################################### # 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_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1 _Assigned_chem_shift_list.Entry_ID 4750 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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_1 . 4750 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 G H8 H 1 8.18 . . . . . . . . . . . 4750 1 2 . 1 1 1 1 G H1' H 1 5.93 . . . . . . . . . . . 4750 1 3 . 1 1 1 1 G H2' H 1 4.5 . . . . . . . . . . . 4750 1 4 . 1 1 1 1 G H3' H 1 4.66 . . . . . . . . . . . 4750 1 5 . 1 1 1 1 G H4' H 1 4.38 . . . . . . . . . . . 4750 1 6 . 1 1 1 1 G H1 H 1 13.27 . . . . . . . . . . . 4750 1 7 . 1 1 2 2 G H8 H 1 7.64 . . . . . . . . . . . 4750 1 8 . 1 1 2 2 G H1' H 1 5.72 . . . . . . . . . . . 4750 1 9 . 1 1 2 2 G H2' H 1 4.45 . . . . . . . . . . . 4750 1 10 . 1 1 2 2 G H3' H 1 4.67 . . . . . . . . . . . 4750 1 11 . 1 1 2 2 G H1 H 1 13.42 . . . . . . . . . . . 4750 1 12 . 1 1 3 3 C H6 H 1 7.71 . . . . . . . . . . . 4750 1 13 . 1 1 3 3 C H5 H 1 5.21 . . . . . . . . . . . 4750 1 14 . 1 1 3 3 C H1' H 1 5.53 . . . . . . . . . . . 4750 1 15 . 1 1 3 3 C H2' H 1 4.55 . . . . . . . . . . . 4750 1 16 . 1 1 3 3 C H3' H 1 4.6 . . . . . . . . . . . 4750 1 17 . 1 1 3 3 C H4' H 1 4.45 . . . . . . . . . . . 4750 1 18 . 1 1 3 3 C H41 H 1 8.47 . . . . . . . . . . . 4750 1 19 . 1 1 3 3 C H42 H 1 6.51 . . . . . . . . . . . 4750 1 20 . 1 1 4 4 G H8 H 1 7.39 . . . . . . . . . . . 4750 1 21 . 1 1 4 4 G H1' H 1 5.73 . . . . . . . . . . . 4750 1 22 . 1 1 4 4 G H2' H 1 4.5 . . . . . . . . . . . 4750 1 23 . 1 1 4 4 G H3' H 1 4.38 . . . . . . . . . . . 4750 1 24 . 1 1 4 4 G H4' H 1 4.46 . . . . . . . . . . . 4750 1 25 . 1 1 4 4 G H1 H 1 13.12 . . . . . . . . . . . 4750 1 26 . 1 1 4 4 G H21 H 1 7.82 . . . . . . . . . . . 4750 1 27 . 1 1 4 4 G H22 H 1 6.09 . . . . . . . . . . . 4750 1 28 . 1 1 5 5 U H6 H 1 7.58 . . . . . . . . . . . 4750 1 29 . 1 1 5 5 U H5 H 1 5.10 . . . . . . . . . . . 4750 1 30 . 1 1 5 5 U H1' H 1 5.58 . . . . . . . . . . . 4750 1 31 . 1 1 5 5 U H2' H 1 4.51 . . . . . . . . . . . 4750 1 32 . 1 1 5 5 U H3' H 1 4.38 . . . . . . . . . . . 4750 1 33 . 1 1 5 5 U H3 H 1 12.31 . . . . . . . . . . . 4750 1 34 . 1 1 6 6 C H6 H 1 7.38 . . . . . . . . . . . 4750 1 35 . 1 1 6 6 C H5 H 1 5.46 . . . . . . . . . . . 4750 1 36 . 1 1 6 6 C H1' H 1 5.11 . . . . . . . . . . . 4750 1 37 . 1 1 6 6 C H2' H 1 4.01 . . . . . . . . . . . 4750 1 38 . 1 1 6 6 C H3' H 1 4.64 . . . . . . . . . . . 4750 1 39 . 1 1 6 6 C H4' H 1 4.52 . . . . . . . . . . . 4750 1 40 . 1 1 6 6 C H41 H 1 6.9 . . . . . . . . . . . 4750 1 41 . 1 1 7 7 A H8 H 1 7.94 . . . . . . . . . . . 4750 1 42 . 1 1 7 7 A H2 H 1 8.11 . . . . . . . . . . . 4750 1 43 . 1 1 7 7 A H1' H 1 6.1 . . . . . . . . . . . 4750 1 44 . 1 1 7 7 A H2' H 1 4.91 . . . . . . . . . . . 4750 1 45 . 1 1 7 7 A H3' H 1 4.66 . . . . . . . . . . . 4750 1 46 . 1 1 7 7 A H4' H 1 4.55 . . . . . . . . . . . 4750 1 47 . 1 1 7 7 A H5' H 1 4.15 . . . . . . . . . . . 4750 1 48 . 1 1 7 7 A H5'' H 1 4.25 . . . . . . . . . . . 4750 1 49 . 1 1 7 7 A H61 H 1 5.62 . . . . . . . . . . . 4750 1 50 . 1 1 8 8 G H8 H 1 7.24 . . . . . . . . . . . 4750 1 51 . 1 1 8 8 G H1' H 1 4.78 . . . . . . . . . . . 4750 1 52 . 1 1 8 8 G H2' H 1 4.44 . . . . . . . . . . . 4750 1 53 . 1 1 8 8 G H3' H 1 4.53 . . . . . . . . . . . 4750 1 54 . 1 1 8 8 G H5' H 1 4.36 . . . . . . . . . . . 4750 1 55 . 1 1 8 8 G H1 H 1 10.31 . . . . . . . . . . . 4750 1 56 . 1 1 8 8 G H21 H 1 8.80 . . . . . . . . . . . 4750 1 57 . 1 1 8 8 G H22 H 1 6.00 . . . . . . . . . . . 4750 1 58 . 1 1 9 9 G H8 H 1 7.84 . . . . . . . . . . . 4750 1 59 . 1 1 9 9 G H1' H 1 5.39 . . . . . . . . . . . 4750 1 60 . 1 1 9 9 G H2' H 1 4.34 . . . . . . . . . . . 4750 1 61 . 1 1 9 9 G H3' H 1 4.44 . . . . . . . . . . . 4750 1 62 . 1 1 9 9 G H5' H 1 4.06 . . . . . . . . . . . 4750 1 63 . 1 1 9 9 G H5'' H 1 4.13 . . . . . . . . . . . 4750 1 64 . 1 1 9 9 G H1 H 1 13.60 . . . . . . . . . . . 4750 1 65 . 1 1 9 9 G H21 H 1 5.98 . . . . . . . . . . . 4750 1 66 . 1 1 10 10 U H6 H 1 7.39 . . . . . . . . . . . 4750 1 67 . 1 1 10 10 U H5 H 1 5.42 . . . . . . . . . . . 4750 1 68 . 1 1 10 10 U H1' H 1 5.52 . . . . . . . . . . . 4750 1 69 . 1 1 10 10 U H2' H 1 4.36 . . . . . . . . . . . 4750 1 70 . 1 1 10 10 U H3' H 1 4.45 . . . . . . . . . . . 4750 1 71 . 1 1 10 10 U H4' H 1 4.07 . . . . . . . . . . . 4750 1 72 . 1 1 10 10 U H3 H 1 12.4 . . . . . . . . . . . 4750 1 73 . 1 1 11 11 C H6 H 1 7.88 . . . . . . . . . . . 4750 1 74 . 1 1 11 11 C H5 H 1 5.62 . . . . . . . . . . . 4750 1 75 . 1 1 11 11 C H1' H 1 5.44 . . . . . . . . . . . 4750 1 76 . 1 1 11 11 C H2' H 1 4.12 . . . . . . . . . . . 4750 1 77 . 1 1 11 11 C H3' H 1 4.5 . . . . . . . . . . . 4750 1 78 . 1 1 11 11 C H4' H 1 4.16 . . . . . . . . . . . 4750 1 79 . 1 1 11 11 C H41 H 1 8.29 . . . . . . . . . . . 4750 1 80 . 1 1 11 11 C H42 H 1 6.98 . . . . . . . . . . . 4750 1 81 . 1 1 12 12 C H6 H 1 7.57 . . . . . . . . . . . 4750 1 82 . 1 1 12 12 C H5 H 1 5.31 . . . . . . . . . . . 4750 1 83 . 1 1 12 12 C H1' H 1 5.48 . . . . . . . . . . . 4750 1 84 . 1 1 12 12 C H2' H 1 4.41 . . . . . . . . . . . 4750 1 85 . 1 1 12 12 C H3' H 1 4.37 . . . . . . . . . . . 4750 1 86 . 1 1 12 12 C H4' H 1 4.5 . . . . . . . . . . . 4750 1 87 . 1 1 12 12 C H41 H 1 8.13 . . . . . . . . . . . 4750 1 88 . 1 1 12 12 C H42 H 1 6.47 . . . . . . . . . . . 4750 1 89 . 1 1 13 13 G H8 H 1 7.52 . . . . . . . . . . . 4750 1 90 . 1 1 13 13 G H1' H 1 5.64 . . . . . . . . . . . 4750 1 91 . 1 1 13 13 G H2' H 1 4.28 . . . . . . . . . . . 4750 1 92 . 1 1 13 13 G H3' H 1 4.67 . . . . . . . . . . . 4750 1 93 . 1 1 13 13 G H4' H 1 4.41 . . . . . . . . . . . 4750 1 94 . 1 1 13 13 G H5' H 1 4.11 . . . . . . . . . . . 4750 1 95 . 1 1 13 13 G H5'' H 1 4.34 . . . . . . . . . . . 4750 1 96 . 1 1 13 13 G H1 H 1 10.57 . . . . . . . . . . . 4750 1 97 . 1 1 14 14 G H8 H 1 7.98 . . . . . . . . . . . 4750 1 98 . 1 1 14 14 G H1' H 1 5.46 . . . . . . . . . . . 4750 1 99 . 1 1 14 14 G H2' H 1 4.72 . . . . . . . . . . . 4750 1 100 . 1 1 14 14 G H3' H 1 4.4 . . . . . . . . . . . 4750 1 101 . 1 1 14 14 G H4' H 1 4.2 . . . . . . . . . . . 4750 1 102 . 1 1 14 14 G H5' H 1 4.00 . . . . . . . . . . . 4750 1 103 . 1 1 14 14 G H5'' H 1 4.02 . . . . . . . . . . . 4750 1 104 . 1 1 14 14 G H1 H 1 12.74 . . . . . . . . . . . 4750 1 105 . 1 1 14 14 G H21 H 1 6.15 . . . . . . . . . . . 4750 1 106 . 1 1 15 15 A H8 H 1 7.97 . . . . . . . . . . . 4750 1 107 . 1 1 15 15 A H2 H 1 7.79 . . . . . . . . . . . 4750 1 108 . 1 1 15 15 A H1' H 1 5.61 . . . . . . . . . . . 4750 1 109 . 1 1 15 15 A H2' H 1 4.39 . . . . . . . . . . . 4750 1 110 . 1 1 15 15 A H3' H 1 4.61 . . . . . . . . . . . 4750 1 111 . 1 1 15 15 A H4' H 1 4.27 . . . . . . . . . . . 4750 1 112 . 1 1 15 15 A H5' H 1 3.91 . . . . . . . . . . . 4750 1 113 . 1 1 15 15 A H5'' H 1 3.94 . . . . . . . . . . . 4750 1 114 . 1 1 16 16 A H8 H 1 8.19 . . . . . . . . . . . 4750 1 115 . 1 1 16 16 A H2 H 1 8.16 . . . . . . . . . . . 4750 1 116 . 1 1 16 16 A H1' H 1 5.99 . . . . . . . . . . . 4750 1 117 . 1 1 16 16 A H2' H 1 4.65 . . . . . . . . . . . 4750 1 118 . 1 1 16 16 A H3' H 1 4.97 . . . . . . . . . . . 4750 1 119 . 1 1 16 16 A H4' H 1 4.46 . . . . . . . . . . . 4750 1 120 . 1 1 16 16 A H5' H 1 4.25 . . . . . . . . . . . 4750 1 121 . 1 1 16 16 A H5'' H 1 4.26 . . . . . . . . . . . 4750 1 122 . 1 1 17 17 G H8 H 1 7.93 . . . . . . . . . . . 4750 1 123 . 1 1 17 17 G H1' H 1 3.61 . . . . . . . . . . . 4750 1 124 . 1 1 17 17 G H2' H 1 4.44 . . . . . . . . . . . 4750 1 125 . 1 1 17 17 G H3' H 1 4.2 . . . . . . . . . . . 4750 1 126 . 1 1 17 17 G H4' H 1 4.21 . . . . . . . . . . . 4750 1 127 . 1 1 17 17 G H5' H 1 4.09 . . . . . . . . . . . 4750 1 128 . 1 1 17 17 G H5'' H 1 4.29 . . . . . . . . . . . 4750 1 129 . 1 1 17 17 G H1 H 1 12.38 . . . . . . . . . . . 4750 1 130 . 1 1 17 17 G H21 H 1 7.78 . . . . . . . . . . . 4750 1 131 . 1 1 17 17 G H22 H 1 6.27 . . . . . . . . . . . 4750 1 132 . 1 1 18 18 G H8 H 1 7.17 . . . . . . . . . . . 4750 1 133 . 1 1 18 18 G H1' H 1 5.72 . . . . . . . . . . . 4750 1 134 . 1 1 18 18 G H2' H 1 4.47 . . . . . . . . . . . 4750 1 135 . 1 1 18 18 G H3' H 1 4.43 . . . . . . . . . . . 4750 1 136 . 1 1 18 18 G H1 H 1 12.4 . . . . . . . . . . . 4750 1 137 . 1 1 18 18 G H21 H 1 7.79 . . . . . . . . . . . 4750 1 138 . 1 1 18 18 G H22 H 1 6.31 . . . . . . . . . . . 4750 1 139 . 1 1 19 19 A H8 H 1 7.78 . . . . . . . . . . . 4750 1 140 . 1 1 19 19 A H2 H 1 6.83 . . . . . . . . . . . 4750 1 141 . 1 1 19 19 A H1' H 1 5.8 . . . . . . . . . . . 4750 1 142 . 1 1 19 19 A H2' H 1 4.3 . . . . . . . . . . . 4750 1 143 . 1 1 19 19 A H3' H 1 4.45 . . . . . . . . . . . 4750 1 144 . 1 1 19 19 A H61 H 1 8.49 . . . . . . . . . . . 4750 1 145 . 1 1 19 19 A H62 H 1 6.54 . . . . . . . . . . . 4750 1 146 . 1 1 20 20 A H8 H 1 7.82 . . . . . . . . . . . 4750 1 147 . 1 1 20 20 A H2 H 1 8.14 . . . . . . . . . . . 4750 1 148 . 1 1 20 20 A H1' H 1 6.08 . . . . . . . . . . . 4750 1 149 . 1 1 20 20 A H2' H 1 4.65 . . . . . . . . . . . 4750 1 150 . 1 1 20 20 A H3' H 1 4.42 . . . . . . . . . . . 4750 1 151 . 1 1 20 20 A H4' H 1 4.51 . . . . . . . . . . . 4750 1 152 . 1 1 20 20 A H61 H 1 8.80 . . . . . . . . . . . 4750 1 153 . 1 1 20 20 A H62 H 1 5.98 . . . . . . . . . . . 4750 1 154 . 1 1 21 21 G H8 H 1 7.46 . . . . . . . . . . . 4750 1 155 . 1 1 21 21 G H1' H 1 4.71 . . . . . . . . . . . 4750 1 156 . 1 1 21 21 G H2' H 1 3.89 . . . . . . . . . . . 4750 1 157 . 1 1 21 21 G H3' H 1 4.75 . . . . . . . . . . . 4750 1 158 . 1 1 21 21 G H4' H 1 4.37 . . . . . . . . . . . 4750 1 159 . 1 1 21 21 G H1 H 1 11.30 . . . . . . . . . . . 4750 1 160 . 1 1 21 21 G H21 H 1 6.16 . . . . . . . . . . . 4750 1 161 . 1 1 22 22 C H6 H 1 8.04 . . . . . . . . . . . 4750 1 162 . 1 1 22 22 C H5 H 1 5.93 . . . . . . . . . . . 4750 1 163 . 1 1 22 22 C H1' H 1 5.85 . . . . . . . . . . . 4750 1 164 . 1 1 22 22 C H2' H 1 4.51 . . . . . . . . . . . 4750 1 165 . 1 1 22 22 C H3' H 1 4.43 . . . . . . . . . . . 4750 1 166 . 1 1 22 22 C H4' H 1 4.17 . . . . . . . . . . . 4750 1 167 . 1 1 22 22 C H5' H 1 4.16 . . . . . . . . . . . 4750 1 168 . 1 1 22 22 C H41 H 1 8.54 . . . . . . . . . . . 4750 1 169 . 1 1 23 23 A H8 H 1 7.6 . . . . . . . . . . . 4750 1 170 . 1 1 23 23 A H2 H 1 6.67 . . . . . . . . . . . 4750 1 171 . 1 1 23 23 A H1' H 1 5.94 . . . . . . . . . . . 4750 1 172 . 1 1 23 23 A H2' H 1 4.63 . . . . . . . . . . . 4750 1 173 . 1 1 23 23 A H3' H 1 4.39 . . . . . . . . . . . 4750 1 174 . 1 1 23 23 A H4' H 1 4.53 . . . . . . . . . . . 4750 1 175 . 1 1 23 23 A H5' H 1 4.19 . . . . . . . . . . . 4750 1 176 . 1 1 23 23 A H61 H 1 5.59 . . . . . . . . . . . 4750 1 177 . 1 1 24 24 G H8 H 1 7.21 . . . . . . . . . . . 4750 1 178 . 1 1 24 24 G H1' H 1 4.62 . . . . . . . . . . . 4750 1 179 . 1 1 24 24 G H2' H 1 4.54 . . . . . . . . . . . 4750 1 180 . 1 1 24 24 G H3' H 1 4.35 . . . . . . . . . . . 4750 1 181 . 1 1 24 24 G H4' H 1 4.33 . . . . . . . . . . . 4750 1 182 . 1 1 24 24 G H5' H 1 4.04 . . . . . . . . . . . 4750 1 183 . 1 1 24 24 G H1 H 1 10.59 . . . . . . . . . . . 4750 1 184 . 1 1 24 24 G H21 H 1 6.69 . . . . . . . . . . . 4750 1 185 . 1 1 25 25 C H6 H 1 7.64 . . . . . . . . . . . 4750 1 186 . 1 1 25 25 C H5 H 1 5.4 . . . . . . . . . . . 4750 1 187 . 1 1 25 25 C H1' H 1 5.37 . . . . . . . . . . . 4750 1 188 . 1 1 25 25 C H2' H 1 4.29 . . . . . . . . . . . 4750 1 189 . 1 1 25 25 C H3' H 1 4.41 . . . . . . . . . . . 4750 1 190 . 1 1 25 25 C H4' H 1 4.33 . . . . . . . . . . . 4750 1 191 . 1 1 25 25 C H5' H 1 4.05 . . . . . . . . . . . 4750 1 192 . 1 1 25 25 C H41 H 1 8.42 . . . . . . . . . . . 4750 1 193 . 1 1 25 25 C H42 H 1 6.73 . . . . . . . . . . . 4750 1 194 . 1 1 26 26 G H8 H 1 7.63 . . . . . . . . . . . 4750 1 195 . 1 1 26 26 G H1' H 1 5.72 . . . . . . . . . . . 4750 1 196 . 1 1 26 26 G H2' H 1 4.46 . . . . . . . . . . . 4750 1 197 . 1 1 26 26 G H3' H 1 4.40 . . . . . . . . . . . 4750 1 198 . 1 1 26 26 G H1 H 1 12.96 . . . . . . . . . . . 4750 1 199 . 1 1 26 26 G H21 H 1 8.27 . . . . . . . . . . . 4750 1 200 . 1 1 26 26 G H22 H 1 6.12 . . . . . . . . . . . 4750 1 201 . 1 1 27 27 C H6 H 1 7.64 . . . . . . . . . . . 4750 1 202 . 1 1 27 27 C H5 H 1 5.21 . . . . . . . . . . . 4750 1 203 . 1 1 27 27 C H1' H 1 5.52 . . . . . . . . . . . 4750 1 204 . 1 1 27 27 C H2' H 1 4.3 . . . . . . . . . . . 4750 1 205 . 1 1 27 27 C H3' H 1 4.17 . . . . . . . . . . . 4750 1 206 . 1 1 27 27 C H41 H 1 8.56 . . . . . . . . . . . 4750 1 207 . 1 1 27 27 C H42 H 1 6.74 . . . . . . . . . . . 4750 1 208 . 1 1 28 28 C H6 H 1 7.64 . . . . . . . . . . . 4750 1 209 . 1 1 28 28 C H5 H 1 5.25 . . . . . . . . . . . 4750 1 210 . 1 1 28 28 C H1' H 1 5.71 . . . . . . . . . . . 4750 1 211 . 1 1 28 28 C H2' H 1 4.00 . . . . . . . . . . . 4750 1 212 . 1 1 28 28 C H3' H 1 4.17 . . . . . . . . . . . 4750 1 213 . 1 1 28 28 C H41 H 1 8.62 . . . . . . . . . . . 4750 1 214 . 1 1 28 28 C H42 H 1 6.75 . . . . . . . . . . . 4750 1 stop_ save_