data_4334 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C, 15N Resonance Assignments of ARID Domain of Dead-Ringer Protein. ; _BMRB_accession_number 4334 _BMRB_flat_file_name bmr4334.str _Entry_type original _Submission_date 1999-04-21 _Accession_date 1999-04-21 _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 Iwahara Junji . . 2 Clubb Robert T. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 coupling_constants 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 873 "13C chemical shifts" 567 "15N chemical shifts" 148 "coupling constants" 90 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 1999-06-07 original author . stop_ _Original_release_date 1999-06-07 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full ; Iwahara, J. and Clubb, R., "1H, 13C, 15N Resonance Assignments of ARID Domain of Dead-Ringer Protein," (1999). ; _Citation_title '1H, 13C, 15N Resonance Assignments of ARID Domain of Dead-Ringer Protein.' _Citation_status published _Citation_type 'BMRB only' _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Iwahara Junji . . 2 Clubb Robert T. . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year 1999 _Details . loop_ _Keyword ARID 'dead-ringer protein' 'DNA-binding domain' NMR stop_ save_ ################################## # Molecular system description # ################################## save_DRI_ARID _Saveframe_category molecular_system _Mol_system_name 'ARID domain of dead-ringer protein' _Abbreviation_common 'Dri ARID' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'dead-ringer ARID domain' $driARID stop_ _System_molecular_weight 16150 _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_driARID _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'ARID domain of dead-ringer protein' _Abbreviation_common 'Dri ARID' _Molecular_mass 16150 _Mol_thiol_state . _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 139 _Mol_residue_sequence ; GSGWSFEEQFKQVRQLYEIN DDPKRKEFLDDLFSFMQKRG TPINRLPIMAKSVLDLYELY NLVIARGGLVDVINKKLWQE IIKGLHLPSSITSAAFTLRT QYMKYLYPYECEKKNLSTPA ELQAAIDGNRREGRRSSYG ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 GLY 4 TRP 5 SER 6 PHE 7 GLU 8 GLU 9 GLN 10 PHE 11 LYS 12 GLN 13 VAL 14 ARG 15 GLN 16 LEU 17 TYR 18 GLU 19 ILE 20 ASN 21 ASP 22 ASP 23 PRO 24 LYS 25 ARG 26 LYS 27 GLU 28 PHE 29 LEU 30 ASP 31 ASP 32 LEU 33 PHE 34 SER 35 PHE 36 MET 37 GLN 38 LYS 39 ARG 40 GLY 41 THR 42 PRO 43 ILE 44 ASN 45 ARG 46 LEU 47 PRO 48 ILE 49 MET 50 ALA 51 LYS 52 SER 53 VAL 54 LEU 55 ASP 56 LEU 57 TYR 58 GLU 59 LEU 60 TYR 61 ASN 62 LEU 63 VAL 64 ILE 65 ALA 66 ARG 67 GLY 68 GLY 69 LEU 70 VAL 71 ASP 72 VAL 73 ILE 74 ASN 75 LYS 76 LYS 77 LEU 78 TRP 79 GLN 80 GLU 81 ILE 82 ILE 83 LYS 84 GLY 85 LEU 86 HIS 87 LEU 88 PRO 89 SER 90 SER 91 ILE 92 THR 93 SER 94 ALA 95 ALA 96 PHE 97 THR 98 LEU 99 ARG 100 THR 101 GLN 102 TYR 103 MET 104 LYS 105 TYR 106 LEU 107 TYR 108 PRO 109 TYR 110 GLU 111 CYS 112 GLU 113 LYS 114 LYS 115 ASN 116 LEU 117 SER 118 THR 119 PRO 120 ALA 121 GLU 122 LEU 123 GLN 124 ALA 125 ALA 126 ILE 127 ASP 128 GLY 129 ASN 130 ARG 131 ARG 132 GLU 133 GLY 134 ARG 135 ARG 136 SER 137 SER 138 TYR 139 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-14 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 1C20 "Solution Structure Of The Dna-Binding Domain From The Dead Ringer Protein" 91.37 128 100.00 100.00 6.71e-88 PDB 1KQQ "Solution Structure Of The Dead Ringer Arid-Dna Complex" 100.00 139 99.28 99.28 1.67e-96 GB AAB05771 "dead ringer [Drosophila melanogaster]" 99.28 901 99.28 100.00 2.00e-90 GB AAF47037 "retained, isoform A [Drosophila melanogaster]" 99.28 906 99.28 100.00 2.44e-90 GB AAM50815 "LD35748p [Drosophila melanogaster]" 99.28 911 99.28 100.00 2.39e-90 GB AAO41347 "retained, isoform B [Drosophila melanogaster]" 99.28 911 99.28 100.00 2.39e-90 GB AHN56568 "retained, isoform C [Drosophila melanogaster]" 99.28 904 99.28 100.00 2.09e-90 REF NP_001286773 "retained, isoform C [Drosophila melanogaster]" 99.28 904 99.28 100.00 2.09e-90 REF NP_001286774 "retained, isoform D [Drosophila melanogaster]" 92.09 635 97.66 100.00 5.36e-81 REF NP_001286775 "retained, isoform E [Drosophila melanogaster]" 89.21 654 100.00 100.00 2.72e-79 REF NP_476864 "retained, isoform A [Drosophila melanogaster]" 99.28 906 99.28 100.00 2.44e-90 REF NP_788434 "retained, isoform B [Drosophila melanogaster]" 99.28 911 99.28 100.00 2.39e-90 SP Q24573 "RecName: Full=Protein dead ringer; AltName: Full=Protein retained" 99.28 911 99.28 100.00 2.39e-90 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $driARID 'fruit fly' 7227 Eucaryota Metazoa Drosophila melanogaster dri stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name _Details $driARID 'recombinant technology' 'E. coli' . . BL21 plasmid pGEX-4T-1 ; DNA fragments which code residue 262-398 of the dead ringer protein were amplified by the PCR method. The fragment was inserted into the pGEX-4T-1 vector. E.coli strain BL21 which was transformed by a resultant plasmid expressed GST-ARID fusion protein. Purified GST-ARID was cleaved with Thrombin protease. ; stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $driARID 1.5 mM [U-15N] Tris-HCl 20.0 mM [U-2H] NaCl 100.0 mM . DTT 2.0 mM [U-2H] NaN3 0.01 % . ZnCl2 1.5 mM . H2O 92 % . D2O 8 % . stop_ save_ save_sample2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $driARID 1.5 mM '[U-13C; U-15N]' Tris-HCl 20.0 mM [U-2H] NaCl 100.0 mM . DTT 2.0 mM [U-2H] NaN3 0.01 % . ZnCl2 1.5 mM . H2O 92 % . D2O 8 % . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_list _Saveframe_category NMR_spectrometer _Manufacturer unknown _Model unknown _Field_strength 0 _Details 'spectrometer information not available' save_ ############################# # NMR applied experiments # ############################# save__1 _Saveframe_category NMR_applied_experiment _Sample_label . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details ; Reference for pH and temperature for all conditions is ref_1 listed below in section: References cited for this entry. ; loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.7 . na temperature 303 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_csReference1 _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 C 13 'methyl carbons' ppm 0.0 external indirect . . . . $entry_citation $entry_citation DSS H 1 'methyl protons' ppm 0.0 external direct . . . 1.000000000 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 external indirect . . . 0.101329118 $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 $sample1 $sample2 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $csReference1 _Mol_system_component_name 'dead-ringer ARID domain' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 2 SER CA C 58.40 . 1 2 . 2 SER HA H 4.50 . 1 3 . 2 SER CB C 64.06 . 1 4 . 2 SER HB2 H 3.87 . 1 5 . 2 SER HB3 H 3.87 . 1 6 . 2 SER C C 174.88 . 1 7 . 3 GLY N N 111.23 . 1 8 . 3 GLY H H 8.47 . 1 9 . 3 GLY CA C 45.33 . 1 10 . 3 GLY HA2 H 3.93 . 2 11 . 3 GLY HA3 H 3.96 . 2 12 . 3 GLY C C 173.66 . 1 13 . 4 TRP N N 121.89 . 1 14 . 4 TRP H H 8.10 . 1 15 . 4 TRP CA C 57.48 . 1 16 . 4 TRP HA H 4.62 . 1 17 . 4 TRP CB C 30.13 . 1 18 . 4 TRP HB2 H 3.14 . 1 19 . 4 TRP HB3 H 3.14 . 1 20 . 4 TRP CD1 C 127.23 . 1 21 . 4 TRP HD1 H 7.13 . 1 22 . 4 TRP NE1 N 129.21 . 1 23 . 4 TRP HE1 H 10.01 . 1 24 . 4 TRP CZ2 C 114.39 . 1 25 . 4 TRP HZ2 H 7.37 . 1 26 . 4 TRP CZ3 C 127.22 . 1 27 . 4 TRP HZ3 H 7.12 . 1 28 . 4 TRP CH2 C 124.60 . 1 29 . 4 TRP HH2 H 7.11 . 1 30 . 4 TRP C C 175.95 . 1 31 . 5 SER N N 118.84 . 1 32 . 5 SER H H 7.88 . 1 33 . 5 SER CA C 57.64 . 1 34 . 5 SER HA H 4.31 . 1 35 . 5 SER CB C 64.57 . 1 36 . 5 SER HB2 H 3.67 . 1 37 . 5 SER HB3 H 3.87 . 1 38 . 5 SER C C 174.35 . 1 39 . 6 PHE N N 123.12 . 1 40 . 6 PHE H H 8.30 . 1 41 . 6 PHE CA C 60.07 . 1 42 . 6 PHE HA H 4.18 . 1 43 . 6 PHE CB C 38.96 . 1 44 . 6 PHE HB2 H 2.97 . 2 45 . 6 PHE HB3 H 3.04 . 2 46 . 6 PHE HD1 H 7.15 . 1 47 . 6 PHE HD2 H 7.15 . 1 48 . 6 PHE C C 176.71 . 1 49 . 7 GLU N N 119.65 . 1 50 . 7 GLU H H 8.38 . 1 51 . 7 GLU CA C 59.03 . 1 52 . 7 GLU HA H 3.92 . 1 53 . 7 GLU CB C 29.43 . 1 54 . 7 GLU HB2 H 1.92 . 1 55 . 7 GLU HB3 H 1.92 . 1 56 . 7 GLU HG2 H 2.22 . 1 57 . 7 GLU HG3 H 2.22 . 1 58 . 7 GLU C C 178.26 . 1 59 . 8 GLU N N 119.75 . 1 60 . 8 GLU H H 7.80 . 1 61 . 8 GLU CA C 58.48 . 1 62 . 8 GLU HA H 3.95 . 1 63 . 8 GLU CB C 29.62 . 1 64 . 8 GLU HB2 H 1.80 . 1 65 . 8 GLU HB3 H 1.80 . 1 66 . 8 GLU HG2 H 2.18 . 1 67 . 8 GLU HG3 H 2.18 . 1 68 . 8 GLU C C 178.13 . 1 69 . 9 GLN N N 119.42 . 1 70 . 9 GLN H H 7.86 . 1 71 . 9 GLN CA C 58.15 . 1 72 . 9 GLN HA H 4.02 . 1 73 . 9 GLN CB C 28.66 . 1 74 . 9 GLN HB2 H 1.95 . 2 75 . 9 GLN HB3 H 1.99 . 2 76 . 9 GLN HG2 H 2.20 . 1 77 . 9 GLN HG3 H 2.20 . 1 78 . 9 GLN NE2 N 111.57 . 1 79 . 9 GLN HE21 H 7.11 . 2 80 . 9 GLN HE22 H 6.79 . 2 81 . 9 GLN C C 177.51 . 1 82 . 10 PHE N N 119.14 . 1 83 . 10 PHE H H 8.11 . 1 84 . 10 PHE CA C 59.74 . 1 85 . 10 PHE HA H 4.26 . 1 86 . 10 PHE CB C 38.77 . 1 87 . 10 PHE HB2 H 2.81 . 2 88 . 10 PHE HB3 H 2.97 . 2 89 . 10 PHE CD1 C 131.66 . 1 90 . 10 PHE HD1 H 7.07 . 1 91 . 10 PHE CD2 C 131.66 . 1 92 . 10 PHE HD2 H 7.07 . 1 93 . 10 PHE HE1 H 7.15 . 1 94 . 10 PHE HE2 H 7.15 . 1 95 . 10 PHE C C 177.05 . 1 96 . 11 LYS N N 118.77 . 1 97 . 11 LYS H H 7.77 . 1 98 . 11 LYS CA C 59.40 . 1 99 . 11 LYS HA H 3.88 . 1 100 . 11 LYS CB C 32.56 . 1 101 . 11 LYS HB2 H 1.68 . 2 102 . 11 LYS HB3 H 1.87 . 2 103 . 11 LYS HG2 H 1.53 . 2 104 . 11 LYS HG3 H 1.40 . 2 105 . 11 LYS HD2 H 1.68 . 1 106 . 11 LYS HD3 H 1.68 . 1 107 . 11 LYS HE2 H 2.96 . 1 108 . 11 LYS HE3 H 2.96 . 1 109 . 11 LYS C C 178.71 . 1 110 . 12 GLN N N 117.56 . 1 111 . 12 GLN H H 7.91 . 1 112 . 12 GLN CA C 58.52 . 1 113 . 12 GLN HA H 4.17 . 1 114 . 12 GLN CB C 29.11 . 1 115 . 12 GLN HB2 H 2.06 . 2 116 . 12 GLN HB3 H 2.21 . 2 117 . 12 GLN HG2 H 2.54 . 2 118 . 12 GLN HG3 H 2.36 . 2 119 . 12 GLN NE2 N 110.79 . 1 120 . 12 GLN HE21 H 6.66 . 2 121 . 12 GLN HE22 H 7.44 . 2 122 . 12 GLN C C 177.65 . 1 123 . 13 VAL N N 116.11 . 1 124 . 13 VAL H H 7.71 . 1 125 . 13 VAL CA C 64.94 . 1 126 . 13 VAL HA H 3.91 . 1 127 . 13 VAL CB C 31.86 . 1 128 . 13 VAL HB H 2.12 . 1 129 . 13 VAL CG1 C 21.52 . 2 130 . 13 VAL HG1 H 0.72 . 2 131 . 13 VAL CG2 C 21.63 . 2 132 . 13 VAL HG2 H 0.88 . 2 133 . 13 VAL C C 177.55 . 1 134 . 14 ARG N N 119.73 . 1 135 . 14 ARG H H 7.71 . 1 136 . 14 ARG CA C 59.20 . 1 137 . 14 ARG HA H 3.85 . 1 138 . 14 ARG CB C 29.11 . 1 139 . 14 ARG HB2 H 1.69 . 2 140 . 14 ARG HB3 H 1.65 . 2 141 . 14 ARG HG2 H 2.03 . 2 142 . 14 ARG HG3 H 1.37 . 2 143 . 14 ARG HD2 H 2.98 . 1 144 . 14 ARG HD3 H 2.98 . 1 145 . 14 ARG C C 178.09 . 1 146 . 15 GLN N N 116.87 . 1 147 . 15 GLN H H 8.13 . 1 148 . 15 GLN CA C 59.36 . 1 149 . 15 GLN HA H 4.00 . 1 150 . 15 GLN CB C 28.72 . 1 151 . 15 GLN HB2 H 2.19 . 1 152 . 15 GLN HB3 H 2.08 . 1 153 . 15 GLN CG C 34.76 . 1 154 . 15 GLN HG2 H 2.40 . 2 155 . 15 GLN HG3 H 2.54 . 2 156 . 15 GLN NE2 N 111.18 . 1 157 . 15 GLN HE21 H 6.79 . 2 158 . 15 GLN HE22 H 7.42 . 2 159 . 15 GLN C C 178.89 . 1 160 . 16 LEU N N 118.26 . 1 161 . 16 LEU H H 7.76 . 1 162 . 16 LEU CA C 57.64 . 1 163 . 16 LEU HA H 4.12 . 1 164 . 16 LEU CB C 42.29 . 1 165 . 16 LEU HB2 H 1.97 . 1 166 . 16 LEU HB3 H 1.78 . 1 167 . 16 LEU HG H 1.77 . 1 168 . 16 LEU CD1 C 25.33 . 2 169 . 16 LEU HD1 H 1.21 . 2 170 . 16 LEU CD2 C 26.72 . 2 171 . 16 LEU HD2 H 1.12 . 2 172 . 16 LEU C C 178.60 . 1 173 . 17 TYR N N 117.39 . 1 174 . 17 TYR H H 7.80 . 1 175 . 17 TYR CA C 61.96 . 1 176 . 17 TYR HA H 3.90 . 1 177 . 17 TYR CB C 39.28 . 1 178 . 17 TYR HB2 H 3.04 . 2 179 . 17 TYR HB3 H 3.12 . 2 180 . 17 TYR CD1 C 133.20 . 1 181 . 17 TYR HD1 H 7.30 . 1 182 . 17 TYR CD2 C 133.20 . 1 183 . 17 TYR HD2 H 7.30 . 1 184 . 17 TYR CE1 C 118.48 . 1 185 . 17 TYR HE1 H 6.72 . 1 186 . 17 TYR CE2 C 118.48 . 1 187 . 17 TYR HE2 H 6.72 . 1 188 . 17 TYR C C 177.26 . 1 189 . 18 GLU N N 114.09 . 1 190 . 18 GLU H H 7.61 . 1 191 . 18 GLU CA C 56.26 . 1 192 . 18 GLU HA H 4.35 . 1 193 . 18 GLU CB C 29.87 . 1 194 . 18 GLU HB2 H 2.20 . 1 195 . 18 GLU HB3 H 1.85 . 1 196 . 18 GLU HG2 H 2.45 . 2 197 . 18 GLU HG3 H 2.25 . 2 198 . 18 GLU C C 177.22 . 1 199 . 19 ILE N N 120.74 . 1 200 . 19 ILE H H 6.97 . 1 201 . 19 ILE CA C 65.81 . 1 202 . 19 ILE HA H 3.60 . 1 203 . 19 ILE CB C 39.16 . 1 204 . 19 ILE HB H 1.35 . 1 205 . 19 ILE CG1 C 29.46 . 1 206 . 19 ILE HG12 H 1.20 . 2 207 . 19 ILE HG13 H 2.15 . 2 208 . 19 ILE CG2 C 17.05 . 1 209 . 19 ILE HG2 H 0.96 . 1 210 . 19 ILE CD1 C 13.46 . 1 211 . 19 ILE HD1 H 0.95 . 1 212 . 19 ILE C C 176.72 . 1 213 . 20 ASN N N 109.25 . 1 214 . 20 ASN H H 7.22 . 1 215 . 20 ASN CA C 52.41 . 1 216 . 20 ASN HA H 4.47 . 1 217 . 20 ASN CB C 39.22 . 1 218 . 20 ASN HB2 H 3.22 . 1 219 . 20 ASN HB3 H 3.22 . 1 220 . 20 ASN ND2 N 114.83 . 1 221 . 20 ASN HD21 H 7.74 . 2 222 . 20 ASN HD22 H 7.82 . 2 223 . 20 ASN C C 174.06 . 1 224 . 21 ASP N N 116.19 . 1 225 . 21 ASP H H 8.07 . 1 226 . 21 ASP CA C 52.99 . 1 227 . 21 ASP HA H 4.80 . 1 228 . 21 ASP CB C 40.18 . 1 229 . 21 ASP HB2 H 2.71 . 2 230 . 21 ASP HB3 H 2.81 . 2 231 . 21 ASP C C 176.27 . 1 232 . 22 ASP N N 122.23 . 1 233 . 22 ASP H H 7.39 . 1 234 . 22 ASP CA C 52.16 . 1 235 . 22 ASP HA H 4.67 . 1 236 . 22 ASP HB2 H 2.83 . 1 237 . 22 ASP HB3 H 2.83 . 1 238 . 23 PRO CA C 65.14 . 1 239 . 23 PRO HA H 4.39 . 1 240 . 23 PRO CB C 32.31 . 1 241 . 23 PRO HB2 H 2.04 . 2 242 . 23 PRO HB3 H 2.46 . 2 243 . 23 PRO HG2 H 2.13 . 1 244 . 23 PRO HG3 H 2.13 . 1 245 . 23 PRO CD C 51.40 . 1 246 . 23 PRO HD3 H 4.07 . 2 247 . 23 PRO HD2 H 4.12 . 2 248 . 23 PRO C C 179.19 . 1 249 . 24 LYS N N 117.36 . 1 250 . 24 LYS H H 8.45 . 1 251 . 24 LYS CA C 58.23 . 1 252 . 24 LYS HA H 4.12 . 1 253 . 24 LYS CB C 31.99 . 1 254 . 24 LYS HB2 H 2.04 . 1 255 . 24 LYS HB3 H 2.04 . 1 256 . 24 LYS CG C 28.66 . 1 257 . 24 LYS HG2 H 1.62 . 2 258 . 24 LYS HG3 H 1.51 . 2 259 . 24 LYS HD2 H 1.78 . 1 260 . 24 LYS HD3 H 1.78 . 1 261 . 24 LYS CE C 41.93 . 1 262 . 24 LYS HE2 H 3.08 . 1 263 . 24 LYS HE3 H 3.08 . 1 264 . 24 LYS C C 178.96 . 1 265 . 25 ARG N N 121.19 . 1 266 . 25 ARG H H 7.24 . 1 267 . 25 ARG CA C 58.86 . 1 268 . 25 ARG HA H 2.47 . 1 269 . 25 ARG CB C 30.58 . 1 270 . 25 ARG HB2 H 1.43 . 2 271 . 25 ARG HB3 H 1.91 . 2 272 . 25 ARG HG2 H 1.57 . 2 273 . 25 ARG HG3 H 1.06 . 2 274 . 25 ARG HD2 H 3.01 . 2 275 . 25 ARG HD3 H 3.21 . 2 276 . 25 ARG C C 176.83 . 1 277 . 26 LYS N N 118.49 . 1 278 . 26 LYS H H 6.93 . 1 279 . 26 LYS CA C 59.95 . 1 280 . 26 LYS HA H 3.91 . 1 281 . 26 LYS CB C 32.43 . 1 282 . 26 LYS HB2 H 1.94 . 2 283 . 26 LYS HB3 H 2.11 . 2 284 . 26 LYS HG2 H 1.59 . 2 285 . 26 LYS HG3 H 1.76 . 2 286 . 26 LYS HD2 H 1.67 . 1 287 . 26 LYS HD3 H 1.67 . 1 288 . 26 LYS CE C 42.52 . 1 289 . 26 LYS HE2 H 3.02 . 1 290 . 26 LYS HE3 H 3.02 . 1 291 . 26 LYS C C 177.37 . 1 292 . 27 GLU N N 115.88 . 1 293 . 27 GLU H H 7.37 . 1 294 . 27 GLU CA C 59.15 . 1 295 . 27 GLU HA H 4.06 . 1 296 . 27 GLU CB C 29.94 . 1 297 . 27 GLU HB2 H 1.99 . 2 298 . 27 GLU HB3 H 2.05 . 2 299 . 27 GLU CG C 36.07 . 1 300 . 27 GLU HG2 H 2.37 . 2 301 . 27 GLU HG3 H 2.42 . 2 302 . 27 GLU C C 179.24 . 1 303 . 28 PHE N N 119.45 . 1 304 . 28 PHE H H 7.82 . 1 305 . 28 PHE CA C 61.08 . 1 306 . 28 PHE HA H 4.22 . 1 307 . 28 PHE CB C 39.67 . 1 308 . 28 PHE HB2 H 2.86 . 2 309 . 28 PHE HB3 H 3.42 . 2 310 . 28 PHE CD1 C 131.46 . 1 311 . 28 PHE HD1 H 7.04 . 1 312 . 28 PHE CD2 C 131.46 . 1 313 . 28 PHE HD2 H 7.04 . 1 314 . 28 PHE CE1 C 131.34 . 1 315 . 28 PHE HE1 H 6.35 . 1 316 . 28 PHE CE2 C 131.34 . 1 317 . 28 PHE HE2 H 6.35 . 1 318 . 28 PHE CZ C 129.10 . 1 319 . 28 PHE HZ H 6.27 . 1 320 . 28 PHE C C 175.74 . 1 321 . 29 LEU N N 119.65 . 1 322 . 29 LEU H H 8.28 . 1 323 . 29 LEU CA C 57.69 . 1 324 . 29 LEU HA H 3.29 . 1 325 . 29 LEU CB C 41.08 . 1 326 . 29 LEU HB2 H 0.88 . 1 327 . 29 LEU HB3 H 1.44 . 1 328 . 29 LEU CG C 26.73 . 1 329 . 29 LEU HG H 1.84 . 1 330 . 29 LEU CD1 C 26.49 . 1 331 . 29 LEU HD1 H 0.10 . 1 332 . 29 LEU CD2 C 22.42 . 1 333 . 29 LEU HD2 H 0.73 . 1 334 . 29 LEU C C 178.32 . 1 335 . 30 ASP N N 117.74 . 1 336 . 30 ASP H H 8.67 . 1 337 . 30 ASP CA C 57.64 . 1 338 . 30 ASP HA H 4.35 . 1 339 . 30 ASP CB C 39.73 . 1 340 . 30 ASP HB2 H 2.67 . 2 341 . 30 ASP HB3 H 2.78 . 2 342 . 30 ASP C C 179.41 . 1 343 . 31 ASP N N 121.23 . 1 344 . 31 ASP H H 7.47 . 1 345 . 31 ASP CA C 57.60 . 1 346 . 31 ASP HA H 4.48 . 1 347 . 31 ASP CB C 42.03 . 1 348 . 31 ASP HB2 H 2.83 . 1 349 . 31 ASP HB3 H 2.83 . 1 350 . 31 ASP C C 177.68 . 1 351 . 32 LEU N N 121.70 . 1 352 . 32 LEU H H 8.69 . 1 353 . 32 LEU CA C 58.36 . 1 354 . 32 LEU HA H 3.50 . 1 355 . 32 LEU CB C 41.01 . 1 356 . 32 LEU HB2 H 0.99 . 1 357 . 32 LEU HB3 H -0.18 . 1 358 . 32 LEU CG C 27.18 . 1 359 . 32 LEU HG H 0.88 . 1 360 . 32 LEU CD1 C 22.94 . 1 361 . 32 LEU HD1 H 0.48 . 1 362 . 32 LEU CD2 C 26.10 . 1 363 . 32 LEU HD2 H 0.32 . 1 364 . 32 LEU C C 179.22 . 1 365 . 33 PHE N N 116.68 . 1 366 . 33 PHE H H 8.99 . 1 367 . 33 PHE CA C 61.71 . 1 368 . 33 PHE HA H 4.20 . 1 369 . 33 PHE CB C 37.62 . 1 370 . 33 PHE HB2 H 3.01 . 2 371 . 33 PHE HB3 H 3.07 . 2 372 . 33 PHE CD1 C 132.33 . 1 373 . 33 PHE HD1 H 7.55 . 1 374 . 33 PHE CD2 C 132.33 . 1 375 . 33 PHE HD2 H 7.55 . 1 376 . 33 PHE CE1 C 130.54 . 1 377 . 33 PHE HE1 H 7.14 . 1 378 . 33 PHE CE2 C 130.54 . 1 379 . 33 PHE HE2 H 7.14 . 1 380 . 33 PHE CZ C 128.18 . 1 381 . 33 PHE HZ H 7.03 . 1 382 . 33 PHE C C 180.35 . 1 383 . 34 SER N N 115.56 . 1 384 . 34 SER H H 7.79 . 1 385 . 34 SER CA C 61.92 . 1 386 . 34 SER HA H 4.30 . 1 387 . 34 SER CB C 62.97 . 1 388 . 34 SER HB2 H 4.07 . 2 389 . 34 SER HB3 H 4.11 . 2 390 . 34 SER C C 176.40 . 1 391 . 35 PHE N N 124.59 . 1 392 . 35 PHE H H 8.79 . 1 393 . 35 PHE CA C 61.46 . 1 394 . 35 PHE HA H 4.23 . 1 395 . 35 PHE CB C 39.22 . 1 396 . 35 PHE HB2 H 3.38 . 2 397 . 35 PHE HB3 H 3.55 . 2 398 . 35 PHE CD1 C 132.30 . 1 399 . 35 PHE HD1 H 7.20 . 1 400 . 35 PHE CD2 C 132.30 . 1 401 . 35 PHE HD2 H 7.20 . 1 402 . 35 PHE HE1 H 7.07 . 1 403 . 35 PHE HE2 H 7.07 . 1 404 . 35 PHE C C 178.03 . 1 405 . 36 MET N N 117.18 . 1 406 . 36 MET H H 8.48 . 1 407 . 36 MET CA C 57.31 . 1 408 . 36 MET HA H 3.90 . 1 409 . 36 MET CB C 31.99 . 1 410 . 36 MET HB2 H 2.14 . 1 411 . 36 MET HB3 H 2.68 . 1 412 . 36 MET CG C 35.03 . 1 413 . 36 MET HG2 H 2.50 . 2 414 . 36 MET HG3 H 3.13 . 2 415 . 36 MET CE C 18.70 . 1 416 . 36 MET HE H 2.42 . 1 417 . 36 MET C C 177.72 . 1 418 . 37 GLN N N 119.93 . 1 419 . 37 GLN H H 7.95 . 1 420 . 37 GLN CA C 59.74 . 1 421 . 37 GLN HA H 3.82 . 1 422 . 37 GLN CB C 28.27 . 1 423 . 37 GLN HB2 H 2.29 . 1 424 . 37 GLN HB3 H 2.29 . 1 425 . 37 GLN HG2 H 2.36 . 2 426 . 37 GLN HG3 H 2.41 . 2 427 . 37 GLN C C 179.94 . 1 428 . 38 LYS N N 121.70 . 1 429 . 38 LYS H H 8.37 . 1 430 . 38 LYS CA C 59.57 . 1 431 . 38 LYS HA H 3.95 . 1 432 . 38 LYS CB C 32.11 . 1 433 . 38 LYS HB2 H 1.87 . 1 434 . 38 LYS HB3 H 1.87 . 1 435 . 38 LYS HG2 H 1.44 . 2 436 . 38 LYS HG3 H 1.58 . 2 437 . 38 LYS HD2 H 1.67 . 1 438 . 38 LYS HD3 H 1.67 . 1 439 . 38 LYS HE2 H 2.97 . 1 440 . 38 LYS HE3 H 2.97 . 1 441 . 38 LYS C C 178.14 . 1 442 . 39 ARG N N 116.08 . 1 443 . 39 ARG H H 7.35 . 1 444 . 39 ARG CA C 55.76 . 1 445 . 39 ARG HA H 4.22 . 1 446 . 39 ARG CB C 30.51 . 1 447 . 39 ARG HB2 H 1.69 . 2 448 . 39 ARG HB3 H 1.41 . 2 449 . 39 ARG HG2 H 1.40 . 2 450 . 39 ARG HG3 H 1.57 . 2 451 . 39 ARG CD C 44.42 . 1 452 . 39 ARG HD2 H 2.19 . 2 453 . 39 ARG HD3 H 3.06 . 2 454 . 39 ARG NE N 84.20 . 1 455 . 39 ARG HE H 7.45 . 1 456 . 39 ARG C C 176.10 . 1 457 . 40 GLY N N 106.91 . 1 458 . 40 GLY H H 7.64 . 1 459 . 40 GLY CA C 44.87 . 1 460 . 40 GLY HA2 H 3.82 . 2 461 . 40 GLY HA3 H 4.26 . 2 462 . 40 GLY C C 174.05 . 1 463 . 41 THR N N 109.84 . 1 464 . 41 THR H H 8.00 . 1 465 . 41 THR CA C 57.06 . 1 466 . 41 THR HA H 4.71 . 1 467 . 41 THR CB C 70.13 . 1 468 . 41 THR HB H 4.35 . 1 469 . 41 THR CG2 C 19.42 . 1 470 . 41 THR HG2 H 0.98 . 1 471 . 42 PRO CA C 62.50 . 1 472 . 42 PRO HA H 4.10 . 1 473 . 42 PRO CB C 32.56 . 1 474 . 42 PRO HB2 H 1.86 . 2 475 . 42 PRO HB3 H 2.04 . 2 476 . 42 PRO HG2 H 1.99 . 2 477 . 42 PRO HG3 H 1.93 . 2 478 . 42 PRO CD C 50.75 . 1 479 . 42 PRO HD3 H 3.55 . 2 480 . 42 PRO HD2 H 3.28 . 2 481 . 42 PRO C C 176.77 . 1 482 . 43 ILE N N 121.16 . 1 483 . 43 ILE H H 8.56 . 1 484 . 43 ILE CA C 61.67 . 1 485 . 43 ILE HA H 4.08 . 1 486 . 43 ILE CB C 36.53 . 1 487 . 43 ILE HB H 1.81 . 1 488 . 43 ILE HG12 H 1.14 . 2 489 . 43 ILE HG13 H 1.67 . 2 490 . 43 ILE CG2 C 17.73 . 1 491 . 43 ILE HG2 H 0.76 . 1 492 . 43 ILE CD1 C 13.22 . 1 493 . 43 ILE HD1 H 0.66 . 1 494 . 43 ILE C C 174.75 . 1 495 . 44 ASN N N 125.15 . 1 496 . 44 ASN H H 8.24 . 1 497 . 44 ASN CA C 53.04 . 1 498 . 44 ASN HA H 4.77 . 1 499 . 44 ASN CB C 39.80 . 1 500 . 44 ASN HB2 H 2.67 . 2 501 . 44 ASN HB3 H 2.77 . 2 502 . 44 ASN CG C 176.56 . 1 503 . 44 ASN ND2 N 111.85 . 1 504 . 44 ASN HD21 H 7.45 . 2 505 . 44 ASN HD22 H 6.77 . 2 506 . 44 ASN C C 174.21 . 1 507 . 45 ARG N N 118.44 . 1 508 . 45 ARG H H 7.65 . 1 509 . 45 ARG CA C 55.13 . 1 510 . 45 ARG HA H 4.45 . 1 511 . 45 ARG CB C 32.24 . 1 512 . 45 ARG HB2 H 1.64 . 2 513 . 45 ARG HB3 H 1.72 . 2 514 . 45 ARG HG2 H 1.45 . 1 515 . 45 ARG HG3 H 1.45 . 1 516 . 45 ARG HD2 H 2.97 . 2 517 . 45 ARG HD3 H 3.06 . 2 518 . 45 ARG C C 175.10 . 1 519 . 46 LEU N N 125.38 . 1 520 . 46 LEU H H 8.71 . 1 521 . 46 LEU CA C 52.45 . 1 522 . 46 LEU HA H 4.41 . 1 523 . 46 LEU CB C 42.24 . 1 524 . 46 LEU HB2 H 1.55 . 2 525 . 46 LEU HB3 H 1.50 . 2 526 . 46 LEU HG H 1.67 . 1 527 . 46 LEU CD1 C 24.40 . 2 528 . 46 LEU HD1 H 0.86 . 2 529 . 46 LEU CD2 C 26.69 . 2 530 . 46 LEU HD2 H 0.97 . 2 531 . 46 LEU C C 174.61 . 1 532 . 47 PRO CA C 62.13 . 1 533 . 47 PRO HA H 4.51 . 1 534 . 47 PRO CB C 31.92 . 1 535 . 47 PRO HB2 H 1.74 . 2 536 . 47 PRO HB3 H 2.11 . 2 537 . 47 PRO HG2 H 1.56 . 2 538 . 47 PRO HG3 H 1.97 . 2 539 . 47 PRO CD C 49.67 . 1 540 . 47 PRO HD3 H 3.30 . 2 541 . 47 PRO HD2 H 3.45 . 2 542 . 47 PRO C C 175.27 . 1 543 . 48 ILE N N 121.85 . 1 544 . 48 ILE H H 8.09 . 1 545 . 48 ILE CA C 58.90 . 1 546 . 48 ILE HA H 4.45 . 1 547 . 48 ILE CB C 40.05 . 1 548 . 48 ILE HB H 1.65 . 1 549 . 48 ILE CG1 C 26.61 . 1 550 . 48 ILE HG12 H 1.13 . 2 551 . 48 ILE HG13 H 1.34 . 2 552 . 48 ILE CG2 C 17.24 . 1 553 . 48 ILE HG2 H 0.63 . 1 554 . 48 ILE CD1 C 12.02 . 1 555 . 48 ILE HD1 H 0.64 . 1 556 . 48 ILE C C 176.10 . 1 557 . 49 MET N N 125.06 . 1 558 . 49 MET H H 8.74 . 1 559 . 49 MET CA C 55.05 . 1 560 . 49 MET HA H 4.58 . 1 561 . 49 MET CB C 35.57 . 1 562 . 49 MET HB2 H 1.82 . 2 563 . 49 MET HB3 H 1.92 . 2 564 . 49 MET HG2 H 2.38 . 2 565 . 49 MET HG3 H 2.44 . 2 566 . 49 MET CE C 17.84 . 1 567 . 49 MET HE H 2.02 . 1 568 . 49 MET C C 174.75 . 1 569 . 50 ALA N N 128.93 . 1 570 . 50 ALA H H 9.27 . 1 571 . 50 ALA CA C 53.79 . 1 572 . 50 ALA HA H 3.98 . 1 573 . 50 ALA CB C 16.88 . 1 574 . 50 ALA HB H 1.41 . 1 575 . 50 ALA C C 176.31 . 1 576 . 51 LYS N N 112.64 . 1 577 . 51 LYS H H 8.39 . 1 578 . 51 LYS CA C 57.73 . 1 579 . 51 LYS HA H 3.85 . 1 580 . 51 LYS CB C 31.28 . 1 581 . 51 LYS HB2 H 2.02 . 1 582 . 51 LYS HB3 H 2.02 . 1 583 . 51 LYS HG2 H 1.35 . 2 584 . 51 LYS HG3 H 1.67 . 2 585 . 51 LYS HD2 H 1.89 . 1 586 . 51 LYS HD3 H 1.89 . 1 587 . 51 LYS HE2 H 2.99 . 1 588 . 51 LYS HE3 H 2.99 . 1 589 . 51 LYS C C 175.65 . 1 590 . 52 SER N N 115.32 . 1 591 . 52 SER H H 7.75 . 1 592 . 52 SER CA C 57.10 . 1 593 . 52 SER HA H 4.84 . 1 594 . 52 SER CB C 65.91 . 1 595 . 52 SER HB2 H 3.84 . 2 596 . 52 SER HB3 H 3.78 . 2 597 . 52 SER C C 173.07 . 1 598 . 53 VAL N N 121.43 . 1 599 . 53 VAL H H 8.41 . 1 600 . 53 VAL CA C 62.76 . 1 601 . 53 VAL HA H 4.08 . 1 602 . 53 VAL CB C 32.43 . 1 603 . 53 VAL HB H 2.04 . 1 604 . 53 VAL CG1 C 21.51 . 1 605 . 53 VAL HG1 H 0.89 . 2 606 . 53 VAL CG2 C 21.57 . 2 607 . 53 VAL HG2 H 0.94 . 2 608 . 53 VAL C C 175.77 . 1 609 . 54 LEU N N 128.20 . 1 610 . 54 LEU H H 8.07 . 1 611 . 54 LEU CA C 54.38 . 1 612 . 54 LEU HA H 4.16 . 1 613 . 54 LEU CB C 42.87 . 1 614 . 54 LEU HB2 H 0.99 . 2 615 . 54 LEU HB3 H 1.60 . 2 616 . 54 LEU HG H 1.22 . 1 617 . 54 LEU CD1 C 22.68 . 1 618 . 54 LEU HD1 H 0.88 . 1 619 . 54 LEU CD2 C 25.59 . 1 620 . 54 LEU HD2 H 0.71 . 1 621 . 54 LEU C C 175.81 . 1 622 . 55 ASP N N 125.25 . 1 623 . 55 ASP H H 9.22 . 1 624 . 55 ASP CA C 52.87 . 1 625 . 55 ASP HA H 4.42 . 1 626 . 55 ASP CB C 38.84 . 1 627 . 55 ASP HB2 H 2.57 . 2 628 . 55 ASP HB3 H 3.09 . 2 629 . 55 ASP CG C 181.31 . 1 630 . 55 ASP C C 176.40 . 1 631 . 56 LEU N N 123.34 . 1 632 . 56 LEU H H 7.50 . 1 633 . 56 LEU CA C 57.44 . 1 634 . 56 LEU HA H 3.86 . 1 635 . 56 LEU CB C 43.25 . 1 636 . 56 LEU HB2 H 1.55 . 1 637 . 56 LEU HB3 H 1.55 . 1 638 . 56 LEU HG H 1.78 . 1 639 . 56 LEU CD1 C 25.58 . 2 640 . 56 LEU HD1 H 0.68 . 2 641 . 56 LEU CD2 C 21.35 . 2 642 . 56 LEU HD2 H 0.64 . 2 643 . 56 LEU C C 177.44 . 1 644 . 57 TYR N N 114.10 . 1 645 . 57 TYR H H 7.41 . 1 646 . 57 TYR CA C 59.66 . 1 647 . 57 TYR HA H 3.94 . 1 648 . 57 TYR CB C 38.13 . 1 649 . 57 TYR HB2 H 3.02 . 1 650 . 57 TYR HB3 H 2.84 . 1 651 . 57 TYR CD1 C 133.40 . 1 652 . 57 TYR HD1 H 6.70 . 1 653 . 57 TYR CD2 C 133.40 . 1 654 . 57 TYR HD2 H 6.70 . 1 655 . 57 TYR CE1 C 118.22 . 1 656 . 57 TYR HE1 H 6.64 . 1 657 . 57 TYR CE2 C 118.22 . 1 658 . 57 TYR HE2 H 6.64 . 1 659 . 57 TYR C C 175.28 . 1 660 . 58 GLU N N 118.58 . 1 661 . 58 GLU H H 6.82 . 1 662 . 58 GLU CA C 58.02 . 1 663 . 58 GLU HA H 3.86 . 1 664 . 58 GLU CB C 29.30 . 1 665 . 58 GLU HB2 H 1.68 . 2 666 . 58 GLU HB3 H 1.82 . 2 667 . 58 GLU CG C 35.35 . 1 668 . 58 GLU HG2 H 2.23 . 1 669 . 58 GLU HG3 H 2.23 . 1 670 . 58 GLU C C 178.45 . 1 671 . 59 LEU N N 117.74 . 1 672 . 59 LEU H H 8.42 . 1 673 . 59 LEU CA C 58.69 . 1 674 . 59 LEU HA H 3.99 . 1 675 . 59 LEU CB C 41.46 . 1 676 . 59 LEU HB2 H 1.43 . 1 677 . 59 LEU HB3 H 1.43 . 1 678 . 59 LEU CG C 27.53 . 1 679 . 59 LEU HG H 1.84 . 1 680 . 59 LEU CD1 C 23.91 . 1 681 . 59 LEU HD1 H 1.18 . 1 682 . 59 LEU CD2 C 26.62 . 1 683 . 59 LEU HD2 H 1.04 . 1 684 . 59 LEU C C 176.61 . 1 685 . 60 TYR N N 117.64 . 1 686 . 60 TYR H H 7.65 . 1 687 . 60 TYR CA C 62.59 . 1 688 . 60 TYR HA H 4.32 . 1 689 . 60 TYR CB C 38.71 . 1 690 . 60 TYR HB2 H 2.72 . 2 691 . 60 TYR HB3 H 3.21 . 2 692 . 60 TYR CD1 C 135.03 . 1 693 . 60 TYR HD1 H 6.95 . 1 694 . 60 TYR CD2 C 135.03 . 1 695 . 60 TYR HD2 H 6.95 . 1 696 . 60 TYR CE1 C 118.40 . 3 697 . 60 TYR HE1 H 6.96 . 3 698 . 60 TYR CE2 C 120.73 . 3 699 . 60 TYR HE2 H 6.83 . 3 700 . 60 TYR HH H 10.81 . 1 701 . 60 TYR C C 176.57 . 1 702 . 61 ASN N N 116.15 . 1 703 . 61 ASN H H 7.79 . 1 704 . 61 ASN CA C 56.05 . 1 705 . 61 ASN HA H 3.97 . 1 706 . 61 ASN CB C 37.62 . 1 707 . 61 ASN HB2 H 2.41 . 1 708 . 61 ASN HB3 H 2.41 . 1 709 . 61 ASN CG C 174.83 . 1 710 . 61 ASN ND2 N 108.51 . 1 711 . 61 ASN HD21 H 6.56 . 2 712 . 61 ASN HD22 H 4.77 . 2 713 . 61 ASN C C 179.08 . 1 714 . 62 LEU N N 120.17 . 1 715 . 62 LEU H H 8.62 . 1 716 . 62 LEU CA C 57.85 . 1 717 . 62 LEU HA H 3.80 . 1 718 . 62 LEU CB C 43.76 . 1 719 . 62 LEU HB2 H 1.93 . 1 720 . 62 LEU HB3 H 1.18 . 1 721 . 62 LEU HG H 1.92 . 1 722 . 62 LEU CD1 C 27.53 . 1 723 . 62 LEU HD1 H 0.81 . 1 724 . 62 LEU CD2 C 23.36 . 1 725 . 62 LEU HD2 H 0.83 . 1 726 . 62 LEU C C 179.44 . 1 727 . 63 VAL N N 120.09 . 1 728 . 63 VAL H H 7.83 . 1 729 . 63 VAL CA C 66.36 . 1 730 . 63 VAL HA H 3.27 . 1 731 . 63 VAL CB C 30.90 . 1 732 . 63 VAL HB H 2.16 . 1 733 . 63 VAL CG1 C 20.14 . 1 734 . 63 VAL HG1 H 0.18 . 1 735 . 63 VAL CG2 C 23.71 . 1 736 . 63 VAL HG2 H 0.72 . 1 737 . 63 VAL C C 179.80 . 1 738 . 64 ILE N N 120.92 . 1 739 . 64 ILE H H 8.91 . 1 740 . 64 ILE CA C 64.06 . 1 741 . 64 ILE HA H 3.43 . 1 742 . 64 ILE CB C 35.95 . 1 743 . 64 ILE HB H 1.67 . 1 744 . 64 ILE CG1 C 26.01 . 1 745 . 64 ILE HG12 H 0.66 . 2 746 . 64 ILE HG13 H 1.10 . 2 747 . 64 ILE CG2 C 18.58 . 1 748 . 64 ILE HG2 H 0.62 . 1 749 . 64 ILE CD1 C 12.32 . 1 750 . 64 ILE HD1 H 0.51 . 1 751 . 64 ILE C C 180.36 . 1 752 . 65 ALA N N 123.06 . 1 753 . 65 ALA H H 7.67 . 1 754 . 65 ALA CA C 54.46 . 1 755 . 65 ALA HA H 4.06 . 1 756 . 65 ALA CB C 18.42 . 1 757 . 65 ALA HB H 1.36 . 1 758 . 65 ALA C C 178.86 . 1 759 . 66 ARG N N 115.72 . 1 760 . 66 ARG H H 6.77 . 1 761 . 66 ARG CA C 55.26 . 1 762 . 66 ARG HA H 4.14 . 1 763 . 66 ARG CB C 30.19 . 1 764 . 66 ARG HB2 H 2.01 . 1 765 . 66 ARG HB3 H 0.99 . 1 766 . 66 ARG HG2 H 1.52 . 1 767 . 66 ARG HG3 H 1.52 . 1 768 . 66 ARG CD C 43.38 . 1 769 . 66 ARG HD2 H 2.67 . 2 770 . 66 ARG HD3 H 2.90 . 2 771 . 66 ARG NE N 85.66 . 1 772 . 66 ARG HE H 8.51 . 1 773 . 66 ARG C C 174.59 . 1 774 . 67 GLY N N 104.31 . 1 775 . 67 GLY H H 7.42 . 1 776 . 67 GLY CA C 44.87 . 1 777 . 67 GLY HA2 H 3.54 . 2 778 . 67 GLY HA3 H 4.75 . 2 779 . 67 GLY C C 175.42 . 1 780 . 68 GLY N N 109.75 . 1 781 . 68 GLY H H 7.99 . 1 782 . 68 GLY CA C 43.23 . 1 783 . 68 GLY HA2 H 4.34 . 2 784 . 68 GLY HA3 H 3.11 . 2 785 . 68 GLY C C 171.43 . 1 786 . 69 LEU N N 121.24 . 1 787 . 69 LEU H H 8.91 . 1 788 . 69 LEU CA C 59.28 . 1 789 . 69 LEU HA H 3.14 . 1 790 . 69 LEU CB C 41.72 . 1 791 . 69 LEU HB2 H 1.63 . 2 792 . 69 LEU HB3 H 1.65 . 2 793 . 69 LEU HG H 1.32 . 1 794 . 69 LEU CD1 C 22.84 . 1 795 . 69 LEU HD1 H 0.81 . 1 796 . 69 LEU CD2 C 27.46 . 1 797 . 69 LEU HD2 H 0.66 . 1 798 . 69 LEU C C 176.83 . 1 799 . 70 VAL N N 116.83 . 1 800 . 70 VAL H H 8.61 . 1 801 . 70 VAL CA C 68.25 . 1 802 . 70 VAL HA H 3.15 . 1 803 . 70 VAL CB C 30.90 . 1 804 . 70 VAL HB H 1.85 . 1 805 . 70 VAL CG1 C 22.22 . 1 806 . 70 VAL HG1 H 0.82 . 1 807 . 70 VAL CG2 C 25.58 . 1 808 . 70 VAL HG2 H 0.91 . 1 809 . 70 VAL C C 176.93 . 1 810 . 71 ASP N N 121.65 . 1 811 . 71 ASP H H 7.52 . 1 812 . 71 ASP CA C 57.52 . 1 813 . 71 ASP HA H 4.32 . 1 814 . 71 ASP CB C 39.86 . 1 815 . 71 ASP HB2 H 2.38 . 2 816 . 71 ASP HB3 H 2.47 . 2 817 . 71 ASP C C 178.40 . 1 818 . 72 VAL N N 119.80 . 1 819 . 72 VAL H H 7.67 . 1 820 . 72 VAL CA C 67.32 . 1 821 . 72 VAL HA H 2.98 . 1 822 . 72 VAL CB C 30.07 . 1 823 . 72 VAL HB H 1.45 . 1 824 . 72 VAL CG1 C 18.93 . 1 825 . 72 VAL HG1 H -1.09 . 1 826 . 72 VAL CG2 C 25.48 . 1 827 . 72 VAL HG2 H 0.43 . 1 828 . 72 VAL C C 177.66 . 1 829 . 73 ILE N N 117.70 . 1 830 . 73 ILE H H 7.86 . 1 831 . 73 ILE CA C 65.14 . 1 832 . 73 ILE HA H 3.65 . 1 833 . 73 ILE CB C 38.84 . 1 834 . 73 ILE HB H 1.82 . 1 835 . 73 ILE HG12 H 1.30 . 2 836 . 73 ILE HG13 H 1.95 . 2 837 . 73 ILE CG2 C 16.77 . 1 838 . 73 ILE HG2 H 0.86 . 1 839 . 73 ILE CD1 C 15.36 . 1 840 . 73 ILE HD1 H 0.70 . 1 841 . 73 ILE C C 180.29 . 1 842 . 74 ASN N N 119.46 . 1 843 . 74 ASN H H 8.95 . 1 844 . 74 ASN CA C 55.97 . 1 845 . 74 ASN HA H 4.47 . 1 846 . 74 ASN CB C 38.20 . 1 847 . 74 ASN HB2 H 2.71 . 2 848 . 74 ASN HB3 H 2.83 . 2 849 . 74 ASN CG C 174.79 . 1 850 . 74 ASN ND2 N 111.28 . 1 851 . 74 ASN HD21 H 6.63 . 2 852 . 74 ASN HD22 H 7.62 . 2 853 . 74 ASN C C 178.17 . 1 854 . 75 LYS N N 117.36 . 1 855 . 75 LYS H H 8.60 . 1 856 . 75 LYS CA C 56.81 . 1 857 . 75 LYS HA H 4.19 . 1 858 . 75 LYS CB C 32.18 . 1 859 . 75 LYS HB2 H 1.85 . 1 860 . 75 LYS HB3 H 1.64 . 1 861 . 75 LYS HG2 H 1.46 . 1 862 . 75 LYS HG3 H 1.46 . 1 863 . 75 LYS CD C 42.60 . 1 864 . 75 LYS HD2 H 2.86 . 1 865 . 75 LYS HD3 H 2.86 . 1 866 . 75 LYS C C 174.87 . 1 867 . 76 LYS N N 116.92 . 1 868 . 76 LYS H H 7.52 . 1 869 . 76 LYS CA C 57.52 . 1 870 . 76 LYS HA H 3.92 . 1 871 . 76 LYS CB C 28.72 . 1 872 . 76 LYS HB2 H 1.90 . 2 873 . 76 LYS HB3 H 2.21 . 2 874 . 76 LYS HG2 H 1.39 . 2 875 . 76 LYS HG3 H 1.47 . 2 876 . 76 LYS HD2 H 1.73 . 2 877 . 76 LYS HD3 H 1.81 . 2 878 . 76 LYS HE2 H 3.10 . 1 879 . 76 LYS HE3 H 3.10 . 1 880 . 76 LYS C C 177.71 . 1 881 . 77 LEU N N 116.63 . 1 882 . 77 LEU H H 7.96 . 1 883 . 77 LEU CA C 54.17 . 1 884 . 77 LEU HA H 4.71 . 1 885 . 77 LEU CB C 42.68 . 1 886 . 77 LEU HB2 H 1.65 . 1 887 . 77 LEU HB3 H 1.23 . 1 888 . 77 LEU HG H 1.31 . 1 889 . 77 LEU CD1 C 22.49 . 2 890 . 77 LEU HD1 H 0.71 . 2 891 . 77 LEU CD2 C 26.12 . 2 892 . 77 LEU HD2 H 0.76 . 2 893 . 77 LEU C C 178.14 . 1 894 . 78 TRP N N 118.22 . 1 895 . 78 TRP H H 7.65 . 1 896 . 78 TRP CA C 60.79 . 1 897 . 78 TRP HA H 4.17 . 1 898 . 78 TRP CB C 29.23 . 1 899 . 78 TRP HB2 H 3.02 . 1 900 . 78 TRP HB3 H 3.32 . 1 901 . 78 TRP CD1 C 128.28 . 1 902 . 78 TRP HD1 H 7.45 . 1 903 . 78 TRP NE1 N 127.39 . 1 904 . 78 TRP HE1 H 9.36 . 1 905 . 78 TRP CE3 C 120.22 . 1 906 . 78 TRP HE3 H 7.22 . 1 907 . 78 TRP CZ2 C 113.30 . 1 908 . 78 TRP HZ2 H 6.85 . 1 909 . 78 TRP HZ3 H 6.53 . 1 910 . 78 TRP CH2 C 122.48 . 1 911 . 78 TRP HH2 H 6.46 . 1 912 . 78 TRP C C 178.86 . 1 913 . 79 GLN N N 117.53 . 1 914 . 79 GLN H H 9.06 . 1 915 . 79 GLN CA C 59.66 . 1 916 . 79 GLN HA H 4.09 . 1 917 . 79 GLN CB C 27.44 . 1 918 . 79 GLN HB2 H 2.13 . 2 919 . 79 GLN HB3 H 2.19 . 2 920 . 79 GLN CG C 33.88 . 1 921 . 79 GLN HG2 H 2.50 . 1 922 . 79 GLN HG3 H 2.50 . 1 923 . 79 GLN NE2 N 112.41 . 1 924 . 79 GLN HE21 H 6.93 . 2 925 . 79 GLN HE22 H 7.59 . 2 926 . 79 GLN C C 178.79 . 1 927 . 80 GLU N N 117.08 . 1 928 . 80 GLU H H 7.51 . 1 929 . 80 GLU CA C 58.90 . 1 930 . 80 GLU HA H 4.00 . 1 931 . 80 GLU CB C 29.23 . 1 932 . 80 GLU HB2 H 1.93 . 2 933 . 80 GLU HB3 H 1.98 . 2 934 . 80 GLU HG2 H 2.25 . 1 935 . 80 GLU HG3 H 2.25 . 1 936 . 80 GLU C C 179.63 . 1 937 . 81 ILE N N 121.19 . 1 938 . 81 ILE H H 7.22 . 1 939 . 81 ILE CA C 63.38 . 1 940 . 81 ILE HA H 3.58 . 1 941 . 81 ILE CB C 36.59 . 1 942 . 81 ILE HB H 2.35 . 1 943 . 81 ILE CG1 C 28.31 . 1 944 . 81 ILE HG12 H 1.19 . 2 945 . 81 ILE HG13 H 1.26 . 2 946 . 81 ILE CG2 C 18.65 . 1 947 . 81 ILE HG2 H 0.95 . 1 948 . 81 ILE CD1 C 12.90 . 1 949 . 81 ILE HD1 H 0.36 . 1 950 . 81 ILE C C 176.80 . 1 951 . 82 ILE N N 120.90 . 1 952 . 82 ILE H H 8.44 . 1 953 . 82 ILE CA C 66.53 . 1 954 . 82 ILE HA H 3.34 . 1 955 . 82 ILE CB C 38.90 . 1 956 . 82 ILE HB H 1.79 . 1 957 . 82 ILE CG1 C 31.64 . 1 958 . 82 ILE HG12 H 0.76 . 2 959 . 82 ILE HG13 H 1.76 . 2 960 . 82 ILE CG2 C 17.64 . 1 961 . 82 ILE HG2 H 0.85 . 1 962 . 82 ILE CD1 C 14.43 . 1 963 . 82 ILE HD1 H 0.78 . 1 964 . 82 ILE C C 178.26 . 1 965 . 83 LYS N N 117.75 . 1 966 . 83 LYS H H 7.68 . 1 967 . 83 LYS CA C 59.07 . 1 968 . 83 LYS HA H 4.14 . 1 969 . 83 LYS CB C 32.50 . 1 970 . 83 LYS HB2 H 1.83 . 1 971 . 83 LYS HB3 H 1.83 . 1 972 . 83 LYS HG2 H 1.43 . 2 973 . 83 LYS HG3 H 1.56 . 2 974 . 83 LYS HD2 H 1.67 . 1 975 . 83 LYS HD3 H 1.67 . 1 976 . 83 LYS HE2 H 2.97 . 2 977 . 83 LYS HE3 H 3.09 . 2 978 . 83 LYS C C 180.88 . 1 979 . 84 GLY N N 108.82 . 1 980 . 84 GLY H H 7.88 . 1 981 . 84 GLY CA C 46.79 . 1 982 . 84 GLY HA2 H 3.55 . 2 983 . 84 GLY HA3 H 3.81 . 2 984 . 84 GLY C C 174.87 . 1 985 . 85 LEU N N 119.49 . 1 986 . 85 LEU H H 7.64 . 1 987 . 85 LEU CA C 54.59 . 1 988 . 85 LEU HA H 4.24 . 1 989 . 85 LEU CB C 42.80 . 1 990 . 85 LEU HB2 H 1.72 . 2 991 . 85 LEU HB3 H 1.53 . 2 992 . 85 LEU HG H 1.74 . 1 993 . 85 LEU CD1 C 22.83 . 1 994 . 85 LEU HD1 H 0.82 . 1 995 . 85 LEU CD2 C 27.42 . 2 996 . 85 LEU HD2 H 0.82 . 1 997 . 85 LEU C C 176.40 . 1 998 . 86 HIS N N 114.28 . 1 999 . 86 HIS H H 7.84 . 1 1000 . 86 HIS CA C 55.93 . 1 1001 . 86 HIS HA H 4.28 . 1 1002 . 86 HIS CB C 25.78 . 1 1003 . 86 HIS HB2 H 3.32 . 2 1004 . 86 HIS HB3 H 3.52 . 2 1005 . 86 HIS CE1 C 136.07 . 1 1006 . 86 HIS HE2 H 8.57 . 1 1007 . 86 HIS C C 174.75 . 1 1008 . 87 LEU N N 118.44 . 1 1009 . 87 LEU H H 7.47 . 1 1010 . 87 LEU CA C 53.12 . 1 1011 . 87 LEU HA H 4.54 . 1 1012 . 87 LEU CB C 41.49 . 1 1013 . 87 LEU HB2 H 1.31 . 1 1014 . 87 LEU HB3 H 1.67 . 1 1015 . 87 LEU HG H 1.72 . 1 1016 . 87 LEU CD1 C 26.56 . 1 1017 . 87 LEU HD1 H 0.90 . 1 1018 . 87 LEU CD2 C 22.70 . 1 1019 . 87 LEU HD2 H 0.88 . 1 1020 . 87 LEU C C 175.07 . 1 1021 . 88 PRO CA C 62.80 . 1 1022 . 88 PRO HA H 4.57 . 1 1023 . 88 PRO CB C 32.50 . 1 1024 . 88 PRO HB2 H 2.01 . 2 1025 . 88 PRO HB3 H 2.40 . 2 1026 . 88 PRO HG2 H 2.08 . 2 1027 . 88 PRO HG3 H 2.13 . 2 1028 . 88 PRO CD C 50.36 . 1 1029 . 88 PRO HD3 H 3.49 . 2 1030 . 88 PRO HD2 H 3.95 . 2 1031 . 88 PRO C C 177.52 . 1 1032 . 89 SER N N 116.64 . 1 1033 . 89 SER H H 8.52 . 1 1034 . 89 SER CA C 59.82 . 1 1035 . 89 SER HA H 4.24 . 1 1036 . 89 SER CB C 63.48 . 1 1037 . 89 SER HB2 H 3.92 . 2 1038 . 89 SER HB3 H 3.98 . 2 1039 . 89 SER C C 174.66 . 1 1040 . 90 SER N N 113.24 . 1 1041 . 90 SER H H 7.61 . 1 1042 . 90 SER CA C 58.23 . 1 1043 . 90 SER HA H 4.29 . 1 1044 . 90 SER CB C 63.22 . 1 1045 . 90 SER HB2 H 3.85 . 2 1046 . 90 SER HB3 H 4.04 . 2 1047 . 90 SER C C 174.95 . 1 1048 . 91 ILE N N 122.18 . 1 1049 . 91 ILE H H 7.33 . 1 1050 . 91 ILE CA C 61.04 . 1 1051 . 91 ILE HA H 4.24 . 1 1052 . 91 ILE CB C 37.49 . 1 1053 . 91 ILE HB H 1.89 . 1 1054 . 91 ILE HG12 H 1.23 . 2 1055 . 91 ILE HG13 H 1.53 . 2 1056 . 91 ILE CG2 C 17.90 . 1 1057 . 91 ILE HG2 H 0.89 . 1 1058 . 91 ILE CD1 C 14.02 . 1 1059 . 91 ILE HD1 H 0.92 . 1 1060 . 91 ILE C C 176.47 . 1 1061 . 92 THR N N 121.49 . 1 1062 . 92 THR H H 8.25 . 1 1063 . 92 THR CA C 63.51 . 1 1064 . 92 THR HA H 4.22 . 1 1065 . 92 THR CB C 69.30 . 1 1066 . 92 THR HB H 4.71 . 1 1067 . 92 THR CG2 C 22.10 . 1 1068 . 92 THR HG2 H 1.29 . 1 1069 . 92 THR C C 175.34 . 1 1070 . 93 SER N N 116.47 . 1 1071 . 93 SER H H 8.57 . 1 1072 . 93 SER CA C 58.06 . 1 1073 . 93 SER HA H 4.43 . 1 1074 . 93 SER CB C 62.71 . 1 1075 . 93 SER HB2 H 4.01 . 2 1076 . 93 SER HB3 H 4.07 . 2 1077 . 93 SER C C 175.62 . 1 1078 . 94 ALA N N 123.27 . 1 1079 . 94 ALA H H 7.89 . 1 1080 . 94 ALA CA C 55.84 . 1 1081 . 94 ALA HA H 3.82 . 1 1082 . 94 ALA CB C 18.61 . 1 1083 . 94 ALA HB H 1.31 . 1 1084 . 94 ALA C C 178.33 . 1 1085 . 95 ALA N N 119.00 . 1 1086 . 95 ALA H H 8.56 . 1 1087 . 95 ALA CA C 55.76 . 1 1088 . 95 ALA HA H 3.24 . 1 1089 . 95 ALA CB C 17.84 . 1 1090 . 95 ALA HB H 1.11 . 1 1091 . 95 ALA C C 178.62 . 1 1092 . 96 PHE N N 118.18 . 1 1093 . 96 PHE H H 7.67 . 1 1094 . 96 PHE CA C 60.74 . 1 1095 . 96 PHE HA H 3.90 . 1 1096 . 96 PHE CB C 38.96 . 1 1097 . 96 PHE HB2 H 2.98 . 2 1098 . 96 PHE HB3 H 3.12 . 2 1099 . 96 PHE CD1 C 131.29 . 1 1100 . 96 PHE HD1 H 7.12 . 1 1101 . 96 PHE CD2 C 131.29 . 1 1102 . 96 PHE HD2 H 7.12 . 1 1103 . 96 PHE CE1 C 131.43 . 1 1104 . 96 PHE HE1 H 7.29 . 1 1105 . 96 PHE CE2 C 131.43 . 1 1106 . 96 PHE HE2 H 7.29 . 1 1107 . 96 PHE C C 178.33 . 1 1108 . 97 THR N N 118.81 . 1 1109 . 97 THR H H 8.12 . 1 1110 . 97 THR CA C 66.69 . 1 1111 . 97 THR HA H 3.71 . 1 1112 . 97 THR CB C 68.66 . 1 1113 . 97 THR HB H 4.06 . 1 1114 . 97 THR CG2 C 22.48 . 1 1115 . 97 THR HG2 H 1.23 . 1 1116 . 97 THR C C 176.23 . 1 1117 . 98 LEU N N 121.49 . 1 1118 . 98 LEU H H 8.50 . 1 1119 . 98 LEU CA C 58.19 . 1 1120 . 98 LEU HA H 3.73 . 1 1121 . 98 LEU CB C 42.16 . 1 1122 . 98 LEU HB2 H 1.25 . 1 1123 . 98 LEU HB3 H 0.98 . 1 1124 . 98 LEU HG H 1.63 . 1 1125 . 98 LEU CD1 C 26.89 . 1 1126 . 98 LEU HD1 H 0.74 . 1 1127 . 98 LEU CD2 C 24.48 . 1 1128 . 98 LEU HD2 H 0.77 . 1 1129 . 98 LEU C C 178.10 . 1 1130 . 99 ARG N N 118.91 . 1 1131 . 99 ARG H H 7.30 . 1 1132 . 99 ARG CA C 60.45 . 1 1133 . 99 ARG HA H 3.60 . 1 1134 . 99 ARG CB C 30.01 . 1 1135 . 99 ARG HB2 H 1.25 . 1 1136 . 99 ARG HB3 H 1.72 . 1 1137 . 99 ARG HG2 H 1.59 . 1 1138 . 99 ARG HG3 H 1.59 . 1 1139 . 99 ARG CD C 44.22 . 1 1140 . 99 ARG HD2 H 3.09 . 2 1141 . 99 ARG HD3 H 3.25 . 2 1142 . 99 ARG NE N 82.51 . 1 1143 . 99 ARG HE H 7.26 . 1 1144 . 99 ARG C C 178.06 . 1 1145 . 100 THR N N 115.00 . 1 1146 . 100 THR H H 7.86 . 1 1147 . 100 THR CA C 66.69 . 1 1148 . 100 THR HA H 3.82 . 1 1149 . 100 THR CB C 68.98 . 1 1150 . 100 THR HB H 4.15 . 1 1151 . 100 THR CG2 C 21.57 . 1 1152 . 100 THR HG2 H 1.04 . 1 1153 . 100 THR C C 177.52 . 1 1154 . 101 GLN N N 119.92 . 1 1155 . 101 GLN H H 8.60 . 1 1156 . 101 GLN CA C 58.06 . 1 1157 . 101 GLN HA H 4.50 . 1 1158 . 101 GLN CB C 27.89 . 1 1159 . 101 GLN HB2 H 1.93 . 2 1160 . 101 GLN HB3 H 2.01 . 2 1161 . 101 GLN CG C 32.93 . 1 1162 . 101 GLN HG2 H 2.17 . 2 1163 . 101 GLN HG3 H 2.77 . 2 1164 . 101 GLN NE2 N 109.64 . 1 1165 . 101 GLN HE21 H 6.62 . 2 1166 . 101 GLN HE22 H 6.76 . 2 1167 . 101 GLN C C 178.89 . 1 1168 . 102 TYR N N 121.55 . 1 1169 . 102 TYR H H 9.21 . 1 1170 . 102 TYR CA C 62.55 . 1 1171 . 102 TYR HA H 3.94 . 1 1172 . 102 TYR CB C 39.09 . 1 1173 . 102 TYR HB2 H 3.41 . 1 1174 . 102 TYR HB3 H 3.19 . 1 1175 . 102 TYR CD1 C 134.33 . 1 1176 . 102 TYR HD1 H 6.93 . 1 1177 . 102 TYR CD2 C 134.33 . 1 1178 . 102 TYR HD2 H 6.93 . 1 1179 . 102 TYR CE1 C 118.36 . 1 1180 . 102 TYR HE1 H 6.97 . 1 1181 . 102 TYR CE2 C 118.36 . 1 1182 . 102 TYR HE2 H 6.97 . 1 1183 . 102 TYR C C 179.84 . 1 1184 . 103 MET N N 119.34 . 1 1185 . 103 MET H H 8.82 . 1 1186 . 103 MET CA C 60.66 . 1 1187 . 103 MET HA H 3.97 . 1 1188 . 103 MET CB C 33.59 . 1 1189 . 103 MET HB2 H 2.25 . 2 1190 . 103 MET HB3 H 2.20 . 2 1191 . 103 MET CG C 33.16 . 1 1192 . 103 MET HG2 H 2.73 . 1 1193 . 103 MET HG3 H 2.73 . 1 1194 . 103 MET CE C 16.04 . 1 1195 . 103 MET HE H 1.99 . 1 1196 . 103 MET C C 176.24 . 1 1197 . 104 LYS N N 115.87 . 1 1198 . 104 LYS H H 7.42 . 1 1199 . 104 LYS CA C 59.03 . 1 1200 . 104 LYS HA H 3.97 . 1 1201 . 104 LYS CB C 33.66 . 1 1202 . 104 LYS HB2 H 1.33 . 2 1203 . 104 LYS HB3 H 1.57 . 2 1204 . 104 LYS CG C 24.76 . 1 1205 . 104 LYS HG2 H 0.49 . 2 1206 . 104 LYS HG3 H 1.06 . 2 1207 . 104 LYS CD C 29.50 . 1 1208 . 104 LYS HD2 H 1.34 . 2 1209 . 104 LYS HD3 H 1.46 . 2 1210 . 104 LYS CE C 42.16 . 1 1211 . 104 LYS HE2 H 2.74 . 2 1212 . 104 LYS HE3 H 2.79 . 2 1213 . 104 LYS C C 177.52 . 1 1214 . 105 TYR N N 111.01 . 1 1215 . 105 TYR H H 8.06 . 1 1216 . 105 TYR CA C 60.41 . 1 1217 . 105 TYR HA H 4.57 . 1 1218 . 105 TYR CB C 41.33 . 1 1219 . 105 TYR HB2 H 2.99 . 1 1220 . 105 TYR HB3 H 2.65 . 1 1221 . 105 TYR CD1 C 132.88 . 1 1222 . 105 TYR HD1 H 7.23 . 1 1223 . 105 TYR CD2 C 132.88 . 1 1224 . 105 TYR HD2 H 7.23 . 1 1225 . 105 TYR CE1 C 118.62 . 1 1226 . 105 TYR HE1 H 7.09 . 1 1227 . 105 TYR CE2 C 118.62 . 1 1228 . 105 TYR HE2 H 7.09 . 1 1229 . 105 TYR C C 176.43 . 1 1230 . 106 LEU N N 115.69 . 1 1231 . 106 LEU H H 8.39 . 1 1232 . 106 LEU CA C 55.05 . 1 1233 . 106 LEU HA H 4.75 . 1 1234 . 106 LEU CB C 44.53 . 1 1235 . 106 LEU HB2 H 1.03 . 1 1236 . 106 LEU HB3 H 0.68 . 1 1237 . 106 LEU HG H 1.42 . 1 1238 . 106 LEU CD1 C 28.21 . 1 1239 . 106 LEU HD1 H 1.02 . 1 1240 . 106 LEU CD2 C 24.64 . 1 1241 . 106 LEU HD2 H 0.99 . 1 1242 . 106 LEU C C 176.69 . 1 1243 . 107 TYR N N 120.75 . 1 1244 . 107 TYR H H 8.38 . 1 1245 . 107 TYR CA C 63.05 . 1 1246 . 107 TYR HA H 3.92 . 1 1247 . 107 TYR CB C 37.67 . 1 1248 . 107 TYR HB2 H 3.46 . 2 1249 . 107 TYR HB3 H 3.21 . 2 1250 . 107 TYR CD1 C 133.13 . 1 1251 . 107 TYR HD1 H 7.15 . 1 1252 . 107 TYR CD2 C 133.13 . 1 1253 . 107 TYR HD2 H 7.15 . 1 1254 . 107 TYR CE1 C 118.49 . 1 1255 . 107 TYR HE1 H 6.54 . 1 1256 . 107 TYR CE2 C 118.49 . 1 1257 . 107 TYR HE2 H 6.54 . 1 1258 . 107 TYR C C 175.74 . 1 1259 . 108 PRO CA C 66.99 . 1 1260 . 108 PRO HA H 4.28 . 1 1261 . 108 PRO CB C 30.32 . 1 1262 . 108 PRO HB2 H 1.93 . 2 1263 . 108 PRO HB3 H 2.40 . 2 1264 . 108 PRO C C 178.88 . 1 1265 . 109 TYR N N 121.38 . 1 1266 . 109 TYR H H 7.73 . 1 1267 . 109 TYR CA C 62.09 . 1 1268 . 109 TYR HA H 3.15 . 1 1269 . 109 TYR CB C 38.64 . 1 1270 . 109 TYR HB2 H 2.82 . 2 1271 . 109 TYR HB3 H 2.92 . 2 1272 . 109 TYR CD1 C 132.53 . 1 1273 . 109 TYR HD1 H 6.34 . 1 1274 . 109 TYR CD2 C 132.53 . 1 1275 . 109 TYR HD2 H 6.34 . 1 1276 . 109 TYR CE1 C 117.35 . 1 1277 . 109 TYR HE1 H 6.28 . 1 1278 . 109 TYR CE2 C 117.35 . 1 1279 . 109 TYR HE2 H 6.28 . 1 1280 . 109 TYR C C 176.19 . 1 1281 . 110 GLU N N 120.77 . 1 1282 . 110 GLU H H 9.02 . 1 1283 . 110 GLU CA C 60.58 . 1 1284 . 110 GLU HA H 4.10 . 1 1285 . 110 GLU CB C 30.51 . 1 1286 . 110 GLU HB2 H 2.61 . 2 1287 . 110 GLU HB3 H 2.72 . 2 1288 . 110 GLU HG2 H 2.29 . 2 1289 . 110 GLU HG3 H 2.42 . 2 1290 . 110 GLU C C 179.77 . 1 1291 . 111 CYS N N 116.28 . 1 1292 . 111 CYS H H 8.51 . 1 1293 . 111 CYS CA C 64.06 . 1 1294 . 111 CYS HA H 4.22 . 1 1295 . 111 CYS CB C 27.06 . 1 1296 . 111 CYS HB2 H 2.81 . 2 1297 . 111 CYS HB3 H 2.84 . 2 1298 . 111 CYS C C 176.79 . 1 1299 . 112 GLU N N 119.14 . 1 1300 . 112 GLU H H 7.50 . 1 1301 . 112 GLU CA C 58.69 . 1 1302 . 112 GLU HA H 3.99 . 1 1303 . 112 GLU CB C 29.49 . 1 1304 . 112 GLU HB2 H 1.94 . 2 1305 . 112 GLU HB3 H 1.46 . 2 1306 . 112 GLU CG C 34.71 . 1 1307 . 112 GLU HG2 H 1.95 . 2 1308 . 112 GLU HG3 H 2.04 . 2 1309 . 112 GLU C C 177.93 . 1 1310 . 113 LYS N N 114.75 . 1 1311 . 113 LYS H H 8.39 . 1 1312 . 113 LYS CA C 56.09 . 1 1313 . 113 LYS HA H 4.01 . 1 1314 . 113 LYS CB C 32.18 . 1 1315 . 113 LYS HB2 H 1.49 . 2 1316 . 113 LYS HB3 H 1.52 . 2 1317 . 113 LYS CG C 23.10 . 1 1318 . 113 LYS HG2 H 0.42 . 1 1319 . 113 LYS HG3 H 0.42 . 1 1320 . 113 LYS CD C 27.34 . 1 1321 . 113 LYS HD2 H 1.22 . 2 1322 . 113 LYS HD3 H 1.15 . 2 1323 . 113 LYS CE C 42.13 . 1 1324 . 113 LYS HE2 H 2.37 . 2 1325 . 113 LYS HE3 H 2.72 . 2 1326 . 113 LYS C C 178.72 . 1 1327 . 114 LYS N N 116.08 . 1 1328 . 114 LYS H H 8.42 . 1 1329 . 114 LYS CA C 54.88 . 1 1330 . 114 LYS HA H 4.52 . 1 1331 . 114 LYS CB C 34.16 . 1 1332 . 114 LYS HB2 H 1.67 . 2 1333 . 114 LYS HB3 H 1.94 . 2 1334 . 114 LYS CG C 24.17 . 1 1335 . 114 LYS HG2 H 1.43 . 1 1336 . 114 LYS HG3 H 1.43 . 1 1337 . 114 LYS HD2 H 1.71 . 1 1338 . 114 LYS HD3 H 1.71 . 1 1339 . 114 LYS HE2 H 2.98 . 2 1340 . 114 LYS HE3 H 2.92 . 2 1341 . 114 LYS C C 176.54 . 1 1342 . 115 ASN N N 117.99 . 1 1343 . 115 ASN H H 8.19 . 1 1344 . 115 ASN CA C 54.54 . 1 1345 . 115 ASN HA H 4.58 . 1 1346 . 115 ASN CB C 37.30 . 1 1347 . 115 ASN HB2 H 2.48 . 2 1348 . 115 ASN HB3 H 3.11 . 2 1349 . 115 ASN CG C 178.49 . 1 1350 . 115 ASN ND2 N 110.74 . 1 1351 . 115 ASN HD21 H 6.52 . 2 1352 . 115 ASN HD22 H 7.40 . 2 1353 . 115 ASN C C 174.54 . 1 1354 . 116 LEU N N 119.91 . 1 1355 . 116 LEU H H 7.89 . 1 1356 . 116 LEU CA C 56.68 . 1 1357 . 116 LEU HA H 4.23 . 1 1358 . 116 LEU CB C 42.23 . 1 1359 . 116 LEU HB2 H 1.54 . 1 1360 . 116 LEU HB3 H 1.88 . 1 1361 . 116 LEU HG H 1.44 . 1 1362 . 116 LEU CD1 C 24.73 . 1 1363 . 116 LEU HD1 H 0.67 . 1 1364 . 116 LEU CD2 C 22.43 . 1 1365 . 116 LEU HD2 H 0.79 . 1 1366 . 116 LEU C C 177.53 . 1 1367 . 117 SER N N 114.75 . 1 1368 . 117 SER H H 8.86 . 1 1369 . 117 SER CA C 57.18 . 1 1370 . 117 SER HA H 4.87 . 1 1371 . 117 SER CB C 65.40 . 1 1372 . 117 SER HB2 H 3.99 . 2 1373 . 117 SER HB3 H 3.86 . 2 1374 . 117 SER C C 172.56 . 1 1375 . 118 THR N N 108.09 . 1 1376 . 118 THR H H 8.04 . 1 1377 . 118 THR CA C 58.44 . 1 1378 . 118 THR HA H 5.07 . 1 1379 . 118 THR HB H 4.68 . 1 1380 . 118 THR CG2 C 22.16 . 1 1381 . 118 THR HG2 H 1.29 . 1 1382 . 118 THR C C 174.64 . 1 1383 . 119 PRO CA C 65.77 . 1 1384 . 119 PRO HA H 4.47 . 1 1385 . 119 PRO CB C 31.99 . 1 1386 . 119 PRO HB2 H 2.08 . 2 1387 . 119 PRO HB3 H 2.57 . 2 1388 . 119 PRO HG2 H 2.00 . 2 1389 . 119 PRO HG3 H 3.28 . 2 1390 . 119 PRO CD C 50.76 . 1 1391 . 119 PRO HD3 H 3.99 . 2 1392 . 119 PRO HD2 H 3.53 . 2 1393 . 119 PRO C C 179.09 . 1 1394 . 120 ALA N N 120.17 . 1 1395 . 120 ALA H H 8.17 . 1 1396 . 120 ALA CA C 55.26 . 1 1397 . 120 ALA HA H 4.22 . 1 1398 . 120 ALA CB C 18.42 . 1 1399 . 120 ALA HB H 1.42 . 1 1400 . 120 ALA C C 181.25 . 1 1401 . 121 GLU N N 120.83 . 1 1402 . 121 GLU H H 7.89 . 1 1403 . 121 GLU CA C 58.94 . 1 1404 . 121 GLU HA H 4.08 . 1 1405 . 121 GLU CB C 30.00 . 1 1406 . 121 GLU HB2 H 2.55 . 1 1407 . 121 GLU HB3 H 2.04 . 1 1408 . 121 GLU CG C 37.10 . 1 1409 . 121 GLU HG2 H 2.30 . 2 1410 . 121 GLU HG3 H 2.41 . 2 1411 . 121 GLU C C 179.90 . 1 1412 . 122 LEU N N 122.64 . 1 1413 . 122 LEU H H 8.12 . 1 1414 . 122 LEU CA C 58.36 . 1 1415 . 122 LEU HA H 4.06 . 1 1416 . 122 LEU CB C 40.24 . 1 1417 . 122 LEU HB2 H 1.23 . 2 1418 . 122 LEU HB3 H 2.00 . 2 1419 . 122 LEU HG H 1.36 . 1 1420 . 122 LEU CD1 C 23.91 . 1 1421 . 122 LEU HD1 H 0.57 . 1 1422 . 122 LEU CD2 C 25.98 . 1 1423 . 122 LEU HD2 H 0.36 . 1 1424 . 122 LEU C C 177.76 . 1 1425 . 123 GLN N N 118.35 . 1 1426 . 123 GLN H H 8.20 . 1 1427 . 123 GLN CA C 58.69 . 1 1428 . 123 GLN HA H 3.80 . 1 1429 . 123 GLN CB C 28.15 . 1 1430 . 123 GLN HB2 H 2.11 . 1 1431 . 123 GLN HB3 H 2.11 . 1 1432 . 123 GLN CG C 33.42 . 1 1433 . 123 GLN HG2 H 2.41 . 1 1434 . 123 GLN HG3 H 2.41 . 1 1435 . 123 GLN NE2 N 114.28 . 1 1436 . 123 GLN HE21 H 6.75 . 2 1437 . 123 GLN HE22 H 7.72 . 2 1438 . 123 GLN C C 178.02 . 1 1439 . 124 ALA N N 119.39 . 1 1440 . 124 ALA H H 7.61 . 1 1441 . 124 ALA CA C 54.67 . 1 1442 . 124 ALA HA H 4.20 . 1 1443 . 124 ALA CB C 18.16 . 1 1444 . 124 ALA HB H 1.48 . 1 1445 . 124 ALA C C 180.15 . 1 1446 . 125 ALA N N 122.17 . 1 1447 . 125 ALA H H 7.88 . 1 1448 . 125 ALA CA C 54.67 . 1 1449 . 125 ALA HA H 4.27 . 1 1450 . 125 ALA CB C 18.61 . 1 1451 . 125 ALA HB H 1.54 . 1 1452 . 125 ALA C C 180.34 . 1 1453 . 126 ILE N N 118.21 . 1 1454 . 126 ILE H H 8.16 . 1 1455 . 126 ILE CA C 64.60 . 1 1456 . 126 ILE HA H 3.74 . 1 1457 . 126 ILE CB C 38.39 . 1 1458 . 126 ILE HB H 1.91 . 1 1459 . 126 ILE HG12 H 1.01 . 2 1460 . 126 ILE HG13 H 1.64 . 2 1461 . 126 ILE CG2 C 16.80 . 1 1462 . 126 ILE HG2 H 0.88 . 1 1463 . 126 ILE CD1 C 13.33 . 1 1464 . 126 ILE HD1 H 0.74 . 1 1465 . 126 ILE C C 178.28 . 1 1466 . 127 ASP N N 120.74 . 1 1467 . 127 ASP H H 8.35 . 1 1468 . 127 ASP CA C 56.35 . 1 1469 . 127 ASP HA H 4.51 . 1 1470 . 127 ASP CB C 40.88 . 1 1471 . 127 ASP HB2 H 2.71 . 1 1472 . 127 ASP HB3 H 2.71 . 1 1473 . 127 ASP C C 178.18 . 1 1474 . 128 GLY N N 107.52 . 1 1475 . 128 GLY H H 8.03 . 1 1476 . 128 GLY CA C 46.21 . 1 1477 . 128 GLY HA2 H 3.94 . 2 1478 . 128 GLY HA3 H 3.98 . 2 1479 . 128 GLY C C 174.72 . 1 1480 . 129 ASN N N 118.99 . 1 1481 . 129 ASN H H 8.05 . 1 1482 . 129 ASN CA C 53.91 . 1 1483 . 129 ASN HA H 4.73 . 1 1484 . 129 ASN CB C 39.22 . 1 1485 . 129 ASN HB2 H 2.76 . 2 1486 . 129 ASN HB3 H 2.84 . 2 1487 . 129 ASN ND2 N 113.62 . 1 1488 . 129 ASN HD21 H 6.91 . 2 1489 . 129 ASN HD22 H 7.75 . 2 1490 . 129 ASN C C 175.51 . 1 1491 . 130 ARG N N 120.94 . 1 1492 . 130 ARG H H 8.07 . 1 1493 . 130 ARG CA C 56.85 . 1 1494 . 130 ARG HA H 4.28 . 1 1495 . 130 ARG CB C 30.71 . 1 1496 . 130 ARG HB2 H 1.78 . 2 1497 . 130 ARG HB3 H 1.87 . 2 1498 . 130 ARG HG2 H 1.62 . 2 1499 . 130 ARG HG3 H 1.62 . 2 1500 . 130 ARG HD2 H 3.19 . 1 1501 . 130 ARG HD3 H 3.19 . 1 1502 . 130 ARG C C 176.66 . 1 1503 . 131 ARG N N 121.49 . 1 1504 . 131 ARG H H 8.24 . 1 1505 . 131 ARG CA C 56.68 . 1 1506 . 131 ARG HA H 4.27 . 1 1507 . 131 ARG CB C 30.71 . 1 1508 . 131 ARG HB2 H 1.79 . 2 1509 . 131 ARG HB3 H 1.85 . 2 1510 . 131 ARG HG2 H 1.63 . 1 1511 . 131 ARG HG3 H 1.63 . 1 1512 . 131 ARG HD2 H 3.18 . 1 1513 . 131 ARG HD3 H 3.18 . 1 1514 . 131 ARG C C 176.54 . 1 1515 . 132 GLU N N 121.38 . 1 1516 . 132 GLU H H 8.31 . 1 1517 . 132 GLU CA C 57.02 . 1 1518 . 132 GLU HA H 4.26 . 1 1519 . 132 GLU CB C 30.26 . 1 1520 . 132 GLU HB2 H 2.08 . 2 1521 . 132 GLU HB3 H 1.96 . 2 1522 . 132 GLU HG2 H 2.29 . 1 1523 . 132 GLU HG3 H 2.29 . 1 1524 . 132 GLU C C 177.03 . 1 1525 . 133 GLY N N 109.82 . 1 1526 . 133 GLY H H 8.31 . 1 1527 . 133 GLY CA C 45.45 . 1 1528 . 133 GLY HA2 H 3.92 . 2 1529 . 133 GLY HA3 H 3.98 . 2 1530 . 133 GLY C C 174.20 . 1 1531 . 134 ARG N N 120.76 . 1 1532 . 134 ARG H H 8.11 . 1 1533 . 134 ARG CA C 56.14 . 1 1534 . 134 ARG HA H 4.33 . 1 1535 . 134 ARG CB C 30.83 . 1 1536 . 134 ARG HB2 H 1.76 . 2 1537 . 134 ARG HB3 H 1.85 . 2 1538 . 134 ARG HG2 H 1.63 . 1 1539 . 134 ARG HG3 H 1.63 . 1 1540 . 134 ARG HD2 H 3.18 . 1 1541 . 134 ARG HD3 H 3.18 . 1 1542 . 134 ARG C C 176.50 . 1 1543 . 135 ARG N N 122.69 . 1 1544 . 135 ARG H H 8.38 . 1 1545 . 135 ARG CA C 56.26 . 1 1546 . 135 ARG HA H 4.33 . 1 1547 . 135 ARG CB C 31.03 . 1 1548 . 135 ARG HB2 H 1.76 . 2 1549 . 135 ARG HB3 H 1.86 . 2 1550 . 135 ARG HG2 H 1.62 . 1 1551 . 135 ARG HG3 H 1.62 . 1 1552 . 135 ARG HD2 H 3.18 . 1 1553 . 135 ARG HD3 H 3.18 . 1 1554 . 135 ARG C C 176.46 . 1 1555 . 136 SER N N 117.08 . 1 1556 . 136 SER H H 8.32 . 1 1557 . 136 SER CA C 58.40 . 1 1558 . 136 SER HA H 4.44 . 1 1559 . 136 SER CB C 64.18 . 1 1560 . 136 SER HB2 H 3.81 . 2 1561 . 136 SER HB3 H 3.87 . 2 1562 . 136 SER C C 174.56 . 1 1563 . 137 SER N N 117.48 . 1 1564 . 137 SER H H 8.20 . 1 1565 . 137 SER CA C 58.48 . 1 1566 . 137 SER HA H 4.37 . 1 1567 . 137 SER CB C 64.06 . 1 1568 . 137 SER HB2 H 3.75 . 1 1569 . 137 SER HB3 H 3.75 . 1 1570 . 137 SER C C 173.94 . 1 1571 . 138 TYR N N 121.65 . 1 1572 . 138 TYR H H 8.09 . 1 1573 . 138 TYR CA C 57.85 . 1 1574 . 138 TYR HA H 4.58 . 1 1575 . 138 TYR CB C 39.03 . 1 1576 . 138 TYR HB2 H 2.89 . 2 1577 . 138 TYR HB3 H 3.12 . 2 1578 . 138 TYR HD1 H 7.10 . 1 1579 . 138 TYR HD2 H 7.10 . 1 1580 . 138 TYR HE1 H 6.81 . 1 1581 . 138 TYR HE2 H 6.81 . 1 1582 . 138 TYR C C 175.23 . 1 1583 . 139 GLY N N 116.50 . 1 1584 . 139 GLY H H 7.80 . 1 1585 . 139 GLY CA C 46.21 . 1 1586 . 139 GLY HA2 H 3.66 . 2 1587 . 139 GLY HA3 H 3.76 . 2 1588 . 139 GLY C C 178.88 . 1 stop_ save_ ######################## # Coupling constants # ######################## save_coupling_constant _Saveframe_category coupling_constants _Details ; 3D HNHA spectrum was used to measure 3JHNHA coupling constants. Error values for these couplings were estimated with the use of noise intensity of this spectrum. ; loop_ _Sample_label $sample1 stop_ _Sample_conditions_label $conditions_1 _Spectrometer_frequency_1H . _Mol_system_component_name 'dead-ringer ARID domain' _Text_data_format . _Text_data . loop_ _Coupling_constant_ID _Coupling_constant_code _Atom_one_residue_seq_code _Atom_one_residue_label _Atom_one_name _Atom_two_residue_seq_code _Atom_two_residue_label _Atom_two_name _Coupling_constant_value _Coupling_constant_min_value _Coupling_constant_max_value _Coupling_constant_value_error 1 3JHNHA 5 SER H 5 SER HA 5.72 . . 0.05 2 3JHNHA 6 PHE H 6 PHE HA 4.33 . . 0.12 3 3JHNHA 7 GLU H 7 GLU HA 3.97 . . 0.13 4 3JHNHA 8 GLU H 8 GLU HA 5.15 . . 0.09 5 3JHNHA 10 PHE H 10 PHE HA 5.20 . . 0.16 6 3JHNHA 11 LYS H 11 LYS HA 3.10 . . 0.24 7 3JHNHA 13 VAL H 13 VAL HA 6.22 . . 0.15 8 3JHNHA 14 ARG H 14 ARG HA 2.39 . . 0.31 9 3JHNHA 15 GLN H 15 GLN HA 3.03 . . 0.23 10 3JHNHA 16 LEU H 16 LEU HA 5.33 . . 0.02 11 3JHNHA 17 TYR H 17 TYR HA 6.57 . . 0.03 12 3JHNHA 18 GLU H 18 GLU HA 8.22 . . 0.02 13 3JHNHA 19 ILE H 19 ILE HA 2.42 . . 0.05 14 3JHNHA 20 ASN H 20 ASN HA 4.04 . . 0.20 15 3JHNHA 21 ASP H 21 ASP HA 7.80 . . 0.02 16 3JHNHA 22 ASP H 22 ASP HA 3.10 . . 0.23 17 3JHNHA 24 LYS H 24 LYS HA 6.30 . . 0.12 18 3JHNHA 26 LYS H 26 LYS HA 3.63 . . 0.04 19 3JHNHA 27 GLU H 27 GLU HA 4.00 . . 0.15 20 3JHNHA 29 LEU H 29 LEU HA 3.42 . . 0.10 21 3JHNHA 30 ASP H 30 ASP HA 2.83 . . 0.33 22 3JHNHA 31 ASP H 31 ASP HA 5.20 . . 0.17 23 3JHNHA 32 LEU H 32 LEU HA 2.95 . . 0.04 24 3JHNHA 33 PHE H 33 PHE HA 3.18 . . 0.04 25 3JHNHA 34 SER H 34 SER HA 3.82 . . 0.22 26 3JHNHA 35 PHE H 35 PHE HA 2.56 . . 0.05 27 3JHNHA 36 MET H 36 MET HA 4.16 . . 0.03 28 3JHNHA 37 GLN H 37 GLN HA 4.04 . . 0.23 29 3JHNHA 38 LYS H 38 LYS HA 3.24 . . 0.20 30 3JHNHA 39 ARG H 39 ARG HA 6.15 . . 0.11 31 3JHNHA 41 THR H 41 THR HA 9.18 . . 0.11 32 3JHNHA 43 ILE H 43 ILE HA 7.09 . . 0.02 33 3JHNHA 44 ASN H 44 ASN HA 8.40 . . 0.01 34 3JHNHA 46 LEU H 46 LEU HA 6.02 . . 0.17 35 3JHNHA 49 MET H 49 MET HA 7.45 . . 0.07 36 3JHNHA 50 ALA H 50 ALA HA 6.70 . . 0.14 37 3JHNHA 51 LYS H 51 LYS HA 7.42 . . 0.13 38 3JHNHA 52 SER H 52 SER HA 8.27 . . 0.05 39 3JHNHA 54 LEU H 54 LEU HA 4.42 . . 0.04 40 3JHNHA 55 ASP H 55 ASP HA 4.23 . . 0.03 41 3JHNHA 56 LEU H 56 LEU HA 2.41 . . 0.07 42 3JHNHA 57 TYR H 57 TYR HA 5.94 . . 0.02 43 3JHNHA 58 GLU H 58 GLU HA 5.03 . . 0.05 44 3JHNHA 59 LEU H 59 LEU HA 2.87 . . 0.36 45 3JHNHA 63 VAL H 63 VAL HA 6.72 . . 0.03 46 3JHNHA 65 ALA H 65 ALA HA 3.03 . . 0.04 47 3JHNHA 66 ARG H 66 ARG HA 8.80 . . 0.02 48 3JHNHA 69 LEU H 69 LEU HA 2.55 . . 0.10 49 3JHNHA 71 ASP H 71 ASP HA 4.67 . . 0.20 50 3JHNHA 74 ASN H 74 ASN HA 3.33 . . 0.04 51 3JHNHA 75 LYS H 75 LYS HA 8.23 . . 0.02 52 3JHNHA 77 LEU H 77 LEU HA 7.32 . . 0.02 53 3JHNHA 79 GLN H 79 GLN HA 3.73 . . 0.14 54 3JHNHA 82 ILE H 82 ILE HA 3.89 . . 0.07 55 3JHNHA 86 HIS H 86 HIS HA 5.86 . . 0.11 56 3JHNHA 87 LEU H 87 LEU HA 6.22 . . 0.14 57 3JHNHA 89 SER H 89 SER HA 4.56 . . 0.13 58 3JHNHA 90 SER H 90 SER HA 5.08 . . 0.05 59 3JHNHA 91 ILE H 91 ILE HA 6.56 . . 0.07 60 3JHNHA 93 SER H 93 SER HA 6.56 . . 0.13 61 3JHNHA 94 ALA H 94 ALA HA 2.24 . . 0.19 62 3JHNHA 95 ALA H 95 ALA HA 3.26 . . 0.16 63 3JHNHA 97 THR H 97 THR HA 4.08 . . 0.19 64 3JHNHA 98 LEU H 98 LEU HA 4.09 . . 0.03 65 3JHNHA 99 ARG H 99 ARG HA 2.79 . . 0.36 66 3JHNHA 102 TYR H 102 TYR HA 2.91 . . 0.35 67 3JHNHA 103 MET H 103 MET HA 4.10 . . 0.23 68 3JHNHA 105 TYR H 105 TYR HA 7.46 . . 0.02 69 3JHNHA 106 LEU H 106 LEU HA 10.31 . . 0.04 70 3JHNHA 109 TYR H 109 TYR HA 4.67 . . 0.04 71 3JHNHA 110 GLU H 110 GLU HA 2.11 . . 0.07 72 3JHNHA 111 CYS H 111 CYS HA 3.92 . . 0.06 73 3JHNHA 112 GLU H 112 GLU HA 5.15 . . 0.18 74 3JHNHA 113 LYS H 113 LYS HA 6.32 . . 0.02 75 3JHNHA 114 LYS H 114 LYS HA 10.69 . . 0.02 76 3JHNHA 116 LEU H 116 LEU HA 7.09 . . 0.04 77 3JHNHA 117 SER H 117 SER HA 6.31 . . 0.02 78 3JHNHA 118 THR H 118 THR HA 7.86 . . 0.02 79 3JHNHA 120 ALA H 120 ALA HA 3.88 . . 0.13 80 3JHNHA 121 GLU H 121 GLU HA 6.42 . . 0.16 81 3JHNHA 122 LEU H 122 LEU HA 4.37 . . 0.04 82 3JHNHA 123 GLN H 123 GLN HA 3.10 . . 0.18 83 3JHNHA 125 ALA H 125 ALA HA 4.94 . . 0.14 84 3JHNHA 126 ILE H 126 ILE HA 5.44 . . 0.02 85 3JHNHA 129 ASN H 129 ASN HA 6.72 . . 0.06 86 3JHNHA 132 GLU H 132 GLU HA 6.27 . . 0.03 87 3JHNHA 134 ARG H 134 ARG HA 6.56 . . 0.02 88 3JHNHA 135 ARG H 135 ARG HA 7.53 . . 0.02 89 3JHNHA 136 SER H 136 SER HA 6.97 . . 0.03 90 3JHNHA 137 SER H 137 SER HA 7.22 . . 0.04 stop_ save_