################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34309 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D NOESY' . . . 34309 1 2 '2D TOCSY' . . . 34309 1 3 '3D NOESY-N-HSQC' . . . 34309 1 4 '2D HSQC' . . . 34309 1 5 '3D NOESY C-HSQC' . . . 34309 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.Ambiguity_set_ID _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 LYS HA H 1 3.9793 0.0000 . 1 . . . . A 1 LYS HA . 34309 1 2 . 1 1 1 1 LYS HB2 H 1 1.8090 0.0000 . 2 . . . . A 1 LYS HB2 . 34309 1 3 . 1 1 1 1 LYS HB3 H 1 1.8910 0.0000 . 2 . . . . A 1 LYS HB3 . 34309 1 4 . 1 1 1 1 LYS HG2 H 1 1.5630 0.0000 . 2 . . . . A 1 LYS HG2 . 34309 1 5 . 1 1 1 1 LYS HE2 H 1 2.9959 0.0000 . 2 . . . . A 1 LYS HE2 . 34309 1 6 . 1 1 2 2 LYS H H 1 8.1961 0.0000 . 1 . . . . A 2 LYS H . 34309 1 7 . 1 1 2 2 LYS HA H 1 4.2590 0.0000 . 1 . . . . A 2 LYS HA . 34309 1 8 . 1 1 2 2 LYS HB2 H 1 1.7160 0.0000 . 2 . . . . A 2 LYS HB2 . 34309 1 9 . 1 1 2 2 LYS HB3 H 1 1.8780 0.0000 . 2 . . . . A 2 LYS HB3 . 34309 1 10 . 1 1 2 2 LYS HG2 H 1 1.3676 0.0000 . 2 . . . . A 2 LYS HG2 . 34309 1 11 . 1 1 2 2 LYS HE2 H 1 2.9039 0.0000 . 2 . . . . A 2 LYS HE2 . 34309 1 12 . 1 1 2 2 LYS HZ1 H 1 7.9180 0.0000 . 1 . . . . A 2 LYS HZ1 . 34309 1 13 . 1 1 2 2 LYS HZ2 H 1 7.9180 0.0000 . 1 . . . . A 2 LYS HZ2 . 34309 1 14 . 1 1 2 2 LYS HZ3 H 1 7.9180 0.0000 . 1 . . . . A 2 LYS HZ3 . 34309 1 15 . 1 1 3 3 SER H H 1 8.4755 0.0000 . 1 . . . . A 3 SER H . 34309 1 16 . 1 1 3 3 SER HA H 1 4.3434 0.0000 . 1 . . . . A 3 SER HA . 34309 1 17 . 1 1 3 3 SER HB2 H 1 3.7776 0.0000 . 2 . . . . A 3 SER HB2 . 34309 1 18 . 1 1 4 4 HIS H H 1 8.8208 0.0000 . 1 . . . . A 4 HIS H . 34309 1 19 . 1 1 4 4 HIS HA H 1 4.6534 0.0000 . 1 . . . . A 4 HIS HA . 34309 1 20 . 1 1 4 4 HIS HB2 H 1 3.1623 0.0000 . 2 . . . . A 4 HIS HB2 . 34309 1 21 . 1 1 4 4 HIS HB3 H 1 3.2640 0.0000 . 2 . . . . A 4 HIS HB3 . 34309 1 22 . 1 1 4 4 HIS HD2 H 1 7.1715 0.0000 . 1 . . . . A 4 HIS HD2 . 34309 1 23 . 1 1 4 4 HIS HE1 H 1 8.4620 0.0000 . 1 . . . . A 4 HIS HE1 . 34309 1 24 . 1 1 5 5 THR H H 1 8.2186 0.0000 . 1 . . . . A 5 THR H . 34309 1 25 . 1 1 5 5 THR HA H 1 4.0196 0.0000 . 1 . . . . A 5 THR HA . 34309 1 26 . 1 1 5 5 THR HB H 1 4.0963 0.0000 . 1 . . . . A 5 THR HB . 34309 1 27 . 1 1 5 5 THR HG1 H 1 1.2190 0.0000 . 1 . . . . A 5 THR HG1 . 34309 1 28 . 1 1 5 5 THR HG21 H 1 1.1394 0.0000 . 1 . . . . A 5 THR HG21 . 34309 1 29 . 1 1 5 5 THR HG22 H 1 1.1394 0.0000 . 1 . . . . A 5 THR HG22 . 34309 1 30 . 1 1 5 5 THR HG23 H 1 1.1394 0.0000 . 1 . . . . A 5 THR HG23 . 34309 1 31 . 1 1 6 6 ALA H H 1 8.7756 0.0000 . 1 . . . . A 6 ALA H . 34309 1 32 . 1 1 6 6 ALA HA H 1 4.0251 0.0000 . 1 . . . . A 6 ALA HA . 34309 1 33 . 1 1 6 6 ALA HB1 H 1 1.3929 0.0000 . 1 . . . . A 6 ALA HB1 . 34309 1 34 . 1 1 6 6 ALA HB2 H 1 1.3929 0.0000 . 1 . . . . A 6 ALA HB2 . 34309 1 35 . 1 1 6 6 ALA HB3 H 1 1.3929 0.0000 . 1 . . . . A 6 ALA HB3 . 34309 1 36 . 1 1 7 7 SER H H 1 8.1539 0.0000 . 1 . . . . A 7 SER H . 34309 1 37 . 1 1 7 7 SER HA H 1 4.1734 0.0000 . 1 . . . . A 7 SER HA . 34309 1 38 . 1 1 7 7 SER HB2 H 1 4.9602 0.0000 . 2 . . . . A 7 SER HB2 . 34309 1 39 . 1 1 8 8 TYR H H 1 8.1234 0.0000 . 1 . . . . A 8 TYR H . 34309 1 40 . 1 1 8 8 TYR HA H 1 4.1916 0.0000 . 1 . . . . A 8 TYR HA . 34309 1 41 . 1 1 8 8 TYR HB2 H 1 2.9750 0.0000 . 2 . . . . A 8 TYR HB2 . 34309 1 42 . 1 1 8 8 TYR HB3 H 1 3.0970 0.0000 . 2 . . . . A 8 TYR HB3 . 34309 1 43 . 1 1 8 8 TYR HD1 H 1 7.0530 0.0000 . 3 . . . . A 8 TYR HD1 . 34309 1 44 . 1 1 8 8 TYR HD2 H 1 6.9734 0.0000 . 3 . . . . A 8 TYR HD2 . 34309 1 45 . 1 1 8 8 TYR HE1 H 1 6.6795 0.0000 . 3 . . . . A 8 TYR HE1 . 34309 1 46 . 1 1 9 9 LEU H H 1 8.0694 0.0000 . 1 . . . . A 9 LEU H . 34309 1 47 . 1 1 9 9 LEU HA H 1 4.0852 0.0000 . 1 . . . . A 9 LEU HA . 34309 1 48 . 1 1 9 9 LEU HB2 H 1 1.7665 0.0000 . 2 . . . . A 9 LEU HB2 . 34309 1 49 . 1 1 9 9 LEU HG H 1 1.4966 0.0000 . 1 . . . . A 9 LEU HG . 34309 1 50 . 1 1 9 9 LEU HD11 H 1 0.9450 0.0000 . 2 . . . . A 9 LEU HD11 . 34309 1 51 . 1 1 9 9 LEU HD12 H 1 0.9450 0.0000 . 2 . . . . A 9 LEU HD12 . 34309 1 52 . 1 1 9 9 LEU HD13 H 1 0.9450 0.0000 . 2 . . . . A 9 LEU HD13 . 34309 1 53 . 1 1 9 9 LEU HD21 H 1 0.8805 0.0000 . 2 . . . . A 9 LEU HD21 . 34309 1 54 . 1 1 9 9 LEU HD22 H 1 0.8805 0.0000 . 2 . . . . A 9 LEU HD22 . 34309 1 55 . 1 1 9 9 LEU HD23 H 1 0.8805 0.0000 . 2 . . . . A 9 LEU HD23 . 34309 1 56 . 1 1 10 10 ARG H H 1 8.0288 0.0000 . 1 . . . . A 10 ARG H . 34309 1 57 . 1 1 10 10 ARG HA H 1 3.8473 0.0000 . 1 . . . . A 10 ARG HA . 34309 1 58 . 1 1 10 10 ARG HB2 H 1 1.8760 0.0000 . 2 . . . . A 10 ARG HB2 . 34309 1 59 . 1 1 10 10 ARG HB3 H 1 2.0180 0.0000 . 2 . . . . A 10 ARG HB3 . 34309 1 60 . 1 1 10 10 ARG HG2 H 1 1.5388 0.0000 . 2 . . . . A 10 ARG HG2 . 34309 1 61 . 1 1 10 10 ARG HD2 H 1 3.1794 0.0000 . 2 . . . . A 10 ARG HD2 . 34309 1 62 . 1 1 10 10 ARG HE H 1 7.5575 0.0000 . 1 . . . . A 10 ARG HE . 34309 1 63 . 1 1 10 10 ARG HH11 H 1 7.0244 0.0000 . 9 . . . . A 10 ARG HH11 . 34309 1 64 . 1 1 10 10 ARG CA C 13 55.5081 0.0000 . 1 . . . . A 10 ARG CA . 34309 1 65 . 1 1 10 10 ARG CB C 13 33.6787 0.0000 . 1 . . . . A 10 ARG CB . 34309 1 66 . 1 1 10 10 ARG CG C 13 31.5635 0.0000 . 1 . . . . A 10 ARG CG . 34309 1 67 . 1 1 10 10 ARG CD C 13 42.7307 0.0000 . 1 . . . . A 10 ARG CD . 34309 1 68 . 1 1 10 10 ARG N N 15 119.3146 0.0000 . 1 . . . . A 10 ARG N . 34309 1 69 . 1 1 10 10 ARG NE N 15 84.1312 0.0000 . 1 . . . . A 10 ARG NE . 34309 1 70 . 1 1 11 11 LEU H H 1 7.7240 0.0000 . 1 . . . . A 11 LEU H . 34309 1 71 . 1 1 11 11 LEU HA H 1 3.9794 0.0000 . 1 . . . . A 11 LEU HA . 34309 1 72 . 1 1 11 11 LEU HB2 H 1 1.6337 0.0000 . 2 . . . . A 11 LEU HB2 . 34309 1 73 . 1 1 11 11 LEU HB3 H 1 1.8370 0.0000 . 2 . . . . A 11 LEU HB3 . 34309 1 74 . 1 1 11 11 LEU HG H 1 1.6545 0.0000 . 1 . . . . A 11 LEU HG . 34309 1 75 . 1 1 11 11 LEU HD11 H 1 0.9011 0.0000 . 2 . . . . A 11 LEU HD11 . 34309 1 76 . 1 1 11 11 LEU HD12 H 1 0.9011 0.0000 . 2 . . . . A 11 LEU HD12 . 34309 1 77 . 1 1 11 11 LEU HD13 H 1 0.9011 0.0000 . 2 . . . . A 11 LEU HD13 . 34309 1 78 . 1 1 11 11 LEU HD21 H 1 0.8186 0.0000 . 2 . . . . A 11 LEU HD21 . 34309 1 79 . 1 1 11 11 LEU HD22 H 1 0.8186 0.0000 . 2 . . . . A 11 LEU HD22 . 34309 1 80 . 1 1 11 11 LEU HD23 H 1 0.8186 0.0000 . 2 . . . . A 11 LEU HD23 . 34309 1 81 . 1 1 12 12 TRP H H 1 8.3308 0.0000 . 1 . . . . A 12 TRP H . 34309 1 82 . 1 1 12 12 TRP HA H 1 4.1949 0.0000 . 1 . . . . A 12 TRP HA . 34309 1 83 . 1 1 12 12 TRP HB2 H 1 3.2183 0.0000 . 2 . . . . A 12 TRP HB2 . 34309 1 84 . 1 1 12 12 TRP HB3 H 1 3.3950 0.0000 . 2 . . . . A 12 TRP HB3 . 34309 1 85 . 1 1 12 12 TRP HD1 H 1 7.0915 0.0000 . 1 . . . . A 12 TRP HD1 . 34309 1 86 . 1 1 12 12 TRP HE1 H 1 10.3796 0.0000 . 1 . . . . A 12 TRP HE1 . 34309 1 87 . 1 1 12 12 TRP HE3 H 1 7.4391 0.0000 . 1 . . . . A 12 TRP HE3 . 34309 1 88 . 1 1 12 12 TRP HZ2 H 1 7.3242 0.0000 . 1 . . . . A 12 TRP HZ2 . 34309 1 89 . 1 1 12 12 TRP HZ3 H 1 6.8697 0.0000 . 1 . . . . A 12 TRP HZ3 . 34309 1 90 . 1 1 12 12 TRP HH2 H 1 6.9454 0.0000 . 1 . . . . A 12 TRP HH2 . 34309 1 91 . 1 1 13 13 ALA H H 1 8.5351 0.0000 . 1 . . . . A 13 ALA H . 34309 1 92 . 1 1 13 13 ALA HA H 1 3.6027 0.0000 . 1 . . . . A 13 ALA HA . 34309 1 93 . 1 1 13 13 ALA HB1 H 1 1.4229 0.0000 . 1 . . . . A 13 ALA HB1 . 34309 1 94 . 1 1 13 13 ALA HB2 H 1 1.4229 0.0000 . 1 . . . . A 13 ALA HB2 . 34309 1 95 . 1 1 13 13 ALA HB3 H 1 1.4229 0.0000 . 1 . . . . A 13 ALA HB3 . 34309 1 96 . 1 1 14 14 LEU H H 1 8.1422 0.0000 . 1 . . . . A 14 LEU H . 34309 1 97 . 1 1 14 14 LEU HB2 H 1 1.3430 0.0000 . 2 . . . . A 14 LEU HB2 . 34309 1 98 . 1 1 14 14 LEU HD11 H 1 0.9045 0.0000 . 2 . . . . A 14 LEU HD11 . 34309 1 99 . 1 1 14 14 LEU HD12 H 1 0.9045 0.0000 . 2 . . . . A 14 LEU HD12 . 34309 1 100 . 1 1 14 14 LEU HD13 H 1 0.9045 0.0000 . 2 . . . . A 14 LEU HD13 . 34309 1 101 . 1 1 14 14 LEU HD21 H 1 0.8199 0.0000 . 2 . . . . A 14 LEU HD21 . 34309 1 102 . 1 1 14 14 LEU HD22 H 1 0.8199 0.0000 . 2 . . . . A 14 LEU HD22 . 34309 1 103 . 1 1 14 14 LEU HD23 H 1 0.8199 0.0000 . 2 . . . . A 14 LEU HD23 . 34309 1 104 . 1 1 15 15 SER H H 1 7.9157 0.0000 . 1 . . . . A 15 SER H . 34309 1 105 . 1 1 15 15 SER HA H 1 4.2009 0.0000 . 1 . . . . A 15 SER HA . 34309 1 106 . 1 1 15 15 SER HB2 H 1 3.8981 0.0000 . 2 . . . . A 15 SER HB2 . 34309 1 107 . 1 1 16 16 LEU H H 1 7.8207 0.0000 . 1 . . . . A 16 LEU H . 34309 1 108 . 1 1 16 16 LEU HA H 1 3.9810 0.0000 . 1 . . . . A 16 LEU HA . 34309 1 109 . 1 1 16 16 LEU HB2 H 1 1.4014 0.0000 . 2 . . . . A 16 LEU HB2 . 34309 1 110 . 1 1 16 16 LEU HD11 H 1 0.6778 0.0000 . 2 . . . . A 16 LEU HD11 . 34309 1 111 . 1 1 16 16 LEU HD12 H 1 0.6778 0.0000 . 2 . . . . A 16 LEU HD12 . 34309 1 112 . 1 1 16 16 LEU HD13 H 1 0.6778 0.0000 . 2 . . . . A 16 LEU HD13 . 34309 1 113 . 1 1 16 16 LEU HD21 H 1 0.6117 0.0000 . 2 . . . . A 16 LEU HD21 . 34309 1 114 . 1 1 16 16 LEU HD22 H 1 0.6117 0.0000 . 2 . . . . A 16 LEU HD22 . 34309 1 115 . 1 1 16 16 LEU HD23 H 1 0.6117 0.0000 . 2 . . . . A 16 LEU HD23 . 34309 1 116 . 1 1 17 17 ALA H H 1 8.0104 0.0000 . 1 . . . . A 17 ALA H . 34309 1 117 . 1 1 17 17 ALA HA H 1 3.9081 0.0000 . 1 . . . . A 17 ALA HA . 34309 1 118 . 1 1 17 17 ALA HB1 H 1 1.3141 0.0000 . 1 . . . . A 17 ALA HB1 . 34309 1 119 . 1 1 17 17 ALA HB2 H 1 1.3141 0.0000 . 1 . . . . A 17 ALA HB2 . 34309 1 120 . 1 1 17 17 ALA HB3 H 1 1.3141 0.0000 . 1 . . . . A 17 ALA HB3 . 34309 1 121 . 1 1 18 18 HIS H H 1 8.1489 0.0000 . 1 . . . . A 18 HIS H . 34309 1 122 . 1 1 18 18 HIS HA H 1 4.3427 0.0000 . 1 . . . . A 18 HIS HA . 34309 1 123 . 1 1 18 18 HIS HB2 H 1 3.2453 0.0000 . 2 . . . . A 18 HIS HB2 . 34309 1 124 . 1 1 18 18 HIS HB3 H 1 3.3210 0.0000 . 2 . . . . A 18 HIS HB3 . 34309 1 125 . 1 1 18 18 HIS HD2 H 1 7.2138 0.0000 . 1 . . . . A 18 HIS HD2 . 34309 1 126 . 1 1 18 18 HIS HE1 H 1 8.5293 0.0000 . 1 . . . . A 18 HIS HE1 . 34309 1 127 . 1 1 19 19 ALA H H 1 7.9077 0.0000 . 1 . . . . A 19 ALA H . 34309 1 128 . 1 1 19 19 ALA HA H 1 4.1466 0.0000 . 1 . . . . A 19 ALA HA . 34309 1 129 . 1 1 19 19 ALA HB1 H 1 1.4302 0.0000 . 1 . . . . A 19 ALA HB1 . 34309 1 130 . 1 1 19 19 ALA HB2 H 1 1.4302 0.0000 . 1 . . . . A 19 ALA HB2 . 34309 1 131 . 1 1 19 19 ALA HB3 H 1 1.4302 0.0000 . 1 . . . . A 19 ALA HB3 . 34309 1 132 . 1 1 20 20 GLN H H 1 8.0446 0.0000 . 1 . . . . A 20 GLN H . 34309 1 133 . 1 1 20 20 GLN HA H 1 4.1514 0.0000 . 1 . . . . A 20 GLN HA . 34309 1 134 . 1 1 20 20 GLN HB2 H 1 2.0139 0.0000 . 2 . . . . A 20 GLN HB2 . 34309 1 135 . 1 1 20 20 GLN HB3 H 1 2.0826 0.0000 . 2 . . . . A 20 GLN HB3 . 34309 1 136 . 1 1 20 20 GLN HG2 H 1 2.2406 0.0000 . 2 . . . . A 20 GLN HG2 . 34309 1 137 . 1 1 20 20 GLN HG3 H 1 2.2790 0.0000 . 2 . . . . A 20 GLN HG3 . 34309 1 138 . 1 1 20 20 GLN HE21 H 1 7.1121 0.0000 . 2 . . . . A 20 GLN HE21 . 34309 1 139 . 1 1 20 20 GLN HE22 H 1 6.8370 0.0000 . 2 . . . . A 20 GLN HE22 . 34309 1 140 . 1 1 21 21 LEU H H 1 7.9881 0.0000 . 1 . . . . A 21 LEU H . 34309 1 141 . 1 1 21 21 LEU HA H 1 4.2628 0.0000 . 1 . . . . A 21 LEU HA . 34309 1 142 . 1 1 21 21 LEU HG H 1 0.8132 0.0000 . 1 . . . . A 21 LEU HG . 34309 1 143 . 1 1 21 21 LEU HD11 H 1 0.8986 0.0000 . 2 . . . . A 21 LEU HD11 . 34309 1 144 . 1 1 21 21 LEU HD12 H 1 0.8986 0.0000 . 2 . . . . A 21 LEU HD12 . 34309 1 145 . 1 1 21 21 LEU HD13 H 1 0.8986 0.0000 . 2 . . . . A 21 LEU HD13 . 34309 1 146 . 1 1 21 21 LEU HD21 H 1 0.8127 0.0000 . 2 . . . . A 21 LEU HD21 . 34309 1 147 . 1 1 21 21 LEU HD22 H 1 0.8127 0.0000 . 2 . . . . A 21 LEU HD22 . 34309 1 148 . 1 1 21 21 LEU HD23 H 1 0.8127 0.0000 . 2 . . . . A 21 LEU HD23 . 34309 1 149 . 1 1 22 22 SER H H 1 8.1675 0.0000 . 1 . . . . A 22 SER H . 34309 1 150 . 1 1 22 22 SER HA H 1 4.3617 0.0000 . 1 . . . . A 22 SER HA . 34309 1 151 . 1 1 22 22 SER HB2 H 1 3.8117 0.0000 . 2 . . . . A 22 SER HB2 . 34309 1 152 . 1 1 23 23 SER H H 1 7.8525 0.0000 . 1 . . . . A 23 SER H . 34309 1 153 . 1 1 23 23 SER HA H 1 4.3604 0.0000 . 1 . . . . A 23 SER HA . 34309 1 154 . 1 1 23 23 SER HB2 H 1 3.7602 0.0000 . 2 . . . . A 23 SER HB2 . 34309 1 155 . 1 1 24 24 LYS H H 1 7.9972 0.0000 . 1 . . . . A 24 LYS H . 34309 1 156 . 1 1 24 24 LYS HA H 1 4.2618 0.0000 . 1 . . . . A 24 LYS HA . 34309 1 157 . 1 1 24 24 LYS HB2 H 1 1.6282 0.0000 . 2 . . . . A 24 LYS HB2 . 34309 1 158 . 1 1 24 24 LYS HG2 H 1 1.5151 0.0000 . 2 . . . . A 24 LYS HG2 . 34309 1 159 . 1 1 25 25 LYS H H 1 7.9398 0.0000 . 1 . . . . A 25 LYS H . 34309 1 160 . 1 1 25 25 LYS HA H 1 4.0725 0.0000 . 1 . . . . A 25 LYS HA . 34309 1 161 . 1 1 25 25 LYS HB2 H 1 1.6757 0.0000 . 2 . . . . A 25 LYS HB2 . 34309 1 162 . 1 1 25 25 LYS HB3 H 1 1.8120 0.0000 . 2 . . . . A 25 LYS HB3 . 34309 1 163 . 1 1 25 25 LYS HG2 H 1 1.3819 0.0000 . 2 . . . . A 25 LYS HG2 . 34309 1 164 . 1 1 25 25 LYS HE2 H 1 2.9091 0.0000 . 2 . . . . A 25 LYS HE2 . 34309 1 stop_ save_