 1 714 73 73 LEU CB C 42.012 0.15 1 715 73 73 LEU CG C 27.701 0.15 1 716 73 73 LEU CD1 C 24.621 0.15 2 717 73 73 LEU N N 120.936 0.15 1 718 74 74 LYS H H 8.698 0.05 1 719 74 74 LYS HA H 3.867 0.05 1 720 74 74 LYS HB2 H 2.024 0.05 2 721 74 74 LYS HB3 H 2.183 0.05 2 722 74 74 LYS HG2 H 1.309 0.05 2 723 74 74 LYS HG3 H 1.523 0.05 2 724 74 74 LYS HD2 H 1.689 0.05 2 725 74 74 LYS HE2 H 3.067 0.05 2 726 74 74 LYS C C 179.009 0.15 1 727 74 74 LYS CA C 59.940 0.15 1 728 74 74 LYS CB C 33.282 0.15 1 729 74 74 LYS CG C 25.049 0.15 1 730 74 74 LYS CD C 30.131 0.15 1 731 74 74 LYS CE C 42.222 0.15 1 732 74 74 LYS N N 119.672 0.15 1 733 75 75 ARG H H 8.027 0.05 1 734 75 75 ARG HA H 4.121 0.05 1 735 75 75 ARG HB2 H 1.968 0.05 2 736 75 75 ARG HB3 H 2.022 0.05 2 737 75 75 ARG HG2 H 1.680 0.05 2 738 75 75 ARG HD2 H 3.287 0.05 2 739 75 75 ARG C C 179.386 0.15 1 740 75 75 ARG CA C 59.355 0.15 1 741 75 75 ARG CB C 30.417 0.15 1 742 75 75 ARG CG C 28.154 0.15 1 743 75 75 ARG CD C 43.583 0.15 1 744 75 75 ARG N N 117.345 0.15 1 745 76 76 MET H H 8.020 0.05 1 746 76 76 MET HA H 4.149 0.05 1 747 76 76 MET HB2 H 2.035 0.05 2 748 76 76 MET HB3 H 2.137 0.05 2 749 76 76 MET HE H 1.290 0.05 1 750 76 76 MET C C 177.795 0.15 1 751 76 76 MET CA C 57.636 0.15 1 752 76 76 MET CB C 32.023 0.15 1 753 76 76 MET CG C 31.105 0.15 1 754 76 76 MET CE C 16.663 0.15 1 755 76 76 MET N N 120.282 0.15 1 756 77 77 LEU H H 8.540 0.05 1 757 77 77 LEU HA H 3.875 0.05 1 758 77 77 LEU HB2 H 1.819 0.05 2 759 77 77 LEU HB3 H 2.008 0.05 2 760 77 77 LEU HD1 H 0.749 0.05 2 761 77 77 LEU HD2 H 0.787 0.05 2 762 77 77 LEU C C 179.746 0.15 1 763 77 77 LEU CA C 58.455 0.15 1 764 77 77 LEU CB C 38.646 0.15 1 765 77 77 LEU CD1 C 23.028 0.15 2 766 77 77 LEU CD2 C 26.099 0.15 2 767 77 77 LEU N N 118.098 0.15 1 768 78 78 GLU H H 8.227 0.05 1 769 78 78 GLU HA H 3.837 0.05 1 770 78 78 GLU HB2 H 2.020 0.05 2 771 78 78 GLU HB3 H 2.233 0.05 2 772 78 78 GLU HG2 H 2.527 0.05 2 773 78 78 GLU HG3 H 2.246 0.05 2 774 78 78 GLU C C 180.679 0.15 1 775 78 78 GLU CA C 59.923 0.15 1 776 78 78 GLU CB C 29.247 0.15 1 777 78 78 GLU CG C 37.005 0.15 1 778 78 78 GLU N N 119.000 0.15 1 779 79 79 LYS H H 7.873 0.05 1 780 79 79 LYS HA H 4.031 0.05 1 781 79 79 LYS HB2 H 2.033 0.05 2 782 79 79 LYS HG2 H 1.411 0.05 2 783 79 79 LYS C C 178.668 0.15 1 784 79 79 LYS CA C 59.696 0.15 1 785 79 79 LYS CB C 31.867 0.15 1 786 79 79 LYS CG C 25.157 0.15 1 787 79 79 LYS CD C 29.614 0.15 1 788 79 79 LYS CE C 41.966 0.15 1 789 79 79 LYS N N 122.768 0.15 1 790 80 80 LEU H H 7.756 0.05 1 791 80 80 LEU HA H 4.226 0.05 1 792 80 80 LEU HB3 H 1.670 0.05 2 793 80 80 LEU HG H 1.842 0.05 1 794 80 80 LEU HD1 H 0.788 0.05 2 795 80 80 LEU HD2 H 0.746 0.05 2 796 80 80 LEU C C 176.910 0.15 1 797 80 80 LEU CA C 55.094 0.15 1 798 80 80 LEU CB C 42.432 0.15 1 799 80 80 LEU CG C 26.265 0.15 1 800 80 80 LEU CD1 C 22.144 0.15 2 801 80 80 LEU CD2 C 25.335 0.15 2 802 80 80 LEU N N 117.170 0.15 1 803 81 81 GLY H H 7.765 0.05 1 804 81 81 GLY HA2 H 3.804 0.05 2 805 81 81 GLY HA3 H 4.130 0.05 2 806 81 81 GLY C C 174.300 0.15 1 807 81 81 GLY CA C 45.698 0.15 1 808 81 81 GLY N N 107.236 0.15 1 809 82 82 VAL H H 8.143 0.05 1 810 82 82 VAL HA H 4.468 0.05 1 811 82 82 VAL HB H 2.034 0.05 1 812 82 82 VAL HG1 H 0.838 0.05 2 813 82 82 VAL HG2 H 0.824 0.05 2 814 82 82 VAL CA C 58.711 0.15 1 815 82 82 VAL CB C 32.386 0.15 1 816 82 82 VAL CG1 C 22.158 0.15 2 817 82 82 VAL CG2 C 20.025 0.15 2 818 82 82 VAL N N 118.928 0.15 1 819 83 83 PRO HA H 4.405 0.05 1 820 83 83 PRO HB2 H 1.904 0.05 2 821 83 83 PRO HD2 H 3.491 0.05 2 822 83 83 PRO HD3 H 3.605 0.05 2 823 83 83 PRO C C 177.542 0.15 1 824 83 83 PRO CA C 62.812 0.15 1 825 83 83 PRO CB C 32.370 0.15 1 826 83 83 PRO CG C 27.391 0.15 1 827 83 83 PRO CD C 50.455 0.15 1 828 84 84 LYS H H 7.988 0.05 1 829 84 84 LYS HA H 4.891 0.05 1 830 84 84 LYS HB2 H 1.834 0.05 2 831 84 84 LYS HB3 H 1.593 0.05 2 832 84 84 LYS HG2 H 1.168 0.05 2 833 84 84 LYS HD2 H 1.528 0.05 2 834 84 84 LYS HE2 H 2.638 0.05 2 835 84 84 LYS C C 176.350 0.15 1 836 84 84 LYS CA C 53.176 0.15 1 837 84 84 LYS CB C 36.968 0.15 1 838 84 84 LYS CG C 24.773 0.15 1 839 84 84 LYS CE C 42.391 0.15 1 840 84 84 LYS N N 120.935 0.15 1 841 85 85 THR H H 8.944 0.05 1 842 85 85 THR HA H 4.420 0.05 1 843 85 85 THR HB H 4.755 0.05 1 844 85 85 THR HG2 H 1.339 0.05 1 845 85 85 THR C C 175.081 0.15 1 846 85 85 THR CA C 61.013 0.15 1 847 85 85 THR CB C 71.072 0.15 1 848 85 85 THR CG2 C 21.799 0.15 1 849 85 85 THR N N 112.289 0.15 1 850 86 86 HIS H H 8.959 0.05 1 851 86 86 HIS HA H 4.164 0.05 1 852 86 86 HIS HB2 H 3.172 0.05 2 853 86 86 HIS HD2 H 6.918 0.05 1 854 86 86 HIS C C 177.258 0.15 1 855 86 86 HIS CA C 61.312 0.15 1 856 86 86 HIS CB C 30.821 0.15 1 857 86 86 HIS N N 120.817 0.15 1 858 87 87 LEU H H 8.155 0.05 1 859 87 87 LEU HA H 3.981 0.05 1 860 87 87 LEU HB2 H 1.709 0.05 2 861 87 87 LEU HB3 H 1.532 0.05 2 862 87 87 LEU HD1 H 1.006 0.05 2 863 87 87 LEU HD2 H 0.954 0.05 2 864 87 87 LEU C C 180.121 0.15 1 865 87 87 LEU CA C 58.240 0.15 1 866 87 87 LEU CB C 41.908 0.15 1 867 87 87 LEU CD1 C 24.061 0.15 2 868 87 87 LEU CD2 C 23.812 0.15 2 869 87 87 LEU N N 116.901 0.15 1 870 88 88 GLU H H 7.586 0.05 1 871 88 88 GLU HA H 3.922 0.05 1 872 88 88 GLU HB2 H 1.838 0.05 2 873 88 88 GLU HB3 H 2.376 0.05 2 874 88 88 GLU HG2 H 2.387 0.05 2 875 88 88 GLU HG3 H 2.205 0.05 2 876 88 88 GLU C C 179.692 0.15 1 877 88 88 GLU CA C 59.289 0.15 1 878 88 88 GLU CB C 30.748 0.15 1 879 88 88 GLU CG C 37.435 0.15 1 880 88 88 GLU N N 119.067 0.15 1 881 89 89 LEU H H 8.687 0.05 1 882 89 89 LEU HA H 3.878 0.05 1 883 89 89 LEU HB2 H 1.287 0.05 2 884 89 89 LEU HB3 H 2.136 0.05 2 885 89 89 LEU HD1 H 0.798 0.05 2 886 89 89 LEU HD2 H 0.836 0.05 2 887 89 89 LEU C C 178.496 0.15 1 888 89 89 LEU CA C 58.416 0.15 1 889 89 89 LEU CB C 41.939 0.15 1 890 89 89 LEU CD1 C 24.153 0.15 2 891 89 89 LEU CD2 C 25.985 0.15 2 892 89 89 LEU N N 120.907 0.15 1 893 90 90 LYS H H 8.075 0.05 1 894 90 90 LYS HA H 3.860 0.05 1 895 90 90 LYS HB2 H 1.845 0.05 2 896 90 90 LYS HG2 H 1.319 0.05 2 897 90 90 LYS HG3 H 1.077 0.05 2 898 90 90 LYS HD2 H 1.587 0.05 2 899 90 90 LYS HE2 H 2.939 0.05 2 900 90 90 LYS C C 179.965 0.15 1 901 90 90 LYS CA C 59.938 0.15 1 902 90 90 LYS CB C 31.999 0.15 1 903 90 90 LYS CG C 25.295 0.15 1 904 90 90 LYS CD C 29.348 0.15 1 905 90 90 LYS N N 118.162 0.15 1 906 91 91 LYS H H 7.622 0.05 1 907 91 91 LYS HA H 4.061 0.05 1 908 91 91 LYS HB3 H 1.931 0.05 2 909 91 91 LYS HG2 H 1.392 0.05 2 910 91 91 LYS HG3 H 1.567 0.05 2 911 91 91 LYS HE2 H 2.933 0.05 2 912 91 91 LYS C C 179.332 0.15 1 913 91 91 LYS CA C 59.212 0.15 1 914 91 91 LYS CB C 32.137 0.15 1 915 91 91 LYS CG C 25.081 0.15 1 916 91 91 LYS CD C 29.285 0.15 1 917 91 91 LYS CE C 42.014 0.15 1 918 91 91 LYS N N 120.697 0.15 1 919 92 92 LEU H H 8.074 0.05 1 920 92 92 LEU HA H 4.110 0.05 1 921 92 92 LEU HB2 H 1.445 0.05 2 922 92 92 LEU HB3 H 1.716 0.05 2 923 92 92 LEU HD1 H 0.840 0.05 2 924 92 92 LEU HD2 H 0.819 0.05 2 925 92 92 LEU C C 179.916 0.15 1 926 92 92 LEU CA C 58.462 0.15 1 927 92 92 LEU CB C 42.257 0.15 1 928 92 92 LEU CD1 C 24.749 0.15 2 929 92 92 LEU CD2 C 25.987 0.15 2 930 92 92 LEU N N 120.513 0.15 1 931 93 93 ILE H H 8.185 0.05 1 932 93 93 ILE HA H 3.506 0.05 1 933 93 93 ILE HB H 1.813 0.05 1 934 93 93 ILE HG12 H 0.957 0.05 2 935 93 93 ILE HG2 H 0.802 0.05 1 936 93 93 ILE HD1 H 0.723 0.05 1 937 93 93 ILE C C 178.320 0.15 1 938 93 93 ILE CA C 65.709 0.15 1 939 93 93 ILE CB C 37.725 0.15 1 940 93 93 ILE CG1 C 30.612 0.15 1 941 93 93 ILE CG2 C 17.477 0.15 1 942 93 93 ILE CD1 C 12.839 0.15 1 943 93 93 ILE N N 118.247 0.15 1 944 94 94 GLY H H 8.217 0.05 1 945 94 94 GLY HA2 H 3.905 0.05 2 946 94 94 GLY C C 175.217 0.15 1 947 94 94 GLY CA C 46.746 0.15 1 948 94 94 GLY N N 107.826 0.15 1 949 95 95 GLU H H 7.314 0.05 1 950 95 95 GLU HA H 4.163 0.05 1 951 95 95 GLU HB2 H 2.019 0.05 2 952 95 95 GLU HB3 H 2.184 0.05 2 953 95 95 GLU HG2 H 2.535 0.05 2 954 95 95 GLU HG3 H 2.216 0.05 2 955 95 95 GLU C C 177.036 0.15 1 956 95 95 GLU CA C 58.013 0.15 1 957 95 95 GLU CB C 30.942 0.15 1 958 95 95 GLU CG C 36.989 0.15 1 959 95 95 GLU N N 117.066 0.15 1 960 96 96 VAL H H 7.308 0.05 1 961 96 96 VAL HA H 3.915 0.05 1 962 96 96 VAL HB H 1.674 0.05 1 963 96 96 VAL HG1 H 0.320 0.05 2 964 96 96 VAL HG2 H 0.580 0.05 2 965 96 96 VAL C C 175.951 0.15 1 966 96 96 VAL CA C 62.530 0.15 1 967 96 96 VAL CB C 33.885 0.15 1 968 96 96 VAL CG1 C 21.155 0.15 1 969 96 96 VAL CG2 C 21.155 0.15 1 970 96 96 VAL N N 114.932 0.15 1 971 97 97 SER H H 8.124 0.05 1 972 97 97 SER HA H 4.557 0.05 1 973 97 97 SER HB2 H 3.855 0.05 2 974 97 97 SER HB3 H 4.099 0.05 2 975 97 97 SER C C 175.961 0.15 1 976 97 97 SER CA C 58.463 0.15 1 977 97 97 SER CB C 65.137 0.15 1 978 97 97 SER N N 113.389 0.15 1 979 98 98 SER H H 8.481 0.05 1 980 98 98 SER HA H 4.579 0.05 1 981 98 98 SER HB2 H 4.105 0.05 2 982 98 98 SER HB3 H 3.970 0.05 2 983 98 98 SER C C 175.203 0.15 1 984 98 98 SER CA C 58.537 0.15 1 985 98 98 SER CB C 63.376 0.15 1 986 98 98 SER N N 120.221 0.15 1 987 99 99 GLY H H 8.487 0.05 1 988 99 99 GLY HA2 H 3.884 0.05 2 989 99 99 GLY HA3 H 4.383 0.05 2 990 99 99 GLY C C 174.334 0.15 1 991 99 99 GLY CA C 45.055 0.15 1 992 99 99 GLY N N 112.290 0.15 1 993 100 100 SER H H 8.591 0.05 1 994 100 100 SER HA H 4.486 0.05 1 995 100 100 SER HB2 H 3.952 0.05 2 996 100 100 SER HB3 H 4.051 0.05 2 997 100 100 SER C C 175.315 0.15 1 998 100 100 SER CA C 58.584 0.15 1 999 100 100 SER CB C 63.716 0.15 1 1000 100 100 SER N N 117.551 0.15 1 1001 101 101 GLY H H 8.266 0.05 1 1002 101 101 GLY HA2 H 3.999 0.05 2 1003 101 101 GLY HA3 H 4.131 0.05 2 1004 101 101 GLY C C 173.703 0.15 1 1005 101 101 GLY CA C 45.564 0.15 1 1006 101 101 GLY N N 109.496 0.15 1 1007 102 102 GLU H H 8.414 0.05 1 1008 102 102 GLU HA H 4.399 0.05 1 1009 102 102 GLU HB2 H 2.251 0.05 2 1010 102 102 GLU HB3 H 1.983 0.05 2 1011 102 102 GLU HG2 H 2.200 0.05 2 1012 102 102 GLU HG3 H 2.306 0.05 2 1013 102 102 GLU C C 175.409 0.15 1 1014 102 102 GLU CA C 56.799 0.15 1 1015 102 102 GLU CB C 30.520 0.15 1 1016 102 102 GLU CG C 36.908 0.15 1 1017 102 102 GLU N N 117.786 0.15 1 1018 103 103 THR H H 7.490 0.05 1 1019 103 103 THR HA H 5.337 0.05 1 1020 103 103 THR HB H 3.929 0.05 1 1021 103 103 THR HG2 H 1.071 0.05 1 1022 103 103 THR C C 173.710 0.15 1 1023 103 103 THR CA C 59.293 0.15 1 1024 103 103 THR CB C 72.966 0.15 1 1025 103 103 THR CG2 C 21.740 0.15 1 1026 103 103 THR N N 107.768 0.15 1 1027 104 104 PHE H H 8.648 0.05 1 1028 104 104 PHE HA H 5.200 0.05 1 1029 104 104 PHE HB2 H 2.824 0.05 2 1030 104 104 PHE HB3 H 3.481 0.05 2 1031 104 104 PHE HD1 H 7.308 0.05 4 1032 104 104 PHE HD2 H 7.308 0.05 4 1033 104 104 PHE HE1 H 6.923 0.05 4 1034 104 104 PHE HE2 H 6.923 0.05 4 1035 104 104 PHE C C 171.723 0.15 1 1036 104 104 PHE CA C 56.608 0.15 1 1037 104 104 PHE CB C 41.884 0.15 1 1038 104 104 PHE N N 114.956 0.15 1 1039 105 105 SER H H 8.580 0.05 1 1040 105 105 SER HA H 5.267 0.05 1 1041 105 105 SER HB2 H 3.828 0.05 2 1042 105 105 SER HB3 H 4.202 0.05 2 1043 105 105 SER C C 175.656 0.15 1 1044 105 105 SER CA C 56.409 0.15 1 1045 105 105 SER CB C 68.029 0.15 1 1046 105 105 SER N N 116.246 0.15 1 1047 106 106 TYR H H 9.132 0.05 1 1048 106 106 TYR HA H 4.238 0.05 1 1049 106 106 TYR HB2 H 2.339 0.05 2 1050 106 106 TYR HB3 H 2.552 0.05 2 1051 106 106 TYR HD1 H 6.160 0.05 4 1052 106 106 TYR HD2 H 6.160 0.05 4 1053 106 106 TYR HE1 H 6.555 0.05 4 1054 106 106 TYR HE2 H 6.555 0.05 4 1055 106 106 TYR HH H 9.618 0.05 1 1056 106 106 TYR CA C 61.923 0.15 1 1057 106 106 TYR CB C 36.008 0.15 1 1058 106 106 TYR N N 121.074 0.15 1 1059 107 107 PRO HA H 3.852 0.05 1 1060 107 107 PRO HB2 H 1.957 0.05 2 1061 107 107 PRO HB3 H 2.496 0.05 2 1062 107 107 PRO HG2 H 2.253 0.05 2 1063 107 107 PRO HD2 H 4.084 0.05 2 1064 107 107 PRO HD3 H 3.844 0.05 2 1065 107 107 PRO C C 178.191 0.15 1 1066 107 107 PRO CA C 66.681 0.15 1 1067 107 107 PRO CB C 30.833 0.15 1 1068 107 107 PRO CG C 29.018 0.15 1 1069 107 107 PRO CD C 49.177 0.15 1 1070 108 108 ASP H H 7.348 0.05 1 1071 108 108 ASP HA H 4.324 0.05 1 1072 108 108 ASP HB2 H 2.994 0.05 2 1073 108 108 ASP HB3 H 3.421 0.05 2 1074 108 108 ASP C C 179.004 0.15 1 1075 108 108 ASP CA C 57.524 0.15 1 1076 108 108 ASP CB C 40.739 0.15 1 1077 108 108 ASP N N 116.026 0.15 1 1078 109 109 PHE H H 8.750 0.05 1 1079 109 109 PHE HA H 3.822 0.05 1 1080 109 109 PHE HB2 H 3.282 0.05 2 1081 109 109 PHE HB3 H 3.556 0.05 2 1082 109 109 PHE HE1 H 7.020 0.05 4 1083 109 109 PHE HE2 H 7.020 0.05 4 1084 109 109 PHE C C 176.621 0.15 1 1085 109 109 PHE CA C 61.472 0.15 1 1086 109 109 PHE CB C 39.822 0.15 1 1087 109 109 PHE N N 124.180 0.15 1 1088 110 110 LEU H H 8.570 0.05 1 1089 110 110 LEU HA H 3.098 0.05 1 1090 110 110 LEU HB2 H 0.083 0.05 2 1091 110 110 LEU HB3 H 1.042 0.05 2 1092 110 110 LEU HD1 H -0.399 0.05 2 1093 110 110 LEU HD2 H 0.428 0.05 2 1094 110 110 LEU C C 178.761 0.15 1 1095 110 110 LEU CA C 57.463 0.15 1 1096 110 110 LEU CB C 42.336 0.15 1 1097 110 110 LEU CD1 C 24.975 0.15 2 1098 110 110 LEU CD2 C 23.031 0.15 2 1099 110 110 LEU N N 119.228 0.15 1 1100 111 111 ARG H H 8.252 0.05 1 1101 111 111 ARG HA H 3.794 0.05 1 1102 111 111 ARG HB2 H 1.805 0.05 2 1103 111 111 ARG HD2 H 3.246 0.05 2 1104 111 111 ARG HD3 H 3.401 0.05 2 1105 111 111 ARG C C 179.676 0.15 1 1106 111 111 ARG CA C 60.716 0.15 1 1107 111 111 ARG CB C 30.231 0.15 1 1108 111 111 ARG CD C 43.456 0.15 1 1109 111 111 ARG N N 117.089 0.15 1 1110 112 112 MET H H 7.560 0.05 1 1111 112 112 MET HA H 4.007 0.05 1 1112 112 112 MET HB2 H 2.035 0.05 2 1113 112 112 MET HB3 H 1.411 0.05 2 1114 112 112 MET HG2 H 1.478 0.05 2 1115 112 112 MET HE H 1.641 0.05 1 1116 112 112 MET C C 178.444 0.15 1 1117 112 112 MET CA C 58.120 0.15 1 1118 112 112 MET CB C 31.941 0.15 1 1119 112 112 MET CG C 31.140 0.15 1 1120 112 112 MET CE C 16.604 0.15 1 1121 112 112 MET N N 118.013 0.15 1 1122 113 113 MET H H 8.147 0.05 1 1123 113 113 MET HA H 3.786 0.05 1 1124 113 113 MET HB2 H 0.691 0.05 2 1125 113 113 MET HG2 H 0.702 0.05 2 1126 113 113 MET HG3 H 1.437 0.05 2 1127 113 113 MET HE H 1.713 0.05 1 1128 113 113 MET C C 178.525 0.15 1 1129 113 113 MET CA C 56.397 0.15 1 1130 113 113 MET CB C 29.938 0.15 1 1131 113 113 MET CG C 31.533 0.15 1 1132 113 113 MET CE C 17.171 0.15 1 1133 113 113 MET N N 118.191 0.15 1 1134 114 114 LEU H H 8.356 0.05 1 1135 114 114 LEU HA H 4.252 0.05 1 1136 114 114 LEU HB3 H 1.546 0.05 2 1137 114 114 LEU HG H 1.447 0.05 1 1138 114 114 LEU HD1 H 0.885 0.05 2 1139 114 114 LEU HD2 H 0.278 0.05 2 1140 114 114 LEU C C 178.310 0.15 1 1141 114 114 LEU CA C 55.312 0.15 1 1142 114 114 LEU CB C 42.991 0.15 1 1143 114 114 LEU CD1 C 23.269 0.15 2 1144 114 114 LEU CD2 C 25.374 0.15 2 1145 114 114 LEU N N 116.888 0.15 1 1146 115 115 GLY H H 7.234 0.05 1 1147 115 115 GLY HA2 H 4.272 0.05 2 1148 115 115 GLY HA3 H 3.948 0.05 2 1149 115 115 GLY C C 173.457 0.15 1 1150 115 115 GLY CA C 45.162 0.15 1 1151 115 115 GLY N N 107.387 0.15 1 1152 116 116 LYS H H 8.324 0.05 1 1153 116 116 LYS HA H 4.306 0.05 1 1154 116 116 LYS HB2 H 1.756 0.05 2 1155 116 116 LYS HB3 H 1.927 0.05 2 1156 116 116 LYS HG2 H 1.480 0.05 2 1157 116 116 LYS HD2 H 1.679 0.05 2 1158 116 116 LYS HE2 H 2.992 0.05 2 1159 116 116 LYS C C 177.802 0.15 1 1160 116 116 LYS CA C 56.434 0.15 1 1161 116 116 LYS CB C 32.902 0.15 1 1162 116 116 LYS CG C 24.953 0.15 1 1163 116 116 LYS CD C 28.854 0.15 1 1164 116 116 LYS CE C 42.245 0.15 1 1165 116 116 LYS N N 117.782 0.15 1 1166 117 117 ARG H H 7.916 0.05 1 1167 117 117 ARG HA H 4.252 0.05 1 1168 117 117 ARG HB2 H 1.786 0.05 2 1169 117 117 ARG HD2 H 3.169 0.05 2 1170 117 117 ARG CA C 56.126 0.15 1 1171 117 117 ARG CB C 30.843 0.15 1 1172 117 117 ARG N N 120.094 0.15 1 1173 118 118 SER HA H 4.360 0.05 1 1174 118 118 SER HB3 H 3.822 0.05 2 1175 118 118 SER C C 173.773 0.15 1 1176 118 118 SER CA C 57.956 0.15 1 1177 118 118 SER CB C 63.022 0.15 1 1178 119 119 ALA H H 7.576 0.05 1 1179 119 119 ALA HA H 4.379 0.05 1 1180 119 119 ALA HB H 1.288 0.05 1 1181 119 119 ALA C C 177.674 0.15 1 1182 119 119 ALA CA C 51.963 0.15 1 1183 119 119 ALA CB C 20.204 0.15 1 1184 119 119 ALA N N 125.266 0.15 1 1185 120 120 ILE H H 9.558 0.05 1 1186 120 120 ILE HA H 3.686 0.05 1 1187 120 120 ILE HB H 1.847 0.05 1 1188 120 120 ILE HG12 H 1.338 0.05 2 1189 120 120 ILE HG13 H 1.717 0.05 2 1190 120 120 ILE HG2 H 0.856 0.05 1 1191 120 120 ILE HD1 H 0.829 0.05 1 1192 120 120 ILE C C 178.851 0.15 1 1193 120 120 ILE CA C 64.908 0.15 1 1194 120 120 ILE CB C 36.846 0.15 1 1195 120 120 ILE CG1 C 28.533 0.15 1 1196 120 120 ILE CG2 C 17.681 0.15 1 1197 120 120 ILE CD1 C 11.973 0.15 1 1198 120 120 ILE N N 125.471 0.15 1 1199 121 121 LEU H H 9.089 0.05 1 1200 121 121 LEU HA H 4.014 0.05 1 1201 121 121 LEU HB2 H 1.364 0.05 2 1202 121 121 LEU HB3 H 1.518 0.05 2 1203 121 121 LEU HD1 H 1.011 0.05 2 1204 121 121 LEU HD2 H 0.813 0.05 2 1205 121 121 LEU C C 177.234 0.15 1 1206 121 121 LEU CA C 57.649 0.15 1 1207 121 121 LEU CB C 41.500 0.15 1 1208 121 121 LEU CD1 C 24.037 0.15 2 1209 121 121 LEU CD2 C 26.127 0.15 2 1210 121 121 LEU N N 117.621 0.15 1 1211 122 122 LYS H H 6.557 0.05 1 1212 122 122 LYS HA H 3.664 0.05 1 1213 122 122 LYS HB2 H 1.654 0.05 2 1214 122 122 LYS HB3 H 2.036 0.05 2 1215 122 122 LYS HG2 H 1.320 0.05 2 1216 122 122 LYS HE2 H 3.010 0.05 2 1217 122 122 LYS C C 177.137 0.15 1 1218 122 122 LYS CA C 60.121 0.15 1 1219 122 122 LYS CB C 33.411 0.15 1 1220 122 122 LYS CG C 25.361 0.15 1 1221 122 122 LYS CD C 30.677 0.15 1 1222 122 122 LYS N N 116.971 0.15 1 1223 123 123 MET H H 7.611 0.05 1 1224 123 123 MET HA H 4.154 0.05 1 1225 123 123 MET HB2 H 2.235 0.05 2 1226 123 123 MET HG2 H 2.673 0.05 2 1227 123 123 MET HG3 H 2.549 0.05 2 1228 123 123 MET C C 179.155 0.15 1 1229 123 123 MET CA C 58.333 0.15 1 1230 123 123 MET CB C 31.833 0.15 1 1231 123 123 MET CG C 32.037 0.15 1 1232 123 123 MET N N 116.042 0.15 1 1233 124 124 ILE H H 7.971 0.05 1 1234 124 124 ILE HA H 3.713 0.05 1 1235 124 124 ILE HB H 1.866 0.05 1 1236 124 124 ILE HG12 H 1.093 0.05 2 1237 124 124 ILE HG2 H 0.848 0.05 1 1238 124 124 ILE HD1 H 0.806 0.05 1 1239 124 124 ILE C C 177.857 0.15 1 1240 124 124 ILE CA C 65.089 0.15 1 1241 124 124 ILE CB C 38.814 0.15 1 1242 124 124 ILE CG1 C 28.619 0.15 1 1243 124 124 ILE CG2 C 17.227 0.15 1 1244 124 124 ILE CD1 C 14.489 0.15 1 1245 124 124 ILE N N 119.079 0.15 1 1246 125 125 LEU H H 7.958 0.05 1 1247 125 125 LEU HA H 4.169 0.05 1 1248 125 125 LEU HB2 H 1.515 0.05 2 1249 125 125 LEU HB3 H 1.835 0.05 2 1250 125 125 LEU HG H 1.873 0.05 1 1251 125 125 LEU HD1 H 0.935 0.05 2 1252 125 125 LEU HD2 H 1.111 0.05 2 1253 125 125 LEU C C 178.445 0.15 1 1254 125 125 LEU CA C 56.773 0.15 1 1255 125 125 LEU CB C 41.699 0.15 1 1256 125 125 LEU CD1 C 22.028 0.15 2 1257 125 125 LEU CD2 C 26.521 0.15 2 1258 125 125 LEU N N 116.353 0.15 1 1259 126 126 MET H H 7.993 0.05 1 1260 126 126 MET HA H 4.434 0.05 1 1261 126 126 MET HB3 H 2.063 0.05 2 1262 126 126 MET HG2 H 2.666 0.05 2 1263 126 126 MET HG3 H 2.526 0.05 2 1264 126 126 MET HE H 1.712 0.05 1 1265 126 126 MET C C 176.922 0.15 1 1266 126 126 MET CA C 56.419 0.15 1 1267 126 126 MET CB C 32.070 0.15 1 1268 126 126 MET CG C 32.183 0.15 1 1269 126 126 MET CE C 17.188 0.15 1 1270 126 126 MET N N 116.401 0.15 1 1271 127 127 TYR H H 7.794 0.05 1 1272 127 127 TYR HA H 4.447 0.05 1 1273 127 127 TYR HB2 H 3.137 0.05 2 1274 127 127 TYR HD1 H 7.151 0.05 4 1275 127 127 TYR HD2 H 7.151 0.05 4 1276 127 127 TYR C C 176.574 0.15 1 1277 127 127 TYR CA C 59.329 0.15 1 1278 127 127 TYR CB C 38.258 0.15 1 1279 127 127 TYR N N 120.043 0.15 1 1280 128 128 GLU H H 8.139 0.05 1 1281 128 128 GLU HB2 H 1.939 0.05 2 1282 128 128 GLU HB3 H 2.045 0.05 2 1283 128 128 GLU HG2 H 2.232 0.05 2 1284 128 128 GLU CA C 56.985 0.15 1 1285 128 128 GLU CB C 30.020 0.15 1 1286 128 128 GLU N N 121.704 0.15 1 1287 130 130 LYS H H 8.195 0.05 1 1288 130 130 LYS HA H 4.206 0.05 1 1289 130 130 LYS HB3 H 1.790 0.05 2 1290 130 130 LYS HG3 H 1.404 0.05 2 1291 130 130 LYS C C 177.134 0.15 1 1292 130 130 LYS CA C 56.893 0.15 1 1293 130 130 LYS CB C 32.630 0.15 1 1294 130 130 LYS CG C 24.738 0.15 1 1295 130 130 LYS CE C 42.084 0.15 1 1296 130 130 LYS N N 121.709 0.15 1 1297 131 131 ALA H H 8.163 0.05 1 1298 131 131 ALA HA H 4.211 0.05 1 1299 131 131 ALA HB H 1.367 0.05 1 1300 131 131 ALA C C 178.335 0.15 1 1301 131 131 ALA CA C 53.174 0.15 1 1302 131 131 ALA CB C 18.785 0.15 1 1303 131 131 ALA N N 123.896 0.15 1 1304 132 132 ARG H H 8.079 0.05 1 1305 132 132 ARG HA H 4.248 0.05 1 1306 132 132 ARG HB2 H 1.810 0.05 2 1307 132 132 ARG HB3 H 1.779 0.05 2 1308 132 132 ARG C C 176.737 0.15 1 1309 132 132 ARG CA C 56.527 0.15 1 1310 132 132 ARG CB C 30.720 0.15 1 1311 132 132 ARG CG C 27.032 0.15 1 1312 132 132 ARG CD C 43.407 0.15 1 1313 132 132 ARG N N 119.361 0.15 1 1314 133 133 GLU H H 8.203 0.05 1 1315 133 133 GLU HA H 4.210 0.05 1 1316 133 133 GLU HB2 H 2.020 0.05 2 1317 133 133 GLU HG2 H 2.256 0.05 2 1318 133 133 GLU C C 177.320 0.15 1 1319 133 133 GLU CA C 57.077 0.15 1 1320 133 133 GLU CB C 30.122 0.15 1 1321 133 133 GLU CG C 36.296 0.15 1 1322 133 133 GLU N N 121.476 0.15 1 1323 134 134 LYS H H 8.186 0.05 1 1324 134 134 LYS HA H 4.246 0.05 1 1325 134 134 LYS HB2 H 1.763 0.05 2 1326 134 134 LYS C C 176.637 0.15 1 1327 134 134 LYS CA C 56.626 0.15 1 1328 134 134 LYS CB C 32.965 0.15 1 1329 134 134 LYS N N 121.410 0.15 1 1330 135 135 GLU HG2 H 2.128 0.05 2 1331 135 135 GLU H H 8.250 0.05 1 1332 135 135 GLU HA H 4.239 0.05 1 1333 135 135 GLU HB2 H 1.930 0.05 2 1334 135 135 GLU HB3 H 2.010 0.05 2 1335 135 135 GLU HG3 H 2.247 0.05 2 1336 135 135 GLU C C 176.232 0.15 1 1337 135 135 GLU CA C 56.261 0.15 1 1338 135 135 GLU CB C 30.297 0.15 1 1339 135 135 GLU CG C 36.218 0.15 1 1340 135 135 GLU N N 121.347 0.15 1 1341 136 136 LYS H H 8.299 0.05 1 1342 136 136 LYS HA H 4.576 0.05 1 1343 136 136 LYS HB2 H 1.725 0.05 2 1344 136 136 LYS HB3 H 1.815 0.05 2 1345 136 136 LYS HG2 H 1.479 0.05 2 1346 136 136 LYS HE2 H 2.609 0.05 2 1347 136 136 LYS HE3 H 2.701 0.05 2 1348 136 136 LYS CA C 54.356 0.15 1 1349 136 136 LYS CB C 32.096 0.15 1 1350 136 136 LYS CE C 41.034 0.15 1 1351 136 136 LYS N N 123.683 0.15 1 1352 137 137 PRO HA H 4.515 0.05 1 1353 137 137 PRO HB2 H 2.312 0.05 2 1354 137 137 PRO HB3 H 1.942 0.05 2 1355 137 137 PRO HG3 H 2.017 0.05 2 1356 137 137 PRO HD2 H 3.649 0.05 2 1357 137 137 PRO HD3 H 3.817 0.05 2 1358 137 137 PRO C C 177.265 0.15 1 1359 137 137 PRO CA C 63.211 0.15 1 1360 137 137 PRO CB C 32.114 0.15 1 1361 137 137 PRO CG C 27.364 0.15 1 1362 137 137 PRO CD C 50.643 0.15 1 1363 138 138 THR H H 8.314 0.05 1 1364 138 138 THR HB H 4.257 0.05 1 1365 138 138 THR HG2 H 1.216 0.05 1 1366 138 138 THR C C 174.857 0.15 1 1367 138 138 THR CA C 61.692 0.15 1 1368 138 138 THR CB C 69.916 0.15 1 1369 138 138 THR CG2 C 21.623 0.15 1 1370 138 138 THR N N 114.270 0.15 1 1371 139 139 GLY H H 8.179 0.05 1 1372 139 139 GLY CA C 44.459 0.15 1 1373 139 139 GLY N N 111.144 0.15 1 1374 141 141 PRO HA H 4.404 0.05 1 1375 141 141 PRO HB2 H 2.275 0.05 2 1376 141 141 PRO HB3 H 1.899 0.05 2 1377 141 141 PRO HG3 H 2.018 0.05 2 1378 141 141 PRO HD2 H 3.623 0.05 2 1379 141 141 PRO C C 176.664 0.15 1 1380 141 141 PRO CA C 62.925 0.15 1 1381 141 141 PRO CB C 32.016 0.15 1 1382 141 141 PRO CG C 27.332 0.15 1 1383 141 141 PRO CD C 50.453 0.15 1 1384 142 142 ALA H H 8.364 0.05 1 1385 142 142 ALA HA H 4.247 0.05 1 1386 142 142 ALA HB H 1.360 0.05 1 1387 142 142 ALA C C 177.738 0.15 1 1388 142 142 ALA CA C 52.385 0.15 1 1389 142 142 ALA CB C 19.235 0.15 1 1390 142 142 ALA N N 124.389 0.15 1 1391 143 143 LYS H H 8.271 0.05 1 1392 143 143 LYS HA H 4.257 0.05 1 1393 143 143 LYS HB2 H 1.715 0.05 2 1394 143 143 LYS HG3 H 1.422 0.05 2 1395 143 143 LYS C C 176.367 0.15 1 1396 143 143 LYS CA C 56.313 0.15 1 1397 143 143 LYS CB C 33.161 0.15 1 1398 143 143 LYS CG C 24.689 0.15 1 1399 143 143 LYS CD C 29.149 0.15 1 1400 143 143 LYS CE C 42.078 0.15 1 1401 143 143 LYS N N 121.086 0.15 1 1402 144 144 LYS H H 8.308 0.05 1 1403 144 144 LYS HA H 4.268 0.05 1 1404 144 144 LYS HB3 H 1.724 0.05 2 1405 144 144 LYS HG2 H 1.436 0.05 2 1406 144 144 LYS HE3 H 2.974 0.05 2 1407 144 144 LYS C C 176.113 0.15 1 1408 144 144 LYS CA C 56.176 0.15 1 1409 144 144 LYS CB C 33.287 0.15 1 1410 144 144 LYS CG C 24.828 0.15 1 1411 144 144 LYS CD C 29.030 0.15 1 1412 144 144 LYS CE C 42.116 0.15 1 1413 144 144 LYS N N 123.442 0.15 1 1414 145 145 ALA H H 8.396 0.05 1 1415 145 145 ALA HA H 4.321 0.05 1 1416 145 145 ALA HB H 1.372 0.05 1 1417 145 145 ALA C C 177.704 0.15 1 1418 145 145 ALA CA C 52.420 0.15 1 1419 145 145 ALA CB C 19.181 0.15 1 1420 145 145 ALA N N 126.137 0.15 1 1421 146 146 ILE H H 8.159 0.05 1 1422 146 146 ILE HA H 4.152 0.05 1 1423 146 146 ILE HB H 1.865 0.05 1 1424 146 146 ILE HG12 H 1.468 0.05 2 1425 146 146 ILE HG13 H 1.194 0.05 2 1426 146 146 ILE HG2 H 0.917 0.05 1 1427 146 146 ILE HD1 H 0.876 0.05 1 1428 146 146 ILE C C 176.298 0.15 1 1429 146 146 ILE CA C 61.331 0.15 1 1430 146 146 ILE CB C 38.734 0.15 1 1431 146 146 ILE CG1 C 27.126 0.15 1 1432 146 146 ILE CG2 C 17.564 0.15 1 1433 146 146 ILE CD1 C 13.041 0.15 1 1434 146 146 ILE N N 120.141 0.15 1 1435 147 147 SER H H 8.263 0.05 1 1436 147 147 SER HA H 4.422 0.05 1 1437 147 147 SER HB3 H 3.837 0.05 2 1438 147 147 SER C C 174.227 0.15 1 1439 147 147 SER CA C 58.179 0.15 1 1440 147 147 SER CB C 63.776 0.15 1 1441 147 147 SER N N 118.926 0.15 1 1442 148 148 GLU H H 8.367 0.05 1 1443 148 148 GLU HA H 4.304 0.05 1 1444 148 148 GLU HB2 H 1.908 0.05 2 1445 148 148 GLU HB3 H 2.050 0.05 2 1446 148 148 GLU HG3 H 2.239 0.05 2 1447 148 148 GLU C C 175.936 0.15 1 1448 148 148 GLU CA C 56.332 0.15 1 1449 148 148 GLU CB C 30.419 0.15 1 1450 148 148 GLU CG C 36.360 0.15 1 1451 148 148 GLU N N 122.952 0.15 1 1452 149 149 LEU H H 8.167 0.05 1 1453 149 149 LEU HA H 4.599 0.05 1 1454 149 149 LEU HB2 H 1.606 0.05 2 1455 149 149 LEU HD1 H 0.938 0.05 2 1456 149 149 LEU HD2 H 0.908 0.05 2 1457 149 149 LEU CA C 52.921 0.15 1 1458 149 149 LEU CB C 41.557 0.15 1 1459 149 149 LEU N N 124.763 0.15 1 stop_ save_