################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 11475 _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 $chemical_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 1H-15N NOESY' . . . 11475 1 2 '3D 1H-13C NOESY' . . . 11475 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 HA2 H 1 3.901 0.030 . 1 . . . . 7 GLY HA2 . 11475 1 2 . 1 1 7 7 GLY HA3 H 1 3.901 0.030 . 1 . . . . 7 GLY HA3 . 11475 1 3 . 1 1 7 7 GLY CA C 13 45.264 0.300 . 1 . . . . 7 GLY CA . 11475 1 4 . 1 1 8 8 LYS HA H 1 4.422 0.030 . 1 . . . . 8 LYS HA . 11475 1 5 . 1 1 8 8 LYS HB2 H 1 1.508 0.030 . 2 . . . . 8 LYS HB2 . 11475 1 6 . 1 1 8 8 LYS HB3 H 1 1.287 0.030 . 2 . . . . 8 LYS HB3 . 11475 1 7 . 1 1 8 8 LYS HD2 H 1 1.525 0.030 . 2 . . . . 8 LYS HD2 . 11475 1 8 . 1 1 8 8 LYS HD3 H 1 1.466 0.030 . 2 . . . . 8 LYS HD3 . 11475 1 9 . 1 1 8 8 LYS HE2 H 1 2.931 0.030 . 1 . . . . 8 LYS HE2 . 11475 1 10 . 1 1 8 8 LYS HE3 H 1 2.931 0.030 . 1 . . . . 8 LYS HE3 . 11475 1 11 . 1 1 8 8 LYS HG2 H 1 1.302 0.030 . 2 . . . . 8 LYS HG2 . 11475 1 12 . 1 1 8 8 LYS HG3 H 1 1.181 0.030 . 2 . . . . 8 LYS HG3 . 11475 1 13 . 1 1 8 8 LYS CA C 13 53.583 0.300 . 1 . . . . 8 LYS CA . 11475 1 14 . 1 1 8 8 LYS CB C 13 33.120 0.300 . 1 . . . . 8 LYS CB . 11475 1 15 . 1 1 8 8 LYS CD C 13 29.527 0.300 . 1 . . . . 8 LYS CD . 11475 1 16 . 1 1 8 8 LYS CE C 13 42.317 0.300 . 1 . . . . 8 LYS CE . 11475 1 17 . 1 1 8 8 LYS CG C 13 24.794 0.300 . 1 . . . . 8 LYS CG . 11475 1 18 . 1 1 9 9 PRO HA H 1 4.121 0.030 . 1 . . . . 9 PRO HA . 11475 1 19 . 1 1 9 9 PRO HB2 H 1 1.980 0.030 . 2 . . . . 9 PRO HB2 . 11475 1 20 . 1 1 9 9 PRO HB3 H 1 1.189 0.030 . 2 . . . . 9 PRO HB3 . 11475 1 21 . 1 1 9 9 PRO HD2 H 1 3.550 0.030 . 2 . . . . 9 PRO HD2 . 11475 1 22 . 1 1 9 9 PRO HD3 H 1 3.470 0.030 . 2 . . . . 9 PRO HD3 . 11475 1 23 . 1 1 9 9 PRO HG2 H 1 1.786 0.030 . 2 . . . . 9 PRO HG2 . 11475 1 24 . 1 1 9 9 PRO HG3 H 1 1.449 0.030 . 2 . . . . 9 PRO HG3 . 11475 1 25 . 1 1 9 9 PRO C C 13 176.392 0.300 . 1 . . . . 9 PRO C . 11475 1 26 . 1 1 9 9 PRO CA C 13 63.495 0.300 . 1 . . . . 9 PRO CA . 11475 1 27 . 1 1 9 9 PRO CB C 13 32.212 0.300 . 1 . . . . 9 PRO CB . 11475 1 28 . 1 1 9 9 PRO CD C 13 50.432 0.300 . 1 . . . . 9 PRO CD . 11475 1 29 . 1 1 9 9 PRO CG C 13 26.644 0.300 . 1 . . . . 9 PRO CG . 11475 1 30 . 1 1 10 10 TYR H H 1 7.801 0.030 . 1 . . . . 10 TYR H . 11475 1 31 . 1 1 10 10 TYR HA H 1 4.607 0.030 . 1 . . . . 10 TYR HA . 11475 1 32 . 1 1 10 10 TYR HB2 H 1 2.945 0.030 . 1 . . . . 10 TYR HB2 . 11475 1 33 . 1 1 10 10 TYR HB3 H 1 2.945 0.030 . 1 . . . . 10 TYR HB3 . 11475 1 34 . 1 1 10 10 TYR HD1 H 1 7.044 0.030 . 1 . . . . 10 TYR HD1 . 11475 1 35 . 1 1 10 10 TYR HD2 H 1 7.044 0.030 . 1 . . . . 10 TYR HD2 . 11475 1 36 . 1 1 10 10 TYR HE1 H 1 6.874 0.030 . 1 . . . . 10 TYR HE1 . 11475 1 37 . 1 1 10 10 TYR HE2 H 1 6.874 0.030 . 1 . . . . 10 TYR HE2 . 11475 1 38 . 1 1 10 10 TYR C C 13 173.957 0.300 . 1 . . . . 10 TYR C . 11475 1 39 . 1 1 10 10 TYR CA C 13 57.623 0.300 . 1 . . . . 10 TYR CA . 11475 1 40 . 1 1 10 10 TYR CB C 13 36.849 0.300 . 1 . . . . 10 TYR CB . 11475 1 41 . 1 1 10 10 TYR CD1 C 13 133.194 0.300 . 1 . . . . 10 TYR CD1 . 11475 1 42 . 1 1 10 10 TYR CD2 C 13 133.194 0.300 . 1 . . . . 10 TYR CD2 . 11475 1 43 . 1 1 10 10 TYR CE1 C 13 118.432 0.300 . 1 . . . . 10 TYR CE1 . 11475 1 44 . 1 1 10 10 TYR CE2 C 13 118.432 0.300 . 1 . . . . 10 TYR CE2 . 11475 1 45 . 1 1 10 10 TYR N N 15 119.413 0.300 . 1 . . . . 10 TYR N . 11475 1 46 . 1 1 11 11 LYS H H 1 8.208 0.030 . 1 . . . . 11 LYS H . 11475 1 47 . 1 1 11 11 LYS HA H 1 4.679 0.030 . 1 . . . . 11 LYS HA . 11475 1 48 . 1 1 11 11 LYS HB2 H 1 1.920 0.030 . 2 . . . . 11 LYS HB2 . 11475 1 49 . 1 1 11 11 LYS HB3 H 1 1.646 0.030 . 2 . . . . 11 LYS HB3 . 11475 1 50 . 1 1 11 11 LYS HD2 H 1 1.719 0.030 . 2 . . . . 11 LYS HD2 . 11475 1 51 . 1 1 11 11 LYS HD3 H 1 1.577 0.030 . 2 . . . . 11 LYS HD3 . 11475 1 52 . 1 1 11 11 LYS HE2 H 1 2.957 0.030 . 1 . . . . 11 LYS HE2 . 11475 1 53 . 1 1 11 11 LYS HE3 H 1 2.957 0.030 . 1 . . . . 11 LYS HE3 . 11475 1 54 . 1 1 11 11 LYS HG2 H 1 1.426 0.030 . 2 . . . . 11 LYS HG2 . 11475 1 55 . 1 1 11 11 LYS HG3 H 1 1.361 0.030 . 2 . . . . 11 LYS HG3 . 11475 1 56 . 1 1 11 11 LYS C C 13 175.723 0.300 . 1 . . . . 11 LYS C . 11475 1 57 . 1 1 11 11 LYS CA C 13 54.852 0.300 . 1 . . . . 11 LYS CA . 11475 1 58 . 1 1 11 11 LYS CB C 13 34.567 0.300 . 1 . . . . 11 LYS CB . 11475 1 59 . 1 1 11 11 LYS CD C 13 28.900 0.300 . 1 . . . . 11 LYS CD . 11475 1 60 . 1 1 11 11 LYS CE C 13 42.303 0.300 . 1 . . . . 11 LYS CE . 11475 1 61 . 1 1 11 11 LYS CG C 13 24.606 0.300 . 1 . . . . 11 LYS CG . 11475 1 62 . 1 1 11 11 LYS N N 15 124.483 0.300 . 1 . . . . 11 LYS N . 11475 1 63 . 1 1 12 12 CYS H H 1 8.923 0.030 . 1 . . . . 12 CYS H . 11475 1 64 . 1 1 12 12 CYS HA H 1 4.675 0.030 . 1 . . . . 12 CYS HA . 11475 1 65 . 1 1 12 12 CYS HB2 H 1 3.500 0.030 . 2 . . . . 12 CYS HB2 . 11475 1 66 . 1 1 12 12 CYS HB3 H 1 2.779 0.030 . 2 . . . . 12 CYS HB3 . 11475 1 67 . 1 1 12 12 CYS C C 13 174.837 0.300 . 1 . . . . 12 CYS C . 11475 1 68 . 1 1 12 12 CYS CA C 13 57.638 0.300 . 1 . . . . 12 CYS CA . 11475 1 69 . 1 1 12 12 CYS CB C 13 30.718 0.300 . 1 . . . . 12 CYS CB . 11475 1 70 . 1 1 12 12 CYS N N 15 129.300 0.300 . 1 . . . . 12 CYS N . 11475 1 71 . 1 1 13 13 PRO HA H 1 4.647 0.030 . 1 . . . . 13 PRO HA . 11475 1 72 . 1 1 13 13 PRO HB2 H 1 2.419 0.030 . 2 . . . . 13 PRO HB2 . 11475 1 73 . 1 1 13 13 PRO HB3 H 1 2.048 0.030 . 2 . . . . 13 PRO HB3 . 11475 1 74 . 1 1 13 13 PRO HD2 H 1 4.427 0.030 . 2 . . . . 13 PRO HD2 . 11475 1 75 . 1 1 13 13 PRO HD3 H 1 4.073 0.030 . 2 . . . . 13 PRO HD3 . 11475 1 76 . 1 1 13 13 PRO HG2 H 1 2.181 0.030 . 2 . . . . 13 PRO HG2 . 11475 1 77 . 1 1 13 13 PRO HG3 H 1 2.062 0.030 . 2 . . . . 13 PRO HG3 . 11475 1 78 . 1 1 13 13 PRO C C 13 177.663 0.300 . 1 . . . . 13 PRO C . 11475 1 79 . 1 1 13 13 PRO CA C 13 63.898 0.300 . 1 . . . . 13 PRO CA . 11475 1 80 . 1 1 13 13 PRO CB C 13 32.530 0.300 . 1 . . . . 13 PRO CB . 11475 1 81 . 1 1 13 13 PRO CD C 13 51.482 0.300 . 1 . . . . 13 PRO CD . 11475 1 82 . 1 1 13 13 PRO CG C 13 27.256 0.300 . 1 . . . . 13 PRO CG . 11475 1 83 . 1 1 14 14 GLN H H 1 9.628 0.030 . 1 . . . . 14 GLN H . 11475 1 84 . 1 1 14 14 GLN HA H 1 4.434 0.030 . 1 . . . . 14 GLN HA . 11475 1 85 . 1 1 14 14 GLN HB2 H 1 1.643 0.030 . 2 . . . . 14 GLN HB2 . 11475 1 86 . 1 1 14 14 GLN HB3 H 1 0.913 0.030 . 2 . . . . 14 GLN HB3 . 11475 1 87 . 1 1 14 14 GLN HE21 H 1 7.289 0.030 . 2 . . . . 14 GLN HE21 . 11475 1 88 . 1 1 14 14 GLN HE22 H 1 6.793 0.030 . 2 . . . . 14 GLN HE22 . 11475 1 89 . 1 1 14 14 GLN HG2 H 1 2.019 0.030 . 2 . . . . 14 GLN HG2 . 11475 1 90 . 1 1 14 14 GLN HG3 H 1 1.886 0.030 . 2 . . . . 14 GLN HG3 . 11475 1 91 . 1 1 14 14 GLN C C 13 174.858 0.300 . 1 . . . . 14 GLN C . 11475 1 92 . 1 1 14 14 GLN CA C 13 56.137 0.300 . 1 . . . . 14 GLN CA . 11475 1 93 . 1 1 14 14 GLN CB C 13 30.751 0.300 . 1 . . . . 14 GLN CB . 11475 1 94 . 1 1 14 14 GLN CG C 13 34.674 0.300 . 1 . . . . 14 GLN CG . 11475 1 95 . 1 1 14 14 GLN N N 15 119.831 0.300 . 1 . . . . 14 GLN N . 11475 1 96 . 1 1 14 14 GLN NE2 N 15 110.760 0.300 . 1 . . . . 14 GLN NE2 . 11475 1 97 . 1 1 15 15 CYS H H 1 7.959 0.030 . 1 . . . . 15 CYS H . 11475 1 98 . 1 1 15 15 CYS HA H 1 5.009 0.030 . 1 . . . . 15 CYS HA . 11475 1 99 . 1 1 15 15 CYS HB2 H 1 3.437 0.030 . 2 . . . . 15 CYS HB2 . 11475 1 100 . 1 1 15 15 CYS HB3 H 1 3.213 0.030 . 2 . . . . 15 CYS HB3 . 11475 1 101 . 1 1 15 15 CYS C C 13 173.170 0.300 . 1 . . . . 15 CYS C . 11475 1 102 . 1 1 15 15 CYS CA C 13 58.656 0.300 . 1 . . . . 15 CYS CA . 11475 1 103 . 1 1 15 15 CYS CB C 13 29.849 0.300 . 1 . . . . 15 CYS CB . 11475 1 104 . 1 1 15 15 CYS N N 15 120.940 0.300 . 1 . . . . 15 CYS N . 11475 1 105 . 1 1 16 16 SER H H 1 8.028 0.030 . 1 . . . . 16 SER H . 11475 1 106 . 1 1 16 16 SER HA H 1 4.400 0.030 . 1 . . . . 16 SER HA . 11475 1 107 . 1 1 16 16 SER HB2 H 1 4.098 0.030 . 2 . . . . 16 SER HB2 . 11475 1 108 . 1 1 16 16 SER HB3 H 1 3.935 0.030 . 2 . . . . 16 SER HB3 . 11475 1 109 . 1 1 16 16 SER C C 13 174.257 0.300 . 1 . . . . 16 SER C . 11475 1 110 . 1 1 16 16 SER CA C 13 59.587 0.300 . 1 . . . . 16 SER CA . 11475 1 111 . 1 1 16 16 SER CB C 13 63.824 0.300 . 1 . . . . 16 SER CB . 11475 1 112 . 1 1 16 16 SER N N 15 110.866 0.300 . 1 . . . . 16 SER N . 11475 1 113 . 1 1 17 17 TYR H H 1 9.020 0.030 . 1 . . . . 17 TYR H . 11475 1 114 . 1 1 17 17 TYR HA H 1 3.953 0.030 . 1 . . . . 17 TYR HA . 11475 1 115 . 1 1 17 17 TYR HB2 H 1 2.636 0.030 . 2 . . . . 17 TYR HB2 . 11475 1 116 . 1 1 17 17 TYR HB3 H 1 2.031 0.030 . 2 . . . . 17 TYR HB3 . 11475 1 117 . 1 1 17 17 TYR HD1 H 1 6.542 0.030 . 1 . . . . 17 TYR HD1 . 11475 1 118 . 1 1 17 17 TYR HD2 H 1 6.542 0.030 . 1 . . . . 17 TYR HD2 . 11475 1 119 . 1 1 17 17 TYR HE1 H 1 6.452 0.030 . 1 . . . . 17 TYR HE1 . 11475 1 120 . 1 1 17 17 TYR HE2 H 1 6.452 0.030 . 1 . . . . 17 TYR HE2 . 11475 1 121 . 1 1 17 17 TYR C C 13 173.170 0.300 . 1 . . . . 17 TYR C . 11475 1 122 . 1 1 17 17 TYR CA C 13 60.885 0.300 . 1 . . . . 17 TYR CA . 11475 1 123 . 1 1 17 17 TYR CB C 13 39.543 0.300 . 1 . . . . 17 TYR CB . 11475 1 124 . 1 1 17 17 TYR CD1 C 13 132.580 0.300 . 1 . . . . 17 TYR CD1 . 11475 1 125 . 1 1 17 17 TYR CD2 C 13 132.580 0.300 . 1 . . . . 17 TYR CD2 . 11475 1 126 . 1 1 17 17 TYR CE1 C 13 117.095 0.300 . 1 . . . . 17 TYR CE1 . 11475 1 127 . 1 1 17 17 TYR CE2 C 13 117.095 0.300 . 1 . . . . 17 TYR CE2 . 11475 1 128 . 1 1 17 17 TYR N N 15 128.129 0.300 . 1 . . . . 17 TYR N . 11475 1 129 . 1 1 18 18 ALA H H 1 6.899 0.030 . 1 . . . . 18 ALA H . 11475 1 130 . 1 1 18 18 ALA HA H 1 4.896 0.030 . 1 . . . . 18 ALA HA . 11475 1 131 . 1 1 18 18 ALA HB1 H 1 1.136 0.030 . 1 . . . . 18 ALA HB . 11475 1 132 . 1 1 18 18 ALA HB2 H 1 1.136 0.030 . 1 . . . . 18 ALA HB . 11475 1 133 . 1 1 18 18 ALA HB3 H 1 1.136 0.030 . 1 . . . . 18 ALA HB . 11475 1 134 . 1 1 18 18 ALA C C 13 175.065 0.300 . 1 . . . . 18 ALA C . 11475 1 135 . 1 1 18 18 ALA CA C 13 50.569 0.300 . 1 . . . . 18 ALA CA . 11475 1 136 . 1 1 18 18 ALA CB C 13 22.969 0.300 . 1 . . . . 18 ALA CB . 11475 1 137 . 1 1 18 18 ALA N N 15 127.893 0.300 . 1 . . . . 18 ALA N . 11475 1 138 . 1 1 19 19 SER H H 1 8.641 0.030 . 1 . . . . 19 SER H . 11475 1 139 . 1 1 19 19 SER HA H 1 4.505 0.030 . 1 . . . . 19 SER HA . 11475 1 140 . 1 1 19 19 SER HB2 H 1 3.987 0.030 . 2 . . . . 19 SER HB2 . 11475 1 141 . 1 1 19 19 SER HB3 H 1 3.417 0.030 . 2 . . . . 19 SER HB3 . 11475 1 142 . 1 1 19 19 SER C C 13 173.435 0.300 . 1 . . . . 19 SER C . 11475 1 143 . 1 1 19 19 SER CA C 13 56.482 0.300 . 1 . . . . 19 SER CA . 11475 1 144 . 1 1 19 19 SER CB C 13 65.315 0.300 . 1 . . . . 19 SER CB . 11475 1 145 . 1 1 19 19 SER N N 15 111.532 0.300 . 1 . . . . 19 SER N . 11475 1 146 . 1 1 20 20 ALA HA H 1 4.597 0.030 . 1 . . . . 20 ALA HA . 11475 1 147 . 1 1 20 20 ALA HB1 H 1 1.579 0.030 . 1 . . . . 20 ALA HB . 11475 1 148 . 1 1 20 20 ALA HB2 H 1 1.579 0.030 . 1 . . . . 20 ALA HB . 11475 1 149 . 1 1 20 20 ALA HB3 H 1 1.579 0.030 . 1 . . . . 20 ALA HB . 11475 1 150 . 1 1 20 20 ALA CA C 13 53.212 0.300 . 1 . . . . 20 ALA CA . 11475 1 151 . 1 1 20 20 ALA CB C 13 19.532 0.300 . 1 . . . . 20 ALA CB . 11475 1 152 . 1 1 21 21 ILE H H 1 8.510 0.030 . 1 . . . . 21 ILE H . 11475 1 153 . 1 1 21 21 ILE HA H 1 4.464 0.030 . 1 . . . . 21 ILE HA . 11475 1 154 . 1 1 21 21 ILE HB H 1 1.917 0.030 . 1 . . . . 21 ILE HB . 11475 1 155 . 1 1 21 21 ILE HD11 H 1 0.889 0.030 . 1 . . . . 21 ILE HD1 . 11475 1 156 . 1 1 21 21 ILE HD12 H 1 0.889 0.030 . 1 . . . . 21 ILE HD1 . 11475 1 157 . 1 1 21 21 ILE HD13 H 1 0.889 0.030 . 1 . . . . 21 ILE HD1 . 11475 1 158 . 1 1 21 21 ILE HG12 H 1 1.469 0.030 . 2 . . . . 21 ILE HG12 . 11475 1 159 . 1 1 21 21 ILE HG13 H 1 1.200 0.030 . 2 . . . . 21 ILE HG13 . 11475 1 160 . 1 1 21 21 ILE HG21 H 1 0.977 0.030 . 1 . . . . 21 ILE HG2 . 11475 1 161 . 1 1 21 21 ILE HG22 H 1 0.977 0.030 . 1 . . . . 21 ILE HG2 . 11475 1 162 . 1 1 21 21 ILE HG23 H 1 0.977 0.030 . 1 . . . . 21 ILE HG2 . 11475 1 163 . 1 1 21 21 ILE C C 13 176.600 0.300 . 1 . . . . 21 ILE C . 11475 1 164 . 1 1 21 21 ILE CA C 13 59.484 0.300 . 1 . . . . 21 ILE CA . 11475 1 165 . 1 1 21 21 ILE CB C 13 39.639 0.300 . 1 . . . . 21 ILE CB . 11475 1 166 . 1 1 21 21 ILE CD1 C 13 12.516 0.300 . 1 . . . . 21 ILE CD1 . 11475 1 167 . 1 1 21 21 ILE CG1 C 13 26.990 0.300 . 1 . . . . 21 ILE CG1 . 11475 1 168 . 1 1 21 21 ILE CG2 C 13 18.115 0.300 . 1 . . . . 21 ILE CG2 . 11475 1 169 . 1 1 21 21 ILE N N 15 118.142 0.300 . 1 . . . . 21 ILE N . 11475 1 170 . 1 1 22 22 LYS HA H 1 3.022 0.030 . 1 . . . . 22 LYS HA . 11475 1 171 . 1 1 22 22 LYS HB2 H 1 1.447 0.030 . 2 . . . . 22 LYS HB2 . 11475 1 172 . 1 1 22 22 LYS HB3 H 1 0.832 0.030 . 2 . . . . 22 LYS HB3 . 11475 1 173 . 1 1 22 22 LYS HD2 H 1 1.482 0.030 . 2 . . . . 22 LYS HD2 . 11475 1 174 . 1 1 22 22 LYS HD3 H 1 1.413 0.030 . 2 . . . . 22 LYS HD3 . 11475 1 175 . 1 1 22 22 LYS HE2 H 1 2.891 0.030 . 1 . . . . 22 LYS HE2 . 11475 1 176 . 1 1 22 22 LYS HE3 H 1 2.891 0.030 . 1 . . . . 22 LYS HE3 . 11475 1 177 . 1 1 22 22 LYS HG2 H 1 1.116 0.030 . 2 . . . . 22 LYS HG2 . 11475 1 178 . 1 1 22 22 LYS HG3 H 1 0.878 0.030 . 2 . . . . 22 LYS HG3 . 11475 1 179 . 1 1 22 22 LYS C C 13 178.541 0.300 . 1 . . . . 22 LYS C . 11475 1 180 . 1 1 22 22 LYS CA C 13 60.396 0.300 . 1 . . . . 22 LYS CA . 11475 1 181 . 1 1 22 22 LYS CB C 13 31.384 0.300 . 1 . . . . 22 LYS CB . 11475 1 182 . 1 1 22 22 LYS CD C 13 28.951 0.300 . 1 . . . . 22 LYS CD . 11475 1 183 . 1 1 22 22 LYS CE C 13 42.050 0.300 . 1 . . . . 22 LYS CE . 11475 1 184 . 1 1 22 22 LYS CG C 13 24.749 0.300 . 1 . . . . 22 LYS CG . 11475 1 185 . 1 1 23 23 ALA H H 1 8.675 0.030 . 1 . . . . 23 ALA H . 11475 1 186 . 1 1 23 23 ALA HA H 1 4.074 0.030 . 1 . . . . 23 ALA HA . 11475 1 187 . 1 1 23 23 ALA HB1 H 1 1.385 0.030 . 1 . . . . 23 ALA HB . 11475 1 188 . 1 1 23 23 ALA HB2 H 1 1.385 0.030 . 1 . . . . 23 ALA HB . 11475 1 189 . 1 1 23 23 ALA HB3 H 1 1.385 0.030 . 1 . . . . 23 ALA HB . 11475 1 190 . 1 1 23 23 ALA C C 13 179.714 0.300 . 1 . . . . 23 ALA C . 11475 1 191 . 1 1 23 23 ALA CA C 13 55.154 0.300 . 1 . . . . 23 ALA CA . 11475 1 192 . 1 1 23 23 ALA CB C 13 18.366 0.300 . 1 . . . . 23 ALA CB . 11475 1 193 . 1 1 23 23 ALA N N 15 119.179 0.300 . 1 . . . . 23 ALA N . 11475 1 194 . 1 1 24 24 ASN H H 1 7.076 0.030 . 1 . . . . 24 ASN H . 11475 1 195 . 1 1 24 24 ASN HA H 1 4.520 0.030 . 1 . . . . 24 ASN HA . 11475 1 196 . 1 1 24 24 ASN HB2 H 1 3.298 0.030 . 2 . . . . 24 ASN HB2 . 11475 1 197 . 1 1 24 24 ASN HB3 H 1 3.172 0.030 . 2 . . . . 24 ASN HB3 . 11475 1 198 . 1 1 24 24 ASN HD21 H 1 7.339 0.030 . 2 . . . . 24 ASN HD21 . 11475 1 199 . 1 1 24 24 ASN HD22 H 1 7.231 0.030 . 2 . . . . 24 ASN HD22 . 11475 1 200 . 1 1 24 24 ASN C C 13 178.878 0.300 . 1 . . . . 24 ASN C . 11475 1 201 . 1 1 24 24 ASN CA C 13 55.201 0.300 . 1 . . . . 24 ASN CA . 11475 1 202 . 1 1 24 24 ASN CB C 13 36.909 0.300 . 1 . . . . 24 ASN CB . 11475 1 203 . 1 1 24 24 ASN N N 15 114.705 0.300 . 1 . . . . 24 ASN N . 11475 1 204 . 1 1 24 24 ASN ND2 N 15 110.941 0.300 . 1 . . . . 24 ASN ND2 . 11475 1 205 . 1 1 25 25 LEU H H 1 7.499 0.030 . 1 . . . . 25 LEU H . 11475 1 206 . 1 1 25 25 LEU HA H 1 4.396 0.030 . 1 . . . . 25 LEU HA . 11475 1 207 . 1 1 25 25 LEU HB2 H 1 2.211 0.030 . 2 . . . . 25 LEU HB2 . 11475 1 208 . 1 1 25 25 LEU HB3 H 1 1.547 0.030 . 2 . . . . 25 LEU HB3 . 11475 1 209 . 1 1 25 25 LEU HD11 H 1 1.075 0.030 . 1 . . . . 25 LEU HD1 . 11475 1 210 . 1 1 25 25 LEU HD12 H 1 1.075 0.030 . 1 . . . . 25 LEU HD1 . 11475 1 211 . 1 1 25 25 LEU HD13 H 1 1.075 0.030 . 1 . . . . 25 LEU HD1 . 11475 1 212 . 1 1 25 25 LEU HD21 H 1 1.017 0.030 . 1 . . . . 25 LEU HD2 . 11475 1 213 . 1 1 25 25 LEU HD22 H 1 1.017 0.030 . 1 . . . . 25 LEU HD2 . 11475 1 214 . 1 1 25 25 LEU HD23 H 1 1.017 0.030 . 1 . . . . 25 LEU HD2 . 11475 1 215 . 1 1 25 25 LEU HG H 1 1.786 0.030 . 1 . . . . 25 LEU HG . 11475 1 216 . 1 1 25 25 LEU C C 13 177.627 0.300 . 1 . . . . 25 LEU C . 11475 1 217 . 1 1 25 25 LEU CA C 13 57.935 0.300 . 1 . . . . 25 LEU CA . 11475 1 218 . 1 1 25 25 LEU CB C 13 40.216 0.300 . 1 . . . . 25 LEU CB . 11475 1 219 . 1 1 25 25 LEU CD1 C 13 23.054 0.300 . 2 . . . . 25 LEU CD1 . 11475 1 220 . 1 1 25 25 LEU CD2 C 13 25.820 0.300 . 2 . . . . 25 LEU CD2 . 11475 1 221 . 1 1 25 25 LEU CG C 13 27.404 0.300 . 1 . . . . 25 LEU CG . 11475 1 222 . 1 1 25 25 LEU N N 15 122.849 0.300 . 1 . . . . 25 LEU N . 11475 1 223 . 1 1 26 26 ASN H H 1 8.088 0.030 . 1 . . . . 26 ASN H . 11475 1 224 . 1 1 26 26 ASN HA H 1 4.399 0.030 . 1 . . . . 26 ASN HA . 11475 1 225 . 1 1 26 26 ASN HB2 H 1 2.901 0.030 . 2 . . . . 26 ASN HB2 . 11475 1 226 . 1 1 26 26 ASN HB3 H 1 2.807 0.030 . 2 . . . . 26 ASN HB3 . 11475 1 227 . 1 1 26 26 ASN HD21 H 1 7.574 0.030 . 2 . . . . 26 ASN HD21 . 11475 1 228 . 1 1 26 26 ASN HD22 H 1 6.769 0.030 . 2 . . . . 26 ASN HD22 . 11475 1 229 . 1 1 26 26 ASN C C 13 178.015 0.300 . 1 . . . . 26 ASN C . 11475 1 230 . 1 1 26 26 ASN CA C 13 56.661 0.300 . 1 . . . . 26 ASN CA . 11475 1 231 . 1 1 26 26 ASN CB C 13 37.549 0.300 . 1 . . . . 26 ASN CB . 11475 1 232 . 1 1 26 26 ASN N N 15 117.517 0.300 . 1 . . . . 26 ASN N . 11475 1 233 . 1 1 26 26 ASN ND2 N 15 110.721 0.300 . 1 . . . . 26 ASN ND2 . 11475 1 234 . 1 1 27 27 VAL H H 1 7.469 0.030 . 1 . . . . 27 VAL H . 11475 1 235 . 1 1 27 27 VAL HA H 1 3.611 0.030 . 1 . . . . 27 VAL HA . 11475 1 236 . 1 1 27 27 VAL HB H 1 2.080 0.030 . 1 . . . . 27 VAL HB . 11475 1 237 . 1 1 27 27 VAL HG11 H 1 1.100 0.030 . 1 . . . . 27 VAL HG1 . 11475 1 238 . 1 1 27 27 VAL HG12 H 1 1.100 0.030 . 1 . . . . 27 VAL HG1 . 11475 1 239 . 1 1 27 27 VAL HG13 H 1 1.100 0.030 . 1 . . . . 27 VAL HG1 . 11475 1 240 . 1 1 27 27 VAL HG21 H 1 0.931 0.030 . 1 . . . . 27 VAL HG2 . 11475 1 241 . 1 1 27 27 VAL HG22 H 1 0.931 0.030 . 1 . . . . 27 VAL HG2 . 11475 1 242 . 1 1 27 27 VAL HG23 H 1 0.931 0.030 . 1 . . . . 27 VAL HG2 . 11475 1 243 . 1 1 27 27 VAL C C 13 178.363 0.300 . 1 . . . . 27 VAL C . 11475 1 244 . 1 1 27 27 VAL CA C 13 66.403 0.300 . 1 . . . . 27 VAL CA . 11475 1 245 . 1 1 27 27 VAL CB C 13 32.212 0.300 . 1 . . . . 27 VAL CB . 11475 1 246 . 1 1 27 27 VAL CG1 C 13 22.550 0.300 . 2 . . . . 27 VAL CG1 . 11475 1 247 . 1 1 27 27 VAL CG2 C 13 21.206 0.300 . 2 . . . . 27 VAL CG2 . 11475 1 248 . 1 1 27 27 VAL N N 15 118.731 0.300 . 1 . . . . 27 VAL N . 11475 1 249 . 1 1 28 28 HIS H H 1 7.793 0.030 . 1 . . . . 28 HIS H . 11475 1 250 . 1 1 28 28 HIS HA H 1 3.827 0.030 . 1 . . . . 28 HIS HA . 11475 1 251 . 1 1 28 28 HIS HB2 H 1 3.233 0.030 . 2 . . . . 28 HIS HB2 . 11475 1 252 . 1 1 28 28 HIS HB3 H 1 2.470 0.030 . 2 . . . . 28 HIS HB3 . 11475 1 253 . 1 1 28 28 HIS HD2 H 1 6.850 0.030 . 1 . . . . 28 HIS HD2 . 11475 1 254 . 1 1 28 28 HIS HE1 H 1 7.553 0.030 . 1 . . . . 28 HIS HE1 . 11475 1 255 . 1 1 28 28 HIS C C 13 176.634 0.300 . 1 . . . . 28 HIS C . 11475 1 256 . 1 1 28 28 HIS CA C 13 60.108 0.300 . 1 . . . . 28 HIS CA . 11475 1 257 . 1 1 28 28 HIS CB C 13 27.778 0.300 . 1 . . . . 28 HIS CB . 11475 1 258 . 1 1 28 28 HIS CD2 C 13 126.429 0.300 . 1 . . . . 28 HIS CD2 . 11475 1 259 . 1 1 28 28 HIS CE1 C 13 138.405 0.300 . 1 . . . . 28 HIS CE1 . 11475 1 260 . 1 1 28 28 HIS N N 15 121.308 0.300 . 1 . . . . 28 HIS N . 11475 1 261 . 1 1 29 29 LEU H H 1 8.566 0.030 . 1 . . . . 29 LEU H . 11475 1 262 . 1 1 29 29 LEU HA H 1 3.841 0.030 . 1 . . . . 29 LEU HA . 11475 1 263 . 1 1 29 29 LEU HB2 H 1 1.922 0.030 . 2 . . . . 29 LEU HB2 . 11475 1 264 . 1 1 29 29 LEU HB3 H 1 1.643 0.030 . 2 . . . . 29 LEU HB3 . 11475 1 265 . 1 1 29 29 LEU HD11 H 1 1.071 0.030 . 1 . . . . 29 LEU HD1 . 11475 1 266 . 1 1 29 29 LEU HD12 H 1 1.071 0.030 . 1 . . . . 29 LEU HD1 . 11475 1 267 . 1 1 29 29 LEU HD13 H 1 1.071 0.030 . 1 . . . . 29 LEU HD1 . 11475 1 268 . 1 1 29 29 LEU HD21 H 1 1.231 0.030 . 1 . . . . 29 LEU HD2 . 11475 1 269 . 1 1 29 29 LEU HD22 H 1 1.231 0.030 . 1 . . . . 29 LEU HD2 . 11475 1 270 . 1 1 29 29 LEU HD23 H 1 1.231 0.030 . 1 . . . . 29 LEU HD2 . 11475 1 271 . 1 1 29 29 LEU HG H 1 2.065 0.030 . 1 . . . . 29 LEU HG . 11475 1 272 . 1 1 29 29 LEU C C 13 179.344 0.300 . 1 . . . . 29 LEU C . 11475 1 273 . 1 1 29 29 LEU CA C 13 58.188 0.300 . 1 . . . . 29 LEU CA . 11475 1 274 . 1 1 29 29 LEU CB C 13 42.268 0.300 . 1 . . . . 29 LEU CB . 11475 1 275 . 1 1 29 29 LEU CD1 C 13 25.483 0.300 . 2 . . . . 29 LEU CD1 . 11475 1 276 . 1 1 29 29 LEU CD2 C 13 24.709 0.300 . 2 . . . . 29 LEU CD2 . 11475 1 277 . 1 1 29 29 LEU CG C 13 27.385 0.300 . 1 . . . . 29 LEU CG . 11475 1 278 . 1 1 29 29 LEU N N 15 116.829 0.300 . 1 . . . . 29 LEU N . 11475 1 279 . 1 1 30 30 ARG H H 1 7.232 0.030 . 1 . . . . 30 ARG H . 11475 1 280 . 1 1 30 30 ARG HA H 1 4.123 0.030 . 1 . . . . 30 ARG HA . 11475 1 281 . 1 1 30 30 ARG HB2 H 1 1.926 0.030 . 2 . . . . 30 ARG HB2 . 11475 1 282 . 1 1 30 30 ARG HB3 H 1 1.794 0.030 . 2 . . . . 30 ARG HB3 . 11475 1 283 . 1 1 30 30 ARG HD2 H 1 3.194 0.030 . 1 . . . . 30 ARG HD2 . 11475 1 284 . 1 1 30 30 ARG HD3 H 1 3.194 0.030 . 1 . . . . 30 ARG HD3 . 11475 1 285 . 1 1 30 30 ARG HG2 H 1 1.859 0.030 . 2 . . . . 30 ARG HG2 . 11475 1 286 . 1 1 30 30 ARG HG3 H 1 1.663 0.030 . 2 . . . . 30 ARG HG3 . 11475 1 287 . 1 1 30 30 ARG C C 13 178.468 0.300 . 1 . . . . 30 ARG C . 11475 1 288 . 1 1 30 30 ARG CA C 13 58.298 0.300 . 1 . . . . 30 ARG CA . 11475 1 289 . 1 1 30 30 ARG CB C 13 29.857 0.300 . 1 . . . . 30 ARG CB . 11475 1 290 . 1 1 30 30 ARG CD C 13 43.662 0.300 . 1 . . . . 30 ARG CD . 11475 1 291 . 1 1 30 30 ARG CG C 13 27.632 0.300 . 1 . . . . 30 ARG CG . 11475 1 292 . 1 1 30 30 ARG N N 15 117.021 0.300 . 1 . . . . 30 ARG N . 11475 1 293 . 1 1 31 31 LYS H H 1 7.896 0.030 . 1 . . . . 31 LYS H . 11475 1 294 . 1 1 31 31 LYS HA H 1 3.971 0.030 . 1 . . . . 31 LYS HA . 11475 1 295 . 1 1 31 31 LYS HB2 H 1 1.361 0.030 . 1 . . . . 31 LYS HB2 . 11475 1 296 . 1 1 31 31 LYS HB3 H 1 1.361 0.030 . 1 . . . . 31 LYS HB3 . 11475 1 297 . 1 1 31 31 LYS HD2 H 1 1.388 0.030 . 1 . . . . 31 LYS HD2 . 11475 1 298 . 1 1 31 31 LYS HD3 H 1 1.388 0.030 . 1 . . . . 31 LYS HD3 . 11475 1 299 . 1 1 31 31 LYS HE2 H 1 2.845 0.030 . 1 . . . . 31 LYS HE2 . 11475 1 300 . 1 1 31 31 LYS HE3 H 1 2.845 0.030 . 1 . . . . 31 LYS HE3 . 11475 1 301 . 1 1 31 31 LYS HG2 H 1 1.155 0.030 . 1 . . . . 31 LYS HG2 . 11475 1 302 . 1 1 31 31 LYS HG3 H 1 1.155 0.030 . 1 . . . . 31 LYS HG3 . 11475 1 303 . 1 1 31 31 LYS C C 13 178.071 0.300 . 1 . . . . 31 LYS C . 11475 1 304 . 1 1 31 31 LYS CA C 13 57.896 0.300 . 1 . . . . 31 LYS CA . 11475 1 305 . 1 1 31 31 LYS CB C 13 31.466 0.300 . 1 . . . . 31 LYS CB . 11475 1 306 . 1 1 31 31 LYS CD C 13 29.115 0.300 . 1 . . . . 31 LYS CD . 11475 1 307 . 1 1 31 31 LYS CE C 13 41.911 0.300 . 1 . . . . 31 LYS CE . 11475 1 308 . 1 1 31 31 LYS CG C 13 24.666 0.300 . 1 . . . . 31 LYS CG . 11475 1 309 . 1 1 31 31 LYS N N 15 118.025 0.300 . 1 . . . . 31 LYS N . 11475 1 310 . 1 1 32 32 HIS H H 1 7.281 0.030 . 1 . . . . 32 HIS H . 11475 1 311 . 1 1 32 32 HIS HA H 1 4.734 0.030 . 1 . . . . 32 HIS HA . 11475 1 312 . 1 1 32 32 HIS HB2 H 1 3.268 0.030 . 2 . . . . 32 HIS HB2 . 11475 1 313 . 1 1 32 32 HIS HB3 H 1 3.121 0.030 . 2 . . . . 32 HIS HB3 . 11475 1 314 . 1 1 32 32 HIS HD2 H 1 6.623 0.030 . 1 . . . . 32 HIS HD2 . 11475 1 315 . 1 1 32 32 HIS HE1 H 1 7.938 0.030 . 1 . . . . 32 HIS HE1 . 11475 1 316 . 1 1 32 32 HIS C C 13 175.800 0.300 . 1 . . . . 32 HIS C . 11475 1 317 . 1 1 32 32 HIS CA C 13 55.720 0.300 . 1 . . . . 32 HIS CA . 11475 1 318 . 1 1 32 32 HIS CB C 13 28.713 0.300 . 1 . . . . 32 HIS CB . 11475 1 319 . 1 1 32 32 HIS CD2 C 13 127.339 0.300 . 1 . . . . 32 HIS CD2 . 11475 1 320 . 1 1 32 32 HIS CE1 C 13 139.658 0.300 . 1 . . . . 32 HIS CE1 . 11475 1 321 . 1 1 32 32 HIS N N 15 115.240 0.300 . 1 . . . . 32 HIS N . 11475 1 322 . 1 1 33 33 THR H H 1 7.799 0.030 . 1 . . . . 33 THR H . 11475 1 323 . 1 1 33 33 THR HA H 1 4.341 0.030 . 1 . . . . 33 THR HA . 11475 1 324 . 1 1 33 33 THR HB H 1 4.316 0.030 . 1 . . . . 33 THR HB . 11475 1 325 . 1 1 33 33 THR HG21 H 1 1.239 0.030 . 1 . . . . 33 THR HG2 . 11475 1 326 . 1 1 33 33 THR HG22 H 1 1.239 0.030 . 1 . . . . 33 THR HG2 . 11475 1 327 . 1 1 33 33 THR HG23 H 1 1.239 0.030 . 1 . . . . 33 THR HG2 . 11475 1 328 . 1 1 33 33 THR C C 13 175.459 0.300 . 1 . . . . 33 THR C . 11475 1 329 . 1 1 33 33 THR CA C 13 62.645 0.300 . 1 . . . . 33 THR CA . 11475 1 330 . 1 1 33 33 THR CB C 13 69.778 0.300 . 1 . . . . 33 THR CB . 11475 1 331 . 1 1 33 33 THR CG2 C 13 21.536 0.300 . 1 . . . . 33 THR CG2 . 11475 1 332 . 1 1 33 33 THR N N 15 112.379 0.300 . 1 . . . . 33 THR N . 11475 1 333 . 1 1 34 34 GLY H H 1 8.298 0.030 . 1 . . . . 34 GLY H . 11475 1 334 . 1 1 34 34 GLY HA2 H 1 3.997 0.030 . 2 . . . . 34 GLY HA2 . 11475 1 335 . 1 1 34 34 GLY HA3 H 1 3.949 0.030 . 2 . . . . 34 GLY HA3 . 11475 1 336 . 1 1 34 34 GLY C C 13 174.092 0.300 . 1 . . . . 34 GLY C . 11475 1 337 . 1 1 34 34 GLY CA C 13 45.413 0.300 . 1 . . . . 34 GLY CA . 11475 1 338 . 1 1 34 34 GLY N N 15 110.964 0.300 . 1 . . . . 34 GLY N . 11475 1 339 . 1 1 35 35 GLU H H 1 8.070 0.030 . 1 . . . . 35 GLU H . 11475 1 340 . 1 1 35 35 GLU HA H 1 4.258 0.030 . 1 . . . . 35 GLU HA . 11475 1 341 . 1 1 35 35 GLU HB2 H 1 2.053 0.030 . 2 . . . . 35 GLU HB2 . 11475 1 342 . 1 1 35 35 GLU HB3 H 1 1.918 0.030 . 2 . . . . 35 GLU HB3 . 11475 1 343 . 1 1 35 35 GLU HG2 H 1 2.279 0.030 . 2 . . . . 35 GLU HG2 . 11475 1 344 . 1 1 35 35 GLU HG3 H 1 2.233 0.030 . 2 . . . . 35 GLU HG3 . 11475 1 345 . 1 1 35 35 GLU C C 13 175.562 0.300 . 1 . . . . 35 GLU C . 11475 1 346 . 1 1 35 35 GLU CA C 13 56.662 0.300 . 1 . . . . 35 GLU CA . 11475 1 347 . 1 1 35 35 GLU CB C 13 30.532 0.300 . 1 . . . . 35 GLU CB . 11475 1 348 . 1 1 35 35 GLU CG C 13 36.365 0.300 . 1 . . . . 35 GLU CG . 11475 1 349 . 1 1 35 35 GLU N N 15 120.906 0.300 . 1 . . . . 35 GLU N . 11475 1 350 . 1 1 36 36 LYS H H 1 7.988 0.030 . 1 . . . . 36 LYS H . 11475 1 351 . 1 1 36 36 LYS HA H 1 4.139 0.030 . 1 . . . . 36 LYS HA . 11475 1 352 . 1 1 36 36 LYS HB2 H 1 1.813 0.030 . 2 . . . . 36 LYS HB2 . 11475 1 353 . 1 1 36 36 LYS HB3 H 1 1.707 0.030 . 2 . . . . 36 LYS HB3 . 11475 1 354 . 1 1 36 36 LYS HD2 H 1 1.650 0.030 . 1 . . . . 36 LYS HD2 . 11475 1 355 . 1 1 36 36 LYS HD3 H 1 1.650 0.030 . 1 . . . . 36 LYS HD3 . 11475 1 356 . 1 1 36 36 LYS HE2 H 1 2.980 0.030 . 1 . . . . 36 LYS HE2 . 11475 1 357 . 1 1 36 36 LYS HE3 H 1 2.980 0.030 . 1 . . . . 36 LYS HE3 . 11475 1 358 . 1 1 36 36 LYS HG2 H 1 1.387 0.030 . 1 . . . . 36 LYS HG2 . 11475 1 359 . 1 1 36 36 LYS HG3 H 1 1.387 0.030 . 1 . . . . 36 LYS HG3 . 11475 1 360 . 1 1 36 36 LYS C C 13 181.337 0.300 . 1 . . . . 36 LYS C . 11475 1 361 . 1 1 36 36 LYS CA C 13 57.686 0.300 . 1 . . . . 36 LYS CA . 11475 1 362 . 1 1 36 36 LYS CB C 13 33.723 0.300 . 1 . . . . 36 LYS CB . 11475 1 363 . 1 1 36 36 LYS CD C 13 29.190 0.300 . 1 . . . . 36 LYS CD . 11475 1 364 . 1 1 36 36 LYS CE C 13 42.317 0.300 . 1 . . . . 36 LYS CE . 11475 1 365 . 1 1 36 36 LYS CG C 13 24.694 0.300 . 1 . . . . 36 LYS CG . 11475 1 366 . 1 1 36 36 LYS N N 15 127.191 0.300 . 1 . . . . 36 LYS N . 11475 1 stop_ save_