data_6526 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the KH-QUA2 region of the Xenopus STAR/GSG Quaking protein. ; _BMRB_accession_number 6526 _BMRB_flat_file_name bmr6526.str _Entry_type original _Submission_date 2005-03-01 _Accession_date 2005-03-01 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'NMR solution structure' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Maguire Mahon L . 2 Guler-Gane Gulin . . 3 Nietlispach Daniel . . 4 Raine Andrew RC . 5 Zorn Aaron . . 6 Standart Nancy M . 7 Broadhurst Richard W . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 572 "13C chemical shifts" 375 "15N chemical shifts" 136 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2005-05-05 original author . stop_ _Original_release_date 2005-05-05 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution structure and backbone dynamics of the KH-QUA2 region of the Xenopus STAR/GSG Quaking protein.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 15811367 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Maguire Mahon L . 2 Guler-Gane Gulin . . 3 Nietlispach Daniel . . 4 Raine Andrew RC . 5 Zorn Aaron M . 6 Standart Nancy . . 7 Broadhurst Richard W . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 348 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 265 _Page_last 279 _Year 2005 _Details . loop_ _Keyword NMR stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name pXqua _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label pxqua $KH-QUA2_region_of_the_Xenopus_STAR-GSG_Quaking_protein stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state protein _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details 'KH-QUA2 region of the Xenopus STAR/GSG Quaking protein' save_ ######################## # Monomeric polymers # ######################## save_KH-QUA2_region_of_the_Xenopus_STAR-GSG_Quaking_protein _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common pxqua _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 134 _Mol_residue_sequence . loop_ _Residue_seq_code _Residue_label 1 GLN 2 LEU 3 GLN 4 GLU 5 LYS 6 LEU 7 TYR 8 VAL 9 PRO 10 VAL 11 LYS 12 GLU 13 TYR 14 PRO 15 ASP 16 PHE 17 ASN 18 PHE 19 VAL 20 GLY 21 ARG 22 ILE 23 LEU 24 GLY 25 PRO 26 ARG 27 GLY 28 LEU 29 THR 30 ALA 31 LYS 32 GLN 33 LEU 34 GLU 35 ALA 36 GLU 37 THR 38 GLY 39 CYS 40 LYS 41 ILE 42 MET 43 VAL 44 ARG 45 GLY 46 LYS 47 GLY 48 SER 49 MET 50 ARG 51 ASP 52 LYS 53 LYS 54 LYS 55 GLU 56 GLU 57 GLN 58 ASN 59 ARG 60 GLY 61 LYS 62 PRO 63 ASN 64 TRP 65 GLU 66 HIS 67 LEU 68 ASN 69 GLU 70 ASP 71 LEU 72 HIS 73 VAL 74 LEU 75 ILE 76 THR 77 VAL 78 GLU 79 ASP 80 ALA 81 GLN 82 ASN 83 ARG 84 ALA 85 GLU 86 LEU 87 LYS 88 LEU 89 LYS 90 ARG 91 ALA 92 VAL 93 GLU 94 GLU 95 VAL 96 LYS 97 LYS 98 LEU 99 LEU 100 VAL 101 PRO 102 ALA 103 ALA 104 GLU 105 GLY 106 GLU 107 ASP 108 SER 109 LEU 110 LYS 111 LYS 112 MET 113 LYS 114 LEU 115 MET 116 GLU 117 LEU 118 ALA 119 ILE 120 LEU 121 ASN 122 GLY 123 THR 124 TYR 125 ARG 126 ASP 127 ALA 128 ASN 129 LEU 130 LYS 131 SER 132 PRO 133 ALA 134 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 2BL5 "Solution Structure Of The Kh-Qua2 Region Of The Xenopus Star-Gsg Quaking Protein" 100.00 140 100.00 100.00 7.47e-91 DBJ BAB11981 "QKI-5 [Canis lupus familiaris]" 100.00 341 97.76 100.00 5.35e-88 DBJ BAB23859 "unnamed protein product [Mus musculus]" 100.00 299 97.76 100.00 7.98e-89 DBJ BAB47360 "QKI [Felis catus]" 100.00 341 97.76 100.00 5.35e-88 DBJ BAB55032 "unnamed protein product [Homo sapiens]" 100.00 323 97.76 100.00 2.86e-88 DBJ BAB62175 "QKI [Rattus norvegicus]" 87.31 205 97.44 100.00 7.29e-76 EMBL CAB37614 "QKI [Mus musculus]" 100.00 277 97.76 100.00 3.50e-89 EMBL CAB37615 "QKI [Mus musculus]" 100.00 271 97.76 100.00 2.56e-89 EMBL CAB37616 "QKI [Mus musculus]" 100.00 293 97.76 100.00 5.04e-89 GB AAC52491 "qkI-7 [Mus musculus]" 100.00 325 97.76 100.00 3.87e-88 GB AAC63042 "KH domain RNA binding protein QKI-7B [Mus musculus]" 100.00 338 97.76 100.00 4.99e-88 GB AAC99452 "KH domain RNA binding protein QKI-5A [Mus musculus]" 100.00 344 97.76 100.00 9.14e-88 GB AAC99453 "KH domain RNA binding protein QKI-5B [Mus musculus]" 100.00 319 97.76 100.00 2.70e-88 GB AAC99454 "KH domain RNA binding protein QKI-6 [Mus musculus]" 100.00 319 97.76 100.00 2.70e-88 PRF 2208447A "RNA-binding/signal transduction protein:ISOTYPE=I" 100.00 325 97.76 100.00 3.87e-88 REF NP_001003021 "protein quaking [Canis lupus familiaris]" 100.00 341 97.76 100.00 5.35e-88 REF NP_001007196 "protein quaking [Sus scrofa]" 100.00 341 97.76 100.00 5.35e-88 REF NP_001007818 "protein quaking [Bos taurus]" 100.00 341 97.76 100.00 5.35e-88 REF NP_001009232 "protein quaking [Felis catus]" 100.00 341 97.76 100.00 5.35e-88 REF NP_001075300 "protein quaking [Equus caballus]" 100.00 341 97.76 100.00 5.35e-88 SP Q32NN2 "RecName: Full=Protein quaking-A; Short=Xqua [Xenopus laevis]" 100.00 341 99.25 100.00 1.73e-88 SP Q5W9D5 "RecName: Full=Protein quaking; Short=PqkI [Sus scrofa]" 100.00 341 97.76 100.00 5.35e-88 SP Q5W9D6 "RecName: Full=Protein quaking; Short=EqkI [Equus caballus]" 100.00 341 97.76 100.00 5.35e-88 SP Q5W9D7 "RecName: Full=Protein quaking; Short=BqkI [Bos taurus]" 100.00 341 97.76 100.00 5.35e-88 SP Q6IRN2 "RecName: Full=Protein quaking-B [Xenopus laevis]" 100.00 342 98.51 100.00 2.47e-88 TPG DAA25959 "TPA: protein quaking [Bos taurus]" 100.00 293 97.76 100.00 1.78e-88 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $KH-QUA2_region_of_the_Xenopus_STAR-GSG_Quaking_protein 'African clawed frog' 8355 Eukaryota Metazoa Xenopus laevis stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Variant _Vector_name $KH-QUA2_region_of_the_Xenopus_STAR-GSG_Quaking_protein 'recombinant technology' 'Escherichia coli' . . BL21 DE3 . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '13C,15N double labelled protein sample' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $KH-QUA2_region_of_the_Xenopus_STAR-GSG_Quaking_protein 1.0 mM '[U-13C; U-15N]' dithiothreitol . mM . 'sodium phosphate' . mM . 'sodium azide' . mM . 'deuterium oxide' . mM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_HNCACB_1 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label . save_ save_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name CBCA(CO)NH _Sample_label . save_ save_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label . save_ save_HN(CO)CA_4 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CO)CA _Sample_label . save_ save_HCCH-TOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name HCCH-TOCSY _Sample_label . save_ save_15N-HSQC-NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name 15N-HSQC-NOESY _Sample_label . save_ save_15N-HSQC-TOCSY_7 _Saveframe_category NMR_applied_experiment _Experiment_name 15N-HSQC-TOCSY _Sample_label . save_ save_13C-HSQC-NOESY_8 _Saveframe_category NMR_applied_experiment _Experiment_name 13C-HSQC-NOESY _Sample_label . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.050 0.005 M pH 6.5 0.1 pH pressure 1 0.01 atm temperature 298 0.5 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name pxqua _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 1 1 GLN HA H 5.059043 0.02 1 2 1 1 GLN HB2 H 1.914164 0.02 2 3 1 1 GLN HB3 H 1.960025 0.02 2 4 1 1 GLN HG2 H 2.033439 0.02 2 5 1 1 GLN HG3 H 2.171195 0.02 2 6 1 1 GLN HE21 H 6.651605 0.02 2 7 1 1 GLN HE22 H 7.422645 0.02 2 8 1 1 GLN CA C 54.813 0.05 1 9 1 1 GLN CB C 30.908 0.05 1 10 1 1 GLN CG C 34.524 0.05 1 11 1 1 GLN NE2 N 111.121 0.05 1 12 2 2 LEU H H 8.704939 0.02 1 13 2 2 LEU HA H 4.663 0.02 1 14 2 2 LEU HG H 1.389928 0.02 1 15 2 2 LEU HD1 H 0.742 0.02 2 16 2 2 LEU HD2 H 0.852 0.02 2 17 2 2 LEU CA C 53.627 0.05 1 18 2 2 LEU CB C 45.448 0.05 1 19 2 2 LEU CG C 27.11 0.05 1 20 2 2 LEU CD1 C 24.101 0.05 2 21 2 2 LEU CD2 C 24.101 0.05 2 22 2 2 LEU N N 125.137 0.05 1 23 3 3 GLN H H 8.222132 0.02 1 24 3 3 GLN HA H 5.586411 0.02 1 25 3 3 GLN HB2 H 1.731366 0.02 2 26 3 3 GLN HB3 H 1.874207 0.02 2 27 3 3 GLN HG2 H 1.964152 0.02 2 28 3 3 GLN HG3 H 2.117864 0.02 2 29 3 3 GLN HE21 H 6.597847 0.02 2 30 3 3 GLN HE22 H 7.350217 0.02 2 31 3 3 GLN CA C 53.9 0.05 1 32 3 3 GLN CB C 33.684 0.05 1 33 3 3 GLN CG C 33.333 0.05 1 34 3 3 GLN N N 115.916 0.05 1 35 3 3 GLN NE2 N 110.833 0.05 1 36 4 4 GLU H H 8.875656 0.02 1 37 4 4 GLU HA H 4.522983 0.02 1 38 4 4 GLU HB2 H 1.560257 0.02 2 39 4 4 GLU HB3 H 1.752106 0.02 2 40 4 4 GLU HG2 H 2.031657 0.02 2 41 4 4 GLU HG3 H 2.095824 0.02 2 42 4 4 GLU CA C 55.589 0.05 1 43 4 4 GLU CB C 34.407 0.05 1 44 4 4 GLU CG C 35.932 0.05 1 45 4 4 GLU N N 121.604 0.05 1 46 5 5 LYS H H 8.492893 0.02 1 47 5 5 LYS HA H 5.035143 0.02 1 48 5 5 LYS HB2 H 1.039384 0.02 2 49 5 5 LYS HB3 H 1.304178 0.02 2 50 5 5 LYS HG2 H 0.6809568 0.02 2 51 5 5 LYS HG3 H 0.9859913 0.02 2 52 5 5 LYS HD2 H 0.8866163 0.02 2 53 5 5 LYS HD3 H 1.115307 0.02 2 54 5 5 LYS CA C 54.815 0.05 1 55 5 5 LYS CB C 34.978 0.05 1 56 5 5 LYS CG C 25.897 0.05 1 57 5 5 LYS CD C 29.706 0.05 1 58 5 5 LYS CE C 41.393 0.05 1 59 5 5 LYS N N 123.592 0.05 1 60 6 6 LEU H H 8.8627 0.02 1 61 6 6 LEU HA H 4.638418 0.02 1 62 6 6 LEU HG H 1.439903 0.02 1 63 6 6 LEU HD1 H 0.7435453 0.02 2 64 6 6 LEU HD2 H 0.8112912 0.02 2 65 6 6 LEU CA C 52.959 0.05 1 66 6 6 LEU CB C 43.782 0.05 1 67 6 6 LEU CG C 26.905 0.05 1 68 6 6 LEU CD1 C 24.842 0.05 2 69 6 6 LEU CD2 C 24.841 0.05 2 70 6 6 LEU N N 124.635 0.05 1 71 7 7 TYR H H 8.860485 0.02 1 72 7 7 TYR HA H 4.326547 0.02 1 73 7 7 TYR HB2 H 2.746884 0.02 2 74 7 7 TYR HB3 H 3.010235 0.02 2 75 7 7 TYR CA C 59.922 0.05 1 76 7 7 TYR CB C 37.916 0.05 1 77 7 7 TYR CD1 C 133.287 0.05 3 78 7 7 TYR CE1 C 117.923 0.05 3 79 7 7 TYR N N 123.1312 0.05 1 80 8 8 VAL H H 7.759424 0.02 1 81 8 8 VAL HA H 3.883169 0.02 1 82 8 8 VAL HB H 1.535928 0.02 1 83 8 8 VAL HG1 H 0.2384026 0.02 2 84 8 8 VAL HG2 H 0.570821 0.02 2 85 8 8 VAL CG1 C 21.76284 0.05 2 86 8 8 VAL CG2 C 21.62974 0.05 2 87 8 8 VAL N N 123.696 0.05 1 88 9 9 PRO HA H 4.977947 0.02 1 89 9 9 PRO HB2 H 1.95 0.02 2 90 9 9 PRO HB3 H 2.597982 0.02 2 91 9 9 PRO HG2 H 2.004 0.02 2 92 9 9 PRO HG3 H 2.251814 0.02 2 93 9 9 PRO CA C 63.611 0.05 1 94 9 9 PRO CB C 28.122 0.05 1 95 9 9 PRO CG C 27.54 0.05 1 96 10 10 VAL H H 8.479692 0.02 1 97 10 10 VAL HA H 3.9294 0.02 1 98 10 10 VAL HB H 2.143011 0.02 1 99 10 10 VAL CA C 64.913 0.05 1 100 10 10 VAL CB C 32.304 0.05 1 101 10 10 VAL CG1 C 21.764 0.05 2 102 10 10 VAL N N 121.822 0.05 1 103 11 11 LYS H H 8.289858 0.02 1 104 11 11 LYS HA H 3.969236 0.02 1 105 11 11 LYS HB2 H 1.670731 0.02 2 106 11 11 LYS HB3 H 1.732614 0.02 2 107 11 11 LYS HG2 H 1.407927 0.02 2 108 11 11 LYS HG3 H 1.313008 0.02 2 109 11 11 LYS CA C 58.486 0.05 1 110 11 11 LYS CB C 31.872 0.05 1 111 11 11 LYS CG C 25.095 0.05 1 112 11 11 LYS CD C 28.997 0.05 1 113 11 11 LYS CE C 41.898 0.05 1 114 11 11 LYS N N 117.656 0.05 1 115 12 12 GLU H H 7.78347 0.02 1 116 12 12 GLU HA H 3.797128 0.02 1 117 12 12 GLU HB2 H 1.44199 0.02 2 118 12 12 GLU HB3 H 1.85752 0.02 2 119 12 12 GLU HG2 H 1.910373 0.02 2 120 12 12 GLU HG3 H 2.026762 0.02 2 121 12 12 GLU CA C 58.484 0.05 1 122 12 12 GLU CB C 30.303 0.05 1 123 12 12 GLU CG C 37.05 0.05 1 124 12 12 GLU N N 117.551 0.05 1 125 13 13 TYR H H 7.259903 0.02 1 126 13 13 TYR HA H 5.020473 0.02 1 127 13 13 TYR HB2 H 2.977839 0.02 2 128 13 13 TYR CE1 C 117.8486 0.05 3 129 13 13 TYR N N 115.336 0.05 1 130 14 14 PRO HA H 4.653768 0.02 1 131 14 14 PRO HB2 H 1.924707 0.02 2 132 14 14 PRO HB3 H 2.292 0.02 2 133 14 14 PRO HG2 H 1.869 0.02 2 134 14 14 PRO HG3 H 1.951 0.02 2 135 14 14 PRO CA C 64.994 0.05 1 136 14 14 PRO CB C 32.258 0.05 1 137 14 14 PRO CG C 27.291 0.05 1 138 15 15 ASP H H 8.508529 0.02 1 139 15 15 ASP HA H 4.725 0.02 1 140 15 15 ASP HB2 H 2.575601 0.02 2 141 15 15 ASP HB3 H 2.751347 0.02 2 142 15 15 ASP CA C 53.793 0.05 1 143 15 15 ASP CB C 41.324 0.05 1 144 15 15 ASP N N 116.05 0.05 1 145 16 16 PHE H H 7.466622 0.02 1 146 16 16 PHE HA H 4.171384 0.02 1 147 16 16 PHE HB2 H 2.419742 0.02 2 148 16 16 PHE HB3 H 2.755177 0.02 2 149 16 16 PHE HZ H 6.987109 0.02 1 150 16 16 PHE CA C 58.289 0.05 1 151 16 16 PHE CB C 40.94 0.05 1 152 16 16 PHE CD1 C 131.653 0.05 3 153 16 16 PHE CE1 C 130.671 0.05 3 154 16 16 PHE CZ C 128.801 0.05 1 155 16 16 PHE N N 121.518 0.05 1 156 17 17 ASN H H 7.743032 0.02 1 157 17 17 ASN HA H 4.701 0.02 1 158 17 17 ASN HB2 H 2.480051 0.02 2 159 17 17 ASN HB3 H 2.611381 0.02 2 160 17 17 ASN HD21 H 6.878285 0.02 2 161 17 17 ASN HD22 H 7.544818 0.02 2 162 17 17 ASN CA C 51.129 0.05 1 163 17 17 ASN CB C 35.996 0.05 1 164 17 17 ASN N N 124.219 0.05 1 165 17 17 ASN ND2 N 110.671 0.05 1 166 18 18 PHE H H 8.184158 0.02 1 167 18 18 PHE HA H 4.016948 0.02 1 168 18 18 PHE HB2 H 2.809424 0.02 2 169 18 18 PHE HZ H 6.988057 0.02 1 170 18 18 PHE CA C 62.721 0.05 1 171 18 18 PHE CB C 40.573 0.05 1 172 18 18 PHE CE1 C 132.337 0.05 3 173 18 18 PHE CZ C 130.094 0.05 1 174 18 18 PHE N N 124.149 0.05 1 175 19 19 VAL H H 8.268217 0.02 1 176 19 19 VAL HA H 3.309248 0.02 1 177 19 19 VAL HB H 1.967733 0.02 1 178 19 19 VAL HG1 H 0.8796919 0.02 2 179 19 19 VAL HG2 H 0.9863212 0.02 2 180 19 19 VAL CA C 68.186 0.05 1 181 19 19 VAL CB C 31.748 0.05 1 182 19 19 VAL CG1 C 21.714 0.05 2 183 19 19 VAL CG2 C 21.714 0.05 2 184 19 19 VAL N N 118.353 0.05 1 185 20 20 GLY H H 7.573565 0.02 1 186 20 20 GLY HA2 H 3.581559 0.02 2 187 20 20 GLY HA3 H 3.750366 0.02 2 188 20 20 GLY CA C 47.311 0.05 1 189 20 20 GLY N N 103.29 0.05 1 190 21 21 ARG H H 7.082166 0.02 1 191 21 21 ARG HA H 4.065206 0.02 1 192 21 21 ARG HB2 H 1.83661 0.02 2 193 21 21 ARG HB3 H 1.999188 0.02 2 194 21 21 ARG HG2 H 1.46 0.02 2 195 21 21 ARG HG3 H 1.757208 0.02 2 196 21 21 ARG HD2 H 3.241798 0.02 2 197 21 21 ARG HD3 H 3.337642 0.02 2 198 21 21 ARG HE H 7.457876 0.02 1 199 21 21 ARG CA C 57.985 0.05 1 200 21 21 ARG CB C 30.453 0.05 1 201 21 21 ARG CG C 27.397 0.05 1 202 21 21 ARG CD C 43.306 0.05 1 203 21 21 ARG N N 120.9606 0.05 1 204 21 21 ARG NE N 84.624 0.05 1 205 22 22 ILE H H 7.989686 0.02 1 206 22 22 ILE HA H 3.674882 0.02 1 207 22 22 ILE HB H 1.573814 0.02 1 208 22 22 ILE HG2 H 0.6160495 0.02 2 209 22 22 ILE HD1 H 0.6046941 0.02 2 210 22 22 ILE CA C 63.879 0.05 1 211 22 22 ILE CB C 38.777 0.05 1 212 22 22 ILE CG2 C 17.419 0.05 1 213 22 22 ILE CD1 C 14.02 0.05 1 214 22 22 ILE N N 117.5445 0.05 1 215 23 23 LEU H H 7.784512 0.02 1 216 23 23 LEU HA H 4.08945 0.02 1 217 23 23 LEU HG H 1.608 0.02 1 218 23 23 LEU HD1 H 0.7905516 0.02 2 219 23 23 LEU HD2 H 0.8336889 0.02 2 220 23 23 LEU CA C 56.822 0.05 1 221 23 23 LEU CB C 42.607 0.05 1 222 23 23 LEU CG C 26.899 0.05 1 223 23 23 LEU N N 111.326 0.05 1 224 24 24 GLY H H 7.407215 0.02 1 225 24 24 GLY HA2 H 3.967402 0.02 2 226 24 24 GLY HA3 H 4.407619 0.02 2 227 24 24 GLY CA C 44.547 0.05 1 228 24 24 GLY N N 104.594 0.05 1 229 25 25 PRO HD2 H 2.897217 0.02 2 230 27 27 GLY H H 7.866857 0.02 1 231 27 27 GLY HA2 H 3.677906 0.02 2 232 27 27 GLY HA3 H 4.01881 0.02 2 233 27 27 GLY CA C 46.573 0.05 1 234 27 27 GLY N N 105.668 0.05 1 235 28 28 LEU H H 7.973504 0.02 1 236 28 28 LEU HA H 3.935206 0.02 1 237 28 28 LEU N N 118.726 0.05 1 238 29 29 THR H H 8.27652 0.02 1 239 29 29 THR HA H 3.926651 0.02 1 240 29 29 THR HB H 3.759164 0.02 1 241 29 29 THR HG2 H 1.161514 0.02 2 242 29 29 THR CA C 66.56 0.05 1 243 29 29 THR CB C 67.715 0.05 1 244 29 29 THR CG2 C 22.714 0.05 1 245 29 29 THR N N 118.355 0.05 1 246 30 30 ALA H H 7.447829 0.02 1 247 30 30 ALA HA H 3.95933 0.02 1 248 30 30 ALA HB H 1.420167 0.02 2 249 30 30 ALA CA C 55.664 0.05 1 250 30 30 ALA CB C 17.996 0.05 1 251 30 30 ALA N N 124.418 0.05 1 252 31 31 LYS H H 7.945615 0.02 1 253 31 31 LYS HA H 4.075374 0.02 1 254 31 31 LYS HB2 H 1.854 0.02 2 255 31 31 LYS HB3 H 2.039899 0.02 2 256 31 31 LYS CA C 59.359 0.05 1 257 31 31 LYS CB C 32.697 0.05 1 258 31 31 LYS CD C 28.996 0.05 1 259 31 31 LYS CE C 41.892 0.05 1 260 31 31 LYS N N 116.371 0.05 1 261 32 32 GLN H H 8.120568 0.02 1 262 32 32 GLN HA H 4.068163 0.02 1 263 32 32 GLN HB2 H 2.127 0.02 2 264 32 32 GLN HB3 H 2.234371 0.02 2 265 32 32 GLN HG2 H 2.304 0.02 2 266 32 32 GLN HG3 H 2.444 0.02 2 267 32 32 GLN HE21 H 6.707767 0.02 2 268 32 32 GLN HE22 H 7.599319 0.02 2 269 32 32 GLN CA C 58.907 0.05 1 270 32 32 GLN CB C 27.887 0.05 1 271 32 32 GLN CG C 33.693 0.05 1 272 32 32 GLN N N 120.351 0.05 1 273 32 32 GLN NE2 N 111.326 0.05 1 274 33 33 LEU H H 7.974453 0.02 1 275 33 33 LEU HA H 4.107916 0.02 1 276 33 33 LEU HB2 H 1.274224 0.02 2 277 33 33 LEU HB3 H 1.830245 0.02 2 278 33 33 LEU HG H 1.694 0.02 1 279 33 33 LEU HD1 H 0.7792851 0.02 2 280 33 33 LEU HD2 H 0.843 0.02 2 281 33 33 LEU CA C 57.982 0.05 1 282 33 33 LEU CB C 42.593 0.05 1 283 33 33 LEU CG C 26.892 0.05 1 284 33 33 LEU CD1 C 24.148 0.05 2 285 33 33 LEU CD2 C 24.148 0.05 2 286 33 33 LEU N N 120.28 0.05 1 287 34 34 GLU H H 8.544767 0.02 1 288 34 34 GLU HA H 4.105466 0.02 1 289 34 34 GLU HB2 H 1.940392 0.02 2 290 34 34 GLU HB3 H 2.24678 0.02 2 291 34 34 GLU CA C 59.879 0.05 1 292 34 34 GLU CB C 29.942 0.05 1 293 34 34 GLU CG C 34.124 0.05 1 294 34 34 GLU N N 123.03 0.05 1 295 35 35 ALA H H 7.860095 0.02 1 296 35 35 ALA HA H 4.051226 0.02 1 297 35 35 ALA HB H 1.497337 0.02 2 298 35 35 ALA CA C 54.898 0.05 1 299 35 35 ALA CB C 18.216 0.05 1 300 35 35 ALA N N 122.046 0.05 1 301 36 36 GLU H H 8.215427 0.02 1 302 36 36 GLU HA H 4.071322 0.02 1 303 36 36 GLU HB2 H 1.974595 0.02 2 304 36 36 GLU HB3 H 2.082916 0.02 2 305 36 36 GLU CA C 58.592 0.05 1 306 36 36 GLU CB C 30.802 0.05 1 307 36 36 GLU CG C 36.309 0.05 1 308 36 36 GLU N N 115.3569 0.05 1 309 37 37 THR H H 7.94479 0.02 1 310 37 37 THR HA H 4.35896 0.02 1 311 37 37 THR HB H 4.235471 0.02 1 312 37 37 THR HG2 H 1.107922 0.02 2 313 37 37 THR CA C 62.572 0.05 1 314 37 37 THR CB C 72.63 0.05 1 315 37 37 THR CG2 C 21.128 0.05 1 316 37 37 THR N N 125.479 0.05 1 317 38 38 GLY H H 8.150395 0.02 1 318 38 38 GLY HA2 H 3.823958 0.02 2 319 38 38 GLY HA3 H 4.077615 0.02 2 320 38 38 GLY CA C 45.982 0.05 1 321 38 38 GLY N N 109.106 0.05 1 322 39 39 CYS H H 7.459463 0.02 1 323 39 39 CYS HA H 4.814808 0.02 1 324 39 39 CYS HB2 H 2.428 0.02 2 325 39 39 CYS HB3 H 2.482 0.02 2 326 39 39 CYS CA C 57.767 0.05 1 327 39 39 CYS CB C 30.499 0.05 1 328 39 39 CYS N N 116.934 0.05 1 329 40 40 LYS H H 8.714034 0.02 1 330 40 40 LYS HA H 4.500618 0.02 1 331 40 40 LYS HB2 H 1.553167 0.02 2 332 40 40 LYS HB3 H 1.663183 0.02 2 333 40 40 LYS HG2 H 1.179399 0.02 2 334 40 40 LYS HG3 H 1.301648 0.02 2 335 40 40 LYS HD2 H 1.524 0.02 2 336 40 40 LYS HD3 H 1.68 0.02 2 337 40 40 LYS CA C 54.858 0.05 1 338 40 40 LYS CB C 33.349 0.05 1 339 40 40 LYS CG C 24.504 0.05 1 340 40 40 LYS CD C 28.774 0.05 1 341 40 40 LYS CE C 42.184 0.05 1 342 40 40 LYS N N 119.612 0.05 1 343 41 41 ILE H H 9.259254 0.02 1 344 41 41 ILE HA H 4.558104 0.02 1 345 41 41 ILE HB H 1.553633 0.02 1 346 41 41 ILE HG12 H 0.9293278 0.02 2 347 41 41 ILE HG13 H 1.284205 0.02 2 348 41 41 ILE HG2 H 0.484848 0.02 2 349 41 41 ILE HD1 H 0.5571688 0.02 2 350 41 41 ILE CA C 60.023 0.05 1 351 41 41 ILE CB C 40.281 0.05 1 352 41 41 ILE CG1 C 27.626 0.05 1 353 41 41 ILE CG2 C 17.002 0.05 1 354 41 41 ILE CD1 C 13.624 0.05 1 355 41 41 ILE N N 123.3203 0.05 1 356 42 42 MET H H 8.623638 0.02 1 357 42 42 MET HA H 4.533984 0.02 1 358 42 42 MET HG2 H 2.149032 0.02 2 359 42 42 MET HG3 H 2.397656 0.02 2 360 42 42 MET CA C 54.02 0.05 1 361 42 42 MET CB C 37.021 0.05 1 362 42 42 MET CG C 32 0.05 1 363 42 42 MET N N 123.633 0.05 1 364 43 43 VAL H H 8.756972 0.02 1 365 43 43 VAL HA H 4.380478 0.02 1 366 43 43 VAL HB H 1.897784 0.02 1 367 43 43 VAL HG1 H 0.7696106 0.02 2 368 43 43 VAL HG2 H 0.8122666 0.02 2 369 43 43 VAL CA C 62.308 0.05 1 370 43 43 VAL CB C 31.493 0.05 1 371 43 43 VAL CG1 C 22.158 0.05 2 372 43 43 VAL CG2 C 22.158 0.05 2 373 43 43 VAL N N 122.809 0.05 1 374 44 44 ARG H H 8.587639 0.02 1 375 44 44 ARG HA H 4.273838 0.02 1 376 44 44 ARG HG2 H 0.4855886 0.02 2 377 44 44 ARG HG3 H 0.9036362 0.02 2 378 44 44 ARG HD2 H 2.311589 0.02 2 379 44 44 ARG HD3 H 2.414302 0.02 2 380 44 44 ARG HE H 7.21104 0.02 1 381 44 44 ARG CA C 53.778 0.05 1 382 44 44 ARG CG C 26.865 0.05 1 383 44 44 ARG CD C 43.619 0.05 1 384 44 44 ARG N N 128.393 0.05 1 385 44 44 ARG NE N 83.517 0.05 1 386 45 45 GLY H H 9.830504 0.02 1 387 45 45 GLY HA2 H 4.307825 0.02 2 388 45 45 GLY HA3 H 4.810131 0.02 2 389 45 45 GLY CA C 43.428 0.05 1 390 45 45 GLY N N 107.328 0.05 1 391 46 46 LYS H H 8.993667 0.02 1 392 46 46 LYS HA H 4.082056 0.02 1 393 46 46 LYS CA C 58.598 0.05 1 394 46 46 LYS CB C 32.749 0.05 1 395 46 46 LYS CG C 24.703 0.05 1 396 46 46 LYS CD C 29.264 0.05 1 397 46 46 LYS CE C 41.903 0.05 1 398 46 46 LYS N N 121.7324 0.05 1 399 47 47 GLY H H 10.83638 0.02 1 400 47 47 GLY HA2 H 3.796755 0.02 2 401 47 47 GLY HA3 H 4.293316 0.02 2 402 47 47 GLY CA C 45.037 0.05 1 403 47 47 GLY N N 116.662 0.05 1 404 48 48 SER H H 8.421703 0.02 1 405 48 48 SER HA H 3.632717 0.02 1 406 48 48 SER CA C 61.016 0.05 1 407 48 48 SER CB C 62.817 0.05 1 408 48 48 SER N N 115.547 0.05 1 409 49 49 MET H H 8.271134 0.02 1 410 49 49 MET HA H 4.387887 0.02 1 411 49 49 MET N N 118.131 0.05 1 412 50 50 ARG H H 7.955 0.02 1 413 50 50 ARG HA H 3.778 0.02 1 414 50 50 ARG HB2 H 1.884 0.02 2 415 50 50 ARG HB3 H 1.906 0.02 2 416 50 50 ARG HG2 H 1.559 0.02 2 417 50 50 ARG HD2 H 3.044784 0.02 2 418 50 50 ARG HD3 H 3.149 0.02 2 419 50 50 ARG CA C 57.125 0.05 1 420 50 50 ARG CB C 28.013 0.05 1 421 50 50 ARG CG C 26.908 0.05 1 422 50 50 ARG CD C 43.405 0.05 1 423 51 51 ASP H H 8.026598 0.02 1 424 51 51 ASP HA H 4.452347 0.02 1 425 51 51 ASP CA C 53.831 0.05 1 426 51 51 ASP CB C 40.841 0.05 1 427 51 51 ASP N N 116.5357 0.05 1 428 52 52 LYS H H 8.625285 0.02 1 429 52 52 LYS HA H 3.890496 0.02 1 430 52 52 LYS CA C 59.643 0.05 1 431 52 52 LYS CB C 32.624 0.05 1 432 52 52 LYS CG C 24.727 0.05 1 433 52 52 LYS CD C 29.479 0.05 1 434 52 52 LYS CE C 42.159 0.05 1 435 52 52 LYS N N 126.049 0.05 1 436 53 53 LYS H H 8.020688 0.02 1 437 53 53 LYS HA H 3.997927 0.02 1 438 53 53 LYS HG2 H 1.27446 0.02 2 439 53 53 LYS HG3 H 1.394284 0.02 2 440 53 53 LYS CA C 58.844 0.05 1 441 53 53 LYS CB C 31.638 0.05 1 442 53 53 LYS CG C 24.751 0.05 1 443 53 53 LYS CD C 29.09 0.05 1 444 53 53 LYS CE C 42.009 0.05 1 445 53 53 LYS N N 119.013 0.05 1 446 54 54 LYS H H 7.595608 0.02 1 447 54 54 LYS HA H 3.767651 0.02 1 448 54 54 LYS HB2 H 1.484324 0.02 2 449 54 54 LYS HB3 H 1.544 0.02 2 450 54 54 LYS HG2 H 1.146159 0.02 2 451 54 54 LYS HG3 H 1.27344 0.02 2 452 54 54 LYS CA C 58.741 0.05 1 453 54 54 LYS CB C 32.463 0.05 1 454 54 54 LYS CG C 25.535 0.05 1 455 54 54 LYS CD C 29.441 0.05 1 456 54 54 LYS CE C 41.988 0.05 1 457 54 54 LYS N N 120.175 0.05 1 458 55 55 GLU H H 7.888193 0.02 1 459 55 55 GLU HA H 3.689103 0.02 1 460 55 55 GLU HG2 H 2.062489 0.02 2 461 55 55 GLU HG3 H 2.452607 0.02 2 462 55 55 GLU CA C 60.386 0.05 1 463 55 55 GLU CB C 29.422 0.05 1 464 55 55 GLU CG C 38.533 0.05 1 465 55 55 GLU N N 118.777 0.05 1 466 56 56 GLU H H 7.717647 0.02 1 467 56 56 GLU HA H 3.802483 0.02 1 468 56 56 GLU HB2 H 1.952 0.02 2 469 56 56 GLU HB3 H 2.041851 0.02 2 470 56 56 GLU HG2 H 2.184291 0.02 2 471 56 56 GLU HG3 H 2.2943 0.02 2 472 56 56 GLU CA C 58.6 0.05 1 473 56 56 GLU CB C 29.391 0.05 1 474 56 56 GLU CG C 36.28 0.05 1 475 56 56 GLU N N 117.1917 0.05 1 476 57 57 GLN H H 7.455932 0.02 1 477 57 57 GLN HA H 3.925338 0.02 1 478 57 57 GLN HB2 H 1.899 0.02 2 479 57 57 GLN HB3 H 1.931 0.02 2 480 57 57 GLN HG2 H 2.238392 0.02 2 481 57 57 GLN HG3 H 2.361662 0.02 2 482 57 57 GLN HE21 H 6.707496 0.02 2 483 57 57 GLN HE22 H 7.324251 0.02 2 484 57 57 GLN CA C 57.698 0.05 1 485 57 57 GLN CB C 28.512 0.05 1 486 57 57 GLN CG C 33.95 0.05 1 487 57 57 GLN N N 116.196 0.05 1 488 57 57 GLN NE2 N 111.124 0.05 1 489 58 58 ASN H H 7.359478 0.02 1 490 58 58 ASN HA H 4.172473 0.02 1 491 58 58 ASN HB2 H 1.609815 0.02 2 492 58 58 ASN HB3 H 1.729136 0.02 2 493 58 58 ASN CA C 53.126 0.05 1 494 58 58 ASN CB C 38.666 0.05 1 495 58 58 ASN N N 116.014 0.05 1 496 59 59 ARG H H 7.392929 0.02 1 497 59 59 ARG HA H 3.831652 0.02 1 498 59 59 ARG HE H 7.184 0.02 1 499 59 59 ARG CA C 58.913 0.05 1 500 59 59 ARG CB C 29.723 0.05 1 501 59 59 ARG CG C 27.09 0.05 1 502 59 59 ARG CD C 43.295 0.05 1 503 59 59 ARG N N 119.713 0.05 1 504 59 59 ARG NE N 84.078 0.05 1 505 60 60 GLY H H 8.644734 0.02 1 506 60 60 GLY HA2 H 4.03409 0.02 2 507 60 60 GLY HA3 H 3.717577 0.02 2 508 60 60 GLY CA C 45.191 0.05 1 509 60 60 GLY N N 111.6638 0.05 1 510 61 61 LYS H H 7.851043 0.02 1 511 61 61 LYS HA H 4.539732 0.02 1 512 61 61 LYS N N 121.221 0.05 1 513 62 62 PRO HA H 4.362798 0.02 1 514 62 62 PRO HB2 H 1.77798 0.02 2 515 62 62 PRO HB3 H 2.277644 0.02 2 516 62 62 PRO CA C 64.154 0.05 1 517 62 62 PRO CB C 31.728 0.05 1 518 62 62 PRO CD C 50.613 0.05 1 519 63 63 ASN H H 8.785313 0.02 1 520 63 63 ASN HA H 4.33198 0.02 1 521 63 63 ASN HB2 H 2.62047 0.02 2 522 63 63 ASN HB3 H 2.994039 0.02 2 523 63 63 ASN HD21 H 6.837751 0.02 2 524 63 63 ASN HD22 H 7.237235 0.02 2 525 63 63 ASN CA C 56.309 0.05 1 526 63 63 ASN CB C 37.648 0.05 1 527 63 63 ASN N N 115.285 0.05 1 528 63 63 ASN ND2 N 112.89 0.05 1 529 64 64 TRP H H 8.051316 0.02 1 530 64 64 TRP HA H 4.344141 0.02 1 531 64 64 TRP HB2 H 2.858216 0.02 2 532 64 64 TRP HB3 H 3.342868 0.02 2 533 64 64 TRP HD1 H 7.019104 0.02 1 534 64 64 TRP HE1 H 10.02768 0.02 1 535 64 64 TRP HE3 H 7.399606 0.02 1 536 64 64 TRP HZ2 H 7.402524 0.02 1 537 64 64 TRP HZ3 H 7.280282 0.02 1 538 64 64 TRP HH2 H 7.205962 0.02 1 539 64 64 TRP CA C 56.492 0.05 1 540 64 64 TRP CD1 C 128.326 0.05 1 541 64 64 TRP CE3 C 122.121 0.05 1 542 64 64 TRP CZ2 C 115.024 0.05 1 543 64 64 TRP CZ3 C 124.365 0.05 1 544 64 64 TRP CH2 C 119.835 0.05 1 545 64 64 TRP N N 119.457 0.05 1 546 64 64 TRP NE1 N 128.575 0.05 1 547 65 65 GLU H H 9.440186 0.02 1 548 65 65 GLU HA H 3.902359 0.02 1 549 65 65 GLU HG2 H 2.308 0.02 2 550 65 65 GLU HG3 H 2.471453 0.02 2 551 65 65 GLU CA C 60.783 0.05 1 552 65 65 GLU CB C 27.84 0.05 1 553 65 65 GLU CG C 36.754 0.05 1 554 65 65 GLU N N 124.957 0.05 1 555 66 66 HIS H H 7.921121 0.02 1 556 66 66 HIS HA H 4.517592 0.02 1 557 66 66 HIS HD2 H 7.081334 0.02 1 558 66 66 HIS HE1 H 7.819 0.02 1 559 66 66 HIS CA C 57.794 0.05 1 560 66 66 HIS CB C 30.996 0.05 1 561 66 66 HIS CD2 C 118.584 0.05 1 562 66 66 HIS CE1 C 138.828 0.05 1 563 66 66 HIS N N 115.476 0.05 1 564 67 67 LEU H H 7.254722 0.02 1 565 67 67 LEU HA H 3.886695 0.02 1 566 67 67 LEU HB2 H 1.531 0.02 2 567 67 67 LEU HB3 H 1.84402 0.02 2 568 67 67 LEU CA C 56.364 0.05 1 569 67 67 LEU CB C 41.289 0.05 1 570 67 67 LEU CG C 24.702 0.05 1 571 67 67 LEU N N 118.183 0.05 1 572 68 68 ASN H H 7.769253 0.02 1 573 68 68 ASN HA H 4.706 0.02 1 574 68 68 ASN HB2 H 2.739736 0.02 2 575 68 68 ASN HB3 H 2.936419 0.02 2 576 68 68 ASN HD21 H 6.999284 0.02 2 577 68 68 ASN HD22 H 7.616364 0.02 2 578 68 68 ASN CA C 53.801 0.05 1 579 68 68 ASN CB C 39.303 0.05 1 580 68 68 ASN N N 114.749 0.05 1 581 68 68 ASN ND2 N 113.286 0.05 1 582 69 69 GLU H H 8.067361 0.02 1 583 69 69 GLU HA H 4.525575 0.02 1 584 69 69 GLU CA C 55.678 0.05 1 585 69 69 GLU CB C 32.891 0.05 1 586 69 69 GLU CG C 37.411 0.05 1 587 69 69 GLU N N 120.535 0.05 1 588 70 70 ASP H H 8.657419 0.02 1 589 70 70 ASP HA H 4.60314 0.02 1 590 70 70 ASP HB2 H 2.543952 0.02 2 591 70 70 ASP HB3 H 3.044991 0.02 2 592 70 70 ASP CA C 55.164 0.05 1 593 70 70 ASP CB C 41.363 0.05 1 594 70 70 ASP N N 120.103 0.05 1 595 71 71 LEU H H 8.4581 0.02 1 596 71 71 LEU HA H 4.625855 0.02 1 597 71 71 LEU HB2 H 1.677148 0.02 2 598 71 71 LEU HB3 H 2.114794 0.02 2 599 71 71 LEU HD1 H 0.6097829 0.02 2 600 71 71 LEU HD2 H 0.7611657 0.02 2 601 71 71 LEU CA C 56.552 0.05 1 602 71 71 LEU CB C 41.7 0.05 1 603 71 71 LEU CD1 C 24.095 0.05 2 604 71 71 LEU CD2 C 24.095 0.05 2 605 71 71 LEU N N 123.114 0.05 1 606 72 72 HIS H H 9.09239 0.02 1 607 72 72 HIS HA H 5.099717 0.02 1 608 72 72 HIS HB2 H 2.02585 0.02 2 609 72 72 HIS HB3 H 2.576585 0.02 2 610 72 72 HIS HD2 H 5.963398 0.02 1 611 72 72 HIS HE1 H 7.341045 0.02 1 612 72 72 HIS CA C 55.187 0.05 1 613 72 72 HIS CB C 30.989 0.05 1 614 72 72 HIS CD2 C 127.023 0.05 1 615 72 72 HIS CE1 C 138.15 0.05 1 616 72 72 HIS N N 122.68 0.05 1 617 73 73 VAL H H 8.931649 0.02 1 618 73 73 VAL HA H 4.514111 0.02 1 619 73 73 VAL HB H 1.786827 0.02 1 620 73 73 VAL HG1 H 0.682823 0.02 2 621 73 73 VAL HG2 H 0.748 0.02 2 622 73 73 VAL CA C 60.369 0.05 1 623 73 73 VAL CB C 33.67 0.05 1 624 73 73 VAL CG1 C 22.051 0.05 2 625 73 73 VAL N N 118.306 0.05 1 626 74 74 LEU H H 9.219151 0.02 1 627 74 74 LEU HA H 4.924691 0.02 1 628 74 74 LEU HB2 H 1.087857 0.02 2 629 74 74 LEU HB3 H 1.592951 0.02 2 630 74 74 LEU HG H 1.217515 0.02 1 631 74 74 LEU HD1 H 0.6453428 0.02 2 632 74 74 LEU HD2 H 0.6931933 0.02 2 633 74 74 LEU CA C 53.454 0.05 1 634 74 74 LEU CB C 45.396 0.05 1 635 74 74 LEU CG C 27.343 0.05 1 636 74 74 LEU CD1 C 23.639 0.05 2 637 74 74 LEU CD2 C 23.639 0.05 2 638 74 74 LEU N N 129.368 0.05 1 639 75 75 ILE H H 8.838203 0.02 1 640 75 75 ILE HA H 5.051129 0.02 1 641 75 75 ILE HB H 1.477401 0.02 1 642 75 75 ILE HG2 H 0.6814491 0.02 2 643 75 75 ILE HD1 H 0.6243554 0.02 2 644 75 75 ILE CA C 59.826 0.05 1 645 75 75 ILE CB C 40.489 0.05 1 646 75 75 ILE CG2 C 19.54 0.05 1 647 75 75 ILE CD1 C 15.572 0.05 1 648 75 75 ILE N N 128.169 0.05 1 649 76 76 THR H H 8.69362 0.02 1 650 76 76 THR HA H 5.32667 0.02 1 651 76 76 THR HB H 3.978889 0.02 1 652 76 76 THR HG2 H 0.9323626 0.02 2 653 76 76 THR CA C 59.742 0.05 1 654 76 76 THR CB C 72.037 0.05 1 655 76 76 THR CG2 C 21.11 0.05 1 656 76 76 THR N N 116.264 0.05 1 657 77 77 VAL H H 8.495261 0.02 1 658 77 77 VAL HA H 4.525575 0.02 1 659 77 77 VAL HB H 2.317752 0.02 1 660 77 77 VAL HG1 H 0.8046086 0.02 2 661 77 77 VAL HG2 H 0.8930839 0.02 2 662 77 77 VAL CA C 60.668 0.05 1 663 77 77 VAL CB C 34.563 0.05 1 664 77 77 VAL CG1 C 20.705 0.05 2 665 77 77 VAL CG2 C 20.705 0.05 2 666 77 77 VAL N N 119.948 0.05 1 667 78 78 GLU H H 8.04048 0.02 1 668 78 78 GLU HA H 5.042092 0.02 1 669 78 78 GLU HB2 H 1.818 0.02 2 670 78 78 GLU HB3 H 1.896 0.02 2 671 78 78 GLU CA C 55.106 0.05 1 672 78 78 GLU CB C 31.145 0.05 1 673 78 78 GLU CG C 36.17 0.05 1 674 78 78 GLU N N 126.323 0.05 1 675 79 79 ASP H H 8.587581 0.02 1 676 79 79 ASP HA H 4.528392 0.02 1 677 79 79 ASP HB2 H 2.428616 0.02 2 678 79 79 ASP HB3 H 2.572454 0.02 2 679 79 79 ASP N N 122.544 0.05 1 680 82 82 ASN HA H 4.38451 0.02 1 681 82 82 ASN HB2 H 2.542 0.02 2 682 82 82 ASN HB3 H 2.652 0.02 2 683 82 82 ASN CA C 56.836 0.05 1 684 82 82 ASN CB C 40.975 0.05 1 685 83 83 ARG H H 7.830813 0.02 1 686 83 83 ARG HA H 4.104228 0.02 1 687 83 83 ARG N N 116.437 0.05 1 688 84 84 ALA H H 8.539552 0.02 1 689 84 84 ALA HA H 3.678344 0.02 1 690 84 84 ALA HB H 1.265926 0.02 2 691 84 84 ALA CA C 55.73 0.05 1 692 84 84 ALA CB C 18.793 0.05 1 693 84 84 ALA N N 121.283 0.05 1 694 85 85 GLU H H 8.607212 0.02 1 695 85 85 GLU HA H 3.666752 0.02 1 696 85 85 GLU HB2 H 1.887262 0.02 2 697 85 85 GLU HB3 H 1.975618 0.02 2 698 85 85 GLU CA C 59.91 0.05 1 699 85 85 GLU CB C 29.317 0.05 1 700 85 85 GLU N N 115.5233 0.05 1 701 86 86 LEU H H 7.223249 0.02 1 702 86 86 LEU HA H 3.990058 0.02 1 703 86 86 LEU HB2 H 1.553132 0.02 2 704 86 86 LEU HB3 H 1.763 0.02 2 705 86 86 LEU HD1 H 0.818 0.02 2 706 86 86 LEU HD2 H 0.871 0.02 2 707 86 86 LEU CA C 57.494 0.05 1 708 86 86 LEU CB C 41.841 0.05 1 709 86 86 LEU CD1 C 24.579 0.05 2 710 86 86 LEU CD2 C 24.577 0.05 2 711 86 86 LEU N N 119.355 0.05 1 712 87 87 LYS H H 7.854298 0.02 1 713 87 87 LYS HA H 3.853875 0.02 1 714 87 87 LYS HB2 H 1.732031 0.02 2 715 87 87 LYS HB3 H 1.895183 0.02 2 716 87 87 LYS CA C 59.915 0.05 1 717 87 87 LYS CB C 33.58 0.05 1 718 87 87 LYS CG C 24.751 0.05 1 719 87 87 LYS CD C 28.951 0.05 1 720 87 87 LYS CE C 41.908 0.05 1 721 87 87 LYS N N 120.762 0.05 1 722 88 88 LEU H H 8.174 0.02 1 723 88 88 LEU HA H 4.003735 0.02 1 724 88 88 LEU HB2 H 1.322566 0.02 2 725 88 88 LEU HB3 H 1.721751 0.02 2 726 88 88 LEU HG H 1.538 0.02 1 727 88 88 LEU HD1 H 0.806928 0.02 2 728 88 88 LEU HD2 H 0.8646215 0.02 2 729 88 88 LEU CA C 57.884 0.05 1 730 88 88 LEU CB C 42.14 0.05 1 731 88 88 LEU CG C 28.982 0.05 1 732 88 88 LEU CD1 C 24.108 0.05 2 733 88 88 LEU CD2 C 24.108 0.05 2 734 88 88 LEU N N 119.009 0.05 1 735 89 89 LYS H H 7.630948 0.02 1 736 89 89 LYS HA H 3.802259 0.02 1 737 89 89 LYS HD2 H 1.495301 0.02 2 738 89 89 LYS HD3 H 1.572148 0.02 2 739 89 89 LYS CA C 59.826 0.05 1 740 89 89 LYS CB C 32.522 0.05 1 741 89 89 LYS CG C 24.94 0.05 1 742 89 89 LYS CD C 29.479 0.05 1 743 89 89 LYS N N 116.589 0.05 1 744 90 90 ARG H H 7.530295 0.02 1 745 90 90 ARG HA H 4.079576 0.02 1 746 90 90 ARG HB2 H 1.847327 0.02 2 747 90 90 ARG HB3 H 1.901644 0.02 2 748 90 90 ARG HG2 H 1.582532 0.02 2 749 90 90 ARG HG3 H 1.665704 0.02 2 750 90 90 ARG HD2 H 3.139 0.02 2 751 90 90 ARG HD3 H 3.191 0.02 2 752 90 90 ARG CA C 58.766 0.05 1 753 90 90 ARG CB C 29.576 0.05 1 754 90 90 ARG CG C 27.093 0.05 1 755 90 90 ARG CD C 43.599 0.05 1 756 90 90 ARG N N 118.105 0.05 1 757 91 91 ALA H H 8.132043 0.02 1 758 91 91 ALA HA H 3.85271 0.02 1 759 91 91 ALA HB H 1.457919 0.02 2 760 91 91 ALA CA C 56.134 0.05 1 761 91 91 ALA CB C 19.812 0.05 1 762 91 91 ALA N N 121.107 0.05 1 763 92 92 VAL H H 8.726431 0.02 1 764 92 92 VAL HA H 3.216201 0.02 1 765 92 92 VAL HB H 2.10173 0.02 1 766 92 92 VAL HG1 H 0.8343012 0.02 2 767 92 92 VAL HG2 H 0.9094351 0.02 2 768 92 92 VAL CA C 67.269 0.05 1 769 92 92 VAL CB C 31.653 0.05 1 770 92 92 VAL CG1 C 20.866 0.05 2 771 92 92 VAL CG2 C 20.866 0.05 2 772 92 92 VAL N N 117.627 0.05 1 773 93 93 GLU H H 7.783741 0.02 1 774 93 93 GLU HA H 3.797712 0.02 1 775 93 93 GLU HB2 H 2.015706 0.02 2 776 93 93 GLU HB3 H 2.140652 0.02 2 777 93 93 GLU CA C 59.499 0.05 1 778 93 93 GLU CB C 29.336 0.05 1 779 93 93 GLU CG C 36.172 0.05 1 780 93 93 GLU N N 117.204 0.05 1 781 94 94 GLU H H 7.898128 0.02 1 782 94 94 GLU HA H 4.029905 0.02 1 783 94 94 GLU CA C 58.4 0.05 1 784 94 94 GLU CB C 29.471 0.05 1 785 94 94 GLU CG C 35.669 0.05 1 786 94 94 GLU N N 116.522 0.05 1 787 95 95 VAL H H 8.684854 0.02 1 788 95 95 VAL HA H 3.479366 0.02 1 789 95 95 VAL HB H 1.902639 0.02 1 790 95 95 VAL HG1 H 0.8072395 0.02 2 791 95 95 VAL HG2 H 0.8855278 0.02 2 792 95 95 VAL CA C 66.902 0.05 1 793 95 95 VAL CB C 30.692 0.05 1 794 95 95 VAL CG1 C 20.741 0.05 2 795 95 95 VAL CG2 C 20.742 0.05 2 796 95 95 VAL N N 120.516 0.05 1 797 96 96 LYS H H 8.589387 0.02 1 798 96 96 LYS HA H 3.662134 0.02 1 799 96 96 LYS CA C 61.203 0.05 1 800 96 96 LYS CB C 32.443 0.05 1 801 96 96 LYS CG C 24.808 0.05 1 802 96 96 LYS CD C 29.008 0.05 1 803 96 96 LYS CE C 42.077 0.05 1 804 96 96 LYS N N 118.694 0.05 1 805 97 97 LYS H H 7.035738 0.02 1 806 97 97 LYS HA H 3.930431 0.02 1 807 97 97 LYS HD2 H 1.594 0.02 2 808 97 97 LYS HD3 H 1.662 0.02 2 809 97 97 LYS HE2 H 2.879 0.02 2 810 97 97 LYS HE3 H 2.946891 0.02 2 811 97 97 LYS CA C 59.344 0.05 1 812 97 97 LYS CB C 32.731 0.05 1 813 97 97 LYS CG C 25.027 0.05 1 814 97 97 LYS CD C 29.04 0.05 1 815 97 97 LYS CE C 42.053 0.05 1 816 97 97 LYS N N 116 0.05 1 817 98 98 LEU H H 7.502329 0.02 1 818 98 98 LEU HA H 4.165183 0.02 1 819 98 98 LEU HB2 H 1.387434 0.02 2 820 98 98 LEU HB3 H 1.945522 0.02 2 821 98 98 LEU HD1 H 0.7572036 0.02 2 822 98 98 LEU HD2 H 0.8641717 0.02 2 823 98 98 LEU CA C 55.619 0.05 1 824 98 98 LEU CB C 42.246 0.05 1 825 98 98 LEU N N 117.135 0.05 1 826 99 99 LEU H H 7.191405 0.02 1 827 99 99 LEU HA H 4.294387 0.02 1 828 99 99 LEU HB2 H 1.495667 0.02 2 829 99 99 LEU HB3 H 1.733818 0.02 2 830 99 99 LEU HG H 1.548597 0.02 1 831 99 99 LEU HD1 H 0.5783296 0.02 2 832 99 99 LEU HD2 H 0.6903385 0.02 2 833 99 99 LEU CA C 54.594 0.05 1 834 99 99 LEU CB C 41.072 0.05 1 835 99 99 LEU CG C 26.895 0.05 1 836 99 99 LEU CD1 C 23.948 0.05 2 837 99 99 LEU CD2 C 23.946 0.05 2 838 99 99 LEU N N 115.468 0.05 1 839 100 100 VAL H H 6.864308 0.02 1 840 100 100 VAL HA H 4.096113 0.02 1 841 100 100 VAL HB H 1.918125 0.02 1 842 100 100 VAL HG1 H 0.7848869 0.02 2 843 100 100 VAL HG2 H 0.837792 0.02 2 844 100 100 VAL CA C 59.286 0.05 1 845 100 100 VAL CB C 33.113 0.05 1 846 100 100 VAL N N 117.218 0.05 1 847 101 101 PRO HA H 3.077595 0.02 1 848 101 101 PRO HB2 H 0.8428227 0.02 2 849 101 101 PRO HB3 H 1.051127 0.02 2 850 101 101 PRO HG2 H 0.3169712 0.02 2 851 101 101 PRO HG3 H 0.8806433 0.02 2 852 101 101 PRO HD2 H 2.863171 0.02 2 853 101 101 PRO HD3 H 3.075889 0.02 2 854 101 101 PRO CA C 63.139 0.05 1 855 101 101 PRO CB C 31.247 0.05 1 856 101 101 PRO CG C 26.867 0.05 1 857 101 101 PRO CD C 50.364 0.05 1 858 102 102 ALA H H 7.095755 0.02 1 859 102 102 ALA HA H 4.144292 0.02 1 860 102 102 ALA HB H 1.209905 0.02 2 861 102 102 ALA CA C 51.579 0.05 1 862 102 102 ALA CB C 20.037 0.05 1 863 102 102 ALA N N 122.94 0.05 1 864 103 103 ALA H H 8.237604 0.02 1 865 103 103 ALA HA H 4.197679 0.02 1 866 103 103 ALA HB H 1.273833 0.02 2 867 103 103 ALA CA C 52.014 0.05 1 868 103 103 ALA CB C 19.594 0.05 1 869 103 103 ALA N N 123.929 0.05 1 870 104 104 GLU H H 8.362335 0.02 1 871 104 104 GLU HA H 4.190675 0.02 1 872 104 104 GLU HB2 H 1.868429 0.02 2 873 104 104 GLU HB3 H 1.972873 0.02 2 874 104 104 GLU CA C 56.571 0.05 1 875 104 104 GLU CB C 30.349 0.05 1 876 104 104 GLU CG C 36.217 0.05 1 877 104 104 GLU N N 120.037 0.05 1 878 105 105 GLY H H 8.356086 0.02 1 879 105 105 GLY HA2 H 3.912708 0.02 2 880 105 105 GLY CA C 45.346 0.05 1 881 105 105 GLY N N 109.616 0.05 1 882 106 106 GLU H H 8.236932 0.02 1 883 106 106 GLU HA H 4.147325 0.02 1 884 106 106 GLU HB2 H 1.897406 0.02 2 885 106 106 GLU HB3 H 1.97548 0.02 2 886 106 106 GLU CA C 57.398 0.05 1 887 106 106 GLU CB C 30.436 0.05 1 888 106 106 GLU CG C 36.244 0.05 1 889 106 106 GLU N N 120.64 0.05 1 890 107 107 ASP H H 8.41659 0.02 1 891 107 107 ASP HA H 4.482228 0.02 1 892 107 107 ASP CA C 55.132 0.05 1 893 107 107 ASP CB C 41.007 0.05 1 894 107 107 ASP N N 120.699 0.05 1 895 108 108 SER H H 8.151936 0.02 1 896 108 108 SER HA H 4.137292 0.02 1 897 108 108 SER CA C 60.204 0.05 1 898 108 108 SER CB C 63.228 0.05 1 899 108 108 SER N N 116.341 0.05 1 900 109 109 LEU H H 8.005293 0.02 1 901 109 109 LEU HA H 4.11396 0.02 1 902 109 109 LEU HB2 H 1.486 0.02 2 903 109 109 LEU HB3 H 1.708 0.02 2 904 109 109 LEU HG H 1.539537 0.02 1 905 109 109 LEU HD1 H 0.7984293 0.02 2 906 109 109 LEU HD2 H 0.817865 0.02 2 907 109 109 LEU CA C 56.991 0.05 1 908 109 109 LEU CB C 41.87 0.05 1 909 109 109 LEU CG C 26.923 0.05 1 910 109 109 LEU CD1 C 24.03 0.05 2 911 109 109 LEU CD2 C 24.031 0.05 2 912 109 109 LEU N N 122.739 0.05 1 913 110 110 LYS H H 8.029 0.02 1 914 110 110 LYS HA H 4.257 0.02 1 915 110 110 LYS HB2 H 2.451 0.02 2 916 110 110 LYS HB3 H 2.57 0.02 2 917 110 110 LYS N N 119.728 0.05 1 918 111 111 LYS H H 7.909165 0.02 1 919 111 111 LYS HA H 4.031682 0.02 1 920 111 111 LYS CA C 58.418 0.05 1 921 111 111 LYS CB C 32.497 0.05 1 922 111 111 LYS CG C 25.025 0.05 1 923 111 111 LYS CD C 28.889 0.05 1 924 111 111 LYS CE C 41.904 0.05 1 925 111 111 LYS N N 119.117 0.05 1 926 112 112 MET H H 8.009863 0.02 1 927 112 112 MET HA H 4.221712 0.02 1 928 112 112 MET HG2 H 2.496888 0.02 2 929 112 112 MET HG3 H 2.575916 0.02 2 930 112 112 MET HE H 2.095 0.02 2 931 112 112 MET CA C 57.395 0.05 1 932 112 112 MET CB C 32.647 0.05 1 933 112 112 MET CG C 32.834 0.05 1 934 112 112 MET N N 119.141 0.05 1 935 113 113 LYS H H 8.152391 0.02 1 936 113 113 LYS HA H 4.094786 0.02 1 937 113 113 LYS HB2 H 2.042 0.02 2 938 113 113 LYS CA C 57.732 0.05 1 939 113 113 LYS CG C 24.771 0.05 1 940 113 113 LYS CD C 28.822 0.05 1 941 113 113 LYS CE C 41.778 0.05 1 942 113 113 LYS N N 120.015 0.05 1 943 114 114 LEU H H 8.048612 0.02 1 944 114 114 LEU HA H 4.124084 0.02 1 945 114 114 LEU HG H 1.619 0.02 1 946 114 114 LEU HD1 H 0.791 0.02 2 947 114 114 LEU HD2 H 0.847 0.02 2 948 114 114 LEU CA C 57.051 0.05 1 949 114 114 LEU CB C 41.633 0.05 1 950 114 114 LEU CG C 27.132 0.05 1 951 114 114 LEU CD1 C 24.127 0.05 2 952 114 114 LEU CD2 C 24.127 0.05 2 953 114 114 LEU N N 120.487 0.05 1 954 115 115 MET H H 7.909636 0.02 1 955 115 115 MET HA H 4.097346 0.02 1 956 115 115 MET HE H 1.775422 0.02 2 957 115 115 MET N N 119.943 0.05 1 958 116 116 GLU H H 8.091949 0.02 1 959 116 116 GLU HA H 3.984789 0.02 1 960 116 116 GLU HG2 H 2.042883 0.02 2 961 116 116 GLU HG3 H 2.265329 0.02 2 962 116 116 GLU CA C 58.386 0.05 1 963 116 116 GLU CB C 29.507 0.05 1 964 116 116 GLU CG C 36.117 0.05 1 965 116 116 GLU N N 119.716 0.05 1 966 117 117 LEU H H 7.872601 0.02 1 967 117 117 LEU HA H 4.135893 0.02 1 968 117 117 LEU HG H 1.641921 0.02 1 969 117 117 LEU HD1 H 0.788 0.02 2 970 117 117 LEU HD2 H 0.845 0.02 2 971 117 117 LEU CA C 56.688 0.05 1 972 117 117 LEU CB C 42.095 0.05 1 973 117 117 LEU CG C 26.903 0.05 1 974 117 117 LEU CD1 C 24.101 0.05 2 975 117 117 LEU CD2 C 24.101 0.05 2 976 117 117 LEU N N 120.316 0.05 1 977 118 118 ALA H H 7.877815 0.02 1 978 118 118 ALA HA H 4.14751 0.02 1 979 118 118 ALA HB H 1.373964 0.02 2 980 118 118 ALA CA C 53.586 0.05 1 981 118 118 ALA CB C 18.506 0.05 1 982 118 118 ALA N N 122.179 0.05 1 983 119 119 ILE H H 7.832732 0.02 1 984 119 119 ILE HA H 3.884301 0.02 1 985 119 119 ILE HB H 1.810766 0.02 1 986 119 119 ILE HG2 H 0.9655175 0.02 2 987 119 119 ILE HD1 H 0.686752 0.02 2 988 119 119 ILE CA C 62.985 0.05 1 989 119 119 ILE CB C 38.313 0.05 1 990 119 119 ILE CG1 C 28.266 0.05 1 991 119 119 ILE CD1 C 12.903 0.05 1 992 119 119 ILE N N 118.577 0.05 1 993 120 120 LEU H H 7.963638 0.02 1 994 120 120 LEU HA H 4.142856 0.02 1 995 120 120 LEU HB2 H 1.658712 0.02 2 996 120 120 LEU HG H 1.552051 0.02 1 997 120 120 LEU HD1 H 0.782805 0.02 2 998 120 120 LEU HD2 H 0.8183605 0.02 2 999 120 120 LEU CA C 56.687 0.05 1 1000 120 120 LEU CB C 42.202 0.05 1 1001 120 120 LEU CG C 26.903 0.05 1 1002 120 120 LEU CD1 C 24.09 0.05 2 1003 120 120 LEU CD2 C 24.09 0.05 2 1004 120 120 LEU N N 122.83 0.05 1 1005 121 121 ASN H H 8.230152 0.02 1 1006 121 121 ASN HA H 4.614055 0.02 1 1007 121 121 ASN HD21 H 6.838337 0.02 2 1008 121 121 ASN HD22 H 7.484103 0.02 2 1009 121 121 ASN CA C 53.786 0.05 1 1010 121 121 ASN CB C 38.893 0.05 1 1011 121 121 ASN N N 116.707 0.05 1 1012 121 121 ASN ND2 N 111.655 0.05 1 1013 122 122 GLY H H 8.023307 0.02 1 1014 122 122 GLY CA C 45.944 0.05 1 1015 122 122 GLY N N 108.137 0.05 1 1016 123 123 THR H H 8.049953 0.02 1 1017 123 123 THR HA H 4.207572 0.02 1 1018 123 123 THR HB H 4.103121 0.02 1 1019 123 123 THR HG2 H 1.011632 0.02 2 1020 123 123 THR N N 112.859 0.05 1 1021 124 124 TYR H H 7.927927 0.02 1 1022 124 124 TYR HA H 4.400306 0.02 1 1023 124 124 TYR HB2 H 2.820791 0.02 2 1024 124 124 TYR HB3 H 2.877986 0.02 2 1025 124 124 TYR CA C 58.246 0.05 1 1026 124 124 TYR CB C 38.614 0.05 1 1027 124 124 TYR CD1 C 133.204 0.05 3 1028 124 124 TYR N N 122.063 0.05 1 1029 125 125 ARG H H 7.896245 0.02 1 1030 125 125 ARG HA H 4.122424 0.02 1 1031 125 125 ARG HE H 7.121 0.02 1 1032 125 125 ARG N N 123.312 0.05 1 1033 125 125 ARG NE N 84.372 0.05 1 1034 126 126 ASP H H 8.052718 0.02 1 1035 126 126 ASP HA H 4.388454 0.02 1 1036 126 126 ASP HB2 H 2.514765 0.02 2 1037 126 126 ASP HB3 H 2.633849 0.02 2 1038 126 126 ASP CA C 54.399 0.05 1 1039 126 126 ASP CB C 41.357 0.05 1 1040 126 126 ASP N N 120.818 0.05 1 1041 127 127 ALA H H 8.151649 0.02 1 1042 127 127 ALA HA H 4.102909 0.02 1 1043 127 127 ALA HB H 1.290109 0.02 2 1044 127 127 ALA CA C 53.208 0.05 1 1045 127 127 ALA CB C 19.22 0.05 1 1046 127 127 ALA N N 124.697 0.05 1 1047 128 128 ASN H H 8.331501 0.02 1 1048 128 128 ASN HA H 4.537279 0.02 1 1049 128 128 ASN HB2 H 2.654871 0.02 2 1050 128 128 ASN HB3 H 2.727359 0.02 2 1051 128 128 ASN HD21 H 6.819507 0.02 2 1052 128 128 ASN HD22 H 7.592134 0.02 2 1053 128 128 ASN CA C 53.619 0.05 1 1054 128 128 ASN CB C 38.881 0.05 1 1055 128 128 ASN N N 116.207 0.05 1 1056 128 128 ASN ND2 N 113.094 0.05 1 1057 129 129 LEU H H 7.825917 0.02 1 1058 129 129 LEU HA H 4.195722 0.02 1 1059 129 129 LEU HG H 1.677 0.02 1 1060 129 129 LEU HD1 H 0.732 0.02 2 1061 129 129 LEU HD2 H 0.794 0.02 2 1062 129 129 LEU CA C 55.509 0.05 1 1063 129 129 LEU CB C 42.244 0.05 1 1064 129 129 LEU CG C 27.011 0.05 1 1065 129 129 LEU CD1 C 24.096 0.05 2 1066 129 129 LEU CD2 C 24.096 0.05 2 1067 129 129 LEU N N 121.098 0.05 1 1068 130 130 LYS H H 8.097445 0.02 1 1069 130 130 LYS HA H 4.212803 0.02 1 1070 130 130 LYS N N 121.111 0.05 1 1071 131 131 SER H H 8.084908 0.02 1 1072 131 131 SER HA H 4.667298 0.02 1 1073 131 131 SER N N 117.364 0.05 1 1074 132 132 PRO HA H 4.238 0.02 1 1075 132 132 PRO CB C 32.368 0.05 1 1076 133 133 ALA H H 8.136 0.02 1 1077 133 133 ALA HA H 4.111 0.02 1 1078 133 133 ALA HB H 1.739 0.02 2 1079 133 133 ALA N N 123.102 0.05 1 1080 134 134 LEU H H 7.965 0.02 1 1081 134 134 LEU HA H 4.485 0.02 1 1082 134 134 LEU HG H 1.732 0.02 1 1083 134 134 LEU N N 120.383 0.05 1 stop_ save_