data_11221 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the Ig-like domain (615-713) from human Obscurin-like protein 1 ; _BMRB_accession_number 11221 _BMRB_flat_file_name bmr11221.str _Entry_type original _Submission_date 2010-07-22 _Accession_date 2010-07-23 _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 Qin X. . . 2 Suetake T. . . 3 Hayashi F. . . 4 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" 597 "13C chemical shifts" 452 "15N chemical shifts" 112 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2011-07-21 original author . stop_ _Original_release_date 2011-07-21 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Solution structure of the Ig-like domain (615-713) from human Obscurin-like protein 1 ; _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 Qin X. . . 2 Suetake T. . . 3 Hayashi F. . . 4 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 'Ig-like domain of Obscurin-like protein 1' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Ig-like domain of Obscurin-like protein 1' $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 'Ig-like domain' _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 112 _Mol_residue_sequence ; GSSGSSGTARLVAGLEDVQV YDGEDAVFSLDLSTIIQGTW FLNGEELKSNEPEGQVEPGA LRYRIEQKGLQHRLILHAVK HQDSGALVGFSCPGVQDSAA LTIQESSGPSSG ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 SER 4 GLY 5 SER 6 SER 7 GLY 8 THR 9 ALA 10 ARG 11 LEU 12 VAL 13 ALA 14 GLY 15 LEU 16 GLU 17 ASP 18 VAL 19 GLN 20 VAL 21 TYR 22 ASP 23 GLY 24 GLU 25 ASP 26 ALA 27 VAL 28 PHE 29 SER 30 LEU 31 ASP 32 LEU 33 SER 34 THR 35 ILE 36 ILE 37 GLN 38 GLY 39 THR 40 TRP 41 PHE 42 LEU 43 ASN 44 GLY 45 GLU 46 GLU 47 LEU 48 LYS 49 SER 50 ASN 51 GLU 52 PRO 53 GLU 54 GLY 55 GLN 56 VAL 57 GLU 58 PRO 59 GLY 60 ALA 61 LEU 62 ARG 63 TYR 64 ARG 65 ILE 66 GLU 67 GLN 68 LYS 69 GLY 70 LEU 71 GLN 72 HIS 73 ARG 74 LEU 75 ILE 76 LEU 77 HIS 78 ALA 79 VAL 80 LYS 81 HIS 82 GLN 83 ASP 84 SER 85 GLY 86 ALA 87 LEU 88 VAL 89 GLY 90 PHE 91 SER 92 CYS 93 PRO 94 GLY 95 VAL 96 GLN 97 ASP 98 SER 99 ALA 100 ALA 101 LEU 102 THR 103 ILE 104 GLN 105 GLU 106 SER 107 SER 108 GLY 109 PRO 110 SER 111 SER 112 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-05-12 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 2E6Q "Solution Structure Of The Ig-Like Domain (615-713) From Human Obscurin-Like Protein 1" 100.00 112 100.00 100.00 2.07e-73 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' 'E. coli' Escherichia coli . plasmid P050725-17 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details ; 1.10mM 13C, 15N-labeled {protein;} 20mM {d-Tris-HCl(pH7.0);} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 90% {H2O;} 10% D2O ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1.10 mM '[U-13C; U-15N]' d-Tris-HCl 20 mM 'natural abundance' NaCl 100 mM 'natural abundance' d-DTT 1 mM 'natural abundance' NaN3 0.02 % 'natural abundance' H2O 90 % . D2O 10 % . stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Saveframe_category software _Name VNMR _Version 6.1C loop_ _Vendor _Address _Electronic_address varian . . stop_ loop_ _Task collection stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version 20031121 loop_ _Vendor _Address _Electronic_address 'Delaglio, F.' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRView _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_Kujira _Saveframe_category software _Name Kujira _Version 0.9816 loop_ _Vendor _Address _Electronic_address 'Kobayashi, N.' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_CYANA _Saveframe_category software _Name CYANA _Version 2.0.17 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 Varian _Model INOVA _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_ ####################### # 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_ _Software_label $VNMR $NMRPipe $NMRView $Kujira $CYANA stop_ 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 'Ig-like domain of Obscurin-like protein 1' _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 4.012 0.030 1 2 7 7 GLY HA3 H 4.012 0.030 1 3 7 7 GLY C C 173.604 0.300 1 4 7 7 GLY CA C 45.295 0.300 1 5 8 8 THR H H 7.761 0.030 1 6 8 8 THR HA H 4.282 0.030 1 7 8 8 THR HB H 4.001 0.030 1 8 8 8 THR HG2 H 1.096 0.030 1 9 8 8 THR C C 173.175 0.300 1 10 8 8 THR CA C 60.964 0.300 1 11 8 8 THR CB C 70.819 0.300 1 12 8 8 THR CG2 C 21.447 0.300 1 13 8 8 THR N N 111.736 0.300 1 14 9 9 ALA H H 8.324 0.030 1 15 9 9 ALA HA H 4.341 0.030 1 16 9 9 ALA HB H 1.312 0.030 1 17 9 9 ALA C C 174.870 0.300 1 18 9 9 ALA CA C 51.214 0.300 1 19 9 9 ALA CB C 22.716 0.300 1 20 9 9 ALA N N 124.617 0.300 1 21 10 10 ARG H H 8.220 0.030 1 22 10 10 ARG HA H 4.508 0.030 1 23 10 10 ARG HB2 H 1.572 0.030 2 24 10 10 ARG HB3 H 1.724 0.030 2 25 10 10 ARG HD2 H 3.187 0.030 1 26 10 10 ARG HD3 H 3.187 0.030 1 27 10 10 ARG HG2 H 1.527 0.030 1 28 10 10 ARG HG3 H 1.527 0.030 1 29 10 10 ARG C C 175.124 0.300 1 30 10 10 ARG CA C 53.720 0.300 1 31 10 10 ARG CB C 33.104 0.300 1 32 10 10 ARG CD C 43.197 0.300 1 33 10 10 ARG CG C 27.164 0.300 1 34 10 10 ARG N N 116.208 0.300 1 35 11 11 LEU H H 8.623 0.030 1 36 11 11 LEU HA H 4.226 0.030 1 37 11 11 LEU HB2 H 1.765 0.030 2 38 11 11 LEU HB3 H 1.408 0.030 2 39 11 11 LEU HD1 H 0.886 0.030 1 40 11 11 LEU HD2 H 0.882 0.030 1 41 11 11 LEU HG H 1.309 0.030 1 42 11 11 LEU C C 176.194 0.300 1 43 11 11 LEU CA C 55.354 0.300 1 44 11 11 LEU CB C 43.380 0.300 1 45 11 11 LEU CD1 C 25.479 0.300 2 46 11 11 LEU CD2 C 24.807 0.300 2 47 11 11 LEU CG C 26.742 0.300 1 48 11 11 LEU N N 123.658 0.300 1 49 12 12 VAL H H 8.576 0.030 1 50 12 12 VAL HA H 3.957 0.030 1 51 12 12 VAL HB H 1.546 0.030 1 52 12 12 VAL HG1 H 0.756 0.030 1 53 12 12 VAL HG2 H 0.899 0.030 1 54 12 12 VAL C C 176.140 0.300 1 55 12 12 VAL CA C 64.525 0.300 1 56 12 12 VAL CB C 32.570 0.300 1 57 12 12 VAL CG1 C 21.108 0.300 2 58 12 12 VAL CG2 C 20.445 0.300 2 59 12 12 VAL N N 129.427 0.300 1 60 13 13 ALA H H 7.941 0.030 1 61 13 13 ALA HA H 4.627 0.030 1 62 13 13 ALA HB H 1.447 0.030 1 63 13 13 ALA C C 175.952 0.300 1 64 13 13 ALA CA C 52.320 0.300 1 65 13 13 ALA CB C 20.999 0.300 1 66 13 13 ALA N N 123.252 0.300 1 67 14 14 GLY H H 8.483 0.030 1 68 14 14 GLY HA2 H 3.923 0.030 2 69 14 14 GLY HA3 H 4.393 0.030 2 70 14 14 GLY C C 173.823 0.300 1 71 14 14 GLY CA C 44.695 0.300 1 72 14 14 GLY N N 108.929 0.300 1 73 15 15 LEU H H 9.831 0.030 1 74 15 15 LEU HA H 4.446 0.030 1 75 15 15 LEU HB2 H 1.634 0.030 2 76 15 15 LEU HB3 H 1.348 0.030 2 77 15 15 LEU HD1 H 1.213 0.030 1 78 15 15 LEU HD2 H 0.672 0.030 1 79 15 15 LEU HG H 1.829 0.030 1 80 15 15 LEU C C 177.843 0.300 1 81 15 15 LEU CA C 55.505 0.300 1 82 15 15 LEU CB C 44.524 0.300 1 83 15 15 LEU CD1 C 25.050 0.300 2 84 15 15 LEU CD2 C 25.005 0.300 2 85 15 15 LEU CG C 26.669 0.300 1 86 15 15 LEU N N 120.332 0.300 1 87 16 16 GLU H H 8.510 0.030 1 88 16 16 GLU HA H 4.719 0.030 1 89 16 16 GLU HB2 H 1.835 0.030 2 90 16 16 GLU HB3 H 2.149 0.030 2 91 16 16 GLU HG2 H 2.332 0.030 2 92 16 16 GLU HG3 H 2.413 0.030 2 93 16 16 GLU C C 175.275 0.300 1 94 16 16 GLU CA C 54.268 0.300 1 95 16 16 GLU CB C 32.745 0.300 1 96 16 16 GLU CG C 36.216 0.300 1 97 16 16 GLU N N 120.700 0.300 1 98 17 17 ASP H H 8.429 0.030 1 99 17 17 ASP HA H 4.995 0.030 1 100 17 17 ASP HB2 H 2.890 0.030 2 101 17 17 ASP HB3 H 2.560 0.030 2 102 17 17 ASP C C 176.576 0.300 1 103 17 17 ASP CA C 55.518 0.300 1 104 17 17 ASP CB C 40.826 0.300 1 105 17 17 ASP N N 120.525 0.300 1 106 18 18 VAL H H 8.366 0.030 1 107 18 18 VAL HA H 4.176 0.030 1 108 18 18 VAL HB H 1.512 0.030 1 109 18 18 VAL HG1 H 0.644 0.030 1 110 18 18 VAL HG2 H 0.300 0.030 1 111 18 18 VAL C C 173.906 0.300 1 112 18 18 VAL CA C 61.682 0.300 1 113 18 18 VAL CB C 35.845 0.300 1 114 18 18 VAL CG1 C 22.458 0.300 2 115 18 18 VAL CG2 C 21.404 0.300 2 116 18 18 VAL N N 122.466 0.300 1 117 19 19 GLN H H 8.367 0.030 1 118 19 19 GLN HA H 5.619 0.030 1 119 19 19 GLN HB2 H 1.847 0.030 1 120 19 19 GLN HB3 H 1.847 0.030 1 121 19 19 GLN HE21 H 7.210 0.030 2 122 19 19 GLN HE22 H 6.599 0.030 2 123 19 19 GLN HG2 H 2.022 0.030 1 124 19 19 GLN HG3 H 2.022 0.030 1 125 19 19 GLN C C 175.110 0.300 1 126 19 19 GLN CA C 53.900 0.300 1 127 19 19 GLN CB C 30.919 0.300 1 128 19 19 GLN CG C 34.025 0.300 1 129 19 19 GLN N N 127.380 0.300 1 130 19 19 GLN NE2 N 110.953 0.300 1 131 20 20 VAL H H 8.135 0.030 1 132 20 20 VAL HA H 4.703 0.030 1 133 20 20 VAL HB H 2.672 0.030 1 134 20 20 VAL HG1 H 0.890 0.030 1 135 20 20 VAL HG2 H 0.573 0.030 1 136 20 20 VAL C C 174.983 0.300 1 137 20 20 VAL CA C 58.755 0.300 1 138 20 20 VAL CB C 35.881 0.300 1 139 20 20 VAL CG1 C 22.188 0.300 2 140 20 20 VAL CG2 C 18.906 0.300 2 141 20 20 VAL N N 117.378 0.300 1 142 21 21 TYR H H 8.774 0.030 1 143 21 21 TYR HA H 4.725 0.030 1 144 21 21 TYR HB2 H 3.114 0.030 2 145 21 21 TYR HB3 H 2.617 0.030 2 146 21 21 TYR HD1 H 7.210 0.030 1 147 21 21 TYR HD2 H 7.210 0.030 1 148 21 21 TYR HE1 H 6.779 0.030 1 149 21 21 TYR HE2 H 6.779 0.030 1 150 21 21 TYR C C 175.054 0.300 1 151 21 21 TYR CA C 57.870 0.300 1 152 21 21 TYR CB C 39.617 0.300 1 153 21 21 TYR CD1 C 133.298 0.300 1 154 21 21 TYR CD2 C 133.298 0.300 1 155 21 21 TYR CE1 C 117.924 0.300 1 156 21 21 TYR CE2 C 117.924 0.300 1 157 21 21 TYR N N 119.294 0.300 1 158 22 22 ASP H H 8.158 0.030 1 159 22 22 ASP HA H 4.103 0.030 1 160 22 22 ASP HB2 H 2.510 0.030 2 161 22 22 ASP HB3 H 2.673 0.030 2 162 22 22 ASP C C 176.921 0.300 1 163 22 22 ASP CA C 56.281 0.300 1 164 22 22 ASP CB C 43.132 0.300 1 165 22 22 ASP N N 118.943 0.300 1 166 23 23 GLY H H 9.579 0.030 1 167 23 23 GLY HA2 H 4.365 0.030 2 168 23 23 GLY HA3 H 3.370 0.030 2 169 23 23 GLY C C 175.191 0.300 1 170 23 23 GLY CA C 45.195 0.300 1 171 23 23 GLY N N 114.960 0.300 1 172 24 24 GLU H H 8.081 0.030 1 173 24 24 GLU HA H 4.424 0.030 1 174 24 24 GLU HB2 H 2.356 0.030 2 175 24 24 GLU HB3 H 2.215 0.030 2 176 24 24 GLU HG2 H 2.206 0.030 2 177 24 24 GLU HG3 H 2.420 0.030 2 178 24 24 GLU C C 174.598 0.300 1 179 24 24 GLU CA C 56.453 0.300 1 180 24 24 GLU CB C 31.259 0.300 1 181 24 24 GLU CG C 38.669 0.300 1 182 24 24 GLU N N 121.528 0.300 1 183 25 25 ASP H H 8.241 0.030 1 184 25 25 ASP HA H 5.385 0.030 1 185 25 25 ASP HB2 H 2.319 0.030 2 186 25 25 ASP HB3 H 2.559 0.030 2 187 25 25 ASP C C 175.489 0.300 1 188 25 25 ASP CA C 53.188 0.300 1 189 25 25 ASP CB C 40.841 0.300 1 190 25 25 ASP N N 118.115 0.300 1 191 26 26 ALA H H 9.059 0.030 1 192 26 26 ALA HA H 4.605 0.030 1 193 26 26 ALA HB H 1.287 0.030 1 194 26 26 ALA C C 174.660 0.300 1 195 26 26 ALA CA C 50.282 0.300 1 196 26 26 ALA CB C 23.432 0.300 1 197 26 26 ALA N N 124.105 0.300 1 198 27 27 VAL H H 8.003 0.030 1 199 27 27 VAL HA H 4.679 0.030 1 200 27 27 VAL HB H 1.830 0.030 1 201 27 27 VAL HG1 H 0.820 0.030 1 202 27 27 VAL HG2 H 0.724 0.030 1 203 27 27 VAL C C 174.378 0.300 1 204 27 27 VAL CA C 61.544 0.300 1 205 27 27 VAL CB C 33.208 0.300 1 206 27 27 VAL CG1 C 20.851 0.300 2 207 27 27 VAL CG2 C 20.762 0.300 2 208 27 27 VAL N N 122.333 0.300 1 209 28 28 PHE H H 9.316 0.030 1 210 28 28 PHE HA H 4.766 0.030 1 211 28 28 PHE HB2 H 3.151 0.030 2 212 28 28 PHE HB3 H 2.861 0.030 2 213 28 28 PHE HD1 H 7.179 0.030 1 214 28 28 PHE HD2 H 7.179 0.030 1 215 28 28 PHE HE1 H 7.109 0.030 1 216 28 28 PHE HE2 H 7.109 0.030 1 217 28 28 PHE HZ H 7.035 0.030 1 218 28 28 PHE C C 174.522 0.300 1 219 28 28 PHE CA C 56.878 0.300 1 220 28 28 PHE CB C 41.374 0.300 1 221 28 28 PHE CD1 C 131.871 0.300 1 222 28 28 PHE CD2 C 131.871 0.300 1 223 28 28 PHE CE1 C 130.987 0.300 1 224 28 28 PHE CE2 C 130.987 0.300 1 225 28 28 PHE CZ C 128.895 0.300 1 226 28 28 PHE N N 127.315 0.300 1 227 29 29 SER H H 8.192 0.030 1 228 29 29 SER HA H 5.706 0.030 1 229 29 29 SER HB2 H 3.644 0.030 2 230 29 29 SER HB3 H 3.569 0.030 2 231 29 29 SER C C 171.553 0.300 1 232 29 29 SER CA C 56.964 0.300 1 233 29 29 SER CB C 66.113 0.300 1 234 29 29 SER N N 114.831 0.300 1 235 30 30 LEU H H 8.969 0.030 1 236 30 30 LEU HA H 4.718 0.030 1 237 30 30 LEU HB2 H 1.598 0.030 2 238 30 30 LEU HB3 H 1.876 0.030 2 239 30 30 LEU HD1 H 0.082 0.030 1 240 30 30 LEU HD2 H -0.154 0.030 1 241 30 30 LEU HG H 1.217 0.030 1 242 30 30 LEU C C 174.145 0.300 1 243 30 30 LEU CA C 55.337 0.300 1 244 30 30 LEU CB C 43.993 0.300 1 245 30 30 LEU CD1 C 25.807 0.300 2 246 30 30 LEU CD2 C 26.552 0.300 2 247 30 30 LEU CG C 25.682 0.300 1 248 30 30 LEU N N 122.154 0.300 1 249 31 31 ASP H H 8.978 0.030 1 250 31 31 ASP HA H 5.537 0.030 1 251 31 31 ASP HB2 H 2.461 0.030 2 252 31 31 ASP HB3 H 2.590 0.030 2 253 31 31 ASP C C 175.786 0.300 1 254 31 31 ASP CA C 53.197 0.300 1 255 31 31 ASP CB C 43.632 0.300 1 256 31 31 ASP N N 118.642 0.300 1 257 32 32 LEU H H 8.979 0.030 1 258 32 32 LEU HA H 5.255 0.030 1 259 32 32 LEU HB2 H 2.368 0.030 2 260 32 32 LEU HB3 H 1.567 0.030 2 261 32 32 LEU HD1 H 0.897 0.030 1 262 32 32 LEU HD2 H 0.762 0.030 1 263 32 32 LEU HG H 1.572 0.030 1 264 32 32 LEU C C 177.234 0.300 1 265 32 32 LEU CA C 52.716 0.300 1 266 32 32 LEU CB C 46.571 0.300 1 267 32 32 LEU CD1 C 27.726 0.300 2 268 32 32 LEU CD2 C 24.925 0.300 2 269 32 32 LEU CG C 27.145 0.300 1 270 32 32 LEU N N 122.080 0.300 1 271 33 33 SER H H 8.375 0.030 1 272 33 33 SER HA H 4.209 0.030 1 273 33 33 SER HB2 H 3.610 0.030 2 274 33 33 SER HB3 H 4.163 0.030 2 275 33 33 SER C C 174.443 0.300 1 276 33 33 SER CA C 59.445 0.300 1 277 33 33 SER CB C 63.479 0.300 1 278 33 33 SER N N 109.510 0.300 1 279 34 34 THR H H 7.323 0.030 1 280 34 34 THR HA H 4.536 0.030 1 281 34 34 THR HB H 4.048 0.030 1 282 34 34 THR HG2 H 1.017 0.030 1 283 34 34 THR C C 172.360 0.300 1 284 34 34 THR CA C 59.420 0.300 1 285 34 34 THR CB C 70.210 0.300 1 286 34 34 THR CG2 C 19.538 0.300 1 287 34 34 THR N N 114.958 0.300 1 288 35 35 ILE H H 8.005 0.030 1 289 35 35 ILE HA H 3.986 0.030 1 290 35 35 ILE HB H 1.821 0.030 1 291 35 35 ILE HD1 H 0.875 0.030 1 292 35 35 ILE HG12 H 1.683 0.030 2 293 35 35 ILE HG13 H 0.696 0.030 2 294 35 35 ILE HG2 H 0.822 0.030 1 295 35 35 ILE C C 174.247 0.300 1 296 35 35 ILE CA C 62.395 0.300 1 297 35 35 ILE CB C 37.076 0.300 1 298 35 35 ILE CD1 C 12.887 0.300 1 299 35 35 ILE CG1 C 28.025 0.300 1 300 35 35 ILE CG2 C 17.155 0.300 1 301 35 35 ILE N N 124.512 0.300 1 302 36 36 ILE H H 8.792 0.030 1 303 36 36 ILE HA H 4.500 0.030 1 304 36 36 ILE HB H 1.609 0.030 1 305 36 36 ILE HD1 H 0.895 0.030 1 306 36 36 ILE HG12 H 1.708 0.030 2 307 36 36 ILE HG13 H 1.416 0.030 2 308 36 36 ILE HG2 H 0.791 0.030 1 309 36 36 ILE C C 171.775 0.300 1 310 36 36 ILE CA C 60.466 0.300 1 311 36 36 ILE CB C 42.563 0.300 1 312 36 36 ILE CD1 C 15.342 0.300 1 313 36 36 ILE CG1 C 29.030 0.300 1 314 36 36 ILE CG2 C 16.843 0.300 1 315 36 36 ILE N N 131.152 0.300 1 316 37 37 GLN H H 7.663 0.030 1 317 37 37 GLN HA H 4.619 0.030 1 318 37 37 GLN HB2 H 2.103 0.030 2 319 37 37 GLN HB3 H 2.057 0.030 2 320 37 37 GLN HE21 H 7.675 0.030 2 321 37 37 GLN HE22 H 6.885 0.030 2 322 37 37 GLN HG2 H 2.461 0.030 2 323 37 37 GLN HG3 H 2.498 0.030 2 324 37 37 GLN C C 175.926 0.300 1 325 37 37 GLN CA C 55.966 0.300 1 326 37 37 GLN CB C 29.478 0.300 1 327 37 37 GLN CG C 34.237 0.300 1 328 37 37 GLN N N 122.647 0.300 1 329 37 37 GLN NE2 N 112.695 0.300 1 330 38 38 GLY H H 8.679 0.030 1 331 38 38 GLY HA2 H 3.195 0.030 2 332 38 38 GLY HA3 H 4.305 0.030 2 333 38 38 GLY C C 171.947 0.300 1 334 38 38 GLY CA C 44.332 0.300 1 335 38 38 GLY N N 109.944 0.300 1 336 39 39 THR H H 7.626 0.030 1 337 39 39 THR HA H 4.329 0.030 1 338 39 39 THR HB H 3.503 0.030 1 339 39 39 THR HG2 H 0.697 0.030 1 340 39 39 THR C C 170.701 0.300 1 341 39 39 THR CA C 61.713 0.300 1 342 39 39 THR CB C 71.435 0.300 1 343 39 39 THR CG2 C 22.629 0.300 1 344 39 39 THR N N 117.047 0.300 1 345 40 40 TRP H H 8.949 0.030 1 346 40 40 TRP HA H 5.330 0.030 1 347 40 40 TRP HB2 H 3.127 0.030 2 348 40 40 TRP HB3 H 2.864 0.030 2 349 40 40 TRP HD1 H 7.305 0.030 1 350 40 40 TRP HE1 H 10.996 0.030 1 351 40 40 TRP HE3 H 7.668 0.030 1 352 40 40 TRP HH2 H 6.639 0.030 1 353 40 40 TRP HZ2 H 6.974 0.030 1 354 40 40 TRP HZ3 H 6.638 0.030 1 355 40 40 TRP C C 174.894 0.300 1 356 40 40 TRP CA C 55.811 0.300 1 357 40 40 TRP CB C 32.904 0.300 1 358 40 40 TRP CD1 C 127.022 0.300 1 359 40 40 TRP CE3 C 122.053 0.300 1 360 40 40 TRP CH2 C 123.769 0.300 1 361 40 40 TRP CZ2 C 113.836 0.300 1 362 40 40 TRP CZ3 C 120.224 0.300 1 363 40 40 TRP N N 125.085 0.300 1 364 40 40 TRP NE1 N 129.857 0.300 1 365 41 41 PHE H H 9.251 0.030 1 366 41 41 PHE HA H 5.139 0.030 1 367 41 41 PHE HB2 H 2.483 0.030 2 368 41 41 PHE HB3 H 2.447 0.030 2 369 41 41 PHE HD1 H 6.637 0.030 1 370 41 41 PHE HD2 H 6.637 0.030 1 371 41 41 PHE HE1 H 7.089 0.030 1 372 41 41 PHE HE2 H 7.089 0.030 1 373 41 41 PHE HZ H 7.083 0.030 1 374 41 41 PHE C C 174.665 0.300 1 375 41 41 PHE CA C 55.771 0.300 1 376 41 41 PHE CB C 44.494 0.300 1 377 41 41 PHE CD1 C 131.068 0.300 1 378 41 41 PHE CD2 C 131.068 0.300 1 379 41 41 PHE CE1 C 130.992 0.300 1 380 41 41 PHE CE2 C 130.992 0.300 1 381 41 41 PHE CZ C 129.554 0.300 1 382 41 41 PHE N N 117.036 0.300 1 383 42 42 LEU H H 8.764 0.030 1 384 42 42 LEU HA H 5.104 0.030 1 385 42 42 LEU HB2 H 1.794 0.030 2 386 42 42 LEU HB3 H 1.112 0.030 2 387 42 42 LEU HD1 H 0.806 0.030 1 388 42 42 LEU HD2 H 0.732 0.030 1 389 42 42 LEU HG H 1.365 0.030 1 390 42 42 LEU C C 177.120 0.300 1 391 42 42 LEU CA C 53.306 0.300 1 392 42 42 LEU CB C 45.603 0.300 1 393 42 42 LEU CD1 C 26.211 0.300 2 394 42 42 LEU CD2 C 24.371 0.300 2 395 42 42 LEU CG C 27.685 0.300 1 396 42 42 LEU N N 120.483 0.300 1 397 43 43 ASN H H 10.185 0.030 1 398 43 43 ASN HA H 4.502 0.030 1 399 43 43 ASN HB2 H 2.952 0.030 2 400 43 43 ASN HB3 H 3.087 0.030 2 401 43 43 ASN HD21 H 6.932 0.030 2 402 43 43 ASN HD22 H 7.917 0.030 2 403 43 43 ASN C C 175.659 0.300 1 404 43 43 ASN CA C 54.444 0.300 1 405 43 43 ASN CB C 37.061 0.300 1 406 43 43 ASN N N 127.854 0.300 1 407 43 43 ASN ND2 N 113.899 0.300 1 408 44 44 GLY H H 9.278 0.030 1 409 44 44 GLY HA2 H 3.454 0.030 2 410 44 44 GLY HA3 H 4.175 0.030 2 411 44 44 GLY C C 173.431 0.300 1 412 44 44 GLY CA C 45.211 0.300 1 413 44 44 GLY N N 103.282 0.300 1 414 45 45 GLU H H 7.868 0.030 1 415 45 45 GLU HA H 4.654 0.030 1 416 45 45 GLU HB2 H 2.019 0.030 2 417 45 45 GLU HB3 H 2.123 0.030 2 418 45 45 GLU HG2 H 2.207 0.030 2 419 45 45 GLU HG3 H 2.336 0.030 2 420 45 45 GLU C C 175.286 0.300 1 421 45 45 GLU CA C 54.754 0.300 1 422 45 45 GLU CB C 31.272 0.300 1 423 45 45 GLU CG C 35.862 0.300 1 424 45 45 GLU N N 121.827 0.300 1 425 46 46 GLU H H 8.806 0.030 1 426 46 46 GLU HA H 3.685 0.030 1 427 46 46 GLU HB2 H 1.812 0.030 2 428 46 46 GLU HB3 H 1.699 0.030 2 429 46 46 GLU HG2 H 1.694 0.030 1 430 46 46 GLU HG3 H 1.694 0.030 1 431 46 46 GLU C C 176.371 0.300 1 432 46 46 GLU CA C 56.689 0.300 1 433 46 46 GLU CB C 30.094 0.300 1 434 46 46 GLU CG C 35.569 0.300 1 435 46 46 GLU N N 126.784 0.300 1 436 47 47 LEU H H 8.565 0.030 1 437 47 47 LEU HA H 4.370 0.030 1 438 47 47 LEU HB2 H 1.444 0.030 2 439 47 47 LEU HB3 H 0.763 0.030 2 440 47 47 LEU HD1 H 0.161 0.030 1 441 47 47 LEU HD2 H 0.318 0.030 1 442 47 47 LEU HG H 1.277 0.030 1 443 47 47 LEU C C 176.085 0.300 1 444 47 47 LEU CA C 53.327 0.300 1 445 47 47 LEU CB C 40.952 0.300 1 446 47 47 LEU CD1 C 25.819 0.300 2 447 47 47 LEU CD2 C 21.396 0.300 2 448 47 47 LEU CG C 25.780 0.300 1 449 47 47 LEU N N 128.611 0.300 1 450 48 48 LYS H H 8.265 0.030 1 451 48 48 LYS HA H 4.456 0.030 1 452 48 48 LYS HB2 H 1.812 0.030 2 453 48 48 LYS HB3 H 1.935 0.030 2 454 48 48 LYS HD2 H 1.693 0.030 1 455 48 48 LYS HD3 H 1.693 0.030 1 456 48 48 LYS HE2 H 2.998 0.030 1 457 48 48 LYS HE3 H 2.998 0.030 1 458 48 48 LYS HG2 H 1.434 0.030 2 459 48 48 LYS HG3 H 1.490 0.030 2 460 48 48 LYS C C 177.423 0.300 1 461 48 48 LYS CA C 55.957 0.300 1 462 48 48 LYS CB C 33.487 0.300 1 463 48 48 LYS CD C 28.896 0.300 1 464 48 48 LYS CE C 42.087 0.300 1 465 48 48 LYS CG C 24.946 0.300 1 466 48 48 LYS N N 122.430 0.300 1 467 49 49 SER H H 8.791 0.030 1 468 49 49 SER HA H 4.539 0.030 1 469 49 49 SER HB2 H 4.047 0.030 2 470 49 49 SER HB3 H 3.973 0.030 2 471 49 49 SER C C 174.271 0.300 1 472 49 49 SER CA C 58.997 0.300 1 473 49 49 SER CB C 63.802 0.300 1 474 50 50 ASN H H 8.449 0.030 1 475 50 50 ASN HA H 4.779 0.030 1 476 50 50 ASN HB2 H 2.838 0.030 2 477 50 50 ASN HB3 H 2.796 0.030 2 478 50 50 ASN HD21 H 7.568 0.030 2 479 50 50 ASN HD22 H 6.859 0.030 2 480 50 50 ASN C C 174.607 0.300 1 481 50 50 ASN CA C 53.525 0.300 1 482 50 50 ASN CB C 39.011 0.300 1 483 50 50 ASN N N 120.303 0.300 1 484 50 50 ASN ND2 N 112.716 0.300 1 485 51 51 GLU H H 8.357 0.030 1 486 51 51 GLU HA H 4.608 0.030 1 487 51 51 GLU HB2 H 1.880 0.030 2 488 51 51 GLU HB3 H 2.072 0.030 2 489 51 51 GLU HG2 H 2.296 0.030 1 490 51 51 GLU HG3 H 2.296 0.030 1 491 51 51 GLU C C 174.746 0.300 1 492 51 51 GLU CA C 54.586 0.300 1 493 51 51 GLU CB C 29.771 0.300 1 494 51 51 GLU CG C 35.919 0.300 1 495 51 51 GLU N N 121.316 0.300 1 496 52 52 PRO HA H 4.384 0.030 1 497 52 52 PRO HB2 H 1.927 0.030 2 498 52 52 PRO HB3 H 2.315 0.030 2 499 52 52 PRO HD2 H 3.727 0.030 2 500 52 52 PRO HD3 H 3.871 0.030 2 501 52 52 PRO HG2 H 2.019 0.030 2 502 52 52 PRO HG3 H 2.120 0.030 2 503 52 52 PRO C C 177.075 0.300 1 504 52 52 PRO CA C 63.736 0.300 1 505 52 52 PRO CB C 32.021 0.300 1 506 52 52 PRO CD C 50.577 0.300 1 507 52 52 PRO CG C 27.617 0.300 1 508 53 53 GLU H H 8.488 0.030 1 509 53 53 GLU HA H 4.308 0.030 1 510 53 53 GLU HB2 H 1.955 0.030 2 511 53 53 GLU HB3 H 2.060 0.030 2 512 53 53 GLU HG2 H 2.258 0.030 2 513 53 53 GLU HG3 H 2.283 0.030 2 514 53 53 GLU C C 176.967 0.300 1 515 53 53 GLU CA C 56.669 0.300 1 516 53 53 GLU CB C 30.086 0.300 1 517 53 53 GLU CG C 36.353 0.300 1 518 53 53 GLU N N 120.045 0.300 1 519 54 54 GLY H H 8.273 0.030 1 520 54 54 GLY HA2 H 3.964 0.030 2 521 54 54 GLY HA3 H 3.903 0.030 2 522 54 54 GLY C C 173.750 0.300 1 523 54 54 GLY CA C 45.252 0.300 1 524 54 54 GLY N N 109.440 0.300 1 525 55 55 GLN H H 8.196 0.030 1 526 55 55 GLN HA H 4.415 0.030 1 527 55 55 GLN HB2 H 1.950 0.030 2 528 55 55 GLN HB3 H 2.080 0.030 2 529 55 55 GLN HE21 H 7.581 0.030 2 530 55 55 GLN HE22 H 6.844 0.030 2 531 55 55 GLN HG2 H 2.313 0.030 1 532 55 55 GLN HG3 H 2.313 0.030 1 533 55 55 GLN C C 175.829 0.300 1 534 55 55 GLN CA C 55.550 0.300 1 535 55 55 GLN CB C 29.487 0.300 1 536 55 55 GLN CG C 33.782 0.300 1 537 55 55 GLN N N 120.055 0.300 1 538 55 55 GLN NE2 N 112.539 0.300 1 539 56 56 VAL H H 8.205 0.030 1 540 56 56 VAL HA H 4.157 0.030 1 541 56 56 VAL HB H 2.061 0.030 1 542 56 56 VAL HG1 H 0.913 0.030 1 543 56 56 VAL HG2 H 0.908 0.030 1 544 56 56 VAL C C 175.977 0.300 1 545 56 56 VAL CA C 62.013 0.300 1 546 56 56 VAL CB C 33.027 0.300 1 547 56 56 VAL CG1 C 21.344 0.300 2 548 56 56 VAL CG2 C 20.431 0.300 2 549 56 56 VAL N N 121.481 0.300 1 550 57 57 GLU H H 8.472 0.030 1 551 57 57 GLU HA H 4.575 0.030 1 552 57 57 GLU HB2 H 1.911 0.030 2 553 57 57 GLU HB3 H 2.068 0.030 2 554 57 57 GLU HG2 H 2.299 0.030 1 555 57 57 GLU HG3 H 2.299 0.030 1 556 57 57 GLU C C 174.656 0.300 1 557 57 57 GLU CA C 54.586 0.300 1 558 57 57 GLU CB C 29.472 0.300 1 559 57 57 GLU CG C 35.983 0.300 1 560 57 57 GLU N N 125.628 0.300 1 561 58 58 PRO HA H 4.338 0.030 1 562 58 58 PRO HB2 H 1.930 0.030 2 563 58 58 PRO HB3 H 2.298 0.030 2 564 58 58 PRO HD2 H 3.872 0.030 2 565 58 58 PRO HD3 H 3.731 0.030 2 566 58 58 PRO HG2 H 2.010 0.030 1 567 58 58 PRO HG3 H 2.010 0.030 1 568 58 58 PRO C C 177.902 0.300 1 569 58 58 PRO CA C 64.093 0.300 1 570 58 58 PRO CB C 31.751 0.300 1 571 58 58 PRO CD C 50.603 0.300 1 572 58 58 PRO CG C 27.600 0.300 1 573 59 59 GLY H H 8.605 0.030 1 574 59 59 GLY HA2 H 4.034 0.030 2 575 59 59 GLY HA3 H 3.847 0.030 2 576 59 59 GLY C C 173.961 0.300 1 577 59 59 GLY CA C 45.245 0.300 1 578 59 59 GLY N N 110.490 0.300 1 579 60 60 ALA H H 7.801 0.030 1 580 60 60 ALA HA H 4.352 0.030 1 581 60 60 ALA HB H 1.444 0.030 1 582 60 60 ALA C C 177.391 0.300 1 583 60 60 ALA CA C 52.119 0.300 1 584 60 60 ALA CB C 19.780 0.300 1 585 60 60 ALA N N 123.239 0.300 1 586 61 61 LEU H H 8.106 0.030 1 587 61 61 LEU HA H 4.352 0.030 1 588 61 61 LEU HB2 H 1.619 0.030 1 589 61 61 LEU HB3 H 1.619 0.030 1 590 61 61 LEU HD1 H 0.861 0.030 1 591 61 61 LEU HD2 H 0.929 0.030 1 592 61 61 LEU HG H 1.634 0.030 1 593 61 61 LEU C C 176.703 0.300 1 594 61 61 LEU CA C 55.414 0.300 1 595 61 61 LEU CB C 42.651 0.300 1 596 61 61 LEU CD1 C 25.198 0.300 2 597 61 61 LEU CD2 C 24.640 0.300 2 598 61 61 LEU CG C 27.211 0.300 1 599 61 61 LEU N N 121.715 0.300 1 600 62 62 ARG H H 8.996 0.030 1 601 62 62 ARG HA H 4.574 0.030 1 602 62 62 ARG HB2 H 1.873 0.030 2 603 62 62 ARG HB3 H 1.946 0.030 2 604 62 62 ARG HD2 H 3.199 0.030 1 605 62 62 ARG HD3 H 3.199 0.030 1 606 62 62 ARG HG2 H 1.779 0.030 2 607 62 62 ARG HG3 H 1.609 0.030 2 608 62 62 ARG C C 174.883 0.300 1 609 62 62 ARG CA C 55.686 0.300 1 610 62 62 ARG CB C 31.422 0.300 1 611 62 62 ARG CD C 43.306 0.300 1 612 62 62 ARG CG C 27.552 0.300 1 613 62 62 ARG N N 125.375 0.300 1 614 63 63 TYR H H 7.646 0.030 1 615 63 63 TYR HA H 5.524 0.030 1 616 63 63 TYR HB2 H 2.830 0.030 2 617 63 63 TYR HB3 H 2.795 0.030 2 618 63 63 TYR HD1 H 6.655 0.030 1 619 63 63 TYR HD2 H 6.655 0.030 1 620 63 63 TYR HE1 H 6.782 0.030 1 621 63 63 TYR HE2 H 6.782 0.030 1 622 63 63 TYR C C 173.589 0.300 1 623 63 63 TYR CA C 55.353 0.300 1 624 63 63 TYR CB C 41.966 0.300 1 625 63 63 TYR CD1 C 132.916 0.300 1 626 63 63 TYR CD2 C 132.916 0.300 1 627 63 63 TYR CE1 C 117.923 0.300 1 628 63 63 TYR CE2 C 117.923 0.300 1 629 63 63 TYR N N 117.568 0.300 1 630 64 64 ARG H H 9.157 0.030 1 631 64 64 ARG HA H 4.676 0.030 1 632 64 64 ARG HB2 H 1.818 0.030 2 633 64 64 ARG HB3 H 1.729 0.030 2 634 64 64 ARG HD2 H 3.231 0.030 2 635 64 64 ARG HD3 H 3.281 0.030 2 636 64 64 ARG HG2 H 1.434 0.030 2 637 64 64 ARG HG3 H 1.641 0.030 2 638 64 64 ARG C C 173.648 0.300 1 639 64 64 ARG CA C 55.418 0.300 1 640 64 64 ARG CB C 34.388 0.300 1 641 64 64 ARG CD C 43.369 0.300 1 642 64 64 ARG CG C 28.136 0.300 1 643 64 64 ARG N N 120.119 0.300 1 644 65 65 ILE H H 8.836 0.030 1 645 65 65 ILE HA H 4.528 0.030 1 646 65 65 ILE HB H 1.678 0.030 1 647 65 65 ILE HD1 H 0.973 0.030 1 648 65 65 ILE HG12 H 1.545 0.030 2 649 65 65 ILE HG13 H 0.705 0.030 2 650 65 65 ILE HG2 H 1.177 0.030 1 651 65 65 ILE C C 175.887 0.300 1 652 65 65 ILE CA C 60.827 0.300 1 653 65 65 ILE CB C 40.744 0.300 1 654 65 65 ILE CD1 C 14.939 0.300 1 655 65 65 ILE CG1 C 29.311 0.300 1 656 65 65 ILE CG2 C 18.961 0.300 1 657 65 65 ILE N N 126.252 0.300 1 658 66 66 GLU H H 9.451 0.030 1 659 66 66 GLU HA H 4.923 0.030 1 660 66 66 GLU HB2 H 1.925 0.030 2 661 66 66 GLU HB3 H 1.858 0.030 2 662 66 66 GLU HG2 H 2.022 0.030 2 663 66 66 GLU HG3 H 2.122 0.030 2 664 66 66 GLU C C 176.138 0.300 1 665 66 66 GLU CA C 54.319 0.300 1 666 66 66 GLU CB C 34.689 0.300 1 667 66 66 GLU CG C 36.194 0.300 1 668 66 66 GLU N N 125.425 0.300 1 669 67 67 GLN H H 8.916 0.030 1 670 67 67 GLN HA H 4.674 0.030 1 671 67 67 GLN HB2 H 1.878 0.030 2 672 67 67 GLN HB3 H 2.008 0.030 2 673 67 67 GLN HE21 H 7.386 0.030 2 674 67 67 GLN HE22 H 6.445 0.030 2 675 67 67 GLN HG2 H 2.051 0.030 2 676 67 67 GLN HG3 H 1.610 0.030 2 677 67 67 GLN C C 174.121 0.300 1 678 67 67 GLN CA C 55.797 0.300 1 679 67 67 GLN CB C 30.267 0.300 1 680 67 67 GLN CG C 32.970 0.300 1 681 67 67 GLN N N 125.640 0.300 1 682 67 67 GLN NE2 N 110.451 0.300 1 683 68 68 LYS H H 8.911 0.030 1 684 68 68 LYS HA H 4.578 0.030 1 685 68 68 LYS HB2 H 1.605 0.030 2 686 68 68 LYS HB3 H 1.797 0.030 2 687 68 68 LYS HD2 H 1.651 0.030 1 688 68 68 LYS HD3 H 1.651 0.030 1 689 68 68 LYS HE2 H 2.930 0.030 1 690 68 68 LYS HE3 H 2.930 0.030 1 691 68 68 LYS HG2 H 1.287 0.030 1 692 68 68 LYS HG3 H 1.287 0.030 1 693 68 68 LYS C C 176.548 0.300 1 694 68 68 LYS CA C 54.129 0.300 1 695 68 68 LYS CB C 32.780 0.300 1 696 68 68 LYS CD C 29.129 0.300 1 697 68 68 LYS CE C 42.119 0.300 1 698 68 68 LYS CG C 24.444 0.300 1 699 68 68 LYS N N 129.550 0.300 1 700 69 69 GLY H H 8.789 0.030 1 701 69 69 GLY HA2 H 4.089 0.030 2 702 69 69 GLY HA3 H 3.437 0.030 2 703 69 69 GLY C C 174.343 0.300 1 704 69 69 GLY CA C 47.638 0.300 1 705 69 69 GLY N N 113.965 0.300 1 706 70 70 LEU H H 8.929 0.030 1 707 70 70 LEU HA H 3.907 0.030 1 708 70 70 LEU HB2 H 2.252 0.030 2 709 70 70 LEU HB3 H 1.691 0.030 2 710 70 70 LEU HD1 H 0.953 0.030 1 711 70 70 LEU HD2 H 0.613 0.030 1 712 70 70 LEU HG H 1.662 0.030 1 713 70 70 LEU C C 174.990 0.300 1 714 70 70 LEU CA C 56.789 0.300 1 715 70 70 LEU CB C 40.797 0.300 1 716 70 70 LEU CD1 C 25.013 0.300 2 717 70 70 LEU CD2 C 21.961 0.300 2 718 70 70 LEU CG C 26.870 0.300 1 719 70 70 LEU N N 131.330 0.300 1 720 71 71 GLN H H 7.678 0.030 1 721 71 71 GLN HA H 5.315 0.030 1 722 71 71 GLN HB2 H 2.005 0.030 2 723 71 71 GLN HB3 H 2.099 0.030 2 724 71 71 GLN HE21 H 8.396 0.030 2 725 71 71 GLN HE22 H 6.555 0.030 2 726 71 71 GLN HG2 H 2.583 0.030 2 727 71 71 GLN HG3 H 1.926 0.030 2 728 71 71 GLN C C 174.826 0.300 1 729 71 71 GLN CA C 54.952 0.300 1 730 71 71 GLN CB C 32.961 0.300 1 731 71 71 GLN CG C 35.521 0.300 1 732 71 71 GLN N N 117.568 0.300 1 733 71 71 GLN NE2 N 113.044 0.300 1 734 72 72 HIS H H 8.998 0.030 1 735 72 72 HIS HA H 4.979 0.030 1 736 72 72 HIS HB2 H 3.351 0.030 2 737 72 72 HIS HB3 H 2.544 0.030 2 738 72 72 HIS HD2 H 6.663 0.030 1 739 72 72 HIS HE1 H 8.029 0.030 1 740 72 72 HIS C C 174.534 0.300 1 741 72 72 HIS CA C 55.987 0.300 1 742 72 72 HIS CB C 35.077 0.300 1 743 72 72 HIS CD2 C 116.540 0.300 1 744 72 72 HIS CE1 C 137.466 0.300 1 745 72 72 HIS N N 126.422 0.300 1 746 73 73 ARG H H 8.986 0.030 1 747 73 73 ARG HA H 5.649 0.030 1 748 73 73 ARG HB2 H 1.681 0.030 1 749 73 73 ARG HB3 H 1.681 0.030 1 750 73 73 ARG HD2 H 3.068 0.030 1 751 73 73 ARG HD3 H 3.068 0.030 1 752 73 73 ARG HE H 7.128 0.030 1 753 73 73 ARG HG2 H 1.506 0.030 2 754 73 73 ARG HG3 H 1.621 0.030 2 755 73 73 ARG C C 172.218 0.300 1 756 73 73 ARG CA C 54.836 0.300 1 757 73 73 ARG CB C 35.794 0.300 1 758 73 73 ARG CD C 44.107 0.300 1 759 73 73 ARG CG C 26.944 0.300 1 760 73 73 ARG N N 119.950 0.300 1 761 73 73 ARG NE N 82.794 0.300 1 762 74 74 LEU H H 8.436 0.030 1 763 74 74 LEU HA H 4.433 0.030 1 764 74 74 LEU HB2 H 0.570 0.030 2 765 74 74 LEU HB3 H -1.023 0.030 2 766 74 74 LEU HD1 H 0.370 0.030 1 767 74 74 LEU HD2 H 0.268 0.030 1 768 74 74 LEU HG H 0.888 0.030 1 769 74 74 LEU C C 173.973 0.300 1 770 74 74 LEU CA C 53.061 0.300 1 771 74 74 LEU CB C 42.922 0.300 1 772 74 74 LEU CD1 C 26.900 0.300 2 773 74 74 LEU CD2 C 23.931 0.300 2 774 74 74 LEU CG C 27.631 0.300 1 775 74 74 LEU N N 124.619 0.300 1 776 75 75 ILE H H 8.977 0.030 1 777 75 75 ILE HA H 4.784 0.030 1 778 75 75 ILE HB H 1.556 0.030 1 779 75 75 ILE HD1 H 0.717 0.030 1 780 75 75 ILE HG12 H 1.326 0.030 2 781 75 75 ILE HG13 H 1.096 0.030 2 782 75 75 ILE HG2 H 0.423 0.030 1 783 75 75 ILE C C 175.516 0.300 1 784 75 75 ILE CA C 60.258 0.300 1 785 75 75 ILE CB C 40.327 0.300 1 786 75 75 ILE CD1 C 15.110 0.300 1 787 75 75 ILE CG1 C 29.297 0.300 1 788 75 75 ILE CG2 C 18.569 0.300 1 789 75 75 ILE N N 126.306 0.300 1 790 76 76 LEU H H 9.162 0.030 1 791 76 76 LEU HA H 4.673 0.030 1 792 76 76 LEU HB2 H 1.906 0.030 2 793 76 76 LEU HB3 H 1.326 0.030 2 794 76 76 LEU HD1 H 0.844 0.030 1 795 76 76 LEU HD2 H 0.756 0.030 1 796 76 76 LEU HG H 1.615 0.030 1 797 76 76 LEU C C 175.656 0.300 1 798 76 76 LEU CA C 53.031 0.300 1 799 76 76 LEU CB C 42.845 0.300 1 800 76 76 LEU CD1 C 26.577 0.300 2 801 76 76 LEU CD2 C 23.504 0.300 2 802 76 76 LEU CG C 26.773 0.300 1 803 76 76 LEU N N 125.857 0.300 1 804 77 77 HIS H H 8.167 0.030 1 805 77 77 HIS HA H 4.701 0.030 1 806 77 77 HIS HB2 H 2.909 0.030 2 807 77 77 HIS HB3 H 2.842 0.030 2 808 77 77 HIS HD2 H 6.520 0.030 1 809 77 77 HIS HE1 H 7.662 0.030 1 810 77 77 HIS C C 175.022 0.300 1 811 77 77 HIS CA C 55.394 0.300 1 812 77 77 HIS CB C 29.952 0.300 1 813 77 77 HIS CD2 C 124.432 0.300 1 814 77 77 HIS CE1 C 138.165 0.300 1 815 77 77 HIS N N 121.473 0.300 1 816 78 78 ALA H H 8.884 0.030 1 817 78 78 ALA HA H 3.550 0.030 1 818 78 78 ALA HB H 1.132 0.030 1 819 78 78 ALA C C 176.828 0.300 1 820 78 78 ALA CA C 51.871 0.300 1 821 78 78 ALA CB C 17.277 0.300 1 822 78 78 ALA N N 127.009 0.300 1 823 79 79 VAL H H 8.012 0.030 1 824 79 79 VAL HA H 4.078 0.030 1 825 79 79 VAL HB H 2.202 0.030 1 826 79 79 VAL HG1 H 0.912 0.030 1 827 79 79 VAL HG2 H 0.871 0.030 1 828 79 79 VAL C C 175.163 0.300 1 829 79 79 VAL CA C 62.344 0.300 1 830 79 79 VAL CB C 32.427 0.300 1 831 79 79 VAL CG1 C 23.629 0.300 2 832 79 79 VAL CG2 C 20.057 0.300 2 833 79 79 VAL N N 113.753 0.300 1 834 80 80 LYS H H 8.927 0.030 1 835 80 80 LYS HA H 5.072 0.030 1 836 80 80 LYS HB2 H 1.711 0.030 2 837 80 80 LYS HB3 H 2.019 0.030 2 838 80 80 LYS HD2 H 1.722 0.030 1 839 80 80 LYS HD3 H 1.722 0.030 1 840 80 80 LYS HE2 H 3.014 0.030 2 841 80 80 LYS HE3 H 3.095 0.030 2 842 80 80 LYS HG2 H 1.568 0.030 1 843 80 80 LYS HG3 H 1.568 0.030 1 844 80 80 LYS C C 178.429 0.300 1 845 80 80 LYS CA C 54.039 0.300 1 846 80 80 LYS CB C 35.539 0.300 1 847 80 80 LYS CD C 28.629 0.300 1 848 80 80 LYS CE C 41.870 0.300 1 849 80 80 LYS CG C 24.219 0.300 1 850 80 80 LYS N N 119.102 0.300 1 851 81 81 HIS H H 9.268 0.030 1 852 81 81 HIS HA H 4.041 0.030 1 853 81 81 HIS HB2 H 3.226 0.030 2 854 81 81 HIS HB3 H 3.089 0.030 2 855 81 81 HIS HD2 H 7.210 0.030 1 856 81 81 HIS HE1 H 8.021 0.030 1 857 81 81 HIS C C 177.444 0.300 1 858 81 81 HIS CA C 60.402 0.300 1 859 81 81 HIS CB C 29.516 0.300 1 860 81 81 HIS CD2 C 121.545 0.300 1 861 81 81 HIS CE1 C 138.091 0.300 1 862 81 81 HIS N N 121.016 0.300 1 863 82 82 GLN H H 8.720 0.030 1 864 82 82 GLN HA H 4.071 0.030 1 865 82 82 GLN HB2 H 2.024 0.030 1 866 82 82 GLN HB3 H 2.024 0.030 1 867 82 82 GLN HE21 H 7.734 0.030 2 868 82 82 GLN HE22 H 6.804 0.030 2 869 82 82 GLN HG2 H 2.352 0.030 2 870 82 82 GLN HG3 H 2.295 0.030 2 871 82 82 GLN C C 175.976 0.300 1 872 82 82 GLN CA C 58.396 0.300 1 873 82 82 GLN CB C 27.717 0.300 1 874 82 82 GLN CG C 33.316 0.300 1 875 82 82 GLN N N 117.944 0.300 1 876 82 82 GLN NE2 N 112.360 0.300 1 877 83 83 ASP H H 8.299 0.030 1 878 83 83 ASP HA H 4.759 0.030 1 879 83 83 ASP HB2 H 2.729 0.030 2 880 83 83 ASP HB3 H 2.800 0.030 2 881 83 83 ASP C C 175.544 0.300 1 882 83 83 ASP CA C 54.877 0.300 1 883 83 83 ASP CB C 41.344 0.300 1 884 83 83 ASP N N 118.757 0.300 1 885 84 84 SER H H 7.629 0.030 1 886 84 84 SER HA H 3.717 0.030 1 887 84 84 SER HB2 H 3.976 0.030 2 888 84 84 SER HB3 H 4.233 0.030 2 889 84 84 SER C C 175.586 0.300 1 890 84 84 SER CA C 61.211 0.300 1 891 84 84 SER CB C 62.422 0.300 1 892 84 84 SER N N 113.079 0.300 1 893 85 85 GLY H H 9.382 0.030 1 894 85 85 GLY HA2 H 3.751 0.030 2 895 85 85 GLY HA3 H 4.412 0.030 2 896 85 85 GLY C C 174.314 0.300 1 897 85 85 GLY CA C 44.586 0.300 1 898 85 85 GLY N N 116.798 0.300 1 899 86 86 ALA H H 7.493 0.030 1 900 86 86 ALA HA H 4.551 0.030 1 901 86 86 ALA HB H 1.461 0.030 1 902 86 86 ALA C C 175.140 0.300 1 903 86 86 ALA CA C 52.487 0.300 1 904 86 86 ALA CB C 19.228 0.300 1 905 86 86 ALA N N 123.054 0.300 1 906 87 87 LEU H H 8.035 0.030 1 907 87 87 LEU HA H 4.928 0.030 1 908 87 87 LEU HB2 H 1.631 0.030 2 909 87 87 LEU HB3 H 1.548 0.030 2 910 87 87 LEU HD1 H 0.830 0.030 1 911 87 87 LEU HD2 H 0.865 0.030 1 912 87 87 LEU HG H 1.503 0.030 1 913 87 87 LEU C C 176.479 0.300 1 914 87 87 LEU CA C 53.263 0.300 1 915 87 87 LEU CB C 44.285 0.300 1 916 87 87 LEU CD1 C 24.487 0.300 2 917 87 87 LEU CD2 C 24.226 0.300 2 918 87 87 LEU CG C 27.113 0.300 1 919 87 87 LEU N N 120.739 0.300 1 920 88 88 VAL H H 9.248 0.030 1 921 88 88 VAL HA H 4.625 0.030 1 922 88 88 VAL HB H 1.263 0.030 1 923 88 88 VAL HG1 H 0.632 0.030 1 924 88 88 VAL HG2 H 0.053 0.030 1 925 88 88 VAL C C 174.611 0.300 1 926 88 88 VAL CA C 61.314 0.300 1 927 88 88 VAL CB C 33.321 0.300 1 928 88 88 VAL CG1 C 21.741 0.300 2 929 88 88 VAL CG2 C 20.728 0.300 2 930 88 88 VAL N N 130.707 0.300 1 931 89 89 GLY H H 9.223 0.030 1 932 89 89 GLY HA2 H 3.637 0.030 2 933 89 89 GLY HA3 H 5.130 0.030 2 934 89 89 GLY C C 171.047 0.300 1 935 89 89 GLY CA C 43.586 0.300 1 936 89 89 GLY N N 112.707 0.300 1 937 90 90 PHE H H 8.349 0.030 1 938 90 90 PHE HA H 5.229 0.030 1 939 90 90 PHE HB2 H 1.878 0.030 2 940 90 90 PHE HB3 H 1.937 0.030 2 941 90 90 PHE HD1 H 6.319 0.030 3 942 90 90 PHE HD2 H 5.462 0.030 3 943 90 90 PHE HE1 H 6.292 0.030 3 944 90 90 PHE HE2 H 5.724 0.030 3 945 90 90 PHE HZ H 5.457 0.030 1 946 90 90 PHE C C 174.482 0.300 1 947 90 90 PHE CA C 55.961 0.300 1 948 90 90 PHE CB C 43.978 0.300 1 949 90 90 PHE CD1 C 129.461 0.300 3 950 90 90 PHE CD2 C 127.211 0.300 3 951 90 90 PHE CE1 C 129.086 0.300 3 952 90 90 PHE CE2 C 127.153 0.300 3 953 90 90 PHE CZ C 127.211 0.300 1 954 90 90 PHE N N 119.727 0.300 1 955 91 91 SER H H 8.246 0.030 1 956 91 91 SER HA H 5.044 0.030 1 957 91 91 SER HB2 H 3.602 0.030 2 958 91 91 SER HB3 H 3.712 0.030 2 959 91 91 SER C C 171.958 0.300 1 960 91 91 SER CA C 56.194 0.300 1 961 91 91 SER CB C 66.711 0.300 1 962 91 91 SER N N 121.133 0.300 1 963 92 92 CYS H H 8.930 0.030 1 964 92 92 CYS HA H 4.825 0.030 1 965 92 92 CYS HB2 H 3.409 0.030 2 966 92 92 CYS HB3 H 2.321 0.030 2 967 92 92 CYS C C 171.373 0.300 1 968 92 92 CYS CA C 55.998 0.300 1 969 92 92 CYS CB C 28.439 0.300 1 970 92 92 CYS N N 119.721 0.300 1 971 93 93 PRO HA H 4.323 0.030 1 972 93 93 PRO HB2 H 2.285 0.030 2 973 93 93 PRO HB3 H 2.085 0.030 2 974 93 93 PRO HD2 H 3.775 0.030 2 975 93 93 PRO HD3 H 3.316 0.030 2 976 93 93 PRO HG2 H 2.204 0.030 2 977 93 93 PRO HG3 H 1.962 0.030 2 978 93 93 PRO C C 176.737 0.300 1 979 93 93 PRO CA C 65.737 0.300 1 980 93 93 PRO CB C 30.672 0.300 1 981 93 93 PRO CD C 50.086 0.300 1 982 93 93 PRO CG C 28.280 0.300 1 983 94 94 GLY H H 8.657 0.030 1 984 94 94 GLY HA2 H 3.662 0.030 2 985 94 94 GLY HA3 H 4.864 0.030 2 986 94 94 GLY C C 174.487 0.300 1 987 94 94 GLY CA C 45.620 0.300 1 988 94 94 GLY N N 115.532 0.300 1 989 95 95 VAL H H 8.476 0.030 1 990 95 95 VAL HA H 4.391 0.030 1 991 95 95 VAL HB H 2.424 0.030 1 992 95 95 VAL HG1 H 0.812 0.030 1 993 95 95 VAL HG2 H 0.628 0.030 1 994 95 95 VAL C C 174.305 0.300 1 995 95 95 VAL CA C 62.336 0.300 1 996 95 95 VAL CB C 36.244 0.300 1 997 95 95 VAL CG1 C 21.629 0.300 2 998 95 95 VAL CG2 C 21.704 0.300 2 999 95 95 VAL N N 121.430 0.300 1 1000 96 96 GLN H H 8.120 0.030 1 1001 96 96 GLN HA H 5.040 0.030 1 1002 96 96 GLN HB2 H 1.974 0.030 1 1003 96 96 GLN HB3 H 1.974 0.030 1 1004 96 96 GLN HE21 H 7.366 0.030 2 1005 96 96 GLN HE22 H 6.662 0.030 2 1006 96 96 GLN HG2 H 2.298 0.030 1 1007 96 96 GLN HG3 H 2.298 0.030 1 1008 96 96 GLN C C 173.811 0.300 1 1009 96 96 GLN CA C 55.496 0.300 1 1010 96 96 GLN CB C 31.469 0.300 1 1011 96 96 GLN CG C 33.900 0.300 1 1012 96 96 GLN N N 125.601 0.300 1 1013 96 96 GLN NE2 N 111.998 0.300 1 1014 97 97 ASP H H 8.985 0.030 1 1015 97 97 ASP HA H 5.221 0.030 1 1016 97 97 ASP HB2 H 2.319 0.030 2 1017 97 97 ASP HB3 H 2.410 0.030 2 1018 97 97 ASP C C 174.927 0.300 1 1019 97 97 ASP CA C 52.944 0.300 1 1020 97 97 ASP CB C 45.389 0.300 1 1021 97 97 ASP N N 124.010 0.300 1 1022 98 98 SER H H 8.777 0.030 1 1023 98 98 SER HA H 5.495 0.030 1 1024 98 98 SER HB2 H 3.795 0.030 2 1025 98 98 SER HB3 H 3.904 0.030 2 1026 98 98 SER C C 171.778 0.300 1 1027 98 98 SER CA C 57.760 0.300 1 1028 98 98 SER CB C 66.168 0.300 1 1029 98 98 SER N N 116.104 0.300 1 1030 99 99 ALA H H 9.187 0.030 1 1031 99 99 ALA HA H 4.594 0.030 1 1032 99 99 ALA HB H 1.523 0.030 1 1033 99 99 ALA C C 173.927 0.300 1 1034 99 99 ALA CA C 52.019 0.300 1 1035 99 99 ALA CB C 24.319 0.300 1 1036 99 99 ALA N N 121.303 0.300 1 1037 100 100 ALA H H 8.851 0.030 1 1038 100 100 ALA HA H 5.312 0.030 1 1039 100 100 ALA HB H 1.283 0.030 1 1040 100 100 ALA C C 176.686 0.300 1 1041 100 100 ALA CA C 50.770 0.300 1 1042 100 100 ALA CB C 22.146 0.300 1 1043 100 100 ALA N N 121.273 0.300 1 1044 101 101 LEU H H 8.540 0.030 1 1045 101 101 LEU HA H 5.363 0.030 1 1046 101 101 LEU HB2 H 2.151 0.030 2 1047 101 101 LEU HB3 H 1.379 0.030 2 1048 101 101 LEU HD1 H 0.846 0.030 1 1049 101 101 LEU HD2 H 0.899 0.030 1 1050 101 101 LEU HG H 1.371 0.030 1 1051 101 101 LEU C C 175.484 0.300 1 1052 101 101 LEU CA C 53.181 0.300 1 1053 101 101 LEU CB C 45.174 0.300 1 1054 101 101 LEU CD1 C 26.571 0.300 2 1055 101 101 LEU CD2 C 23.901 0.300 2 1056 101 101 LEU CG C 27.710 0.300 1 1057 101 101 LEU N N 122.994 0.300 1 1058 102 102 THR H H 9.252 0.030 1 1059 102 102 THR HA H 4.672 0.030 1 1060 102 102 THR HB H 3.946 0.030 1 1061 102 102 THR HG2 H 1.143 0.030 1 1062 102 102 THR C C 172.552 0.300 1 1063 102 102 THR CA C 61.931 0.300 1 1064 102 102 THR CB C 70.463 0.300 1 1065 102 102 THR CG2 C 21.737 0.300 1 1066 102 102 THR N N 123.589 0.300 1 1067 103 103 ILE H H 8.471 0.030 1 1068 103 103 ILE HA H 4.880 0.030 1 1069 103 103 ILE HB H 1.588 0.030 1 1070 103 103 ILE HD1 H 0.614 0.030 1 1071 103 103 ILE HG12 H 1.322 0.030 2 1072 103 103 ILE HG13 H 0.795 0.030 2 1073 103 103 ILE HG2 H 0.664 0.030 1 1074 103 103 ILE C C 175.951 0.300 1 1075 103 103 ILE CA C 58.513 0.300 1 1076 103 103 ILE CB C 40.409 0.300 1 1077 103 103 ILE CD1 C 14.257 0.300 1 1078 103 103 ILE CG1 C 27.802 0.300 1 1079 103 103 ILE CG2 C 17.862 0.300 1 1080 103 103 ILE N N 125.479 0.300 1 1081 104 104 GLN H H 8.757 0.030 1 1082 104 104 GLN HA H 4.445 0.030 1 1083 104 104 GLN HB2 H 1.967 0.030 2 1084 104 104 GLN HB3 H 1.535 0.030 2 1085 104 104 GLN HE21 H 6.623 0.030 2 1086 104 104 GLN HE22 H 6.900 0.030 2 1087 104 104 GLN HG2 H 2.037 0.030 1 1088 104 104 GLN HG3 H 2.037 0.030 1 1089 104 104 GLN C C 175.333 0.300 1 1090 104 104 GLN CA C 55.021 0.300 1 1091 104 104 GLN CB C 30.698 0.300 1 1092 104 104 GLN CG C 33.540 0.300 1 1093 104 104 GLN N N 126.875 0.300 1 1094 104 104 GLN NE2 N 110.307 0.300 1 1095 105 105 GLU H H 8.704 0.030 1 1096 105 105 GLU HA H 4.113 0.030 1 1097 105 105 GLU HB2 H 1.724 0.030 2 1098 105 105 GLU HB3 H 1.879 0.030 2 1099 105 105 GLU HG2 H 2.012 0.030 1 1100 105 105 GLU HG3 H 2.012 0.030 1 1101 105 105 GLU C C 176.534 0.300 1 1102 105 105 GLU CA C 57.138 0.300 1 1103 105 105 GLU CB C 30.519 0.300 1 1104 105 105 GLU CG C 36.189 0.300 1 1105 105 105 GLU N N 121.944 0.300 1 1106 106 106 SER H H 8.594 0.030 1 1107 106 106 SER HA H 4.514 0.030 1 1108 106 106 SER HB2 H 3.879 0.030 2 1109 106 106 SER HB3 H 3.935 0.030 2 1110 106 106 SER C C 174.498 0.300 1 1111 106 106 SER CA C 58.093 0.300 1 1112 106 106 SER CB C 64.087 0.300 1 1113 106 106 SER N N 116.398 0.300 1 1114 107 107 SER H H 8.408 0.030 1 1115 107 107 SER HA H 4.547 0.030 1 1116 107 107 SER HB2 H 3.880 0.030 1 1117 107 107 SER HB3 H 3.880 0.030 1 1118 107 107 SER C C 174.574 0.300 1 1119 107 107 SER CA C 58.323 0.300 1 1120 107 107 SER CB C 64.084 0.300 1 1121 107 107 SER N N 117.581 0.300 1 1122 108 108 GLY H H 8.169 0.030 1 1123 108 108 GLY HA2 H 3.898 0.030 2 1124 108 108 GLY HA3 H 3.970 0.030 2 1125 108 108 GLY C C 171.676 0.300 1 1126 108 108 GLY CA C 44.478 0.300 1 1127 108 108 GLY N N 110.557 0.300 1 1128 109 109 PRO HA H 4.457 0.030 1 1129 109 109 PRO HB2 H 1.968 0.030 2 1130 109 109 PRO HB3 H 2.285 0.030 2 1131 109 109 PRO HD2 H 3.513 0.030 2 1132 109 109 PRO HD3 H 3.577 0.030 2 1133 109 109 PRO HG2 H 2.003 0.030 1 1134 109 109 PRO HG3 H 2.003 0.030 1 1135 109 109 PRO C C 177.383 0.300 1 1136 109 109 PRO CA C 63.138 0.300 1 1137 109 109 PRO CB C 32.146 0.300 1 1138 109 109 PRO CD C 49.770 0.300 1 1139 109 109 PRO CG C 27.042 0.300 1 1140 110 110 SER H H 8.514 0.030 1 1141 110 110 SER HA H 4.513 0.030 1 1142 110 110 SER HB2 H 3.914 0.030 1 1143 110 110 SER HB3 H 3.914 0.030 1 1144 110 110 SER C C 174.717 0.300 1 1145 110 110 SER CA C 58.338 0.300 1 1146 110 110 SER CB C 63.905 0.300 1 1147 110 110 SER N N 116.520 0.300 1 1148 111 111 SER H H 8.335 0.030 1 1149 111 111 SER HA H 4.512 0.030 1 1150 111 111 SER HB2 H 3.905 0.030 1 1151 111 111 SER HB3 H 3.905 0.030 1 1152 111 111 SER C C 173.960 0.300 1 1153 111 111 SER CA C 58.419 0.300 1 1154 111 111 SER CB C 64.144 0.300 1 1155 111 111 SER N N 117.961 0.300 1 1156 112 112 GLY H H 8.046 0.030 1 1157 112 112 GLY HA2 H 3.766 0.030 2 1158 112 112 GLY HA3 H 3.800 0.030 2 1159 112 112 GLY C C 179.029 0.300 1 1160 112 112 GLY CA C 46.230 0.300 1 1161 112 112 GLY N N 116.924 0.300 1 stop_ save_