data_10071 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of RRM domain in RNA-binding protein NP_057951 ; _BMRB_accession_number 10071 _BMRB_flat_file_name bmr10071.str _Entry_type original _Submission_date 2006-12-25 _Accession_date 2006-12-27 _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 He F. . . 2 Muto Y. . . 3 Inoue M. . . 4 Kigawa T. . . 5 Shirouzu M. . . 6 Terada T. . . 7 Yokoyama S. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 591 "13C chemical shifts" 442 "15N chemical shifts" 108 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2008-08-14 original author . stop_ _Original_release_date 2008-08-14 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution structure of RRM domain in RNA-binding protein NP_057951' _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 He F. . . 2 Muto Y. . . 3 Inoue M. . . 4 Kigawa T. . . 5 Shirouzu M. . . 6 Terada T. . . 7 Yokoyama S. . . 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 'RNA-binding protein Raly' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'RNA-binding protein Raly' $entity_1 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state 'protein monomer' _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'RRM domain' _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 110 _Mol_residue_sequence ; GSSGSSGMSLKLQASNVTNK NDPKSINSRVFIGNLNTALV KKSDVETIFSKYGRVAGCSV HKGYAFVQYSNERHARAAVL GENGRVLAGQTLDINMAGEP KPDRSGPSSG ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 SER 4 GLY 5 SER 6 SER 7 GLY 8 MET 9 SER 10 LEU 11 LYS 12 LEU 13 GLN 14 ALA 15 SER 16 ASN 17 VAL 18 THR 19 ASN 20 LYS 21 ASN 22 ASP 23 PRO 24 LYS 25 SER 26 ILE 27 ASN 28 SER 29 ARG 30 VAL 31 PHE 32 ILE 33 GLY 34 ASN 35 LEU 36 ASN 37 THR 38 ALA 39 LEU 40 VAL 41 LYS 42 LYS 43 SER 44 ASP 45 VAL 46 GLU 47 THR 48 ILE 49 PHE 50 SER 51 LYS 52 TYR 53 GLY 54 ARG 55 VAL 56 ALA 57 GLY 58 CYS 59 SER 60 VAL 61 HIS 62 LYS 63 GLY 64 TYR 65 ALA 66 PHE 67 VAL 68 GLN 69 TYR 70 SER 71 ASN 72 GLU 73 ARG 74 HIS 75 ALA 76 ARG 77 ALA 78 ALA 79 VAL 80 LEU 81 GLY 82 GLU 83 ASN 84 GLY 85 ARG 86 VAL 87 LEU 88 ALA 89 GLY 90 GLN 91 THR 92 LEU 93 ASP 94 ILE 95 ASN 96 MET 97 ALA 98 GLY 99 GLU 100 PRO 101 LYS 102 PRO 103 ASP 104 ARG 105 SER 106 GLY 107 PRO 108 SER 109 SER 110 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-10-27 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 1WF1 "Solution Structure Of Rrm Domain In Rna-Binding Protein Np_057951" 100.00 110 100.00 100.00 5.20e-73 DBJ BAD96635 "RNA binding protein (autoantigenic, hnRNP-associated with lethal yellow) long isoform variant [Homo sapiens]" 88.18 307 100.00 100.00 6.92e-62 DBJ BAF83743 "unnamed protein product [Homo sapiens]" 88.18 291 100.00 100.00 2.25e-62 DBJ BAF83768 "unnamed protein product [Homo sapiens]" 88.18 307 100.00 100.00 6.92e-62 DBJ BAG61653 "unnamed protein product [Homo sapiens]" 88.18 126 100.00 100.00 7.84e-64 DBJ BAI46166 "RNA binding protein, autoantigenic [synthetic construct]" 88.18 306 100.00 100.00 7.03e-62 GB AAC28898 "autoantigen p542 [Homo sapiens]" 88.18 291 100.00 100.00 1.56e-62 GB AAF04487 "heterogeneous nuclear ribonucleoprotein, alternate transcript [Homo sapiens]" 88.18 306 100.00 100.00 7.03e-62 GB AAI03754 "RNA binding protein, autoantigenic (hnRNP-associated with lethal yellow homolog (mouse)) [Homo sapiens]" 88.18 307 100.00 100.00 6.92e-62 GB AAI05019 "RNA binding protein, autoantigenic (hnRNP-associated with lethal yellow homolog (mouse)) [Homo sapiens]" 88.18 306 100.00 100.00 7.03e-62 GB ACA53514 "RNA binding protein short isoform (predicted) [Callicebus moloch]" 88.18 284 97.94 98.97 1.31e-61 REF NP_001267354 "RNA-binding protein Raly [Pan troglodytes]" 88.18 306 98.97 98.97 6.01e-61 REF NP_031393 "RNA-binding protein Raly isoform 2 [Homo sapiens]" 88.18 290 100.00 100.00 1.78e-62 REF NP_057951 "RNA-binding protein Raly isoform 1 [Homo sapiens]" 88.18 306 100.00 100.00 7.03e-62 REF XP_001102633 "PREDICTED: RNA-binding protein Raly [Macaca mulatta]" 88.18 307 98.97 100.00 1.64e-61 REF XP_002747313 "PREDICTED: RNA-binding protein Raly isoform X1 [Callithrix jacchus]" 88.18 309 98.97 100.00 1.99e-61 SP Q9UKM9 "RecName: Full=RNA-binding protein Raly; AltName: Full=Autoantigen p542; AltName: Full=Heterogeneous nuclear ribonucleoprotein C" 88.18 306 100.00 100.00 7.03e-62 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $entity_1 'cell free synthesis' . . . . plasmid P040223-76 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 $entity_1 0.8 mM '[U-13C; U-15N]' 'd-Tris-HCl(pH 7.0)' 20 mM . NaCl 100 mM . d-DTT 1 mM . NaN3 0.02 % . H2O 90 % . D2O 10 % . stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name xwinnmr _Version 2.6 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task collection stop_ _Details . save_ save_software_2 _Saveframe_category software _Name NMRPipe _Version 20020425 loop_ _Vendor _Address _Electronic_address 'Delaglio, F.' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_3 _Saveframe_category software _Name NMRView _Version 5.0.4 loop_ _Vendor _Address _Electronic_address 'Johnson, B. A.' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_4 _Saveframe_category software _Name Kujira _Version 0.863 loop_ _Vendor _Address _Electronic_address 'Kobayashi, N.' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_5 _Saveframe_category software _Name CYANA _Version 1.0.8 loop_ _Vendor _Address _Electronic_address 'Guntert, P.' . . stop_ loop_ _Task refinement 'structure solution' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AVANCE _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_15N-separated_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-separated NOESY' _Sample_label $sample_1 save_ save_3D_13C-separated_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-separated NOESY' _Sample_label $sample_1 save_ save_3D_15N-separated_NOESY _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-separated NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_13C-separated_NOESY _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-separated NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_condition_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 120 0.1 mM pH 7.0 0.05 pH pressure 1 0.001 atm temperature 298 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Saveframe_category chemical_shift_reference _Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 . indirect . . . 1.0 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_chemical_shift_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D 15N-separated NOESY' '3D 13C-separated NOESY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $condition_1 _Chem_shift_reference_set_label $reference_1 _Mol_system_component_name 'RNA-binding protein Raly' _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 7 7 GLY HA2 H 3.960 0.030 1 2 7 7 GLY HA3 H 3.960 0.030 1 3 7 7 GLY C C 174.389 0.300 1 4 7 7 GLY CA C 45.607 0.300 1 5 8 8 MET H H 8.160 0.030 1 6 8 8 MET HA H 4.478 0.030 1 7 8 8 MET HB2 H 2.089 0.030 2 8 8 8 MET HB3 H 2.011 0.030 2 9 8 8 MET HG2 H 2.590 0.030 2 10 8 8 MET HG3 H 2.530 0.030 2 11 8 8 MET HE H 2.085 0.030 1 12 8 8 MET C C 176.445 0.300 1 13 8 8 MET CA C 55.757 0.300 1 14 8 8 MET CB C 32.960 0.300 1 15 8 8 MET CG C 32.000 0.300 1 16 8 8 MET CE C 16.983 0.300 1 17 8 8 MET N N 119.955 0.300 1 18 9 9 SER H H 8.316 0.030 1 19 9 9 SER HA H 4.398 0.030 1 20 9 9 SER HB2 H 3.875 0.030 1 21 9 9 SER HB3 H 3.875 0.030 1 22 9 9 SER C C 174.707 0.300 1 23 9 9 SER CA C 58.616 0.300 1 24 9 9 SER CB C 63.612 0.300 1 25 9 9 SER N N 116.997 0.300 1 26 10 10 LEU H H 8.223 0.030 1 27 10 10 LEU HA H 4.303 0.030 1 28 10 10 LEU HB2 H 1.665 0.030 2 29 10 10 LEU HB3 H 1.733 0.030 2 30 10 10 LEU HG H 1.609 0.030 1 31 10 10 LEU HD1 H 0.908 0.030 1 32 10 10 LEU HD2 H 0.855 0.030 1 33 10 10 LEU C C 177.538 0.300 1 34 10 10 LEU CA C 55.632 0.300 1 35 10 10 LEU CB C 42.287 0.300 1 36 10 10 LEU CG C 27.143 0.300 1 37 10 10 LEU CD1 C 24.954 0.300 2 38 10 10 LEU CD2 C 23.494 0.300 2 39 10 10 LEU N N 124.234 0.300 1 40 11 11 LYS H H 8.173 0.030 1 41 11 11 LYS HA H 4.262 0.030 1 42 11 11 LYS HB2 H 1.807 0.030 2 43 11 11 LYS HB3 H 1.741 0.030 2 44 11 11 LYS HG2 H 1.409 0.030 1 45 11 11 LYS HG3 H 1.409 0.030 1 46 11 11 LYS HD2 H 1.714 0.030 1 47 11 11 LYS HD3 H 1.714 0.030 1 48 11 11 LYS HE2 H 2.989 0.030 1 49 11 11 LYS HE3 H 2.989 0.030 1 50 11 11 LYS C C 176.644 0.300 1 51 11 11 LYS CA C 56.551 0.300 1 52 11 11 LYS CB C 32.763 0.300 1 53 11 11 LYS CG C 24.879 0.300 1 54 11 11 LYS CD C 29.044 0.300 1 55 11 11 LYS CE C 42.105 0.300 1 56 11 11 LYS N N 121.635 0.300 1 57 12 12 LEU H H 8.109 0.030 1 58 12 12 LEU HA H 4.310 0.030 1 59 12 12 LEU HB2 H 1.647 0.030 2 60 12 12 LEU HB3 H 1.571 0.030 2 61 12 12 LEU HG H 1.609 0.030 1 62 12 12 LEU HD1 H 0.886 0.030 1 63 12 12 LEU HD2 H 0.886 0.030 1 64 12 12 LEU C C 177.432 0.300 1 65 12 12 LEU CA C 55.297 0.300 1 66 12 12 LEU CB C 42.287 0.300 1 67 12 12 LEU CG C 27.143 0.300 1 68 12 12 LEU CD1 C 24.879 0.300 2 69 12 12 LEU CD2 C 23.501 0.300 2 70 12 12 LEU N N 122.924 0.300 1 71 13 13 GLN H H 8.279 0.030 1 72 13 13 GLN HA H 4.293 0.030 1 73 13 13 GLN HB2 H 2.085 0.030 2 74 13 13 GLN HB3 H 1.980 0.030 2 75 13 13 GLN HG2 H 2.371 0.030 1 76 13 13 GLN HG3 H 2.371 0.030 1 77 13 13 GLN HE21 H 7.505 0.030 2 78 13 13 GLN HE22 H 6.873 0.030 2 79 13 13 GLN C C 175.807 0.300 1 80 13 13 GLN CA C 55.840 0.300 1 81 13 13 GLN CB C 29.483 0.300 1 82 13 13 GLN CG C 33.844 0.300 1 83 13 13 GLN N N 121.133 0.300 1 84 13 13 GLN NE2 N 112.439 0.300 1 85 14 14 ALA H H 8.307 0.030 1 86 14 14 ALA HA H 4.312 0.030 1 87 14 14 ALA HB H 1.394 0.030 1 88 14 14 ALA C C 177.800 0.300 1 89 14 14 ALA CA C 52.729 0.300 1 90 14 14 ALA CB C 19.282 0.300 1 91 14 14 ALA N N 125.256 0.300 1 92 15 15 SER H H 8.248 0.030 1 93 15 15 SER HA H 4.419 0.030 1 94 15 15 SER HB2 H 3.863 0.030 1 95 15 15 SER HB3 H 3.863 0.030 1 96 15 15 SER C C 174.288 0.300 1 97 15 15 SER CA C 58.474 0.300 1 98 15 15 SER CB C 63.864 0.300 1 99 15 15 SER N N 114.709 0.300 1 100 16 16 ASN H H 8.404 0.030 1 101 16 16 ASN HA H 4.750 0.030 1 102 16 16 ASN HB2 H 2.809 0.030 1 103 16 16 ASN HB3 H 2.809 0.030 1 104 16 16 ASN C C 175.232 0.300 1 105 16 16 ASN CA C 53.332 0.300 1 106 16 16 ASN CB C 38.844 0.300 1 107 16 16 ASN N N 120.770 0.300 1 108 17 17 VAL H H 8.033 0.030 1 109 17 17 VAL HA H 4.157 0.030 1 110 17 17 VAL HB H 2.104 0.030 1 111 17 17 VAL HG1 H 0.914 0.030 1 112 17 17 VAL HG2 H 0.914 0.030 1 113 17 17 VAL C C 176.410 0.300 1 114 17 17 VAL CA C 62.670 0.300 1 115 17 17 VAL CB C 32.619 0.300 1 116 17 17 VAL CG1 C 21.267 0.300 2 117 17 17 VAL CG2 C 20.480 0.300 2 118 17 17 VAL N N 119.756 0.300 1 119 18 18 THR H H 8.189 0.030 1 120 18 18 THR HA H 4.316 0.030 1 121 18 18 THR HB H 4.186 0.030 1 122 18 18 THR HG2 H 1.152 0.030 1 123 18 18 THR C C 174.132 0.300 1 124 18 18 THR CA C 61.966 0.300 1 125 18 18 THR CB C 69.771 0.300 1 126 18 18 THR CG2 C 21.631 0.300 1 127 18 18 THR N N 116.988 0.300 1 128 19 19 ASN H H 8.343 0.030 1 129 19 19 ASN HA H 4.684 0.030 1 130 19 19 ASN HB2 H 2.789 0.030 1 131 19 19 ASN HB3 H 2.789 0.030 1 132 19 19 ASN C C 175.331 0.300 1 133 19 19 ASN CA C 53.122 0.300 1 134 19 19 ASN CB C 38.928 0.300 1 135 19 19 ASN N N 121.119 0.300 1 136 20 20 LYS H H 8.291 0.030 1 137 20 20 LYS HA H 4.227 0.030 1 138 20 20 LYS HB2 H 1.800 0.030 2 139 20 20 LYS HB3 H 1.733 0.030 2 140 20 20 LYS HG2 H 1.390 0.030 1 141 20 20 LYS HG3 H 1.390 0.030 1 142 20 20 LYS HD2 H 1.676 0.030 1 143 20 20 LYS HD3 H 1.676 0.030 1 144 20 20 LYS HE2 H 2.970 0.030 1 145 20 20 LYS HE3 H 2.970 0.030 1 146 20 20 LYS C C 176.346 0.300 1 147 20 20 LYS CA C 56.886 0.300 1 148 20 20 LYS CB C 32.841 0.300 1 149 20 20 LYS CG C 24.682 0.300 1 150 20 20 LYS CD C 29.013 0.300 1 151 20 20 LYS CE C 42.105 0.300 1 152 20 20 LYS N N 121.817 0.300 1 153 21 21 ASN H H 8.389 0.030 1 154 21 21 ASN HA H 4.684 0.030 1 155 21 21 ASN HB2 H 2.781 0.030 2 156 21 21 ASN HB3 H 2.679 0.030 2 157 21 21 ASN C C 174.373 0.300 1 158 21 21 ASN CA C 52.997 0.300 1 159 21 21 ASN CB C 39.027 0.300 1 160 21 21 ASN N N 119.163 0.300 1 161 22 22 ASP H H 8.111 0.030 1 162 22 22 ASP HA H 4.844 0.030 1 163 22 22 ASP HB2 H 2.742 0.030 2 164 22 22 ASP HB3 H 2.589 0.030 2 165 22 22 ASP C C 174.897 0.300 1 166 22 22 ASP CA C 52.166 0.300 1 167 22 22 ASP CB C 41.316 0.300 1 168 22 22 ASP N N 121.732 0.300 1 169 23 23 PRO HA H 4.360 0.030 1 170 23 23 PRO HB2 H 2.018 0.030 2 171 23 23 PRO HB3 H 2.302 0.030 2 172 23 23 PRO HG2 H 2.018 0.030 1 173 23 23 PRO HG3 H 2.018 0.030 1 174 23 23 PRO HD2 H 3.846 0.030 1 175 23 23 PRO HD3 H 3.846 0.030 1 176 23 23 PRO C C 177.479 0.300 1 177 23 23 PRO CA C 64.260 0.300 1 178 23 23 PRO CB C 32.072 0.300 1 179 23 23 PRO CG C 27.242 0.300 1 180 23 23 PRO CD C 50.866 0.300 1 181 24 24 LYS H H 8.314 0.030 1 182 24 24 LYS HA H 4.215 0.030 1 183 24 24 LYS HB2 H 1.800 0.030 1 184 24 24 LYS HB3 H 1.800 0.030 1 185 24 24 LYS HG2 H 1.432 0.030 2 186 24 24 LYS HG3 H 1.366 0.030 2 187 24 24 LYS HD2 H 1.657 0.030 1 188 24 24 LYS HD3 H 1.657 0.030 1 189 24 24 LYS HE2 H 2.980 0.030 1 190 24 24 LYS HE3 H 2.980 0.030 1 191 24 24 LYS C C 177.730 0.300 1 192 24 24 LYS CA C 56.928 0.300 1 193 24 24 LYS CB C 32.127 0.300 1 194 24 24 LYS CG C 24.978 0.300 1 195 24 24 LYS CD C 29.013 0.300 1 196 24 24 LYS CE C 42.007 0.300 1 197 24 24 LYS N N 118.393 0.300 1 198 25 25 SER H H 7.929 0.030 1 199 25 25 SER HA H 4.282 0.030 1 200 25 25 SER HB2 H 3.894 0.030 2 201 25 25 SER HB3 H 3.817 0.030 2 202 25 25 SER C C 176.403 0.300 1 203 25 25 SER CA C 59.482 0.300 1 204 25 25 SER CB C 63.318 0.300 1 205 25 25 SER N N 116.083 0.300 1 206 26 26 ILE H H 8.165 0.030 1 207 26 26 ILE HA H 3.897 0.030 1 208 26 26 ILE HB H 1.813 0.030 1 209 26 26 ILE HG12 H 1.397 0.030 2 210 26 26 ILE HG13 H 1.191 0.030 2 211 26 26 ILE HG2 H 0.881 0.030 1 212 26 26 ILE HD1 H 0.781 0.030 1 213 26 26 ILE C C 176.615 0.300 1 214 26 26 ILE CA C 63.283 0.300 1 215 26 26 ILE CB C 38.610 0.300 1 216 26 26 ILE CG1 C 29.079 0.300 1 217 26 26 ILE CG2 C 17.164 0.300 1 218 26 26 ILE CD1 C 13.709 0.300 1 219 26 26 ILE N N 123.698 0.300 1 220 27 27 ASN H H 8.150 0.030 1 221 27 27 ASN HA H 4.595 0.030 1 222 27 27 ASN HB2 H 2.913 0.030 2 223 27 27 ASN HB3 H 2.812 0.030 2 224 27 27 ASN HD21 H 6.917 0.030 2 225 27 27 ASN HD22 H 7.600 0.030 2 226 27 27 ASN C C 173.714 0.300 1 227 27 27 ASN CA C 54.168 0.300 1 228 27 27 ASN CB C 38.187 0.300 1 229 27 27 ASN N N 119.471 0.300 1 230 27 27 ASN ND2 N 112.051 0.300 1 231 28 28 SER H H 7.652 0.030 1 232 28 28 SER HA H 4.513 0.030 1 233 28 28 SER HB2 H 3.742 0.030 2 234 28 28 SER HB3 H 3.400 0.030 2 235 28 28 SER C C 171.663 0.300 1 236 28 28 SER CA C 56.843 0.300 1 237 28 28 SER CB C 63.441 0.300 1 238 28 28 SER N N 110.257 0.300 1 239 29 29 ARG H H 7.729 0.030 1 240 29 29 ARG HA H 5.307 0.030 1 241 29 29 ARG HB2 H 1.971 0.030 2 242 29 29 ARG HB3 H 1.866 0.030 2 243 29 29 ARG HG2 H 1.486 0.030 1 244 29 29 ARG HG3 H 1.486 0.030 1 245 29 29 ARG HD2 H 2.923 0.030 2 246 29 29 ARG HD3 H 2.809 0.030 2 247 29 29 ARG C C 173.863 0.300 1 248 29 29 ARG CA C 54.757 0.300 1 249 29 29 ARG CB C 33.800 0.300 1 250 29 29 ARG CG C 27.635 0.300 1 251 29 29 ARG CD C 43.736 0.300 1 252 29 29 ARG N N 124.771 0.300 1 253 30 30 VAL H H 9.444 0.030 1 254 30 30 VAL HA H 4.607 0.030 1 255 30 30 VAL HB H 1.972 0.030 1 256 30 30 VAL HG1 H 1.124 0.030 1 257 30 30 VAL HG2 H 0.876 0.030 1 258 30 30 VAL C C 174.303 0.300 1 259 30 30 VAL CA C 61.653 0.300 1 260 30 30 VAL CB C 34.961 0.300 1 261 30 30 VAL CG1 C 22.363 0.300 2 262 30 30 VAL CG2 C 23.101 0.300 2 263 30 30 VAL N N 124.549 0.300 1 264 31 31 PHE H H 9.227 0.030 1 265 31 31 PHE HA H 4.722 0.030 1 266 31 31 PHE HB2 H 3.010 0.030 2 267 31 31 PHE HB3 H 2.922 0.030 2 268 31 31 PHE HD1 H 6.835 0.030 1 269 31 31 PHE HD2 H 6.835 0.030 1 270 31 31 PHE HE1 H 6.835 0.030 1 271 31 31 PHE HE2 H 6.835 0.030 1 272 31 31 PHE HZ H 6.930 0.030 1 273 31 31 PHE C C 172.514 0.300 1 274 31 31 PHE CA C 57.052 0.300 1 275 31 31 PHE CB C 41.056 0.300 1 276 31 31 PHE CD1 C 132.196 0.300 1 277 31 31 PHE CD2 C 132.196 0.300 1 278 31 31 PHE CE1 C 131.041 0.300 1 279 31 31 PHE CE2 C 131.041 0.300 1 280 31 31 PHE CZ C 129.309 0.300 1 281 31 31 PHE N N 127.241 0.300 1 282 32 32 ILE H H 8.239 0.030 1 283 32 32 ILE HA H 4.005 0.030 1 284 32 32 ILE HB H 1.371 0.030 1 285 32 32 ILE HG12 H 1.050 0.030 2 286 32 32 ILE HG13 H 0.559 0.030 2 287 32 32 ILE HG2 H 0.683 0.030 1 288 32 32 ILE HD1 H -0.094 0.030 1 289 32 32 ILE C C 173.167 0.300 1 290 32 32 ILE CA C 59.645 0.300 1 291 32 32 ILE CB C 38.728 0.300 1 292 32 32 ILE CG1 C 27.400 0.300 1 293 32 32 ILE CG2 C 20.200 0.300 1 294 32 32 ILE CD1 C 15.823 0.300 1 295 32 32 ILE N N 127.177 0.300 1 296 33 33 GLY H H 8.495 0.030 1 297 33 33 GLY HA2 H 4.301 0.030 2 298 33 33 GLY HA3 H 3.729 0.030 2 299 33 33 GLY C C 173.947 0.300 1 300 33 33 GLY CA C 44.038 0.300 1 301 33 33 GLY N N 113.319 0.300 1 302 34 34 ASN H H 8.772 0.030 1 303 34 34 ASN HA H 4.408 0.030 1 304 34 34 ASN HB2 H 3.760 0.030 2 305 34 34 ASN HB3 H 2.580 0.030 2 306 34 34 ASN HD21 H 8.277 0.030 2 307 34 34 ASN HD22 H 6.809 0.030 2 308 34 34 ASN C C 174.317 0.300 1 309 34 34 ASN CA C 53.624 0.300 1 310 34 34 ASN CB C 38.088 0.300 1 311 34 34 ASN N N 117.629 0.300 1 312 34 34 ASN ND2 N 112.272 0.300 1 313 35 35 LEU H H 7.324 0.030 1 314 35 35 LEU HA H 4.021 0.030 1 315 35 35 LEU HB2 H 1.286 0.030 2 316 35 35 LEU HB3 H 0.791 0.030 2 317 35 35 LEU HG H 0.967 0.030 1 318 35 35 LEU HD1 H 0.716 0.030 1 319 35 35 LEU HD2 H 0.422 0.030 1 320 35 35 LEU C C 176.424 0.300 1 321 35 35 LEU CA C 52.745 0.300 1 322 35 35 LEU CB C 44.343 0.300 1 323 35 35 LEU CG C 26.557 0.300 1 324 35 35 LEU CD1 C 23.389 0.300 2 325 35 35 LEU CD2 C 27.329 0.300 2 326 35 35 LEU N N 118.643 0.300 1 327 36 36 ASN H H 9.077 0.030 1 328 36 36 ASN HA H 4.769 0.030 1 329 36 36 ASN HB2 H 3.189 0.030 2 330 36 36 ASN HB3 H 2.471 0.030 2 331 36 36 ASN HD21 H 8.021 0.030 2 332 36 36 ASN HD22 H 7.142 0.030 2 333 36 36 ASN C C 175.686 0.300 1 334 36 36 ASN CA C 51.617 0.300 1 335 36 36 ASN CB C 35.662 0.300 1 336 36 36 ASN N N 124.698 0.300 1 337 36 36 ASN ND2 N 110.314 0.300 1 338 37 37 THR H H 8.190 0.030 1 339 37 37 THR HA H 4.236 0.030 1 340 37 37 THR HB H 4.588 0.030 1 341 37 37 THR HG2 H 1.152 0.030 1 342 37 37 THR C C 174.905 0.300 1 343 37 37 THR CA C 63.662 0.300 1 344 37 37 THR CB C 67.709 0.300 1 345 37 37 THR CG2 C 22.838 0.300 1 346 37 37 THR N N 117.403 0.300 1 347 38 38 ALA H H 7.852 0.030 1 348 38 38 ALA HA H 4.322 0.030 1 349 38 38 ALA HB H 1.470 0.030 1 350 38 38 ALA C C 178.652 0.300 1 351 38 38 ALA CA C 54.419 0.300 1 352 38 38 ALA CB C 18.160 0.300 1 353 38 38 ALA N N 122.999 0.300 1 354 39 39 LEU H H 6.845 0.030 1 355 39 39 LEU HA H 4.503 0.030 1 356 39 39 LEU HB2 H 1.590 0.030 2 357 39 39 LEU HB3 H 1.402 0.030 2 358 39 39 LEU HG H 1.543 0.030 1 359 39 39 LEU HD1 H 0.879 0.030 1 360 39 39 LEU HD2 H 0.838 0.030 1 361 39 39 LEU C C 176.474 0.300 1 362 39 39 LEU CA C 54.930 0.300 1 363 39 39 LEU CB C 45.594 0.300 1 364 39 39 LEU CG C 27.340 0.300 1 365 39 39 LEU CD1 C 25.273 0.300 2 366 39 39 LEU CD2 C 22.983 0.300 2 367 39 39 LEU N N 115.070 0.300 1 368 40 40 VAL H H 8.025 0.030 1 369 40 40 VAL HA H 4.016 0.030 1 370 40 40 VAL HB H 1.666 0.030 1 371 40 40 VAL HG1 H 0.885 0.030 1 372 40 40 VAL HG2 H 0.807 0.030 1 373 40 40 VAL C C 174.295 0.300 1 374 40 40 VAL CA C 62.572 0.300 1 375 40 40 VAL CB C 32.622 0.300 1 376 40 40 VAL CG1 C 22.517 0.300 2 377 40 40 VAL CG2 C 21.082 0.300 2 378 40 40 VAL N N 121.337 0.300 1 379 41 41 LYS H H 8.859 0.030 1 380 41 41 LYS HA H 4.569 0.030 1 381 41 41 LYS HB2 H 2.060 0.030 2 382 41 41 LYS HB3 H 1.740 0.030 2 383 41 41 LYS HG2 H 1.493 0.030 2 384 41 41 LYS HG3 H 1.442 0.030 2 385 41 41 LYS HD2 H 1.676 0.030 2 386 41 41 LYS HD3 H 1.632 0.030 2 387 41 41 LYS HE2 H 2.961 0.030 1 388 41 41 LYS HE3 H 2.961 0.030 1 389 41 41 LYS C C 177.921 0.300 1 390 41 41 LYS CA C 53.959 0.300 1 391 41 41 LYS CB C 34.520 0.300 1 392 41 41 LYS CG C 24.622 0.300 1 393 41 41 LYS CD C 28.604 0.300 1 394 41 41 LYS CE C 42.007 0.300 1 395 41 41 LYS N N 124.232 0.300 1 396 42 42 LYS H H 8.955 0.030 1 397 42 42 LYS HA H 3.637 0.030 1 398 42 42 LYS HB2 H 1.819 0.030 1 399 42 42 LYS HB3 H 1.819 0.030 1 400 42 42 LYS HG2 H 1.262 0.030 1 401 42 42 LYS HG3 H 1.262 0.030 1 402 42 42 LYS HD2 H 1.696 0.030 2 403 42 42 LYS HD3 H 1.621 0.030 2 404 42 42 LYS HE2 H 2.989 0.030 1 405 42 42 LYS HE3 H 2.989 0.030 1 406 42 42 LYS C C 177.766 0.300 1 407 42 42 LYS CA C 61.234 0.300 1 408 42 42 LYS CB C 32.463 0.300 1 409 42 42 LYS CG C 24.615 0.300 1 410 42 42 LYS CD C 29.899 0.300 1 411 42 42 LYS CE C 42.105 0.300 1 412 42 42 LYS N N 123.373 0.300 1 413 43 43 SER H H 8.479 0.030 1 414 43 43 SER HA H 4.303 0.030 1 415 43 43 SER HB2 H 3.935 0.030 2 416 43 43 SER HB3 H 3.832 0.030 2 417 43 43 SER C C 177.297 0.300 1 418 43 43 SER CA C 61.063 0.300 1 419 43 43 SER CB C 61.823 0.300 1 420 43 43 SER N N 111.030 0.300 1 421 44 44 ASP H H 7.144 0.030 1 422 44 44 ASP HA H 4.498 0.030 1 423 44 44 ASP HB2 H 3.179 0.030 2 424 44 44 ASP HB3 H 2.666 0.030 2 425 44 44 ASP C C 178.248 0.300 1 426 44 44 ASP CA C 57.497 0.300 1 427 44 44 ASP CB C 41.489 0.300 1 428 44 44 ASP N N 122.044 0.300 1 429 45 45 VAL H H 7.645 0.030 1 430 45 45 VAL HA H 3.476 0.030 1 431 45 45 VAL HB H 2.209 0.030 1 432 45 45 VAL HG1 H 0.720 0.030 1 433 45 45 VAL HG2 H 0.597 0.030 1 434 45 45 VAL C C 178.134 0.300 1 435 45 45 VAL CA C 67.256 0.300 1 436 45 45 VAL CB C 31.353 0.300 1 437 45 45 VAL CG1 C 23.362 0.300 2 438 45 45 VAL CG2 C 23.157 0.300 2 439 45 45 VAL N N 119.587 0.300 1 440 46 46 GLU H H 8.642 0.030 1 441 46 46 GLU HA H 3.730 0.030 1 442 46 46 GLU HB2 H 2.161 0.030 2 443 46 46 GLU HB3 H 2.038 0.030 2 444 46 46 GLU HG2 H 2.399 0.030 2 445 46 46 GLU HG3 H 1.987 0.030 2 446 46 46 GLU C C 179.214 0.300 1 447 46 46 GLU CA C 61.151 0.300 1 448 46 46 GLU CB C 29.558 0.300 1 449 46 46 GLU CG C 37.698 0.300 1 450 46 46 GLU N N 119.066 0.300 1 451 47 47 THR H H 8.094 0.030 1 452 47 47 THR HA H 3.911 0.030 1 453 47 47 THR HB H 4.366 0.030 1 454 47 47 THR HG2 H 1.236 0.030 1 455 47 47 THR C C 176.928 0.300 1 456 47 47 THR CA C 67.385 0.300 1 457 47 47 THR CB C 68.835 0.300 1 458 47 47 THR CG2 C 21.584 0.300 1 459 47 47 THR N N 116.894 0.300 1 460 48 48 ILE H H 7.963 0.030 1 461 48 48 ILE HA H 3.608 0.030 1 462 48 48 ILE HB H 1.737 0.030 1 463 48 48 ILE HG12 H 0.993 0.030 2 464 48 48 ILE HG13 H 1.846 0.030 2 465 48 48 ILE HG2 H 0.221 0.030 1 466 48 48 ILE HD1 H 0.785 0.030 1 467 48 48 ILE C C 178.702 0.300 1 468 48 48 ILE CA C 65.520 0.300 1 469 48 48 ILE CB C 39.306 0.300 1 470 48 48 ILE CG1 C 29.047 0.300 1 471 48 48 ILE CG2 C 16.555 0.300 1 472 48 48 ILE CD1 C 14.150 0.300 1 473 48 48 ILE N N 121.749 0.300 1 474 49 49 PHE H H 8.535 0.030 1 475 49 49 PHE HA H 4.289 0.030 1 476 49 49 PHE HB2 H 3.711 0.030 2 477 49 49 PHE HB3 H 2.866 0.030 2 478 49 49 PHE HD1 H 8.015 0.030 1 479 49 49 PHE HD2 H 8.015 0.030 1 480 49 49 PHE HE1 H 6.940 0.030 1 481 49 49 PHE HE2 H 6.940 0.030 1 482 49 49 PHE HZ H 7.042 0.030 1 483 49 49 PHE C C 179.071 0.300 1 484 49 49 PHE CA C 62.865 0.300 1 485 49 49 PHE CB C 36.493 0.300 1 486 49 49 PHE CD1 C 132.143 0.300 1 487 49 49 PHE CD2 C 132.143 0.300 1 488 49 49 PHE CE1 C 130.149 0.300 1 489 49 49 PHE CE2 C 130.149 0.300 1 490 49 49 PHE CZ C 128.995 0.300 1 491 49 49 PHE N N 113.755 0.300 1 492 50 50 SER H H 8.502 0.030 1 493 50 50 SER HA H 5.131 0.030 1 494 50 50 SER HB2 H 4.155 0.030 2 495 50 50 SER HB3 H 4.128 0.030 2 496 50 50 SER C C 174.714 0.300 1 497 50 50 SER CA C 61.234 0.300 1 498 50 50 SER CB C 63.112 0.300 1 499 50 50 SER N N 120.940 0.300 1 500 51 51 LYS H H 6.956 0.030 1 501 51 51 LYS HA H 3.870 0.030 1 502 51 51 LYS HB2 H 1.418 0.030 2 503 51 51 LYS HB3 H 1.131 0.030 2 504 51 51 LYS HG2 H 1.022 0.030 2 505 51 51 LYS HG3 H 0.885 0.030 2 506 51 51 LYS HD2 H 1.442 0.030 1 507 51 51 LYS HD3 H 1.442 0.030 1 508 51 51 LYS HE2 H 2.785 0.030 2 509 51 51 LYS HE3 H 2.761 0.030 2 510 51 51 LYS C C 177.077 0.300 1 511 51 51 LYS CA C 58.517 0.300 1 512 51 51 LYS CB C 31.819 0.300 1 513 51 51 LYS CG C 24.014 0.300 1 514 51 51 LYS CD C 28.875 0.300 1 515 51 51 LYS CE C 41.649 0.300 1 516 51 51 LYS N N 119.780 0.300 1 517 52 52 TYR H H 6.785 0.030 1 518 52 52 TYR HA H 4.060 0.030 1 519 52 52 TYR HB2 H 3.342 0.030 2 520 52 52 TYR HB3 H 2.586 0.030 2 521 52 52 TYR HD1 H 7.106 0.030 1 522 52 52 TYR HD2 H 7.106 0.030 1 523 52 52 TYR HE1 H 6.623 0.030 1 524 52 52 TYR HE2 H 6.623 0.030 1 525 52 52 TYR C C 174.089 0.300 1 526 52 52 TYR CA C 59.056 0.300 1 527 52 52 TYR CB C 38.551 0.300 1 528 52 52 TYR CD1 C 132.825 0.300 1 529 52 52 TYR CD2 C 132.825 0.300 1 530 52 52 TYR CE1 C 118.145 0.300 1 531 52 52 TYR CE2 C 118.145 0.300 1 532 52 52 TYR N N 114.348 0.300 1 533 53 53 GLY H H 7.133 0.030 1 534 53 53 GLY HA2 H 3.779 0.030 2 535 53 53 GLY HA3 H 3.351 0.030 2 536 53 53 GLY C C 170.875 0.300 1 537 53 53 GLY CA C 43.613 0.300 1 538 53 53 GLY N N 105.744 0.300 1 539 54 54 ARG H H 7.855 0.030 1 540 54 54 ARG HA H 4.210 0.030 1 541 54 54 ARG HB2 H 1.884 0.030 1 542 54 54 ARG HB3 H 1.884 0.030 1 543 54 54 ARG HG2 H 1.438 0.030 2 544 54 54 ARG HG3 H 1.638 0.030 2 545 54 54 ARG HD2 H 3.279 0.030 2 546 54 54 ARG HD3 H 3.228 0.030 2 547 54 54 ARG C C 177.212 0.300 1 548 54 54 ARG CA C 57.541 0.300 1 549 54 54 ARG CB C 30.322 0.300 1 550 54 54 ARG CG C 27.380 0.300 1 551 54 54 ARG CD C 43.434 0.300 1 552 54 54 ARG N N 116.932 0.300 1 553 55 55 VAL H H 9.044 0.030 1 554 55 55 VAL HA H 3.663 0.030 1 555 55 55 VAL HB H 2.019 0.030 1 556 55 55 VAL HG1 H 0.853 0.030 1 557 55 55 VAL HG2 H 0.718 0.030 1 558 55 55 VAL C C 175.488 0.300 1 559 55 55 VAL CA C 63.056 0.300 1 560 55 55 VAL CB C 31.917 0.300 1 561 55 55 VAL CG1 C 21.775 0.300 2 562 55 55 VAL CG2 C 22.416 0.300 2 563 55 55 VAL N N 130.401 0.300 1 564 56 56 ALA H H 8.885 0.030 1 565 56 56 ALA HA H 4.267 0.030 1 566 56 56 ALA HB H 1.190 0.030 1 567 56 56 ALA C C 177.765 0.300 1 568 56 56 ALA CA C 52.831 0.300 1 569 56 56 ALA CB C 18.993 0.300 1 570 56 56 ALA N N 133.425 0.300 1 571 57 57 GLY H H 7.515 0.030 1 572 57 57 GLY HA2 H 4.141 0.030 2 573 57 57 GLY HA3 H 3.891 0.030 2 574 57 57 GLY C C 170.769 0.300 1 575 57 57 GLY CA C 45.319 0.300 1 576 57 57 GLY N N 104.896 0.300 1 577 58 58 CYS H H 8.366 0.030 1 578 58 58 CYS HA H 5.110 0.030 1 579 58 58 CYS HB2 H 2.813 0.030 2 580 58 58 CYS HB3 H 2.636 0.030 2 581 58 58 CYS C C 172.387 0.300 1 582 58 58 CYS CA C 57.505 0.300 1 583 58 58 CYS CB C 28.800 0.300 1 584 58 58 CYS N N 121.713 0.300 1 585 59 59 SER H H 8.785 0.030 1 586 59 59 SER HA H 4.712 0.030 1 587 59 59 SER HB2 H 3.824 0.030 2 588 59 59 SER HB3 H 3.760 0.030 2 589 59 59 SER C C 172.053 0.300 1 590 59 59 SER CA C 57.053 0.300 1 591 59 59 SER CB C 65.093 0.300 1 592 59 59 SER N N 122.224 0.300 1 593 60 60 VAL H H 8.524 0.030 1 594 60 60 VAL HA H 4.047 0.030 1 595 60 60 VAL HB H 1.861 0.030 1 596 60 60 VAL HG1 H 0.931 0.030 1 597 60 60 VAL HG2 H 0.694 0.030 1 598 60 60 VAL C C 174.196 0.300 1 599 60 60 VAL CA C 62.204 0.300 1 600 60 60 VAL CB C 33.351 0.300 1 601 60 60 VAL CG1 C 22.496 0.300 2 602 60 60 VAL CG2 C 21.469 0.300 2 603 60 60 VAL N N 122.949 0.300 1 604 61 61 HIS H H 8.390 0.030 1 605 61 61 HIS HA H 4.617 0.030 1 606 61 61 HIS HB2 H 2.809 0.030 2 607 61 61 HIS HB3 H 0.993 0.030 2 608 61 61 HIS HD2 H 6.349 0.030 1 609 61 61 HIS HE1 H 7.754 0.030 1 610 61 61 HIS C C 173.642 0.300 1 611 61 61 HIS CA C 54.377 0.300 1 612 61 61 HIS CB C 29.608 0.300 1 613 61 61 HIS CD2 C 125.426 0.300 1 614 61 61 HIS CE1 C 138.598 0.300 1 615 61 61 HIS N N 129.084 0.300 1 616 62 62 LYS H H 7.777 0.030 1 617 62 62 LYS HA H 4.422 0.030 1 618 62 62 LYS HB2 H 1.972 0.030 2 619 62 62 LYS HB3 H 1.819 0.030 2 620 62 62 LYS HG2 H 1.363 0.030 2 621 62 62 LYS HG3 H 1.444 0.030 2 622 62 62 LYS HD2 H 1.730 0.030 1 623 62 62 LYS HD3 H 1.730 0.030 1 624 62 62 LYS HE2 H 3.027 0.030 1 625 62 62 LYS HE3 H 3.027 0.030 1 626 62 62 LYS C C 175.679 0.300 1 627 62 62 LYS CA C 56.610 0.300 1 628 62 62 LYS CB C 30.752 0.300 1 629 62 62 LYS CG C 24.978 0.300 1 630 62 62 LYS CD C 29.407 0.300 1 631 62 62 LYS CE C 42.204 0.300 1 632 62 62 LYS N N 121.505 0.300 1 633 63 63 GLY H H 8.441 0.030 1 634 63 63 GLY HA2 H 4.465 0.030 2 635 63 63 GLY HA3 H 4.393 0.030 2 636 63 63 GLY C C 173.805 0.300 1 637 63 63 GLY CA C 45.669 0.300 1 638 63 63 GLY N N 115.142 0.300 1 639 64 64 TYR H H 7.125 0.030 1 640 64 64 TYR HA H 5.169 0.030 1 641 64 64 TYR HB2 H 3.256 0.030 2 642 64 64 TYR HB3 H 2.590 0.030 2 643 64 64 TYR HD1 H 6.594 0.030 1 644 64 64 TYR HD2 H 6.594 0.030 1 645 64 64 TYR HE1 H 6.662 0.030 1 646 64 64 TYR HE2 H 6.662 0.030 1 647 64 64 TYR C C 171.649 0.300 1 648 64 64 TYR CA C 56.049 0.300 1 649 64 64 TYR CB C 40.028 0.300 1 650 64 64 TYR CD1 C 134.055 0.300 1 651 64 64 TYR CD2 C 134.055 0.300 1 652 64 64 TYR CE1 C 118.237 0.300 1 653 64 64 TYR CE2 C 118.237 0.300 1 654 64 64 TYR N N 113.632 0.300 1 655 65 65 ALA H H 8.727 0.030 1 656 65 65 ALA HA H 4.969 0.030 1 657 65 65 ALA HB H 1.109 0.030 1 658 65 65 ALA C C 173.876 0.300 1 659 65 65 ALA CA C 50.234 0.300 1 660 65 65 ALA CB C 24.493 0.300 1 661 65 65 ALA N N 119.588 0.300 1 662 66 66 PHE H H 8.877 0.030 1 663 66 66 PHE HA H 5.759 0.030 1 664 66 66 PHE HB2 H 2.907 0.030 2 665 66 66 PHE HB3 H 2.827 0.030 2 666 66 66 PHE HD1 H 7.331 0.030 1 667 66 66 PHE HD2 H 7.331 0.030 1 668 66 66 PHE HE1 H 7.478 0.030 1 669 66 66 PHE HE2 H 7.478 0.030 1 670 66 66 PHE HZ H 7.352 0.030 1 671 66 66 PHE C C 175.977 0.300 1 672 66 66 PHE CA C 56.770 0.300 1 673 66 66 PHE CB C 43.851 0.300 1 674 66 66 PHE CD1 C 131.723 0.300 1 675 66 66 PHE CD2 C 131.723 0.300 1 676 66 66 PHE CE1 C 131.776 0.300 1 677 66 66 PHE CE2 C 131.776 0.300 1 678 66 66 PHE CZ C 129.992 0.300 1 679 66 66 PHE N N 114.078 0.300 1 680 67 67 VAL H H 8.701 0.030 1 681 67 67 VAL HA H 4.260 0.030 1 682 67 67 VAL HB H 1.362 0.030 1 683 67 67 VAL HG1 H 0.389 0.030 1 684 67 67 VAL HG2 H 0.336 0.030 1 685 67 67 VAL C C 172.649 0.300 1 686 67 67 VAL CA C 61.527 0.300 1 687 67 67 VAL CB C 35.076 0.300 1 688 67 67 VAL CG1 C 21.942 0.300 2 689 67 67 VAL CG2 C 22.660 0.300 2 690 67 67 VAL N N 119.458 0.300 1 691 68 68 GLN H H 8.766 0.030 1 692 68 68 GLN HA H 4.652 0.030 1 693 68 68 GLN HB2 H 1.901 0.030 2 694 68 68 GLN HB3 H 1.790 0.030 2 695 68 68 GLN HG2 H 2.241 0.030 2 696 68 68 GLN HG3 H 2.125 0.030 2 697 68 68 GLN HE21 H 7.763 0.030 2 698 68 68 GLN HE22 H 7.565 0.030 2 699 68 68 GLN C C 174.401 0.300 1 700 68 68 GLN CA C 54.042 0.300 1 701 68 68 GLN CB C 31.551 0.300 1 702 68 68 GLN CG C 33.723 0.300 1 703 68 68 GLN N N 127.544 0.300 1 704 68 68 GLN NE2 N 117.762 0.300 1 705 69 69 TYR H H 8.771 0.030 1 706 69 69 TYR HA H 5.208 0.030 1 707 69 69 TYR HB2 H 3.791 0.030 2 708 69 69 TYR HB3 H 3.234 0.030 2 709 69 69 TYR HD1 H 7.122 0.030 1 710 69 69 TYR HD2 H 7.122 0.030 1 711 69 69 TYR HE1 H 6.689 0.030 1 712 69 69 TYR HE2 H 6.689 0.030 1 713 69 69 TYR C C 175.842 0.300 1 714 69 69 TYR CA C 58.411 0.300 1 715 69 69 TYR CB C 41.447 0.300 1 716 69 69 TYR CD1 C 132.843 0.300 1 717 69 69 TYR CD2 C 132.843 0.300 1 718 69 69 TYR CE1 C 117.760 0.300 1 719 69 69 TYR CE2 C 117.760 0.300 1 720 69 69 TYR N N 125.185 0.300 1 721 70 70 SER H H 10.049 0.030 1 722 70 70 SER HA H 4.779 0.030 1 723 70 70 SER HB2 H 4.061 0.030 2 724 70 70 SER HB3 H 4.005 0.030 2 725 70 70 SER C C 173.337 0.300 1 726 70 70 SER CA C 58.809 0.300 1 727 70 70 SER CB C 64.368 0.300 1 728 70 70 SER N N 114.875 0.300 1 729 71 71 ASN H H 7.173 0.030 1 730 71 71 ASN HA H 4.750 0.030 1 731 71 71 ASN HB2 H 2.489 0.030 2 732 71 71 ASN HB3 H 1.924 0.030 2 733 71 71 ASN HD21 H 6.180 0.030 2 734 71 71 ASN HD22 H 7.492 0.030 2 735 71 71 ASN C C 175.104 0.300 1 736 71 71 ASN CA C 52.955 0.300 1 737 71 71 ASN CB C 41.034 0.300 1 738 71 71 ASN N N 116.703 0.300 1 739 71 71 ASN ND2 N 113.179 0.300 1 740 72 72 GLU H H 9.308 0.030 1 741 72 72 GLU HA H 4.009 0.030 1 742 72 72 GLU HB2 H 2.068 0.030 2 743 72 72 GLU HB3 H 1.944 0.030 2 744 72 72 GLU HG2 H 2.469 0.030 2 745 72 72 GLU HG3 H 2.237 0.030 2 746 72 72 GLU C C 177.488 0.300 1 747 72 72 GLU CA C 59.394 0.300 1 748 72 72 GLU CB C 29.977 0.300 1 749 72 72 GLU CG C 35.904 0.300 1 750 72 72 GLU N N 126.592 0.300 1 751 73 73 ARG H H 8.478 0.030 1 752 73 73 ARG HA H 3.960 0.030 1 753 73 73 ARG HB2 H 1.809 0.030 1 754 73 73 ARG HB3 H 1.809 0.030 1 755 73 73 ARG HG2 H 1.749 0.030 2 756 73 73 ARG HG3 H 1.648 0.030 2 757 73 73 ARG HD2 H 3.239 0.030 1 758 73 73 ARG HD3 H 3.239 0.030 1 759 73 73 ARG C C 179.852 0.300 1 760 73 73 ARG CA C 59.269 0.300 1 761 73 73 ARG CB C 29.397 0.300 1 762 73 73 ARG CG C 27.734 0.300 1 763 73 73 ARG CD C 43.286 0.300 1 764 73 73 ARG N N 118.650 0.300 1 765 74 74 HIS H H 7.337 0.030 1 766 74 74 HIS HA H 4.350 0.030 1 767 74 74 HIS HB2 H 2.818 0.030 2 768 74 74 HIS HB3 H 2.380 0.030 2 769 74 74 HIS HD2 H 6.833 0.030 1 770 74 74 HIS HE1 H 7.966 0.030 1 771 74 74 HIS C C 175.743 0.300 1 772 74 74 HIS CA C 56.840 0.300 1 773 74 74 HIS CB C 32.002 0.300 1 774 74 74 HIS CD2 C 116.033 0.300 1 775 74 74 HIS CE1 C 138.807 0.300 1 776 74 74 HIS N N 120.052 0.300 1 777 75 75 ALA H H 6.467 0.030 1 778 75 75 ALA HA H 3.783 0.030 1 779 75 75 ALA HB H 1.447 0.030 1 780 75 75 ALA C C 178.000 0.300 1 781 75 75 ALA CA C 54.832 0.300 1 782 75 75 ALA CB C 18.630 0.300 1 783 75 75 ALA N N 118.086 0.300 1 784 76 76 ARG H H 8.143 0.030 1 785 76 76 ARG HA H 3.920 0.030 1 786 76 76 ARG HB2 H 1.878 0.030 2 787 76 76 ARG HB3 H 1.818 0.030 2 788 76 76 ARG HG2 H 1.893 0.030 2 789 76 76 ARG HG3 H 1.814 0.030 2 790 76 76 ARG HD2 H 3.277 0.030 2 791 76 76 ARG HD3 H 3.154 0.030 2 792 76 76 ARG C C 179.347 0.300 1 793 76 76 ARG CA C 59.297 0.300 1 794 76 76 ARG CB C 29.793 0.300 1 795 76 76 ARG CG C 28.128 0.300 1 796 76 76 ARG CD C 43.160 0.300 1 797 76 76 ARG N N 115.225 0.300 1 798 77 77 ALA H H 7.709 0.030 1 799 77 77 ALA HA H 4.055 0.030 1 800 77 77 ALA HB H 1.657 0.030 1 801 77 77 ALA C C 179.696 0.300 1 802 77 77 ALA CA C 54.908 0.300 1 803 77 77 ALA CB C 18.243 0.300 1 804 77 77 ALA N N 121.246 0.300 1 805 78 78 ALA H H 7.674 0.030 1 806 78 78 ALA HA H 2.110 0.030 1 807 78 78 ALA HB H 1.533 0.030 1 808 78 78 ALA C C 179.291 0.300 1 809 78 78 ALA CA C 54.328 0.300 1 810 78 78 ALA CB C 19.407 0.300 1 811 78 78 ALA N N 123.866 0.300 1 812 79 79 VAL H H 7.674 0.030 1 813 79 79 VAL HA H 3.380 0.030 1 814 79 79 VAL HB H 2.099 0.030 1 815 79 79 VAL HG1 H 1.008 0.030 1 816 79 79 VAL HG2 H 0.939 0.030 1 817 79 79 VAL C C 178.120 0.300 1 818 79 79 VAL CA C 66.572 0.300 1 819 79 79 VAL CB C 31.749 0.300 1 820 79 79 VAL CG1 C 23.501 0.300 2 821 79 79 VAL CG2 C 21.765 0.300 2 822 79 79 VAL N N 116.794 0.300 1 823 80 80 LEU H H 7.413 0.030 1 824 80 80 LEU HA H 4.084 0.030 1 825 80 80 LEU HB2 H 1.688 0.030 2 826 80 80 LEU HB3 H 1.615 0.030 2 827 80 80 LEU HG H 1.710 0.030 1 828 80 80 LEU HD1 H 0.919 0.030 1 829 80 80 LEU HD2 H 0.932 0.030 1 830 80 80 LEU C C 180.227 0.300 1 831 80 80 LEU CA C 57.286 0.300 1 832 80 80 LEU CB C 42.203 0.300 1 833 80 80 LEU CG C 27.045 0.300 1 834 80 80 LEU CD1 C 23.926 0.300 2 835 80 80 LEU CD2 C 24.552 0.300 2 836 80 80 LEU N N 117.071 0.300 1 837 81 81 GLY H H 8.321 0.030 1 838 81 81 GLY HA2 H 3.951 0.030 1 839 81 81 GLY HA3 H 3.951 0.030 1 840 81 81 GLY C C 175.708 0.300 1 841 81 81 GLY CA C 46.474 0.300 1 842 81 81 GLY N N 105.323 0.300 1 843 82 82 GLU H H 7.783 0.030 1 844 82 82 GLU HA H 4.598 0.030 1 845 82 82 GLU HB2 H 2.247 0.030 2 846 82 82 GLU HB3 H 1.638 0.030 2 847 82 82 GLU HG2 H 2.077 0.030 2 848 82 82 GLU HG3 H 1.634 0.030 2 849 82 82 GLU C C 176.601 0.300 1 850 82 82 GLU CA C 55.004 0.300 1 851 82 82 GLU CB C 31.032 0.300 1 852 82 82 GLU CG C 34.919 0.300 1 853 82 82 GLU N N 114.364 0.300 1 854 83 83 ASN H H 7.732 0.030 1 855 83 83 ASN HA H 4.338 0.030 1 856 83 83 ASN HB2 H 3.199 0.030 2 857 83 83 ASN HB3 H 2.875 0.030 2 858 83 83 ASN HD21 H 7.658 0.030 2 859 83 83 ASN HD22 H 7.023 0.030 2 860 83 83 ASN C C 177.488 0.300 1 861 83 83 ASN CA C 56.299 0.300 1 862 83 83 ASN CB C 38.497 0.300 1 863 83 83 ASN N N 116.808 0.300 1 864 83 83 ASN ND2 N 113.108 0.300 1 865 84 84 GLY H H 8.442 0.030 1 866 84 84 GLY HA2 H 4.217 0.030 2 867 84 84 GLY HA3 H 3.618 0.030 2 868 84 84 GLY C C 173.408 0.300 1 869 84 84 GLY CA C 45.629 0.300 1 870 84 84 GLY N N 114.941 0.300 1 871 85 85 ARG H H 7.948 0.030 1 872 85 85 ARG HA H 4.198 0.030 1 873 85 85 ARG HB2 H 2.100 0.030 2 874 85 85 ARG HB3 H 1.863 0.030 2 875 85 85 ARG HG2 H 1.517 0.030 2 876 85 85 ARG HG3 H 1.710 0.030 2 877 85 85 ARG HD2 H 3.059 0.030 2 878 85 85 ARG HD3 H 3.363 0.030 2 879 85 85 ARG HE H 7.366 0.030 1 880 85 85 ARG C C 175.232 0.300 1 881 85 85 ARG CA C 56.327 0.300 1 882 85 85 ARG CB C 30.826 0.300 1 883 85 85 ARG CG C 27.271 0.300 1 884 85 85 ARG CD C 43.822 0.300 1 885 85 85 ARG N N 121.982 0.300 1 886 86 86 VAL H H 8.629 0.030 1 887 86 86 VAL HA H 4.320 0.030 1 888 86 86 VAL HB H 1.934 0.030 1 889 86 86 VAL HG1 H 0.953 0.030 1 890 86 86 VAL HG2 H 0.692 0.030 1 891 86 86 VAL C C 175.714 0.300 1 892 86 86 VAL CA C 62.503 0.300 1 893 86 86 VAL CB C 31.316 0.300 1 894 86 86 VAL CG1 C 21.425 0.300 2 895 86 86 VAL CG2 C 20.996 0.300 2 896 86 86 VAL N N 125.688 0.300 1 897 87 87 LEU H H 8.831 0.030 1 898 87 87 LEU HA H 4.703 0.030 1 899 87 87 LEU HB2 H 1.834 0.030 2 900 87 87 LEU HB3 H 1.199 0.030 2 901 87 87 LEU HG H 1.438 0.030 1 902 87 87 LEU HD1 H 0.838 0.030 1 903 87 87 LEU HD2 H 0.966 0.030 1 904 87 87 LEU C C 175.551 0.300 1 905 87 87 LEU CA C 53.760 0.300 1 906 87 87 LEU CB C 45.393 0.300 1 907 87 87 LEU CG C 27.045 0.300 1 908 87 87 LEU CD1 C 26.320 0.300 2 909 87 87 LEU CD2 C 23.206 0.300 2 910 87 87 LEU N N 130.789 0.300 1 911 88 88 ALA H H 9.685 0.030 1 912 88 88 ALA HA H 4.012 0.030 1 913 88 88 ALA HB H 1.409 0.030 1 914 88 88 ALA C C 177.106 0.300 1 915 88 88 ALA CA C 52.871 0.300 1 916 88 88 ALA CB C 17.482 0.300 1 917 88 88 ALA N N 132.616 0.300 1 918 89 89 GLY H H 8.315 0.030 1 919 89 89 GLY HA2 H 4.141 0.030 2 920 89 89 GLY HA3 H 3.532 0.030 2 921 89 89 GLY C C 173.997 0.300 1 922 89 89 GLY CA C 45.457 0.300 1 923 89 89 GLY N N 101.262 0.300 1 924 90 90 GLN H H 7.620 0.030 1 925 90 90 GLN HA H 4.798 0.030 1 926 90 90 GLN HB2 H 2.238 0.030 2 927 90 90 GLN HB3 H 1.998 0.030 2 928 90 90 GLN HG2 H 2.415 0.030 2 929 90 90 GLN HG3 H 2.292 0.030 2 930 90 90 GLN HE21 H 6.651 0.030 2 931 90 90 GLN HE22 H 6.954 0.030 2 932 90 90 GLN C C 174.238 0.300 1 933 90 90 GLN CA C 54.209 0.300 1 934 90 90 GLN CB C 32.085 0.300 1 935 90 90 GLN CG C 34.671 0.300 1 936 90 90 GLN N N 118.273 0.300 1 937 90 90 GLN NE2 N 109.971 0.300 1 938 91 91 THR H H 8.684 0.030 1 939 91 91 THR HA H 4.293 0.030 1 940 91 91 THR HB H 3.968 0.030 1 941 91 91 THR HG2 H 1.143 0.030 1 942 91 91 THR C C 174.813 0.300 1 943 91 91 THR CA C 62.823 0.300 1 944 91 91 THR CB C 69.009 0.300 1 945 91 91 THR CG2 C 21.707 0.300 1 946 91 91 THR N N 119.239 0.300 1 947 92 92 LEU H H 9.239 0.030 1 948 92 92 LEU HA H 4.358 0.030 1 949 92 92 LEU HB2 H 2.178 0.030 2 950 92 92 LEU HB3 H 1.282 0.030 2 951 92 92 LEU HG H 2.094 0.030 1 952 92 92 LEU HD1 H 1.010 0.030 1 953 92 92 LEU HD2 H 0.829 0.030 1 954 92 92 LEU C C 176.445 0.300 1 955 92 92 LEU CA C 56.007 0.300 1 956 92 92 LEU CB C 42.706 0.300 1 957 92 92 LEU CG C 26.356 0.300 1 958 92 92 LEU CD1 C 25.550 0.300 2 959 92 92 LEU CD2 C 23.243 0.300 2 960 92 92 LEU N N 128.715 0.300 1 961 93 93 ASP H H 7.708 0.030 1 962 93 93 ASP HA H 5.083 0.030 1 963 93 93 ASP HB2 H 2.637 0.030 2 964 93 93 ASP HB3 H 2.498 0.030 2 965 93 93 ASP C C 174.536 0.300 1 966 93 93 ASP CA C 52.746 0.300 1 967 93 93 ASP CB C 42.113 0.300 1 968 93 93 ASP N N 124.070 0.300 1 969 94 94 ILE H H 8.622 0.030 1 970 94 94 ILE HA H 5.327 0.030 1 971 94 94 ILE HB H 1.673 0.030 1 972 94 94 ILE HG12 H 1.190 0.030 2 973 94 94 ILE HG13 H 1.676 0.030 2 974 94 94 ILE HG2 H 0.966 0.030 1 975 94 94 ILE HD1 H 1.024 0.030 1 976 94 94 ILE C C 174.806 0.300 1 977 94 94 ILE CA C 59.227 0.300 1 978 94 94 ILE CB C 39.919 0.300 1 979 94 94 ILE CG1 C 27.931 0.300 1 980 94 94 ILE CG2 C 19.170 0.300 1 981 94 94 ILE CD1 C 15.233 0.300 1 982 94 94 ILE N N 124.128 0.300 1 983 95 95 ASN H H 8.951 0.030 1 984 95 95 ASN HA H 4.928 0.030 1 985 95 95 ASN HB2 H 2.885 0.030 1 986 95 95 ASN HB3 H 2.885 0.030 1 987 95 95 ASN HD21 H 6.658 0.030 2 988 95 95 ASN HD22 H 7.272 0.030 2 989 95 95 ASN C C 173.969 0.300 1 990 95 95 ASN CA C 52.245 0.300 1 991 95 95 ASN CB C 42.643 0.300 1 992 95 95 ASN N N 121.475 0.300 1 993 95 95 ASN ND2 N 113.661 0.300 1 994 96 96 MET H H 8.887 0.030 1 995 96 96 MET HA H 4.902 0.030 1 996 96 96 MET HB2 H 2.523 0.030 2 997 96 96 MET HB3 H 1.914 0.030 2 998 96 96 MET HG2 H 2.732 0.030 2 999 96 96 MET HG3 H 2.605 0.030 2 1000 96 96 MET HE H 2.039 0.030 1 1001 96 96 MET C C 178.149 0.300 1 1002 96 96 MET CA C 54.673 0.300 1 1003 96 96 MET CB C 30.113 0.300 1 1004 96 96 MET CG C 32.190 0.300 1 1005 96 96 MET CE C 16.541 0.300 1 1006 96 96 MET N N 119.981 0.300 1 1007 97 97 ALA H H 9.112 0.030 1 1008 97 97 ALA HA H 4.249 0.030 1 1009 97 97 ALA HB H 1.477 0.030 1 1010 97 97 ALA C C 178.020 0.300 1 1011 97 97 ALA CA C 54.062 0.300 1 1012 97 97 ALA CB C 18.820 0.300 1 1013 97 97 ALA N N 126.091 0.300 1 1014 98 98 GLY H H 9.010 0.030 1 1015 98 98 GLY HA2 H 4.027 0.030 2 1016 98 98 GLY HA3 H 3.741 0.030 2 1017 98 98 GLY C C 173.536 0.300 1 1018 98 98 GLY CA C 44.741 0.300 1 1019 98 98 GLY N N 106.795 0.300 1 1020 99 99 GLU H H 7.712 0.030 1 1021 99 99 GLU HA H 4.571 0.030 1 1022 99 99 GLU HB2 H 2.008 0.030 2 1023 99 99 GLU HB3 H 1.883 0.030 2 1024 99 99 GLU HG2 H 2.210 0.030 1 1025 99 99 GLU HG3 H 2.210 0.030 1 1026 99 99 GLU C C 173.675 0.300 1 1027 99 99 GLU CA C 53.942 0.300 1 1028 99 99 GLU CB C 30.004 0.300 1 1029 99 99 GLU CG C 35.942 0.300 1 1030 99 99 GLU N N 120.789 0.300 1 1031 100 100 PRO HA H 4.303 0.030 1 1032 100 100 PRO HB2 H 2.120 0.030 2 1033 100 100 PRO HB3 H 1.780 0.030 2 1034 100 100 PRO HG2 H 1.938 0.030 2 1035 100 100 PRO HG3 H 1.878 0.030 2 1036 100 100 PRO HD2 H 3.618 0.030 1 1037 100 100 PRO HD3 H 3.618 0.030 1 1038 100 100 PRO C C 176.629 0.300 1 1039 100 100 PRO CA C 62.762 0.300 1 1040 100 100 PRO CB C 31.988 0.300 1 1041 100 100 PRO CG C 27.340 0.300 1 1042 100 100 PRO CD C 50.472 0.300 1 1043 101 101 LYS H H 8.352 0.030 1 1044 101 101 LYS HA H 4.503 0.030 1 1045 101 101 LYS HB2 H 1.768 0.030 2 1046 101 101 LYS HB3 H 1.628 0.030 2 1047 101 101 LYS HG2 H 1.372 0.030 2 1048 101 101 LYS HG3 H 1.423 0.030 2 1049 101 101 LYS HD2 H 1.604 0.030 1 1050 101 101 LYS HD3 H 1.604 0.030 1 1051 101 101 LYS HE2 H 2.906 0.030 1 1052 101 101 LYS HE3 H 2.906 0.030 1 1053 101 101 LYS C C 174.897 0.300 1 1054 101 101 LYS CA C 54.109 0.300 1 1055 101 101 LYS CB C 32.348 0.300 1 1056 101 101 LYS CG C 24.535 0.300 1 1057 101 101 LYS CD C 29.017 0.300 1 1058 101 101 LYS CE C 42.080 0.300 1 1059 101 101 LYS N N 122.864 0.300 1 1060 102 102 PRO HA H 4.367 0.030 1 1061 102 102 PRO HB2 H 2.256 0.030 2 1062 102 102 PRO HB3 H 1.857 0.030 2 1063 102 102 PRO HG2 H 1.971 0.030 1 1064 102 102 PRO HG3 H 1.971 0.030 1 1065 102 102 PRO HD2 H 3.776 0.030 2 1066 102 102 PRO HD3 H 3.621 0.030 2 1067 102 102 PRO C C 176.544 0.300 1 1068 102 102 PRO CA C 63.254 0.300 1 1069 102 102 PRO CB C 32.072 0.300 1 1070 102 102 PRO CG C 27.242 0.300 1 1071 102 102 PRO CD C 50.628 0.300 1 1072 103 103 ASP H H 8.404 0.030 1 1073 103 103 ASP HA H 4.522 0.030 1 1074 103 103 ASP HB2 H 2.680 0.030 2 1075 103 103 ASP HB3 H 2.631 0.030 2 1076 103 103 ASP C C 176.339 0.300 1 1077 103 103 ASP CA C 54.209 0.300 1 1078 103 103 ASP CB C 41.069 0.300 1 1079 103 103 ASP N N 120.343 0.300 1 1080 104 104 ARG H H 8.274 0.030 1 1081 104 104 ARG HA H 4.398 0.030 1 1082 104 104 ARG HB2 H 1.901 0.030 2 1083 104 104 ARG HB3 H 1.749 0.030 2 1084 104 104 ARG HG2 H 1.590 0.030 2 1085 104 104 ARG HG3 H 1.714 0.030 2 1086 104 104 ARG HD2 H 3.161 0.030 1 1087 104 104 ARG HD3 H 3.161 0.030 1 1088 104 104 ARG C C 176.256 0.300 1 1089 104 104 ARG CA C 55.840 0.300 1 1090 104 104 ARG CB C 30.617 0.300 1 1091 104 104 ARG CG C 27.045 0.300 1 1092 104 104 ARG CD C 43.385 0.300 1 1093 104 104 ARG N N 121.782 0.300 1 1094 105 105 SER H H 8.380 0.030 1 1095 105 105 SER HA H 4.446 0.030 1 1096 105 105 SER HB2 H 3.875 0.030 1 1097 105 105 SER HB3 H 3.875 0.030 1 1098 105 105 SER C C 174.558 0.300 1 1099 105 105 SER CA C 58.642 0.300 1 1100 105 105 SER CB C 64.075 0.300 1 1101 105 105 SER N N 117.065 0.300 1 1102 106 106 GLY H H 8.229 0.030 1 1103 106 106 GLY HA2 H 4.140 0.030 2 1104 106 106 GLY HA3 H 4.059 0.030 2 1105 106 106 GLY C C 171.771 0.300 1 1106 106 106 GLY CA C 44.687 0.300 1 1107 106 106 GLY N N 110.618 0.300 1 1108 107 107 PRO HA H 4.465 0.030 1 1109 107 107 PRO HB2 H 2.276 0.030 2 1110 107 107 PRO HB3 H 1.952 0.030 2 1111 107 107 PRO HG2 H 2.000 0.030 1 1112 107 107 PRO HG3 H 2.000 0.030 1 1113 107 107 PRO HD2 H 3.608 0.030 1 1114 107 107 PRO HD3 H 3.608 0.030 1 1115 107 107 PRO C C 177.408 0.300 1 1116 107 107 PRO CA C 63.264 0.300 1 1117 107 107 PRO CB C 32.156 0.300 1 1118 107 107 PRO CG C 27.143 0.300 1 1119 107 107 PRO CD C 49.783 0.300 1 1120 108 108 SER H H 8.501 0.030 1 1121 108 108 SER HA H 4.493 0.030 1 1122 108 108 SER HB2 H 3.894 0.030 1 1123 108 108 SER HB3 H 3.894 0.030 1 1124 108 108 SER C C 174.615 0.300 1 1125 108 108 SER CA C 58.433 0.300 1 1126 108 108 SER CB C 63.780 0.300 1 1127 108 108 SER N N 116.329 0.300 1 1128 109 109 SER H H 8.293 0.030 1 1129 109 109 SER HA H 4.484 0.030 1 1130 109 109 SER HB2 H 3.875 0.030 1 1131 109 109 SER HB3 H 3.875 0.030 1 1132 109 109 SER C C 173.870 0.300 1 1133 109 109 SER CA C 58.432 0.300 1 1134 109 109 SER CB C 64.075 0.300 1 1135 109 109 SER N N 117.780 0.300 1 1136 110 110 GLY H H 8.024 0.030 1 1137 110 110 GLY HA2 H 3.739 0.030 2 1138 110 110 GLY HA3 H 3.781 0.030 2 1139 110 110 GLY C C 178.962 0.300 1 1140 110 110 GLY CA C 46.253 0.300 1 1141 110 110 GLY N N 116.756 0.300 1 stop_ save_