data_10283 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the first homeobox domain of AT-binding transcription factor 1 (ATBF1) ; _BMRB_accession_number 10283 _BMRB_flat_file_name bmr10283.str _Entry_type new _Submission_date 2008-12-17 _Accession_date 2008-12-18 _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 Ohnishi S. . . 2 Kigawa T. . . 3 Tomizawa T. . . 4 Koshiba S. . . 5 Inoue M. . . 6 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" 384 "13C chemical shifts" 294 "15N chemical shifts" 66 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-12-17 original author . stop_ save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Solution structure of the first homeobox domain of AT-binding transcription factor 1 (ATBF1) ; _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 Ohnishi S. . . 2 Kigawa T. . . 3 Tomizawa T. . . 4 Koshiba S. . . 5 Inoue M. . . 6 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 'Alpha-fetoprotein enhancer binding protein' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'The first homeobox domain' $entity_1 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'The first homeobox domain' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 70 _Mol_residue_sequence ; GSSGSSGKRPRTRITDDQLR VLRQYFDINNSPSEEQIKEM ADKSGLPQKVIKHWFRNTLF KERQSGPSSG ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 SER 4 GLY 5 SER 6 SER 7 GLY 8 LYS 9 ARG 10 PRO 11 ARG 12 THR 13 ARG 14 ILE 15 THR 16 ASP 17 ASP 18 GLN 19 LEU 20 ARG 21 VAL 22 LEU 23 ARG 24 GLN 25 TYR 26 PHE 27 ASP 28 ILE 29 ASN 30 ASN 31 SER 32 PRO 33 SER 34 GLU 35 GLU 36 GLN 37 ILE 38 LYS 39 GLU 40 MET 41 ALA 42 ASP 43 LYS 44 SER 45 GLY 46 LEU 47 PRO 48 GLN 49 LYS 50 VAL 51 ILE 52 LYS 53 HIS 54 TRP 55 PHE 56 ARG 57 ASN 58 THR 59 LEU 60 PHE 61 LYS 62 GLU 63 ARG 64 GLN 65 SER 66 GLY 67 PRO 68 SER 69 SER 70 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-06-23 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 2DA1 "Solution Structure Of The First Homeobox Domain Of At- Binding Transcription Factor 1 (Atbf1)" 100.00 70 100.00 100.00 1.53e-42 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 P050322-08 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 1.2 mM '[U-13C; U-15N]' d-TrisHCl 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 3.5 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task collection stop_ _Details . save_ save_software_2 _Saveframe_category software _Name NMRPipe _Version 20030801 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 0.932 loop_ _Vendor _Address _Electronic_address 'Kobayashi, N.' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_5 _Saveframe_category software _Name CYANA _Version 2.0.17 loop_ _Vendor _Address _Electronic_address 'Guntert, P.' . . stop_ loop_ _Task 'structure solution' refinement 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_13C-separated_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-separated NOESY' _Sample_label $sample_1 save_ save_3D_15N-separated_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-separated NOESY' _Sample_label $sample_1 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 296 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 H 1 'methyl protons' ppm 0.0 . indirect . . . 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_chemical_shift_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D 13C-separated NOESY' '3D 15N-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 'The first homeobox domain' _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 H H 8.499 0.030 1 2 7 7 GLY HA2 H 3.948 0.030 1 3 7 7 GLY HA3 H 3.948 0.030 1 4 7 7 GLY C C 173.949 0.300 1 5 7 7 GLY CA C 45.325 0.300 1 6 8 8 LYS H H 8.116 0.030 1 7 8 8 LYS HA H 4.308 0.030 1 8 8 8 LYS HB2 H 1.786 0.030 2 9 8 8 LYS HB3 H 1.706 0.030 2 10 8 8 LYS HD2 H 1.647 0.030 2 11 8 8 LYS HE2 H 2.969 0.030 2 12 8 8 LYS HG2 H 1.358 0.030 2 13 8 8 LYS HG3 H 1.420 0.030 2 14 8 8 LYS C C 176.504 0.300 1 15 8 8 LYS CA C 56.113 0.300 1 16 8 8 LYS CB C 33.151 0.300 1 17 8 8 LYS CD C 29.031 0.300 1 18 8 8 LYS CE C 42.214 0.300 1 19 8 8 LYS CG C 24.830 0.300 1 20 8 8 LYS N N 120.734 0.300 1 21 9 9 ARG H H 8.362 0.030 1 22 9 9 ARG HA H 4.590 0.030 1 23 9 9 ARG HB2 H 1.814 0.030 2 24 9 9 ARG HB3 H 1.718 0.030 2 25 9 9 ARG HD2 H 3.177 0.030 2 26 9 9 ARG HG2 H 1.646 0.030 2 27 9 9 ARG C C 176.479 0.300 1 28 9 9 ARG CA C 53.962 0.300 1 29 9 9 ARG CB C 30.103 0.300 1 30 9 9 ARG CD C 43.361 0.300 1 31 9 9 ARG CG C 26.751 0.300 1 32 9 9 ARG N N 123.609 0.300 1 33 10 10 PRO HA H 4.419 0.030 1 34 10 10 PRO HB2 H 1.871 0.030 2 35 10 10 PRO HB3 H 2.285 0.030 2 36 10 10 PRO HD2 H 3.597 0.030 2 37 10 10 PRO HD3 H 3.777 0.030 2 38 10 10 PRO HG2 H 1.988 0.030 2 39 10 10 PRO C C 176.796 0.300 1 40 10 10 PRO CA C 62.987 0.300 1 41 10 10 PRO CB C 32.080 0.300 1 42 10 10 PRO CD C 50.700 0.300 1 43 10 10 PRO CG C 27.384 0.300 1 44 11 11 ARG H H 8.517 0.030 1 45 11 11 ARG C C 176.551 0.300 1 46 11 11 ARG CA C 56.077 0.300 1 47 11 11 ARG CB C 30.762 0.300 1 48 11 11 ARG N N 121.931 0.300 1 49 12 12 THR HA H 4.260 0.030 1 50 12 12 THR HB H 4.093 0.030 1 51 12 12 THR HG2 H 1.180 0.030 1 52 12 12 THR C C 173.904 0.300 1 53 12 12 THR CA C 62.218 0.300 1 54 12 12 THR CB C 69.843 0.300 1 55 12 12 THR CG2 C 21.699 0.300 1 56 13 13 ARG H H 8.434 0.030 1 57 13 13 ARG HA H 4.381 0.030 1 58 13 13 ARG HB2 H 1.762 0.030 2 59 13 13 ARG HB3 H 1.825 0.030 2 60 13 13 ARG HD2 H 3.185 0.030 2 61 13 13 ARG HG2 H 1.592 0.030 2 62 13 13 ARG HG3 H 1.553 0.030 2 63 13 13 ARG C C 175.336 0.300 1 64 13 13 ARG CA C 55.972 0.300 1 65 13 13 ARG CB C 31.059 0.300 1 66 13 13 ARG CD C 43.367 0.300 1 67 13 13 ARG CG C 27.054 0.300 1 68 13 13 ARG N N 125.368 0.300 1 69 14 14 ILE H H 8.179 0.030 1 70 14 14 ILE HA H 4.268 0.030 1 71 14 14 ILE HB H 1.703 0.030 1 72 14 14 ILE HD1 H 0.661 0.030 1 73 14 14 ILE HG12 H 1.562 0.030 2 74 14 14 ILE HG13 H 0.870 0.030 2 75 14 14 ILE HG2 H 0.810 0.030 1 76 14 14 ILE C C 176.844 0.300 1 77 14 14 ILE CA C 61.647 0.300 1 78 14 14 ILE CB C 39.248 0.300 1 79 14 14 ILE CD1 C 13.212 0.300 1 80 14 14 ILE CG1 C 27.466 0.300 1 81 14 14 ILE CG2 C 18.073 0.300 1 82 14 14 ILE N N 123.951 0.300 1 83 15 15 THR H H 8.922 0.030 1 84 15 15 THR HA H 4.386 0.030 1 85 15 15 THR HB H 4.706 0.030 1 86 15 15 THR HG2 H 1.250 0.030 1 87 15 15 THR C C 175.263 0.300 1 88 15 15 THR CA C 61.402 0.300 1 89 15 15 THR CB C 70.796 0.300 1 90 15 15 THR CG2 C 21.534 0.300 1 91 15 15 THR N N 119.222 0.300 1 92 16 16 ASP H H 8.951 0.030 1 93 16 16 ASP HA H 4.353 0.030 1 94 16 16 ASP HB2 H 2.658 0.030 1 95 16 16 ASP HB3 H 2.658 0.030 1 96 16 16 ASP C C 178.888 0.300 1 97 16 16 ASP CA C 58.016 0.300 1 98 16 16 ASP CB C 40.154 0.300 1 99 16 16 ASP N N 120.852 0.300 1 100 17 17 ASP H H 8.387 0.030 1 101 17 17 ASP HA H 4.361 0.030 1 102 17 17 ASP HB2 H 2.510 0.030 2 103 17 17 ASP HB3 H 2.602 0.030 2 104 17 17 ASP C C 178.815 0.300 1 105 17 17 ASP CA C 57.311 0.300 1 106 17 17 ASP CB C 40.649 0.300 1 107 17 17 ASP N N 118.488 0.300 1 108 18 18 GLN H H 7.561 0.030 1 109 18 18 GLN HA H 3.844 0.030 1 110 18 18 GLN HB2 H 2.468 0.030 2 111 18 18 GLN HB3 H 1.519 0.030 2 112 18 18 GLN HE21 H 6.633 0.030 2 113 18 18 GLN HE22 H 7.426 0.030 2 114 18 18 GLN HG2 H 2.497 0.030 2 115 18 18 GLN HG3 H 2.552 0.030 2 116 18 18 GLN C C 177.988 0.300 1 117 18 18 GLN CA C 58.933 0.300 1 118 18 18 GLN CB C 28.702 0.300 1 119 18 18 GLN CG C 34.634 0.300 1 120 18 18 GLN N N 119.852 0.300 1 121 18 18 GLN NE2 N 109.816 0.300 1 122 19 19 LEU H H 8.538 0.030 1 123 19 19 LEU HA H 3.549 0.030 1 124 19 19 LEU HB2 H 1.617 0.030 1 125 19 19 LEU HB3 H 1.617 0.030 1 126 19 19 LEU HD1 H 0.879 0.030 1 127 19 19 LEU HD2 H 0.807 0.030 1 128 19 19 LEU HG H 1.519 0.030 1 129 19 19 LEU C C 178.202 0.300 1 130 19 19 LEU CA C 57.593 0.300 1 131 19 19 LEU CB C 41.720 0.300 1 132 19 19 LEU CD1 C 24.542 0.300 2 133 19 19 LEU CD2 C 24.521 0.300 2 134 19 19 LEU CG C 26.437 0.300 1 135 19 19 LEU N N 120.203 0.300 1 136 20 20 ARG H H 7.644 0.030 1 137 20 20 ARG HA H 3.893 0.030 1 138 20 20 ARG HB2 H 1.925 0.030 1 139 20 20 ARG HB3 H 1.925 0.030 1 140 20 20 ARG HD2 H 3.227 0.030 2 141 20 20 ARG HG2 H 1.550 0.030 2 142 20 20 ARG HG3 H 1.768 0.030 2 143 20 20 ARG C C 179.148 0.300 1 144 20 20 ARG CA C 59.744 0.300 1 145 20 20 ARG CB C 29.855 0.300 1 146 20 20 ARG CD C 43.367 0.300 1 147 20 20 ARG CG C 27.833 0.300 1 148 20 20 ARG N N 117.442 0.300 1 149 21 21 VAL H H 7.074 0.030 1 150 21 21 VAL HA H 3.726 0.030 1 151 21 21 VAL HB H 2.189 0.030 1 152 21 21 VAL HG1 H 0.951 0.030 1 153 21 21 VAL HG2 H 1.030 0.030 1 154 21 21 VAL C C 177.643 0.300 1 155 21 21 VAL CA C 66.098 0.300 1 156 21 21 VAL CB C 31.750 0.300 1 157 21 21 VAL CG1 C 21.398 0.300 2 158 21 21 VAL CG2 C 22.393 0.300 2 159 21 21 VAL N N 118.796 0.300 1 160 22 22 LEU H H 7.620 0.030 1 161 22 22 LEU HA H 3.947 0.030 1 162 22 22 LEU HB2 H 0.184 0.030 2 163 22 22 LEU HB3 H 0.789 0.030 2 164 22 22 LEU HD1 H -0.024 0.030 1 165 22 22 LEU HD2 H 0.581 0.030 1 166 22 22 LEU HG H 1.486 0.030 1 167 22 22 LEU C C 178.979 0.300 1 168 22 22 LEU CA C 58.369 0.300 1 169 22 22 LEU CB C 38.869 0.300 1 170 22 22 LEU CD1 C 24.066 0.300 2 171 22 22 LEU CD2 C 23.055 0.300 2 172 22 22 LEU CG C 26.676 0.300 1 173 22 22 LEU N N 119.184 0.300 1 174 23 23 ARG H H 8.451 0.030 1 175 23 23 ARG HA H 4.054 0.030 1 176 23 23 ARG HB2 H 1.875 0.030 2 177 23 23 ARG HB3 H 1.970 0.030 2 178 23 23 ARG HD2 H 3.180 0.030 2 179 23 23 ARG HD3 H 3.232 0.030 2 180 23 23 ARG HG2 H 1.764 0.030 2 181 23 23 ARG HG3 H 1.844 0.030 2 182 23 23 ARG C C 178.177 0.300 1 183 23 23 ARG CA C 59.157 0.300 1 184 23 23 ARG CB C 29.772 0.300 1 185 23 23 ARG CD C 43.111 0.300 1 186 23 23 ARG CG C 27.301 0.300 1 187 23 23 ARG N N 116.571 0.300 1 188 24 24 GLN H H 7.749 0.030 1 189 24 24 GLN HA H 4.129 0.030 1 190 24 24 GLN HB2 H 2.265 0.030 2 191 24 24 GLN HB3 H 2.146 0.030 2 192 24 24 GLN HE21 H 6.728 0.030 2 193 24 24 GLN HE22 H 7.279 0.030 2 194 24 24 GLN HG2 H 2.508 0.030 2 195 24 24 GLN HG3 H 2.242 0.030 2 196 24 24 GLN C C 179.100 0.300 1 197 24 24 GLN CA C 58.827 0.300 1 198 24 24 GLN CB C 28.290 0.300 1 199 24 24 GLN CG C 34.063 0.300 1 200 24 24 GLN N N 118.256 0.300 1 201 24 24 GLN NE2 N 110.739 0.300 1 202 25 25 TYR H H 7.902 0.030 1 203 25 25 TYR HA H 4.295 0.030 1 204 25 25 TYR HB2 H 3.517 0.030 2 205 25 25 TYR HB3 H 3.304 0.030 2 206 25 25 TYR HD1 H 7.372 0.030 1 207 25 25 TYR HD2 H 7.372 0.030 1 208 25 25 TYR HE1 H 6.721 0.030 1 209 25 25 TYR HE2 H 6.721 0.030 1 210 25 25 TYR C C 178.080 0.300 1 211 25 25 TYR CA C 61.506 0.300 1 212 25 25 TYR CB C 39.001 0.300 1 213 25 25 TYR CD1 C 133.291 0.300 1 214 25 25 TYR CD2 C 133.291 0.300 1 215 25 25 TYR CE1 C 117.574 0.300 1 216 25 25 TYR CE2 C 117.574 0.300 1 217 25 25 TYR N N 117.374 0.300 1 218 26 26 PHE H H 8.935 0.030 1 219 26 26 PHE HA H 4.366 0.030 1 220 26 26 PHE HB2 H 3.305 0.030 2 221 26 26 PHE HB3 H 3.202 0.030 2 222 26 26 PHE HD1 H 7.131 0.030 1 223 26 26 PHE HD2 H 7.131 0.030 1 224 26 26 PHE HE1 H 7.235 0.030 1 225 26 26 PHE HE2 H 7.235 0.030 1 226 26 26 PHE HZ H 6.978 0.030 1 227 26 26 PHE C C 175.847 0.300 1 228 26 26 PHE CA C 61.452 0.300 1 229 26 26 PHE CB C 39.538 0.300 1 230 26 26 PHE CD1 C 132.197 0.300 1 231 26 26 PHE CD2 C 132.197 0.300 1 232 26 26 PHE CE1 C 131.160 0.300 1 233 26 26 PHE CE2 C 131.160 0.300 1 234 26 26 PHE CZ C 129.421 0.300 1 235 27 27 ASP H H 8.138 0.030 1 236 27 27 ASP HA H 4.407 0.030 1 237 27 27 ASP HB2 H 2.711 0.030 1 238 27 27 ASP HB3 H 2.711 0.030 1 239 27 27 ASP C C 177.546 0.300 1 240 27 27 ASP CA C 56.007 0.300 1 241 27 27 ASP CB C 40.813 0.300 1 242 27 27 ASP N N 116.760 0.300 1 243 28 28 ILE H H 7.463 0.030 1 244 28 28 ILE HA H 3.945 0.030 1 245 28 28 ILE HB H 1.945 0.030 1 246 28 28 ILE HD1 H 0.762 0.030 1 247 28 28 ILE HG12 H 1.159 0.030 2 248 28 28 ILE HG13 H 1.589 0.030 2 249 28 28 ILE HG2 H 0.888 0.030 1 250 28 28 ILE C C 176.260 0.300 1 251 28 28 ILE CA C 62.881 0.300 1 252 28 28 ILE CB C 38.836 0.300 1 253 28 28 ILE CD1 C 13.221 0.300 1 254 28 28 ILE CG1 C 28.058 0.300 1 255 28 28 ILE CG2 C 17.420 0.300 1 256 28 28 ILE N N 119.169 0.300 1 257 29 29 ASN H H 8.214 0.030 1 258 29 29 ASN HA H 4.620 0.030 1 259 29 29 ASN HB2 H 2.788 0.030 1 260 29 29 ASN HB3 H 2.788 0.030 1 261 29 29 ASN HD21 H 7.580 0.030 2 262 29 29 ASN HD22 H 6.567 0.030 2 263 29 29 ASN C C 173.633 0.300 1 264 29 29 ASN CA C 53.081 0.300 1 265 29 29 ASN CB C 39.330 0.300 1 266 29 29 ASN N N 117.989 0.300 1 267 29 29 ASN ND2 N 111.646 0.300 1 268 30 30 ASN H H 8.383 0.030 1 269 30 30 ASN HA H 4.231 0.030 1 270 30 30 ASN HB2 H 2.611 0.030 2 271 30 30 ASN HB3 H 2.219 0.030 2 272 30 30 ASN HD21 H 7.233 0.030 2 273 30 30 ASN HD22 H 6.733 0.030 2 274 30 30 ASN C C 174.338 0.300 1 275 30 30 ASN CA C 53.610 0.300 1 276 30 30 ASN CB C 38.836 0.300 1 277 30 30 ASN N N 120.522 0.300 1 278 30 30 ASN ND2 N 113.572 0.300 1 279 31 31 SER H H 7.941 0.030 1 280 31 31 SER HA H 4.795 0.030 1 281 31 31 SER HB2 H 3.666 0.030 2 282 31 31 SER HB3 H 3.828 0.030 2 283 31 31 SER C C 174.387 0.300 1 284 31 31 SER CA C 54.843 0.300 1 285 31 31 SER CB C 63.553 0.300 1 286 31 31 SER N N 112.907 0.300 1 287 32 32 PRO HA H 4.437 0.030 1 288 32 32 PRO HB2 H 1.592 0.030 2 289 32 32 PRO HB3 H 1.826 0.030 2 290 32 32 PRO HD2 H 3.252 0.030 2 291 32 32 PRO HD3 H 3.317 0.030 2 292 32 32 PRO HG2 H 1.129 0.030 2 293 32 32 PRO HG3 H 0.496 0.030 2 294 32 32 PRO C C 176.844 0.300 1 295 32 32 PRO CA C 62.180 0.300 1 296 32 32 PRO CB C 32.380 0.300 1 297 32 32 PRO CD C 50.947 0.300 1 298 32 32 PRO CG C 26.052 0.300 1 299 33 33 SER H H 8.658 0.030 1 300 33 33 SER HA H 4.462 0.030 1 301 33 33 SER HB2 H 3.986 0.030 2 302 33 33 SER HB3 H 4.409 0.030 2 303 33 33 SER C C 175.068 0.300 1 304 33 33 SER CA C 56.539 0.300 1 305 33 33 SER CB C 65.613 0.300 1 306 33 33 SER N N 117.201 0.300 1 307 34 34 GLU H H 8.983 0.030 1 308 34 34 GLU HA H 3.885 0.030 1 309 34 34 GLU HB2 H 2.008 0.030 1 310 34 34 GLU HB3 H 2.008 0.030 1 311 34 34 GLU HG2 H 2.361 0.030 2 312 34 34 GLU HG3 H 2.304 0.030 2 313 34 34 GLU C C 179.464 0.300 1 314 34 34 GLU CA C 59.990 0.300 1 315 34 34 GLU CB C 29.031 0.300 1 316 34 34 GLU CG C 36.199 0.300 1 317 34 34 GLU N N 120.557 0.300 1 318 35 35 GLU H H 8.672 0.030 1 319 35 35 GLU HA H 3.989 0.030 1 320 35 35 GLU HB2 H 1.951 0.030 2 321 35 35 GLU HB3 H 2.009 0.030 2 322 35 35 GLU HG2 H 2.372 0.030 2 323 35 35 GLU HG3 H 2.283 0.030 2 324 35 35 GLU C C 179.440 0.300 1 325 35 35 GLU CA C 60.096 0.300 1 326 35 35 GLU CB C 28.949 0.300 1 327 35 35 GLU CG C 36.859 0.300 1 328 35 35 GLU N N 119.112 0.300 1 329 36 36 GLN H H 7.705 0.030 1 330 36 36 GLN HA H 4.012 0.030 1 331 36 36 GLN HB2 H 1.756 0.030 2 332 36 36 GLN HB3 H 2.309 0.030 2 333 36 36 GLN HE21 H 6.857 0.030 2 334 36 36 GLN HE22 H 7.633 0.030 2 335 36 36 GLN HG2 H 2.453 0.030 2 336 36 36 GLN C C 178.372 0.300 1 337 36 36 GLN CA C 58.968 0.300 1 338 36 36 GLN CB C 28.290 0.300 1 339 36 36 GLN CG C 35.211 0.300 1 340 36 36 GLN N N 120.638 0.300 1 341 36 36 GLN NE2 N 111.502 0.300 1 342 37 37 ILE H H 8.308 0.030 1 343 37 37 ILE HA H 3.474 0.030 1 344 37 37 ILE HB H 1.991 0.030 1 345 37 37 ILE HD1 H 0.554 0.030 1 346 37 37 ILE HG12 H 1.429 0.030 2 347 37 37 ILE HG13 H 0.820 0.030 2 348 37 37 ILE HG2 H 0.813 0.030 1 349 37 37 ILE C C 177.400 0.300 1 350 37 37 ILE CA C 65.173 0.300 1 351 37 37 ILE CB C 36.447 0.300 1 352 37 37 ILE CD1 C 12.274 0.300 1 353 37 37 ILE CG1 C 28.867 0.300 1 354 37 37 ILE CG2 C 17.431 0.300 1 355 37 37 ILE N N 121.515 0.300 1 356 38 38 LYS H H 7.808 0.030 1 357 38 38 LYS HA H 3.803 0.030 1 358 38 38 LYS HB2 H 1.983 0.030 2 359 38 38 LYS HB3 H 1.862 0.030 2 360 38 38 LYS HD2 H 1.605 0.030 2 361 38 38 LYS HD3 H 1.719 0.030 2 362 38 38 LYS HE2 H 2.968 0.030 2 363 38 38 LYS HG2 H 1.463 0.030 2 364 38 38 LYS HG3 H 1.371 0.030 2 365 38 38 LYS C C 178.153 0.300 1 366 38 38 LYS CA C 60.096 0.300 1 367 38 38 LYS CB C 31.833 0.300 1 368 38 38 LYS CD C 28.819 0.300 1 369 38 38 LYS CE C 42.379 0.300 1 370 38 38 LYS CG C 25.196 0.300 1 371 38 38 LYS N N 120.672 0.300 1 372 39 39 GLU H H 7.719 0.030 1 373 39 39 GLU HA H 4.089 0.030 1 374 39 39 GLU HB2 H 2.192 0.030 2 375 39 39 GLU HB3 H 2.106 0.030 2 376 39 39 GLU HG2 H 2.461 0.030 2 377 39 39 GLU HG3 H 2.194 0.030 2 378 39 39 GLU C C 179.278 0.300 1 379 39 39 GLU CA C 59.522 0.300 1 380 39 39 GLU CB C 29.773 0.300 1 381 39 39 GLU CG C 36.246 0.300 1 382 39 39 GLU N N 119.510 0.300 1 383 40 40 MET H H 8.167 0.030 1 384 40 40 MET HA H 3.599 0.030 1 385 40 40 MET HB2 H 1.500 0.030 2 386 40 40 MET HB3 H 2.163 0.030 2 387 40 40 MET HE H 1.495 0.030 1 388 40 40 MET HG2 H 1.866 0.030 2 389 40 40 MET HG3 H 1.521 0.030 2 390 40 40 MET C C 179.813 0.300 1 391 40 40 MET CA C 59.533 0.300 1 392 40 40 MET CB C 35.410 0.300 1 393 40 40 MET CE C 18.305 0.300 1 394 40 40 MET CG C 32.657 0.300 1 395 40 40 MET N N 117.312 0.300 1 396 41 41 ALA H H 8.689 0.030 1 397 41 41 ALA HA H 4.102 0.030 1 398 41 41 ALA HB H 1.536 0.030 1 399 41 41 ALA C C 179.610 0.300 1 400 41 41 ALA CA C 55.866 0.300 1 401 41 41 ALA CB C 18.609 0.300 1 402 41 41 ALA N N 128.620 0.300 1 403 42 42 ASP H H 8.324 0.030 1 404 42 42 ASP HA H 4.306 0.030 1 405 42 42 ASP HB2 H 2.676 0.030 2 406 42 42 ASP HB3 H 2.842 0.030 2 407 42 42 ASP C C 179.003 0.300 1 408 42 42 ASP CA C 57.241 0.300 1 409 42 42 ASP CB C 40.319 0.300 1 410 42 42 ASP N N 120.159 0.300 1 411 43 43 LYS H H 8.036 0.030 1 412 43 43 LYS HA H 4.155 0.030 1 413 43 43 LYS HB2 H 1.874 0.030 2 414 43 43 LYS HB3 H 1.826 0.030 2 415 43 43 LYS HD2 H 1.676 0.030 2 416 43 43 LYS HD3 H 1.739 0.030 2 417 43 43 LYS HE2 H 2.994 0.030 2 418 43 43 LYS HG2 H 1.521 0.030 2 419 43 43 LYS HG3 H 1.664 0.030 2 420 43 43 LYS C C 178.105 0.300 1 421 43 43 LYS CA C 58.580 0.300 1 422 43 43 LYS CB C 33.893 0.300 1 423 43 43 LYS CD C 29.279 0.300 1 424 43 43 LYS CE C 42.296 0.300 1 425 43 43 LYS CG C 25.693 0.300 1 426 43 43 LYS N N 116.586 0.300 1 427 44 44 SER H H 8.314 0.030 1 428 44 44 SER HA H 4.486 0.030 1 429 44 44 SER HB2 H 3.790 0.030 1 430 44 44 SER HB3 H 3.790 0.030 1 431 44 44 SER C C 175.458 0.300 1 432 44 44 SER CA C 59.955 0.300 1 433 44 44 SER CB C 66.025 0.300 1 434 44 44 SER N N 111.140 0.300 1 435 45 45 GLY H H 8.249 0.030 1 436 45 45 GLY HA2 H 3.872 0.030 2 437 45 45 GLY HA3 H 4.233 0.030 2 438 45 45 GLY C C 174.317 0.300 1 439 45 45 GLY CA C 45.889 0.300 1 440 45 45 GLY N N 112.770 0.300 1 441 46 46 LEU H H 7.800 0.030 1 442 46 46 LEU HA H 4.685 0.030 1 443 46 46 LEU HB2 H 1.087 0.030 2 444 46 46 LEU HB3 H 1.631 0.030 2 445 46 46 LEU HD1 H 0.685 0.030 1 446 46 46 LEU HD2 H 0.911 0.030 1 447 46 46 LEU HG H 1.423 0.030 1 448 46 46 LEU C C 174.366 0.300 1 449 46 46 LEU CA C 52.235 0.300 1 450 46 46 LEU CB C 43.285 0.300 1 451 46 46 LEU CD1 C 26.235 0.300 2 452 46 46 LEU CD2 C 23.672 0.300 2 453 46 46 LEU CG C 26.914 0.300 1 454 46 46 LEU N N 121.722 0.300 1 455 47 47 PRO HA H 4.542 0.030 1 456 47 47 PRO HB2 H 2.600 0.030 2 457 47 47 PRO HB3 H 1.759 0.030 2 458 47 47 PRO HD2 H 3.322 0.030 2 459 47 47 PRO HD3 H 4.074 0.030 2 460 47 47 PRO HG2 H 2.145 0.030 2 461 47 47 PRO C C 178.542 0.300 1 462 47 47 PRO CA C 62.000 0.300 1 463 47 47 PRO CB C 32.731 0.300 1 464 47 47 PRO CD C 50.482 0.300 1 465 47 47 PRO CG C 28.043 0.300 1 466 48 48 GLN H H 9.124 0.030 1 467 48 48 GLN HA H 3.629 0.030 1 468 48 48 GLN HB2 H 2.030 0.030 2 469 48 48 GLN HB3 H 1.970 0.030 2 470 48 48 GLN HE21 H 6.989 0.030 2 471 48 48 GLN HE22 H 7.674 0.030 2 472 48 48 GLN HG2 H 2.497 0.030 2 473 48 48 GLN HG3 H 2.101 0.030 2 474 48 48 GLN C C 178.080 0.300 1 475 48 48 GLN CA C 60.872 0.300 1 476 48 48 GLN CB C 28.455 0.300 1 477 48 48 GLN CG C 35.128 0.300 1 478 48 48 GLN N N 123.862 0.300 1 479 48 48 GLN NE2 N 111.582 0.300 1 480 49 49 LYS H H 8.912 0.030 1 481 49 49 LYS HA H 3.969 0.030 1 482 49 49 LYS HB2 H 1.753 0.030 2 483 49 49 LYS HB3 H 1.889 0.030 2 484 49 49 LYS HD2 H 1.690 0.030 2 485 49 49 LYS HE2 H 2.957 0.030 2 486 49 49 LYS HG2 H 1.466 0.030 2 487 49 49 LYS HG3 H 1.379 0.030 2 488 49 49 LYS C C 178.954 0.300 1 489 49 49 LYS CA C 59.955 0.300 1 490 49 49 LYS CB C 32.327 0.300 1 491 49 49 LYS CD C 29.534 0.300 1 492 49 49 LYS CE C 42.049 0.300 1 493 49 49 LYS CG C 25.241 0.300 1 494 49 49 LYS N N 116.406 0.300 1 495 50 50 VAL H H 6.874 0.030 1 496 50 50 VAL HA H 3.835 0.030 1 497 50 50 VAL HB H 2.211 0.030 1 498 50 50 VAL HG1 H 1.012 0.030 1 499 50 50 VAL HG2 H 1.101 0.030 1 500 50 50 VAL C C 178.299 0.300 1 501 50 50 VAL CA C 65.560 0.300 1 502 50 50 VAL CB C 32.080 0.300 1 503 50 50 VAL CG1 C 21.253 0.300 2 504 50 50 VAL CG2 C 22.873 0.300 2 505 50 50 VAL N N 119.065 0.300 1 506 51 51 ILE H H 7.503 0.030 1 507 51 51 ILE HA H 3.672 0.030 1 508 51 51 ILE HB H 1.959 0.030 1 509 51 51 ILE HD1 H 0.694 0.030 1 510 51 51 ILE HG12 H 0.847 0.030 2 511 51 51 ILE HG13 H 1.636 0.030 2 512 51 51 ILE HG2 H 1.102 0.030 1 513 51 51 ILE C C 178.007 0.300 1 514 51 51 ILE CA C 66.019 0.300 1 515 51 51 ILE CB C 38.081 0.300 1 516 51 51 ILE CD1 C 13.437 0.300 1 517 51 51 ILE CG1 C 29.031 0.300 1 518 51 51 ILE CG2 C 19.227 0.300 1 519 51 51 ILE N N 121.254 0.300 1 520 52 52 LYS H H 8.596 0.030 1 521 52 52 LYS HA H 3.984 0.030 1 522 52 52 LYS HB2 H 1.937 0.030 2 523 52 52 LYS HB3 H 1.869 0.030 2 524 52 52 LYS HD2 H 1.679 0.030 2 525 52 52 LYS HE2 H 2.901 0.030 2 526 52 52 LYS HG2 H 1.403 0.030 2 527 52 52 LYS HG3 H 1.587 0.030 2 528 52 52 LYS C C 179.302 0.300 1 529 52 52 LYS CA C 60.978 0.300 1 530 52 52 LYS CB C 32.574 0.300 1 531 52 52 LYS CD C 29.728 0.300 1 532 52 52 LYS CE C 42.049 0.300 1 533 52 52 LYS CG C 26.455 0.300 1 534 52 52 LYS N N 118.531 0.300 1 535 53 53 HIS H H 7.952 0.030 1 536 53 53 HIS HA H 4.324 0.030 1 537 53 53 HIS HB2 H 3.285 0.030 1 538 53 53 HIS HB3 H 3.285 0.030 1 539 53 53 HIS HD2 H 7.027 0.030 1 540 53 53 HIS HE1 H 7.702 0.030 1 541 53 53 HIS C C 177.085 0.300 1 542 53 53 HIS CA C 60.026 0.300 1 543 53 53 HIS CB C 30.867 0.300 1 544 53 53 HIS CD2 C 119.335 0.300 1 545 53 53 HIS CE1 C 138.458 0.300 1 546 53 53 HIS N N 118.728 0.300 1 547 54 54 TRP H H 8.614 0.030 1 548 54 54 TRP HA H 4.048 0.030 1 549 54 54 TRP HB2 H 3.556 0.030 2 550 54 54 TRP HB3 H 3.267 0.030 2 551 54 54 TRP HD1 H 7.099 0.030 1 552 54 54 TRP HE1 H 9.600 0.030 1 553 54 54 TRP HE3 H 6.860 0.030 1 554 54 54 TRP HH2 H 6.318 0.030 1 555 54 54 TRP HZ2 H 7.042 0.030 1 556 54 54 TRP HZ3 H 5.867 0.030 1 557 54 54 TRP C C 180.144 0.300 1 558 54 54 TRP CA C 62.916 0.300 1 559 54 54 TRP CB C 28.766 0.300 1 560 54 54 TRP CD1 C 126.682 0.300 1 561 54 54 TRP CE3 C 120.280 0.300 1 562 54 54 TRP CH2 C 122.570 0.300 1 563 54 54 TRP CZ2 C 114.295 0.300 1 564 54 54 TRP CZ3 C 120.967 0.300 1 565 54 54 TRP N N 121.845 0.300 1 566 54 54 TRP NE1 N 128.914 0.300 1 567 55 55 PHE H H 9.035 0.030 1 568 55 55 PHE HA H 3.786 0.030 1 569 55 55 PHE HB2 H 3.313 0.030 2 570 55 55 PHE HB3 H 3.362 0.030 2 571 55 55 PHE HD1 H 7.823 0.030 1 572 55 55 PHE HD2 H 7.823 0.030 1 573 55 55 PHE HE1 H 7.630 0.030 1 574 55 55 PHE HE2 H 7.630 0.030 1 575 55 55 PHE HZ H 7.525 0.030 1 576 55 55 PHE C C 178.129 0.300 1 577 55 55 PHE CA C 63.617 0.300 1 578 55 55 PHE CB C 39.260 0.300 1 579 55 55 PHE CD1 C 132.128 0.300 1 580 55 55 PHE CD2 C 132.128 0.300 1 581 55 55 PHE CE1 C 132.128 0.300 1 582 55 55 PHE CE2 C 132.128 0.300 1 583 55 55 PHE CZ C 130.249 0.300 1 584 55 55 PHE N N 120.180 0.300 1 585 56 56 ARG H H 7.962 0.030 1 586 56 56 ARG HA H 4.095 0.030 1 587 56 56 ARG HB2 H 1.957 0.030 2 588 56 56 ARG HB3 H 1.909 0.030 2 589 56 56 ARG HD2 H 3.182 0.030 2 590 56 56 ARG HG2 H 1.768 0.030 2 591 56 56 ARG HG3 H 1.592 0.030 2 592 56 56 ARG C C 178.444 0.300 1 593 56 56 ARG CA C 59.356 0.300 1 594 56 56 ARG CB C 30.087 0.300 1 595 56 56 ARG CD C 43.437 0.300 1 596 56 56 ARG CG C 27.209 0.300 1 597 56 56 ARG N N 118.370 0.300 1 598 57 57 ASN H H 8.194 0.030 1 599 57 57 ASN HA H 4.401 0.030 1 600 57 57 ASN HB2 H 2.503 0.030 2 601 57 57 ASN HB3 H 2.465 0.030 2 602 57 57 ASN HD21 H 7.357 0.030 2 603 57 57 ASN HD22 H 6.633 0.030 2 604 57 57 ASN C C 176.866 0.300 1 605 57 57 ASN CA C 55.497 0.300 1 606 57 57 ASN CB C 38.640 0.300 1 607 57 57 ASN N N 117.190 0.300 1 608 57 57 ASN ND2 N 112.666 0.300 1 609 58 58 THR H H 7.999 0.030 1 610 58 58 THR HA H 3.426 0.030 1 611 58 58 THR HB H 2.984 0.030 1 612 58 58 THR HG2 H 0.040 0.030 1 613 58 58 THR C C 175.361 0.300 1 614 58 58 THR CA C 65.801 0.300 1 615 58 58 THR CB C 68.064 0.300 1 616 58 58 THR CG2 C 20.428 0.300 1 617 58 58 THR N N 117.859 0.300 1 618 59 59 LEU H H 7.950 0.030 1 619 59 59 LEU HA H 4.127 0.030 1 620 59 59 LEU HB2 H 1.689 0.030 1 621 59 59 LEU HD1 H 0.943 0.030 1 622 59 59 LEU HD2 H 0.866 0.030 1 623 59 59 LEU HG H 1.553 0.030 1 624 59 59 LEU C C 177.886 0.300 1 625 59 59 LEU CA C 57.628 0.300 1 626 59 59 LEU CB C 42.296 0.300 1 627 59 59 LEU CD1 C 24.461 0.300 2 628 59 59 LEU CD2 C 24.791 0.300 2 629 59 59 LEU CG C 27.136 0.300 1 630 59 59 LEU N N 122.280 0.300 1 631 60 60 PHE H H 7.797 0.030 1 632 60 60 PHE HA H 4.309 0.030 1 633 60 60 PHE HB2 H 3.122 0.030 1 634 60 60 PHE HB3 H 3.122 0.030 1 635 60 60 PHE HD1 H 7.200 0.030 1 636 60 60 PHE HD2 H 7.200 0.030 1 637 60 60 PHE HE1 H 7.279 0.030 1 638 60 60 PHE HE2 H 7.279 0.030 1 639 60 60 PHE HZ H 7.225 0.030 1 640 60 60 PHE C C 177.085 0.300 1 641 60 60 PHE CA C 59.920 0.300 1 642 60 60 PHE CB C 38.918 0.300 1 643 60 60 PHE CD1 C 131.616 0.300 1 644 60 60 PHE CD2 C 131.616 0.300 1 645 60 60 PHE CE1 C 131.419 0.300 1 646 60 60 PHE CE2 C 131.419 0.300 1 647 60 60 PHE CZ C 129.804 0.300 1 648 60 60 PHE N N 118.008 0.300 1 649 61 61 LYS H H 7.839 0.030 1 650 61 61 LYS HA H 4.007 0.030 1 651 61 61 LYS HB2 H 1.796 0.030 1 652 61 61 LYS HB3 H 1.796 0.030 1 653 61 61 LYS HD2 H 1.605 0.030 2 654 61 61 LYS HE2 H 2.905 0.030 2 655 61 61 LYS HG2 H 1.468 0.030 2 656 61 61 LYS HG3 H 1.388 0.030 2 657 61 61 LYS C C 178.032 0.300 1 658 61 61 LYS CA C 58.016 0.300 1 659 61 61 LYS CB C 32.657 0.300 1 660 61 61 LYS CD C 29.031 0.300 1 661 61 61 LYS CE C 42.049 0.300 1 662 61 61 LYS CG C 24.912 0.300 1 663 61 61 LYS N N 119.447 0.300 1 664 62 62 GLU H H 8.139 0.030 1 665 62 62 GLU HA H 4.146 0.030 1 666 62 62 GLU HB2 H 2.128 0.030 2 667 62 62 GLU HB3 H 1.987 0.030 2 668 62 62 GLU HG2 H 2.224 0.030 2 669 62 62 GLU HG3 H 2.336 0.030 2 670 62 62 GLU C C 177.595 0.300 1 671 62 62 GLU CA C 57.699 0.300 1 672 62 62 GLU CB C 29.608 0.300 1 673 62 62 GLU CG C 36.529 0.300 1 674 62 62 GLU N N 119.302 0.300 1 675 63 63 ARG H H 8.015 0.030 1 676 63 63 ARG HA H 4.258 0.030 1 677 63 63 ARG HB2 H 1.856 0.030 2 678 63 63 ARG HB3 H 1.789 0.030 2 679 63 63 ARG HD2 H 3.118 0.030 2 680 63 63 ARG HG2 H 1.675 0.030 2 681 63 63 ARG HG3 H 1.610 0.030 2 682 63 63 ARG C C 176.769 0.300 1 683 63 63 ARG CA C 56.677 0.300 1 684 63 63 ARG CB C 30.514 0.300 1 685 63 63 ARG CD C 43.450 0.300 1 686 63 63 ARG CG C 27.301 0.300 1 687 63 63 ARG N N 119.598 0.300 1 688 64 64 GLN H H 8.058 0.030 1 689 64 64 GLN HA H 4.242 0.030 1 690 64 64 GLN HB2 H 2.070 0.030 2 691 64 64 GLN HB3 H 1.931 0.030 2 692 64 64 GLN HE21 H 6.775 0.030 2 693 64 64 GLN HE22 H 7.342 0.030 2 694 64 64 GLN HG2 H 2.259 0.030 2 695 64 64 GLN C C 176.114 0.300 1 696 64 64 GLN CA C 56.148 0.300 1 697 64 64 GLN CB C 29.258 0.300 1 698 64 64 GLN CG C 33.810 0.300 1 699 64 64 GLN N N 120.027 0.300 1 700 64 64 GLN NE2 N 112.666 0.300 1 701 65 65 SER H H 8.172 0.030 1 702 65 65 SER HA H 4.457 0.030 1 703 65 65 SER HB2 H 3.846 0.030 1 704 65 65 SER HB3 H 3.846 0.030 1 705 65 65 SER C C 174.487 0.300 1 706 65 65 SER CA C 58.404 0.300 1 707 65 65 SER CB C 63.965 0.300 1 708 65 65 SER N N 116.070 0.300 1 709 66 66 GLY H H 8.170 0.030 1 710 66 66 GLY HA2 H 4.141 0.030 2 711 66 66 GLY HA3 H 4.082 0.030 2 712 66 66 GLY C C 171.768 0.300 1 713 66 66 GLY CA C 44.620 0.300 1 714 66 66 GLY N N 110.579 0.300 1 715 67 67 PRO HA H 4.453 0.030 1 716 67 67 PRO HB2 H 1.957 0.030 2 717 67 67 PRO HB3 H 2.279 0.030 2 718 67 67 PRO HD2 H 3.607 0.030 2 719 67 67 PRO HG2 H 1.992 0.030 2 720 67 67 PRO C C 177.400 0.300 1 721 67 67 PRO CA C 63.198 0.300 1 722 67 67 PRO CB C 32.171 0.300 1 723 67 67 PRO CD C 49.768 0.300 1 724 67 67 PRO CG C 27.196 0.300 1 725 68 68 SER H H 8.525 0.030 1 726 68 68 SER HA H 4.490 0.030 1 727 68 68 SER HB2 H 3.879 0.030 1 728 68 68 SER HB3 H 3.879 0.030 1 729 68 68 SER C C 174.657 0.300 1 730 68 68 SER CA C 58.589 0.300 1 731 68 68 SER CB C 63.800 0.300 1 732 68 68 SER N N 116.415 0.300 1 733 69 69 SER H H 8.316 0.030 1 734 69 69 SER HA H 4.467 0.030 1 735 69 69 SER HB2 H 3.867 0.030 1 736 69 69 SER HB3 H 3.867 0.030 1 737 69 69 SER C C 173.953 0.300 1 738 69 69 SER CA C 58.369 0.300 1 739 69 69 SER CB C 64.047 0.300 1 740 69 69 SER N N 117.832 0.300 1 741 70 70 GLY H H 8.045 0.030 1 742 70 70 GLY C C 179.003 0.300 1 743 70 70 GLY CA C 46.171 0.300 1 744 70 70 GLY N N 116.844 0.300 1 stop_ save_