data_6285 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 15N, 13C, 1H NMR assignment of a 14kDa construct of the focal adhesion protein Talin ; _BMRB_accession_number 6285 _BMRB_flat_file_name bmr6285.str _Entry_type original _Submission_date 2004-08-09 _Accession_date 2004-08-09 _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 Fillingham Ian J . 2 Critchley David R . 3 Roberts Gordon C . 4 Barsukov Igor G . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 684 "13C chemical shifts" 520 "15N chemical shifts" 141 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-03-22 original author . stop_ _Original_release_date 2007-03-22 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; A vinculin binding domain from the talin rod unfolds to form a complex with the vinculin head ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 15642262 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Fillingham Ian J. . 2 Gingras A. R. . 3 Papagrigoriou E. . . 4 Patel B. . . 5 Emsley J. . . 6 Critchley D. R. . 7 Roberts Gordon C. . 8 Barsukov Ian L. . stop_ _Journal_abbreviation Structure _Journal_volume 13 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 65 _Page_last 74 _Year 2005 _Details . loop_ _Keyword talin 'focal adhesion' stop_ save_ ################################## # Molecular system description # ################################## save_molecular_system_talin _Saveframe_category molecular_system _Mol_system_name 'talin 755-889' _Abbreviation_common 'talin 755-889' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'talin 755-889' $talin stop_ _System_molecular_weight 14000 _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_talin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'talin 755-889' _Abbreviation_common 'talin 755-889' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 139 _Mol_residue_sequence ; GSHMQAATEDGQLLRGVGAA ATAVTQALNELLQHVKAHAT GAGPAGRYDQATDTILTVTE NIFSSMGDAGEMVRQARILA QATSDLVNAIKADAEGESDL ENSRKLLSAAKILADATAKM VEAAKGAAAHPDSEEQQQR ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 HIS 4 MET 5 GLN 6 ALA 7 ALA 8 THR 9 GLU 10 ASP 11 GLY 12 GLN 13 LEU 14 LEU 15 ARG 16 GLY 17 VAL 18 GLY 19 ALA 20 ALA 21 ALA 22 THR 23 ALA 24 VAL 25 THR 26 GLN 27 ALA 28 LEU 29 ASN 30 GLU 31 LEU 32 LEU 33 GLN 34 HIS 35 VAL 36 LYS 37 ALA 38 HIS 39 ALA 40 THR 41 GLY 42 ALA 43 GLY 44 PRO 45 ALA 46 GLY 47 ARG 48 TYR 49 ASP 50 GLN 51 ALA 52 THR 53 ASP 54 THR 55 ILE 56 LEU 57 THR 58 VAL 59 THR 60 GLU 61 ASN 62 ILE 63 PHE 64 SER 65 SER 66 MET 67 GLY 68 ASP 69 ALA 70 GLY 71 GLU 72 MET 73 VAL 74 ARG 75 GLN 76 ALA 77 ARG 78 ILE 79 LEU 80 ALA 81 GLN 82 ALA 83 THR 84 SER 85 ASP 86 LEU 87 VAL 88 ASN 89 ALA 90 ILE 91 LYS 92 ALA 93 ASP 94 ALA 95 GLU 96 GLY 97 GLU 98 SER 99 ASP 100 LEU 101 GLU 102 ASN 103 SER 104 ARG 105 LYS 106 LEU 107 LEU 108 SER 109 ALA 110 ALA 111 LYS 112 ILE 113 LEU 114 ALA 115 ASP 116 ALA 117 THR 118 ALA 119 LYS 120 MET 121 VAL 122 GLU 123 ALA 124 ALA 125 LYS 126 GLY 127 ALA 128 ALA 129 ALA 130 HIS 131 PRO 132 ASP 133 SER 134 GLU 135 GLU 136 GLN 137 GLN 138 GLN 139 ARG 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 BMRB 17332 Vbs2b 74.10 131 100.00 100.00 1.13e-64 PDB 1U89 "Solution Structure Of Vbs2 Fragment Of Talin" 100.00 139 100.00 100.00 7.09e-92 PDB 2L7A "Solution Structure Of The Talin Vbs2b Domain" 74.10 131 100.00 100.00 1.13e-64 DBJ BAA82979 "KIAA1027 protein [Homo sapiens]" 97.12 2550 100.00 100.00 2.80e-79 DBJ BAC65702 "mKIAA1027 protein [Mus musculus]" 97.12 2564 100.00 100.00 4.56e-79 DBJ BAE27781 "unnamed protein product [Mus musculus]" 97.12 2541 100.00 100.00 3.25e-79 DBJ BAG09941 "talin-1 [synthetic construct]" 97.12 2541 100.00 100.00 2.92e-79 EMBL CAA39588 "talin [Mus musculus]" 97.12 2541 100.00 100.00 3.69e-79 GB AAD13152 "talin [Homo sapiens]" 97.12 2541 99.26 99.26 6.05e-78 GB AAF23322 "talin [Homo sapiens]" 97.12 2541 99.26 99.26 6.41e-78 GB AAF27330 "talin [Homo sapiens]" 97.12 2540 100.00 100.00 2.92e-79 GB AAH42923 "Talin 1 [Homo sapiens]" 97.12 2541 100.00 100.00 3.10e-79 GB AAI50811 "Talin 1 [Mus musculus]" 97.12 2541 100.00 100.00 3.28e-79 PRF 1617167A talin 97.12 2541 100.00 100.00 3.69e-79 REF NP_001034114 "talin-1 [Rattus norvegicus]" 97.12 2541 100.00 100.00 3.38e-79 REF NP_001192357 "talin-1 [Bos taurus]" 97.12 2541 97.78 99.26 6.99e-77 REF NP_006280 "talin-1 [Homo sapiens]" 97.12 2541 100.00 100.00 2.92e-79 REF NP_035732 "talin-1 [Mus musculus]" 97.12 2541 100.00 100.00 3.28e-79 REF XP_001084941 "PREDICTED: talin-1 [Macaca mulatta]" 97.12 2428 99.26 100.00 1.86e-78 SP P26039 "RecName: Full=Talin-1 [Mus musculus]" 97.12 2541 100.00 100.00 3.28e-79 SP Q9Y490 "RecName: Full=Talin-1 [Homo sapiens]" 97.12 2541 100.00 100.00 2.92e-79 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $talin Mouse 10090 Eukaryota Animalia Mus musculus 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 $talin 'recombinant technology' 'E. coli' . . . . 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 $talin 1 mM '[U-95% 13C; U-98% 15N]' 'phosphate buffer' 20 mM . 'sodium chloride' 50 mM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save__1 _Saveframe_category NMR_applied_experiment _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 0.1 pH temperature 303 1 K 'ionic strength' 0.05 0.005 M stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _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 _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS H 1 'methyl protons' ppm 0.0 internal indirect . . . 1.0 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 external indirect . . . 0.101329118 $entry_citation $entry_citation DSS C 13 'methyl protons' ppm 0.0 external indirect . . . 0.251449530 $entry_citation $entry_citation 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_chemical_shifts _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'talin 755-889' _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 . 5 GLN N N 121.8 . 1 2 . 5 GLN H H 8.38 . 1 3 . 5 GLN CA C 55.8 . 1 4 . 5 GLN HA H 4.32 . 1 5 . 5 GLN CB C 29.3 . 1 6 . 5 GLN HB2 H 2.12 . 2 7 . 5 GLN HB3 H 1.99 . 2 8 . 5 GLN CG C 33.7 . 1 9 . 5 GLN HG2 H 2.37 . 1 10 . 5 GLN HG3 H 2.37 . 1 11 . 5 GLN C C 175.5 . 1 12 . 6 ALA N N 125.5 . 1 13 . 6 ALA H H 8.33 . 1 14 . 6 ALA CA C 52.3 . 1 15 . 6 ALA HA H 4.32 . 1 16 . 6 ALA HB H 1.40 . 1 17 . 6 ALA CB C 19.3 . 1 18 . 6 ALA C C 177.4 . 1 19 . 7 ALA N N 123.3 . 1 20 . 7 ALA H H 8.33 . 1 21 . 7 ALA CA C 52.5 . 1 22 . 7 ALA HA H 4.40 . 1 23 . 7 ALA HB H 1.42 . 1 24 . 7 ALA CB C 19.2 . 1 25 . 7 ALA C C 178.0 . 1 26 . 8 THR N N 112.4 . 1 27 . 8 THR H H 8.04 . 1 28 . 8 THR CA C 61.6 . 1 29 . 8 THR HA H 4.34 . 1 30 . 8 THR CB C 69.8 . 1 31 . 8 THR HB H 4.27 . 1 32 . 8 THR HG2 H 1.21 . 1 33 . 8 THR CG2 C 21.7 . 1 34 . 8 THR C C 179.0 . 1 35 . 9 GLU N N 122.8 . 1 36 . 9 GLU H H 8.45 . 1 37 . 9 GLU CA C 56.8 . 1 38 . 9 GLU HA H 4.30 . 1 39 . 9 GLU CB C 30.1 . 1 40 . 9 GLU HB2 H 1.97 . 2 41 . 9 GLU HB3 H 2.10 . 2 42 . 9 GLU CG C 36.2 . 1 43 . 9 GLU HG2 H 2.28 . 1 44 . 9 GLU HG3 H 2.28 . 1 45 . 9 GLU C C 176.8 . 1 46 . 10 ASP N N 120.9 . 1 47 . 10 ASP H H 8.35 . 1 48 . 10 ASP CA C 54.6 . 1 49 . 10 ASP HA H 4.59 . 1 50 . 10 ASP CB C 41.1 . 1 51 . 10 ASP HB2 H 2.71 . 1 52 . 10 ASP HB3 H 2.71 . 1 53 . 10 ASP C C 177.2 . 1 54 . 11 GLY N N 109.5 . 1 55 . 11 GLY H H 8.41 . 1 56 . 11 GLY CA C 46.1 . 1 57 . 11 GLY HA2 H 3.97 . 1 58 . 11 GLY HA3 H 3.97 . 1 59 . 11 GLY C C 175.1 . 1 60 . 12 GLN N N 119.8 . 1 61 . 12 GLN H H 8.25 . 1 62 . 12 GLN CA C 57.2 . 1 63 . 12 GLN HA H 4.21 . 1 64 . 12 GLN CB C 28.8 . 1 65 . 12 GLN HB2 H 2.10 . 2 66 . 12 GLN HB3 H 2.14 . 2 67 . 12 GLN CG C 33.7 . 1 68 . 12 GLN HG2 H 2.37 . 2 69 . 12 GLN HG3 H 2.42 . 2 70 . 12 GLN C C 177.4 . 1 71 . 13 LEU N N 121.7 . 1 72 . 13 LEU H H 8.20 . 1 73 . 13 LEU CA C 56.7 . 1 74 . 13 LEU HA H 4.26 . 1 75 . 13 LEU CB C 41.8 . 1 76 . 13 LEU HB2 H 1.63 . 2 77 . 13 LEU HB3 H 1.74 . 2 78 . 13 LEU CG C 27.1 . 1 79 . 13 LEU HG H 1.65 . 1 80 . 13 LEU HD1 H 0.94 . 1 81 . 13 LEU HD2 H 0.88 . 1 82 . 13 LEU CD1 C 24.9 . 1 83 . 13 LEU CD2 C 23.8 . 1 84 . 13 LEU C C 178.3 . 1 85 . 14 LEU N N 120.4 . 1 86 . 14 LEU H H 8.09 . 1 87 . 14 LEU CA C 56.2 . 1 88 . 14 LEU HA H 4.24 . 1 89 . 14 LEU CB C 41.6 . 1 90 . 14 LEU HB2 H 1.64 . 2 91 . 14 LEU HB3 H 1.74 . 2 92 . 14 LEU CG C 27.1 . 1 93 . 14 LEU HG H 1.68 . 1 94 . 14 LEU HD1 H 0.94 . 1 95 . 14 LEU HD2 H 0.88 . 1 96 . 14 LEU CD1 C 25.0 . 1 97 . 14 LEU CD2 C 23.7 . 1 98 . 14 LEU C C 178.4 . 1 99 . 15 ARG N N 120.0 . 1 100 . 15 ARG H H 8.14 . 1 101 . 15 ARG CA C 57.6 . 1 102 . 15 ARG HA H 4.27 . 1 103 . 15 ARG CB C 30.5 . 1 104 . 15 ARG HB2 H 1.90 . 1 105 . 15 ARG HB3 H 1.90 . 1 106 . 15 ARG CG C 27.5 . 1 107 . 15 ARG HG2 H 1.65 . 2 108 . 15 ARG HG3 H 1.75 . 2 109 . 15 ARG CD C 43.5 . 1 110 . 15 ARG HD2 H 3.24 . 2 111 . 15 ARG HD3 H 3.21 . 2 112 . 15 ARG C C 178.2 . 1 113 . 16 GLY N N 108.3 . 1 114 . 16 GLY H H 8.38 . 1 115 . 16 GLY CA C 46.2 . 1 116 . 16 GLY HA2 H 3.99 . 2 117 . 16 GLY HA3 H 4.10 . 2 118 . 16 GLY C C 176.3 . 1 119 . 17 VAL N N 122.3 . 1 120 . 17 VAL H H 8.33 . 1 121 . 17 VAL CA C 66.0 . 1 122 . 17 VAL HA H 3.66 . 1 123 . 17 VAL CB C 31.6 . 1 124 . 17 VAL HB H 2.13 . 1 125 . 17 VAL HG1 H 0.87 . 1 126 . 17 VAL HG2 H 0.96 . 1 127 . 17 VAL CG1 C 22.4 . 1 128 . 17 VAL CG2 C 21.7 . 1 129 . 17 VAL C C 177.4 . 1 130 . 18 GLY N N 108.0 . 1 131 . 18 GLY H H 8.47 . 1 132 . 18 GLY CA C 47.4 . 1 133 . 18 GLY HA2 H 3.73 . 2 134 . 18 GLY HA3 H 4.03 . 2 135 . 18 GLY C C 176.3 . 1 136 . 19 ALA N N 124.2 . 1 137 . 19 ALA H H 8.04 . 1 138 . 19 ALA CA C 54.8 . 1 139 . 19 ALA HA H 4.22 . 1 140 . 19 ALA HB H 1.47 . 1 141 . 19 ALA CB C 18.1 . 1 142 . 19 ALA C C 180.7 . 1 143 . 20 ALA N N 121.8 . 1 144 . 20 ALA H H 7.92 . 1 145 . 20 ALA CA C 54.6 . 1 146 . 20 ALA HA H 4.22 . 1 147 . 20 ALA HB H 1.48 . 1 148 . 20 ALA CB C 17.8 . 1 149 . 20 ALA C C 179.9 . 1 150 . 21 ALA N N 122.8 . 1 151 . 21 ALA H H 8.65 . 1 152 . 21 ALA CA C 55.6 . 1 153 . 21 ALA HA H 4.05 . 1 154 . 21 ALA HB H 1.39 . 1 155 . 21 ALA CB C 18.0 . 1 156 . 21 ALA C C 180.0 . 1 157 . 22 THR N N 116.2 . 1 158 . 22 THR H H 8.18 . 1 159 . 22 THR CA C 66.5 . 1 160 . 22 THR HA H 4.06 . 1 161 . 22 THR CB C 68.7 . 1 162 . 22 THR HB H 4.31 . 1 163 . 22 THR HG2 H 1.27 . 1 164 . 22 THR CG2 C 21.4 . 1 165 . 22 THR C C 176.0 . 1 166 . 23 ALA N N 123.7 . 1 167 . 23 ALA H H 7.69 . 1 168 . 23 ALA CA C 55.2 . 1 169 . 23 ALA HA H 4.26 . 1 170 . 23 ALA HB H 1.60 . 1 171 . 23 ALA CB C 17.9 . 1 172 . 23 ALA C C 181.2 . 1 173 . 24 VAL N N 119.9 . 1 174 . 24 VAL H H 7.97 . 1 175 . 24 VAL CA C 67.2 . 1 176 . 24 VAL HA H 3.47 . 1 177 . 24 VAL CB C 31.4 . 1 178 . 24 VAL HB H 2.42 . 1 179 . 24 VAL HG1 H 0.83 . 1 180 . 24 VAL HG2 H 0.99 . 1 181 . 24 VAL CG1 C 21.2 . 1 182 . 24 VAL CG2 C 23.3 . 1 183 . 24 VAL C C 177.0 . 1 184 . 25 THR N N 114.5 . 1 185 . 25 THR H H 8.16 . 1 186 . 25 THR CA C 67.1 . 1 187 . 25 THR HA H 3.77 . 1 188 . 25 THR CB C 68.4 . 1 189 . 25 THR HB H 4.34 . 1 190 . 25 THR HG2 H 1.29 . 1 191 . 25 THR CG2 C 22.2 . 1 192 . 25 THR C C 177.0 . 1 193 . 26 GLN N N 121.1 . 1 194 . 26 GLN H H 8.40 . 1 195 . 26 GLN CA C 59.1 . 1 196 . 26 GLN HA H 4.13 . 1 197 . 26 GLN CB C 28.2 . 1 198 . 26 GLN HB2 H 2.10 . 2 199 . 26 GLN HB3 H 2.19 . 2 200 . 26 GLN CG C 33.8 . 1 201 . 26 GLN HG2 H 2.43 . 2 202 . 26 GLN HG3 H 2.54 . 2 203 . 26 GLN NE2 N 111.9 . 1 204 . 26 GLN HE21 H 6.79 . 2 205 . 26 GLN HE22 H 7.58 . 2 206 . 26 GLN C C 178.4 . 1 207 . 27 ALA N N 121.7 . 1 208 . 27 ALA H H 7.98 . 1 209 . 27 ALA CA C 54.9 . 1 210 . 27 ALA HA H 4.21 . 1 211 . 27 ALA HB H 1.50 . 1 212 . 27 ALA CB C 18.5 . 1 213 . 27 ALA C C 181.0 . 1 214 . 28 LEU N N 121.1 . 1 215 . 28 LEU H H 8.81 . 1 216 . 28 LEU CA C 57.7 . 1 217 . 28 LEU HA H 4.05 . 1 218 . 28 LEU CB C 41.6 . 1 219 . 28 LEU HB2 H 1.98 . 2 220 . 28 LEU HB3 H 1.61 . 2 221 . 28 LEU CG C 26.6 . 1 222 . 28 LEU HG H 1.71 . 1 223 . 28 LEU HD1 H 0.92 . 1 224 . 28 LEU HD2 H 0.96 . 1 225 . 28 LEU CD1 C 24.2 . 1 226 . 28 LEU CD2 C 25.6 . 1 227 . 28 LEU C C 177.8 . 1 228 . 29 ASN N N 117.8 . 1 229 . 29 ASN H H 8.29 . 1 230 . 29 ASN CA C 56.7 . 1 231 . 29 ASN HA H 4.45 . 1 232 . 29 ASN CB C 38.1 . 1 233 . 29 ASN HB2 H 2.82 . 2 234 . 29 ASN HB3 H 2.95 . 2 235 . 29 ASN ND2 N 111.6 . 1 236 . 29 ASN HD21 H 7.50 . 2 237 . 29 ASN HD22 H 6.85 . 2 238 . 29 ASN C C 178.4 . 1 239 . 30 GLU N N 119.3 . 1 240 . 30 GLU H H 8.01 . 1 241 . 30 GLU CA C 59.5 . 1 242 . 30 GLU HA H 4.06 . 1 243 . 30 GLU CB C 29.3 . 1 244 . 30 GLU HB2 H 2.13 . 1 245 . 30 GLU HB3 H 2.13 . 1 246 . 30 GLU CG C 36.3 . 1 247 . 30 GLU HG2 H 2.38 . 2 248 . 30 GLU HG3 H 2.45 . 2 249 . 30 GLU C C 178.9 . 1 250 . 31 LEU N N 120.5 . 1 251 . 31 LEU H H 7.83 . 1 252 . 31 LEU CA C 58.8 . 1 253 . 31 LEU HA H 4.04 . 1 254 . 31 LEU CB C 41.9 . 1 255 . 31 LEU HB2 H 2.25 . 1 256 . 31 LEU HB3 H 1.54 . 1 257 . 31 LEU CG C 27.2 . 1 258 . 31 LEU HG H 1.54 . 1 259 . 31 LEU HD1 H 0.86 . 1 260 . 31 LEU HD2 H 0.77 . 1 261 . 31 LEU CD1 C 24.5 . 1 262 . 31 LEU CD2 C 26.2 . 1 263 . 31 LEU C C 178.5 . 1 264 . 32 LEU N N 117.8 . 1 265 . 32 LEU H H 8.63 . 1 266 . 32 LEU CA C 57.6 . 1 267 . 32 LEU HA H 4.02 . 1 268 . 32 LEU CB C 41.3 . 1 269 . 32 LEU HB2 H 1.51 . 2 270 . 32 LEU HB3 H 1.99 . 2 271 . 32 LEU CG C 27.0 . 1 272 . 32 LEU HG H 1.91 . 1 273 . 32 LEU HD1 H 0.96 . 1 274 . 32 LEU HD2 H 0.89 . 1 275 . 32 LEU CD1 C 25.3 . 1 276 . 32 LEU CD2 C 22.0 . 1 277 . 32 LEU C C 179.3 . 1 278 . 33 GLN N N 117.5 . 1 279 . 33 GLN H H 7.88 . 1 280 . 33 GLN CA C 58.6 . 1 281 . 33 GLN HA H 4.02 . 1 282 . 33 GLN CB C 27.9 . 1 283 . 33 GLN HB2 H 2.06 . 2 284 . 33 GLN HB3 H 2.03 . 2 285 . 33 GLN CG C 33.6 . 1 286 . 33 GLN HG2 H 2.42 . 1 287 . 33 GLN HG3 H 2.42 . 1 288 . 33 GLN NE2 N 111.8 . 1 289 . 33 GLN HE21 H 6.82 . 2 290 . 33 GLN HE22 H 7.32 . 2 291 . 33 GLN C C 178.5 . 1 292 . 34 HIS N N 117.6 . 1 293 . 34 HIS H H 7.63 . 1 294 . 34 HIS CA C 58.9 . 1 295 . 34 HIS HA H 4.56 . 1 296 . 34 HIS CB C 30.8 . 1 297 . 34 HIS HB2 H 3.27 . 2 298 . 34 HIS HB3 H 3.18 . 2 299 . 34 HIS HD1 H 6.89 . 1 300 . 34 HIS C C 177.7 . 1 301 . 35 VAL N N 118.8 . 1 302 . 35 VAL H H 8.19 . 1 303 . 35 VAL CA C 65.1 . 1 304 . 35 VAL HA H 3.87 . 1 305 . 35 VAL CB C 32.2 . 1 306 . 35 VAL HB H 2.30 . 1 307 . 35 VAL HG1 H 1.06 . 1 308 . 35 VAL HG2 H 1.11 . 1 309 . 35 VAL CG1 C 21.5 . 1 310 . 35 VAL CG2 C 22.3 . 1 311 . 35 VAL C C 177.8 . 1 312 . 36 LYS N N 119.4 . 1 313 . 36 LYS H H 8.22 . 1 314 . 36 LYS CA C 58.0 . 1 315 . 36 LYS HA H 4.15 . 1 316 . 36 LYS CB C 32.2 . 1 317 . 36 LYS HB2 H 1.88 . 1 318 . 36 LYS HB3 H 1.88 . 1 319 . 36 LYS CG C 25.4 . 1 320 . 36 LYS HG2 H 1.60 . 2 321 . 36 LYS HG3 H 1.50 . 2 322 . 36 LYS CD C 29.0 . 1 323 . 36 LYS HD2 H 1.68 . 1 324 . 36 LYS HD3 H 1.68 . 1 325 . 36 LYS CE C 42.1 . 1 326 . 36 LYS HE2 H 2.98 . 1 327 . 36 LYS HE3 H 2.98 . 1 328 . 36 LYS C C 177.6 . 1 329 . 37 ALA N N 120.8 . 1 330 . 37 ALA H H 7.67 . 1 331 . 37 ALA CA C 53.2 . 1 332 . 37 ALA HA H 4.24 . 1 333 . 37 ALA HB H 1.36 . 1 334 . 37 ALA CB C 18.9 . 1 335 . 37 ALA C C 178.0 . 1 336 . 38 HIS N N 115.9 . 1 337 . 38 HIS H H 7.83 . 1 338 . 38 HIS CA C 55.7 . 1 339 . 38 HIS HA H 4.67 . 1 340 . 38 HIS CB C 29.7 . 1 341 . 38 HIS HB2 H 3.31 . 2 342 . 38 HIS HB3 H 2.99 . 2 343 . 38 HIS HD1 H 7.09 . 1 344 . 38 HIS C C 174.4 . 1 345 . 39 ALA N N 124.4 . 1 346 . 39 ALA H H 8.01 . 1 347 . 39 ALA CA C 52.5 . 1 348 . 39 ALA HA H 4.46 . 1 349 . 39 ALA HB H 1.47 . 1 350 . 39 ALA CB C 19.2 . 1 351 . 39 ALA C C 178.0 . 1 352 . 40 THR N N 112.8 . 1 353 . 40 THR H H 8.25 . 1 354 . 40 THR CA C 61.8 . 1 355 . 40 THR HA H 4.40 . 1 356 . 40 THR CB C 69.8 . 1 357 . 40 THR HB H 4.33 . 1 358 . 40 THR HG2 H 1.24 . 1 359 . 40 THR CG2 C 21.5 . 1 360 . 40 THR C C 175.3 . 1 361 . 41 GLY N N 110.8 . 1 362 . 41 GLY H H 8.35 . 1 363 . 41 GLY CA C 45.3 . 1 364 . 41 GLY HA2 H 3.98 . 2 365 . 41 GLY HA3 H 4.04 . 2 366 . 41 GLY C C 173.8 . 1 367 . 42 ALA N N 123.5 . 1 368 . 42 ALA H H 8.25 . 1 369 . 42 ALA CA C 52.7 . 1 370 . 42 ALA HA H 4.35 . 1 371 . 42 ALA HB H 1.39 . 1 372 . 42 ALA CB C 19.3 . 1 373 . 42 ALA C C 178.2 . 1 374 . 43 GLY N N 107.2 . 1 375 . 43 GLY H H 8.22 . 1 376 . 43 GLY CA C 45.1 . 1 377 . 43 GLY HA2 H 4.03 . 1 378 . 43 GLY HA3 H 4.03 . 1 379 . 43 GLY C C 172.4 . 1 380 . 44 PRO CD C 49.8 . 1 381 . 44 PRO CA C 63.4 . 1 382 . 44 PRO HA H 4.38 . 1 383 . 44 PRO CB C 32.0 . 1 384 . 44 PRO HB2 H 2.29 . 2 385 . 44 PRO HB3 H 1.92 . 2 386 . 44 PRO CG C 27.2 . 1 387 . 44 PRO HG2 H 2.00 . 1 388 . 44 PRO HG3 H 2.00 . 1 389 . 44 PRO HD2 H 3.57 . 2 390 . 44 PRO HD3 H 3.61 . 2 391 . 44 PRO C C 177.5 . 1 392 . 45 ALA N N 123.1 . 1 393 . 45 ALA H H 8.31 . 1 394 . 45 ALA CA C 53.1 . 1 395 . 45 ALA HA H 4.17 . 1 396 . 45 ALA HB H 1.41 . 1 397 . 45 ALA CB C 18.9 . 1 398 . 45 ALA C C 178.5 . 1 399 . 46 GLY N N 107.2 . 1 400 . 46 GLY H H 8.29 . 1 401 . 46 GLY CA C 45.5 . 1 402 . 46 GLY HA2 H 3.82 . 2 403 . 46 GLY HA3 H 4.13 . 2 404 . 46 GLY C C 176.0 . 1 405 . 47 ARG N N 119.8 . 1 406 . 47 ARG H H 7.61 . 1 407 . 47 ARG CA C 58.1 . 1 408 . 47 ARG HA H 4.01 . 1 409 . 47 ARG CB C 30.1 . 1 410 . 47 ARG HB2 H 1.53 . 2 411 . 47 ARG HB3 H 1.34 . 2 412 . 47 ARG CG C 26.1 . 1 413 . 47 ARG HG2 H 0.92 . 2 414 . 47 ARG HG3 H 1.18 . 2 415 . 47 ARG CD C 43.3 . 1 416 . 47 ARG HD2 H 3.01 . 2 417 . 47 ARG HD3 H 2.98 . 2 418 . 47 ARG C C 177.0 . 1 419 . 48 TYR N N 117.5 . 1 420 . 48 TYR H H 8.50 . 1 421 . 48 TYR CA C 56.4 . 1 422 . 48 TYR HA H 5.01 . 1 423 . 48 TYR CB C 37.6 . 1 424 . 48 TYR HB2 H 2.83 . 2 425 . 48 TYR HB3 H 3.35 . 2 426 . 48 TYR HD1 H 6.99 . 1 427 . 48 TYR HD2 H 6.99 . 1 428 . 48 TYR HE1 H 6.66 . 1 429 . 48 TYR HE2 H 6.66 . 1 430 . 48 TYR C C 177.1 . 1 431 . 49 ASP N N 122.4 . 1 432 . 49 ASP H H 7.80 . 1 433 . 49 ASP CA C 57.8 . 1 434 . 49 ASP HA H 4.29 . 1 435 . 49 ASP CB C 39.8 . 1 436 . 49 ASP HB2 H 2.71 . 1 437 . 49 ASP HB3 H 2.71 . 1 438 . 49 ASP C C 177.4 . 1 439 . 50 GLN N N 119.3 . 1 440 . 50 GLN H H 8.51 . 1 441 . 50 GLN CA C 59.4 . 1 442 . 50 GLN HA H 4.17 . 1 443 . 50 GLN CB C 27.9 . 1 444 . 50 GLN HB2 H 2.13 . 1 445 . 50 GLN HB3 H 2.13 . 1 446 . 50 GLN CG C 34.1 . 1 447 . 50 GLN HG2 H 2.39 . 2 448 . 50 GLN HG3 H 2.46 . 2 449 . 50 GLN C C 178.9 . 1 450 . 51 ALA N N 122.6 . 1 451 . 51 ALA H H 8.38 . 1 452 . 51 ALA CA C 55.2 . 1 453 . 51 ALA HA H 4.27 . 1 454 . 51 ALA HB H 1.62 . 1 455 . 51 ALA CB C 19.4 . 1 456 . 51 ALA C C 180.3 . 1 457 . 52 THR N N 111.6 . 1 458 . 52 THR H H 8.37 . 1 459 . 52 THR CA C 66.9 . 1 460 . 52 THR HA H 3.83 . 1 461 . 52 THR CB C 68.1 . 1 462 . 52 THR HB H 4.30 . 1 463 . 52 THR HG2 H 1.27 . 1 464 . 52 THR CG2 C 22.0 . 1 465 . 52 THR C C 176.2 . 1 466 . 53 ASP N N 122.3 . 1 467 . 53 ASP H H 8.35 . 1 468 . 53 ASP CA C 57.8 . 1 469 . 53 ASP HA H 4.46 . 1 470 . 53 ASP CB C 40.7 . 1 471 . 53 ASP HB2 H 2.89 . 2 472 . 53 ASP HB3 H 2.71 . 2 473 . 53 ASP C C 179.5 . 1 474 . 54 THR N N 117.7 . 1 475 . 54 THR H H 8.06 . 1 476 . 54 THR CA C 67.1 . 1 477 . 54 THR HA H 3.95 . 1 478 . 54 THR CB C 68.4 . 1 479 . 54 THR HB H 4.37 . 1 480 . 54 THR HG2 H 1.17 . 1 481 . 54 THR CG2 C 21.7 . 1 482 . 54 THR C C 175.5 . 1 483 . 55 ILE N N 121.4 . 1 484 . 55 ILE H H 8.08 . 1 485 . 55 ILE CA C 66.2 . 1 486 . 55 ILE HA H 3.42 . 1 487 . 55 ILE CB C 38.0 . 1 488 . 55 ILE HB H 1.89 . 1 489 . 55 ILE HG2 H 0.77 . 1 490 . 55 ILE CG2 C 17.4 . 1 491 . 55 ILE CG1 C 30.3 . 1 492 . 55 ILE HG12 H 1.90 . 2 493 . 55 ILE HG13 H 0.90 . 2 494 . 55 ILE HD1 H 0.78 . 1 495 . 55 ILE CD1 C 14.9 . 1 496 . 55 ILE C C 178.3 . 1 497 . 56 LEU N N 121.3 . 1 498 . 56 LEU H H 8.47 . 1 499 . 56 LEU CA C 58.4 . 1 500 . 56 LEU HA H 4.04 . 1 501 . 56 LEU CB C 41.5 . 1 502 . 56 LEU HB2 H 1.63 . 1 503 . 56 LEU HB3 H 1.90 . 1 504 . 56 LEU CG C 27.0 . 1 505 . 56 LEU HG H 1.75 . 1 506 . 56 LEU HD1 H 0.91 . 1 507 . 56 LEU HD2 H 0.91 . 1 508 . 56 LEU CD1 C 25.0 . 1 509 . 56 LEU CD2 C 23.7 . 1 510 . 56 LEU C C 179.5 . 1 511 . 57 THR N N 116.7 . 1 512 . 57 THR H H 8.24 . 1 513 . 57 THR CA C 66.7 . 1 514 . 57 THR HA H 3.97 . 1 515 . 57 THR CB C 68.9 . 1 516 . 57 THR HB H 4.35 . 1 517 . 57 THR HG2 H 1.27 . 1 518 . 57 THR CG2 C 21.4 . 1 519 . 57 THR C C 176.5 . 1 520 . 58 VAL N N 121.6 . 1 521 . 58 VAL H H 8.48 . 1 522 . 58 VAL CA C 66.6 . 1 523 . 58 VAL HA H 3.79 . 1 524 . 58 VAL CB C 31.1 . 1 525 . 58 VAL HB H 2.13 . 1 526 . 58 VAL HG1 H 1.11 . 2 527 . 58 VAL HG2 H 1.06 . 2 528 . 58 VAL CG1 C 23.0 . 1 529 . 58 VAL CG2 C 23.0 . 1 530 . 58 VAL C C 178.4 . 1 531 . 59 THR N N 114.7 . 1 532 . 59 THR H H 8.20 . 1 533 . 59 THR CA C 68.0 . 1 534 . 59 THR HA H 3.71 . 1 535 . 59 THR CB C 67.8 . 1 536 . 59 THR HB H 4.20 . 1 537 . 59 THR HG2 H 1.22 . 1 538 . 59 THR CG2 C 22.2 . 1 539 . 59 THR C C 176.4 . 1 540 . 60 GLU N N 120.4 . 1 541 . 60 GLU H H 7.83 . 1 542 . 60 GLU CA C 59.4 . 1 543 . 60 GLU HA H 4.20 . 1 544 . 60 GLU CB C 28.8 . 1 545 . 60 GLU HB2 H 2.13 . 2 546 . 60 GLU HB3 H 2.25 . 2 547 . 60 GLU CG C 36.3 . 1 548 . 60 GLU HG2 H 2.31 . 2 549 . 60 GLU HG3 H 2.45 . 2 550 . 60 GLU C C 179.2 . 1 551 . 61 ASN N N 118.5 . 1 552 . 61 ASN H H 8.10 . 1 553 . 61 ASN CA C 55.1 . 1 554 . 61 ASN HA H 4.61 . 1 555 . 61 ASN CB C 38.0 . 1 556 . 61 ASN HB2 H 2.80 . 2 557 . 61 ASN HB3 H 3.09 . 2 558 . 61 ASN ND2 N 111.0 . 1 559 . 61 ASN HD21 H 6.91 . 2 560 . 61 ASN HD22 H 7.41 . 2 561 . 61 ASN C C 178.5 . 1 562 . 62 ILE N N 122.9 . 1 563 . 62 ILE H H 8.28 . 1 564 . 62 ILE CA C 65.6 . 1 565 . 62 ILE HA H 3.59 . 1 566 . 62 ILE CB C 37.5 . 1 567 . 62 ILE HB H 2.02 . 1 568 . 62 ILE HG2 H 0.62 . 1 569 . 62 ILE CG2 C 17.1 . 1 570 . 62 ILE CG1 C 30.3 . 1 571 . 62 ILE HG12 H 0.96 . 2 572 . 62 ILE HG13 H 1.79 . 2 573 . 62 ILE HD1 H 0.76 . 1 574 . 62 ILE CD1 C 14.0 . 1 575 . 62 ILE C C 177.1 . 1 576 . 63 PHE N N 117.3 . 1 577 . 63 PHE H H 7.70 . 1 578 . 63 PHE CA C 61.0 . 1 579 . 63 PHE HA H 4.27 . 1 580 . 63 PHE CB C 38.5 . 1 581 . 63 PHE HB2 H 3.27 . 2 582 . 63 PHE HB3 H 3.09 . 2 583 . 63 PHE HD1 H 7.34 . 1 584 . 63 PHE HD2 H 7.34 . 1 585 . 63 PHE HE1 H 7.32 . 1 586 . 63 PHE HE2 H 7.32 . 1 587 . 63 PHE HZ H 7.26 . 1 588 . 63 PHE C C 178.5 . 1 589 . 64 SER N N 113.7 . 1 590 . 64 SER H H 8.23 . 1 591 . 64 SER CA C 60.1 . 1 592 . 64 SER HA H 4.46 . 1 593 . 64 SER CB C 63.3 . 1 594 . 64 SER HB2 H 4.04 . 2 595 . 64 SER HB3 H 4.11 . 2 596 . 64 SER C C 175.2 . 1 597 . 65 SER N N 116.5 . 1 598 . 65 SER H H 7.72 . 1 599 . 65 SER CA C 58.3 . 1 600 . 65 SER HA H 4.67 . 1 601 . 65 SER CB C 63.8 . 1 602 . 65 SER HB2 H 3.87 . 2 603 . 65 SER HB3 H 4.03 . 2 604 . 65 SER C C 174.1 . 1 605 . 66 MET N N 119.1 . 1 606 . 66 MET H H 7.38 . 1 607 . 66 MET CA C 57.5 . 1 608 . 66 MET HA H 4.40 . 1 609 . 66 MET CB C 32.3 . 1 610 . 66 MET HB2 H 2.11 . 2 611 . 66 MET HB3 H 2.08 . 2 612 . 66 MET CG C 32.4 . 1 613 . 66 MET HG2 H 2.79 . 2 614 . 66 MET HG3 H 2.63 . 2 615 . 66 MET HE H 1.97 . 1 616 . 66 MET CE C 17.0 . 1 617 . 66 MET C C 176.5 . 1 618 . 67 GLY N N 108.1 . 1 619 . 67 GLY H H 8.31 . 1 620 . 67 GLY CA C 45.2 . 1 621 . 67 GLY HA2 H 3.94 . 2 622 . 67 GLY HA3 H 4.00 . 2 623 . 67 GLY C C 173.4 . 1 624 . 68 ASP N N 121.7 . 1 625 . 68 ASP H H 8.06 . 1 626 . 68 ASP CA C 52.3 . 1 627 . 68 ASP HA H 4.86 . 1 628 . 68 ASP CB C 41.6 . 1 629 . 68 ASP HB2 H 2.48 . 2 630 . 68 ASP HB3 H 3.04 . 2 631 . 68 ASP C C 175.0 . 1 632 . 69 ALA N N 127.1 . 1 633 . 69 ALA H H 8.77 . 1 634 . 69 ALA CA C 55.7 . 1 635 . 69 ALA HA H 4.03 . 1 636 . 69 ALA HB H 1.47 . 1 637 . 69 ALA CB C 18.5 . 1 638 . 69 ALA C C 179.8 . 1 639 . 70 GLY N N 104.8 . 1 640 . 70 GLY H H 8.48 . 1 641 . 70 GLY CA C 46.9 . 1 642 . 70 GLY HA2 H 3.83 . 2 643 . 70 GLY HA3 H 3.99 . 2 644 . 70 GLY C C 176.9 . 1 645 . 71 GLU N N 124.6 . 1 646 . 71 GLU H H 7.91 . 1 647 . 71 GLU CA C 57.5 . 1 648 . 71 GLU HA H 4.38 . 1 649 . 71 GLU CB C 29.3 . 1 650 . 71 GLU HB2 H 2.08 . 2 651 . 71 GLU HB3 H 2.02 . 2 652 . 71 GLU CG C 35.3 . 1 653 . 71 GLU HG2 H 2.46 . 2 654 . 71 GLU HG3 H 2.28 . 2 655 . 71 GLU C C 178.7 . 1 656 . 72 MET N N 119.5 . 1 657 . 72 MET H H 8.46 . 1 658 . 72 MET CA C 59.8 . 1 659 . 72 MET HA H 3.98 . 1 660 . 72 MET CB C 33.0 . 1 661 . 72 MET HB2 H 2.38 . 2 662 . 72 MET HB3 H 2.01 . 2 663 . 72 MET CG C 32.2 . 1 664 . 72 MET HG2 H 2.41 . 2 665 . 72 MET HG3 H 2.67 . 2 666 . 72 MET HE H 2.03 . 1 667 . 72 MET CE C 17.2 . 1 668 . 72 MET C C 178.5 . 1 669 . 73 VAL N N 117.4 . 1 670 . 73 VAL H H 7.87 . 1 671 . 73 VAL CA C 66.7 . 1 672 . 73 VAL HA H 3.56 . 1 673 . 73 VAL CB C 31.6 . 1 674 . 73 VAL HB H 2.15 . 1 675 . 73 VAL HG1 H 0.95 . 1 676 . 73 VAL HG2 H 1.04 . 1 677 . 73 VAL CG1 C 21.3 . 1 678 . 73 VAL CG2 C 23.5 . 1 679 . 73 VAL C C 177.7 . 1 680 . 74 ARG N N 121.1 . 1 681 . 74 ARG H H 7.69 . 1 682 . 74 ARG CA C 60.2 . 1 683 . 74 ARG HA H 3.96 . 1 684 . 74 ARG CB C 30.8 . 1 685 . 74 ARG HB2 H 1.99 . 1 686 . 74 ARG HB3 H 1.99 . 1 687 . 74 ARG CG C 28.4 . 1 688 . 74 ARG HG2 H 1.43 . 2 689 . 74 ARG HG3 H 1.77 . 2 690 . 74 ARG CD C 43.2 . 1 691 . 74 ARG HD2 H 3.21 . 2 692 . 74 ARG HD3 H 3.31 . 2 693 . 74 ARG C C 180.0 . 1 694 . 75 GLN N N 116.7 . 1 695 . 75 GLN H H 8.54 . 1 696 . 75 GLN CA C 58.0 . 1 697 . 75 GLN HA H 4.04 . 1 698 . 75 GLN CB C 28.4 . 1 699 . 75 GLN HB2 H 2.22 . 2 700 . 75 GLN HB3 H 2.93 . 2 701 . 75 GLN CG C 33.5 . 1 702 . 75 GLN HG2 H 2.21 . 2 703 . 75 GLN HG3 H 2.59 . 2 704 . 75 GLN NE2 N 110.5 . 1 705 . 75 GLN HE21 H 7.48 . 2 706 . 75 GLN HE22 H 6.38 . 2 707 . 75 GLN C C 178.1 . 1 708 . 76 ALA N N 121.9 . 1 709 . 76 ALA H H 8.54 . 1 710 . 76 ALA CA C 55.3 . 1 711 . 76 ALA HA H 3.96 . 1 712 . 76 ALA HB H 1.49 . 1 713 . 76 ALA CB C 17.7 . 1 714 . 76 ALA C C 179.1 . 1 715 . 77 ARG N N 117.9 . 1 716 . 77 ARG H H 7.99 . 1 717 . 77 ARG CA C 59.7 . 1 718 . 77 ARG HA H 4.06 . 1 719 . 77 ARG CB C 29.8 . 1 720 . 77 ARG HB2 H 1.99 . 1 721 . 77 ARG HB3 H 1.99 . 1 722 . 77 ARG CG C 27.9 . 1 723 . 77 ARG HG2 H 1.64 . 2 724 . 77 ARG HG3 H 1.90 . 2 725 . 77 ARG CD C 43.6 . 1 726 . 77 ARG HD2 H 3.19 . 1 727 . 77 ARG HD3 H 3.19 . 1 728 . 77 ARG C C 179.7 . 1 729 . 78 ILE N N 122.5 . 1 730 . 78 ILE H H 7.57 . 1 731 . 78 ILE CA C 65.2 . 1 732 . 78 ILE HA H 3.76 . 1 733 . 78 ILE CB C 37.6 . 1 734 . 78 ILE HB H 2.08 . 1 735 . 78 ILE HG2 H 0.91 . 1 736 . 78 ILE CG2 C 17.6 . 1 737 . 78 ILE CG1 C 28.7 . 1 738 . 78 ILE HG12 H 1.82 . 1 739 . 78 ILE HG13 H 1.82 . 1 740 . 78 ILE HD1 H 0.84 . 1 741 . 78 ILE CD1 C 13.1 . 1 742 . 78 ILE C C 178.9 . 1 743 . 79 LEU N N 121.8 . 1 744 . 79 LEU H H 8.53 . 1 745 . 79 LEU CA C 58.0 . 1 746 . 79 LEU HA H 3.94 . 1 747 . 79 LEU CB C 41.3 . 1 748 . 79 LEU HB2 H 1.65 . 2 749 . 79 LEU HB3 H 2.12 . 2 750 . 79 LEU CG C 27.0 . 1 751 . 79 LEU HG H 1.60 . 1 752 . 79 LEU HD1 H 0.96 . 1 753 . 79 LEU HD2 H 0.86 . 1 754 . 79 LEU CD1 C 24.9 . 1 755 . 79 LEU CD2 C 23.5 . 1 756 . 79 LEU C C 179.0 . 1 757 . 80 ALA N N 122.5 . 1 758 . 80 ALA H H 8.53 . 1 759 . 80 ALA CA C 55.2 . 1 760 . 80 ALA HA H 4.03 . 1 761 . 80 ALA HB H 1.50 . 1 762 . 80 ALA CB C 17.7 . 1 763 . 80 ALA C C 180.2 . 1 764 . 81 GLN N N 119.6 . 1 765 . 81 GLN H H 7.82 . 1 766 . 81 GLN CA C 58.5 . 1 767 . 81 GLN HA H 4.05 . 1 768 . 81 GLN CB C 28.4 . 1 769 . 81 GLN HB2 H 2.23 . 1 770 . 81 GLN HB3 H 2.23 . 1 771 . 81 GLN CG C 33.7 . 1 772 . 81 GLN HG2 H 2.42 . 1 773 . 81 GLN HG3 H 2.42 . 1 774 . 81 GLN NE2 N 114.7 . 1 775 . 81 GLN HE21 H 6.83 . 2 776 . 81 GLN HE22 H 7.71 . 2 777 . 81 GLN C C 177.3 . 1 778 . 82 ALA N N 121.9 . 1 779 . 82 ALA H H 8.44 . 1 780 . 82 ALA CA C 55.1 . 1 781 . 82 ALA HA H 4.33 . 1 782 . 82 ALA HB H 1.54 . 1 783 . 82 ALA CB C 18.2 . 1 784 . 82 ALA C C 181.0 . 1 785 . 83 THR N N 113.9 . 1 786 . 83 THR H H 8.71 . 1 787 . 83 THR CA C 67.1 . 1 788 . 83 THR HA H 3.86 . 1 789 . 83 THR CB C 68.3 . 1 790 . 83 THR HB H 4.24 . 1 791 . 83 THR HG2 H 1.21 . 1 792 . 83 THR CG2 C 22.0 . 1 793 . 83 THR C C 181.1 . 1 794 . 84 SER N N 118.0 . 1 795 . 84 SER H H 7.99 . 1 796 . 84 SER CA C 61.9 . 1 797 . 84 SER HA H 4.13 . 1 798 . 84 SER CB C 62.5 . 1 799 . 84 SER HB2 H 4.03 . 1 800 . 84 SER HB3 H 4.03 . 1 801 . 85 ASP N N 120.8 . 1 802 . 85 ASP H H 8.35 . 1 803 . 85 ASP CA C 57.5 . 1 804 . 85 ASP HA H 4.45 . 1 805 . 85 ASP CB C 39.9 . 1 806 . 85 ASP HB2 H 2.72 . 2 807 . 85 ASP HB3 H 2.90 . 2 808 . 85 ASP C C 179.2 . 1 809 . 86 LEU N N 122.5 . 1 810 . 86 LEU H H 7.91 . 1 811 . 86 LEU CA C 58.0 . 1 812 . 86 LEU HA H 4.25 . 1 813 . 86 LEU CB C 41.6 . 1 814 . 86 LEU HB2 H 2.04 . 2 815 . 86 LEU HB3 H 1.53 . 2 816 . 86 LEU CG C 27.1 . 1 817 . 86 LEU HG H 1.36 . 1 818 . 86 LEU HD1 H 0.80 . 1 819 . 86 LEU HD2 H 0.71 . 1 820 . 86 LEU CD1 C 23.5 . 1 821 . 86 LEU CD2 C 26.8 . 1 822 . 86 LEU C C 177.8 . 1 823 . 87 VAL N N 118.5 . 1 824 . 87 VAL H H 8.78 . 1 825 . 87 VAL CA C 67.3 . 1 826 . 87 VAL HA H 3.39 . 1 827 . 87 VAL CB C 31.2 . 1 828 . 87 VAL HB H 2.23 . 1 829 . 87 VAL HG1 H 0.92 . 1 830 . 87 VAL HG2 H 1.05 . 1 831 . 87 VAL CG1 C 21.3 . 1 832 . 87 VAL CG2 C 23.2 . 1 833 . 87 VAL C C 177.9 . 1 834 . 88 ASN N N 117.1 . 1 835 . 88 ASN H H 8.27 . 1 836 . 88 ASN CA C 56.1 . 1 837 . 88 ASN HA H 4.46 . 1 838 . 88 ASN CB C 37.7 . 1 839 . 88 ASN HB2 H 2.80 . 2 840 . 88 ASN HB3 H 2.97 . 2 841 . 88 ASN ND2 N 112.8 . 1 842 . 88 ASN HD21 H 6.88 . 2 843 . 88 ASN HD22 H 7.66 . 2 844 . 88 ASN C C 178.1 . 1 845 . 89 ALA N N 125.1 . 1 846 . 89 ALA H H 7.91 . 1 847 . 89 ALA CA C 55.3 . 1 848 . 89 ALA HA H 4.28 . 1 849 . 89 ALA HB H 1.69 . 1 850 . 89 ALA CB C 18.0 . 1 851 . 89 ALA C C 179.6 . 1 852 . 90 ILE N N 119.7 . 1 853 . 90 ILE H H 8.44 . 1 854 . 90 ILE CA C 64.5 . 1 855 . 90 ILE HA H 3.85 . 1 856 . 90 ILE CB C 37.5 . 1 857 . 90 ILE HB H 1.81 . 1 858 . 90 ILE HG2 H 0.78 . 1 859 . 90 ILE CG2 C 17.9 . 1 860 . 90 ILE CG1 C 28.8 . 1 861 . 90 ILE HG12 H 1.40 . 1 862 . 90 ILE HG13 H 1.40 . 1 863 . 90 ILE HD1 H 0.45 . 1 864 . 90 ILE CD1 C 13.8 . 1 865 . 90 ILE C C 178.5 . 1 866 . 91 LYS N N 119.1 . 1 867 . 91 LYS H H 8.48 . 1 868 . 91 LYS CA C 60.2 . 1 869 . 91 LYS HA H 3.84 . 1 870 . 91 LYS CB C 32.4 . 1 871 . 91 LYS HB2 H 1.89 . 1 872 . 91 LYS HB3 H 1.89 . 1 873 . 91 LYS CG C 25.7 . 1 874 . 91 LYS HG2 H 1.65 . 2 875 . 91 LYS HG3 H 1.32 . 2 876 . 91 LYS CD C 29.7 . 1 877 . 91 LYS HD2 H 1.65 . 1 878 . 91 LYS HD3 H 1.65 . 1 879 . 91 LYS CE C 42.1 . 1 880 . 91 LYS HE2 H 2.93 . 1 881 . 91 LYS HE3 H 2.93 . 1 882 . 91 LYS C C 178.9 . 1 883 . 92 ALA N N 120.9 . 1 884 . 92 ALA H H 7.68 . 1 885 . 92 ALA CA C 54.8 . 1 886 . 92 ALA HA H 4.21 . 1 887 . 92 ALA HB H 1.55 . 1 888 . 92 ALA CB C 18.0 . 1 889 . 92 ALA C C 180.6 . 1 890 . 93 ASP N N 119.7 . 1 891 . 93 ASP H H 8.15 . 1 892 . 93 ASP CA C 56.4 . 1 893 . 93 ASP HA H 4.53 . 1 894 . 93 ASP CB C 40.4 . 1 895 . 93 ASP HB2 H 2.79 . 2 896 . 93 ASP HB3 H 2.94 . 2 897 . 93 ASP C C 178.2 . 1 898 . 94 ALA N N 122.5 . 1 899 . 94 ALA H H 8.54 . 1 900 . 94 ALA CA C 54.1 . 1 901 . 94 ALA HA H 4.18 . 1 902 . 94 ALA HB H 1.50 . 1 903 . 94 ALA CB C 18.5 . 1 904 . 94 ALA C C 179.5 . 1 905 . 95 GLU N N 118.1 . 1 906 . 95 GLU H H 7.83 . 1 907 . 95 GLU CA C 58.4 . 1 908 . 95 GLU HA H 4.14 . 1 909 . 95 GLU CB C 29.5 . 1 910 . 95 GLU HB2 H 2.13 . 1 911 . 95 GLU HB3 H 2.13 . 1 912 . 95 GLU CG C 36.4 . 1 913 . 95 GLU HG2 H 2.34 . 2 914 . 95 GLU HG3 H 2.48 . 2 915 . 95 GLU C C 177.6 . 1 916 . 96 GLY N N 106.7 . 1 917 . 96 GLY H H 7.92 . 1 918 . 96 GLY CA C 45.1 . 1 919 . 96 GLY HA2 H 3.89 . 2 920 . 96 GLY HA3 H 4.18 . 2 921 . 96 GLY C C 174.3 . 1 922 . 97 GLU N N 121.1 . 1 923 . 97 GLU H H 7.53 . 1 924 . 97 GLU CA C 56.1 . 1 925 . 97 GLU HA H 4.38 . 1 926 . 97 GLU CB C 30.1 . 1 927 . 97 GLU HB2 H 2.18 . 2 928 . 97 GLU HB3 H 2.07 . 2 929 . 97 GLU CG C 36.5 . 1 930 . 97 GLU HG2 H 2.34 . 1 931 . 97 GLU HG3 H 2.34 . 1 932 . 97 GLU C C 176.5 . 1 933 . 98 SER N N 118.1 . 1 934 . 98 SER H H 8.38 . 1 935 . 98 SER CA C 59.5 . 1 936 . 98 SER HA H 4.36 . 1 937 . 98 SER CB C 63.6 . 1 938 . 98 SER HB2 H 3.93 . 2 939 . 98 SER HB3 H 3.97 . 2 940 . 98 SER C C 174.6 . 1 941 . 99 ASP N N 122.4 . 1 942 . 99 ASP H H 8.58 . 1 943 . 99 ASP CA C 53.4 . 1 944 . 99 ASP HA H 4.78 . 1 945 . 99 ASP CB C 41.1 . 1 946 . 99 ASP HB2 H 2.61 . 2 947 . 99 ASP HB3 H 2.98 . 2 948 . 99 ASP C C 176.3 . 1 949 . 100 LEU N N 126.0 . 1 950 . 100 LEU H H 8.38 . 1 951 . 100 LEU CA C 57.3 . 1 952 . 100 LEU HA H 4.17 . 1 953 . 100 LEU CB C 41.8 . 1 954 . 100 LEU HB2 H 1.79 . 2 955 . 100 LEU HB3 H 1.63 . 2 956 . 100 LEU CG C 27.2 . 1 957 . 100 LEU HG H 1.71 . 1 958 . 100 LEU HD1 H 0.98 . 1 959 . 100 LEU HD2 H 0.92 . 1 960 . 100 LEU CD1 C 24.7 . 1 961 . 100 LEU CD2 C 23.7 . 1 962 . 100 LEU C C 179.1 . 1 963 . 101 GLU N N 119.5 . 1 964 . 101 GLU H H 8.39 . 1 965 . 101 GLU CA C 59.0 . 1 966 . 101 GLU HA H 4.13 . 1 967 . 101 GLU CB C 29.0 . 1 968 . 101 GLU HB2 H 2.05 . 2 969 . 101 GLU HB3 H 2.13 . 2 970 . 101 GLU CG C 36.0 . 1 971 . 101 GLU HG2 H 2.31 . 1 972 . 101 GLU HG3 H 2.31 . 1 973 . 101 GLU C C 179.0 . 1 974 . 102 ASN N N 118.0 . 1 975 . 102 ASN H H 8.19 . 1 976 . 102 ASN CA C 56.1 . 1 977 . 102 ASN HA H 4.50 . 1 978 . 102 ASN CB C 38.3 . 1 979 . 102 ASN HB2 H 2.82 . 2 980 . 102 ASN HB3 H 2.79 . 2 981 . 102 ASN ND2 N 113.4 . 1 982 . 102 ASN HD21 H 6.99 . 2 983 . 102 ASN HD22 H 8.08 . 2 984 . 102 ASN C C 177.7 . 1 985 . 103 SER N N 115.0 . 1 986 . 103 SER H H 8.22 . 1 987 . 103 SER CA C 61.8 . 1 988 . 103 SER HA H 4.15 . 1 989 . 103 SER CB C 62.8 . 1 990 . 103 SER HB2 H 4.03 . 1 991 . 103 SER HB3 H 4.03 . 1 992 . 103 SER C C 178.4 . 1 993 . 104 ARG N N 120.3 . 1 994 . 104 ARG H H 8.08 . 1 995 . 104 ARG CA C 59.8 . 1 996 . 104 ARG HA H 4.24 . 1 997 . 104 ARG CB C 29.9 . 1 998 . 104 ARG HB2 H 1.91 . 2 999 . 104 ARG HB3 H 1.98 . 2 1000 . 104 ARG C C 179.6 . 1 1001 . 105 LYS N N 119.9 . 1 1002 . 105 LYS H H 7.84 . 1 1003 . 105 LYS CA C 59.3 . 1 1004 . 105 LYS HA H 3.94 . 1 1005 . 105 LYS CB C 32.0 . 1 1006 . 105 LYS HB2 H 1.31 . 2 1007 . 105 LYS HB3 H 1.72 . 2 1008 . 105 LYS CG C 25.4 . 1 1009 . 105 LYS HG2 H 1.30 . 2 1010 . 105 LYS HG3 H 1.48 . 2 1011 . 105 LYS CD C 29.3 . 1 1012 . 105 LYS HD2 H 1.63 . 1 1013 . 105 LYS HD3 H 1.63 . 1 1014 . 105 LYS CE C 42.1 . 1 1015 . 105 LYS HE2 H 2.93 . 1 1016 . 105 LYS HE3 H 2.93 . 1 1017 . 105 LYS C C 179.5 . 1 1018 . 106 LEU N N 121.1 . 1 1019 . 106 LEU H H 7.90 . 1 1020 . 106 LEU CA C 58.1 . 1 1021 . 106 LEU HA H 3.83 . 1 1022 . 106 LEU CB C 41.9 . 1 1023 . 106 LEU HB2 H 1.79 . 2 1024 . 106 LEU HB3 H 1.61 . 2 1025 . 106 LEU CG C 27.0 . 1 1026 . 106 LEU HG H 1.61 . 1 1027 . 106 LEU HD1 H 0.88 . 1 1028 . 106 LEU HD2 H 0.88 . 1 1029 . 106 LEU CD1 C 24.9 . 1 1030 . 106 LEU CD2 C 24.9 . 1 1031 . 106 LEU C C 178.2 . 1 1032 . 107 LEU N N 118.0 . 1 1033 . 107 LEU H H 8.25 . 1 1034 . 107 LEU CA C 58.0 . 1 1035 . 107 LEU HA H 3.94 . 1 1036 . 107 LEU CB C 41.1 . 1 1037 . 107 LEU HB2 H 1.79 . 2 1038 . 107 LEU HB3 H 1.53 . 2 1039 . 107 LEU CG C 27.0 . 1 1040 . 107 LEU HG H 1.72 . 1 1041 . 107 LEU HD1 H 0.86 . 1 1042 . 107 LEU HD2 H 0.86 . 1 1043 . 107 LEU CD1 C 24.9 . 1 1044 . 107 LEU CD2 C 23.8 . 1 1045 . 107 LEU C C 180.3 . 1 1046 . 108 SER N N 115.5 . 1 1047 . 108 SER H H 8.19 . 1 1048 . 108 SER CA C 61.5 . 1 1049 . 108 SER HA H 4.23 . 1 1050 . 108 SER CB C 62.5 . 1 1051 . 108 SER HB2 H 3.99 . 2 1052 . 108 SER HB3 H 3.97 . 2 1053 . 108 SER C C 176.5 . 1 1054 . 109 ALA N N 123.4 . 1 1055 . 109 ALA H H 7.94 . 1 1056 . 109 ALA CA C 54.8 . 1 1057 . 109 ALA HA H 4.19 . 1 1058 . 109 ALA HB H 1.53 . 1 1059 . 109 ALA CB C 17.9 . 1 1060 . 109 ALA C C 180.6 . 1 1061 . 110 ALA N N 121.8 . 1 1062 . 110 ALA H H 8.54 . 1 1063 . 110 ALA CA C 55.1 . 1 1064 . 110 ALA HA H 3.94 . 1 1065 . 110 ALA HB H 1.50 . 1 1066 . 110 ALA CB C 17.7 . 1 1067 . 110 ALA C C 178.5 . 1 1068 . 111 LYS N N 119.9 . 1 1069 . 111 LYS H H 7.90 . 1 1070 . 111 LYS CA C 59.5 . 1 1071 . 111 LYS HA H 4.05 . 1 1072 . 111 LYS CB C 32.0 . 1 1073 . 111 LYS HB2 H 1.98 . 2 1074 . 111 LYS HB3 H 2.08 . 2 1075 . 111 LYS CG C 25.1 . 1 1076 . 111 LYS HG2 H 1.44 . 2 1077 . 111 LYS HG3 H 1.56 . 2 1078 . 111 LYS CD C 28.9 . 1 1079 . 111 LYS HD2 H 1.74 . 2 1080 . 111 LYS HD3 H 1.65 . 2 1081 . 111 LYS CE C 42.2 . 1 1082 . 111 LYS HE2 H 2.98 . 1 1083 . 111 LYS HE3 H 2.98 . 1 1084 . 111 LYS C C 178.5 . 1 1085 . 112 ILE N N 119.9 . 1 1086 . 112 ILE H H 7.84 . 1 1087 . 112 ILE CA C 64.6 . 1 1088 . 112 ILE HA H 3.88 . 1 1089 . 112 ILE CB C 37.5 . 1 1090 . 112 ILE HB H 1.99 . 1 1091 . 112 ILE HG2 H 1.01 . 1 1092 . 112 ILE CG2 C 17.2 . 1 1093 . 112 ILE CG1 C 29.2 . 1 1094 . 112 ILE HG12 H 1.32 . 2 1095 . 112 ILE HG13 H 1.74 . 2 1096 . 112 ILE HD1 H 0.87 . 1 1097 . 112 ILE CD1 C 12.5 . 1 1098 . 112 ILE C C 179.6 . 1 1099 . 113 LEU N N 120.6 . 1 1100 . 113 LEU H H 7.79 . 1 1101 . 113 LEU CA C 58.0 . 1 1102 . 113 LEU HA H 4.09 . 1 1103 . 113 LEU CB C 41.2 . 1 1104 . 113 LEU HB2 H 1.32 . 2 1105 . 113 LEU HB3 H 2.07 . 2 1106 . 113 LEU CG C 27.3 . 1 1107 . 113 LEU HG H 1.59 . 1 1108 . 113 LEU HD1 H 0.96 . 1 1109 . 113 LEU HD2 H 0.89 . 1 1110 . 113 LEU CD1 C 24.2 . 1 1111 . 113 LEU CD2 C 27.5 . 1 1112 . 113 LEU C C 178.3 . 1 1113 . 114 ALA N N 124.3 . 1 1114 . 114 ALA H H 8.61 . 1 1115 . 114 ALA CA C 55.7 . 1 1116 . 114 ALA HA H 4.05 . 1 1117 . 114 ALA HB H 1.55 . 1 1118 . 114 ALA CB C 17.6 . 1 1119 . 114 ALA C C 180.8 . 1 1120 . 115 ASP N N 120.9 . 1 1121 . 115 ASP H H 8.68 . 1 1122 . 115 ASP CA C 57.2 . 1 1123 . 115 ASP HA H 4.45 . 1 1124 . 115 ASP CB C 40.3 . 1 1125 . 115 ASP HB2 H 2.68 . 2 1126 . 115 ASP HB3 H 2.83 . 2 1127 . 115 ASP C C 178.5 . 1 1128 . 116 ALA N N 123.3 . 1 1129 . 116 ALA H H 8.42 . 1 1130 . 116 ALA CA C 55.0 . 1 1131 . 116 ALA HA H 4.17 . 1 1132 . 116 ALA HB H 1.50 . 1 1133 . 116 ALA CB C 17.4 . 1 1134 . 116 ALA C C 181.1 . 1 1135 . 117 THR N N 116.6 . 1 1136 . 117 THR H H 8.82 . 1 1137 . 117 THR CA C 67.0 . 1 1138 . 117 THR HA H 3.75 . 1 1139 . 117 THR CB C 68.3 . 1 1140 . 117 THR HB H 4.31 . 1 1141 . 117 THR HG2 H 1.24 . 1 1142 . 117 THR CG2 C 22.2 . 1 1143 . 117 THR C C 176.0 . 1 1144 . 118 ALA N N 125.2 . 1 1145 . 118 ALA H H 8.07 . 1 1146 . 118 ALA CA C 55.5 . 1 1147 . 118 ALA HA H 4.12 . 1 1148 . 118 ALA HB H 1.60 . 1 1149 . 118 ALA CB C 17.5 . 1 1150 . 118 ALA C C 181.0 . 1 1151 . 119 LYS N N 118.1 . 1 1152 . 119 LYS H H 7.83 . 1 1153 . 119 LYS CA C 59.1 . 1 1154 . 119 LYS HA H 4.11 . 1 1155 . 119 LYS CB C 31.8 . 1 1156 . 119 LYS HB2 H 2.02 . 2 1157 . 119 LYS HB3 H 1.92 . 2 1158 . 119 LYS CD C 28.8 . 1 1159 . 119 LYS HD2 H 1.70 . 2 1160 . 119 LYS HD3 H 1.65 . 2 1161 . 119 LYS CE C 42.1 . 1 1162 . 119 LYS HE2 H 2.97 . 1 1163 . 119 LYS HE3 H 2.97 . 1 1164 . 119 LYS C C 179.4 . 1 1165 . 120 MET N N 121.4 . 1 1166 . 120 MET H H 7.96 . 1 1167 . 120 MET CA C 58.3 . 1 1168 . 120 MET HA H 4.18 . 1 1169 . 120 MET CB C 32.5 . 1 1170 . 120 MET HB2 H 1.86 . 2 1171 . 120 MET HB3 H 2.50 . 2 1172 . 120 MET CG C 32.6 . 1 1173 . 120 MET HG2 H 2.51 . 2 1174 . 120 MET HG3 H 2.34 . 2 1175 . 120 MET HE H 2.07 . 1 1176 . 120 MET CE C 19.2 . 1 1177 . 120 MET C C 177.2 . 1 1178 . 121 VAL N N 120.3 . 1 1179 . 121 VAL H H 8.40 . 1 1180 . 121 VAL CA C 67.3 . 1 1181 . 121 VAL HA H 3.46 . 1 1182 . 121 VAL CB C 31.6 . 1 1183 . 121 VAL HB H 2.25 . 1 1184 . 121 VAL HG1 H 0.93 . 1 1185 . 121 VAL HG2 H 1.06 . 1 1186 . 121 VAL CG1 C 21.1 . 1 1187 . 121 VAL CG2 C 23.0 . 1 1188 . 121 VAL C C 178.0 . 1 1189 . 122 GLU N N 117.8 . 1 1190 . 122 GLU H H 7.79 . 1 1191 . 122 GLU CA C 59.1 . 1 1192 . 122 GLU HA H 4.00 . 1 1193 . 122 GLU CB C 29.5 . 1 1194 . 122 GLU HB2 H 2.10 . 1 1195 . 122 GLU HB3 H 2.10 . 1 1196 . 122 GLU CG C 36.1 . 1 1197 . 122 GLU HG2 H 2.30 . 2 1198 . 122 GLU HG3 H 2.36 . 2 1199 . 122 GLU C C 179.4 . 1 1200 . 123 ALA N N 122.5 . 1 1201 . 123 ALA H H 8.26 . 1 1202 . 123 ALA CA C 54.6 . 1 1203 . 123 ALA HA H 4.17 . 1 1204 . 123 ALA HB H 1.43 . 1 1205 . 123 ALA CB C 17.6 . 1 1206 . 123 ALA C C 180.1 . 1 1207 . 124 ALA N N 120.9 . 1 1208 . 124 ALA H H 8.45 . 1 1209 . 124 ALA CA C 54.5 . 1 1210 . 124 ALA HA H 3.99 . 1 1211 . 124 ALA HB H 1.38 . 1 1212 . 124 ALA CB C 17.9 . 1 1213 . 124 ALA C C 178.4 . 1 1214 . 125 LYS N N 116.6 . 1 1215 . 125 LYS H H 8.09 . 1 1216 . 125 LYS CA C 59.1 . 1 1217 . 125 LYS HA H 3.93 . 1 1218 . 125 LYS CB C 32.4 . 1 1219 . 125 LYS HB2 H 1.88 . 1 1220 . 125 LYS HB3 H 1.88 . 1 1221 . 125 LYS CG C 25.4 . 1 1222 . 125 LYS HG2 H 1.40 . 2 1223 . 125 LYS HG3 H 1.66 . 2 1224 . 125 LYS CD C 29.6 . 1 1225 . 125 LYS HD2 H 1.66 . 1 1226 . 125 LYS HD3 H 1.66 . 1 1227 . 125 LYS CE C 41.6 . 1 1228 . 125 LYS HE2 H 2.93 . 2 1229 . 125 LYS HE3 H 2.86 . 2 1230 . 125 LYS C C 179.3 . 1 1231 . 126 GLY N N 106.5 . 1 1232 . 126 GLY H H 8.03 . 1 1233 . 126 GLY CA C 46.2 . 1 1234 . 126 GLY HA2 H 3.91 . 2 1235 . 126 GLY HA3 H 3.94 . 2 1236 . 126 GLY C C 175.0 . 1 1237 . 127 ALA N N 123.1 . 1 1238 . 127 ALA H H 7.81 . 1 1239 . 127 ALA CA C 53.2 . 1 1240 . 127 ALA HA H 4.26 . 1 1241 . 127 ALA HB H 1.45 . 1 1242 . 127 ALA CB C 18.7 . 1 1243 . 127 ALA C C 177.9 . 1 1244 . 128 ALA N N 120.2 . 1 1245 . 128 ALA H H 7.76 . 1 1246 . 128 ALA CA C 52.4 . 1 1247 . 128 ALA HA H 4.22 . 1 1248 . 128 ALA HB H 1.39 . 1 1249 . 128 ALA CB C 19.2 . 1 1250 . 128 ALA C C 177.2 . 1 1251 . 129 ALA N N 121.4 . 1 1252 . 129 ALA H H 7.72 . 1 1253 . 129 ALA CA C 52.5 . 1 1254 . 129 ALA HA H 4.24 . 1 1255 . 129 ALA HB H 1.36 . 1 1256 . 129 ALA CB C 19.2 . 1 1257 . 129 ALA C C 177.2 . 1 1258 . 130 HIS N N 118.0 . 1 1259 . 130 HIS H H 8.18 . 1 1260 . 130 HIS CA C 53.5 . 1 1261 . 130 HIS HA H 4.96 . 1 1262 . 130 HIS CB C 29.3 . 1 1263 . 130 HIS HB2 H 3.13 . 2 1264 . 130 HIS HB3 H 3.22 . 2 1265 . 130 HIS C C 172.8 . 1 1266 . 131 PRO CD C 50.4 . 1 1267 . 131 PRO CA C 63.4 . 1 1268 . 131 PRO HA H 4.49 . 1 1269 . 131 PRO CB C 32.0 . 1 1270 . 131 PRO HB2 H 1.98 . 2 1271 . 131 PRO HB3 H 2.31 . 2 1272 . 131 PRO CG C 27.3 . 1 1273 . 131 PRO HG2 H 1.99 . 1 1274 . 131 PRO HG3 H 1.99 . 1 1275 . 131 PRO HD2 H 3.54 . 2 1276 . 131 PRO HD3 H 3.68 . 2 1277 . 131 PRO C C 176.9 . 1 1278 . 132 ASP N N 120.6 . 1 1279 . 132 ASP H H 8.62 . 1 1280 . 132 ASP CA C 54.6 . 1 1281 . 132 ASP HA H 4.64 . 1 1282 . 132 ASP CB C 41.0 . 1 1283 . 132 ASP HB2 H 2.67 . 2 1284 . 132 ASP HB3 H 2.76 . 2 1285 . 132 ASP C C 176.5 . 1 1286 . 133 SER N N 115.3 . 1 1287 . 133 SER H H 8.18 . 1 1288 . 133 SER CA C 58.5 . 1 1289 . 133 SER HA H 4.44 . 1 1290 . 133 SER CB C 63.8 . 1 1291 . 133 SER HB2 H 3.87 . 2 1292 . 133 SER HB3 H 3.96 . 2 1293 . 133 SER C C 174.8 . 1 1294 . 134 GLU N N 122.7 . 1 1295 . 134 GLU H H 8.44 . 1 1296 . 134 GLU CA C 56.9 . 1 1297 . 134 GLU HA H 4.30 . 1 1298 . 134 GLU CB C 30.1 . 1 1299 . 134 GLU HB2 H 1.97 . 2 1300 . 134 GLU HB3 H 2.10 . 2 1301 . 134 GLU HG2 H 2.28 . 1 1302 . 134 GLU HG3 H 2.28 . 1 1303 . 134 GLU C C 176.8 . 1 1304 . 135 GLU N N 121.4 . 1 1305 . 135 GLU H H 8.36 . 1 1306 . 135 GLU CA C 55.7 . 1 1307 . 135 GLU HA H 4.25 . 1 1308 . 135 GLU CB C 30.1 . 1 1309 . 135 GLU HB2 H 1.98 . 2 1310 . 135 GLU HB3 H 2.06 . 2 1311 . 135 GLU CG C 36.4 . 1 1312 . 135 GLU HG2 H 2.26 . 2 1313 . 135 GLU HG3 H 2.30 . 2 1314 . 135 GLU C C 175.8 . 1 1315 . 136 GLN N N 120.9 . 1 1316 . 136 GLN H H 8.33 . 1 1317 . 136 GLN CA C 55.9 . 1 1318 . 136 GLN HA H 4.31 . 1 1319 . 136 GLN CB C 29.2 . 1 1320 . 136 GLN HB2 H 2.00 . 2 1321 . 136 GLN HB3 H 2.13 . 2 1322 . 136 GLN C C 176.7 . 1 1323 . 137 GLN N N 121.2 . 1 1324 . 137 GLN H H 8.32 . 1 1325 . 137 GLN CA C 55.9 . 1 1326 . 137 GLN HA H 4.32 . 1 1327 . 137 GLN CB C 29.4 . 1 1328 . 137 GLN HB2 H 1.99 . 2 1329 . 137 GLN HB3 H 2.12 . 2 1330 . 137 GLN C C 175.9 . 1 1331 . 138 GLN N N 122.1 . 1 1332 . 138 GLN H H 8.41 . 1 1333 . 138 GLN CA C 55.9 . 1 1334 . 138 GLN HA H 4.34 . 1 1335 . 138 GLN CB C 29.3 . 1 1336 . 138 GLN HB2 H 2.00 . 2 1337 . 138 GLN HB3 H 2.13 . 2 1338 . 138 GLN HG2 H 2.38 . 1 1339 . 138 GLN HG3 H 2.38 . 1 1340 . 138 GLN C C 175.0 . 1 1341 . 139 ARG N N 128.2 . 1 1342 . 139 ARG H H 8.02 . 1 1343 . 139 ARG CA C 57.3 . 1 1344 . 139 ARG CB C 31.4 . 1 1345 . 139 ARG C C 180.9 . 1 stop_ save_