################################### # 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 10222 _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 10222 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10222 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 3.934 0.030 . 1 . . . . 7 GLY HA2 . 10222 1 2 . 1 1 7 7 GLY HA3 H 1 3.934 0.030 . 1 . . . . 7 GLY HA3 . 10222 1 3 . 1 1 7 7 GLY C C 13 173.995 0.300 . 1 . . . . 7 GLY C . 10222 1 4 . 1 1 7 7 GLY CA C 13 45.347 0.300 . 1 . . . . 7 GLY CA . 10222 1 5 . 1 1 8 8 ALA H H 1 8.206 0.030 . 1 . . . . 8 ALA H . 10222 1 6 . 1 1 8 8 ALA HA H 1 4.287 0.030 . 1 . . . . 8 ALA HA . 10222 1 7 . 1 1 8 8 ALA HB1 H 1 1.342 0.030 . 1 . . . . 8 ALA HB . 10222 1 8 . 1 1 8 8 ALA HB2 H 1 1.342 0.030 . 1 . . . . 8 ALA HB . 10222 1 9 . 1 1 8 8 ALA HB3 H 1 1.342 0.030 . 1 . . . . 8 ALA HB . 10222 1 10 . 1 1 8 8 ALA C C 13 178.191 0.300 . 1 . . . . 8 ALA C . 10222 1 11 . 1 1 8 8 ALA CA C 13 52.640 0.300 . 1 . . . . 8 ALA CA . 10222 1 12 . 1 1 8 8 ALA CB C 13 19.260 0.300 . 1 . . . . 8 ALA CB . 10222 1 13 . 1 1 8 8 ALA N N 15 123.916 0.300 . 1 . . . . 8 ALA N . 10222 1 14 . 1 1 9 9 GLY H H 1 8.350 0.030 . 1 . . . . 9 GLY H . 10222 1 15 . 1 1 9 9 GLY HA2 H 1 3.879 0.030 . 1 . . . . 9 GLY HA2 . 10222 1 16 . 1 1 9 9 GLY HA3 H 1 3.879 0.030 . 1 . . . . 9 GLY HA3 . 10222 1 17 . 1 1 9 9 GLY C C 13 174.064 0.300 . 1 . . . . 9 GLY C . 10222 1 18 . 1 1 9 9 GLY CA C 13 45.102 0.300 . 1 . . . . 9 GLY CA . 10222 1 19 . 1 1 9 9 GLY N N 15 107.995 0.300 . 1 . . . . 9 GLY N . 10222 1 20 . 1 1 10 10 GLU H H 1 8.187 0.030 . 1 . . . . 10 GLU H . 10222 1 21 . 1 1 10 10 GLU HA H 1 4.163 0.030 . 1 . . . . 10 GLU HA . 10222 1 22 . 1 1 10 10 GLU HB2 H 1 1.970 0.030 . 2 . . . . 10 GLU HB2 . 10222 1 23 . 1 1 10 10 GLU HB3 H 1 1.885 0.030 . 2 . . . . 10 GLU HB3 . 10222 1 24 . 1 1 10 10 GLU HG2 H 1 2.228 0.030 . 2 . . . . 10 GLU HG2 . 10222 1 25 . 1 1 10 10 GLU HG3 H 1 2.189 0.030 . 2 . . . . 10 GLU HG3 . 10222 1 26 . 1 1 10 10 GLU C C 13 176.513 0.300 . 1 . . . . 10 GLU C . 10222 1 27 . 1 1 10 10 GLU CA C 13 56.755 0.300 . 1 . . . . 10 GLU CA . 10222 1 28 . 1 1 10 10 GLU CB C 13 30.372 0.300 . 1 . . . . 10 GLU CB . 10222 1 29 . 1 1 10 10 GLU CG C 13 36.229 0.300 . 1 . . . . 10 GLU CG . 10222 1 30 . 1 1 10 10 GLU N N 15 120.089 0.300 . 1 . . . . 10 GLU N . 10222 1 31 . 1 1 11 11 LYS H H 1 8.308 0.030 . 1 . . . . 11 LYS H . 10222 1 32 . 1 1 11 11 LYS HA H 1 4.435 0.030 . 1 . . . . 11 LYS HA . 10222 1 33 . 1 1 11 11 LYS HB2 H 1 1.517 0.030 . 2 . . . . 11 LYS HB2 . 10222 1 34 . 1 1 11 11 LYS HB3 H 1 1.344 0.030 . 2 . . . . 11 LYS HB3 . 10222 1 35 . 1 1 11 11 LYS HD2 H 1 1.422 0.030 . 1 . . . . 11 LYS HD2 . 10222 1 36 . 1 1 11 11 LYS HD3 H 1 1.422 0.030 . 1 . . . . 11 LYS HD3 . 10222 1 37 . 1 1 11 11 LYS HE2 H 1 2.877 0.030 . 1 . . . . 11 LYS HE2 . 10222 1 38 . 1 1 11 11 LYS HE3 H 1 2.877 0.030 . 1 . . . . 11 LYS HE3 . 10222 1 39 . 1 1 11 11 LYS HG2 H 1 1.268 0.030 . 2 . . . . 11 LYS HG2 . 10222 1 40 . 1 1 11 11 LYS HG3 H 1 1.108 0.030 . 2 . . . . 11 LYS HG3 . 10222 1 41 . 1 1 11 11 LYS C C 13 173.740 0.300 . 1 . . . . 11 LYS C . 10222 1 42 . 1 1 11 11 LYS CA C 13 53.707 0.300 . 1 . . . . 11 LYS CA . 10222 1 43 . 1 1 11 11 LYS CB C 13 32.998 0.300 . 1 . . . . 11 LYS CB . 10222 1 44 . 1 1 11 11 LYS CD C 13 29.393 0.300 . 1 . . . . 11 LYS CD . 10222 1 45 . 1 1 11 11 LYS CE C 13 42.184 0.300 . 1 . . . . 11 LYS CE . 10222 1 46 . 1 1 11 11 LYS CG C 13 24.799 0.300 . 1 . . . . 11 LYS CG . 10222 1 47 . 1 1 11 11 LYS N N 15 121.349 0.300 . 1 . . . . 11 LYS N . 10222 1 48 . 1 1 12 12 PRO HA H 1 4.250 0.030 . 1 . . . . 12 PRO HA . 10222 1 49 . 1 1 12 12 PRO HB2 H 1 1.975 0.030 . 2 . . . . 12 PRO HB2 . 10222 1 50 . 1 1 12 12 PRO HB3 H 1 1.196 0.030 . 2 . . . . 12 PRO HB3 . 10222 1 51 . 1 1 12 12 PRO HD2 H 1 3.567 0.030 . 2 . . . . 12 PRO HD2 . 10222 1 52 . 1 1 12 12 PRO HD3 H 1 3.532 0.030 . 2 . . . . 12 PRO HD3 . 10222 1 53 . 1 1 12 12 PRO HG2 H 1 1.748 0.030 . 2 . . . . 12 PRO HG2 . 10222 1 54 . 1 1 12 12 PRO HG3 H 1 1.546 0.030 . 2 . . . . 12 PRO HG3 . 10222 1 55 . 1 1 12 12 PRO C C 13 176.405 0.300 . 1 . . . . 12 PRO C . 10222 1 56 . 1 1 12 12 PRO CA C 13 63.446 0.300 . 1 . . . . 12 PRO CA . 10222 1 57 . 1 1 12 12 PRO CB C 13 32.187 0.300 . 1 . . . . 12 PRO CB . 10222 1 58 . 1 1 12 12 PRO CD C 13 50.225 0.300 . 1 . . . . 12 PRO CD . 10222 1 59 . 1 1 12 12 PRO CG C 13 26.615 0.300 . 1 . . . . 12 PRO CG . 10222 1 60 . 1 1 13 13 TYR H H 1 7.900 0.030 . 1 . . . . 13 TYR H . 10222 1 61 . 1 1 13 13 TYR HA H 1 4.635 0.030 . 1 . . . . 13 TYR HA . 10222 1 62 . 1 1 13 13 TYR HB2 H 1 2.925 0.030 . 2 . . . . 13 TYR HB2 . 10222 1 63 . 1 1 13 13 TYR HB3 H 1 2.813 0.030 . 2 . . . . 13 TYR HB3 . 10222 1 64 . 1 1 13 13 TYR HD1 H 1 7.000 0.030 . 1 . . . . 13 TYR HD1 . 10222 1 65 . 1 1 13 13 TYR HD2 H 1 7.000 0.030 . 1 . . . . 13 TYR HD2 . 10222 1 66 . 1 1 13 13 TYR HE1 H 1 6.835 0.030 . 1 . . . . 13 TYR HE1 . 10222 1 67 . 1 1 13 13 TYR HE2 H 1 6.835 0.030 . 1 . . . . 13 TYR HE2 . 10222 1 68 . 1 1 13 13 TYR C C 13 175.154 0.300 . 1 . . . . 13 TYR C . 10222 1 69 . 1 1 13 13 TYR CA C 13 57.184 0.300 . 1 . . . . 13 TYR CA . 10222 1 70 . 1 1 13 13 TYR CB C 13 38.108 0.300 . 1 . . . . 13 TYR CB . 10222 1 71 . 1 1 13 13 TYR CD1 C 13 133.082 0.300 . 1 . . . . 13 TYR CD1 . 10222 1 72 . 1 1 13 13 TYR CD2 C 13 133.082 0.300 . 1 . . . . 13 TYR CD2 . 10222 1 73 . 1 1 13 13 TYR CE1 C 13 118.375 0.300 . 1 . . . . 13 TYR CE1 . 10222 1 74 . 1 1 13 13 TYR CE2 C 13 118.375 0.300 . 1 . . . . 13 TYR CE2 . 10222 1 75 . 1 1 13 13 TYR N N 15 118.220 0.300 . 1 . . . . 13 TYR N . 10222 1 76 . 1 1 14 14 GLY H H 1 8.456 0.030 . 1 . . . . 14 GLY H . 10222 1 77 . 1 1 14 14 GLY HA2 H 1 3.594 0.030 . 2 . . . . 14 GLY HA2 . 10222 1 78 . 1 1 14 14 GLY HA3 H 1 4.707 0.030 . 2 . . . . 14 GLY HA3 . 10222 1 79 . 1 1 14 14 GLY C C 13 172.853 0.300 . 1 . . . . 14 GLY C . 10222 1 80 . 1 1 14 14 GLY CA C 13 44.490 0.300 . 1 . . . . 14 GLY CA . 10222 1 81 . 1 1 14 14 GLY N N 15 111.867 0.300 . 1 . . . . 14 GLY N . 10222 1 82 . 1 1 15 15 CYS H H 1 9.062 0.030 . 1 . . . . 15 CYS H . 10222 1 83 . 1 1 15 15 CYS HA H 1 4.671 0.030 . 1 . . . . 15 CYS HA . 10222 1 84 . 1 1 15 15 CYS HB2 H 1 3.383 0.030 . 2 . . . . 15 CYS HB2 . 10222 1 85 . 1 1 15 15 CYS HB3 H 1 2.842 0.030 . 2 . . . . 15 CYS HB3 . 10222 1 86 . 1 1 15 15 CYS C C 13 177.727 0.300 . 1 . . . . 15 CYS C . 10222 1 87 . 1 1 15 15 CYS CA C 13 59.128 0.300 . 1 . . . . 15 CYS CA . 10222 1 88 . 1 1 15 15 CYS CB C 13 30.051 0.300 . 1 . . . . 15 CYS CB . 10222 1 89 . 1 1 15 15 CYS N N 15 124.910 0.300 . 1 . . . . 15 CYS N . 10222 1 90 . 1 1 16 16 SER H H 1 9.141 0.030 . 1 . . . . 16 SER H . 10222 1 91 . 1 1 16 16 SER HA H 1 4.233 0.030 . 1 . . . . 16 SER HA . 10222 1 92 . 1 1 16 16 SER HB2 H 1 4.019 0.030 . 2 . . . . 16 SER HB2 . 10222 1 93 . 1 1 16 16 SER HB3 H 1 3.948 0.030 . 2 . . . . 16 SER HB3 . 10222 1 94 . 1 1 16 16 SER C C 13 174.558 0.300 . 1 . . . . 16 SER C . 10222 1 95 . 1 1 16 16 SER CA C 13 60.751 0.300 . 1 . . . . 16 SER CA . 10222 1 96 . 1 1 16 16 SER CB C 13 63.002 0.300 . 1 . . . . 16 SER CB . 10222 1 97 . 1 1 16 16 SER N N 15 127.649 0.300 . 1 . . . . 16 SER N . 10222 1 98 . 1 1 17 17 GLU H H 1 8.995 0.030 . 1 . . . . 17 GLU H . 10222 1 99 . 1 1 17 17 GLU HA H 1 4.232 0.030 . 1 . . . . 17 GLU HA . 10222 1 100 . 1 1 17 17 GLU HB2 H 1 1.400 0.030 . 2 . . . . 17 GLU HB2 . 10222 1 101 . 1 1 17 17 GLU HB3 H 1 1.211 0.030 . 2 . . . . 17 GLU HB3 . 10222 1 102 . 1 1 17 17 GLU HG2 H 1 1.835 0.030 . 2 . . . . 17 GLU HG2 . 10222 1 103 . 1 1 17 17 GLU HG3 H 1 1.796 0.030 . 2 . . . . 17 GLU HG3 . 10222 1 104 . 1 1 17 17 GLU C C 13 177.147 0.300 . 1 . . . . 17 GLU C . 10222 1 105 . 1 1 17 17 GLU CA C 13 57.745 0.300 . 1 . . . . 17 GLU CA . 10222 1 106 . 1 1 17 17 GLU CB C 13 29.520 0.300 . 1 . . . . 17 GLU CB . 10222 1 107 . 1 1 17 17 GLU CG C 13 35.511 0.300 . 1 . . . . 17 GLU CG . 10222 1 108 . 1 1 17 17 GLU N N 15 123.716 0.300 . 1 . . . . 17 GLU N . 10222 1 109 . 1 1 18 18 CYS H H 1 8.235 0.030 . 1 . . . . 18 CYS H . 10222 1 110 . 1 1 18 18 CYS HA H 1 5.138 0.030 . 1 . . . . 18 CYS HA . 10222 1 111 . 1 1 18 18 CYS HB2 H 1 2.865 0.030 . 2 . . . . 18 CYS HB2 . 10222 1 112 . 1 1 18 18 CYS HB3 H 1 3.408 0.030 . 2 . . . . 18 CYS HB3 . 10222 1 113 . 1 1 18 18 CYS C C 13 176.193 0.300 . 1 . . . . 18 CYS C . 10222 1 114 . 1 1 18 18 CYS CA C 13 58.406 0.300 . 1 . . . . 18 CYS CA . 10222 1 115 . 1 1 18 18 CYS CB C 13 32.419 0.300 . 1 . . . . 18 CYS CB . 10222 1 116 . 1 1 18 18 CYS N N 15 116.049 0.300 . 1 . . . . 18 CYS N . 10222 1 117 . 1 1 19 19 GLY H H 1 8.053 0.030 . 1 . . . . 19 GLY H . 10222 1 118 . 1 1 19 19 GLY HA2 H 1 3.839 0.030 . 2 . . . . 19 GLY HA2 . 10222 1 119 . 1 1 19 19 GLY HA3 H 1 4.189 0.030 . 2 . . . . 19 GLY HA3 . 10222 1 120 . 1 1 19 19 GLY C C 13 174.331 0.300 . 1 . . . . 19 GLY C . 10222 1 121 . 1 1 19 19 GLY CA C 13 46.163 0.300 . 1 . . . . 19 GLY CA . 10222 1 122 . 1 1 19 19 GLY N N 15 112.495 0.300 . 1 . . . . 19 GLY N . 10222 1 123 . 1 1 20 20 LYS H H 1 7.977 0.030 . 1 . . . . 20 LYS H . 10222 1 124 . 1 1 20 20 LYS HA H 1 3.960 0.030 . 1 . . . . 20 LYS HA . 10222 1 125 . 1 1 20 20 LYS HB2 H 1 1.356 0.030 . 2 . . . . 20 LYS HB2 . 10222 1 126 . 1 1 20 20 LYS HB3 H 1 1.252 0.030 . 2 . . . . 20 LYS HB3 . 10222 1 127 . 1 1 20 20 LYS HD2 H 1 1.513 0.030 . 1 . . . . 20 LYS HD2 . 10222 1 128 . 1 1 20 20 LYS HD3 H 1 1.513 0.030 . 1 . . . . 20 LYS HD3 . 10222 1 129 . 1 1 20 20 LYS HE2 H 1 2.969 0.030 . 2 . . . . 20 LYS HE2 . 10222 1 130 . 1 1 20 20 LYS HE3 H 1 2.940 0.030 . 2 . . . . 20 LYS HE3 . 10222 1 131 . 1 1 20 20 LYS HG2 H 1 1.486 0.030 . 2 . . . . 20 LYS HG2 . 10222 1 132 . 1 1 20 20 LYS HG3 H 1 1.162 0.030 . 2 . . . . 20 LYS HG3 . 10222 1 133 . 1 1 20 20 LYS C C 13 173.565 0.300 . 1 . . . . 20 LYS C . 10222 1 134 . 1 1 20 20 LYS CA C 13 58.093 0.300 . 1 . . . . 20 LYS CA . 10222 1 135 . 1 1 20 20 LYS CB C 13 33.855 0.300 . 1 . . . . 20 LYS CB . 10222 1 136 . 1 1 20 20 LYS CD C 13 29.316 0.300 . 1 . . . . 20 LYS CD . 10222 1 137 . 1 1 20 20 LYS CE C 13 42.191 0.300 . 1 . . . . 20 LYS CE . 10222 1 138 . 1 1 20 20 LYS CG C 13 26.416 0.300 . 1 . . . . 20 LYS CG . 10222 1 139 . 1 1 20 20 LYS N N 15 123.456 0.300 . 1 . . . . 20 LYS N . 10222 1 140 . 1 1 21 21 ALA H H 1 7.712 0.030 . 1 . . . . 21 ALA H . 10222 1 141 . 1 1 21 21 ALA HA H 1 5.014 0.030 . 1 . . . . 21 ALA HA . 10222 1 142 . 1 1 21 21 ALA HB1 H 1 1.154 0.030 . 1 . . . . 21 ALA HB . 10222 1 143 . 1 1 21 21 ALA HB2 H 1 1.154 0.030 . 1 . . . . 21 ALA HB . 10222 1 144 . 1 1 21 21 ALA HB3 H 1 1.154 0.030 . 1 . . . . 21 ALA HB . 10222 1 145 . 1 1 21 21 ALA C C 13 176.067 0.300 . 1 . . . . 21 ALA C . 10222 1 146 . 1 1 21 21 ALA CA C 13 50.593 0.300 . 1 . . . . 21 ALA CA . 10222 1 147 . 1 1 21 21 ALA CB C 13 22.078 0.300 . 1 . . . . 21 ALA CB . 10222 1 148 . 1 1 21 21 ALA N N 15 122.924 0.300 . 1 . . . . 21 ALA N . 10222 1 149 . 1 1 22 22 PHE H H 1 8.402 0.030 . 1 . . . . 22 PHE H . 10222 1 150 . 1 1 22 22 PHE HA H 1 4.736 0.030 . 1 . . . . 22 PHE HA . 10222 1 151 . 1 1 22 22 PHE HB2 H 1 2.875 0.030 . 2 . . . . 22 PHE HB2 . 10222 1 152 . 1 1 22 22 PHE HB3 H 1 3.417 0.030 . 2 . . . . 22 PHE HB3 . 10222 1 153 . 1 1 22 22 PHE HD1 H 1 7.274 0.030 . 1 . . . . 22 PHE HD1 . 10222 1 154 . 1 1 22 22 PHE HD2 H 1 7.274 0.030 . 1 . . . . 22 PHE HD2 . 10222 1 155 . 1 1 22 22 PHE HE1 H 1 6.803 0.030 . 1 . . . . 22 PHE HE1 . 10222 1 156 . 1 1 22 22 PHE HE2 H 1 6.803 0.030 . 1 . . . . 22 PHE HE2 . 10222 1 157 . 1 1 22 22 PHE HZ H 1 6.185 0.030 . 1 . . . . 22 PHE HZ . 10222 1 158 . 1 1 22 22 PHE C C 13 175.978 0.300 . 1 . . . . 22 PHE C . 10222 1 159 . 1 1 22 22 PHE CA C 13 57.326 0.300 . 1 . . . . 22 PHE CA . 10222 1 160 . 1 1 22 22 PHE CB C 13 44.297 0.300 . 1 . . . . 22 PHE CB . 10222 1 161 . 1 1 22 22 PHE CD1 C 13 132.202 0.300 . 1 . . . . 22 PHE CD1 . 10222 1 162 . 1 1 22 22 PHE CD2 C 13 132.202 0.300 . 1 . . . . 22 PHE CD2 . 10222 1 163 . 1 1 22 22 PHE CE1 C 13 130.830 0.300 . 1 . . . . 22 PHE CE1 . 10222 1 164 . 1 1 22 22 PHE CE2 C 13 130.830 0.300 . 1 . . . . 22 PHE CE2 . 10222 1 165 . 1 1 22 22 PHE CZ C 13 128.853 0.300 . 1 . . . . 22 PHE CZ . 10222 1 166 . 1 1 22 22 PHE N N 15 116.160 0.300 . 1 . . . . 22 PHE N . 10222 1 167 . 1 1 23 23 SER H H 1 9.393 0.030 . 1 . . . . 23 SER H . 10222 1 168 . 1 1 23 23 SER HA H 1 4.610 0.030 . 1 . . . . 23 SER HA . 10222 1 169 . 1 1 23 23 SER HB2 H 1 4.197 0.030 . 2 . . . . 23 SER HB2 . 10222 1 170 . 1 1 23 23 SER HB3 H 1 4.006 0.030 . 2 . . . . 23 SER HB3 . 10222 1 171 . 1 1 23 23 SER CA C 13 59.987 0.300 . 1 . . . . 23 SER CA . 10222 1 172 . 1 1 23 23 SER CB C 13 64.120 0.300 . 1 . . . . 23 SER CB . 10222 1 173 . 1 1 23 23 SER N N 15 114.844 0.300 . 1 . . . . 23 SER N . 10222 1 174 . 1 1 24 24 SER H H 1 7.438 0.030 . 1 . . . . 24 SER H . 10222 1 175 . 1 1 24 24 SER HA H 1 4.680 0.030 . 1 . . . . 24 SER HA . 10222 1 176 . 1 1 24 24 SER HB2 H 1 3.876 0.030 . 2 . . . . 24 SER HB2 . 10222 1 177 . 1 1 24 24 SER HB3 H 1 3.645 0.030 . 2 . . . . 24 SER HB3 . 10222 1 178 . 1 1 24 24 SER CA C 13 56.126 0.300 . 1 . . . . 24 SER CA . 10222 1 179 . 1 1 24 24 SER CB C 13 66.262 0.300 . 1 . . . . 24 SER CB . 10222 1 180 . 1 1 24 24 SER N N 15 113.000 0.300 . 1 . . . . 24 SER N . 10222 1 181 . 1 1 25 25 LYS H H 1 8.371 0.030 . 1 . . . . 25 LYS H . 10222 1 182 . 1 1 25 25 LYS HA H 1 3.283 0.030 . 1 . . . . 25 LYS HA . 10222 1 183 . 1 1 25 25 LYS HB2 H 1 1.531 0.030 . 2 . . . . 25 LYS HB2 . 10222 1 184 . 1 1 25 25 LYS HB3 H 1 1.222 0.030 . 2 . . . . 25 LYS HB3 . 10222 1 185 . 1 1 25 25 LYS HD2 H 1 1.580 0.030 . 1 . . . . 25 LYS HD2 . 10222 1 186 . 1 1 25 25 LYS HD3 H 1 1.580 0.030 . 1 . . . . 25 LYS HD3 . 10222 1 187 . 1 1 25 25 LYS HE2 H 1 2.896 0.030 . 1 . . . . 25 LYS HE2 . 10222 1 188 . 1 1 25 25 LYS HE3 H 1 2.896 0.030 . 1 . . . . 25 LYS HE3 . 10222 1 189 . 1 1 25 25 LYS HG2 H 1 1.212 0.030 . 2 . . . . 25 LYS HG2 . 10222 1 190 . 1 1 25 25 LYS HG3 H 1 1.081 0.030 . 2 . . . . 25 LYS HG3 . 10222 1 191 . 1 1 25 25 LYS CA C 13 58.883 0.300 . 1 . . . . 25 LYS CA . 10222 1 192 . 1 1 25 25 LYS CB C 13 31.758 0.300 . 1 . . . . 25 LYS CB . 10222 1 193 . 1 1 25 25 LYS CD C 13 29.179 0.300 . 1 . . . . 25 LYS CD . 10222 1 194 . 1 1 25 25 LYS CE C 13 42.014 0.300 . 1 . . . . 25 LYS CE . 10222 1 195 . 1 1 25 25 LYS CG C 13 24.949 0.300 . 1 . . . . 25 LYS CG . 10222 1 196 . 1 1 25 25 LYS N N 15 125.320 0.300 . 1 . . . . 25 LYS N . 10222 1 197 . 1 1 26 26 SER H H 1 8.141 0.030 . 1 . . . . 26 SER H . 10222 1 198 . 1 1 26 26 SER HA H 1 3.938 0.030 . 1 . . . . 26 SER HA . 10222 1 199 . 1 1 26 26 SER HB2 H 1 3.638 0.030 . 1 . . . . 26 SER HB2 . 10222 1 200 . 1 1 26 26 SER HB3 H 1 3.638 0.030 . 1 . . . . 26 SER HB3 . 10222 1 201 . 1 1 26 26 SER C C 13 176.936 0.300 . 1 . . . . 26 SER C . 10222 1 202 . 1 1 26 26 SER CA C 13 61.420 0.300 . 1 . . . . 26 SER CA . 10222 1 203 . 1 1 26 26 SER CB C 13 61.954 0.300 . 1 . . . . 26 SER CB . 10222 1 204 . 1 1 26 26 SER N N 15 113.202 0.300 . 1 . . . . 26 SER N . 10222 1 205 . 1 1 27 27 TYR H H 1 7.289 0.030 . 1 . . . . 27 TYR H . 10222 1 206 . 1 1 27 27 TYR HA H 1 4.277 0.030 . 1 . . . . 27 TYR HA . 10222 1 207 . 1 1 27 27 TYR HB2 H 1 3.139 0.030 . 2 . . . . 27 TYR HB2 . 10222 1 208 . 1 1 27 27 TYR HB3 H 1 3.002 0.030 . 2 . . . . 27 TYR HB3 . 10222 1 209 . 1 1 27 27 TYR HD1 H 1 7.158 0.030 . 1 . . . . 27 TYR HD1 . 10222 1 210 . 1 1 27 27 TYR HD2 H 1 7.158 0.030 . 1 . . . . 27 TYR HD2 . 10222 1 211 . 1 1 27 27 TYR HE1 H 1 6.838 0.030 . 1 . . . . 27 TYR HE1 . 10222 1 212 . 1 1 27 27 TYR HE2 H 1 6.838 0.030 . 1 . . . . 27 TYR HE2 . 10222 1 213 . 1 1 27 27 TYR C C 13 178.485 0.300 . 1 . . . . 27 TYR C . 10222 1 214 . 1 1 27 27 TYR CA C 13 59.473 0.300 . 1 . . . . 27 TYR CA . 10222 1 215 . 1 1 27 27 TYR CB C 13 37.432 0.300 . 1 . . . . 27 TYR CB . 10222 1 216 . 1 1 27 27 TYR CD1 C 13 132.157 0.300 . 1 . . . . 27 TYR CD1 . 10222 1 217 . 1 1 27 27 TYR CD2 C 13 132.157 0.300 . 1 . . . . 27 TYR CD2 . 10222 1 218 . 1 1 27 27 TYR CE1 C 13 118.336 0.300 . 1 . . . . 27 TYR CE1 . 10222 1 219 . 1 1 27 27 TYR CE2 C 13 118.336 0.300 . 1 . . . . 27 TYR CE2 . 10222 1 220 . 1 1 27 27 TYR N N 15 119.334 0.300 . 1 . . . . 27 TYR N . 10222 1 221 . 1 1 28 28 LEU H H 1 7.331 0.030 . 1 . . . . 28 LEU H . 10222 1 222 . 1 1 28 28 LEU HA H 1 3.427 0.030 . 1 . . . . 28 LEU HA . 10222 1 223 . 1 1 28 28 LEU HB2 H 1 2.107 0.030 . 2 . . . . 28 LEU HB2 . 10222 1 224 . 1 1 28 28 LEU HB3 H 1 1.411 0.030 . 2 . . . . 28 LEU HB3 . 10222 1 225 . 1 1 28 28 LEU HD11 H 1 1.029 0.030 . 1 . . . . 28 LEU HD1 . 10222 1 226 . 1 1 28 28 LEU HD12 H 1 1.029 0.030 . 1 . . . . 28 LEU HD1 . 10222 1 227 . 1 1 28 28 LEU HD13 H 1 1.029 0.030 . 1 . . . . 28 LEU HD1 . 10222 1 228 . 1 1 28 28 LEU HD21 H 1 1.029 0.030 . 1 . . . . 28 LEU HD2 . 10222 1 229 . 1 1 28 28 LEU HD22 H 1 1.029 0.030 . 1 . . . . 28 LEU HD2 . 10222 1 230 . 1 1 28 28 LEU HD23 H 1 1.029 0.030 . 1 . . . . 28 LEU HD2 . 10222 1 231 . 1 1 28 28 LEU HG H 1 1.568 0.030 . 1 . . . . 28 LEU HG . 10222 1 232 . 1 1 28 28 LEU C C 13 177.513 0.300 . 1 . . . . 28 LEU C . 10222 1 233 . 1 1 28 28 LEU CA C 13 58.079 0.300 . 1 . . . . 28 LEU CA . 10222 1 234 . 1 1 28 28 LEU CB C 13 40.642 0.300 . 1 . . . . 28 LEU CB . 10222 1 235 . 1 1 28 28 LEU CD1 C 13 22.806 0.300 . 2 . . . . 28 LEU CD1 . 10222 1 236 . 1 1 28 28 LEU CD2 C 13 26.496 0.300 . 2 . . . . 28 LEU CD2 . 10222 1 237 . 1 1 28 28 LEU CG C 13 27.610 0.300 . 1 . . . . 28 LEU CG . 10222 1 238 . 1 1 28 28 LEU N N 15 122.412 0.300 . 1 . . . . 28 LEU N . 10222 1 239 . 1 1 29 29 ILE H H 1 8.252 0.030 . 1 . . . . 29 ILE H . 10222 1 240 . 1 1 29 29 ILE HA H 1 3.553 0.030 . 1 . . . . 29 ILE HA . 10222 1 241 . 1 1 29 29 ILE HB H 1 1.841 0.030 . 1 . . . . 29 ILE HB . 10222 1 242 . 1 1 29 29 ILE HD11 H 1 0.750 0.030 . 1 . . . . 29 ILE HD1 . 10222 1 243 . 1 1 29 29 ILE HD12 H 1 0.750 0.030 . 1 . . . . 29 ILE HD1 . 10222 1 244 . 1 1 29 29 ILE HD13 H 1 0.750 0.030 . 1 . . . . 29 ILE HD1 . 10222 1 245 . 1 1 29 29 ILE HG12 H 1 1.168 0.030 . 2 . . . . 29 ILE HG12 . 10222 1 246 . 1 1 29 29 ILE HG13 H 1 1.573 0.030 . 2 . . . . 29 ILE HG13 . 10222 1 247 . 1 1 29 29 ILE HG21 H 1 0.830 0.030 . 1 . . . . 29 ILE HG2 . 10222 1 248 . 1 1 29 29 ILE HG22 H 1 0.830 0.030 . 1 . . . . 29 ILE HG2 . 10222 1 249 . 1 1 29 29 ILE HG23 H 1 0.830 0.030 . 1 . . . . 29 ILE HG2 . 10222 1 250 . 1 1 29 29 ILE C C 13 179.076 0.300 . 1 . . . . 29 ILE C . 10222 1 251 . 1 1 29 29 ILE CA C 13 65.256 0.300 . 1 . . . . 29 ILE CA . 10222 1 252 . 1 1 29 29 ILE CB C 13 37.648 0.300 . 1 . . . . 29 ILE CB . 10222 1 253 . 1 1 29 29 ILE CD1 C 13 12.892 0.300 . 1 . . . . 29 ILE CD1 . 10222 1 254 . 1 1 29 29 ILE CG1 C 13 29.174 0.300 . 1 . . . . 29 ILE CG1 . 10222 1 255 . 1 1 29 29 ILE CG2 C 13 17.064 0.300 . 1 . . . . 29 ILE CG2 . 10222 1 256 . 1 1 29 29 ILE N N 15 120.098 0.300 . 1 . . . . 29 ILE N . 10222 1 257 . 1 1 30 30 ILE H H 1 7.366 0.030 . 1 . . . . 30 ILE H . 10222 1 258 . 1 1 30 30 ILE HA H 1 3.509 0.030 . 1 . . . . 30 ILE HA . 10222 1 259 . 1 1 30 30 ILE HB H 1 1.672 0.030 . 1 . . . . 30 ILE HB . 10222 1 260 . 1 1 30 30 ILE HD11 H 1 0.750 0.030 . 1 . . . . 30 ILE HD1 . 10222 1 261 . 1 1 30 30 ILE HD12 H 1 0.750 0.030 . 1 . . . . 30 ILE HD1 . 10222 1 262 . 1 1 30 30 ILE HD13 H 1 0.750 0.030 . 1 . . . . 30 ILE HD1 . 10222 1 263 . 1 1 30 30 ILE HG12 H 1 1.629 0.030 . 2 . . . . 30 ILE HG12 . 10222 1 264 . 1 1 30 30 ILE HG13 H 1 1.053 0.030 . 2 . . . . 30 ILE HG13 . 10222 1 265 . 1 1 30 30 ILE HG21 H 1 0.844 0.030 . 1 . . . . 30 ILE HG2 . 10222 1 266 . 1 1 30 30 ILE HG22 H 1 0.844 0.030 . 1 . . . . 30 ILE HG2 . 10222 1 267 . 1 1 30 30 ILE HG23 H 1 0.844 0.030 . 1 . . . . 30 ILE HG2 . 10222 1 268 . 1 1 30 30 ILE C C 13 179.070 0.300 . 1 . . . . 30 ILE C . 10222 1 269 . 1 1 30 30 ILE CA C 13 65.059 0.300 . 1 . . . . 30 ILE CA . 10222 1 270 . 1 1 30 30 ILE CB C 13 38.426 0.300 . 1 . . . . 30 ILE CB . 10222 1 271 . 1 1 30 30 ILE CD1 C 13 13.027 0.300 . 1 . . . . 30 ILE CD1 . 10222 1 272 . 1 1 30 30 ILE CG1 C 13 29.156 0.300 . 1 . . . . 30 ILE CG1 . 10222 1 273 . 1 1 30 30 ILE CG2 C 13 17.162 0.300 . 1 . . . . 30 ILE CG2 . 10222 1 274 . 1 1 30 30 ILE N N 15 119.564 0.300 . 1 . . . . 30 ILE N . 10222 1 275 . 1 1 31 31 HIS H H 1 7.749 0.030 . 1 . . . . 31 HIS H . 10222 1 276 . 1 1 31 31 HIS HA H 1 4.167 0.030 . 1 . . . . 31 HIS HA . 10222 1 277 . 1 1 31 31 HIS HB2 H 1 3.058 0.030 . 2 . . . . 31 HIS HB2 . 10222 1 278 . 1 1 31 31 HIS HB3 H 1 2.650 0.030 . 2 . . . . 31 HIS HB3 . 10222 1 279 . 1 1 31 31 HIS HD2 H 1 7.046 0.030 . 1 . . . . 31 HIS HD2 . 10222 1 280 . 1 1 31 31 HIS HE1 H 1 7.953 0.030 . 1 . . . . 31 HIS HE1 . 10222 1 281 . 1 1 31 31 HIS C C 13 178.149 0.300 . 1 . . . . 31 HIS C . 10222 1 282 . 1 1 31 31 HIS CA C 13 59.298 0.300 . 1 . . . . 31 HIS CA . 10222 1 283 . 1 1 31 31 HIS CB C 13 28.126 0.300 . 1 . . . . 31 HIS CB . 10222 1 284 . 1 1 31 31 HIS CD2 C 13 127.807 0.300 . 1 . . . . 31 HIS CD2 . 10222 1 285 . 1 1 31 31 HIS CE1 C 13 139.342 0.300 . 1 . . . . 31 HIS CE1 . 10222 1 286 . 1 1 31 31 HIS N N 15 119.938 0.300 . 1 . . . . 31 HIS N . 10222 1 287 . 1 1 32 32 MET H H 1 8.834 0.030 . 1 . . . . 32 MET H . 10222 1 288 . 1 1 32 32 MET HA H 1 3.998 0.030 . 1 . . . . 32 MET HA . 10222 1 289 . 1 1 32 32 MET HB2 H 1 2.267 0.030 . 2 . . . . 32 MET HB2 . 10222 1 290 . 1 1 32 32 MET HB3 H 1 2.217 0.030 . 2 . . . . 32 MET HB3 . 10222 1 291 . 1 1 32 32 MET HE1 H 1 2.244 0.030 . 1 . . . . 32 MET HE . 10222 1 292 . 1 1 32 32 MET HE2 H 1 2.244 0.030 . 1 . . . . 32 MET HE . 10222 1 293 . 1 1 32 32 MET HE3 H 1 2.244 0.030 . 1 . . . . 32 MET HE . 10222 1 294 . 1 1 32 32 MET HG2 H 1 3.035 0.030 . 2 . . . . 32 MET HG2 . 10222 1 295 . 1 1 32 32 MET HG3 H 1 2.926 0.030 . 2 . . . . 32 MET HG3 . 10222 1 296 . 1 1 32 32 MET C C 13 178.677 0.300 . 1 . . . . 32 MET C . 10222 1 297 . 1 1 32 32 MET CA C 13 58.339 0.300 . 1 . . . . 32 MET CA . 10222 1 298 . 1 1 32 32 MET CB C 13 30.691 0.300 . 1 . . . . 32 MET CB . 10222 1 299 . 1 1 32 32 MET CE C 13 16.019 0.300 . 1 . . . . 32 MET CE . 10222 1 300 . 1 1 32 32 MET CG C 13 31.921 0.300 . 1 . . . . 32 MET CG . 10222 1 301 . 1 1 32 32 MET N N 15 119.535 0.300 . 1 . . . . 32 MET N . 10222 1 302 . 1 1 33 33 ARG H H 1 7.353 0.030 . 1 . . . . 33 ARG H . 10222 1 303 . 1 1 33 33 ARG HA H 1 4.152 0.030 . 1 . . . . 33 ARG HA . 10222 1 304 . 1 1 33 33 ARG HB2 H 1 1.933 0.030 . 2 . . . . 33 ARG HB2 . 10222 1 305 . 1 1 33 33 ARG HB3 H 1 1.842 0.030 . 2 . . . . 33 ARG HB3 . 10222 1 306 . 1 1 33 33 ARG HD2 H 1 3.162 0.030 . 1 . . . . 33 ARG HD2 . 10222 1 307 . 1 1 33 33 ARG HD3 H 1 3.162 0.030 . 1 . . . . 33 ARG HD3 . 10222 1 308 . 1 1 33 33 ARG HG2 H 1 1.887 0.030 . 2 . . . . 33 ARG HG2 . 10222 1 309 . 1 1 33 33 ARG HG3 H 1 1.649 0.030 . 2 . . . . 33 ARG HG3 . 10222 1 310 . 1 1 33 33 ARG C C 13 178.595 0.300 . 1 . . . . 33 ARG C . 10222 1 311 . 1 1 33 33 ARG CA C 13 58.840 0.300 . 1 . . . . 33 ARG CA . 10222 1 312 . 1 1 33 33 ARG CB C 13 29.865 0.300 . 1 . . . . 33 ARG CB . 10222 1 313 . 1 1 33 33 ARG CD C 13 43.762 0.300 . 1 . . . . 33 ARG CD . 10222 1 314 . 1 1 33 33 ARG CG C 13 27.774 0.300 . 1 . . . . 33 ARG CG . 10222 1 315 . 1 1 33 33 ARG N N 15 118.560 0.300 . 1 . . . . 33 ARG N . 10222 1 316 . 1 1 34 34 THR H H 1 7.849 0.030 . 1 . . . . 34 THR H . 10222 1 317 . 1 1 34 34 THR HA H 1 4.092 0.030 . 1 . . . . 34 THR HA . 10222 1 318 . 1 1 34 34 THR HB H 1 3.958 0.030 . 1 . . . . 34 THR HB . 10222 1 319 . 1 1 34 34 THR HG21 H 1 1.115 0.030 . 1 . . . . 34 THR HG2 . 10222 1 320 . 1 1 34 34 THR HG22 H 1 1.115 0.030 . 1 . . . . 34 THR HG2 . 10222 1 321 . 1 1 34 34 THR HG23 H 1 1.115 0.030 . 1 . . . . 34 THR HG2 . 10222 1 322 . 1 1 34 34 THR C C 13 175.437 0.300 . 1 . . . . 34 THR C . 10222 1 323 . 1 1 34 34 THR CA C 13 63.939 0.300 . 1 . . . . 34 THR CA . 10222 1 324 . 1 1 34 34 THR CB C 13 69.256 0.300 . 1 . . . . 34 THR CB . 10222 1 325 . 1 1 34 34 THR CG2 C 13 20.855 0.300 . 1 . . . . 34 THR CG2 . 10222 1 326 . 1 1 34 34 THR N N 15 109.861 0.300 . 1 . . . . 34 THR N . 10222 1 327 . 1 1 35 35 HIS H H 1 7.161 0.030 . 1 . . . . 35 HIS H . 10222 1 328 . 1 1 35 35 HIS HA H 1 4.867 0.030 . 1 . . . . 35 HIS HA . 10222 1 329 . 1 1 35 35 HIS HB2 H 1 3.059 0.030 . 2 . . . . 35 HIS HB2 . 10222 1 330 . 1 1 35 35 HIS HB3 H 1 3.335 0.030 . 2 . . . . 35 HIS HB3 . 10222 1 331 . 1 1 35 35 HIS HD2 H 1 6.709 0.030 . 1 . . . . 35 HIS HD2 . 10222 1 332 . 1 1 35 35 HIS HE1 H 1 7.959 0.030 . 1 . . . . 35 HIS HE1 . 10222 1 333 . 1 1 35 35 HIS C C 13 175.263 0.300 . 1 . . . . 35 HIS C . 10222 1 334 . 1 1 35 35 HIS CA C 13 55.115 0.300 . 1 . . . . 35 HIS CA . 10222 1 335 . 1 1 35 35 HIS CB C 13 28.806 0.300 . 1 . . . . 35 HIS CB . 10222 1 336 . 1 1 35 35 HIS CD2 C 13 127.143 0.300 . 1 . . . . 35 HIS CD2 . 10222 1 337 . 1 1 35 35 HIS CE1 C 13 139.836 0.300 . 1 . . . . 35 HIS CE1 . 10222 1 338 . 1 1 35 35 HIS N N 15 118.505 0.300 . 1 . . . . 35 HIS N . 10222 1 339 . 1 1 36 36 SER H H 1 7.799 0.030 . 1 . . . . 36 SER H . 10222 1 340 . 1 1 36 36 SER HA H 1 4.433 0.030 . 1 . . . . 36 SER HA . 10222 1 341 . 1 1 36 36 SER HB2 H 1 3.933 0.030 . 2 . . . . 36 SER HB2 . 10222 1 342 . 1 1 36 36 SER HB3 H 1 3.874 0.030 . 2 . . . . 36 SER HB3 . 10222 1 343 . 1 1 36 36 SER C C 13 175.089 0.300 . 1 . . . . 36 SER C . 10222 1 344 . 1 1 36 36 SER CA C 13 58.832 0.300 . 1 . . . . 36 SER CA . 10222 1 345 . 1 1 36 36 SER CB C 13 63.950 0.300 . 1 . . . . 36 SER CB . 10222 1 346 . 1 1 36 36 SER N N 15 114.963 0.300 . 1 . . . . 36 SER N . 10222 1 347 . 1 1 37 37 GLY H H 1 8.368 0.030 . 1 . . . . 37 GLY H . 10222 1 348 . 1 1 37 37 GLY HA2 H 1 3.960 0.030 . 1 . . . . 37 GLY HA2 . 10222 1 349 . 1 1 37 37 GLY HA3 H 1 3.960 0.030 . 1 . . . . 37 GLY HA3 . 10222 1 350 . 1 1 37 37 GLY C C 13 174.032 0.300 . 1 . . . . 37 GLY C . 10222 1 351 . 1 1 37 37 GLY CA C 13 45.315 0.300 . 1 . . . . 37 GLY CA . 10222 1 352 . 1 1 37 37 GLY N N 15 111.027 0.300 . 1 . . . . 37 GLY N . 10222 1 353 . 1 1 38 38 GLU H H 1 8.108 0.030 . 1 . . . . 38 GLU H . 10222 1 354 . 1 1 38 38 GLU HA H 1 4.227 0.030 . 1 . . . . 38 GLU HA . 10222 1 355 . 1 1 38 38 GLU HB2 H 1 1.964 0.030 . 2 . . . . 38 GLU HB2 . 10222 1 356 . 1 1 38 38 GLU HB3 H 1 1.884 0.030 . 2 . . . . 38 GLU HB3 . 10222 1 357 . 1 1 38 38 GLU HG2 H 1 2.229 0.030 . 2 . . . . 38 GLU HG2 . 10222 1 358 . 1 1 38 38 GLU HG3 H 1 2.197 0.030 . 2 . . . . 38 GLU HG3 . 10222 1 359 . 1 1 38 38 GLU C C 13 176.258 0.300 . 1 . . . . 38 GLU C . 10222 1 360 . 1 1 38 38 GLU CA C 13 56.400 0.300 . 1 . . . . 38 GLU CA . 10222 1 361 . 1 1 38 38 GLU CB C 13 30.486 0.300 . 1 . . . . 38 GLU CB . 10222 1 362 . 1 1 38 38 GLU CG C 13 36.229 0.300 . 1 . . . . 38 GLU CG . 10222 1 363 . 1 1 38 38 GLU N N 15 120.555 0.300 . 1 . . . . 38 GLU N . 10222 1 364 . 1 1 39 39 LYS H H 1 8.412 0.030 . 1 . . . . 39 LYS H . 10222 1 365 . 1 1 39 39 LYS HA H 1 4.587 0.030 . 1 . . . . 39 LYS HA . 10222 1 366 . 1 1 39 39 LYS HB2 H 1 1.787 0.030 . 2 . . . . 39 LYS HB2 . 10222 1 367 . 1 1 39 39 LYS HB3 H 1 1.701 0.030 . 2 . . . . 39 LYS HB3 . 10222 1 368 . 1 1 39 39 LYS HD2 H 1 1.659 0.030 . 1 . . . . 39 LYS HD2 . 10222 1 369 . 1 1 39 39 LYS HD3 H 1 1.659 0.030 . 1 . . . . 39 LYS HD3 . 10222 1 370 . 1 1 39 39 LYS HE2 H 1 2.943 0.030 . 1 . . . . 39 LYS HE2 . 10222 1 371 . 1 1 39 39 LYS HE3 H 1 2.943 0.030 . 1 . . . . 39 LYS HE3 . 10222 1 372 . 1 1 39 39 LYS HG2 H 1 1.463 0.030 . 1 . . . . 39 LYS HG2 . 10222 1 373 . 1 1 39 39 LYS HG3 H 1 1.463 0.030 . 1 . . . . 39 LYS HG3 . 10222 1 374 . 1 1 39 39 LYS C C 13 174.462 0.300 . 1 . . . . 39 LYS C . 10222 1 375 . 1 1 39 39 LYS CA C 13 54.050 0.300 . 1 . . . . 39 LYS CA . 10222 1 376 . 1 1 39 39 LYS CB C 13 32.421 0.300 . 1 . . . . 39 LYS CB . 10222 1 377 . 1 1 39 39 LYS CD C 13 29.222 0.300 . 1 . . . . 39 LYS CD . 10222 1 378 . 1 1 39 39 LYS CE C 13 42.203 0.300 . 1 . . . . 39 LYS CE . 10222 1 379 . 1 1 39 39 LYS N N 15 123.844 0.300 . 1 . . . . 39 LYS N . 10222 1 380 . 1 1 40 40 PRO HA H 1 4.429 0.030 . 1 . . . . 40 PRO HA . 10222 1 381 . 1 1 40 40 PRO HB2 H 1 2.277 0.030 . 2 . . . . 40 PRO HB2 . 10222 1 382 . 1 1 40 40 PRO HB3 H 1 1.909 0.030 . 2 . . . . 40 PRO HB3 . 10222 1 383 . 1 1 40 40 PRO HD2 H 1 3.615 0.030 . 2 . . . . 40 PRO HD2 . 10222 1 384 . 1 1 40 40 PRO HD3 H 1 3.791 0.030 . 2 . . . . 40 PRO HD3 . 10222 1 385 . 1 1 40 40 PRO HG2 H 1 1.992 0.030 . 1 . . . . 40 PRO HG2 . 10222 1 386 . 1 1 40 40 PRO HG3 H 1 1.992 0.030 . 1 . . . . 40 PRO HG3 . 10222 1 387 . 1 1 40 40 PRO CA C 13 63.196 0.300 . 1 . . . . 40 PRO CA . 10222 1 388 . 1 1 40 40 PRO CB C 13 32.135 0.300 . 1 . . . . 40 PRO CB . 10222 1 389 . 1 1 40 40 PRO CD C 13 50.651 0.300 . 1 . . . . 40 PRO CD . 10222 1 390 . 1 1 40 40 PRO CG C 13 27.369 0.300 . 1 . . . . 40 PRO CG . 10222 1 391 . 1 1 41 41 SER H H 1 8.470 0.030 . 1 . . . . 41 SER H . 10222 1 392 . 1 1 41 41 SER N N 15 116.554 0.300 . 1 . . . . 41 SER N . 10222 1 393 . 1 1 42 42 GLY HA2 H 1 4.127 0.030 . 2 . . . . 42 GLY HA2 . 10222 1 394 . 1 1 42 42 GLY HA3 H 1 4.076 0.030 . 2 . . . . 42 GLY HA3 . 10222 1 395 . 1 1 42 42 GLY CA C 13 44.637 0.300 . 1 . . . . 42 GLY CA . 10222 1 396 . 1 1 43 43 PRO HA H 1 4.437 0.030 . 1 . . . . 43 PRO HA . 10222 1 397 . 1 1 43 43 PRO HB2 H 1 2.279 0.030 . 2 . . . . 43 PRO HB2 . 10222 1 398 . 1 1 43 43 PRO HB3 H 1 1.910 0.030 . 2 . . . . 43 PRO HB3 . 10222 1 399 . 1 1 43 43 PRO HD2 H 1 3.597 0.030 . 1 . . . . 43 PRO HD2 . 10222 1 400 . 1 1 43 43 PRO HD3 H 1 3.597 0.030 . 1 . . . . 43 PRO HD3 . 10222 1 401 . 1 1 43 43 PRO HG2 H 1 1.990 0.030 . 1 . . . . 43 PRO HG2 . 10222 1 402 . 1 1 43 43 PRO HG3 H 1 1.990 0.030 . 1 . . . . 43 PRO HG3 . 10222 1 403 . 1 1 43 43 PRO CA C 13 63.210 0.300 . 1 . . . . 43 PRO CA . 10222 1 404 . 1 1 43 43 PRO CB C 13 32.130 0.300 . 1 . . . . 43 PRO CB . 10222 1 405 . 1 1 43 43 PRO CD C 13 49.802 0.300 . 1 . . . . 43 PRO CD . 10222 1 406 . 1 1 43 43 PRO CG C 13 27.176 0.300 . 1 . . . . 43 PRO CG . 10222 1 407 . 1 1 44 44 SER H H 1 8.510 0.030 . 1 . . . . 44 SER H . 10222 1 408 . 1 1 44 44 SER N N 15 116.443 0.300 . 1 . . . . 44 SER N . 10222 1 stop_ save_