################################### # 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 25474 _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 $TSP-d4 _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 2 '2D 1H-1H COSY' . . . 25474 1 3 '2D 1H-1H TOCSY' . . . 25474 1 4 '2D 1H-1H NOESY' . . . 25474 1 5 '2D 1H-15N HSQC' . . . 25474 1 6 '2D 1H-13C HSQC' . . . 25474 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 25474 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 ARG HA H 1 4.028 . . . . . . A 1 ARG HA . 25474 1 2 . 1 1 1 1 ARG HB2 H 1 1.875 . . . . . . A 1 ARG HB2 . 25474 1 3 . 1 1 1 1 ARG HB3 H 1 1.875 . . . . . . A 1 ARG HB3 . 25474 1 4 . 1 1 1 1 ARG HG2 H 1 1.624 . . . . . . A 1 ARG HG2 . 25474 1 5 . 1 1 1 1 ARG HG3 H 1 1.525 . . . . . . A 1 ARG HG3 . 25474 1 6 . 1 1 1 1 ARG HD2 H 1 3.140 . . . . . . A 1 ARG HD2 . 25474 1 7 . 1 1 1 1 ARG HD3 H 1 3.140 . . . . . . A 1 ARG HD3 . 25474 1 8 . 1 1 1 1 ARG HE H 1 7.348 . . . . . . A 1 ARG HE . 25474 1 9 . 1 1 1 1 ARG C C 13 170.168 . . . . . . A 1 ARG C . 25474 1 10 . 1 1 1 1 ARG CA C 13 52.990 . . . . . . A 1 ARG CA . 25474 1 11 . 1 1 1 1 ARG CB C 13 28.051 . . . . . . A 1 ARG CB . 25474 1 12 . 1 1 1 1 ARG CG C 13 23.563 . . . . . . A 1 ARG CG . 25474 1 13 . 1 1 1 1 ARG CD C 13 40.518 . . . . . . A 1 ARG CD . 25474 1 14 . 1 1 2 2 GLY H H 1 8.943 . . . . . . A 2 GLY H . 25474 1 15 . 1 1 2 2 GLY HA2 H 1 4.017 . . . . . . A 2 GLY HA2 . 25474 1 16 . 1 1 2 2 GLY HA3 H 1 4.017 . . . . . . A 2 GLY HA3 . 25474 1 17 . 1 1 2 2 GLY CA C 13 42.609 . . . . . . A 2 GLY CA . 25474 1 18 . 1 1 2 2 GLY N N 15 111.641 . . . . . . A 2 GLY N . 25474 1 19 . 1 1 3 3 GLY H H 1 8.482 . . . . . . A 3 GLY H . 25474 1 20 . 1 1 3 3 GLY HA2 H 1 3.940 . . . . . . A 3 GLY HA2 . 25474 1 21 . 1 1 3 3 GLY HA3 H 1 3.940 . . . . . . A 3 GLY HA3 . 25474 1 22 . 1 1 3 3 GLY CA C 13 42.733 . . . . . . A 3 GLY CA . 25474 1 23 . 1 1 3 3 GLY N N 15 108.976 . . . . . . A 3 GLY N . 25474 1 24 . 1 1 4 4 GLY H H 1 8.824 . . . . . . A 4 GLY H . 25474 1 25 . 1 1 4 4 GLY HA2 H 1 3.869 . . . . . . A 4 GLY HA2 . 25474 1 26 . 1 1 4 4 GLY HA3 H 1 3.869 . . . . . . A 4 GLY HA3 . 25474 1 27 . 1 1 4 4 GLY CA C 13 43.706 . . . . . . A 4 GLY CA . 25474 1 28 . 1 1 4 4 GLY N N 15 110.406 . . . . . . A 4 GLY N . 25474 1 29 . 1 1 5 5 LEU H H 1 8.661 . . . . . . A 5 LEU H . 25474 1 30 . 1 1 5 5 LEU HA H 1 4.130 . . . . . . A 5 LEU HA . 25474 1 31 . 1 1 5 5 LEU HB2 H 1 1.672 . . . . . . A 5 LEU HB2 . 25474 1 32 . 1 1 5 5 LEU HB3 H 1 1.672 . . . . . . A 5 LEU HB3 . 25474 1 33 . 1 1 5 5 LEU HG H 1 1.541 . . . . . . A 5 LEU HG . 25474 1 34 . 1 1 5 5 LEU HD11 H 1 0.885 . . . . . . A 5 LEU HD11 . 25474 1 35 . 1 1 5 5 LEU HD12 H 1 0.885 . . . . . . A 5 LEU HD12 . 25474 1 36 . 1 1 5 5 LEU HD13 H 1 0.885 . . . . . . A 5 LEU HD13 . 25474 1 37 . 1 1 5 5 LEU HD21 H 1 0.832 . . . . . . A 5 LEU HD21 . 25474 1 38 . 1 1 5 5 LEU HD22 H 1 0.832 . . . . . . A 5 LEU HD22 . 25474 1 39 . 1 1 5 5 LEU HD23 H 1 0.832 . . . . . . A 5 LEU HD23 . 25474 1 40 . 1 1 5 5 LEU CA C 13 54.437 . . . . . . A 5 LEU CA . 25474 1 41 . 1 1 5 5 LEU CB C 13 39.029 . . . . . . A 5 LEU CB . 25474 1 42 . 1 1 5 5 LEU CG C 13 24.458 . . . . . . A 5 LEU CG . 25474 1 43 . 1 1 5 5 LEU CD1 C 13 22.409 . . . . . . A 5 LEU CD1 . 25474 1 44 . 1 1 5 5 LEU CD2 C 13 21.429 . . . . . . A 5 LEU CD2 . 25474 1 45 . 1 1 5 5 LEU N N 15 122.857 . . . . . . A 5 LEU N . 25474 1 46 . 1 1 6 6 CYS H H 1 8.313 . . . . . . A 6 CYS H . 25474 1 47 . 1 1 6 6 CYS HA H 1 4.642 . . . . . . A 6 CYS HA . 25474 1 48 . 1 1 6 6 CYS HB2 H 1 2.870 . . . . . . A 6 CYS HB2 . 25474 1 49 . 1 1 6 6 CYS HB3 H 1 2.870 . . . . . . A 6 CYS HB3 . 25474 1 50 . 1 1 6 6 CYS CA C 13 58.782 . . . . . . A 6 CYS CA . 25474 1 51 . 1 1 6 6 CYS CB C 13 24.366 . . . . . . A 6 CYS CB . 25474 1 52 . 1 1 6 6 CYS N N 15 118.749 . . . . . . A 6 CYS N . 25474 1 53 . 1 1 7 7 TYR H H 1 8.014 . . . . . . A 7 TYR H . 25474 1 54 . 1 1 7 7 TYR HA H 1 4.233 . . . . . . A 7 TYR HA . 25474 1 55 . 1 1 7 7 TYR HB2 H 1 3.068 . . . . . . A 7 TYR HB2 . 25474 1 56 . 1 1 7 7 TYR HB3 H 1 3.068 . . . . . . A 7 TYR HB3 . 25474 1 57 . 1 1 7 7 TYR HD1 H 1 7.052 . . . . . . A 7 TYR HD1 . 25474 1 58 . 1 1 7 7 TYR HD2 H 1 7.052 . . . . . . A 7 TYR HD2 . 25474 1 59 . 1 1 7 7 TYR HE1 H 1 6.709 . . . . . . A 7 TYR HE1 . 25474 1 60 . 1 1 7 7 TYR HE2 H 1 6.709 . . . . . . A 7 TYR HE2 . 25474 1 61 . 1 1 7 7 TYR CA C 13 57.821 . . . . . . A 7 TYR CA . 25474 1 62 . 1 1 7 7 TYR CB C 13 40.694 . . . . . . A 7 TYR CB . 25474 1 63 . 1 1 7 7 TYR CD1 C 13 130.553 . . . . . . A 7 TYR CD1 . 25474 1 64 . 1 1 7 7 TYR CD2 C 13 130.553 . . . . . . A 7 TYR CD2 . 25474 1 65 . 1 1 7 7 TYR CE1 C 13 115.426 . . . . . . A 7 TYR CE1 . 25474 1 66 . 1 1 7 7 TYR CE2 C 13 115.426 . . . . . . A 7 TYR CE2 . 25474 1 67 . 1 1 7 7 TYR N N 15 120.140 . . . . . . A 7 TYR N . 25474 1 68 . 1 1 8 8 CYS H H 1 8.100 . . . . . . A 8 CYS H . 25474 1 69 . 1 1 8 8 CYS HA H 1 4.032 . . . . . . A 8 CYS HA . 25474 1 70 . 1 1 8 8 CYS HB2 H 1 3.012 . . . . . . A 8 CYS HB2 . 25474 1 71 . 1 1 8 8 CYS HB3 H 1 2.688 . . . . . . A 8 CYS HB3 . 25474 1 72 . 1 1 8 8 CYS CA C 13 52.871 . . . . . . A 8 CYS CA . 25474 1 73 . 1 1 8 8 CYS CB C 13 24.840 . . . . . . A 8 CYS CB . 25474 1 74 . 1 1 8 8 CYS N N 15 117.450 . . . . . . A 8 CYS N . 25474 1 75 . 1 1 9 9 ARG H H 1 8.331 . . . . . . A 9 ARG H . 25474 1 76 . 1 1 9 9 ARG HA H 1 3.935 . . . . . . A 9 ARG HA . 25474 1 77 . 1 1 9 9 ARG HB2 H 1 1.919 . . . . . . A 9 ARG HB2 . 25474 1 78 . 1 1 9 9 ARG HB3 H 1 1.759 . . . . . . A 9 ARG HB3 . 25474 1 79 . 1 1 9 9 ARG HG2 H 1 1.588 . . . . . . A 9 ARG HG2 . 25474 1 80 . 1 1 9 9 ARG HG3 H 1 1.588 . . . . . . A 9 ARG HG3 . 25474 1 81 . 1 1 9 9 ARG HD2 H 1 3.096 . . . . . . A 9 ARG HD2 . 25474 1 82 . 1 1 9 9 ARG HE H 1 7.493 . . . . . . A 9 ARG HE . 25474 1 83 . 1 1 9 9 ARG HH21 H 1 7.139 . . . . . . A 9 ARG HH21 . 25474 1 84 . 1 1 9 9 ARG CA C 13 56.412 . . . . . . A 9 ARG CA . 25474 1 85 . 1 1 9 9 ARG CB C 13 27.467 . . . . . . A 9 ARG CB . 25474 1 86 . 1 1 9 9 ARG CG C 13 24.681 . . . . . . A 9 ARG CG . 25474 1 87 . 1 1 9 9 ARG CD C 13 40.666 . . . . . . A 9 ARG CD . 25474 1 88 . 1 1 9 9 ARG N N 15 120.000 . . . . . . A 9 ARG N . 25474 1 89 . 1 1 10 10 ARG H H 1 7.900 . . . . . . A 10 ARG H . 25474 1 90 . 1 1 10 10 ARG HA H 1 4.036 . . . . . . A 10 ARG HA . 25474 1 91 . 1 1 10 10 ARG HB2 H 1 1.757 . . . . . . A 10 ARG HB2 . 25474 1 92 . 1 1 10 10 ARG HB3 H 1 1.757 . . . . . . A 10 ARG HB3 . 25474 1 93 . 1 1 10 10 ARG HG2 H 1 1.606 . . . . . . A 10 ARG HG2 . 25474 1 94 . 1 1 10 10 ARG HG3 H 1 1.522 . . . . . . A 10 ARG HG3 . 25474 1 95 . 1 1 10 10 ARG HD2 H 1 3.093 . . . . . . A 10 ARG HD2 . 25474 1 96 . 1 1 10 10 ARG HD3 H 1 3.093 . . . . . . A 10 ARG HD3 . 25474 1 97 . 1 1 10 10 ARG HE H 1 7.214 . . . . . . A 10 ARG HE . 25474 1 98 . 1 1 10 10 ARG HH21 H 1 7.214 . . . . . . A 10 ARG HH21 . 25474 1 99 . 1 1 10 10 ARG CA C 13 55.596 . . . . . . A 10 ARG CA . 25474 1 100 . 1 1 10 10 ARG CB C 13 27.475 . . . . . . A 10 ARG CB . 25474 1 101 . 1 1 10 10 ARG CG C 13 23.639 . . . . . . A 10 ARG CG . 25474 1 102 . 1 1 10 10 ARG CD C 13 40.531 . . . . . . A 10 ARG CD . 25474 1 103 . 1 1 10 10 ARG NE N 15 84.825 . . . . . . A 10 ARG NE . 25474 1 104 . 1 1 11 11 ARG H H 1 7.957 . . . . . . A 11 ARG H . 25474 1 105 . 1 1 11 11 ARG HA H 1 3.994 . . . . . . A 11 ARG HA . 25474 1 106 . 1 1 11 11 ARG HB2 H 1 1.758 . . . . . . A 11 ARG HB2 . 25474 1 107 . 1 1 11 11 ARG HB3 H 1 1.758 . . . . . . A 11 ARG HB3 . 25474 1 108 . 1 1 11 11 ARG HG2 H 1 1.526 . . . . . . A 11 ARG HG2 . 25474 1 109 . 1 1 11 11 ARG HG3 H 1 1.247 . . . . . . A 11 ARG HG3 . 25474 1 110 . 1 1 11 11 ARG HD2 H 1 2.969 . . . . . . A 11 ARG HD2 . 25474 1 111 . 1 1 11 11 ARG HD3 H 1 2.874 . . . . . . A 11 ARG HD3 . 25474 1 112 . 1 1 11 11 ARG HE H 1 7.398 . . . . . . A 11 ARG HE . 25474 1 113 . 1 1 11 11 ARG HH11 H 1 6.709 . . . . . . A 11 ARG HH11 . 25474 1 114 . 1 1 11 11 ARG HH12 H 1 6.709 . . . . . . A 11 ARG HH12 . 25474 1 115 . 1 1 11 11 ARG HH21 H 1 6.805 . . . . . . A 11 ARG HH21 . 25474 1 116 . 1 1 11 11 ARG HH22 H 1 6.805 . . . . . . A 11 ARG HH22 . 25474 1 117 . 1 1 11 11 ARG CA C 13 54.347 . . . . . . A 11 ARG CA . 25474 1 118 . 1 1 11 11 ARG CB C 13 27.475 . . . . . . A 11 ARG CB . 25474 1 119 . 1 1 11 11 ARG CG C 13 24.055 . . . . . . A 11 ARG CG . 25474 1 120 . 1 1 11 11 ARG CD C 13 39.937 . . . . . . A 11 ARG CD . 25474 1 121 . 1 1 11 11 ARG N N 15 117.419 . . . . . . A 11 ARG N . 25474 1 122 . 1 1 12 12 PHE H H 1 8.138 . . . . . . A 12 PHE H . 25474 1 123 . 1 1 12 12 PHE HA H 1 4.348 . . . . . . A 12 PHE HA . 25474 1 124 . 1 1 12 12 PHE HB2 H 1 3.187 . . . . . . A 12 PHE HB2 . 25474 1 125 . 1 1 12 12 PHE HB3 H 1 2.982 . . . . . . A 12 PHE HB3 . 25474 1 126 . 1 1 12 12 PHE HD1 H 1 7.054 . . . . . . A 12 PHE HD1 . 25474 1 127 . 1 1 12 12 PHE HD2 H 1 7.054 . . . . . . A 12 PHE HD2 . 25474 1 128 . 1 1 12 12 PHE HE1 H 1 7.139 . . . . . . A 12 PHE HE1 . 25474 1 129 . 1 1 12 12 PHE HE2 H 1 7.139 . . . . . . A 12 PHE HE2 . 25474 1 130 . 1 1 12 12 PHE CA C 13 58.491 . . . . . . A 12 PHE CA . 25474 1 131 . 1 1 12 12 PHE CB C 13 36.982 . . . . . . A 12 PHE CB . 25474 1 132 . 1 1 12 12 PHE CD1 C 13 126.584 . . . . . . A 12 PHE CD1 . 25474 1 133 . 1 1 12 12 PHE CD2 C 13 126.584 . . . . . . A 12 PHE CD2 . 25474 1 134 . 1 1 12 12 PHE CE1 C 13 129.118 . . . . . . A 12 PHE CE1 . 25474 1 135 . 1 1 12 12 PHE CE2 C 13 129.118 . . . . . . A 12 PHE CE2 . 25474 1 136 . 1 1 13 13 CYS H H 1 8.047 . . . . . . A 13 CYS H . 25474 1 137 . 1 1 13 13 CYS HA H 1 4.155 . . . . . . A 13 CYS HA . 25474 1 138 . 1 1 13 13 CYS HB2 H 1 2.961 . . . . . . A 13 CYS HB2 . 25474 1 139 . 1 1 13 13 CYS HB3 H 1 2.887 . . . . . . A 13 CYS HB3 . 25474 1 140 . 1 1 13 13 CYS CB C 13 24.426 . . . . . . A 13 CYS CB . 25474 1 141 . 1 1 13 13 CYS N N 15 119.944 . . . . . . A 13 CYS N . 25474 1 142 . 1 1 14 14 VAL H H 1 7.836 . . . . . . A 14 VAL H . 25474 1 143 . 1 1 14 14 VAL HA H 1 3.932 . . . . . . A 14 VAL HA . 25474 1 144 . 1 1 14 14 VAL HB H 1 2.059 . . . . . . A 14 VAL HB . 25474 1 145 . 1 1 14 14 VAL HG11 H 1 0.923 . . . . . . A 14 VAL HG11 . 25474 1 146 . 1 1 14 14 VAL HG12 H 1 0.923 . . . . . . A 14 VAL HG12 . 25474 1 147 . 1 1 14 14 VAL HG13 H 1 0.923 . . . . . . A 14 VAL HG13 . 25474 1 148 . 1 1 14 14 VAL HG21 H 1 0.872 . . . . . . A 14 VAL HG21 . 25474 1 149 . 1 1 14 14 VAL HG22 H 1 0.872 . . . . . . A 14 VAL HG22 . 25474 1 150 . 1 1 14 14 VAL HG23 H 1 0.872 . . . . . . A 14 VAL HG23 . 25474 1 151 . 1 1 14 14 VAL CA C 13 61.054 . . . . . . A 14 VAL CA . 25474 1 152 . 1 1 14 14 VAL CB C 13 29.860 . . . . . . A 14 VAL CB . 25474 1 153 . 1 1 14 14 VAL CG1 C 13 18.766 . . . . . . A 14 VAL CG1 . 25474 1 154 . 1 1 15 15 CYS H H 1 8.045 . . . . . . A 15 CYS H . 25474 1 155 . 1 1 15 15 CYS HA H 1 4.275 . . . . . . A 15 CYS HA . 25474 1 156 . 1 1 15 15 CYS HB2 H 1 2.849 . . . . . . A 15 CYS HB2 . 25474 1 157 . 1 1 15 15 CYS HB3 H 1 2.809 . . . . . . A 15 CYS HB3 . 25474 1 158 . 1 1 15 15 CYS CA C 13 57.856 . . . . . . A 15 CYS CA . 25474 1 159 . 1 1 15 15 CYS CB C 13 25.187 . . . . . . A 15 CYS CB . 25474 1 160 . 1 1 15 15 CYS N N 15 117.212 . . . . . . A 15 CYS N . 25474 1 161 . 1 1 16 16 VAL H H 1 7.743 . . . . . . A 16 VAL H . 25474 1 162 . 1 1 16 16 VAL HA H 1 4.075 . . . . . . A 16 VAL HA . 25474 1 163 . 1 1 16 16 VAL HB H 1 2.033 . . . . . . A 16 VAL HB . 25474 1 164 . 1 1 16 16 VAL HG11 H 1 0.723 . . . . . . A 16 VAL HG11 . 25474 1 165 . 1 1 16 16 VAL HG12 H 1 0.723 . . . . . . A 16 VAL HG12 . 25474 1 166 . 1 1 16 16 VAL HG13 H 1 0.723 . . . . . . A 16 VAL HG13 . 25474 1 167 . 1 1 16 16 VAL HG21 H 1 0.723 . . . . . . A 16 VAL HG21 . 25474 1 168 . 1 1 16 16 VAL HG22 H 1 0.723 . . . . . . A 16 VAL HG22 . 25474 1 169 . 1 1 16 16 VAL HG23 H 1 0.723 . . . . . . A 16 VAL HG23 . 25474 1 170 . 1 1 16 16 VAL CA C 13 59.486 . . . . . . A 16 VAL CA . 25474 1 171 . 1 1 16 16 VAL CB C 13 29.632 . . . . . . A 16 VAL CB . 25474 1 172 . 1 1 16 16 VAL CG1 C 13 18.763 . . . . . . A 16 VAL CG1 . 25474 1 173 . 1 1 16 16 VAL CG2 C 13 17.658 . . . . . . A 16 VAL CG2 . 25474 1 174 . 1 1 17 17 GLY H H 1 8.001 . . . . . . A 17 GLY H . 25474 1 175 . 1 1 17 17 GLY HA2 H 1 3.859 . . . . . . A 17 GLY HA2 . 25474 1 176 . 1 1 17 17 GLY HA3 H 1 3.859 . . . . . . A 17 GLY HA3 . 25474 1 177 . 1 1 17 17 GLY CA C 13 42.780 . . . . . . A 17 GLY CA . 25474 1 178 . 1 1 17 17 GLY N N 15 110.355 . . . . . . A 17 GLY N . 25474 1 179 . 1 1 18 18 ARG H H 1 7.871 . . . . . . A 18 ARG H . 25474 1 180 . 1 1 18 18 ARG HA H 1 4.244 . . . . . . A 18 ARG HA . 25474 1 181 . 1 1 18 18 ARG HB2 H 1 1.847 . . . . . . A 18 ARG HB2 . 25474 1 182 . 1 1 18 18 ARG HB3 H 1 1.847 . . . . . . A 18 ARG HB3 . 25474 1 183 . 1 1 18 18 ARG HG2 H 1 1.596 . . . . . . A 18 ARG HG2 . 25474 1 184 . 1 1 18 18 ARG HG3 H 1 1.530 . . . . . . A 18 ARG HG3 . 25474 1 185 . 1 1 18 18 ARG HD2 H 1 3.096 . . . . . . A 18 ARG HD2 . 25474 1 186 . 1 1 18 18 ARG HD3 H 1 3.096 . . . . . . A 18 ARG HD3 . 25474 1 187 . 1 1 18 18 ARG HE H 1 7.349 . . . . . . A 18 ARG HE . 25474 1 188 . 1 1 18 18 ARG CA C 13 53.059 . . . . . . A 18 ARG CA . 25474 1 189 . 1 1 18 18 ARG CB C 13 28.539 . . . . . . A 18 ARG CB . 25474 1 190 . 1 1 18 18 ARG CG C 13 24.656 . . . . . . A 18 ARG CG . 25474 1 191 . 1 1 18 18 ARG CD C 13 40.640 . . . . . . A 18 ARG CD . 25474 1 192 . 1 1 18 18 ARG N N 15 121.880 . . . . . . A 18 ARG N . 25474 1 stop_ save_