################################### # 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_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30028 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_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 HNCACB' . . . 30028 1 2 '2D 1H-15N HSQC' . . . 30028 1 3 '3D 1H-15N NOESY' . . . 30028 1 4 '3D 1H-13C NOESY' . . . 30028 1 5 '3D HNCO' . . . 30028 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 30028 1 2 $software_2 . . 30028 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 1 1 GLY C C 13 169.869 0.000 . 1 . . 1 A 1 GLY C . 30028 1 2 . 1 1 2 2 SER C C 13 174.927 0.000 . 1 . . 1 A 2 SER C . 30028 1 3 . 1 1 2 2 SER CA C 13 57.706 0.000 . 1 . . 1 A 2 SER CA . 30028 1 4 . 1 1 2 2 SER CB C 13 64.987 0.000 . 1 . . 1 A 2 SER CB . 30028 1 5 . 1 1 2 2 SER H H 1 8.655 0.000 . 1 . . 1 A 2 SER H . 30028 1 6 . 1 1 2 2 SER HA H 1 4.606 0.006 . 1 . . 1 A 2 SER HA . 30028 1 7 . 1 1 2 2 SER HB3 H 1 4.103 0.000 . 2 . . 1 A 2 SER HB3 . 30028 1 8 . 1 1 2 2 SER HB2 H 1 3.887 0.014 . 2 . . 1 A 2 SER HB2 . 30028 1 9 . 1 1 2 2 SER HG H 1 2.051 0.006 . 1 . . 1 A 2 SER HG . 30028 1 10 . 1 1 2 2 SER N N 15 115.440 0.000 . 1 . . 1 A 2 SER N . 30028 1 11 . 1 1 3 3 MET C C 13 177.436 0.000 . 1 . . 1 A 3 MET C . 30028 1 12 . 1 1 3 3 MET CA C 13 58.646 0.000 . 1 . . 1 A 3 MET CA . 30028 1 13 . 1 1 3 3 MET CB C 13 32.104 0.000 . 1 . . 1 A 3 MET CB . 30028 1 14 . 1 1 3 3 MET H H 1 8.914 0.007 . 1 . . 1 A 3 MET H . 30028 1 15 . 1 1 3 3 MET HA H 1 4.179 0.019 . 1 . . 1 A 3 MET HA . 30028 1 16 . 1 1 3 3 MET HB3 H 1 2.524 0.022 . 2 . . 1 A 3 MET HB3 . 30028 1 17 . 1 1 3 3 MET HB2 H 1 2.079 0.014 . 2 . . 1 A 3 MET HB2 . 30028 1 18 . 1 1 3 3 MET N N 15 122.381 0.000 . 1 . . 1 A 3 MET N . 30028 1 19 . 1 1 4 4 LYS C C 13 177.860 0.000 . 1 . . 1 A 4 LYS C . 30028 1 20 . 1 1 4 4 LYS CA C 13 59.006 0.000 . 1 . . 1 A 4 LYS CA . 30028 1 21 . 1 1 4 4 LYS CB C 13 32.415 0.000 . 1 . . 1 A 4 LYS CB . 30028 1 22 . 1 1 4 4 LYS CD C 13 27.300 0.000 . 1 . . 1 A 4 LYS CD . 30028 1 23 . 1 1 4 4 LYS H H 1 8.221 0.022 . 1 . . 1 A 4 LYS H . 30028 1 24 . 1 1 4 4 LYS HA H 1 4.107 0.000 . 1 . . 1 A 4 LYS HA . 30028 1 25 . 1 1 4 4 LYS HB3 H 1 1.725 0.004 . 1 . . 1 A 4 LYS HB3 . 30028 1 26 . 1 1 4 4 LYS HB2 H 1 1.725 0.004 . 1 . . 1 A 4 LYS HB2 . 30028 1 27 . 1 1 4 4 LYS HD3 H 1 0.888 0.000 . 2 . . 1 A 4 LYS HD3 . 30028 1 28 . 1 1 4 4 LYS HD2 H 1 1.751 0.000 . 2 . . 1 A 4 LYS HD2 . 30028 1 29 . 1 1 4 4 LYS HE3 H 1 3.322 0.004 . 1 . . 1 A 4 LYS HE3 . 30028 1 30 . 1 1 4 4 LYS HG3 H 1 1.998 0.000 . 2 . . 1 A 4 LYS HG3 . 30028 1 31 . 1 1 4 4 LYS HG2 H 1 1.356 0.000 . 2 . . 1 A 4 LYS HG2 . 30028 1 32 . 1 1 4 4 LYS N N 15 119.588 0.000 . 1 . . 1 A 4 LYS N . 30028 1 33 . 1 1 5 5 GLN C C 13 179.608 0.000 . 1 . . 1 A 5 GLN C . 30028 1 34 . 1 1 5 5 GLN CA C 13 59.100 0.000 . 1 . . 1 A 5 GLN CA . 30028 1 35 . 1 1 5 5 GLN CB C 13 28.473 0.000 . 1 . . 1 A 5 GLN CB . 30028 1 36 . 1 1 5 5 GLN CG C 13 35.094 0.000 . 1 . . 1 A 5 GLN CG . 30028 1 37 . 1 1 5 5 GLN H H 1 7.800 0.005 . 1 . . 1 A 5 GLN H . 30028 1 38 . 1 1 5 5 GLN HA H 1 4.106 0.013 . 1 . . 1 A 5 GLN HA . 30028 1 39 . 1 1 5 5 GLN HB3 H 1 1.725 0.009 . 1 . . 1 A 5 GLN HB3 . 30028 1 40 . 1 1 5 5 GLN HB2 H 1 1.725 0.009 . 1 . . 1 A 5 GLN HB2 . 30028 1 41 . 1 1 5 5 GLN HE21 H 1 7.585 0.000 . 1 . . 1 A 5 GLN HE21 . 30028 1 42 . 1 1 5 5 GLN HE22 H 1 6.892 0.010 . 1 . . 1 A 5 GLN HE22 . 30028 1 43 . 1 1 5 5 GLN HG3 H 1 2.421 0.018 . 2 . . 1 A 5 GLN HG3 . 30028 1 44 . 1 1 5 5 GLN HG2 H 1 2.416 0.013 . 2 . . 1 A 5 GLN HG2 . 30028 1 45 . 1 1 5 5 GLN N N 15 116.850 0.000 . 1 . . 1 A 5 GLN N . 30028 1 46 . 1 1 5 5 GLN NE2 N 15 111.678 0.000 . 1 . . 1 A 5 GLN NE2 . 30028 1 47 . 1 1 6 6 LEU C C 13 179.408 0.000 . 1 . . 1 A 6 LEU C . 30028 1 48 . 1 1 6 6 LEU CA C 13 57.936 0.000 . 1 . . 1 A 6 LEU CA . 30028 1 49 . 1 1 6 6 LEU CB C 13 42.755 0.000 . 1 . . 1 A 6 LEU CB . 30028 1 50 . 1 1 6 6 LEU CD1 C 13 22.000 0.000 . 2 . . 1 A 6 LEU CD1 . 30028 1 51 . 1 1 6 6 LEU CD2 C 13 23.100 0.000 . 2 . . 1 A 6 LEU CD2 . 30028 1 52 . 1 1 6 6 LEU CG C 13 27.750 0.000 . 1 . . 1 A 6 LEU CG . 30028 1 53 . 1 1 6 6 LEU H H 1 7.891 0.000 . 1 . . 1 A 6 LEU H . 30028 1 54 . 1 1 6 6 LEU HA H 1 4.161 0.010 . 1 . . 1 A 6 LEU HA . 30028 1 55 . 1 1 6 6 LEU HB3 H 1 1.428 0.015 . 2 . . 1 A 6 LEU HB3 . 30028 1 56 . 1 1 6 6 LEU HB2 H 1 1.974 0.008 . 2 . . 1 A 6 LEU HB2 . 30028 1 57 . 1 1 6 6 LEU HD11 H 1 0.848 0.026 . 2 . . 1 A 6 LEU HD11 . 30028 1 58 . 1 1 6 6 LEU HD12 H 1 0.848 0.026 . 2 . . 1 A 6 LEU HD12 . 30028 1 59 . 1 1 6 6 LEU HD13 H 1 0.848 0.026 . 2 . . 1 A 6 LEU HD13 . 30028 1 60 . 1 1 6 6 LEU HD21 H 1 0.865 0.012 . 2 . . 1 A 6 LEU HD21 . 30028 1 61 . 1 1 6 6 LEU HD22 H 1 0.865 0.012 . 2 . . 1 A 6 LEU HD22 . 30028 1 62 . 1 1 6 6 LEU HD23 H 1 0.865 0.012 . 2 . . 1 A 6 LEU HD23 . 30028 1 63 . 1 1 6 6 LEU HG H 1 1.788 0.005 . 1 . . 1 A 6 LEU HG . 30028 1 64 . 1 1 6 6 LEU N N 15 120.694 0.000 . 1 . . 1 A 6 LEU N . 30028 1 65 . 1 1 7 7 GLU C C 13 178.297 0.000 . 1 . . 1 A 7 GLU C . 30028 1 66 . 1 1 7 7 GLU CA C 13 59.580 0.020 . 1 . . 1 A 7 GLU CA . 30028 1 67 . 1 1 7 7 GLU CB C 13 28.188 0.000 . 1 . . 1 A 7 GLU CB . 30028 1 68 . 1 1 7 7 GLU CG C 13 34.753 0.000 . 1 . . 1 A 7 GLU CG . 30028 1 69 . 1 1 7 7 GLU H H 1 8.546 0.012 . 1 . . 1 A 7 GLU H . 30028 1 70 . 1 1 7 7 GLU HA H 1 3.919 0.017 . 1 . . 1 A 7 GLU HA . 30028 1 71 . 1 1 7 7 GLU HB3 H 1 2.237 0.000 . 2 . . 1 A 7 GLU HB3 . 30028 1 72 . 1 1 7 7 GLU HB2 H 1 2.093 0.000 . 2 . . 1 A 7 GLU HB2 . 30028 1 73 . 1 1 7 7 GLU HG3 H 1 2.504 0.008 . 2 . . 1 A 7 GLU HG3 . 30028 1 74 . 1 1 7 7 GLU HG2 H 1 2.177 0.011 . 2 . . 1 A 7 GLU HG2 . 30028 1 75 . 1 1 7 7 GLU N N 15 120.490 0.000 . 1 . . 1 A 7 GLU N . 30028 1 76 . 1 1 8 8 ASP C C 13 178.449 0.000 . 1 . . 1 A 8 ASP C . 30028 1 77 . 1 1 8 8 ASP CA C 13 57.000 0.000 . 1 . . 1 A 8 ASP CA . 30028 1 78 . 1 1 8 8 ASP CB C 13 39.248 0.000 . 1 . . 1 A 8 ASP CB . 30028 1 79 . 1 1 8 8 ASP H H 1 8.568 0.003 . 1 . . 1 A 8 ASP H . 30028 1 80 . 1 1 8 8 ASP HA H 1 4.364 0.018 . 1 . . 1 A 8 ASP HA . 30028 1 81 . 1 1 8 8 ASP HB3 H 1 2.703 0.011 . 2 . . 1 A 8 ASP HB3 . 30028 1 82 . 1 1 8 8 ASP HB2 H 1 2.885 0.009 . 2 . . 1 A 8 ASP HB2 . 30028 1 83 . 1 1 8 8 ASP N N 15 119.579 0.000 . 1 . . 1 A 8 ASP N . 30028 1 84 . 1 1 9 9 LYS C C 13 178.417 0.000 . 1 . . 1 A 9 LYS C . 30028 1 85 . 1 1 9 9 LYS CA C 13 58.623 0.000 . 1 . . 1 A 9 LYS CA . 30028 1 86 . 1 1 9 9 LYS CB C 13 31.389 0.000 . 1 . . 1 A 9 LYS CB . 30028 1 87 . 1 1 9 9 LYS CE C 13 42.994 0.000 . 1 . . 1 A 9 LYS CE . 30028 1 88 . 1 1 9 9 LYS CG C 13 24.697 0.000 . 1 . . 1 A 9 LYS CG . 30028 1 89 . 1 1 9 9 LYS H H 1 7.894 0.011 . 1 . . 1 A 9 LYS H . 30028 1 90 . 1 1 9 9 LYS HA H 1 4.179 0.006 . 1 . . 1 A 9 LYS HA . 30028 1 91 . 1 1 9 9 LYS HB3 H 1 1.689 0.018 . 2 . . 1 A 9 LYS HB3 . 30028 1 92 . 1 1 9 9 LYS HB2 H 1 1.997 0.015 . 2 . . 1 A 9 LYS HB2 . 30028 1 93 . 1 1 9 9 LYS HD3 H 1 0.879 0.007 . 2 . . 1 A 9 LYS HD3 . 30028 1 94 . 1 1 9 9 LYS HD2 H 1 1.613 0.010 . 2 . . 1 A 9 LYS HD2 . 30028 1 95 . 1 1 9 9 LYS HE3 H 1 3.065 0.001 . 2 . . 1 A 9 LYS HE3 . 30028 1 96 . 1 1 9 9 LYS HE2 H 1 3.343 0.000 . 2 . . 1 A 9 LYS HE2 . 30028 1 97 . 1 1 9 9 LYS HG3 H 1 1.503 0.008 . 2 . . 1 A 9 LYS HG3 . 30028 1 98 . 1 1 9 9 LYS HG2 H 1 1.705 0.000 . 2 . . 1 A 9 LYS HG2 . 30028 1 99 . 1 1 9 9 LYS N N 15 122.658 0.000 . 1 . . 1 A 9 LYS N . 30028 1 100 . 1 1 10 10 VAL C C 13 177.150 0.000 . 1 . . 1 A 10 VAL C . 30028 1 101 . 1 1 10 10 VAL CA C 13 67.707 0.000 . 1 . . 1 A 10 VAL CA . 30028 1 102 . 1 1 10 10 VAL CB C 13 31.730 0.000 . 1 . . 1 A 10 VAL CB . 30028 1 103 . 1 1 10 10 VAL CG1 C 13 24.400 0.000 . 2 . . 1 A 10 VAL CG1 . 30028 1 104 . 1 1 10 10 VAL CG2 C 13 20.153 0.000 . 2 . . 1 A 10 VAL CG2 . 30028 1 105 . 1 1 10 10 VAL H H 1 8.393 0.018 . 1 . . 1 A 10 VAL H . 30028 1 106 . 1 1 10 10 VAL HA H 1 3.421 0.017 . 1 . . 1 A 10 VAL HA . 30028 1 107 . 1 1 10 10 VAL HB H 1 2.229 0.018 . 1 . . 1 A 10 VAL HB . 30028 1 108 . 1 1 10 10 VAL HG11 H 1 0.877 0.005 . 1 . . 1 A 10 VAL HG11 . 30028 1 109 . 1 1 10 10 VAL HG12 H 1 0.877 0.005 . 1 . . 1 A 10 VAL HG12 . 30028 1 110 . 1 1 10 10 VAL HG13 H 1 0.877 0.005 . 1 . . 1 A 10 VAL HG13 . 30028 1 111 . 1 1 10 10 VAL HG21 H 1 0.877 0.005 . 1 . . 1 A 10 VAL HG21 . 30028 1 112 . 1 1 10 10 VAL HG22 H 1 0.877 0.005 . 1 . . 1 A 10 VAL HG22 . 30028 1 113 . 1 1 10 10 VAL HG23 H 1 0.877 0.005 . 1 . . 1 A 10 VAL HG23 . 30028 1 114 . 1 1 10 10 VAL N N 15 119.542 0.000 . 1 . . 1 A 10 VAL N . 30028 1 115 . 1 1 11 11 GLU C C 13 179.287 0.000 . 1 . . 1 A 11 GLU C . 30028 1 116 . 1 1 11 11 GLU CA C 13 59.282 0.000 . 1 . . 1 A 11 GLU CA . 30028 1 117 . 1 1 11 11 GLU CB C 13 28.265 0.000 . 1 . . 1 A 11 GLU CB . 30028 1 118 . 1 1 11 11 GLU CG C 13 35.947 0.000 . 1 . . 1 A 11 GLU CG . 30028 1 119 . 1 1 11 11 GLU H H 1 7.886 0.018 . 1 . . 1 A 11 GLU H . 30028 1 120 . 1 1 11 11 GLU HA H 1 3.993 0.013 . 1 . . 1 A 11 GLU HA . 30028 1 121 . 1 1 11 11 GLU HB3 H 1 2.080 0.009 . 2 . . 1 A 11 GLU HB3 . 30028 1 122 . 1 1 11 11 GLU HB2 H 1 2.165 0.001 . 2 . . 1 A 11 GLU HB2 . 30028 1 123 . 1 1 11 11 GLU HG3 H 1 2.158 0.000 . 1 . . 1 A 11 GLU HG3 . 30028 1 124 . 1 1 11 11 GLU HG2 H 1 2.158 0.000 . 1 . . 1 A 11 GLU HG2 . 30028 1 125 . 1 1 11 11 GLU N N 15 116.832 0.000 . 1 . . 1 A 11 GLU N . 30028 1 126 . 1 1 12 12 GLU C C 13 179.315 0.000 . 1 . . 1 A 12 GLU C . 30028 1 127 . 1 1 12 12 GLU CA C 13 59.308 0.000 . 1 . . 1 A 12 GLU CA . 30028 1 128 . 1 1 12 12 GLU CB C 13 29.224 0.000 . 1 . . 1 A 12 GLU CB . 30028 1 129 . 1 1 12 12 GLU CG C 13 35.500 0.000 . 1 . . 1 A 12 GLU CG . 30028 1 130 . 1 1 12 12 GLU H H 1 8.248 0.009 . 1 . . 1 A 12 GLU H . 30028 1 131 . 1 1 12 12 GLU HA H 1 4.113 0.010 . 1 . . 1 A 12 GLU HA . 30028 1 132 . 1 1 12 12 GLU HB3 H 1 2.142 0.015 . 2 . . 1 A 12 GLU HB3 . 30028 1 133 . 1 1 12 12 GLU HB2 H 1 2.140 0.015 . 2 . . 1 A 12 GLU HB2 . 30028 1 134 . 1 1 12 12 GLU HG3 H 1 2.386 0.010 . 2 . . 1 A 12 GLU HG3 . 30028 1 135 . 1 1 12 12 GLU HG2 H 1 2.383 0.010 . 2 . . 1 A 12 GLU HG2 . 30028 1 136 . 1 1 12 12 GLU N N 15 120.609 0.000 . 1 . . 1 A 12 GLU N . 30028 1 137 . 1 1 13 13 LEU C C 13 179.426 0.000 . 1 . . 1 A 13 LEU C . 30028 1 138 . 1 1 13 13 LEU CA C 13 58.058 0.000 . 1 . . 1 A 13 LEU CA . 30028 1 139 . 1 1 13 13 LEU CB C 13 43.464 0.000 . 1 . . 1 A 13 LEU CB . 30028 1 140 . 1 1 13 13 LEU CD1 C 13 22.847 0.000 . 2 . . 1 A 13 LEU CD1 . 30028 1 141 . 1 1 13 13 LEU CD2 C 13 24.491 0.000 . 2 . . 1 A 13 LEU CD2 . 30028 1 142 . 1 1 13 13 LEU CG C 13 27.350 0.000 . 1 . . 1 A 13 LEU CG . 30028 1 143 . 1 1 13 13 LEU H H 1 8.631 0.006 . 1 . . 1 A 13 LEU H . 30028 1 144 . 1 1 13 13 LEU HA H 1 4.001 0.014 . 1 . . 1 A 13 LEU HA . 30028 1 145 . 1 1 13 13 LEU HB3 H 1 1.238 0.014 . 2 . . 1 A 13 LEU HB3 . 30028 1 146 . 1 1 13 13 LEU HB2 H 1 2.074 0.008 . 2 . . 1 A 13 LEU HB2 . 30028 1 147 . 1 1 13 13 LEU HD11 H 1 0.825 0.008 . 2 . . 1 A 13 LEU HD11 . 30028 1 148 . 1 1 13 13 LEU HD12 H 1 0.825 0.008 . 2 . . 1 A 13 LEU HD12 . 30028 1 149 . 1 1 13 13 LEU HD13 H 1 0.825 0.008 . 2 . . 1 A 13 LEU HD13 . 30028 1 150 . 1 1 13 13 LEU HD21 H 1 0.883 0.002 . 2 . . 1 A 13 LEU HD21 . 30028 1 151 . 1 1 13 13 LEU HD22 H 1 0.883 0.002 . 2 . . 1 A 13 LEU HD22 . 30028 1 152 . 1 1 13 13 LEU HD23 H 1 0.883 0.002 . 2 . . 1 A 13 LEU HD23 . 30028 1 153 . 1 1 13 13 LEU HG H 1 1.899 0.007 . 1 . . 1 A 13 LEU HG . 30028 1 154 . 1 1 13 13 LEU N N 15 120.593 0.000 . 1 . . 1 A 13 LEU N . 30028 1 155 . 1 1 14 14 LEU C C 13 179.683 0.000 . 1 . . 1 A 14 LEU C . 30028 1 156 . 1 1 14 14 LEU CA C 13 58.270 0.000 . 1 . . 1 A 14 LEU CA . 30028 1 157 . 1 1 14 14 LEU CB C 13 42.045 0.000 . 1 . . 1 A 14 LEU CB . 30028 1 158 . 1 1 14 14 LEU CD1 C 13 23.400 0.000 . 1 . . 1 A 14 LEU CD1 . 30028 1 159 . 1 1 14 14 LEU CG C 13 26.450 0.000 . 1 . . 1 A 14 LEU CG . 30028 1 160 . 1 1 14 14 LEU H H 1 8.993 0.007 . 1 . . 1 A 14 LEU H . 30028 1 161 . 1 1 14 14 LEU HA H 1 4.050 0.014 . 1 . . 1 A 14 LEU HA . 30028 1 162 . 1 1 14 14 LEU HB3 H 1 1.885 0.005 . 2 . . 1 A 14 LEU HB3 . 30028 1 163 . 1 1 14 14 LEU HB2 H 1 1.404 0.013 . 2 . . 1 A 14 LEU HB2 . 30028 1 164 . 1 1 14 14 LEU HD11 H 1 0.810 0.017 . 2 . . 1 A 14 LEU HD11 . 30028 1 165 . 1 1 14 14 LEU HD12 H 1 0.810 0.017 . 2 . . 1 A 14 LEU HD12 . 30028 1 166 . 1 1 14 14 LEU HD13 H 1 0.810 0.017 . 2 . . 1 A 14 LEU HD13 . 30028 1 167 . 1 1 14 14 LEU HD21 H 1 0.782 0.000 . 2 . . 1 A 14 LEU HD21 . 30028 1 168 . 1 1 14 14 LEU HD22 H 1 0.782 0.000 . 2 . . 1 A 14 LEU HD22 . 30028 1 169 . 1 1 14 14 LEU HD23 H 1 0.782 0.000 . 2 . . 1 A 14 LEU HD23 . 30028 1 170 . 1 1 14 14 LEU HG H 1 1.778 0.011 . 1 . . 1 A 14 LEU HG . 30028 1 171 . 1 1 14 14 LEU N N 15 121.828 0.000 . 1 . . 1 A 14 LEU N . 30028 1 172 . 1 1 15 15 SER C C 13 177.779 0.000 . 1 . . 1 A 15 SER C . 30028 1 173 . 1 1 15 15 SER CA C 13 61.497 0.000 . 1 . . 1 A 15 SER CA . 30028 1 174 . 1 1 15 15 SER CB C 13 62.694 0.000 . 1 . . 1 A 15 SER CB . 30028 1 175 . 1 1 15 15 SER H H 1 7.803 0.014 . 1 . . 1 A 15 SER H . 30028 1 176 . 1 1 15 15 SER HA H 1 4.130 0.000 . 1 . . 1 A 15 SER HA . 30028 1 177 . 1 1 15 15 SER HB3 H 1 3.982 0.000 . 1 . . 1 A 15 SER HB3 . 30028 1 178 . 1 1 15 15 SER HB2 H 1 3.982 0.000 . 1 . . 1 A 15 SER HB2 . 30028 1 179 . 1 1 15 15 SER N N 15 114.278 0.000 . 1 . . 1 A 15 SER N . 30028 1 180 . 1 1 16 16 LYS C C 13 178.674 0.000 . 1 . . 1 A 16 LYS C . 30028 1 181 . 1 1 16 16 LYS CA C 13 59.921 0.000 . 1 . . 1 A 16 LYS CA . 30028 1 182 . 1 1 16 16 LYS CB C 13 32.886 0.000 . 1 . . 1 A 16 LYS CB . 30028 1 183 . 1 1 16 16 LYS CD C 13 27.900 0.000 . 1 . . 1 A 16 LYS CD . 30028 1 184 . 1 1 16 16 LYS CE C 13 42.047 0.000 . 1 . . 1 A 16 LYS CE . 30028 1 185 . 1 1 16 16 LYS CG C 13 27.807 0.000 . 1 . . 1 A 16 LYS CG . 30028 1 186 . 1 1 16 16 LYS H H 1 8.344 0.007 . 1 . . 1 A 16 LYS H . 30028 1 187 . 1 1 16 16 LYS HA H 1 4.161 0.008 . 1 . . 1 A 16 LYS HA . 30028 1 188 . 1 1 16 16 LYS HB3 H 1 1.724 0.006 . 2 . . 1 A 16 LYS HB3 . 30028 1 189 . 1 1 16 16 LYS HB2 H 1 1.905 0.019 . 2 . . 1 A 16 LYS HB2 . 30028 1 190 . 1 1 16 16 LYS HD3 H 1 1.766 0.016 . 2 . . 1 A 16 LYS HD3 . 30028 1 191 . 1 1 16 16 LYS HD2 H 1 0.861 0.000 . 2 . . 1 A 16 LYS HD2 . 30028 1 192 . 1 1 16 16 LYS HE3 H 1 2.993 0.012 . 1 . . 1 A 16 LYS HE3 . 30028 1 193 . 1 1 16 16 LYS HE2 H 1 2.993 0.012 . 1 . . 1 A 16 LYS HE2 . 30028 1 194 . 1 1 16 16 LYS HG3 H 1 1.430 0.004 . 2 . . 1 A 16 LYS HG3 . 30028 1 195 . 1 1 16 16 LYS HG2 H 1 1.429 0.003 . 2 . . 1 A 16 LYS HG2 . 30028 1 196 . 1 1 16 16 LYS N N 15 122.215 0.000 . 1 . . 1 A 16 LYS N . 30028 1 197 . 1 1 17 17 ASN C C 13 176.837 0.000 . 1 . . 1 A 17 ASN C . 30028 1 198 . 1 1 17 17 ASN CA C 13 57.473 0.000 . 1 . . 1 A 17 ASN CA . 30028 1 199 . 1 1 17 17 ASN CB C 13 38.933 0.000 . 1 . . 1 A 17 ASN CB . 30028 1 200 . 1 1 17 17 ASN H H 1 8.838 0.011 . 1 . . 1 A 17 ASN H . 30028 1 201 . 1 1 17 17 ASN HA H 1 4.359 0.006 . 1 . . 1 A 17 ASN HA . 30028 1 202 . 1 1 17 17 ASN HB3 H 1 2.714 0.008 . 2 . . 1 A 17 ASN HB3 . 30028 1 203 . 1 1 17 17 ASN HB2 H 1 3.252 0.009 . 2 . . 1 A 17 ASN HB2 . 30028 1 204 . 1 1 17 17 ASN HD21 H 1 6.511 0.000 . 1 . . 1 A 17 ASN HD21 . 30028 1 205 . 1 1 17 17 ASN HD22 H 1 7.629 0.000 . 1 . . 1 A 17 ASN HD22 . 30028 1 206 . 1 1 17 17 ASN N N 15 119.450 0.000 . 1 . . 1 A 17 ASN N . 30028 1 207 . 1 1 17 17 ASN ND2 N 15 122.832 0.014 . 1 . . 1 A 17 ASN ND2 . 30028 1 208 . 1 1 18 18 TYR C C 13 178.120 0.000 . 1 . . 1 A 18 TYR C . 30028 1 209 . 1 1 18 18 TYR CA C 13 60.886 0.067 . 1 . . 1 A 18 TYR CA . 30028 1 210 . 1 1 18 18 TYR CB C 13 37.871 0.000 . 1 . . 1 A 18 TYR CB . 30028 1 211 . 1 1 18 18 TYR H H 1 8.284 0.013 . 1 . . 1 A 18 TYR H . 30028 1 212 . 1 1 18 18 TYR HA H 1 4.363 0.014 . 1 . . 1 A 18 TYR HA . 30028 1 213 . 1 1 18 18 TYR HB3 H 1 3.145 0.012 . 2 . . 1 A 18 TYR HB3 . 30028 1 214 . 1 1 18 18 TYR HB2 H 1 3.232 0.013 . 2 . . 1 A 18 TYR HB2 . 30028 1 215 . 1 1 18 18 TYR HD1 H 1 7.346 0.015 . 1 . . 1 A 18 TYR HD1 . 30028 1 216 . 1 1 18 18 TYR HD2 H 1 7.346 0.015 . 1 . . 1 A 18 TYR HD2 . 30028 1 217 . 1 1 18 18 TYR HE1 H 1 7.083 0.005 . 1 . . 1 A 18 TYR HE1 . 30028 1 218 . 1 1 18 18 TYR HE2 H 1 7.083 0.005 . 1 . . 1 A 18 TYR HE2 . 30028 1 219 . 1 1 18 18 TYR N N 15 120.068 0.000 . 1 . . 1 A 18 TYR N . 30028 1 220 . 1 1 19 19 HIS C C 13 177.940 0.000 . 1 . . 1 A 19 HIS C . 30028 1 221 . 1 1 19 19 HIS CA C 13 59.323 0.000 . 1 . . 1 A 19 HIS CA . 30028 1 222 . 1 1 19 19 HIS CB C 13 28.106 0.000 . 1 . . 1 A 19 HIS CB . 30028 1 223 . 1 1 19 19 HIS H H 1 7.987 0.015 . 1 . . 1 A 19 HIS H . 30028 1 224 . 1 1 19 19 HIS HA H 1 4.352 0.009 . 1 . . 1 A 19 HIS HA . 30028 1 225 . 1 1 19 19 HIS HB3 H 1 3.445 0.021 . 1 . . 1 A 19 HIS HB3 . 30028 1 226 . 1 1 19 19 HIS HD1 H 1 7.404 0.000 . 1 . . 1 A 19 HIS HD1 . 30028 1 227 . 1 1 19 19 HIS HE1 H 1 8.287 0.000 . 1 . . 1 A 19 HIS HE1 . 30028 1 228 . 1 1 19 19 HIS N N 15 116.680 0.000 . 1 . . 1 A 19 HIS N . 30028 1 229 . 1 1 20 20 LEU C C 13 178.627 0.000 . 1 . . 1 A 20 LEU C . 30028 1 230 . 1 1 20 20 LEU CA C 13 58.199 0.000 . 1 . . 1 A 20 LEU CA . 30028 1 231 . 1 1 20 20 LEU CB C 13 43.578 0.000 . 1 . . 1 A 20 LEU CB . 30028 1 232 . 1 1 20 20 LEU CD1 C 13 23.850 0.000 . 1 . . 1 A 20 LEU CD1 . 30028 1 233 . 1 1 20 20 LEU CG C 13 27.397 0.000 . 1 . . 1 A 20 LEU CG . 30028 1 234 . 1 1 20 20 LEU H H 1 8.683 0.018 . 1 . . 1 A 20 LEU H . 30028 1 235 . 1 1 20 20 LEU HA H 1 4.036 0.021 . 1 . . 1 A 20 LEU HA . 30028 1 236 . 1 1 20 20 LEU HB3 H 1 1.257 0.016 . 1 . . 1 A 20 LEU HB3 . 30028 1 237 . 1 1 20 20 LEU HB2 H 1 1.257 0.016 . 1 . . 1 A 20 LEU HB2 . 30028 1 238 . 1 1 20 20 LEU HD11 H 1 0.840 0.011 . 2 . . 1 A 20 LEU HD11 . 30028 1 239 . 1 1 20 20 LEU HD12 H 1 0.840 0.011 . 2 . . 1 A 20 LEU HD12 . 30028 1 240 . 1 1 20 20 LEU HD13 H 1 0.840 0.011 . 2 . . 1 A 20 LEU HD13 . 30028 1 241 . 1 1 20 20 LEU HD21 H 1 0.795 0.000 . 2 . . 1 A 20 LEU HD21 . 30028 1 242 . 1 1 20 20 LEU HD22 H 1 0.795 0.000 . 2 . . 1 A 20 LEU HD22 . 30028 1 243 . 1 1 20 20 LEU HD23 H 1 0.795 0.000 . 2 . . 1 A 20 LEU HD23 . 30028 1 244 . 1 1 20 20 LEU HG H 1 2.055 0.011 . 1 . . 1 A 20 LEU HG . 30028 1 245 . 1 1 20 20 LEU N N 15 120.891 0.000 . 1 . . 1 A 20 LEU N . 30028 1 246 . 1 1 21 21 GLU C C 13 179.736 0.000 . 1 . . 1 A 21 GLU C . 30028 1 247 . 1 1 21 21 GLU CA C 13 59.818 0.000 . 1 . . 1 A 21 GLU CA . 30028 1 248 . 1 1 21 21 GLU CB C 13 28.434 0.000 . 1 . . 1 A 21 GLU CB . 30028 1 249 . 1 1 21 21 GLU CG C 13 35.853 0.000 . 1 . . 1 A 21 GLU CG . 30028 1 250 . 1 1 21 21 GLU H H 1 8.849 0.006 . 1 . . 1 A 21 GLU H . 30028 1 251 . 1 1 21 21 GLU HA H 1 4.005 0.012 . 1 . . 1 A 21 GLU HA . 30028 1 252 . 1 1 21 21 GLU HB3 H 1 2.067 0.005 . 2 . . 1 A 21 GLU HB3 . 30028 1 253 . 1 1 21 21 GLU HB2 H 1 2.160 0.007 . 2 . . 1 A 21 GLU HB2 . 30028 1 254 . 1 1 21 21 GLU HG3 H 1 2.050 0.004 . 2 . . 1 A 21 GLU HG3 . 30028 1 255 . 1 1 21 21 GLU HG2 H 1 2.446 0.012 . 2 . . 1 A 21 GLU HG2 . 30028 1 256 . 1 1 21 21 GLU N N 15 119.035 0.000 . 1 . . 1 A 21 GLU N . 30028 1 257 . 1 1 22 22 ASN C C 13 177.580 0.000 . 1 . . 1 A 22 ASN C . 30028 1 258 . 1 1 22 22 ASN CA C 13 56.122 0.000 . 1 . . 1 A 22 ASN CA . 30028 1 259 . 1 1 22 22 ASN CB C 13 38.256 0.000 . 1 . . 1 A 22 ASN CB . 30028 1 260 . 1 1 22 22 ASN H H 1 7.791 0.020 . 1 . . 1 A 22 ASN H . 30028 1 261 . 1 1 22 22 ASN HA H 1 4.407 0.017 . 1 . . 1 A 22 ASN HA . 30028 1 262 . 1 1 22 22 ASN HB3 H 1 2.792 0.015 . 2 . . 1 A 22 ASN HB3 . 30028 1 263 . 1 1 22 22 ASN HB2 H 1 2.709 0.003 . 2 . . 1 A 22 ASN HB2 . 30028 1 264 . 1 1 22 22 ASN HD21 H 1 7.344 0.000 . 1 . . 1 A 22 ASN HD21 . 30028 1 265 . 1 1 22 22 ASN HD22 H 1 6.035 0.000 . 1 . . 1 A 22 ASN HD22 . 30028 1 266 . 1 1 22 22 ASN N N 15 118.592 0.000 . 1 . . 1 A 22 ASN N . 30028 1 267 . 1 1 22 22 ASN ND2 N 15 111.069 0.014 . 1 . . 1 A 22 ASN ND2 . 30028 1 268 . 1 1 23 23 GLU C C 13 178.162 0.000 . 1 . . 1 A 23 GLU C . 30028 1 269 . 1 1 23 23 GLU CA C 13 58.914 0.000 . 1 . . 1 A 23 GLU CA . 30028 1 270 . 1 1 23 23 GLU CB C 13 29.494 0.000 . 1 . . 1 A 23 GLU CB . 30028 1 271 . 1 1 23 23 GLU CG C 13 36.300 0.000 . 1 . . 1 A 23 GLU CG . 30028 1 272 . 1 1 23 23 GLU H H 1 8.030 0.008 . 1 . . 1 A 23 GLU H . 30028 1 273 . 1 1 23 23 GLU HA H 1 4.344 0.008 . 1 . . 1 A 23 GLU HA . 30028 1 274 . 1 1 23 23 GLU HB3 H 1 2.086 0.008 . 1 . . 1 A 23 GLU HB3 . 30028 1 275 . 1 1 23 23 GLU HB2 H 1 2.086 0.008 . 1 . . 1 A 23 GLU HB2 . 30028 1 276 . 1 1 23 23 GLU HG3 H 1 2.058 0.005 . 2 . . 1 A 23 GLU HG3 . 30028 1 277 . 1 1 23 23 GLU HG2 H 1 2.055 0.003 . 2 . . 1 A 23 GLU HG2 . 30028 1 278 . 1 1 23 23 GLU N N 15 122.907 0.000 . 1 . . 1 A 23 GLU N . 30028 1 279 . 1 1 24 24 VAL C C 13 177.070 0.000 . 1 . . 1 A 24 VAL C . 30028 1 280 . 1 1 24 24 VAL CA C 13 67.689 0.000 . 1 . . 1 A 24 VAL CA . 30028 1 281 . 1 1 24 24 VAL CB C 13 31.766 0.000 . 1 . . 1 A 24 VAL CB . 30028 1 282 . 1 1 24 24 VAL CG1 C 13 25.000 0.000 . 2 . . 1 A 24 VAL CG1 . 30028 1 283 . 1 1 24 24 VAL CG2 C 13 21.547 0.000 . 2 . . 1 A 24 VAL CG2 . 30028 1 284 . 1 1 24 24 VAL H H 1 8.652 0.009 . 1 . . 1 A 24 VAL H . 30028 1 285 . 1 1 24 24 VAL HA H 1 3.367 0.021 . 1 . . 1 A 24 VAL HA . 30028 1 286 . 1 1 24 24 VAL HB H 1 2.036 0.020 . 1 . . 1 A 24 VAL HB . 30028 1 287 . 1 1 24 24 VAL HG11 H 1 0.870 0.011 . 1 . . 1 A 24 VAL HG11 . 30028 1 288 . 1 1 24 24 VAL HG12 H 1 0.870 0.011 . 1 . . 1 A 24 VAL HG12 . 30028 1 289 . 1 1 24 24 VAL HG13 H 1 0.870 0.011 . 1 . . 1 A 24 VAL HG13 . 30028 1 290 . 1 1 24 24 VAL HG21 H 1 0.870 0.011 . 1 . . 1 A 24 VAL HG21 . 30028 1 291 . 1 1 24 24 VAL HG22 H 1 0.870 0.011 . 1 . . 1 A 24 VAL HG22 . 30028 1 292 . 1 1 24 24 VAL HG23 H 1 0.870 0.011 . 1 . . 1 A 24 VAL HG23 . 30028 1 293 . 1 1 24 24 VAL N N 15 119.655 0.000 . 1 . . 1 A 24 VAL N . 30028 1 294 . 1 1 25 25 ALA C C 13 180.359 0.000 . 1 . . 1 A 25 ALA C . 30028 1 295 . 1 1 25 25 ALA CA C 13 55.557 0.000 . 1 . . 1 A 25 ALA CA . 30028 1 296 . 1 1 25 25 ALA CB C 13 18.123 0.000 . 1 . . 1 A 25 ALA CB . 30028 1 297 . 1 1 25 25 ALA H H 1 7.766 0.009 . 1 . . 1 A 25 ALA H . 30028 1 298 . 1 1 25 25 ALA HA H 1 3.995 0.004 . 1 . . 1 A 25 ALA HA . 30028 1 299 . 1 1 25 25 ALA HB1 H 1 1.441 0.006 . 1 . . 1 A 25 ALA HB1 . 30028 1 300 . 1 1 25 25 ALA HB2 H 1 1.441 0.006 . 1 . . 1 A 25 ALA HB2 . 30028 1 301 . 1 1 25 25 ALA HB3 H 1 1.441 0.006 . 1 . . 1 A 25 ALA HB3 . 30028 1 302 . 1 1 25 25 ALA N N 15 119.643 0.000 . 1 . . 1 A 25 ALA N . 30028 1 303 . 1 1 26 26 ARG C C 13 179.147 0.000 . 1 . . 1 A 26 ARG C . 30028 1 304 . 1 1 26 26 ARG CA C 13 59.360 0.000 . 1 . . 1 A 26 ARG CA . 30028 1 305 . 1 1 26 26 ARG CB C 13 30.715 0.000 . 1 . . 1 A 26 ARG CB . 30028 1 306 . 1 1 26 26 ARG CG C 13 28.190 0.000 . 1 . . 1 A 26 ARG CG . 30028 1 307 . 1 1 26 26 ARG H H 1 7.867 0.013 . 1 . . 1 A 26 ARG H . 30028 1 308 . 1 1 26 26 ARG HA H 1 3.985 0.006 . 1 . . 1 A 26 ARG HA . 30028 1 309 . 1 1 26 26 ARG HB3 H 1 1.899 0.007 . 2 . . 1 A 26 ARG HB3 . 30028 1 310 . 1 1 26 26 ARG HB2 H 1 1.622 0.007 . 2 . . 1 A 26 ARG HB2 . 30028 1 311 . 1 1 26 26 ARG HD3 H 1 3.074 0.000 . 2 . . 1 A 26 ARG HD3 . 30028 1 312 . 1 1 26 26 ARG HD2 H 1 3.531 0.000 . 2 . . 1 A 26 ARG HD2 . 30028 1 313 . 1 1 26 26 ARG HG3 H 1 2.172 0.000 . 1 . . 1 A 26 ARG HG3 . 30028 1 314 . 1 1 26 26 ARG HG2 H 1 2.172 0.000 . 1 . . 1 A 26 ARG HG2 . 30028 1 315 . 1 1 26 26 ARG N N 15 118.786 0.000 . 1 . . 1 A 26 ARG N . 30028 1 316 . 1 1 27 27 LEU C C 13 178.931 0.000 . 1 . . 1 A 27 LEU C . 30028 1 317 . 1 1 27 27 LEU CA C 13 57.991 0.000 . 1 . . 1 A 27 LEU CA . 30028 1 318 . 1 1 27 27 LEU CB C 13 43.867 0.000 . 1 . . 1 A 27 LEU CB . 30028 1 319 . 1 1 27 27 LEU CD1 C 13 23.647 0.000 . 1 . . 1 A 27 LEU CD1 . 30028 1 320 . 1 1 27 27 LEU CD2 C 13 23.647 0.000 . 1 . . 1 A 27 LEU CD2 . 30028 1 321 . 1 1 27 27 LEU CG C 13 26.897 0.000 . 1 . . 1 A 27 LEU CG . 30028 1 322 . 1 1 27 27 LEU H H 1 8.429 0.014 . 1 . . 1 A 27 LEU H . 30028 1 323 . 1 1 27 27 LEU HA H 1 3.989 0.022 . 1 . . 1 A 27 LEU HA . 30028 1 324 . 1 1 27 27 LEU HB3 H 1 1.967 0.008 . 2 . . 1 A 27 LEU HB3 . 30028 1 325 . 1 1 27 27 LEU HB2 H 1 1.243 0.007 . 2 . . 1 A 27 LEU HB2 . 30028 1 326 . 1 1 27 27 LEU HD11 H 1 0.797 0.019 . 2 . . 1 A 27 LEU HD11 . 30028 1 327 . 1 1 27 27 LEU HD12 H 1 0.797 0.019 . 2 . . 1 A 27 LEU HD12 . 30028 1 328 . 1 1 27 27 LEU HD13 H 1 0.797 0.019 . 2 . . 1 A 27 LEU HD13 . 30028 1 329 . 1 1 27 27 LEU HD21 H 1 0.789 0.019 . 2 . . 1 A 27 LEU HD21 . 30028 1 330 . 1 1 27 27 LEU HD22 H 1 0.789 0.019 . 2 . . 1 A 27 LEU HD22 . 30028 1 331 . 1 1 27 27 LEU HD23 H 1 0.789 0.019 . 2 . . 1 A 27 LEU HD23 . 30028 1 332 . 1 1 27 27 LEU HG H 1 1.628 0.007 . 1 . . 1 A 27 LEU HG . 30028 1 333 . 1 1 27 27 LEU N N 15 120.003 0.000 . 1 . . 1 A 27 LEU N . 30028 1 334 . 1 1 28 28 LYS C C 13 178.995 0.000 . 1 . . 1 A 28 LYS C . 30028 1 335 . 1 1 28 28 LYS CA C 13 60.721 0.000 . 1 . . 1 A 28 LYS CA . 30028 1 336 . 1 1 28 28 LYS CB C 13 32.426 0.000 . 1 . . 1 A 28 LYS CB . 30028 1 337 . 1 1 28 28 LYS CD C 13 29.547 0.000 . 1 . . 1 A 28 LYS CD . 30028 1 338 . 1 1 28 28 LYS CE C 13 43.591 0.000 . 1 . . 1 A 28 LYS CE . 30028 1 339 . 1 1 28 28 LYS CG C 13 27.100 0.000 . 1 . . 1 A 28 LYS CG . 30028 1 340 . 1 1 28 28 LYS H H 1 8.898 0.012 . 1 . . 1 A 28 LYS H . 30028 1 341 . 1 1 28 28 LYS HA H 1 3.810 0.004 . 1 . . 1 A 28 LYS HA . 30028 1 342 . 1 1 28 28 LYS HB3 H 1 1.902 0.013 . 2 . . 1 A 28 LYS HB3 . 30028 1 343 . 1 1 28 28 LYS HB2 H 1 1.637 0.018 . 2 . . 1 A 28 LYS HB2 . 30028 1 344 . 1 1 28 28 LYS HD3 H 1 1.698 0.000 . 1 . . 1 A 28 LYS HD3 . 30028 1 345 . 1 1 28 28 LYS HD2 H 1 0.868 0.000 . 1 . . 1 A 28 LYS HD2 . 30028 1 346 . 1 1 28 28 LYS HE3 H 1 3.161 0.009 . 1 . . 1 A 28 LYS HE3 . 30028 1 347 . 1 1 28 28 LYS HE2 H 1 3.161 0.009 . 1 . . 1 A 28 LYS HE2 . 30028 1 348 . 1 1 28 28 LYS HG3 H 1 1.240 0.009 . 2 . . 1 A 28 LYS HG3 . 30028 1 349 . 1 1 28 28 LYS HG2 H 1 1.712 0.006 . 2 . . 1 A 28 LYS HG2 . 30028 1 350 . 1 1 28 28 LYS N N 15 118.039 0.000 . 1 . . 1 A 28 LYS N . 30028 1 351 . 1 1 29 29 LYS C C 13 178.964 0.000 . 1 . . 1 A 29 LYS C . 30028 1 352 . 1 1 29 29 LYS CA C 13 58.595 0.000 . 1 . . 1 A 29 LYS CA . 30028 1 353 . 1 1 29 29 LYS CB C 13 32.331 0.000 . 1 . . 1 A 29 LYS CB . 30028 1 354 . 1 1 29 29 LYS CD C 13 28.453 0.000 . 1 . . 1 A 29 LYS CD . 30028 1 355 . 1 1 29 29 LYS CE C 13 41.747 0.000 . 1 . . 1 A 29 LYS CE . 30028 1 356 . 1 1 29 29 LYS CG C 13 24.700 0.000 . 1 . . 1 A 29 LYS CG . 30028 1 357 . 1 1 29 29 LYS H H 1 7.279 0.010 . 1 . . 1 A 29 LYS H . 30028 1 358 . 1 1 29 29 LYS HA H 1 4.169 0.009 . 1 . . 1 A 29 LYS HA . 30028 1 359 . 1 1 29 29 LYS HB3 H 1 1.932 0.019 . 2 . . 1 A 29 LYS HB3 . 30028 1 360 . 1 1 29 29 LYS HB2 H 1 1.709 0.011 . 2 . . 1 A 29 LYS HB2 . 30028 1 361 . 1 1 29 29 LYS HD3 H 1 0.884 0.000 . 2 . . 1 A 29 LYS HD3 . 30028 1 362 . 1 1 29 29 LYS HD2 H 1 1.668 0.006 . 2 . . 1 A 29 LYS HD2 . 30028 1 363 . 1 1 29 29 LYS HE3 H 1 2.892 0.000 . 2 . . 1 A 29 LYS HE3 . 30028 1 364 . 1 1 29 29 LYS HE2 H 1 2.955 0.000 . 2 . . 1 A 29 LYS HE2 . 30028 1 365 . 1 1 29 29 LYS HG3 H 1 1.429 0.005 . 2 . . 1 A 29 LYS HG3 . 30028 1 366 . 1 1 29 29 LYS HG2 H 1 1.426 0.002 . 2 . . 1 A 29 LYS HG2 . 30028 1 367 . 1 1 29 29 LYS N N 15 116.795 0.000 . 1 . . 1 A 29 LYS N . 30028 1 368 . 1 1 30 30 LEU C C 13 178.720 0.000 . 1 . . 1 A 30 LEU C . 30028 1 369 . 1 1 30 30 LEU CA C 13 57.009 0.000 . 1 . . 1 A 30 LEU CA . 30028 1 370 . 1 1 30 30 LEU CB C 13 42.698 0.000 . 1 . . 1 A 30 LEU CB . 30028 1 371 . 1 1 30 30 LEU CD1 C 13 23.394 0.000 . 2 . . 1 A 30 LEU CD1 . 30028 1 372 . 1 1 30 30 LEU CD2 C 13 25.447 0.000 . 2 . . 1 A 30 LEU CD2 . 30028 1 373 . 1 1 30 30 LEU CG C 13 25.000 0.000 . 1 . . 1 A 30 LEU CG . 30028 1 374 . 1 1 30 30 LEU H H 1 7.520 0.001 . 1 . . 1 A 30 LEU H . 30028 1 375 . 1 1 30 30 LEU HA H 1 4.171 0.006 . 1 . . 1 A 30 LEU HA . 30028 1 376 . 1 1 30 30 LEU HB3 H 1 1.629 0.011 . 2 . . 1 A 30 LEU HB3 . 30028 1 377 . 1 1 30 30 LEU HB2 H 1 1.969 0.018 . 2 . . 1 A 30 LEU HB2 . 30028 1 378 . 1 1 30 30 LEU HD11 H 1 0.820 0.006 . 2 . . 1 A 30 LEU HD11 . 30028 1 379 . 1 1 30 30 LEU HD12 H 1 0.820 0.006 . 2 . . 1 A 30 LEU HD12 . 30028 1 380 . 1 1 30 30 LEU HD13 H 1 0.820 0.006 . 2 . . 1 A 30 LEU HD13 . 30028 1 381 . 1 1 30 30 LEU HD21 H 1 0.869 0.000 . 2 . . 1 A 30 LEU HD21 . 30028 1 382 . 1 1 30 30 LEU HD22 H 1 0.869 0.000 . 2 . . 1 A 30 LEU HD22 . 30028 1 383 . 1 1 30 30 LEU HD23 H 1 0.869 0.000 . 2 . . 1 A 30 LEU HD23 . 30028 1 384 . 1 1 30 30 LEU HG H 1 2.063 0.005 . 1 . . 1 A 30 LEU HG . 30028 1 385 . 1 1 30 30 LEU N N 15 118.537 0.000 . 1 . . 1 A 30 LEU N . 30028 1 386 . 1 1 31 31 VAL C C 13 176.437 0.000 . 1 . . 1 A 31 VAL C . 30028 1 387 . 1 1 31 31 VAL CA C 13 62.437 0.000 . 1 . . 1 A 31 VAL CA . 30028 1 388 . 1 1 31 31 VAL CB C 13 32.381 0.000 . 1 . . 1 A 31 VAL CB . 30028 1 389 . 1 1 31 31 VAL CG1 C 13 22.491 0.000 . 1 . . 1 A 31 VAL CG1 . 30028 1 390 . 1 1 31 31 VAL H H 1 7.657 0.017 . 1 . . 1 A 31 VAL H . 30028 1 391 . 1 1 31 31 VAL HA H 1 4.184 0.004 . 1 . . 1 A 31 VAL HA . 30028 1 392 . 1 1 31 31 VAL HB H 1 2.254 0.007 . 1 . . 1 A 31 VAL HB . 30028 1 393 . 1 1 31 31 VAL HG11 H 1 0.869 0.006 . 1 . . 1 A 31 VAL HG11 . 30028 1 394 . 1 1 31 31 VAL HG12 H 1 0.869 0.006 . 1 . . 1 A 31 VAL HG12 . 30028 1 395 . 1 1 31 31 VAL HG13 H 1 0.869 0.006 . 1 . . 1 A 31 VAL HG13 . 30028 1 396 . 1 1 31 31 VAL N N 15 113.227 0.000 . 1 . . 1 A 31 VAL N . 30028 1 397 . 1 1 32 32 GLY C C 13 174.015 0.000 . 1 . . 1 A 32 GLY C . 30028 1 398 . 1 1 32 32 GLY CA C 13 46.142 0.000 . 1 . . 1 A 32 GLY CA . 30028 1 399 . 1 1 32 32 GLY H H 1 7.842 0.013 . 1 . . 1 A 32 GLY H . 30028 1 400 . 1 1 32 32 GLY HA3 H 1 4.123 0.019 . 2 . . 1 A 32 GLY HA3 . 30028 1 401 . 1 1 32 32 GLY HA2 H 1 3.896 0.007 . 2 . . 1 A 32 GLY HA2 . 30028 1 402 . 1 1 32 32 GLY N N 15 109.411 0.000 . 1 . . 1 A 32 GLY N . 30028 1 403 . 1 1 33 33 GLU CA C 13 56.628 0.000 . 1 . . 1 A 33 GLU CA . 30028 1 404 . 1 1 33 33 GLU CB C 13 30.702 0.000 . 1 . . 1 A 33 GLU CB . 30028 1 405 . 1 1 33 33 GLU H H 1 7.894 0.014 . 1 . . 1 A 33 GLU H . 30028 1 406 . 1 1 33 33 GLU HA H 1 4.211 0.000 . 1 . . 1 A 33 GLU HA . 30028 1 407 . 1 1 33 33 GLU HB3 H 1 2.260 0.005 . 1 . . 1 A 33 GLU HB3 . 30028 1 408 . 1 1 33 33 GLU N N 15 124.253 0.000 . 1 . . 1 A 33 GLU N . 30028 1 stop_ save_