################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10197 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10197 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10197 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 7 7 GLY CA C 13 45.522 0.300 . 1 . . . . 7 GLY CA . 10197 1 2 . 1 1 7 7 GLY HA2 H 1 3.949 0.030 . 2 . . . . 7 GLY HA2 . 10197 1 3 . 1 1 7 7 GLY C C 13 174.326 0.300 . 1 . . . . 7 GLY C . 10197 1 4 . 1 1 8 8 MET N N 15 119.786 0.300 . 1 . . . . 8 MET N . 10197 1 5 . 1 1 8 8 MET H H 1 8.274 0.030 . 1 . . . . 8 MET H . 10197 1 6 . 1 1 8 8 MET CA C 13 55.569 0.300 . 1 . . . . 8 MET CA . 10197 1 7 . 1 1 8 8 MET HA H 1 4.511 0.030 . 1 . . . . 8 MET HA . 10197 1 8 . 1 1 8 8 MET CB C 13 32.859 0.300 . 1 . . . . 8 MET CB . 10197 1 9 . 1 1 8 8 MET HB2 H 1 2.006 0.030 . 2 . . . . 8 MET HB2 . 10197 1 10 . 1 1 8 8 MET HB3 H 1 2.131 0.030 . 2 . . . . 8 MET HB3 . 10197 1 11 . 1 1 8 8 MET CG C 13 32.083 0.300 . 1 . . . . 8 MET CG . 10197 1 12 . 1 1 8 8 MET HG2 H 1 2.609 0.030 . 2 . . . . 8 MET HG2 . 10197 1 13 . 1 1 8 8 MET HG3 H 1 2.520 0.030 . 2 . . . . 8 MET HG3 . 10197 1 14 . 1 1 8 8 MET CE C 13 16.971 0.300 . 1 . . . . 8 MET CE . 10197 1 15 . 1 1 8 8 MET HE1 H 1 2.093 0.030 . 1 . . . . 8 MET HE . 10197 1 16 . 1 1 8 8 MET HE2 H 1 2.093 0.030 . 1 . . . . 8 MET HE . 10197 1 17 . 1 1 8 8 MET HE3 H 1 2.093 0.030 . 1 . . . . 8 MET HE . 10197 1 18 . 1 1 8 8 MET C C 13 176.789 0.300 . 1 . . . . 8 MET C . 10197 1 19 . 1 1 9 9 GLY N N 15 110.120 0.300 . 1 . . . . 9 GLY N . 10197 1 20 . 1 1 9 9 GLY H H 1 8.454 0.030 . 1 . . . . 9 GLY H . 10197 1 21 . 1 1 9 9 GLY CA C 13 45.277 0.300 . 1 . . . . 9 GLY CA . 10197 1 22 . 1 1 9 9 GLY HA2 H 1 3.956 0.030 . 1 . . . . 9 GLY HA2 . 10197 1 23 . 1 1 9 9 GLY HA3 H 1 3.956 0.030 . 1 . . . . 9 GLY HA3 . 10197 1 24 . 1 1 9 9 GLY C C 13 174.007 0.300 . 1 . . . . 9 GLY C . 10197 1 25 . 1 1 10 10 GLU N N 15 120.558 0.300 . 1 . . . . 10 GLU N . 10197 1 26 . 1 1 10 10 GLU H H 1 8.068 0.030 . 1 . . . . 10 GLU H . 10197 1 27 . 1 1 10 10 GLU CA C 13 56.544 0.300 . 1 . . . . 10 GLU CA . 10197 1 28 . 1 1 10 10 GLU HA H 1 4.252 0.030 . 1 . . . . 10 GLU HA . 10197 1 29 . 1 1 10 10 GLU CB C 13 30.579 0.300 . 1 . . . . 10 GLU CB . 10197 1 30 . 1 1 10 10 GLU HB2 H 1 1.918 0.030 . 2 . . . . 10 GLU HB2 . 10197 1 31 . 1 1 10 10 GLU HB3 H 1 2.002 0.030 . 2 . . . . 10 GLU HB3 . 10197 1 32 . 1 1 10 10 GLU CG C 13 36.295 0.300 . 1 . . . . 10 GLU CG . 10197 1 33 . 1 1 10 10 GLU HG2 H 1 2.228 0.030 . 2 . . . . 10 GLU HG2 . 10197 1 34 . 1 1 10 10 GLU HG3 H 1 2.268 0.030 . 2 . . . . 10 GLU HG3 . 10197 1 35 . 1 1 10 10 GLU C C 13 176.309 0.300 . 1 . . . . 10 GLU C . 10197 1 36 . 1 1 11 11 LYS N N 15 122.155 0.300 . 1 . . . . 11 LYS N . 10197 1 37 . 1 1 11 11 LYS H H 1 8.398 0.030 . 1 . . . . 11 LYS H . 10197 1 38 . 1 1 11 11 LYS CA C 13 55.910 0.300 . 1 . . . . 11 LYS CA . 10197 1 39 . 1 1 11 11 LYS HA H 1 4.245 0.030 . 1 . . . . 11 LYS HA . 10197 1 40 . 1 1 11 11 LYS CB C 13 33.017 0.300 . 1 . . . . 11 LYS CB . 10197 1 41 . 1 1 11 11 LYS HB2 H 1 1.645 0.030 . 2 . . . . 11 LYS HB2 . 10197 1 42 . 1 1 11 11 LYS HB3 H 1 1.688 0.030 . 2 . . . . 11 LYS HB3 . 10197 1 43 . 1 1 11 11 LYS CG C 13 24.769 0.300 . 1 . . . . 11 LYS CG . 10197 1 44 . 1 1 11 11 LYS HG2 H 1 1.333 0.030 . 2 . . . . 11 LYS HG2 . 10197 1 45 . 1 1 11 11 LYS HG3 H 1 1.266 0.030 . 2 . . . . 11 LYS HG3 . 10197 1 46 . 1 1 11 11 LYS CD C 13 29.010 0.300 . 1 . . . . 11 LYS CD . 10197 1 47 . 1 1 11 11 LYS HD2 H 1 1.624 0.030 . 1 . . . . 11 LYS HD2 . 10197 1 48 . 1 1 11 11 LYS HD3 H 1 1.624 0.030 . 1 . . . . 11 LYS HD3 . 10197 1 49 . 1 1 11 11 LYS CE C 13 42.243 0.300 . 1 . . . . 11 LYS CE . 10197 1 50 . 1 1 11 11 LYS HE2 H 1 2.937 0.030 . 1 . . . . 11 LYS HE2 . 10197 1 51 . 1 1 11 11 LYS HE3 H 1 2.937 0.030 . 1 . . . . 11 LYS HE3 . 10197 1 52 . 1 1 11 11 LYS C C 13 175.280 0.300 . 1 . . . . 11 LYS C . 10197 1 53 . 1 1 12 12 CYS N N 15 119.118 0.300 . 1 . . . . 12 CYS N . 10197 1 54 . 1 1 12 12 CYS H H 1 7.956 0.030 . 1 . . . . 12 CYS H . 10197 1 55 . 1 1 12 12 CYS CA C 13 57.559 0.300 . 1 . . . . 12 CYS CA . 10197 1 56 . 1 1 12 12 CYS HA H 1 4.542 0.030 . 1 . . . . 12 CYS HA . 10197 1 57 . 1 1 12 12 CYS CB C 13 28.894 0.300 . 1 . . . . 12 CYS CB . 10197 1 58 . 1 1 12 12 CYS HB2 H 1 2.689 0.030 . 2 . . . . 12 CYS HB2 . 10197 1 59 . 1 1 12 12 CYS HB3 H 1 2.734 0.030 . 2 . . . . 12 CYS HB3 . 10197 1 60 . 1 1 12 12 CYS C C 13 172.990 0.300 . 1 . . . . 12 CYS C . 10197 1 61 . 1 1 13 13 TYR N N 15 124.152 0.300 . 1 . . . . 13 TYR N . 10197 1 62 . 1 1 13 13 TYR H H 1 8.727 0.030 . 1 . . . . 13 TYR H . 10197 1 63 . 1 1 13 13 TYR CA C 13 57.441 0.300 . 1 . . . . 13 TYR CA . 10197 1 64 . 1 1 13 13 TYR HA H 1 4.601 0.030 . 1 . . . . 13 TYR HA . 10197 1 65 . 1 1 13 13 TYR CB C 13 39.188 0.300 . 1 . . . . 13 TYR CB . 10197 1 66 . 1 1 13 13 TYR HB2 H 1 2.948 0.030 . 2 . . . . 13 TYR HB2 . 10197 1 67 . 1 1 13 13 TYR HB3 H 1 2.751 0.030 . 2 . . . . 13 TYR HB3 . 10197 1 68 . 1 1 13 13 TYR CD1 C 13 133.151 0.300 . 1 . . . . 13 TYR CD1 . 10197 1 69 . 1 1 13 13 TYR HD1 H 1 6.946 0.030 . 1 . . . . 13 TYR HD1 . 10197 1 70 . 1 1 13 13 TYR CD2 C 13 133.151 0.300 . 1 . . . . 13 TYR CD2 . 10197 1 71 . 1 1 13 13 TYR HD2 H 1 6.946 0.030 . 1 . . . . 13 TYR HD2 . 10197 1 72 . 1 1 13 13 TYR CE1 C 13 118.186 0.300 . 1 . . . . 13 TYR CE1 . 10197 1 73 . 1 1 13 13 TYR HE1 H 1 6.776 0.030 . 1 . . . . 13 TYR HE1 . 10197 1 74 . 1 1 13 13 TYR CE2 C 13 118.186 0.300 . 1 . . . . 13 TYR CE2 . 10197 1 75 . 1 1 13 13 TYR HE2 H 1 6.776 0.030 . 1 . . . . 13 TYR HE2 . 10197 1 76 . 1 1 13 13 TYR C C 13 174.171 0.300 . 1 . . . . 13 TYR C . 10197 1 77 . 1 1 14 14 LYS N N 15 125.412 0.300 . 1 . . . . 14 LYS N . 10197 1 78 . 1 1 14 14 LYS H H 1 8.727 0.030 . 1 . . . . 14 LYS H . 10197 1 79 . 1 1 14 14 LYS CA C 13 54.992 0.300 . 1 . . . . 14 LYS CA . 10197 1 80 . 1 1 14 14 LYS HA H 1 5.102 0.030 . 1 . . . . 14 LYS HA . 10197 1 81 . 1 1 14 14 LYS CB C 13 36.167 0.300 . 1 . . . . 14 LYS CB . 10197 1 82 . 1 1 14 14 LYS HB2 H 1 1.738 0.030 . 2 . . . . 14 LYS HB2 . 10197 1 83 . 1 1 14 14 LYS HB3 H 1 1.557 0.030 . 2 . . . . 14 LYS HB3 . 10197 1 84 . 1 1 14 14 LYS CG C 13 24.719 0.300 . 1 . . . . 14 LYS CG . 10197 1 85 . 1 1 14 14 LYS HG2 H 1 1.133 0.030 . 2 . . . . 14 LYS HG2 . 10197 1 86 . 1 1 14 14 LYS HG3 H 1 1.217 0.030 . 2 . . . . 14 LYS HG3 . 10197 1 87 . 1 1 14 14 LYS CD C 13 29.822 0.300 . 1 . . . . 14 LYS CD . 10197 1 88 . 1 1 14 14 LYS HD2 H 1 1.600 0.030 . 2 . . . . 14 LYS HD2 . 10197 1 89 . 1 1 14 14 LYS HD3 H 1 1.651 0.030 . 2 . . . . 14 LYS HD3 . 10197 1 90 . 1 1 14 14 LYS CE C 13 42.034 0.300 . 1 . . . . 14 LYS CE . 10197 1 91 . 1 1 14 14 LYS HE2 H 1 2.959 0.030 . 1 . . . . 14 LYS HE2 . 10197 1 92 . 1 1 14 14 LYS HE3 H 1 2.959 0.030 . 1 . . . . 14 LYS HE3 . 10197 1 93 . 1 1 14 14 LYS C C 13 175.134 0.300 . 1 . . . . 14 LYS C . 10197 1 94 . 1 1 15 15 CYS N N 15 127.849 0.300 . 1 . . . . 15 CYS N . 10197 1 95 . 1 1 15 15 CYS H H 1 9.310 0.030 . 1 . . . . 15 CYS H . 10197 1 96 . 1 1 15 15 CYS CA C 13 59.999 0.300 . 1 . . . . 15 CYS CA . 10197 1 97 . 1 1 15 15 CYS HA H 1 4.533 0.030 . 1 . . . . 15 CYS HA . 10197 1 98 . 1 1 15 15 CYS CB C 13 29.661 0.300 . 1 . . . . 15 CYS CB . 10197 1 99 . 1 1 15 15 CYS HB2 H 1 3.413 0.030 . 2 . . . . 15 CYS HB2 . 10197 1 100 . 1 1 15 15 CYS HB3 H 1 2.911 0.030 . 2 . . . . 15 CYS HB3 . 10197 1 101 . 1 1 15 15 CYS C C 13 176.848 0.300 . 1 . . . . 15 CYS C . 10197 1 102 . 1 1 16 16 ASP N N 15 115.181 0.300 . 1 . . . . 16 ASP N . 10197 1 103 . 1 1 16 16 ASP H H 1 9.321 0.030 . 1 . . . . 16 ASP H . 10197 1 104 . 1 1 16 16 ASP CA C 13 56.333 0.300 . 1 . . . . 16 ASP CA . 10197 1 105 . 1 1 16 16 ASP HA H 1 4.447 0.030 . 1 . . . . 16 ASP HA . 10197 1 106 . 1 1 16 16 ASP CB C 13 40.579 0.300 . 1 . . . . 16 ASP CB . 10197 1 107 . 1 1 16 16 ASP HB2 H 1 2.773 0.030 . 1 . . . . 16 ASP HB2 . 10197 1 108 . 1 1 16 16 ASP HB3 H 1 2.773 0.030 . 1 . . . . 16 ASP HB3 . 10197 1 109 . 1 1 16 16 ASP C C 13 175.969 0.300 . 1 . . . . 16 ASP C . 10197 1 110 . 1 1 17 17 VAL N N 15 121.861 0.300 . 1 . . . . 17 VAL N . 10197 1 111 . 1 1 17 17 VAL H H 1 8.757 0.030 . 1 . . . . 17 VAL H . 10197 1 112 . 1 1 17 17 VAL CA C 13 65.159 0.300 . 1 . . . . 17 VAL CA . 10197 1 113 . 1 1 17 17 VAL HA H 1 3.797 0.030 . 1 . . . . 17 VAL HA . 10197 1 114 . 1 1 17 17 VAL CB C 13 32.936 0.300 . 1 . . . . 17 VAL CB . 10197 1 115 . 1 1 17 17 VAL HB H 1 1.218 0.030 . 1 . . . . 17 VAL HB . 10197 1 116 . 1 1 17 17 VAL CG1 C 13 21.362 0.300 . 2 . . . . 17 VAL CG1 . 10197 1 117 . 1 1 17 17 VAL HG11 H 1 0.808 0.030 . 1 . . . . 17 VAL HG1 . 10197 1 118 . 1 1 17 17 VAL HG12 H 1 0.808 0.030 . 1 . . . . 17 VAL HG1 . 10197 1 119 . 1 1 17 17 VAL HG13 H 1 0.808 0.030 . 1 . . . . 17 VAL HG1 . 10197 1 120 . 1 1 17 17 VAL CG2 C 13 20.237 0.300 . 2 . . . . 17 VAL CG2 . 10197 1 121 . 1 1 17 17 VAL HG21 H 1 0.300 0.030 . 1 . . . . 17 VAL HG2 . 10197 1 122 . 1 1 17 17 VAL HG22 H 1 0.300 0.030 . 1 . . . . 17 VAL HG2 . 10197 1 123 . 1 1 17 17 VAL HG23 H 1 0.300 0.030 . 1 . . . . 17 VAL HG2 . 10197 1 124 . 1 1 17 17 VAL C C 13 177.154 0.300 . 1 . . . . 17 VAL C . 10197 1 125 . 1 1 18 18 CYS N N 15 115.378 0.300 . 1 . . . . 18 CYS N . 10197 1 126 . 1 1 18 18 CYS H H 1 8.044 0.030 . 1 . . . . 18 CYS H . 10197 1 127 . 1 1 18 18 CYS CA C 13 58.172 0.300 . 1 . . . . 18 CYS CA . 10197 1 128 . 1 1 18 18 CYS HA H 1 5.163 0.030 . 1 . . . . 18 CYS HA . 10197 1 129 . 1 1 18 18 CYS CB C 13 32.784 0.300 . 1 . . . . 18 CYS CB . 10197 1 130 . 1 1 18 18 CYS HB2 H 1 3.483 0.030 . 2 . . . . 18 CYS HB2 . 10197 1 131 . 1 1 18 18 CYS HB3 H 1 2.825 0.030 . 2 . . . . 18 CYS HB3 . 10197 1 132 . 1 1 18 18 CYS C C 13 176.540 0.300 . 1 . . . . 18 CYS C . 10197 1 133 . 1 1 19 19 GLY N N 15 113.425 0.300 . 1 . . . . 19 GLY N . 10197 1 134 . 1 1 19 19 GLY H H 1 8.066 0.030 . 1 . . . . 19 GLY H . 10197 1 135 . 1 1 19 19 GLY CA C 13 46.336 0.300 . 1 . . . . 19 GLY CA . 10197 1 136 . 1 1 19 19 GLY HA2 H 1 4.269 0.030 . 2 . . . . 19 GLY HA2 . 10197 1 137 . 1 1 19 19 GLY HA3 H 1 3.806 0.030 . 2 . . . . 19 GLY HA3 . 10197 1 138 . 1 1 19 19 GLY C C 13 173.558 0.300 . 1 . . . . 19 GLY C . 10197 1 139 . 1 1 20 20 LYS N N 15 123.276 0.300 . 1 . . . . 20 LYS N . 10197 1 140 . 1 1 20 20 LYS H H 1 8.018 0.030 . 1 . . . . 20 LYS H . 10197 1 141 . 1 1 20 20 LYS CA C 13 58.465 0.300 . 1 . . . . 20 LYS CA . 10197 1 142 . 1 1 20 20 LYS HA H 1 3.935 0.030 . 1 . . . . 20 LYS HA . 10197 1 143 . 1 1 20 20 LYS CB C 13 33.640 0.300 . 1 . . . . 20 LYS CB . 10197 1 144 . 1 1 20 20 LYS HB2 H 1 1.448 0.030 . 2 . . . . 20 LYS HB2 . 10197 1 145 . 1 1 20 20 LYS HB3 H 1 1.193 0.030 . 2 . . . . 20 LYS HB3 . 10197 1 146 . 1 1 20 20 LYS CG C 13 26.261 0.300 . 1 . . . . 20 LYS CG . 10197 1 147 . 1 1 20 20 LYS HG2 H 1 1.031 0.030 . 2 . . . . 20 LYS HG2 . 10197 1 148 . 1 1 20 20 LYS HG3 H 1 1.392 0.030 . 2 . . . . 20 LYS HG3 . 10197 1 149 . 1 1 20 20 LYS CD C 13 29.277 0.300 . 1 . . . . 20 LYS CD . 10197 1 150 . 1 1 20 20 LYS HD2 H 1 1.413 0.030 . 2 . . . . 20 LYS HD2 . 10197 1 151 . 1 1 20 20 LYS HD3 H 1 1.497 0.030 . 2 . . . . 20 LYS HD3 . 10197 1 152 . 1 1 20 20 LYS CE C 13 42.159 0.300 . 1 . . . . 20 LYS CE . 10197 1 153 . 1 1 20 20 LYS HE2 H 1 2.893 0.030 . 2 . . . . 20 LYS HE2 . 10197 1 154 . 1 1 20 20 LYS HE3 H 1 2.983 0.030 . 2 . . . . 20 LYS HE3 . 10197 1 155 . 1 1 20 20 LYS C C 13 174.303 0.300 . 1 . . . . 20 LYS C . 10197 1 156 . 1 1 21 21 GLU N N 15 120.572 0.300 . 1 . . . . 21 GLU N . 10197 1 157 . 1 1 21 21 GLU H H 1 7.893 0.030 . 1 . . . . 21 GLU H . 10197 1 158 . 1 1 21 21 GLU CA C 13 55.071 0.300 . 1 . . . . 21 GLU CA . 10197 1 159 . 1 1 21 21 GLU HA H 1 4.863 0.030 . 1 . . . . 21 GLU HA . 10197 1 160 . 1 1 21 21 GLU CB C 13 32.738 0.300 . 1 . . . . 21 GLU CB . 10197 1 161 . 1 1 21 21 GLU HB2 H 1 1.717 0.030 . 2 . . . . 21 GLU HB2 . 10197 1 162 . 1 1 21 21 GLU HB3 H 1 1.793 0.030 . 2 . . . . 21 GLU HB3 . 10197 1 163 . 1 1 21 21 GLU CG C 13 36.906 0.300 . 1 . . . . 21 GLU CG . 10197 1 164 . 1 1 21 21 GLU HG2 H 1 2.347 0.030 . 2 . . . . 21 GLU HG2 . 10197 1 165 . 1 1 21 21 GLU HG3 H 1 1.926 0.030 . 2 . . . . 21 GLU HG3 . 10197 1 166 . 1 1 21 21 GLU C C 13 175.442 0.300 . 1 . . . . 21 GLU C . 10197 1 167 . 1 1 22 22 PHE N N 15 118.232 0.300 . 1 . . . . 22 PHE N . 10197 1 168 . 1 1 22 22 PHE H H 1 8.808 0.030 . 1 . . . . 22 PHE H . 10197 1 169 . 1 1 22 22 PHE CA C 13 56.999 0.300 . 1 . . . . 22 PHE CA . 10197 1 170 . 1 1 22 22 PHE HA H 1 4.879 0.030 . 1 . . . . 22 PHE HA . 10197 1 171 . 1 1 22 22 PHE CB C 13 43.906 0.300 . 1 . . . . 22 PHE CB . 10197 1 172 . 1 1 22 22 PHE HB2 H 1 2.788 0.030 . 2 . . . . 22 PHE HB2 . 10197 1 173 . 1 1 22 22 PHE HB3 H 1 3.538 0.030 . 2 . . . . 22 PHE HB3 . 10197 1 174 . 1 1 22 22 PHE CD1 C 13 132.536 0.300 . 1 . . . . 22 PHE CD1 . 10197 1 175 . 1 1 22 22 PHE HD1 H 1 7.304 0.030 . 1 . . . . 22 PHE HD1 . 10197 1 176 . 1 1 22 22 PHE CD2 C 13 132.536 0.300 . 1 . . . . 22 PHE CD2 . 10197 1 177 . 1 1 22 22 PHE HD2 H 1 7.304 0.030 . 1 . . . . 22 PHE HD2 . 10197 1 178 . 1 1 22 22 PHE CE1 C 13 130.686 0.300 . 1 . . . . 22 PHE CE1 . 10197 1 179 . 1 1 22 22 PHE HE1 H 1 6.867 0.030 . 1 . . . . 22 PHE HE1 . 10197 1 180 . 1 1 22 22 PHE CE2 C 13 130.686 0.300 . 1 . . . . 22 PHE CE2 . 10197 1 181 . 1 1 22 22 PHE HE2 H 1 6.867 0.030 . 1 . . . . 22 PHE HE2 . 10197 1 182 . 1 1 22 22 PHE CZ C 13 128.822 0.300 . 1 . . . . 22 PHE CZ . 10197 1 183 . 1 1 22 22 PHE HZ H 1 6.231 0.030 . 1 . . . . 22 PHE HZ . 10197 1 184 . 1 1 22 22 PHE C C 13 175.502 0.300 . 1 . . . . 22 PHE C . 10197 1 185 . 1 1 23 23 SER CA C 13 59.319 0.300 . 1 . . . . 23 SER CA . 10197 1 186 . 1 1 23 23 SER HA H 1 4.872 0.030 . 1 . . . . 23 SER HA . 10197 1 187 . 1 1 23 23 SER CB C 13 64.471 0.300 . 1 . . . . 23 SER CB . 10197 1 188 . 1 1 23 23 SER HB2 H 1 4.035 0.030 . 2 . . . . 23 SER HB2 . 10197 1 189 . 1 1 23 23 SER HB3 H 1 4.172 0.030 . 2 . . . . 23 SER HB3 . 10197 1 190 . 1 1 23 23 SER C C 13 174.157 0.300 . 1 . . . . 23 SER C . 10197 1 191 . 1 1 24 24 GLN N N 15 115.876 0.300 . 1 . . . . 24 GLN N . 10197 1 192 . 1 1 24 24 GLN H H 1 7.123 0.030 . 1 . . . . 24 GLN H . 10197 1 193 . 1 1 24 24 GLN CA C 13 53.975 0.300 . 1 . . . . 24 GLN CA . 10197 1 194 . 1 1 24 24 GLN HA H 1 4.582 0.030 . 1 . . . . 24 GLN HA . 10197 1 195 . 1 1 24 24 GLN CB C 13 31.867 0.300 . 1 . . . . 24 GLN CB . 10197 1 196 . 1 1 24 24 GLN HB2 H 1 1.937 0.030 . 2 . . . . 24 GLN HB2 . 10197 1 197 . 1 1 24 24 GLN HB3 H 1 0.915 0.030 . 2 . . . . 24 GLN HB3 . 10197 1 198 . 1 1 24 24 GLN CG C 13 33.427 0.300 . 1 . . . . 24 GLN CG . 10197 1 199 . 1 1 24 24 GLN HG2 H 1 2.040 0.030 . 2 . . . . 24 GLN HG2 . 10197 1 200 . 1 1 24 24 GLN HG3 H 1 2.147 0.030 . 2 . . . . 24 GLN HG3 . 10197 1 201 . 1 1 24 24 GLN NE2 N 15 112.028 0.300 . 1 . . . . 24 GLN NE2 . 10197 1 202 . 1 1 24 24 GLN HE21 H 1 7.372 0.030 . 2 . . . . 24 GLN HE21 . 10197 1 203 . 1 1 24 24 GLN HE22 H 1 6.822 0.030 . 2 . . . . 24 GLN HE22 . 10197 1 204 . 1 1 24 24 GLN C C 13 175.839 0.300 . 1 . . . . 24 GLN C . 10197 1 205 . 1 1 25 25 SER CA C 13 61.060 0.300 . 1 . . . . 25 SER CA . 10197 1 206 . 1 1 25 25 SER HA H 1 3.107 0.030 . 1 . . . . 25 SER HA . 10197 1 207 . 1 1 25 25 SER CB C 13 61.929 0.300 . 1 . . . . 25 SER CB . 10197 1 208 . 1 1 25 25 SER HB2 H 1 3.348 0.030 . 2 . . . . 25 SER HB2 . 10197 1 209 . 1 1 25 25 SER HB3 H 1 3.505 0.030 . 2 . . . . 25 SER HB3 . 10197 1 210 . 1 1 26 26 SER CA C 13 61.019 0.300 . 1 . . . . 26 SER CA . 10197 1 211 . 1 1 26 26 SER HA H 1 4.054 0.030 . 1 . . . . 26 SER HA . 10197 1 212 . 1 1 26 26 SER CB C 13 61.700 0.300 . 1 . . . . 26 SER CB . 10197 1 213 . 1 1 26 26 SER HB2 H 1 3.851 0.030 . 2 . . . . 26 SER HB2 . 10197 1 214 . 1 1 26 26 SER C C 13 176.800 0.300 . 1 . . . . 26 SER C . 10197 1 215 . 1 1 27 27 HIS N N 15 120.923 0.300 . 1 . . . . 27 HIS N . 10197 1 216 . 1 1 27 27 HIS H H 1 6.656 0.030 . 1 . . . . 27 HIS H . 10197 1 217 . 1 1 27 27 HIS CA C 13 56.877 0.300 . 1 . . . . 27 HIS CA . 10197 1 218 . 1 1 27 27 HIS HA H 1 4.465 0.030 . 1 . . . . 27 HIS HA . 10197 1 219 . 1 1 27 27 HIS CB C 13 31.765 0.300 . 1 . . . . 27 HIS CB . 10197 1 220 . 1 1 27 27 HIS HB2 H 1 3.285 0.030 . 2 . . . . 27 HIS HB2 . 10197 1 221 . 1 1 27 27 HIS HB3 H 1 3.225 0.030 . 2 . . . . 27 HIS HB3 . 10197 1 222 . 1 1 27 27 HIS CD2 C 13 116.824 0.300 . 1 . . . . 27 HIS CD2 . 10197 1 223 . 1 1 27 27 HIS HD2 H 1 6.981 0.030 . 1 . . . . 27 HIS HD2 . 10197 1 224 . 1 1 27 27 HIS CE1 C 13 139.170 0.300 . 1 . . . . 27 HIS CE1 . 10197 1 225 . 1 1 27 27 HIS HE1 H 1 7.763 0.030 . 1 . . . . 27 HIS HE1 . 10197 1 226 . 1 1 27 27 HIS C C 13 178.354 0.300 . 1 . . . . 27 HIS C . 10197 1 227 . 1 1 28 28 LEU N N 15 121.000 0.300 . 1 . . . . 28 LEU N . 10197 1 228 . 1 1 28 28 LEU H H 1 6.955 0.030 . 1 . . . . 28 LEU H . 10197 1 229 . 1 1 28 28 LEU CA C 13 57.734 0.300 . 1 . . . . 28 LEU CA . 10197 1 230 . 1 1 28 28 LEU HA H 1 3.249 0.030 . 1 . . . . 28 LEU HA . 10197 1 231 . 1 1 28 28 LEU CB C 13 40.290 0.300 . 1 . . . . 28 LEU CB . 10197 1 232 . 1 1 28 28 LEU HB2 H 1 1.979 0.030 . 2 . . . . 28 LEU HB2 . 10197 1 233 . 1 1 28 28 LEU HB3 H 1 1.247 0.030 . 2 . . . . 28 LEU HB3 . 10197 1 234 . 1 1 28 28 LEU CG C 13 27.511 0.300 . 1 . . . . 28 LEU CG . 10197 1 235 . 1 1 28 28 LEU HG H 1 1.542 0.030 . 1 . . . . 28 LEU HG . 10197 1 236 . 1 1 28 28 LEU CD1 C 13 26.455 0.300 . 2 . . . . 28 LEU CD1 . 10197 1 237 . 1 1 28 28 LEU HD11 H 1 1.041 0.030 . 1 . . . . 28 LEU HD1 . 10197 1 238 . 1 1 28 28 LEU HD12 H 1 1.041 0.030 . 1 . . . . 28 LEU HD1 . 10197 1 239 . 1 1 28 28 LEU HD13 H 1 1.041 0.030 . 1 . . . . 28 LEU HD1 . 10197 1 240 . 1 1 28 28 LEU CD2 C 13 22.886 0.300 . 2 . . . . 28 LEU CD2 . 10197 1 241 . 1 1 28 28 LEU HD21 H 1 1.051 0.030 . 1 . . . . 28 LEU HD2 . 10197 1 242 . 1 1 28 28 LEU HD22 H 1 1.051 0.030 . 1 . . . . 28 LEU HD2 . 10197 1 243 . 1 1 28 28 LEU HD23 H 1 1.051 0.030 . 1 . . . . 28 LEU HD2 . 10197 1 244 . 1 1 28 28 LEU C C 13 177.380 0.300 . 1 . . . . 28 LEU C . 10197 1 245 . 1 1 29 29 GLN N N 15 118.542 0.300 . 1 . . . . 29 GLN N . 10197 1 246 . 1 1 29 29 GLN H H 1 8.074 0.030 . 1 . . . . 29 GLN H . 10197 1 247 . 1 1 29 29 GLN CA C 13 59.241 0.300 . 1 . . . . 29 GLN CA . 10197 1 248 . 1 1 29 29 GLN HA H 1 4.078 0.030 . 1 . . . . 29 GLN HA . 10197 1 249 . 1 1 29 29 GLN CB C 13 28.246 0.300 . 1 . . . . 29 GLN CB . 10197 1 250 . 1 1 29 29 GLN HB2 H 1 2.087 0.030 . 1 . . . . 29 GLN HB2 . 10197 1 251 . 1 1 29 29 GLN HB3 H 1 2.087 0.030 . 1 . . . . 29 GLN HB3 . 10197 1 252 . 1 1 29 29 GLN CG C 13 34.056 0.300 . 1 . . . . 29 GLN CG . 10197 1 253 . 1 1 29 29 GLN HG2 H 1 2.319 0.030 . 2 . . . . 29 GLN HG2 . 10197 1 254 . 1 1 29 29 GLN HG3 H 1 2.410 0.030 . 2 . . . . 29 GLN HG3 . 10197 1 255 . 1 1 29 29 GLN NE2 N 15 111.794 0.300 . 1 . . . . 29 GLN NE2 . 10197 1 256 . 1 1 29 29 GLN HE21 H 1 7.388 0.030 . 2 . . . . 29 GLN HE21 . 10197 1 257 . 1 1 29 29 GLN HE22 H 1 6.797 0.030 . 2 . . . . 29 GLN HE22 . 10197 1 258 . 1 1 29 29 GLN C C 13 179.270 0.300 . 1 . . . . 29 GLN C . 10197 1 259 . 1 1 30 30 THR N N 15 115.381 0.300 . 1 . . . . 30 THR N . 10197 1 260 . 1 1 30 30 THR H H 1 8.023 0.030 . 1 . . . . 30 THR H . 10197 1 261 . 1 1 30 30 THR CA C 13 66.331 0.300 . 1 . . . . 30 THR CA . 10197 1 262 . 1 1 30 30 THR HA H 1 3.857 0.030 . 1 . . . . 30 THR HA . 10197 1 263 . 1 1 30 30 THR CB C 13 68.800 0.300 . 1 . . . . 30 THR CB . 10197 1 264 . 1 1 30 30 THR HB H 1 4.094 0.030 . 1 . . . . 30 THR HB . 10197 1 265 . 1 1 30 30 THR CG2 C 13 22.048 0.300 . 1 . . . . 30 THR CG2 . 10197 1 266 . 1 1 30 30 THR HG21 H 1 1.213 0.030 . 1 . . . . 30 THR HG2 . 10197 1 267 . 1 1 30 30 THR HG22 H 1 1.213 0.030 . 1 . . . . 30 THR HG2 . 10197 1 268 . 1 1 30 30 THR HG23 H 1 1.213 0.030 . 1 . . . . 30 THR HG2 . 10197 1 269 . 1 1 30 30 THR C C 13 176.560 0.300 . 1 . . . . 30 THR C . 10197 1 270 . 1 1 31 31 HIS N N 15 121.437 0.300 . 1 . . . . 31 HIS N . 10197 1 271 . 1 1 31 31 HIS H H 1 7.611 0.030 . 1 . . . . 31 HIS H . 10197 1 272 . 1 1 31 31 HIS CA C 13 59.124 0.300 . 1 . . . . 31 HIS CA . 10197 1 273 . 1 1 31 31 HIS HA H 1 4.227 0.030 . 1 . . . . 31 HIS HA . 10197 1 274 . 1 1 31 31 HIS CB C 13 28.616 0.300 . 1 . . . . 31 HIS CB . 10197 1 275 . 1 1 31 31 HIS HB2 H 1 3.137 0.030 . 2 . . . . 31 HIS HB2 . 10197 1 276 . 1 1 31 31 HIS HB3 H 1 2.912 0.030 . 2 . . . . 31 HIS HB3 . 10197 1 277 . 1 1 31 31 HIS CD2 C 13 127.132 0.300 . 1 . . . . 31 HIS CD2 . 10197 1 278 . 1 1 31 31 HIS HD2 H 1 6.947 0.030 . 1 . . . . 31 HIS HD2 . 10197 1 279 . 1 1 31 31 HIS CE1 C 13 139.909 0.300 . 1 . . . . 31 HIS CE1 . 10197 1 280 . 1 1 31 31 HIS HE1 H 1 8.054 0.030 . 1 . . . . 31 HIS HE1 . 10197 1 281 . 1 1 31 31 HIS C C 13 175.895 0.300 . 1 . . . . 31 HIS C . 10197 1 282 . 1 1 32 32 GLN N N 15 115.030 0.300 . 1 . . . . 32 GLN N . 10197 1 283 . 1 1 32 32 GLN H H 1 8.285 0.030 . 1 . . . . 32 GLN H . 10197 1 284 . 1 1 32 32 GLN CA C 13 59.440 0.300 . 1 . . . . 32 GLN CA . 10197 1 285 . 1 1 32 32 GLN HA H 1 3.680 0.030 . 1 . . . . 32 GLN HA . 10197 1 286 . 1 1 32 32 GLN CB C 13 28.287 0.300 . 1 . . . . 32 GLN CB . 10197 1 287 . 1 1 32 32 GLN HB2 H 1 2.219 0.030 . 2 . . . . 32 GLN HB2 . 10197 1 288 . 1 1 32 32 GLN HB3 H 1 2.296 0.030 . 2 . . . . 32 GLN HB3 . 10197 1 289 . 1 1 32 32 GLN CG C 13 35.152 0.300 . 1 . . . . 32 GLN CG . 10197 1 290 . 1 1 32 32 GLN HG2 H 1 2.793 0.030 . 1 . . . . 32 GLN HG2 . 10197 1 291 . 1 1 32 32 GLN HG3 H 1 2.793 0.030 . 1 . . . . 32 GLN HG3 . 10197 1 292 . 1 1 32 32 GLN NE2 N 15 112.574 0.300 . 1 . . . . 32 GLN NE2 . 10197 1 293 . 1 1 32 32 GLN HE21 H 1 7.515 0.030 . 2 . . . . 32 GLN HE21 . 10197 1 294 . 1 1 32 32 GLN HE22 H 1 7.051 0.030 . 2 . . . . 32 GLN HE22 . 10197 1 295 . 1 1 32 32 GLN C C 13 177.393 0.300 . 1 . . . . 32 GLN C . 10197 1 296 . 1 1 33 33 ARG N N 15 117.259 0.300 . 1 . . . . 33 ARG N . 10197 1 297 . 1 1 33 33 ARG H H 1 7.113 0.030 . 1 . . . . 33 ARG H . 10197 1 298 . 1 1 33 33 ARG CA C 13 58.407 0.300 . 1 . . . . 33 ARG CA . 10197 1 299 . 1 1 33 33 ARG HA H 1 4.158 0.030 . 1 . . . . 33 ARG HA . 10197 1 300 . 1 1 33 33 ARG CB C 13 29.987 0.300 . 1 . . . . 33 ARG CB . 10197 1 301 . 1 1 33 33 ARG HB2 H 1 1.816 0.030 . 2 . . . . 33 ARG HB2 . 10197 1 302 . 1 1 33 33 ARG HB3 H 1 1.906 0.030 . 2 . . . . 33 ARG HB3 . 10197 1 303 . 1 1 33 33 ARG CG C 13 27.565 0.300 . 1 . . . . 33 ARG CG . 10197 1 304 . 1 1 33 33 ARG HG2 H 1 1.690 0.030 . 2 . . . . 33 ARG HG2 . 10197 1 305 . 1 1 33 33 ARG HG3 H 1 1.823 0.030 . 2 . . . . 33 ARG HG3 . 10197 1 306 . 1 1 33 33 ARG CD C 13 43.520 0.300 . 1 . . . . 33 ARG CD . 10197 1 307 . 1 1 33 33 ARG HD2 H 1 3.217 0.030 . 1 . . . . 33 ARG HD2 . 10197 1 308 . 1 1 33 33 ARG HD3 H 1 3.217 0.030 . 1 . . . . 33 ARG HD3 . 10197 1 309 . 1 1 33 33 ARG C C 13 178.523 0.300 . 1 . . . . 33 ARG C . 10197 1 310 . 1 1 34 34 VAL N N 15 116.132 0.300 . 1 . . . . 34 VAL N . 10197 1 311 . 1 1 34 34 VAL H H 1 7.926 0.030 . 1 . . . . 34 VAL H . 10197 1 312 . 1 1 34 34 VAL CA C 13 64.005 0.300 . 1 . . . . 34 VAL CA . 10197 1 313 . 1 1 34 34 VAL HA H 1 3.917 0.030 . 1 . . . . 34 VAL HA . 10197 1 314 . 1 1 34 34 VAL CB C 13 31.133 0.300 . 1 . . . . 34 VAL CB . 10197 1 315 . 1 1 34 34 VAL HB H 1 1.896 0.030 . 1 . . . . 34 VAL HB . 10197 1 316 . 1 1 34 34 VAL CG1 C 13 19.833 0.300 . 2 . . . . 34 VAL CG1 . 10197 1 317 . 1 1 34 34 VAL HG11 H 1 0.644 0.030 . 1 . . . . 34 VAL HG1 . 10197 1 318 . 1 1 34 34 VAL HG12 H 1 0.644 0.030 . 1 . . . . 34 VAL HG1 . 10197 1 319 . 1 1 34 34 VAL HG13 H 1 0.644 0.030 . 1 . . . . 34 VAL HG1 . 10197 1 320 . 1 1 34 34 VAL CG2 C 13 19.481 0.300 . 2 . . . . 34 VAL CG2 . 10197 1 321 . 1 1 34 34 VAL HG21 H 1 0.484 0.030 . 1 . . . . 34 VAL HG2 . 10197 1 322 . 1 1 34 34 VAL HG22 H 1 0.484 0.030 . 1 . . . . 34 VAL HG2 . 10197 1 323 . 1 1 34 34 VAL HG23 H 1 0.484 0.030 . 1 . . . . 34 VAL HG2 . 10197 1 324 . 1 1 34 34 VAL C C 13 177.246 0.300 . 1 . . . . 34 VAL C . 10197 1 325 . 1 1 35 35 HIS N N 15 116.613 0.300 . 1 . . . . 35 HIS N . 10197 1 326 . 1 1 35 35 HIS H H 1 7.200 0.030 . 1 . . . . 35 HIS H . 10197 1 327 . 1 1 35 35 HIS CA C 13 54.962 0.300 . 1 . . . . 35 HIS CA . 10197 1 328 . 1 1 35 35 HIS HA H 1 4.945 0.030 . 1 . . . . 35 HIS HA . 10197 1 329 . 1 1 35 35 HIS CB C 13 28.553 0.300 . 1 . . . . 35 HIS CB . 10197 1 330 . 1 1 35 35 HIS HB2 H 1 3.304 0.030 . 2 . . . . 35 HIS HB2 . 10197 1 331 . 1 1 35 35 HIS HB3 H 1 3.399 0.030 . 2 . . . . 35 HIS HB3 . 10197 1 332 . 1 1 35 35 HIS CD2 C 13 127.610 0.300 . 1 . . . . 35 HIS CD2 . 10197 1 333 . 1 1 35 35 HIS HD2 H 1 6.733 0.030 . 1 . . . . 35 HIS HD2 . 10197 1 334 . 1 1 35 35 HIS CE1 C 13 140.373 0.300 . 1 . . . . 35 HIS CE1 . 10197 1 335 . 1 1 35 35 HIS HE1 H 1 8.112 0.030 . 1 . . . . 35 HIS HE1 . 10197 1 336 . 1 1 35 35 HIS C C 13 175.670 0.300 . 1 . . . . 35 HIS C . 10197 1 337 . 1 1 36 36 THR N N 15 112.053 0.300 . 1 . . . . 36 THR N . 10197 1 338 . 1 1 36 36 THR H H 1 7.769 0.030 . 1 . . . . 36 THR H . 10197 1 339 . 1 1 36 36 THR CA C 13 62.692 0.300 . 1 . . . . 36 THR CA . 10197 1 340 . 1 1 36 36 THR HA H 1 4.347 0.030 . 1 . . . . 36 THR HA . 10197 1 341 . 1 1 36 36 THR CB C 13 69.819 0.300 . 1 . . . . 36 THR CB . 10197 1 342 . 1 1 36 36 THR HB H 1 4.320 0.030 . 1 . . . . 36 THR HB . 10197 1 343 . 1 1 36 36 THR CG2 C 13 21.584 0.300 . 1 . . . . 36 THR CG2 . 10197 1 344 . 1 1 36 36 THR HG21 H 1 1.250 0.030 . 1 . . . . 36 THR HG2 . 10197 1 345 . 1 1 36 36 THR HG22 H 1 1.250 0.030 . 1 . . . . 36 THR HG2 . 10197 1 346 . 1 1 36 36 THR HG23 H 1 1.250 0.030 . 1 . . . . 36 THR HG2 . 10197 1 347 . 1 1 36 36 THR C C 13 175.500 0.300 . 1 . . . . 36 THR C . 10197 1 348 . 1 1 37 37 GLY CA C 13 45.299 0.300 . 1 . . . . 37 GLY CA . 10197 1 349 . 1 1 37 37 GLY HA2 H 1 3.936 0.030 . 2 . . . . 37 GLY HA2 . 10197 1 350 . 1 1 37 37 GLY C C 13 173.971 0.300 . 1 . . . . 37 GLY C . 10197 1 351 . 1 1 38 38 GLU N N 15 120.577 0.300 . 1 . . . . 38 GLU N . 10197 1 352 . 1 1 38 38 GLU H H 1 8.266 0.030 . 1 . . . . 38 GLU H . 10197 1 353 . 1 1 38 38 GLU CA C 13 56.543 0.300 . 1 . . . . 38 GLU CA . 10197 1 354 . 1 1 38 38 GLU HA H 1 4.272 0.030 . 1 . . . . 38 GLU HA . 10197 1 355 . 1 1 38 38 GLU CB C 13 30.449 0.300 . 1 . . . . 38 GLU CB . 10197 1 356 . 1 1 38 38 GLU HB2 H 1 1.891 0.030 . 2 . . . . 38 GLU HB2 . 10197 1 357 . 1 1 38 38 GLU HB3 H 1 2.032 0.030 . 2 . . . . 38 GLU HB3 . 10197 1 358 . 1 1 38 38 GLU CG C 13 36.294 0.300 . 1 . . . . 38 GLU CG . 10197 1 359 . 1 1 38 38 GLU HG2 H 1 2.251 0.030 . 1 . . . . 38 GLU HG2 . 10197 1 360 . 1 1 38 38 GLU HG3 H 1 2.251 0.030 . 1 . . . . 38 GLU HG3 . 10197 1 361 . 1 1 38 38 GLU C C 13 176.313 0.300 . 1 . . . . 38 GLU C . 10197 1 362 . 1 1 39 39 LYS N N 15 123.814 0.300 . 1 . . . . 39 LYS N . 10197 1 363 . 1 1 39 39 LYS H H 1 8.418 0.030 . 1 . . . . 39 LYS H . 10197 1 364 . 1 1 39 39 LYS CA C 13 54.156 0.300 . 1 . . . . 39 LYS CA . 10197 1 365 . 1 1 39 39 LYS HA H 1 4.611 0.030 . 1 . . . . 39 LYS HA . 10197 1 366 . 1 1 39 39 LYS CB C 13 32.558 0.300 . 1 . . . . 39 LYS CB . 10197 1 367 . 1 1 39 39 LYS HB2 H 1 1.730 0.030 . 2 . . . . 39 LYS HB2 . 10197 1 368 . 1 1 39 39 LYS HB3 H 1 1.820 0.030 . 2 . . . . 39 LYS HB3 . 10197 1 369 . 1 1 39 39 LYS CG C 13 24.515 0.300 . 1 . . . . 39 LYS CG . 10197 1 370 . 1 1 39 39 LYS HG2 H 1 1.470 0.030 . 1 . . . . 39 LYS HG2 . 10197 1 371 . 1 1 39 39 LYS HG3 H 1 1.470 0.030 . 1 . . . . 39 LYS HG3 . 10197 1 372 . 1 1 39 39 LYS CD C 13 29.180 0.300 . 1 . . . . 39 LYS CD . 10197 1 373 . 1 1 39 39 LYS HD2 H 1 1.691 0.030 . 1 . . . . 39 LYS HD2 . 10197 1 374 . 1 1 39 39 LYS HD3 H 1 1.691 0.030 . 1 . . . . 39 LYS HD3 . 10197 1 375 . 1 1 39 39 LYS CE C 13 42.171 0.300 . 1 . . . . 39 LYS CE . 10197 1 376 . 1 1 39 39 LYS HE2 H 1 3.002 0.030 . 2 . . . . 39 LYS HE2 . 10197 1 377 . 1 1 39 39 LYS C C 13 174.459 0.300 . 1 . . . . 39 LYS C . 10197 1 378 . 1 1 40 40 PRO CA C 13 63.278 0.300 . 1 . . . . 40 PRO CA . 10197 1 379 . 1 1 40 40 PRO HA H 1 4.465 0.030 . 1 . . . . 40 PRO HA . 10197 1 380 . 1 1 40 40 PRO CB C 13 32.181 0.300 . 1 . . . . 40 PRO CB . 10197 1 381 . 1 1 40 40 PRO HB2 H 1 2.305 0.030 . 2 . . . . 40 PRO HB2 . 10197 1 382 . 1 1 40 40 PRO HB3 H 1 1.935 0.030 . 2 . . . . 40 PRO HB3 . 10197 1 383 . 1 1 40 40 PRO CG C 13 27.426 0.300 . 1 . . . . 40 PRO CG . 10197 1 384 . 1 1 40 40 PRO HG2 H 1 2.017 0.030 . 1 . . . . 40 PRO HG2 . 10197 1 385 . 1 1 40 40 PRO HG3 H 1 2.017 0.030 . 1 . . . . 40 PRO HG3 . 10197 1 386 . 1 1 40 40 PRO CD C 13 50.698 0.300 . 1 . . . . 40 PRO CD . 10197 1 387 . 1 1 40 40 PRO HD2 H 1 3.644 0.030 . 2 . . . . 40 PRO HD2 . 10197 1 388 . 1 1 40 40 PRO HD3 H 1 3.819 0.030 . 2 . . . . 40 PRO HD3 . 10197 1 389 . 1 1 42 42 GLY CA C 13 44.677 0.300 . 1 . . . . 42 GLY CA . 10197 1 390 . 1 1 42 42 GLY HA2 H 1 4.162 0.030 . 2 . . . . 42 GLY HA2 . 10197 1 391 . 1 1 42 42 GLY HA3 H 1 4.112 0.030 . 2 . . . . 42 GLY HA3 . 10197 1 392 . 1 1 43 43 PRO CA C 13 63.257 0.300 . 1 . . . . 43 PRO CA . 10197 1 393 . 1 1 43 43 PRO HA H 1 4.479 0.030 . 1 . . . . 43 PRO HA . 10197 1 394 . 1 1 43 43 PRO CB C 13 32.210 0.300 . 1 . . . . 43 PRO CB . 10197 1 395 . 1 1 43 43 PRO HB2 H 1 1.976 0.030 . 2 . . . . 43 PRO HB2 . 10197 1 396 . 1 1 43 43 PRO CG C 13 27.186 0.300 . 1 . . . . 43 PRO CG . 10197 1 397 . 1 1 43 43 PRO HG2 H 1 2.018 0.030 . 1 . . . . 43 PRO HG2 . 10197 1 398 . 1 1 43 43 PRO HG3 H 1 2.018 0.030 . 1 . . . . 43 PRO HG3 . 10197 1 399 . 1 1 43 43 PRO CD C 13 49.811 0.300 . 1 . . . . 43 PRO CD . 10197 1 400 . 1 1 43 43 PRO HD2 H 1 3.627 0.030 . 1 . . . . 43 PRO HD2 . 10197 1 401 . 1 1 43 43 PRO HD3 H 1 3.627 0.030 . 1 . . . . 43 PRO HD3 . 10197 1 402 . 1 1 45 45 SER CA C 13 58.380 0.300 . 1 . . . . 45 SER CA . 10197 1 403 . 1 1 45 45 SER HA H 1 4.440 0.030 . 1 . . . . 45 SER HA . 10197 1 404 . 1 1 45 45 SER CB C 13 64.123 0.300 . 1 . . . . 45 SER CB . 10197 1 405 . 1 1 45 45 SER HB2 H 1 3.833 0.030 . 2 . . . . 45 SER HB2 . 10197 1 406 . 1 1 45 45 SER C C 13 173.895 0.300 . 1 . . . . 45 SER C . 10197 1 407 . 1 1 46 46 GLY N N 15 116.861 0.300 . 1 . . . . 46 GLY N . 10197 1 408 . 1 1 46 46 GLY H H 1 8.043 0.030 . 1 . . . . 46 GLY H . 10197 1 409 . 1 1 46 46 GLY CA C 13 46.221 0.300 . 1 . . . . 46 GLY CA . 10197 1 410 . 1 1 46 46 GLY C C 13 178.966 0.300 . 1 . . . . 46 GLY C . 10197 1 stop_ save_