data_27608 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; MapZ is a multi-functional regulator of FtsZ that controls both the precise positioning of Z-ring and proper timing of Z-ring formation ; _BMRB_accession_number 27608 _BMRB_flat_file_name bmr27608.str _Entry_type original _Submission_date 2018-09-13 _Accession_date 2018-09-13 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Feng Zhang . . 2 Zhang Jiahai . . 3 Xu Da . . 4 Jiang Yongliang . . 5 Zhou Congzhao . . 6 Chen Yuxing . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 903 "13C chemical shifts" 641 "15N chemical shifts" 163 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-05-24 original BMRB . stop_ _Original_release_date 2018-09-14 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Multi-functional regulator MapZ controls both positioning and timing of FtsZ polymerization. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 31036719 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Feng Zhang . . 2 Zhang Jiahai . . 3 Xu Da . . 4 Jiang Yongliang . . 5 Zhou Congzhao . . 6 Chen Yuxing . . stop_ _Journal_abbreviation 'Biochem. J.' _Journal_name_full 'The Biochemical journal' _Journal_volume 476 _Journal_issue 10 _Journal_ISSN 1470-8728 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1433 _Page_last 1444 _Year 2019 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name MapZ _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label MapZ $MapZ 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_MapZ _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common MapZ _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 158 _Mol_residue_sequence ; MSKKRRNRHKKEAQEPQFDF DEAKELTVGQAIRKNEEVEA GVLPEDSILDKYVKQHRDEI EADKFATRQYKKEEFVETQS LDDLIQEMREAVEKSEASSE EVPSSEDILLPLPLDDEEQG LDPLLLDDENPTEMTEEVEE EQNLSRLDQEDSEKKSKK ; loop_ _Residue_seq_code _Residue_label 1 MET 2 SER 3 LYS 4 LYS 5 ARG 6 ARG 7 ASN 8 ARG 9 HIS 10 LYS 11 LYS 12 GLU 13 ALA 14 GLN 15 GLU 16 PRO 17 GLN 18 PHE 19 ASP 20 PHE 21 ASP 22 GLU 23 ALA 24 LYS 25 GLU 26 LEU 27 THR 28 VAL 29 GLY 30 GLN 31 ALA 32 ILE 33 ARG 34 LYS 35 ASN 36 GLU 37 GLU 38 VAL 39 GLU 40 ALA 41 GLY 42 VAL 43 LEU 44 PRO 45 GLU 46 ASP 47 SER 48 ILE 49 LEU 50 ASP 51 LYS 52 TYR 53 VAL 54 LYS 55 GLN 56 HIS 57 ARG 58 ASP 59 GLU 60 ILE 61 GLU 62 ALA 63 ASP 64 LYS 65 PHE 66 ALA 67 THR 68 ARG 69 GLN 70 TYR 71 LYS 72 LYS 73 GLU 74 GLU 75 PHE 76 VAL 77 GLU 78 THR 79 GLN 80 SER 81 LEU 82 ASP 83 ASP 84 LEU 85 ILE 86 GLN 87 GLU 88 MET 89 ARG 90 GLU 91 ALA 92 VAL 93 GLU 94 LYS 95 SER 96 GLU 97 ALA 98 SER 99 SER 100 GLU 101 GLU 102 VAL 103 PRO 104 SER 105 SER 106 GLU 107 ASP 108 ILE 109 LEU 110 LEU 111 PRO 112 LEU 113 PRO 114 LEU 115 ASP 116 ASP 117 GLU 118 GLU 119 GLN 120 GLY 121 LEU 122 ASP 123 PRO 124 LEU 125 LEU 126 LEU 127 ASP 128 ASP 129 GLU 130 ASN 131 PRO 132 THR 133 GLU 134 MET 135 THR 136 GLU 137 GLU 138 VAL 139 GLU 140 GLU 141 GLU 142 GLN 143 ASN 144 LEU 145 SER 146 ARG 147 LEU 148 ASP 149 GLN 150 GLU 151 ASP 152 SER 153 GLU 154 LYS 155 LYS 156 SER 157 LYS 158 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $MapZ 'S. pneumoniae' 1313 Bacteria Bacteria Streptococcus pneumoniae stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $MapZ 'recombinant technology' . Escherichia coli . 2B-T stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $MapZ 0.8 mM '[U-99% 13C; U-99% 15N]' 'phosphate sodium' 50 mM 'natural abundance' NaCl 50 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.1 . M pH 6.5 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _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 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na 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_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name MapZ _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 MET H H 8.177 0.010 . 2 1 1 MET HA H 4.350 0.010 . 3 1 1 MET HB2 H 1.953 0.010 . 4 1 1 MET HB3 H 2.056 0.010 . 5 1 1 MET HG2 H 2.317 0.010 . 6 1 1 MET HG3 H 2.314 0.010 . 7 1 1 MET C C 175.675 0.000 . 8 1 1 MET CA C 55.797 0.000 . 9 1 1 MET CB C 29.499 0.010 . 10 1 1 MET CG C 33.404 0.010 . 11 1 1 MET N N 122.197 0.010 . 12 2 2 SER H H 8.571 0.010 . 13 2 2 SER HA H 4.423 0.010 . 14 2 2 SER HB2 H 3.863 0.010 . 15 2 2 SER HB3 H 4.427 0.010 . 16 2 2 SER C C 174.663 0.010 . 17 2 2 SER CA C 57.954 0.000 . 18 2 2 SER CB C 63.593 0.000 . 19 2 2 SER N N 118.679 0.010 . 20 3 3 LYS H H 8.467 0.010 . 21 3 3 LYS HA H 4.245 0.010 . 22 3 3 LYS HB2 H 1.501 0.010 . 23 3 3 LYS HB3 H 1.791 0.010 . 24 3 3 LYS HG2 H 1.179 0.010 . 25 3 3 LYS HG3 H 1.770 0.010 . 26 3 3 LYS HD2 H 1.398 0.010 . 27 3 3 LYS HD3 H 1.779 0.010 . 28 3 3 LYS HE2 H 2.952 0.010 . 29 3 3 LYS HE3 H 3.075 0.010 . 30 3 3 LYS C C 175.561 0.010 . 31 3 3 LYS CA C 56.016 0.010 . 32 3 3 LYS CB C 32.759 0.010 . 33 3 3 LYS CG C 24.282 0.010 . 34 3 3 LYS CD C 28.527 0.010 . 35 3 3 LYS CE C 42.066 0.010 . 36 3 3 LYS N N 125.428 0.010 . 37 4 4 LYS H H 8.369 0.010 . 38 4 4 LYS HA H 4.287 0.010 . 39 4 4 LYS HB2 H 1.767 0.010 . 40 4 4 LYS HB3 H 1.761 0.010 . 41 4 4 LYS HG2 H 0.858 0.010 . 42 4 4 LYS HG3 H 2.231 0.010 . 43 4 4 LYS HD2 H 1.769 0.010 . 44 4 4 LYS HD3 H 1.769 0.010 . 45 4 4 LYS HE2 H 2.815 0.010 . 46 4 4 LYS HE3 H 2.929 0.010 . 47 4 4 LYS C C 175.885 0.010 . 48 4 4 LYS CA C 54.424 0.010 . 49 4 4 LYS CB C 32.574 0.010 . 50 4 4 LYS CG C 23.075 0.010 . 51 4 4 LYS CD C 30.091 0.010 . 52 4 4 LYS CE C 41.000 0.010 . 53 4 4 LYS N N 124.271 0.010 . 54 5 5 ARG H H 8.300 0.010 . 55 5 5 ARG HA H 4.222 0.010 . 56 5 5 ARG HB2 H 1.881 0.010 . 57 5 5 ARG HB3 H 2.166 0.010 . 58 5 5 ARG HG2 H 0.863 0.010 . 59 5 5 ARG HG3 H 1.576 0.010 . 60 5 5 ARG HD2 H 2.811 0.010 . 61 5 5 ARG HD3 H 2.811 0.010 . 62 5 5 ARG C C 176.612 0.010 . 63 5 5 ARG CA C 56.433 0.010 . 64 5 5 ARG CB C 29.892 0.010 . 65 5 5 ARG CG C 27.095 0.010 . 66 5 5 ARG CD C 43.016 0.010 . 67 5 5 ARG N N 121.672 0.010 . 68 6 6 ARG H H 8.284 0.010 . 69 6 6 ARG HA H 4.223 0.010 . 70 6 6 ARG HB2 H 1.834 0.010 . 71 6 6 ARG HB3 H 1.757 0.010 . 72 6 6 ARG HG2 H 1.398 0.010 . 73 6 6 ARG HG3 H 2.195 0.010 . 74 6 6 ARG HD2 H 2.943 0.010 . 75 6 6 ARG HD3 H 2.947 0.010 . 76 6 6 ARG C C 175.737 0.010 . 77 6 6 ARG CA C 55.905 0.010 . 78 6 6 ARG CB C 28.910 0.010 . 79 6 6 ARG CG C 24.355 0.010 . 80 6 6 ARG CD C 43.008 0.010 . 81 6 6 ARG N N 121.866 0.010 . 82 7 7 ASN H H 8.565 0.010 . 83 7 7 ASN HA H 4.591 0.010 . 84 7 7 ASN HB2 H 2.728 0.010 . 85 7 7 ASN HB3 H 2.796 0.010 . 86 7 7 ASN HD21 H 6.943 0.010 . 87 7 7 ASN HD22 H 7.644 0.010 . 88 7 7 ASN C C 175.105 0.010 . 89 7 7 ASN CA C 53.378 0.010 . 90 7 7 ASN CB C 38.447 0.010 . 91 7 7 ASN N N 120.707 0.010 . 92 7 7 ASN ND2 N 113.400 0.010 . 93 8 8 ARG H H 8.490 0.010 . 94 8 8 ARG HA H 4.210 0.010 . 95 8 8 ARG HB2 H 1.891 0.010 . 96 8 8 ARG HB3 H 2.019 0.010 . 97 8 8 ARG HG2 H 1.605 0.010 . 98 8 8 ARG HG3 H 2.208 0.010 . 99 8 8 ARG HD2 H 3.161 0.010 . 100 8 8 ARG HD3 H 3.157 0.010 . 101 8 8 ARG C C 176.221 0.010 . 102 8 8 ARG CA C 56.270 0.010 . 103 8 8 ARG CB C 30.036 0.010 . 104 8 8 ARG CG C 28.288 0.010 . 105 8 8 ARG CD C 43.007 0.010 . 106 8 8 ARG N N 121.642 0.010 . 107 9 9 HIS H H 8.221 0.010 . 108 9 9 HIS HA H 4.526 0.010 . 109 9 9 HIS HB2 H 2.562 0.010 . 110 9 9 HIS HB3 H 2.814 0.010 . 111 9 9 HIS HD1 H 8.199 0.010 . 112 9 9 HIS C C 176.012 0.010 . 113 9 9 HIS CA C 58.645 0.010 . 114 9 9 HIS CB C 29.991 0.010 . 115 9 9 HIS N N 123.388 0.010 . 116 10 10 LYS H H 8.297 0.010 . 117 10 10 LYS HA H 4.270 0.010 . 118 10 10 LYS HB2 H 1.750 0.010 . 119 10 10 LYS HB3 H 1.879 0.010 . 120 10 10 LYS HG2 H 0.858 0.010 . 121 10 10 LYS HG3 H 1.627 0.010 . 122 10 10 LYS HD2 H 1.619 0.010 . 123 10 10 LYS HD3 H 1.623 0.010 . 124 10 10 LYS HE2 H 2.945 0.010 . 125 10 10 LYS HE3 H 3.045 0.010 . 126 10 10 LYS C C 175.809 0.010 . 127 10 10 LYS CA C 55.366 0.010 . 128 10 10 LYS CB C 32.550 0.010 . 129 10 10 LYS CG C 24.347 0.010 . 130 10 10 LYS CD C 28.542 0.010 . 131 10 10 LYS CE C 42.040 0.010 . 132 10 10 LYS N N 121.509 0.010 . 133 11 11 LYS H H 8.327 0.010 . 134 11 11 LYS HA H 4.545 0.010 . 135 11 11 LYS HB2 H 1.602 0.010 . 136 11 11 LYS HB3 H 1.767 0.010 . 137 11 11 LYS HG2 H 0.638 0.010 . 138 11 11 LYS HG3 H 1.441 0.010 . 139 11 11 LYS HD2 H 2.222 0.010 . 140 11 11 LYS HD3 H 1.440 0.010 . 141 11 11 LYS HE2 H 2.929 0.010 . 142 11 11 LYS HE3 H 2.927 0.010 . 143 11 11 LYS C C 175.875 0.010 . 144 11 11 LYS CA C 54.390 0.010 . 145 11 11 LYS CB C 32.512 0.010 . 146 11 11 LYS CG C 24.639 0.010 . 147 11 11 LYS CD C 32.983 0.010 . 148 11 11 LYS CE C 41.008 0.010 . 149 11 11 LYS N N 124.242 0.010 . 150 12 12 GLU H H 8.276 0.000 . 151 12 12 GLU HA H 4.195 0.010 . 152 12 12 GLU HB2 H 1.933 0.010 . 153 12 12 GLU HB3 H 1.984 0.010 . 154 12 12 GLU HG2 H 2.229 0.010 . 155 12 12 GLU HG3 H 2.230 0.010 . 156 12 12 GLU C C 176.077 0.010 . 157 12 12 GLU CA C 56.436 0.010 . 158 12 12 GLU CB C 29.926 0.010 . 159 12 12 GLU CG C 35.935 0.010 . 160 12 12 GLU N N 121.694 0.010 . 161 13 13 ALA H H 8.328 0.010 . 162 13 13 ALA HA H 4.242 0.000 . 163 13 13 ALA HB H 1.339 0.000 . 164 13 13 ALA C C 177.284 0.000 . 165 13 13 ALA CA C 52.377 0.000 . 166 13 13 ALA CB C 19.063 0.000 . 167 13 13 ALA N N 125.639 0.010 . 168 14 14 GLN H H 8.301 0.010 . 169 14 14 GLN HA H 4.226 0.010 . 170 14 14 GLN HB2 H 2.286 0.010 . 171 14 14 GLN HB3 H 2.690 0.010 . 172 14 14 GLN HG2 H 2.271 0.010 . 173 14 14 GLN HG3 H 2.250 0.010 . 174 14 14 GLN HE21 H 6.931 0.010 . 175 14 14 GLN HE22 H 7.749 0.010 . 176 14 14 GLN C C 175.288 0.010 . 177 14 14 GLN CA C 55.289 0.000 . 178 14 14 GLN CB C 29.244 0.010 . 179 14 14 GLN CG C 33.347 0.010 . 180 14 14 GLN N N 119.721 0.000 . 181 14 14 GLN NE2 N 113.491 0.010 . 182 15 15 GLU H H 8.141 0.010 . 183 15 15 GLU CA C 54.229 0.010 . 184 15 15 GLU CB C 32.569 0.010 . 185 15 15 GLU N N 122.869 0.010 . 186 16 16 PRO HA H 4.289 0.010 . 187 16 16 PRO HB2 H 1.708 0.010 . 188 16 16 PRO HB3 H 2.163 0.000 . 189 16 16 PRO HG2 H 1.964 0.010 . 190 16 16 PRO HG3 H 1.965 0.010 . 191 16 16 PRO HD2 H 3.647 0.010 . 192 16 16 PRO HD3 H 3.762 0.000 . 193 16 16 PRO C C 176.295 0.000 . 194 16 16 PRO CA C 63.108 0.000 . 195 16 16 PRO CB C 31.762 0.000 . 196 16 16 PRO CG C 27.204 0.000 . 197 16 16 PRO CD C 50.559 0.000 . 198 17 17 GLN H H 8.402 0.000 . 199 17 17 GLN HA H 4.207 0.000 . 200 17 17 GLN HB2 H 1.836 0.010 . 201 17 17 GLN HB3 H 2.195 0.010 . 202 17 17 GLN HG2 H 2.193 0.010 . 203 17 17 GLN HG3 H 2.195 0.010 . 204 17 17 GLN HE21 H 8.139 0.010 . 205 17 17 GLN HE22 H 8.257 0.010 . 206 17 17 GLN C C 176.279 0.010 . 207 17 17 GLN CA C 55.349 0.000 . 208 17 17 GLN CB C 29.460 0.010 . 209 17 17 GLN CG C 34.718 0.010 . 210 17 17 GLN N N 121.066 0.000 . 211 17 17 GLN NE2 N 113.483 0.010 . 212 18 18 PHE H H 8.200 0.010 . 213 18 18 PHE HA H 4.423 0.010 . 214 18 18 PHE HB2 H 2.986 0.010 . 215 18 18 PHE HB3 H 3.099 0.010 . 216 18 18 PHE C C 175.159 0.010 . 217 18 18 PHE CA C 57.787 0.010 . 218 18 18 PHE CB C 39.333 0.010 . 219 18 18 PHE N N 122.022 0.010 . 220 19 19 ASP H H 8.312 0.010 . 221 19 19 ASP HA H 4.528 0.010 . 222 19 19 ASP HB2 H 2.457 0.010 . 223 19 19 ASP HB3 H 2.571 0.010 . 224 19 19 ASP C C 175.699 0.010 . 225 19 19 ASP CA C 54.139 0.010 . 226 19 19 ASP CB C 40.951 0.000 . 227 19 19 ASP N N 122.903 0.010 . 228 20 20 PHE H H 8.093 0.010 . 229 20 20 PHE HA H 4.523 0.010 . 230 20 20 PHE HB2 H 2.985 0.010 . 231 20 20 PHE HB3 H 3.102 0.010 . 232 20 20 PHE C C 175.258 0.010 . 233 20 20 PHE CA C 54.123 0.010 . 234 20 20 PHE CB C 39.349 0.010 . 235 20 20 PHE N N 121.537 0.010 . 236 21 21 ASP H H 8.306 0.010 . 237 21 21 ASP HA H 4.527 0.010 . 238 21 21 ASP HB2 H 2.608 0.010 . 239 21 21 ASP HB3 H 2.612 0.010 . 240 21 21 ASP C C 176.238 0.010 . 241 21 21 ASP CA C 54.266 0.000 . 242 21 21 ASP CB C 41.000 0.010 . 243 21 21 ASP N N 122.986 0.010 . 244 22 22 GLU H H 8.340 0.010 . 245 22 22 GLU HA H 4.189 0.010 . 246 22 22 GLU HB2 H 1.951 0.010 . 247 22 22 GLU HB3 H 2.015 0.010 . 248 22 22 GLU HG2 H 2.230 0.010 . 249 22 22 GLU HG3 H 2.230 0.010 . 250 22 22 GLU C C 176.363 0.010 . 251 22 22 GLU CA C 56.776 0.010 . 252 22 22 GLU CB C 29.880 0.010 . 253 22 22 GLU CG C 35.931 0.010 . 254 22 22 GLU N N 121.729 0.010 . 255 23 23 ALA H H 8.271 0.010 . 256 23 23 ALA HA H 4.232 0.010 . 257 23 23 ALA HB H 1.346 0.000 . 258 23 23 ALA C C 177.676 0.010 . 259 23 23 ALA CA C 52.629 0.000 . 260 23 23 ALA CB C 18.764 0.000 . 261 23 23 ALA N N 124.747 0.010 . 262 24 24 LYS H H 8.016 0.010 . 263 24 24 LYS HA H 4.180 0.010 . 264 24 24 LYS HB2 H 1.744 0.010 . 265 24 24 LYS HB3 H 1.744 0.010 . 266 24 24 LYS HG2 H 0.867 0.010 . 267 24 24 LYS HG3 H 1.607 0.010 . 268 24 24 LYS HD2 H 1.596 0.010 . 269 24 24 LYS HD3 H 1.881 0.010 . 270 24 24 LYS HE2 H 2.939 0.010 . 271 24 24 LYS HE3 H 3.042 0.010 . 272 24 24 LYS C C 176.844 0.010 . 273 24 24 LYS CA C 56.516 0.010 . 274 24 24 LYS CB C 32.570 0.010 . 275 24 24 LYS CG C 24.322 0.010 . 276 24 24 LYS CD C 28.573 0.010 . 277 24 24 LYS CE C 41.879 0.010 . 278 24 24 LYS N N 120.761 0.010 . 279 25 25 GLU H H 8.316 0.010 . 280 25 25 GLU HA H 4.109 0.010 . 281 25 25 GLU HB2 H 1.879 0.010 . 282 25 25 GLU HB3 H 1.885 0.010 . 283 25 25 GLU HG2 H 1.881 0.010 . 284 25 25 GLU HG3 H 2.187 0.010 . 285 25 25 GLU C C 176.397 0.000 . 286 25 25 GLU CA C 56.348 0.010 . 287 25 25 GLU CB C 38.052 0.010 . 288 25 25 GLU CG C 35.864 0.010 . 289 25 25 GLU N N 121.794 0.010 . 290 26 26 LEU H H 8.130 0.010 . 291 26 26 LEU HA H 4.350 0.000 . 292 26 26 LEU HB2 H 1.548 0.000 . 293 26 26 LEU HB3 H 1.645 0.000 . 294 26 26 LEU C C 177.524 0.000 . 295 26 26 LEU CA C 55.244 0.000 . 296 26 26 LEU CB C 42.054 0.000 . 297 26 26 LEU N N 123.176 0.010 . 298 27 27 THR H H 8.132 0.000 . 299 27 27 THR HA H 4.312 0.010 . 300 27 27 THR HB H 4.148 0.010 . 301 27 27 THR HG2 H 1.142 0.000 . 302 27 27 THR C C 174.440 0.000 . 303 27 27 THR CA C 61.755 0.000 . 304 27 27 THR CB C 69.539 0.000 . 305 27 27 THR CG2 C 21.268 0.000 . 306 27 27 THR N N 115.628 0.000 . 307 28 28 VAL H H 8.147 0.000 . 308 28 28 VAL HA H 4.104 0.000 . 309 28 28 VAL HB H 2.048 0.000 . 310 28 28 VAL HG1 H 0.915 0.000 . 311 28 28 VAL HG2 H 0.915 0.000 . 312 28 28 VAL C C 176.408 0.000 . 313 28 28 VAL CA C 62.447 0.000 . 314 28 28 VAL CB C 32.440 0.000 . 315 28 28 VAL CG1 C 20.626 0.000 . 316 28 28 VAL CG2 C 20.626 0.010 . 317 28 28 VAL N N 123.308 0.000 . 318 29 29 GLY H H 8.531 0.000 . 319 29 29 GLY HA2 H 3.917 0.000 . 320 29 29 GLY HA3 H 3.917 0.000 . 321 29 29 GLY C C 173.122 0.000 . 322 29 29 GLY CA C 45.130 0.000 . 323 29 29 GLY N N 113.872 0.000 . 324 30 30 GLN H H 7.885 0.000 . 325 30 30 GLN HA H 4.091 0.010 . 326 30 30 GLN HB2 H 2.031 0.010 . 327 30 30 GLN HB3 H 2.221 0.010 . 328 30 30 GLN HG2 H 1.787 0.010 . 329 30 30 GLN HG3 H 2.228 0.010 . 330 30 30 GLN HE21 H 7.523 0.010 . 331 30 30 GLN HE22 H 7.536 0.010 . 332 30 30 GLN C C 176.439 0.010 . 333 30 30 GLN CA C 56.913 0.000 . 334 30 30 GLN CB C 29.975 0.000 . 335 30 30 GLN CG C 33.345 0.010 . 336 30 30 GLN N N 125.556 0.000 . 337 30 30 GLN NE2 N 112.925 0.010 . 338 31 31 ALA H H 8.261 0.010 . 339 31 31 ALA HA H 4.225 0.010 . 340 31 31 ALA HB H 1.362 0.000 . 341 31 31 ALA C C 177.778 0.000 . 342 31 31 ALA CA C 52.750 0.000 . 343 31 31 ALA CB C 18.736 0.000 . 344 31 31 ALA N N 124.723 0.000 . 345 32 32 ILE H H 8.021 0.010 . 346 32 32 ILE HA H 4.075 0.010 . 347 32 32 ILE HB H 2.243 0.010 . 348 32 32 ILE HG12 H 0.844 0.010 . 349 32 32 ILE HG13 H 1.830 0.010 . 350 32 32 ILE HG2 H 0.844 0.010 . 351 32 32 ILE HD1 H 0.842 0.010 . 352 32 32 ILE C C 175.989 0.000 . 353 32 32 ILE CA C 56.389 0.010 . 354 32 32 ILE CB C 38.291 0.010 . 355 32 32 ILE CG2 C 20.643 0.010 . 356 32 32 ILE CD1 C 17.276 0.010 . 357 32 32 ILE N N 120.740 0.010 . 358 33 33 ARG H H 8.376 0.010 . 359 33 33 ARG HA H 4.345 0.010 . 360 33 33 ARG HB2 H 1.862 0.010 . 361 33 33 ARG HB3 H 1.862 0.010 . 362 33 33 ARG HG2 H 0.864 0.010 . 363 33 33 ARG HG3 H 0.861 0.010 . 364 33 33 ARG HD2 H 3.156 0.010 . 365 33 33 ARG HD3 H 3.153 0.010 . 366 33 33 ARG C C 176.761 0.010 . 367 33 33 ARG CA C 56.145 0.010 . 368 33 33 ARG CB C 30.102 0.010 . 369 33 33 ARG CG C 26.898 0.010 . 370 33 33 ARG CD C 43.040 0.010 . 371 33 33 ARG N N 125.967 0.010 . 372 34 34 LYS H H 8.274 0.010 . 373 34 34 LYS HA H 4.268 0.010 . 374 34 34 LYS HB2 H 1.644 0.010 . 375 34 34 LYS HB3 H 1.765 0.010 . 376 34 34 LYS HG2 H 1.398 0.010 . 377 34 34 LYS HG3 H 1.65 0.010 . 378 34 34 LYS HD2 H 1.648 0.010 . 379 34 34 LYS HD3 H 1.605 0.010 . 380 34 34 LYS HE2 H 2.941 0.010 . 381 34 34 LYS HE3 H 2.940 0.010 . 382 34 34 LYS C C 175.844 0.010 . 383 34 34 LYS CA C 56.204 0.010 . 384 34 34 LYS CB C 28.726 0.010 . 385 34 34 LYS CG C 24.342 0.010 . 386 34 34 LYS CD C 33.161 0.010 . 387 34 34 LYS CE C 42.126 0.010 . 388 34 34 LYS N N 123.987 0.010 . 389 35 35 ASN H H 8.569 0.010 . 390 35 35 ASN HA H 4.526 0.010 . 391 35 35 ASN HB2 H 2.734 0.010 . 392 35 35 ASN HB3 H 2.799 0.010 . 393 35 35 ASN HD21 H 7.515 0.010 . 394 35 35 ASN HD22 H 7.644 0.010 . 395 35 35 ASN C C 175.138 0.010 . 396 35 35 ASN CA C 53.451 0.010 . 397 35 35 ASN CB C 40.986 0.010 . 398 35 35 ASN N N 120.685 0.010 . 399 35 35 ASN ND2 N 113.356 0.010 . 400 36 36 GLU H H 8.305 0.010 . 401 36 36 GLU HA H 4.230 0.010 . 402 36 36 GLU HB2 H 1.896 0.010 . 403 36 36 GLU HB3 H 2.226 0.010 . 404 36 36 GLU HG2 H 2.072 0.010 . 405 36 36 GLU HG3 H 2.210 0.010 . 406 36 36 GLU C C 176.111 0.010 . 407 36 36 GLU CA C 56.533 0.010 . 408 36 36 GLU CB C 29.810 0.000 . 409 36 36 GLU CG C 35.918 0.010 . 410 36 36 GLU N N 121.592 0.010 . 411 37 37 GLU H H 8.360 0.010 . 412 37 37 GLU HA H 4.393 0.010 . 413 37 37 GLU HB2 H 1.968 0.010 . 414 37 37 GLU HB3 H 1.981 0.010 . 415 37 37 GLU HG2 H 1.855 0.010 . 416 37 37 GLU HG3 H 2.819 0.010 . 417 37 37 GLU C C 176.238 0.010 . 418 37 37 GLU CA C 56.518 0.000 . 419 37 37 GLU CB C 29.940 0.000 . 420 37 37 GLU CG C 31.661 0.010 . 421 37 37 GLU N N 122.133 0.010 . 422 38 38 VAL H H 8.270 0.010 . 423 38 38 VAL HA H 4.031 0.010 . 424 38 38 VAL HB H 2.022 0.010 . 425 38 38 VAL HG1 H 0.857 0.010 . 426 38 38 VAL HG2 H 1.013 0.010 . 427 38 38 VAL C C 176.152 0.010 . 428 38 38 VAL CA C 61.916 0.000 . 429 38 38 VAL CB C 32.668 0.000 . 430 38 38 VAL CG1 C 20.556 0.010 . 431 38 38 VAL CG2 C 20.620 0.000 . 432 38 38 VAL N N 122.565 0.010 . 433 39 39 GLU H H 8.473 0.010 . 434 39 39 GLU HA H 4.269 0.010 . 435 39 39 GLU HB2 H 1.926 0.010 . 436 39 39 GLU HB3 H 2.038 0.010 . 437 39 39 GLU HG2 H 2.225 0.010 . 438 39 39 GLU HG3 H 2.226 0.010 . 439 39 39 GLU C C 175.992 0.000 . 440 39 39 GLU CA C 56.397 0.000 . 441 39 39 GLU CB C 29.964 0.000 . 442 39 39 GLU CG C 35.880 0.000 . 443 39 39 GLU N N 125.791 0.010 . 444 40 40 ALA H H 8.318 0.010 . 445 40 40 ALA HA H 4.255 0.000 . 446 40 40 ALA HB H 1.368 0.000 . 447 40 40 ALA C C 178.118 0.000 . 448 40 40 ALA CA C 52.520 0.000 . 449 40 40 ALA CB C 19.025 0.000 . 450 40 40 ALA N N 125.731 0.000 . 451 41 41 GLY H H 8.376 0.000 . 452 41 41 GLY HA2 H 3.897 0.000 . 453 41 41 GLY HA3 H 3.897 0.000 . 454 41 41 GLY C C 173.661 0.000 . 455 41 41 GLY CA C 45.039 0.000 . 456 41 41 GLY N N 108.912 0.000 . 457 42 42 VAL H H 7.893 0.000 . 458 42 42 VAL HA H 4.075 0.000 . 459 42 42 VAL HB H 1.998 0.000 . 460 42 42 VAL HG1 H 0.864 0.000 . 461 42 42 VAL HG2 H 0.864 0.010 . 462 42 42 VAL C C 175.885 0.000 . 463 42 42 VAL CA C 61.903 0.000 . 464 42 42 VAL CB C 32.442 0.000 . 465 42 42 VAL CG1 C 20.613 0.000 . 466 42 42 VAL CG2 C 20.613 0.000 . 467 42 42 VAL N N 120.183 0.000 . 468 43 43 LEU H H 8.483 0.000 . 469 43 43 LEU CA C 52.644 0.000 . 470 43 43 LEU CB C 41.342 0.000 . 471 43 43 LEU N N 128.649 0.000 . 472 44 44 PRO HA H 4.358 0.000 . 473 44 44 PRO HB2 H 1.901 0.000 . 474 44 44 PRO HB3 H 2.278 0.000 . 475 44 44 PRO HG2 H 2.013 0.010 . 476 44 44 PRO HG3 H 2.012 0.010 . 477 44 44 PRO HD2 H 3.632 0.000 . 478 44 44 PRO HD3 H 3.838 0.000 . 479 44 44 PRO C C 177.215 0.000 . 480 44 44 PRO CA C 63.169 0.000 . 481 44 44 PRO CB C 31.742 0.000 . 482 44 44 PRO CG C 27.246 0.000 . 483 44 44 PRO CD C 50.467 0.000 . 484 45 45 GLU H H 8.656 0.000 . 485 45 45 GLU HA H 4.205 0.010 . 486 45 45 GLU HB2 H 1.936 0.010 . 487 45 45 GLU HB3 H 2.020 0.010 . 488 45 45 GLU HG2 H 1.924 0.010 . 489 45 45 GLU HG3 H 2.223 0.010 . 490 45 45 GLU C C 176.283 0.010 . 491 45 45 GLU CA C 56.788 0.000 . 492 45 45 GLU CB C 29.861 0.000 . 493 45 45 GLU CG C 34.344 0.000 . 494 45 45 GLU N N 121.282 0.000 . 495 46 46 ASP H H 8.424 0.010 . 496 46 46 ASP HA H 4.361 0.010 . 497 46 46 ASP HB2 H 1.595 0.010 . 498 46 46 ASP HB3 H 2.644 0.010 . 499 46 46 ASP C C 176.289 0.000 . 500 46 46 ASP CA C 54.594 0.000 . 501 46 46 ASP CB C 40.888 0.000 . 502 46 46 ASP N N 122.409 0.010 . 503 47 47 SER H H 8.181 0.000 . 504 47 47 SER HA H 4.387 0.010 . 505 47 47 SER HB2 H 4.272 0.010 . 506 47 47 SER HB3 H 4.387 0.010 . 507 47 47 SER C C 174.614 0.010 . 508 47 47 SER CA C 58.476 0.000 . 509 47 47 SER CB C 63.532 0.010 . 510 47 47 SER N N 116.454 0.000 . 511 48 48 ILE H H 8.088 0.000 . 512 48 48 ILE HA H 4.108 0.010 . 513 48 48 ILE HB H 1.877 0.010 . 514 48 48 ILE HG12 H 1.869 0.010 . 515 48 48 ILE HG13 H 2.182 0.010 . 516 48 48 ILE HG2 H 0.859 0.010 . 517 48 48 ILE HD1 H 0.858 0.010 . 518 48 48 ILE C C 176.359 0.010 . 519 48 48 ILE CA C 61.486 0.010 . 520 48 48 ILE CB C 38.038 0.010 . 521 48 48 ILE N N 122.867 0.000 . 522 49 49 LEU H H 8.127 0.010 . 523 49 49 LEU HA H 4.302 0.010 . 524 49 49 LEU HB2 H 0.878 0.010 . 525 49 49 LEU HB3 H 1.622 0.010 . 526 49 49 LEU HG H 1.624 0.010 . 527 49 49 LEU HD1 H 0.877 0.010 . 528 49 49 LEU HD2 H 0.872 0.010 . 529 49 49 LEU C C 177.238 0.010 . 530 49 49 LEU CA C 55.747 0.010 . 531 49 49 LEU CB C 41.732 0.000 . 532 49 49 LEU CG C 24.273 0.010 . 533 49 49 LEU CD1 C 23.150 0.010 . 534 49 49 LEU CD2 C 23.149 0.010 . 535 49 49 LEU N N 125.225 0.010 . 536 50 50 ASP H H 8.258 0.010 . 537 50 50 ASP HA H 4.483 0.010 . 538 50 50 ASP HB2 H 2.625 0.010 . 539 50 50 ASP HB3 H 2.625 0.010 . 540 50 50 ASP C C 176.559 0.010 . 541 50 50 ASP CA C 54.752 0.000 . 542 50 50 ASP CB C 40.818 0.010 . 543 50 50 ASP N N 119.984 0.010 . 544 51 51 LYS H H 8.032 0.010 . 545 51 51 LYS HA H 4.081 0.010 . 546 51 51 LYS HB2 H 1.327 0.010 . 547 51 51 LYS HB3 H 1.627 0.010 . 548 51 51 LYS HG2 H 1.181 0.010 . 549 51 51 LYS HG3 H 1.181 0.010 . 550 51 51 LYS HD2 H 1.181 0.010 . 551 51 51 LYS HD3 H 1.576 0.010 . 552 51 51 LYS HE2 H 2.897 0.010 . 553 51 51 LYS HE3 H 2.892 0.010 . 554 51 51 LYS C C 177.312 0.010 . 555 51 51 LYS CA C 57.010 0.010 . 556 51 51 LYS CB C 32.401 0.010 . 557 51 51 LYS CG C 24.054 0.010 . 558 51 51 LYS CD C 28.530 0.010 . 559 51 51 LYS CE C 44.930 0.010 . 560 51 51 LYS N N 120.913 0.010 . 561 52 52 TYR H H 8.125 0.010 . 562 52 52 TYR HA H 3.066 0.010 . 563 52 52 TYR HB2 H 2.939 0.010 . 564 52 52 TYR HB3 H 3.046 0.010 . 565 52 52 TYR C C 176.055 0.000 . 566 52 52 TYR CA C 58.255 0.010 . 567 52 52 TYR CB C 38.124 0.010 . 568 52 52 TYR N N 120.802 0.010 . 569 53 53 VAL H H 7.891 0.010 . 570 53 53 VAL HA H 4.300 0.010 . 571 53 53 VAL HB H 1.897 0.010 . 572 53 53 VAL HG1 H 0.862 0.000 . 573 53 53 VAL HG2 H 1.853 0.010 . 574 53 53 VAL C C 176.944 0.010 . 575 53 53 VAL CA C 63.165 0.010 . 576 53 53 VAL CB C 32.228 0.010 . 577 53 53 VAL CG1 C 21.900 0.010 . 578 53 53 VAL CG2 C 23.240 0.010 . 579 53 53 VAL N N 122.735 0.010 . 580 54 54 LYS H H 8.349 0.010 . 581 54 54 LYS HA H 4.272 0.010 . 582 54 54 LYS HB2 H 1.562 0.010 . 583 54 54 LYS HB3 H 1.562 0.010 . 584 54 54 LYS HG2 H 0.638 0.010 . 585 54 54 LYS HG3 H 1.887 0.010 . 586 54 54 LYS HD2 H 1.764 0.010 . 587 54 54 LYS HD3 H 2.232 0.010 . 588 54 54 LYS HE2 H 2.821 0.010 . 589 54 54 LYS HE3 H 2.925 0.010 . 590 54 54 LYS C C 176.158 0.010 . 591 54 54 LYS CA C 56.412 0.010 . 592 54 54 LYS CB C 29.948 0.010 . 593 54 54 LYS CG C 24.675 0.010 . 594 54 54 LYS CD C 30.089 0.010 . 595 54 54 LYS CE C 41.034 0.010 . 596 54 54 LYS N N 121.707 0.010 . 597 55 55 GLN H H 8.287 0.000 . 598 55 55 GLN HA H 4.222 0.000 . 599 55 55 GLN HB2 H 1.805 0.010 . 600 55 55 GLN HB3 H 1.897 0.010 . 601 55 55 GLN HG2 H 2.073 0.010 . 602 55 55 GLN HG3 H 2.211 0.010 . 603 55 55 GLN HE21 H 7.975 0.010 . 604 55 55 GLN HE22 H 7.974 0.010 . 605 55 55 GLN C C 176.389 0.010 . 606 55 55 GLN CA C 56.514 0.000 . 607 55 55 GLN CB C 30.103 0.010 . 608 55 55 GLN CG C 35.908 0.010 . 609 55 55 GLN N N 121.622 0.010 . 610 55 55 GLN NE2 N 121.696 0.010 . 611 56 56 HIS H H 8.372 0.010 . 612 56 56 HIS HA H 4.650 0.010 . 613 56 56 HIS HB2 H 2.820 0.010 . 614 56 56 HIS HB3 H 3.087 0.010 . 615 56 56 HIS HD1 H 8.199 0.010 . 616 56 56 HIS C C 176.452 0.010 . 617 56 56 HIS CA C 56.463 0.010 . 618 56 56 HIS CB C 29.999 0.010 . 619 56 56 HIS N N 122.167 0.010 . 620 57 57 ARG H H 8.279 0.000 . 621 57 57 ARG HA H 4.204 0.010 . 622 57 57 ARG HB2 H 1.938 0.010 . 623 57 57 ARG HB3 H 2.012 0.010 . 624 57 57 ARG HG2 H 1.620 0.010 . 625 57 57 ARG HG3 H 1.624 0.010 . 626 57 57 ARG HD2 H 3.158 0.010 . 627 57 57 ARG HD3 H 3.154 0.010 . 628 57 57 ARG C C 176.636 0.010 . 629 57 57 ARG CA C 56.518 0.010 . 630 57 57 ARG CB C 28.743 0.010 . 631 57 57 ARG CG C 26.851 0.010 . 632 57 57 ARG CD C 42.934 0.010 . 633 57 57 ARG N N 123.641 0.010 . 634 58 58 ASP H H 8.409 0.010 . 635 58 58 ASP HA H 4.524 0.010 . 636 58 58 ASP HB2 H 2.529 0.010 . 637 58 58 ASP HB3 H 2.633 0.010 . 638 58 58 ASP C C 176.174 0.010 . 639 58 58 ASP CA C 54.351 0.010 . 640 58 58 ASP CB C 40.990 0.010 . 641 58 58 ASP N N 122.241 0.010 . 642 59 59 GLU H H 8.308 0.010 . 643 59 59 GLU HA H 4.247 0.000 . 644 59 59 GLU HB2 H 1.934 0.000 . 645 59 59 GLU HB3 H 1.987 0.010 . 646 59 59 GLU HG2 H 2.216 0.000 . 647 59 59 GLU HG3 H 2.456 0.010 . 648 59 59 GLU C C 176.586 0.010 . 649 59 59 GLU CA C 56.839 0.010 . 650 59 59 GLU CB C 29.765 0.000 . 651 59 59 GLU CG C 35.978 0.000 . 652 59 59 GLU N N 123.022 0.010 . 653 60 60 ILE H H 8.093 0.000 . 654 60 60 ILE HA H 4.040 0.010 . 655 60 60 ILE HB H 2.037 0.010 . 656 60 60 ILE HG12 H 2.040 0.010 . 657 60 60 ILE HG13 H 2.040 0.010 . 658 60 60 ILE C C 176.532 0.000 . 659 60 60 ILE CA C 62.002 0.010 . 660 60 60 ILE CB C 32.85 0.010 . 661 60 60 ILE CG1 C 32.392 0.010 . 662 60 60 ILE CG2 C 20.515 0.010 . 663 60 60 ILE CD1 C 20.396 0.010 . 664 60 60 ILE N N 121.629 0.000 . 665 61 61 GLU H H 8.428 0.010 . 666 61 61 GLU HA H 4.181 0.000 . 667 61 61 GLU HB2 H 1.927 0.010 . 668 61 61 GLU HB3 H 2.233 0.010 . 669 61 61 GLU HG2 H 2.233 0.000 . 670 61 61 GLU HG3 H 2.233 0.000 . 671 61 61 GLU C C 176.530 0.000 . 672 61 61 GLU CA C 56.722 0.000 . 673 61 61 GLU CB C 29.744 0.000 . 674 61 61 GLU CG C 35.984 0.000 . 675 61 61 GLU N N 124.847 0.000 . 676 62 62 ALA H H 8.219 0.000 . 677 62 62 ALA HA H 4.155 0.000 . 678 62 62 ALA HB H 1.356 0.000 . 679 62 62 ALA C C 177.894 0.000 . 680 62 62 ALA CA C 52.956 0.000 . 681 62 62 ALA CB C 18.799 0.000 . 682 62 62 ALA N N 125.072 0.000 . 683 63 63 ASP H H 8.224 0.010 . 684 63 63 ASP HA H 4.229 0.010 . 685 63 63 ASP HB2 H 2.622 0.010 . 686 63 63 ASP HB3 H 2.615 0.000 . 687 63 63 ASP C C 177.822 0.010 . 688 63 63 ASP CA C 54.485 0.000 . 689 63 63 ASP CB C 40.773 0.000 . 690 63 63 ASP N N 119.504 0.010 . 691 64 64 LYS H H 8.065 0.000 . 692 64 64 LYS HA H 4.080 0.000 . 693 64 64 LYS HB2 H 1.344 0.000 . 694 64 64 LYS HB3 H 1.584 0.000 . 695 64 64 LYS HG2 H 1.344 0.000 . 696 64 64 LYS HG3 H 1.344 0.010 . 697 64 64 LYS HD2 H 1.344 0.010 . 698 64 64 LYS HD3 H 1.344 0.010 . 699 64 64 LYS C C 177.105 0.010 . 700 64 64 LYS CA C 56.973 0.000 . 701 64 64 LYS CB C 32.141 0.000 . 702 64 64 LYS CG C 18.951 0.000 . 703 64 64 LYS CD C 28.535 0.010 . 704 64 64 LYS CE C 44.936 0.010 . 705 64 64 LYS N N 121.978 0.000 . 706 65 65 PHE H H 8.123 0.000 . 707 65 65 PHE HA H 3.208 0.000 . 708 65 65 PHE HB2 H 2.966 0.000 . 709 65 65 PHE HB3 H 3.207 0.010 . 710 65 65 PHE C C 175.590 0.000 . 711 65 65 PHE CA C 57.646 0.000 . 712 65 65 PHE CB C 38.916 0.000 . 713 65 65 PHE N N 119.930 0.000 . 714 66 66 ALA H H 7.970 0.000 . 715 66 66 ALA HA H 4.271 0.000 . 716 66 66 ALA HB H 1.391 0.000 . 717 66 66 ALA C C 177.984 0.000 . 718 66 66 ALA CA C 52.883 0.000 . 719 66 66 ALA CB C 18.917 0.000 . 720 66 66 ALA N N 124.645 0.000 . 721 67 67 THR H H 8.042 0.000 . 722 67 67 THR HA H 4.307 0.010 . 723 67 67 THR HB H 4.309 0.000 . 724 67 67 THR HG2 H 1.158 0.000 . 725 67 67 THR C C 175.815 0.010 . 726 67 67 THR CA C 61.810 0.000 . 727 67 67 THR CB C 69.536 0.000 . 728 67 67 THR CG2 C 21.328 0.000 . 729 67 67 THR N N 113.060 0.000 . 730 68 68 ARG H H 8.473 0.010 . 731 68 68 ARG HA H 4.212 0.010 . 732 68 68 ARG HB2 H 1.885 0.010 . 733 68 68 ARG HB3 H 2.009 0.010 . 734 68 68 ARG HG2 H 1.587 0.010 . 735 68 68 ARG HG3 H 1.842 0.010 . 736 68 68 ARG HD2 H 2.927 0.010 . 737 68 68 ARG HD3 H 3.161 0.010 . 738 68 68 ARG C C 176.236 0.010 . 739 68 68 ARG CA C 56.219 0.010 . 740 68 68 ARG CB C 30.088 0.010 . 741 68 68 ARG CG C 28.335 0.010 . 742 68 68 ARG CD C 43.034 0.010 . 743 68 68 ARG N N 124.185 0.000 . 744 69 69 GLN H H 8.216 0.010 . 745 69 69 GLN HA H 4.239 0.010 . 746 69 69 GLN HB2 H 1.860 0.010 . 747 69 69 GLN HB3 H 2.204 0.010 . 748 69 69 GLN HG2 H 2.207 0.010 . 749 69 69 GLN HG3 H 2.204 0.010 . 750 69 69 GLN HE21 H 7.513 0.010 . 751 69 69 GLN HE22 H 7.525 0.010 . 752 69 69 GLN C C 176.162 0.010 . 753 69 69 GLN CA C 56.166 0.010 . 754 69 69 GLN CB C 30.048 0.010 . 755 69 69 GLN CG C 35.910 0.010 . 756 69 69 GLN N N 123.438 0.010 . 757 69 69 GLN NE2 N 113.078 0.010 . 758 70 70 TYR H H 8.267 0.010 . 759 70 70 TYR HA H 4.595 0.010 . 760 70 70 TYR HB2 H 3.011 0.010 . 761 70 70 TYR HB3 H 3.014 0.010 . 762 70 70 TYR C C 175.844 0.010 . 763 70 70 TYR CA C 57.608 0.010 . 764 70 70 TYR CB C 39.266 0.010 . 765 70 70 TYR N N 122.154 0.010 . 766 71 71 LYS H H 7.983 0.010 . 767 71 71 LYS HA H 4.250 0.010 . 768 71 71 LYS HB2 H 1.509 0.010 . 769 71 71 LYS HB3 H 1.779 0.010 . 770 71 71 LYS HG2 H 1.181 0.010 . 771 71 71 LYS HG3 H 1.787 0.010 . 772 71 71 LYS HD2 H 1.772 0.010 . 773 71 71 LYS HD3 H 1.783 0.010 . 774 71 71 LYS HE2 H 2.956 0.010 . 775 71 71 LYS HE3 H 3.067 0.010 . 776 71 71 LYS C C 175.596 0.010 . 777 71 71 LYS CA C 61.927 0.010 . 778 71 71 LYS CB C 32.669 0.010 . 779 71 71 LYS CG C 24.316 0.000 . 780 71 71 LYS CD C 28.600 0.000 . 781 71 71 LYS CE C 42.284 0.010 . 782 71 71 LYS N N 123.860 0.010 . 783 72 72 LYS H H 8.369 0.000 . 784 72 72 LYS HA H 4.301 0.010 . 785 72 72 LYS HB2 H 1.751 0.010 . 786 72 72 LYS HB3 H 2.664 0.010 . 787 72 72 LYS HG2 H 0.864 0.010 . 788 72 72 LYS HG3 H 1.613 0.010 . 789 72 72 LYS HD2 H 1.606 0.010 . 790 72 72 LYS HD3 H 1.883 0.010 . 791 72 72 LYS HE2 H 2.940 0.010 . 792 72 72 LYS HE3 H 3.041 0.010 . 793 72 72 LYS C C 176.800 0.010 . 794 72 72 LYS CA C 54.392 0.000 . 795 72 72 LYS CB C 29.890 0.010 . 796 72 72 LYS CG C 26.871 0.010 . 797 72 72 LYS CD C 26.860 0.010 . 798 72 72 LYS CE C 40.988 0.010 . 799 72 72 LYS N N 124.285 0.000 . 800 73 73 GLU H H 8.332 0.010 . 801 73 73 GLU HA H 4.221 0.010 . 802 73 73 GLU HB2 H 1.706 0.010 . 803 73 73 GLU HB3 H 2.163 0.010 . 804 73 73 GLU HG2 H 2.076 0.010 . 805 73 73 GLU HG3 H 2.323 0.010 . 806 73 73 GLU C C 176.038 0.010 . 807 73 73 GLU CA C 56.478 0.010 . 808 73 73 GLU CB C 31.832 0.010 . 809 73 73 GLU CG C 35.883 0.010 . 810 73 73 GLU N N 121.722 0.000 . 811 74 74 GLU H H 8.387 0.010 . 812 74 74 GLU HA H 4.216 0.010 . 813 74 74 GLU HB2 H 1.840 0.000 . 814 74 74 GLU HB3 H 2.191 0.010 . 815 74 74 GLU HG2 H 2.192 0.010 . 816 74 74 GLU HG3 H 2.194 0.010 . 817 74 74 GLU C C 175.789 0.010 . 818 74 74 GLU CA C 55.447 0.010 . 819 74 74 GLU CB C 29.290 0.010 . 820 74 74 GLU CG C 33.285 0.010 . 821 74 74 GLU N N 122.047 0.010 . 822 75 75 PHE H H 8.196 0.010 . 823 75 75 PHE HA H 4.601 0.000 . 824 75 75 PHE HB2 H 3.015 0.000 . 825 75 75 PHE HB3 H 3.015 0.010 . 826 75 75 PHE C C 175.071 0.010 . 827 75 75 PHE CA C 57.563 0.000 . 828 75 75 PHE CB C 39.368 0.000 . 829 75 75 PHE N N 122.077 0.000 . 830 76 76 VAL H H 7.984 0.000 . 831 76 76 VAL HA H 4.082 0.010 . 832 76 76 VAL HB H 2.020 0.010 . 833 76 76 VAL HG1 H 0.875 0.000 . 834 76 76 VAL HG2 H 0.911 0.010 . 835 76 76 VAL C C 175.932 0.000 . 836 76 76 VAL CA C 61.878 0.000 . 837 76 76 VAL CB C 32.743 0.000 . 838 76 76 VAL CG1 C 17.256 0.010 . 839 76 76 VAL CG2 C 20.628 0.000 . 840 76 76 VAL N N 123.900 0.000 . 841 77 77 GLU H H 8.522 0.010 . 842 77 77 GLU HA H 4.255 0.010 . 843 77 77 GLU HB2 H 2.022 0.010 . 844 77 77 GLU HB3 H 2.244 0.010 . 845 77 77 GLU HG2 H 2.244 0.010 . 846 77 77 GLU HG3 H 2.556 0.010 . 847 77 77 GLU C C 176.419 0.000 . 848 77 77 GLU CA C 56.395 0.000 . 849 77 77 GLU CB C 30.024 0.000 . 850 77 77 GLU CG C 35.963 0.000 . 851 77 77 GLU N N 126.082 0.000 . 852 78 78 THR H H 8.242 0.000 . 853 78 78 THR HA H 4.205 0.010 . 854 78 78 THR HB H 4.314 0.010 . 855 78 78 THR HG2 H 1.144 0.000 . 856 78 78 THR C C 174.476 0.010 . 857 78 78 THR CA C 61.705 0.000 . 858 78 78 THR CB C 69.579 0.000 . 859 78 78 THR CG2 C 21.276 0.000 . 860 78 78 THR N N 116.906 0.000 . 861 79 79 GLN H H 8.147 0.000 . 862 79 79 GLN HA H 4.243 0.010 . 863 79 79 GLN HB2 H 2.017 0.010 . 864 79 79 GLN HB3 H 2.040 0.010 . 865 79 79 GLN HG2 H 2.238 0.010 . 866 79 79 GLN HG3 H 2.554 0.010 . 867 79 79 GLN HE21 H 7.514 0.010 . 868 79 79 GLN HE22 H 7.748 0.010 . 869 79 79 GLN C C 175.999 0.010 . 870 79 79 GLN CA C 55.474 0.010 . 871 79 79 GLN CB C 32.455 0.010 . 872 79 79 GLN CG C 35.920 0.010 . 873 79 79 GLN N N 123.265 0.000 . 874 79 79 GLN NE2 N 113.403 0.010 . 875 80 80 SER H H 8.251 0.010 . 876 80 80 SER HA H 4.421 0.010 . 877 80 80 SER HB2 H 3.860 0.010 . 878 80 80 SER HB3 H 4.420 0.010 . 879 80 80 SER C C 174.538 0.010 . 880 80 80 SER CA C 58.184 0.010 . 881 80 80 SER CB C 63.584 0.010 . 882 80 80 SER N N 117.035 0.010 . 883 81 81 LEU H H 8.459 0.010 . 884 81 81 LEU HA H 4.250 0.000 . 885 81 81 LEU HB2 H 1.337 0.010 . 886 81 81 LEU HB3 H 1.577 0.010 . 887 81 81 LEU HG H 1.577 0.010 . 888 81 81 LEU HD1 H 0.844 0.010 . 889 81 81 LEU HD2 H 1.334 0.010 . 890 81 81 LEU C C 177.316 0.000 . 891 81 81 LEU CA C 55.305 0.010 . 892 81 81 LEU CB C 41.871 0.000 . 893 81 81 LEU CG C 26.642 0.000 . 894 81 81 LEU CD1 C 23.267 0.000 . 895 81 81 LEU CD2 C 24.383 0.010 . 896 81 81 LEU N N 123.003 0.010 . 897 82 82 ASP H H 8.160 0.010 . 898 82 82 ASP HA H 4.484 0.000 . 899 82 82 ASP HB2 H 2.513 0.000 . 900 82 82 ASP HB3 H 2.647 0.000 . 901 82 82 ASP C C 176.254 0.000 . 902 82 82 ASP CA C 54.878 0.000 . 903 82 82 ASP CB C 40.729 0.000 . 904 82 82 ASP N N 121.248 0.010 . 905 83 83 ASP H H 7.974 0.010 . 906 83 83 ASP HA H 4.488 0.000 . 907 83 83 ASP HB2 H 2.635 0.010 . 908 83 83 ASP HB3 H 2.638 0.000 . 909 83 83 ASP C C 176.534 0.000 . 910 83 83 ASP CA C 54.925 0.000 . 911 83 83 ASP CB C 40.621 0.000 . 912 83 83 ASP N N 120.508 0.000 . 913 84 84 LEU H H 7.990 0.000 . 914 84 84 LEU HA H 4.488 0.010 . 915 84 84 LEU HB2 H 1.576 0.010 . 916 84 84 LEU HB3 H 2.630 0.010 . 917 84 84 LEU HG H 0.853 0.010 . 918 84 84 LEU HD1 H 0.858 0.000 . 919 84 84 LEU HD2 H 0.860 0.010 . 920 84 84 LEU C C 176.958 0.010 . 921 84 84 LEU CA C 55.784 0.010 . 922 84 84 LEU CB C 41.807 0.010 . 923 84 84 LEU CG C 26.593 0.010 . 924 84 84 LEU CD1 C 23.486 0.010 . 925 84 84 LEU CD2 C 24.160 0.010 . 926 84 84 LEU N N 122.300 0.000 . 927 85 85 ILE H H 8.045 0.010 . 928 85 85 ILE HA H 4.261 0.010 . 929 85 85 ILE HB H 1.767 0.010 . 930 85 85 ILE HG12 H 1.613 0.010 . 931 85 85 ILE HG13 H 1.604 0.010 . 932 85 85 ILE HG2 H 0.854 0.010 . 933 85 85 ILE HD1 H 0.848 0.010 . 934 85 85 ILE C C 176.729 0.000 . 935 85 85 ILE CA C 61.695 0.010 . 936 85 85 ILE CB C 38.031 0.010 . 937 85 85 ILE CG1 C 32.382 0.010 . 938 85 85 ILE CG2 C 20.487 0.010 . 939 85 85 ILE CD1 C 20.395 0.010 . 940 85 85 ILE N N 121.917 0.010 . 941 86 86 GLN H H 8.400 0.010 . 942 86 86 GLN HA H 4.229 0.010 . 943 86 86 GLN HB2 H 1.903 0.010 . 944 86 86 GLN HB3 H 2.016 0.010 . 945 86 86 GLN HG2 H 2.207 0.010 . 946 86 86 GLN HG3 H 2.208 0.010 . 947 86 86 GLN HE21 H 7.525 0.010 . 948 86 86 GLN HE22 H 8.349 0.010 . 949 86 86 GLN C C 176.175 0.010 . 950 86 86 GLN CA C 56.499 0.010 . 951 86 86 GLN CB C 29.942 0.010 . 952 86 86 GLN CG C 35.921 0.010 . 953 86 86 GLN N N 124.672 0.010 . 954 87 87 GLU H H 8.438 0.010 . 955 87 87 GLU HA H 4.241 0.010 . 956 87 87 GLU HB2 H 1.870 0.010 . 957 87 87 GLU HB3 H 2.003 0.010 . 958 87 87 GLU HG2 H 1.858 0.010 . 959 87 87 GLU HG3 H 2.871 0.010 . 960 87 87 GLU C C 176.314 0.010 . 961 87 87 GLU CA C 56.409 0.010 . 962 87 87 GLU CB C 30.088 0.010 . 963 87 87 GLU CG C 35.900 0.010 . 964 87 87 GLU N N 122.234 0.010 . 965 88 88 MET H H 8.264 0.010 . 966 88 88 MET HA H 4.238 0.010 . 967 88 88 MET HB2 H 1.892 0.010 . 968 88 88 MET HB3 H 1.979 0.010 . 969 88 88 MET HG2 H 1.869 0.010 . 970 88 88 MET HG3 H 2.223 0.010 . 971 88 88 MET C C 176.024 0.010 . 972 88 88 MET CA C 56.306 0.010 . 973 88 88 MET CB C 32.612 0.010 . 974 88 88 MET CG C 35.857 0.010 . 975 88 88 MET N N 123.303 0.010 . 976 89 89 ARG H H 8.271 0.010 . 977 89 89 ARG HA H 4.343 0.010 . 978 89 89 ARG HB2 H 1.753 0.010 . 979 89 89 ARG HB3 H 1.790 0.010 . 980 89 89 ARG HG2 H 1.588 0.010 . 981 89 89 ARG HG3 H 1.585 0.010 . 982 89 89 ARG HD2 H 3.160 0.010 . 983 89 89 ARG HD3 H 3.159 0.010 . 984 89 89 ARG C C 176.285 0.010 . 985 89 89 ARG CA C 56.096 0.010 . 986 89 89 ARG CB C 30.270 0.000 . 987 89 89 ARG CG C 26.775 0.000 . 988 89 89 ARG CD C 43.028 0.000 . 989 89 89 ARG N N 122.740 0.010 . 990 90 90 GLU H H 8.546 0.010 . 991 90 90 GLU HA H 4.264 0.010 . 992 90 90 GLU HB2 H 1.928 0.010 . 993 90 90 GLU HB3 H 2.028 0.010 . 994 90 90 GLU HG2 H 2.226 0.010 . 995 90 90 GLU HG3 H 2.227 0.010 . 996 90 90 GLU C C 175.999 0.010 . 997 90 90 GLU CA C 56.387 0.010 . 998 90 90 GLU CB C 29.981 0.010 . 999 90 90 GLU CG C 35.907 0.000 . 1000 90 90 GLU N N 124.496 0.010 . 1001 91 91 ALA H H 8.335 0.010 . 1002 91 91 ALA HA H 4.275 0.000 . 1003 91 91 ALA HB H 1.371 0.000 . 1004 91 91 ALA C C 177.709 0.010 . 1005 91 91 ALA CA C 52.610 0.000 . 1006 91 91 ALA CB C 18.832 0.000 . 1007 91 91 ALA N N 125.911 0.010 . 1008 92 92 VAL H H 8.015 0.000 . 1009 92 92 VAL HA H 4.505 0.010 . 1010 92 92 VAL HB H 2.887 0.010 . 1011 92 92 VAL HG1 H 1.176 0.010 . 1012 92 92 VAL HG2 H 1.176 0.010 . 1013 92 92 VAL C C 176.051 0.010 . 1014 92 92 VAL CA C 62.807 0.000 . 1015 92 92 VAL CB C 32.473 0.000 . 1016 92 92 VAL CG1 C 23.177 0.010 . 1017 92 92 VAL CG2 C 24.443 0.010 . 1018 92 92 VAL N N 119.992 0.000 . 1019 93 93 GLU H H 8.209 0.000 . 1020 93 93 GLU HA H 4.273 0.010 . 1021 93 93 GLU HB2 H 1.894 0.000 . 1022 93 93 GLU HB3 H 1.998 0.010 . 1023 93 93 GLU HG2 H 2.201 0.010 . 1024 93 93 GLU HG3 H 2.301 0.010 . 1025 93 93 GLU C C 175.855 0.010 . 1026 93 93 GLU CA C 56.027 0.000 . 1027 93 93 GLU CB C 29.861 0.000 . 1028 93 93 GLU CG C 35.808 0.010 . 1029 93 93 GLU N N 124.645 0.000 . 1030 94 94 LYS H H 8.463 0.000 . 1031 94 94 LYS HA H 4.296 0.000 . 1032 94 94 LYS HB2 H 1.768 0.000 . 1033 94 94 LYS HB3 H 1.802 0.000 . 1034 94 94 LYS HG2 H 1.399 0.000 . 1035 94 94 LYS HG3 H 1.403 0.000 . 1036 94 94 LYS HD2 H 1.401 0.000 . 1037 94 94 LYS HD3 H 1.646 0.000 . 1038 94 94 LYS HE2 H 2.942 0.000 . 1039 94 94 LYS HE3 H 2.942 0.010 . 1040 94 94 LYS C C 176.491 0.000 . 1041 94 94 LYS CA C 56.258 0.000 . 1042 94 94 LYS CB C 32.627 0.000 . 1043 94 94 LYS N N 122.882 0.000 . 1044 95 95 SER H H 8.372 0.000 . 1045 95 95 SER HA H 4.419 0.010 . 1046 95 95 SER HB2 H 3.852 0.010 . 1047 95 95 SER HB3 H 4.411 0.010 . 1048 95 95 SER C C 174.343 0.000 . 1049 95 95 SER CA C 58.258 0.000 . 1050 95 95 SER CB C 63.545 0.000 . 1051 95 95 SER N N 118.204 0.000 . 1052 96 96 GLU H H 8.387 0.010 . 1053 96 96 GLU HA H 4.267 0.010 . 1054 96 96 GLU HB2 H 1.928 0.010 . 1055 96 96 GLU HB3 H 2.017 0.010 . 1056 96 96 GLU HG2 H 2.225 0.010 . 1057 96 96 GLU HG3 H 2.224 0.010 . 1058 96 96 GLU C C 175.976 0.000 . 1059 96 96 GLU CA C 56.281 0.000 . 1060 96 96 GLU CB C 29.976 0.000 . 1061 96 96 GLU CG C 35.888 0.000 . 1062 96 96 GLU N N 123.327 0.010 . 1063 97 97 ALA H H 8.336 0.010 . 1064 97 97 ALA HA H 4.303 0.000 . 1065 97 97 ALA HB H 1.361 0.000 . 1066 97 97 ALA C C 177.666 0.000 . 1067 97 97 ALA CA C 52.377 0.000 . 1068 97 97 ALA CB C 19.043 0.000 . 1069 97 97 ALA N N 125.878 0.000 . 1070 98 98 SER H H 8.334 0.000 . 1071 98 98 SER HA H 4.440 0.010 . 1072 98 98 SER HB2 H 3.865 0.010 . 1073 98 98 SER HB3 H 4.439 0.000 . 1074 98 98 SER C C 174.680 0.000 . 1075 98 98 SER CA C 58.107 0.000 . 1076 98 98 SER CB C 63.615 0.010 . 1077 98 98 SER N N 116.150 0.000 . 1078 99 99 SER H H 8.448 0.010 . 1079 99 99 SER HA H 4.417 0.010 . 1080 99 99 SER HB2 H 3.851 0.010 . 1081 99 99 SER HB3 H 4.416 0.010 . 1082 99 99 SER C C 174.234 0.000 . 1083 99 99 SER CA C 58.247 0.000 . 1084 99 99 SER CB C 63.584 0.010 . 1085 99 99 SER N N 118.820 0.000 . 1086 100 100 GLU H H 8.386 0.010 . 1087 100 100 GLU HA H 4.219 0.010 . 1088 100 100 GLU HB2 H 2.006 0.010 . 1089 100 100 GLU HB3 H 1.998 0.010 . 1090 100 100 GLU HG2 H 2.250 0.010 . 1091 100 100 GLU HG3 H 2.236 0.010 . 1092 100 100 GLU C C 175.945 0.010 . 1093 100 100 GLU CA C 56.295 0.010 . 1094 100 100 GLU CB C 32.635 0.010 . 1095 100 100 GLU CG C 35.883 0.010 . 1096 100 100 GLU N N 123.108 0.010 . 1097 101 101 GLU H H 8.530 0.010 . 1098 101 101 GLU HA H 4.310 0.010 . 1099 101 101 GLU HB2 H 1.886 0.010 . 1100 101 101 GLU HB3 H 1.863 0.010 . 1101 101 101 GLU HG2 H 1.821 0.010 . 1102 101 101 GLU HG3 H 2.214 0.010 . 1103 101 101 GLU C C 175.437 0.010 . 1104 101 101 GLU CA C 56.249 0.000 . 1105 101 101 GLU CB C 32.669 0.010 . 1106 101 101 GLU CG C 35.912 0.010 . 1107 101 101 GLU N N 122.152 0.010 . 1108 102 102 VAL H H 7.982 0.010 . 1109 102 102 VAL CA C 57.608 0.010 . 1110 102 102 VAL CB C 32.328 0.010 . 1111 102 102 VAL N N 124.302 0.010 . 1112 103 103 PRO HA H 4.427 0.000 . 1113 103 103 PRO HB2 H 1.888 0.010 . 1114 103 103 PRO HB3 H 2.290 0.000 . 1115 103 103 PRO HG2 H 1.976 0.000 . 1116 103 103 PRO HG3 H 1.976 0.010 . 1117 103 103 PRO HD2 H 3.648 0.000 . 1118 103 103 PRO HD3 H 3.835 0.000 . 1119 103 103 PRO C C 176.775 0.000 . 1120 103 103 PRO CA C 62.912 0.000 . 1121 103 103 PRO CB C 31.914 0.000 . 1122 103 103 PRO CG C 27.143 0.000 . 1123 103 103 PRO CD C 50.888 0.000 . 1124 104 104 SER H H 8.548 0.000 . 1125 104 104 SER HA H 4.441 0.000 . 1126 104 104 SER HB2 H 3.865 0.000 . 1127 104 104 SER HB3 H 4.444 0.010 . 1128 104 104 SER C C 174.652 0.000 . 1129 104 104 SER CA C 58.098 0.000 . 1130 104 104 SER CB C 63.691 0.010 . 1131 104 104 SER N N 117.462 0.000 . 1132 105 105 SER H H 8.418 0.010 . 1133 105 105 SER HA H 4.410 0.010 . 1134 105 105 SER HB2 H 3.850 0.010 . 1135 105 105 SER HB3 H 4.415 0.010 . 1136 105 105 SER C C 174.323 0.010 . 1137 105 105 SER CA C 58.214 0.000 . 1138 105 105 SER CB C 63.584 0.000 . 1139 105 105 SER N N 118.811 0.000 . 1140 106 106 GLU H H 8.484 0.010 . 1141 106 106 GLU HA H 4.209 0.000 . 1142 106 106 GLU HB2 H 1.835 0.010 . 1143 106 106 GLU HB3 H 2.021 0.010 . 1144 106 106 GLU HG2 H 2.202 0.010 . 1145 106 106 GLU HG3 H 2.203 0.000 . 1146 106 106 GLU C C 176.284 0.010 . 1147 106 106 GLU CA C 56.460 0.010 . 1148 106 106 GLU CB C 29.980 0.010 . 1149 106 106 GLU CG C 33.274 0.010 . 1150 106 106 GLU N N 123.583 0.010 . 1151 107 107 ASP H H 8.208 0.010 . 1152 107 107 ASP HA H 4.538 0.000 . 1153 107 107 ASP HB2 H 2.523 0.000 . 1154 107 107 ASP HB3 H 2.634 0.000 . 1155 107 107 ASP C C 175.786 0.000 . 1156 107 107 ASP CA C 54.285 0.000 . 1157 107 107 ASP CB C 40.826 0.000 . 1158 107 107 ASP N N 122.172 0.000 . 1159 108 108 ILE H H 7.979 0.000 . 1160 108 108 ILE HA H 4.097 0.000 . 1161 108 108 ILE HB H 1.823 0.000 . 1162 108 108 ILE HG12 H 0.827 0.010 . 1163 108 108 ILE HG13 H 1.817 0.010 . 1164 108 108 ILE HG2 H 0.826 0.000 . 1165 108 108 ILE HD1 H 0.829 0.010 . 1166 108 108 ILE C C 175.658 0.000 . 1167 108 108 ILE CA C 60.926 0.000 . 1168 108 108 ILE CB C 38.456 0.000 . 1169 108 108 ILE CG1 C 26.826 0.000 . 1170 108 108 ILE CG2 C 16.830 0.010 . 1171 108 108 ILE CD1 C 13.191 0.010 . 1172 108 108 ILE N N 121.442 0.000 . 1173 109 109 LEU H H 8.267 0.000 . 1174 109 109 LEU HA H 4.346 0.000 . 1175 109 109 LEU HB2 H 1.544 0.010 . 1176 109 109 LEU HB3 H 1.545 0.010 . 1177 109 109 LEU HG H 1.543 0.010 . 1178 109 109 LEU HD1 H 0.848 0.000 . 1179 109 109 LEU HD2 H 0.862 0.010 . 1180 109 109 LEU C C 176.248 0.000 . 1181 109 109 LEU CA C 54.523 0.000 . 1182 109 109 LEU CB C 41.884 0.000 . 1183 109 109 LEU CG C 26.608 0.000 . 1184 109 109 LEU CD1 C 23.496 0.000 . 1185 109 109 LEU CD2 C 23.648 0.010 . 1186 109 109 LEU N N 127.307 0.000 . 1187 110 110 LEU H H 8.176 0.010 . 1188 110 110 LEU CA C 52.579 0.010 . 1189 110 110 LEU CB C 41.720 0.000 . 1190 110 110 LEU N N 126.037 0.010 . 1191 111 111 PRO HA H 4.328 0.010 . 1192 111 111 PRO HB2 H 1.851 0.010 . 1193 111 111 PRO HB3 H 2.018 0.010 . 1194 111 111 PRO HG2 H 0.955 0.010 . 1195 111 111 PRO HG3 H 1.787 0.010 . 1196 111 111 PRO HD2 H 3.580 0.010 . 1197 111 111 PRO HD3 H 3.770 0.010 . 1198 111 111 PRO C C 176.391 0.010 . 1199 111 111 PRO CA C 62.558 0.000 . 1200 111 111 PRO CB C 31.864 0.000 . 1201 111 111 PRO CG C 26.996 0.000 . 1202 111 111 PRO CD C 50.532 0.000 . 1203 112 112 LEU H H 8.265 0.010 . 1204 112 112 LEU CA C 58.203 0.010 . 1205 112 112 LEU CB C 41.343 0.000 . 1206 112 112 LEU N N 124.595 0.010 . 1207 113 113 PRO HA H 4.358 0.010 . 1208 113 113 PRO HB2 H 1.884 0.010 . 1209 113 113 PRO HB3 H 2.006 0.010 . 1210 113 113 PRO HG2 H 1.987 0.010 . 1211 113 113 PRO HG3 H 2.003 0.010 . 1212 113 113 PRO HD2 H 3.596 0.010 . 1213 113 113 PRO HD3 H 3.793 0.010 . 1214 113 113 PRO C C 176.547 0.000 . 1215 113 113 PRO CA C 62.722 0.000 . 1216 113 113 PRO CB C 31.763 0.000 . 1217 113 113 PRO CG C 26.988 0.000 . 1218 113 113 PRO CD C 50.604 0.000 . 1219 114 114 LEU H H 8.345 0.000 . 1220 114 114 LEU HA H 4.299 0.010 . 1221 114 114 LEU HB2 H 1.578 0.010 . 1222 114 114 LEU HB3 H 1.603 0.010 . 1223 114 114 LEU HG H 1.605 0.010 . 1224 114 114 LEU HD1 H 0.853 0.010 . 1225 114 114 LEU HD2 H 1.584 0.010 . 1226 114 114 LEU C C 176.703 0.010 . 1227 114 114 LEU CA C 54.789 0.010 . 1228 114 114 LEU CB C 42.207 0.010 . 1229 114 114 LEU CG C 24.408 0.010 . 1230 114 114 LEU CD1 C 23.111 0.010 . 1231 114 114 LEU CD2 C 24.492 0.010 . 1232 114 114 LEU N N 123.353 0.010 . 1233 115 115 ASP H H 8.349 0.010 . 1234 115 115 ASP HA H 4.506 0.010 . 1235 115 115 ASP HB2 H 2.697 0.010 . 1236 115 115 ASP HB3 H 2.643 0.010 . 1237 115 115 ASP C C 176.424 0.010 . 1238 115 115 ASP CA C 54.603 0.010 . 1239 115 115 ASP CB C 40.765 0.010 . 1240 115 115 ASP N N 124.010 0.010 . 1241 116 116 ASP H H 8.347 0.010 . 1242 116 116 ASP HA H 4.516 0.010 . 1243 116 116 ASP HB2 H 2.552 0.010 . 1244 116 116 ASP HB3 H 2.636 0.010 . 1245 116 116 ASP C C 176.046 0.010 . 1246 116 116 ASP CA C 54.414 0.010 . 1247 116 116 ASP CB C 40.912 0.000 . 1248 116 116 ASP N N 120.650 0.010 . 1249 117 117 GLU H H 8.301 0.010 . 1250 117 117 GLU HA H 4.188 0.010 . 1251 117 117 GLU HB2 H 1.974 0.010 . 1252 117 117 GLU HB3 H 2.226 0.010 . 1253 117 117 GLU HG2 H 2.225 0.010 . 1254 117 117 GLU HG3 H 2.226 0.010 . 1255 117 117 GLU C C 176.369 0.010 . 1256 117 117 GLU CA C 56.686 0.010 . 1257 117 117 GLU CB C 29.778 0.010 . 1258 117 117 GLU CG C 35.940 0.010 . 1259 117 117 GLU N N 121.391 0.010 . 1260 118 118 GLU H H 8.478 0.010 . 1261 118 118 GLU HA H 4.205 0.010 . 1262 118 118 GLU HB2 H 1.804 0.010 . 1263 118 118 GLU HB3 H 1.982 0.010 . 1264 118 118 GLU HG2 H 2.234 0.010 . 1265 118 118 GLU HG3 H 2.247 0.010 . 1266 118 118 GLU C C 176.579 0.010 . 1267 118 118 GLU CA C 56.446 0.000 . 1268 118 118 GLU CB C 32.387 0.010 . 1269 118 118 GLU CG C 35.912 0.010 . 1270 118 118 GLU N N 121.955 0.010 . 1271 119 119 GLN H H 8.151 0.010 . 1272 119 119 GLN HA H 4.275 0.000 . 1273 119 119 GLN HB2 H 1.958 0.010 . 1274 119 119 GLN HB3 H 2.103 0.000 . 1275 119 119 GLN HG2 H 2.339 0.010 . 1276 119 119 GLN HG3 H 2.342 0.010 . 1277 119 119 GLN HE21 H 6.858 0.010 . 1278 119 119 GLN C C 176.386 0.000 . 1279 119 119 GLN CA C 55.854 0.000 . 1280 119 119 GLN CB C 29.374 0.000 . 1281 119 119 GLN CG C 33.386 0.000 . 1282 119 119 GLN N N 121.960 0.010 . 1283 120 120 GLY H H 8.451 0.000 . 1284 120 120 GLY HA2 H 3.830 0.000 . 1285 120 120 GLY HA3 H 3.963 0.000 . 1286 120 120 GLY C C 173.701 0.000 . 1287 120 120 GLY CA C 45.102 0.000 . 1288 120 120 GLY N N 110.539 0.000 . 1289 121 121 LEU H H 8.075 0.000 . 1290 121 121 LEU HA H 4.336 0.010 . 1291 121 121 LEU HB2 H 1.552 0.010 . 1292 121 121 LEU HB3 H 1.555 0.010 . 1293 121 121 LEU HG H 1.552 0.010 . 1294 121 121 LEU HD1 H 0.851 0.000 . 1295 121 121 LEU HD2 H 0.850 0.010 . 1296 121 121 LEU C C 176.640 0.010 . 1297 121 121 LEU CA C 54.574 0.000 . 1298 121 121 LEU CB C 41.783 0.010 . 1299 121 121 LEU CG C 26.597 0.010 . 1300 121 121 LEU CD1 C 23.110 0.010 . 1301 121 121 LEU CD2 C 24.512 0.010 . 1302 121 121 LEU N N 122.171 0.000 . 1303 122 122 ASP H H 8.175 0.010 . 1304 122 122 ASP CA C 52.494 0.010 . 1305 122 122 ASP CB C 41.824 0.010 . 1306 122 122 ASP N N 126.037 0.010 . 1307 123 123 PRO HA H 4.365 0.010 . 1308 123 123 PRO HB2 H 1.872 0.010 . 1309 123 123 PRO HB3 H 1.997 0.010 . 1310 123 123 PRO HG2 H 1.876 0.010 . 1311 123 123 PRO HD2 H 3.591 0.000 . 1312 123 123 PRO HD3 H 3.780 0.010 . 1313 123 123 PRO C C 176.427 0.010 . 1314 123 123 PRO CA C 62.627 0.000 . 1315 123 123 PRO CB C 31.700 0.010 . 1316 123 123 PRO CG C 27.045 0.000 . 1317 123 123 PRO CD C 50.524 0.000 . 1318 124 124 LEU H H 8.339 0.010 . 1319 124 124 LEU HA H 4.376 0.010 . 1320 124 124 LEU HB2 H 1.596 0.010 . 1321 124 124 LEU HB3 H 1.613 0.010 . 1322 124 124 LEU HG H 1.614 0.010 . 1323 124 124 LEU HD1 H 0.858 0.010 . 1324 124 124 LEU HD2 H 0.896 0.010 . 1325 124 124 LEU C C 176.639 0.010 . 1326 124 124 LEU CA C 55.038 0.010 . 1327 124 124 LEU CB C 41.858 0.000 . 1328 124 124 LEU CG C 26.638 0.010 . 1329 124 124 LEU CD1 C 22.878 0.010 . 1330 124 124 LEU CD2 C 24.581 0.010 . 1331 124 124 LEU N N 123.418 0.010 . 1332 125 125 LEU H H 7.979 0.010 . 1333 125 125 LEU HA H 4.343 0.010 . 1334 125 125 LEU HB2 H 1.577 0.010 . 1335 125 125 LEU HB3 H 1.611 0.010 . 1336 125 125 LEU HG H 0.839 0.010 . 1337 125 125 LEU HD1 H 0.856 0.010 . 1338 125 125 LEU HD2 H 0.859 0.010 . 1339 125 125 LEU C C 177.029 0.010 . 1340 125 125 LEU CA C 54.771 0.010 . 1341 125 125 LEU CB C 41.781 0.000 . 1342 125 125 LEU CG C 26.620 0.010 . 1343 125 125 LEU CD1 C 22.898 0.010 . 1344 125 125 LEU CD2 C 24.492 0.010 . 1345 125 125 LEU N N 123.054 0.010 . 1346 126 126 LEU H H 7.994 0.010 . 1347 126 126 LEU HA H 4.303 0.010 . 1348 126 126 LEU HB2 H 1.588 0.010 . 1349 126 126 LEU HB3 H 1.603 0.010 . 1350 126 126 LEU HG H 0.854 0.010 . 1351 126 126 LEU HD1 H 0.853 0.000 . 1352 126 126 LEU HD2 H 0.849 0.010 . 1353 126 126 LEU C C 176.832 0.010 . 1354 126 126 LEU CA C 54.672 0.010 . 1355 126 126 LEU CB C 41.944 0.010 . 1356 126 126 LEU CG C 24.413 0.010 . 1357 126 126 LEU CD1 C 22.987 0.010 . 1358 126 126 LEU CD2 C 24.475 0.010 . 1359 126 126 LEU N N 123.073 0.010 . 1360 127 127 ASP H H 8.257 0.010 . 1361 127 127 ASP HA H 4.526 0.010 . 1362 127 127 ASP HB2 H 2.544 0.010 . 1363 127 127 ASP HB3 H 2.641 0.010 . 1364 127 127 ASP C C 176.123 0.010 . 1365 127 127 ASP CA C 54.528 0.010 . 1366 127 127 ASP CB C 40.817 0.000 . 1367 127 127 ASP N N 122.260 0.010 . 1368 128 128 ASP H H 8.196 0.010 . 1369 128 128 ASP HA H 4.528 0.010 . 1370 128 128 ASP HB2 H 2.581 0.010 . 1371 128 128 ASP HB3 H 2.579 0.010 . 1372 128 128 ASP C C 176.111 0.010 . 1373 128 128 ASP CA C 54.334 0.010 . 1374 128 128 ASP CB C 40.970 0.000 . 1375 128 128 ASP N N 120.684 0.010 . 1376 129 129 GLU H H 8.332 0.010 . 1377 129 129 GLU HA H 4.196 0.000 . 1378 129 129 GLU HB2 H 1.898 0.000 . 1379 129 129 GLU HB3 H 1.993 0.000 . 1380 129 129 GLU HG2 H 1.363 0.000 . 1381 129 129 GLU HG3 H 2.560 0.010 . 1382 129 129 GLU C C 175.920 0.000 . 1383 129 129 GLU CA C 56.492 0.000 . 1384 129 129 GLU CB C 30.082 0.000 . 1385 129 129 GLU CG C 35.946 0.000 . 1386 129 129 GLU N N 121.637 0.000 . 1387 130 130 ASN H H 8.480 0.000 . 1388 130 130 ASN HD21 H 6.940 0.000 . 1389 130 130 ASN HD22 H 7.649 0.000 . 1390 130 130 ASN CA C 51.202 0.000 . 1391 130 130 ASN CB C 38.579 0.000 . 1392 130 130 ASN N N 121.165 0.000 . 1393 130 130 ASN ND2 N 113.564 0.000 . 1394 131 131 PRO HA H 4.472 0.000 . 1395 131 131 PRO HB2 H 1.935 0.010 . 1396 131 131 PRO HB3 H 2.263 0.000 . 1397 131 131 PRO HG2 H 1.972 0.000 . 1398 131 131 PRO HG3 H 2.260 0.010 . 1399 131 131 PRO HD2 H 3.690 0.000 . 1400 131 131 PRO HD3 H 4.466 0.010 . 1401 131 131 PRO C C 177.066 0.000 . 1402 131 131 PRO CA C 63.240 0.000 . 1403 131 131 PRO CB C 31.882 0.000 . 1404 131 131 PRO CG C 26.996 0.000 . 1405 131 131 PRO CD C 50.517 0.000 . 1406 132 132 THR H H 8.283 0.000 . 1407 132 132 THR HA H 4.145 0.010 . 1408 132 132 THR HB H 4.259 0.010 . 1409 132 132 THR HG2 H 1.180 0.000 . 1410 132 132 THR C C 174.336 0.010 . 1411 132 132 THR CA C 62.010 0.000 . 1412 132 132 THR CB C 69.551 0.000 . 1413 132 132 THR CG2 C 21.392 0.000 . 1414 132 132 THR N N 115.537 0.000 . 1415 133 133 GLU H H 8.376 0.000 . 1416 133 133 GLU HA H 4.246 0.010 . 1417 133 133 GLU HB2 H 1.894 0.000 . 1418 133 133 GLU HB3 H 1.994 0.010 . 1419 133 133 GLU HG2 H 2.208 0.010 . 1420 133 133 GLU HG3 H 2.208 0.010 . 1421 133 133 GLU C C 176.111 0.010 . 1422 133 133 GLU CA C 56.272 0.000 . 1423 133 133 GLU CB C 29.901 0.000 . 1424 133 133 GLU CG C 35.884 0.010 . 1425 133 133 GLU N N 124.208 0.000 . 1426 134 134 MET H H 8.488 0.010 . 1427 134 134 MET HA H 4.526 0.010 . 1428 134 134 MET HB2 H 2.023 0.010 . 1429 134 134 MET HB3 H 2.244 0.010 . 1430 134 134 MET HG2 H 2.239 0.010 . 1431 134 134 MET HG3 H 2.554 0.010 . 1432 134 134 MET C C 176.137 0.000 . 1433 134 134 MET CA C 55.208 0.000 . 1434 134 134 MET CB C 32.627 0.000 . 1435 134 134 MET CG C 31.425 0.010 . 1436 134 134 MET N N 123.240 0.000 . 1437 135 135 THR H H 8.246 0.010 . 1438 135 135 THR HA H 4.316 0.010 . 1439 135 135 THR HB H 4.307 0.010 . 1440 135 135 THR HG2 H 1.154 0.000 . 1441 135 135 THR C C 174.186 0.010 . 1442 135 135 THR CA C 61.673 0.010 . 1443 135 135 THR CB C 69.635 0.010 . 1444 135 135 THR CG2 C 21.300 0.000 . 1445 135 135 THR N N 117.021 0.010 . 1446 136 136 GLU H H 8.473 0.010 . 1447 136 136 GLU HA H 4.153 0.010 . 1448 136 136 GLU HB2 H 1.745 0.010 . 1449 136 136 GLU HB3 H 2.315 0.010 . 1450 136 136 GLU HG2 H 2.311 0.010 . 1451 136 136 GLU HG3 H 2.317 0.010 . 1452 136 136 GLU C C 176.439 0.000 . 1453 136 136 GLU CA C 56.292 0.000 . 1454 136 136 GLU CB C 32.638 0.000 . 1455 136 136 GLU CG C 33.372 0.000 . 1456 136 136 GLU N N 124.005 0.010 . 1457 137 137 GLU H H 8.576 0.010 . 1458 137 137 GLU HA H 4.252 0.010 . 1459 137 137 GLU HB2 H 1.943 0.010 . 1460 137 137 GLU HB3 H 1.987 0.010 . 1461 137 137 GLU HG2 H 2.216 0.010 . 1462 137 137 GLU HG3 H 2.562 0.010 . 1463 137 137 GLU C C 176.245 0.010 . 1464 137 137 GLU CA C 56.564 0.000 . 1465 137 137 GLU CB C 29.850 0.000 . 1466 137 137 GLU CG C 35.977 0.010 . 1467 137 137 GLU N N 122.879 0.010 . 1468 138 138 VAL H H 8.097 0.010 . 1469 138 138 VAL HA H 4.039 0.010 . 1470 138 138 VAL HB H 2.026 0.010 . 1471 138 138 VAL HG1 H 0.855 0.010 . 1472 138 138 VAL C C 175.592 0.010 . 1473 138 138 VAL CA C 61.933 0.000 . 1474 138 138 VAL CB C 32.641 0.000 . 1475 138 138 VAL CG1 C 20.608 0.000 . 1476 138 138 VAL CG2 C 20.612 0.010 . 1477 138 138 VAL N N 121.596 0.010 . 1478 139 139 GLU H H 8.468 0.000 . 1479 139 139 GLU HA H 4.239 0.010 . 1480 139 139 GLU HB2 H 1.893 0.010 . 1481 139 139 GLU HB3 H 1.995 0.010 . 1482 139 139 GLU HG2 H 1.980 0.010 . 1483 139 139 GLU HG3 H 2.215 0.010 . 1484 139 139 GLU C C 176.165 0.010 . 1485 139 139 GLU CA C 56.387 0.000 . 1486 139 139 GLU CB C 32.683 0.010 . 1487 139 139 GLU CG C 35.888 0.010 . 1488 139 139 GLU N N 125.591 0.000 . 1489 140 140 GLU H H 8.510 0.010 . 1490 140 140 GLU HA H 4.268 0.010 . 1491 140 140 GLU HB2 H 1.907 0.010 . 1492 140 140 GLU HB3 H 1.995 0.010 . 1493 140 140 GLU HG2 H 2.313 0.010 . 1494 140 140 GLU HG3 H 2.210 0.010 . 1495 140 140 GLU C C 176.155 0.000 . 1496 140 140 GLU CA C 56.318 0.000 . 1497 140 140 GLU CB C 30.064 0.010 . 1498 140 140 GLU CG C 33.352 0.010 . 1499 140 140 GLU N N 123.406 0.010 . 1500 141 141 GLU H H 8.352 0.010 . 1501 141 141 GLU HA H 4.219 0.010 . 1502 141 141 GLU HB2 H 1.878 0.010 . 1503 141 141 GLU HB3 H 1.963 0.010 . 1504 141 141 GLU HG2 H 1.823 0.010 . 1505 141 141 GLU HG3 H 2.814 0.010 . 1506 141 141 GLU C C 176.577 0.010 . 1507 141 141 GLU CA C 56.398 0.000 . 1508 141 141 GLU CB C 32.533 0.010 . 1509 141 141 GLU CG C 35.913 0.010 . 1510 141 141 GLU N N 123.095 0.010 . 1511 142 142 GLN H H 8.292 0.010 . 1512 142 142 GLN HA H 4.251 0.000 . 1513 142 142 GLN HB2 H 1.947 0.000 . 1514 142 142 GLN HB3 H 2.048 0.000 . 1515 142 142 GLN HG2 H 2.327 0.010 . 1516 142 142 GLN HG3 H 2.329 0.000 . 1517 142 142 GLN HE21 H 8.452 0.010 . 1518 142 142 GLN HE22 H 8.445 0.010 . 1519 142 142 GLN C C 175.823 0.000 . 1520 142 142 GLN CA C 56.067 0.000 . 1521 142 142 GLN CB C 28.991 0.000 . 1522 142 142 GLN CG C 33.378 0.000 . 1523 142 142 GLN N N 122.011 0.010 . 1524 142 142 GLN NE2 N 113.437 0.010 . 1525 143 143 ASN H H 8.533 0.000 . 1526 143 143 ASN HA H 4.647 0.000 . 1527 143 143 ASN HB2 H 2.724 0.000 . 1528 143 143 ASN HB3 H 2.724 0.010 . 1529 143 143 ASN HD21 H 6.935 0.010 . 1530 143 143 ASN HD22 H 7.655 0.010 . 1531 143 143 ASN C C 175.229 0.010 . 1532 143 143 ASN CA C 53.202 0.000 . 1533 143 143 ASN CB C 38.349 0.000 . 1534 143 143 ASN N N 120.421 0.000 . 1535 143 143 ASN ND2 N 113.573 0.010 . 1536 144 144 LEU H H 8.271 0.000 . 1537 144 144 LEU HA H 4.286 0.000 . 1538 144 144 LEU HB2 H 1.595 0.010 . 1539 144 144 LEU HB3 H 1.595 0.000 . 1540 144 144 LEU HG H 2.614 0.010 . 1541 144 144 LEU HD1 H 0.852 0.000 . 1542 144 144 LEU HD2 H 0.852 0.010 . 1543 144 144 LEU C C 177.678 0.000 . 1544 144 144 LEU CA C 55.462 0.000 . 1545 144 144 LEU CB C 41.825 0.000 . 1546 144 144 LEU CG C 23.053 0.000 . 1547 144 144 LEU CD1 C 22.933 0.000 . 1548 144 144 LEU CD2 C 23.137 0.010 . 1549 144 144 LEU N N 123.420 0.000 . 1550 145 145 SER H H 8.311 0.000 . 1551 145 145 SER HA H 4.303 0.010 . 1552 145 145 SER HB2 H 3.065 0.010 . 1553 145 145 SER HB3 H 3.854 0.010 . 1554 145 145 SER C C 174.813 0.010 . 1555 145 145 SER CA C 58.584 0.000 . 1556 145 145 SER CB C 63.445 0.000 . 1557 145 145 SER N N 116.894 0.000 . 1558 146 146 ARG H H 8.210 0.000 . 1559 146 146 ARG HA H 4.358 0.010 . 1560 146 146 ARG HB2 H 1.740 0.010 . 1561 146 146 ARG HB3 H 1.855 0.010 . 1562 146 146 ARG HG2 H 1.580 0.010 . 1563 146 146 ARG HG3 H 1.890 0.010 . 1564 146 146 ARG HD2 H 3.163 0.010 . 1565 146 146 ARG HD3 H 3.163 0.010 . 1566 146 146 ARG C C 176.377 0.010 . 1567 146 146 ARG CA C 56.154 0.000 . 1568 146 146 ARG CB C 30.179 0.000 . 1569 146 146 ARG CG C 26.814 0.010 . 1570 146 146 ARG CD C 42.996 0.010 . 1571 146 146 ARG N N 123.295 0.000 . 1572 147 147 LEU H H 8.215 0.000 . 1573 147 147 LEU HA H 4.267 0.010 . 1574 147 147 LEU HB2 H 1.595 0.010 . 1575 147 147 LEU HB3 H 1.607 0.010 . 1576 147 147 LEU HG H 1.587 0.010 . 1577 147 147 LEU HD1 H 0.857 0.000 . 1578 147 147 LEU HD2 H 0.847 0.010 . 1579 147 147 LEU C C 177.259 0.010 . 1580 147 147 LEU CA C 55.405 0.010 . 1581 147 147 LEU CB C 41.948 0.000 . 1582 147 147 LEU CG C 26.625 0.010 . 1583 147 147 LEU CD1 C 23.190 0.010 . 1584 147 147 LEU CD2 C 24.390 0.010 . 1585 147 147 LEU N N 123.401 0.000 . 1586 148 148 ASP H H 8.170 0.010 . 1587 148 148 ASP HA H 4.476 0.010 . 1588 148 148 ASP HB2 H 2.520 0.010 . 1589 148 148 ASP HB3 H 2.628 0.010 . 1590 148 148 ASP C C 176.571 0.010 . 1591 148 148 ASP CA C 54.865 0.010 . 1592 148 148 ASP CB C 40.877 0.000 . 1593 148 148 ASP N N 121.481 0.010 . 1594 149 149 GLN H H 8.029 0.010 . 1595 149 149 GLN HA H 4.232 0.010 . 1596 149 149 GLN HB2 H 1.890 0.010 . 1597 149 149 GLN HB3 H 1.981 0.010 . 1598 149 149 GLN HG2 H 2.212 0.010 . 1599 149 149 GLN HG3 H 2.211 0.010 . 1600 149 149 GLN HE21 H 8.334 0.010 . 1601 149 149 GLN HE22 H 8.464 0.010 . 1602 149 149 GLN C C 176.160 0.010 . 1603 149 149 GLN CA C 56.427 0.010 . 1604 149 149 GLN CB C 32.496 0.010 . 1605 149 149 GLN CG C 35.901 0.010 . 1606 149 149 GLN N N 120.849 0.010 . 1607 149 149 GLN NE2 N 113.361 0.010 . 1608 150 150 GLU H H 8.273 0.010 . 1609 150 150 GLU HA H 4.207 0.000 . 1610 150 150 GLU HB2 H 1.932 0.010 . 1611 150 150 GLU HB3 H 2.015 0.010 . 1612 150 150 GLU HG2 H 2.216 0.010 . 1613 150 150 GLU HG3 H 2.219 0.000 . 1614 150 150 GLU C C 176.137 0.000 . 1615 150 150 GLU CA C 56.515 0.000 . 1616 150 150 GLU CB C 30.100 0.000 . 1617 150 150 GLU CG C 35.965 0.010 . 1618 150 150 GLU N N 122.514 0.010 . 1619 151 151 ASP H H 8.426 0.010 . 1620 151 151 ASP HA H 4.569 0.000 . 1621 151 151 ASP HB2 H 2.673 0.000 . 1622 151 151 ASP HB3 H 2.673 0.000 . 1623 151 151 ASP C C 176.769 0.000 . 1624 151 151 ASP CA C 54.446 0.000 . 1625 151 151 ASP CB C 40.927 0.000 . 1626 151 151 ASP N N 122.372 0.000 . 1627 152 152 SER H H 8.326 0.000 . 1628 152 152 SER HA H 4.450 0.010 . 1629 152 152 SER HB2 H 4.312 0.010 . 1630 152 152 SER HB3 H 4.450 0.010 . 1631 152 152 SER C C 175.147 0.000 . 1632 152 152 SER CA C 59.452 0.000 . 1633 152 152 SER CB C 63.497 0.000 . 1634 152 152 SER N N 117.500 0.000 . 1635 153 153 GLU H H 8.395 0.000 . 1636 153 153 GLU HA H 4.395 0.010 . 1637 153 153 GLU HB2 H 1.896 0.010 . 1638 153 153 GLU HB3 H 1.984 0.000 . 1639 153 153 GLU HG2 H 2.212 0.010 . 1640 153 153 GLU HG3 H 2.212 0.010 . 1641 153 153 GLU C C 176.197 0.010 . 1642 153 153 GLU CA C 58.236 0.000 . 1643 153 153 GLU CB C 29.998 0.010 . 1644 153 153 GLU CG C 34.456 0.010 . 1645 153 153 GLU N N 122.997 0.000 . 1646 154 154 LYS H H 8.498 0.010 . 1647 154 154 LYS HA H 4.175 0.010 . 1648 154 154 LYS HB2 H 1.741 0.010 . 1649 154 154 LYS HB3 H 1.869 0.010 . 1650 154 154 LYS HG2 H 1.610 0.010 . 1651 154 154 LYS HG3 H 1.609 0.010 . 1652 154 154 LYS HD2 H 1.508 0.010 . 1653 154 154 LYS HD3 H 1.872 0.010 . 1654 154 154 LYS HE2 H 2.930 0.010 . 1655 154 154 LYS HE3 H 3.044 0.010 . 1656 154 154 LYS C C 177.004 0.010 . 1657 154 154 LYS CA C 55.021 0.010 . 1658 154 154 LYS CB C 32.640 0.000 . 1659 154 154 LYS CG C 24.284 0.010 . 1660 154 154 LYS CD C 28.501 0.010 . 1661 154 154 LYS CE C 41.692 0.010 . 1662 154 154 LYS N N 123.493 0.010 . 1663 155 155 LYS H H 8.314 0.010 . 1664 155 155 LYS HA H 4.562 0.010 . 1665 155 155 LYS HB2 H 1.595 0.010 . 1666 155 155 LYS HB3 H 1.596 0.010 . 1667 155 155 LYS HG2 H 0.860 0.010 . 1668 155 155 LYS HG3 H 1.593 0.010 . 1669 155 155 LYS HD2 H 1.594 0.010 . 1670 155 155 LYS HD3 H 1.593 0.010 . 1671 155 155 LYS HE2 H 2.640 0.010 . 1672 155 155 LYS C C 177.334 0.000 . 1673 155 155 LYS CA C 54.669 0.000 . 1674 155 155 LYS CB C 30.32 0.000 . 1675 155 155 LYS CG C 24.458 0.000 . 1676 155 155 LYS CD C 26.598 0.000 . 1677 155 155 LYS CE C 41.987 0.000 . 1678 155 155 LYS N N 121.671 0.010 . 1679 156 156 SER H H 8.173 0.000 . 1680 156 156 SER HA H 4.406 0.010 . 1681 156 156 SER HB2 H 3.859 0.010 . 1682 156 156 SER HB3 H 4.408 0.010 . 1683 156 156 SER C C 175.426 0.010 . 1684 156 156 SER CA C 58.413 0.000 . 1685 156 156 SER CB C 63.531 0.010 . 1686 156 156 SER N N 116.356 0.000 . 1687 157 157 LYS H H 8.455 0.010 . 1688 157 157 LYS HA H 4.305 0.010 . 1689 157 157 LYS HB2 H 1.721 0.010 . 1690 157 157 LYS HB3 H 1.865 0.010 . 1691 157 157 LYS HG2 H 0.861 0.010 . 1692 157 157 LYS HG3 H 1.602 0.010 . 1693 157 157 LYS HD2 H 1.193 0.010 . 1694 157 157 LYS HD3 H 1.824 0.010 . 1695 157 157 LYS HE2 H 2.810 0.010 . 1696 157 157 LYS HE3 H 2.819 0.010 . 1697 157 157 LYS C C 175.360 0.010 . 1698 157 157 LYS CA C 56.220 0.010 . 1699 157 157 LYS CB C 32.618 0.010 . 1700 157 157 LYS CG C 23.108 0.010 . 1701 157 157 LYS CD C 32.724 0.010 . 1702 157 157 LYS CE C 42.220 0.010 . 1703 157 157 LYS N N 122.953 0.000 . 1704 158 158 LYS H H 8.314 0.010 . 1705 158 158 LYS CA C 57.573 0.010 . 1706 158 158 LYS CB C 33.144 0.010 . 1707 158 158 LYS N N 128.792 0.010 . stop_ save_