################################### # 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_assignment_data_set_one _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment_data_set_one _Assigned_chem_shift_list.Entry_ID 2261 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_one _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 $sample_one . 2261 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 ASP H H 1 8.2 . . 1 . . . . . . . . 2261 1 2 . 1 1 1 1 ASP HA H 1 4.9 . . 1 . . . . . . . . 2261 1 3 . 1 1 1 1 ASP HB2 H 1 2.92 . . 1 . . . . . . . . 2261 1 4 . 1 1 1 1 ASP HB3 H 1 2.62 . . 1 . . . . . . . . 2261 1 5 . 1 1 2 2 CYS H H 1 7.91 . . 1 . . . . . . . . 2261 1 6 . 1 1 2 2 CYS HA H 1 5.17 . . 1 . . . . . . . . 2261 1 7 . 1 1 2 2 CYS HB2 H 1 2.85 . . 1 . . . . . . . . 2261 1 8 . 1 1 2 2 CYS HB3 H 1 3.01 . . 1 . . . . . . . . 2261 1 9 . 1 1 3 3 TYR H H 1 8.64 . . 1 . . . . . . . . 2261 1 10 . 1 1 3 3 TYR HA H 1 5.37 . . 1 . . . . . . . . 2261 1 11 . 1 1 3 3 TYR HB2 H 1 3.14 . . 1 . . . . . . . . 2261 1 12 . 1 1 3 3 TYR HB3 H 1 2.37 . . 1 . . . . . . . . 2261 1 13 . 1 1 3 3 TYR HD1 H 1 6.47 . . 1 . . . . . . . . 2261 1 14 . 1 1 3 3 TYR HD2 H 1 6.47 . . 1 . . . . . . . . 2261 1 15 . 1 1 3 3 TYR HE1 H 1 6.98 . . 1 . . . . . . . . 2261 1 16 . 1 1 3 3 TYR HE2 H 1 6.98 . . 1 . . . . . . . . 2261 1 17 . 1 1 6 6 ASN H H 1 8.57 . . 1 . . . . . . . . 2261 1 18 . 1 1 6 6 ASN HA H 1 4.96 . . 1 . . . . . . . . 2261 1 19 . 1 1 6 6 ASN HB2 H 1 3.57 . . 1 . . . . . . . . 2261 1 20 . 1 1 6 6 ASN HB3 H 1 2.81 . . 1 . . . . . . . . 2261 1 21 . 1 1 6 6 ASN HD21 H 1 7.19 . . 2 . . . . . . . . 2261 1 22 . 1 1 6 6 ASN HD22 H 1 7.12 . . 2 . . . . . . . . 2261 1 23 . 1 1 8 8 SER H H 1 8.53 . . 1 . . . . . . . . 2261 1 24 . 1 1 8 8 SER HA H 1 4.41 . . 1 . . . . . . . . 2261 1 25 . 1 1 8 8 SER HB2 H 1 4.1 . . 1 . . . . . . . . 2261 1 26 . 1 1 8 8 SER HB3 H 1 4.04 . . 1 . . . . . . . . 2261 1 27 . 1 1 10 10 TYR H H 1 7.54 . . 1 . . . . . . . . 2261 1 28 . 1 1 10 10 TYR HA H 1 4.41 . . 1 . . . . . . . . 2261 1 29 . 1 1 10 10 TYR HB2 H 1 3.19 . . 1 . . . . . . . . 2261 1 30 . 1 1 10 10 TYR HB3 H 1 3.13 . . 1 . . . . . . . . 2261 1 31 . 1 1 10 10 TYR HD1 H 1 6.86 . . 1 . . . . . . . . 2261 1 32 . 1 1 10 10 TYR HD2 H 1 6.86 . . 1 . . . . . . . . 2261 1 33 . 1 1 10 10 TYR HE1 H 1 7.14 . . 1 . . . . . . . . 2261 1 34 . 1 1 10 10 TYR HE2 H 1 7.14 . . 1 . . . . . . . . 2261 1 35 . 1 1 15 15 SER H H 1 8.67 . . 1 . . . . . . . . 2261 1 36 . 1 1 15 15 SER HA H 1 5.26 . . 1 . . . . . . . . 2261 1 37 . 1 1 15 15 SER HB2 H 1 3.66 . . 1 . . . . . . . . 2261 1 38 . 1 1 15 15 SER HB3 H 1 4.48 . . 1 . . . . . . . . 2261 1 39 . 1 1 18 18 GLU H H 1 8.97 . . 1 . . . . . . . . 2261 1 40 . 1 1 18 18 GLU HA H 1 4.04 . . 1 . . . . . . . . 2261 1 41 . 1 1 18 18 GLU HB2 H 1 2.12 . . 1 . . . . . . . . 2261 1 42 . 1 1 18 18 GLU HB3 H 1 1.99 . . 1 . . . . . . . . 2261 1 43 . 1 1 18 18 GLU HG2 H 1 2.29 . . 2 . . . . . . . . 2261 1 44 . 1 1 18 18 GLU HG3 H 1 2.22 . . 2 . . . . . . . . 2261 1 45 . 1 1 19 19 SER H H 1 7.82 . . 1 . . . . . . . . 2261 1 46 . 1 1 19 19 SER HA H 1 4.58 . . 1 . . . . . . . . 2261 1 47 . 1 1 19 19 SER HB2 H 1 4.1 . . 1 . . . . . . . . 2261 1 48 . 1 1 19 19 SER HB3 H 1 3.9 . . 1 . . . . . . . . 2261 1 49 . 1 1 24 24 LEU H H 1 8.92 . . 1 . . . . . . . . 2261 1 50 . 1 1 24 24 LEU HA H 1 4.58 . . 1 . . . . . . . . 2261 1 51 . 1 1 24 24 LEU HB2 H 1 1.35 . . 1 . . . . . . . . 2261 1 52 . 1 1 24 24 LEU HB3 H 1 1.17 . . 1 . . . . . . . . 2261 1 53 . 1 1 24 24 LEU HG H 1 1.78 . . 1 . . . . . . . . 2261 1 54 . 1 1 24 24 LEU HD11 H 1 .92 . . 2 . . . . . . . . 2261 1 55 . 1 1 24 24 LEU HD12 H 1 .92 . . 2 . . . . . . . . 2261 1 56 . 1 1 24 24 LEU HD13 H 1 .92 . . 2 . . . . . . . . 2261 1 57 . 1 1 24 24 LEU HD21 H 1 .71 . . 2 . . . . . . . . 2261 1 58 . 1 1 24 24 LEU HD22 H 1 .71 . . 2 . . . . . . . . 2261 1 59 . 1 1 24 24 LEU HD23 H 1 .71 . . 2 . . . . . . . . 2261 1 60 . 1 1 26 26 TRP H H 1 8.36 . . 1 . . . . . . . . 2261 1 61 . 1 1 26 26 TRP HA H 1 4.08 . . 1 . . . . . . . . 2261 1 62 . 1 1 26 26 TRP HB2 H 1 3.78 . . 1 . . . . . . . . 2261 1 63 . 1 1 26 26 TRP HB3 H 1 3.18 . . 1 . . . . . . . . 2261 1 64 . 1 1 26 26 TRP HD1 H 1 7.45 . . 1 . . . . . . . . 2261 1 65 . 1 1 26 26 TRP HE1 H 1 11.57 . . 1 . . . . . . . . 2261 1 66 . 1 1 26 26 TRP HE3 H 1 7.81 . . 1 . . . . . . . . 2261 1 67 . 1 1 26 26 TRP HZ2 H 1 7.65 . . 1 . . . . . . . . 2261 1 68 . 1 1 26 26 TRP HZ3 H 1 6.96 . . 1 . . . . . . . . 2261 1 69 . 1 1 26 26 TRP HH2 H 1 5.57 . . 1 . . . . . . . . 2261 1 70 . 1 1 28 28 SER H H 1 7.49 . . 1 . . . . . . . . 2261 1 71 . 1 1 28 28 SER HA H 1 4.18 . . 1 . . . . . . . . 2261 1 72 . 1 1 28 28 SER HB2 H 1 3.67 . . 1 . . . . . . . . 2261 1 73 . 1 1 28 28 SER HB3 H 1 4.01 . . 1 . . . . . . . . 2261 1 74 . 1 1 35 35 VAL H H 1 10.4 . . 1 . . . . . . . . 2261 1 75 . 1 1 35 35 VAL HA H 1 3.69 . . 1 . . . . . . . . 2261 1 76 . 1 1 35 35 VAL HB H 1 1.72 . . 1 . . . . . . . . 2261 1 77 . 1 1 35 35 VAL HG11 H 1 .94 . . 1 . . . . . . . . 2261 1 78 . 1 1 35 35 VAL HG12 H 1 .94 . . 1 . . . . . . . . 2261 1 79 . 1 1 35 35 VAL HG13 H 1 .94 . . 1 . . . . . . . . 2261 1 80 . 1 1 35 35 VAL HG21 H 1 .11 . . 1 . . . . . . . . 2261 1 81 . 1 1 35 35 VAL HG22 H 1 .11 . . 1 . . . . . . . . 2261 1 82 . 1 1 35 35 VAL HG23 H 1 .11 . . 1 . . . . . . . . 2261 1 83 . 1 1 39 39 GLN H H 1 8.09 . . 1 . . . . . . . . 2261 1 84 . 1 1 39 39 GLN HA H 1 4.33 . . 1 . . . . . . . . 2261 1 85 . 1 1 39 39 GLN HB2 H 1 1.82 . . 1 . . . . . . . . 2261 1 86 . 1 1 39 39 GLN HB3 H 1 2.23 . . 1 . . . . . . . . 2261 1 87 . 1 1 39 39 GLN HG2 H 1 2.41 . . 2 . . . . . . . . 2261 1 88 . 1 1 39 39 GLN HG3 H 1 2.31 . . 2 . . . . . . . . 2261 1 89 . 1 1 40 40 ASN H H 1 7.49 . . 1 . . . . . . . . 2261 1 90 . 1 1 40 40 ASN HA H 1 4.85 . . 1 . . . . . . . . 2261 1 91 . 1 1 40 40 ASN HB2 H 1 3.18 . . 1 . . . . . . . . 2261 1 92 . 1 1 40 40 ASN HB3 H 1 2.64 . . 1 . . . . . . . . 2261 1 93 . 1 1 40 40 ASN HD21 H 1 7.41 . . 2 . . . . . . . . 2261 1 94 . 1 1 40 40 ASN HD22 H 1 7.24 . . 2 . . . . . . . . 2261 1 95 . 1 1 42 42 SER H H 1 8.97 . . 1 . . . . . . . . 2261 1 96 . 1 1 42 42 SER HA H 1 4.96 . . 1 . . . . . . . . 2261 1 97 . 1 1 42 42 SER HB2 H 1 3.76 . . 1 . . . . . . . . 2261 1 98 . 1 1 42 42 SER HB3 H 1 4.22 . . 1 . . . . . . . . 2261 1 99 . 1 1 48 48 LEU H H 1 8.16 . . 1 . . . . . . . . 2261 1 100 . 1 1 48 48 LEU HA H 1 3.57 . . 1 . . . . . . . . 2261 1 101 . 1 1 48 48 LEU HB2 H 1 1.58 . . 1 . . . . . . . . 2261 1 102 . 1 1 48 48 LEU HB3 H 1 .46 . . 1 . . . . . . . . 2261 1 103 . 1 1 48 48 LEU HG H 1 1.1 . . 1 . . . . . . . . 2261 1 104 . 1 1 48 48 LEU HD11 H 1 .5 . . 2 . . . . . . . . 2261 1 105 . 1 1 48 48 LEU HD12 H 1 .5 . . 2 . . . . . . . . 2261 1 106 . 1 1 48 48 LEU HD13 H 1 .5 . . 2 . . . . . . . . 2261 1 107 . 1 1 48 48 LEU HD21 H 1 .95 . . 2 . . . . . . . . 2261 1 108 . 1 1 48 48 LEU HD22 H 1 .95 . . 2 . . . . . . . . 2261 1 109 . 1 1 48 48 LEU HD23 H 1 .95 . . 2 . . . . . . . . 2261 1 110 . 1 1 51 51 HIS H H 1 7.86 . . 1 . . . . . . . . 2261 1 111 . 1 1 51 51 HIS HA H 1 4.53 . . 1 . . . . . . . . 2261 1 112 . 1 1 51 51 HIS HB2 H 1 2.83 . . 1 . . . . . . . . 2261 1 113 . 1 1 51 51 HIS HB3 H 1 1.66 . . 1 . . . . . . . . 2261 1 114 . 1 1 51 51 HIS HD2 H 1 6.85 . . 1 . . . . . . . . 2261 1 115 . 1 1 51 51 HIS HE1 H 1 7.63 . . 1 . . . . . . . . 2261 1 116 . 1 1 52 52 ASN H H 1 7.46 . . 1 . . . . . . . . 2261 1 117 . 1 1 52 52 ASN HA H 1 4.88 . . 1 . . . . . . . . 2261 1 118 . 1 1 52 52 ASN HB2 H 1 2.52 . . 1 . . . . . . . . 2261 1 119 . 1 1 52 52 ASN HB3 H 1 1.81 . . 1 . . . . . . . . 2261 1 120 . 1 1 52 52 ASN HD21 H 1 7.76 . . 2 . . . . . . . . 2261 1 121 . 1 1 52 52 ASN HD22 H 1 6.67 . . 2 . . . . . . . . 2261 1 122 . 1 1 53 53 TYR H H 1 10.08 . . 1 . . . . . . . . 2261 1 123 . 1 1 53 53 TYR HA H 1 5.15 . . 1 . . . . . . . . 2261 1 124 . 1 1 53 53 TYR HB2 H 1 2.64 . . 1 . . . . . . . . 2261 1 125 . 1 1 53 53 TYR HB3 H 1 3.31 . . 1 . . . . . . . . 2261 1 126 . 1 1 53 53 TYR HD1 H 1 6.28 . . 1 . . . . . . . . 2261 1 127 . 1 1 53 53 TYR HD2 H 1 6.28 . . 1 . . . . . . . . 2261 1 128 . 1 1 53 53 TYR HE1 H 1 6.75 . . 1 . . . . . . . . 2261 1 129 . 1 1 53 53 TYR HE2 H 1 6.75 . . 1 . . . . . . . . 2261 1 130 . 1 1 54 54 CYS H H 1 9.05 . . 1 . . . . . . . . 2261 1 131 . 1 1 54 54 CYS HA H 1 4.61 . . 1 . . . . . . . . 2261 1 132 . 1 1 54 54 CYS HB2 H 1 3.37 . . 1 . . . . . . . . 2261 1 133 . 1 1 54 54 CYS HB3 H 1 2.6 . . 1 . . . . . . . . 2261 1 134 . 1 1 56 56 ASN H H 1 8.56 . . 1 . . . . . . . . 2261 1 135 . 1 1 56 56 ASN HA H 1 5.31 . . 1 . . . . . . . . 2261 1 136 . 1 1 56 56 ASN HB2 H 1 2.51 . . 1 . . . . . . . . 2261 1 137 . 1 1 56 56 ASN HB3 H 1 1.82 . . 1 . . . . . . . . 2261 1 138 . 1 1 56 56 ASN HD21 H 1 6.79 . . 2 . . . . . . . . 2261 1 139 . 1 1 56 56 ASN HD22 H 1 6.72 . . 2 . . . . . . . . 2261 1 140 . 1 1 62 62 LYS H H 1 7.44 . . 1 . . . . . . . . 2261 1 141 . 1 1 62 62 LYS HA H 1 4.45 . . 1 . . . . . . . . 2261 1 142 . 1 1 62 62 LYS HB2 H 1 1.79 . . 1 . . . . . . . . 2261 1 143 . 1 1 62 62 LYS HB3 H 1 .92 . . 1 . . . . . . . . 2261 1 144 . 1 1 62 62 LYS HG2 H 1 1.26 . . 1 . . . . . . . . 2261 1 145 . 1 1 62 62 LYS HG3 H 1 1.26 . . 1 . . . . . . . . 2261 1 146 . 1 1 62 62 LYS HD2 H 1 1.46 . . 1 . . . . . . . . 2261 1 147 . 1 1 62 62 LYS HD3 H 1 1.46 . . 1 . . . . . . . . 2261 1 148 . 1 1 62 62 LYS HE2 H 1 2.97 . . 2 . . . . . . . . 2261 1 149 . 1 1 62 62 LYS HE3 H 1 2.83 . . 2 . . . . . . . . 2261 1 150 . 1 1 64 64 TRP H H 1 9 . . 1 . . . . . . . . 2261 1 151 . 1 1 64 64 TRP HA H 1 5.6 . . 1 . . . . . . . . 2261 1 152 . 1 1 64 64 TRP HB2 H 1 3.72 . . 1 . . . . . . . . 2261 1 153 . 1 1 64 64 TRP HB3 H 1 3.41 . . 1 . . . . . . . . 2261 1 154 . 1 1 64 64 TRP HD1 H 1 7.74 . . 1 . . . . . . . . 2261 1 155 . 1 1 64 64 TRP HE1 H 1 11.05 . . 1 . . . . . . . . 2261 1 156 . 1 1 64 64 TRP HE3 H 1 7.3 . . 1 . . . . . . . . 2261 1 157 . 1 1 64 64 TRP HZ2 H 1 6.52 . . 1 . . . . . . . . 2261 1 158 . 1 1 64 64 TRP HZ3 H 1 5.66 . . 1 . . . . . . . . 2261 1 159 . 1 1 64 64 TRP HH2 H 1 7.07 . . 1 . . . . . . . . 2261 1 160 . 1 1 65 65 CYS H H 1 8.94 . . 1 . . . . . . . . 2261 1 161 . 1 1 65 65 CYS HA H 1 4.66 . . 1 . . . . . . . . 2261 1 162 . 1 1 65 65 CYS HB2 H 1 3.49 . . 1 . . . . . . . . 2261 1 163 . 1 1 65 65 CYS HB3 H 1 3.25 . . 1 . . . . . . . . 2261 1 164 . 1 1 66 66 HIS H H 1 8.11 . . 1 . . . . . . . . 2261 1 165 . 1 1 66 66 HIS HA H 1 5.19 . . 1 . . . . . . . . 2261 1 166 . 1 1 66 66 HIS HB2 H 1 2.8 . . 1 . . . . . . . . 2261 1 167 . 1 1 66 66 HIS HB3 H 1 2.92 . . 1 . . . . . . . . 2261 1 168 . 1 1 66 66 HIS HD2 H 1 6.83 . . 1 . . . . . . . . 2261 1 169 . 1 1 66 66 HIS HE1 H 1 8.47 . . 1 . . . . . . . . 2261 1 170 . 1 1 66 66 HIS HE2 H 1 9.9 . . 1 . . . . . . . . 2261 1 171 . 1 1 67 67 VAL H H 1 8.72 . . 1 . . . . . . . . 2261 1 172 . 1 1 67 67 VAL HA H 1 4.61 . . 1 . . . . . . . . 2261 1 173 . 1 1 67 67 VAL HB H 1 1.88 . . 1 . . . . . . . . 2261 1 174 . 1 1 67 67 VAL HG11 H 1 .72 . . 1 . . . . . . . . 2261 1 175 . 1 1 67 67 VAL HG12 H 1 .72 . . 1 . . . . . . . . 2261 1 176 . 1 1 67 67 VAL HG13 H 1 .72 . . 1 . . . . . . . . 2261 1 177 . 1 1 67 67 VAL HG21 H 1 .86 . . 1 . . . . . . . . 2261 1 178 . 1 1 67 67 VAL HG22 H 1 .86 . . 1 . . . . . . . . 2261 1 179 . 1 1 67 67 VAL HG23 H 1 .86 . . 1 . . . . . . . . 2261 1 180 . 1 1 72 72 ARG H H 1 7.81 . . 1 . . . . . . . . 2261 1 181 . 1 1 72 72 ARG HA H 1 4.56 . . 1 . . . . . . . . 2261 1 182 . 1 1 72 72 ARG HB2 H 1 1.87 . . 1 . . . . . . . . 2261 1 183 . 1 1 72 72 ARG HB3 H 1 1.8 . . 1 . . . . . . . . 2261 1 184 . 1 1 72 72 ARG HG2 H 1 1.67 . . 2 . . . . . . . . 2261 1 185 . 1 1 72 72 ARG HG3 H 1 1.57 . . 2 . . . . . . . . 2261 1 186 . 1 1 72 72 ARG HD2 H 1 3.23 . . 1 . . . . . . . . 2261 1 187 . 1 1 72 72 ARG HD3 H 1 3.23 . . 1 . . . . . . . . 2261 1 188 . 1 1 72 72 ARG HE H 1 7.17 . . 1 . . . . . . . . 2261 1 189 . 1 1 73 73 LEU H H 1 8.42 . . 1 . . . . . . . . 2261 1 190 . 1 1 73 73 LEU HA H 1 4.7 . . 1 . . . . . . . . 2261 1 191 . 1 1 73 73 LEU HB2 H 1 1.32 . . 1 . . . . . . . . 2261 1 192 . 1 1 73 73 LEU HB3 H 1 1.87 . . 1 . . . . . . . . 2261 1 193 . 1 1 73 73 LEU HG H 1 1.62 . . 1 . . . . . . . . 2261 1 194 . 1 1 73 73 LEU HD11 H 1 .87 . . 1 . . . . . . . . 2261 1 195 . 1 1 73 73 LEU HD12 H 1 .87 . . 1 . . . . . . . . 2261 1 196 . 1 1 73 73 LEU HD13 H 1 .87 . . 1 . . . . . . . . 2261 1 197 . 1 1 73 73 LEU HD21 H 1 .87 . . 1 . . . . . . . . 2261 1 198 . 1 1 73 73 LEU HD22 H 1 .87 . . 1 . . . . . . . . 2261 1 199 . 1 1 73 73 LEU HD23 H 1 .87 . . 1 . . . . . . . . 2261 1 200 . 1 1 75 75 TRP H H 1 8.97 . . 1 . . . . . . . . 2261 1 201 . 1 1 75 75 TRP HA H 1 5.6 . . 1 . . . . . . . . 2261 1 202 . 1 1 75 75 TRP HB2 H 1 3.33 . . 1 . . . . . . . . 2261 1 203 . 1 1 75 75 TRP HB3 H 1 3.17 . . 1 . . . . . . . . 2261 1 204 . 1 1 75 75 TRP HD1 H 1 7.06 . . 1 . . . . . . . . 2261 1 205 . 1 1 75 75 TRP HE1 H 1 9.73 . . 1 . . . . . . . . 2261 1 206 . 1 1 75 75 TRP HE3 H 1 6.84 . . 1 . . . . . . . . 2261 1 207 . 1 1 75 75 TRP HZ2 H 1 7.21 . . 1 . . . . . . . . 2261 1 208 . 1 1 75 75 TRP HZ3 H 1 5.51 . . 1 . . . . . . . . 2261 1 209 . 1 1 75 75 TRP HH2 H 1 6.84 . . 1 . . . . . . . . 2261 1 210 . 1 1 78 78 CYS H H 1 9.32 . . 1 . . . . . . . . 2261 1 211 . 1 1 78 78 CYS HA H 1 5.03 . . 1 . . . . . . . . 2261 1 212 . 1 1 78 78 CYS HB2 H 1 3.38 . . 1 . . . . . . . . 2261 1 213 . 1 1 78 78 CYS HB3 H 1 3.12 . . 1 . . . . . . . . 2261 1 stop_ save_