################################### # 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 30876 _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 1H-1H TOCSY' . . . 30876 1 2 '2D 1H-1H NOESY' . . . 30876 1 3 '2D 1H-15N HSQC' . . . 30876 1 4 '2D 1H-1H TOCSY' . . . 30876 1 5 '2D 1H-1H NOESY' . . . 30876 1 6 '2D 1H-13C HSQC aliphatic' . . . 30876 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 GLY HA2 H 1 3.782 0.000 . . . . . A A 1 GLY HA2 . 30876 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.843 0.000 . . . . . A A 1 GLY HA3 . 30876 1 3 . 1 . 1 1 1 GLY CA C 13 43.065 0.000 . . . . . A A 1 GLY CA . 30876 1 4 . 1 . 1 2 2 ASN H H 1 8.406 0.000 . . . . . A A 2 ASN H . 30876 1 5 . 1 . 1 2 2 ASN HA H 1 4.876 0.000 . . . . . A A 2 ASN HA . 30876 1 6 . 1 . 1 2 2 ASN HB2 H 1 2.786 0.000 . . . . . A A 2 ASN HB2 . 30876 1 7 . 1 . 1 2 2 ASN HB3 H 1 2.887 0.000 . . . . . A A 2 ASN HB3 . 30876 1 8 . 1 . 1 2 2 ASN HD21 H 1 7.447 0.000 . . . . . A A 2 ASN HD21 . 30876 1 9 . 1 . 1 2 2 ASN HD22 H 1 6.842 0.000 . . . . . A A 2 ASN HD22 . 30876 1 10 . 1 . 1 2 2 ASN CA C 13 53.039 0.000 . . . . . A A 2 ASN CA . 30876 1 11 . 1 . 1 2 2 ASN CB C 13 38.848 0.000 . . . . . A A 2 ASN CB . 30876 1 12 . 1 . 1 2 2 ASN N N 15 117.251 0.000 . . . . . A A 2 ASN N . 30876 1 13 . 1 . 1 3 3 SER H H 1 8.636 0.000 . . . . . A A 3 SER H . 30876 1 14 . 1 . 1 3 3 SER HA H 1 4.185 0.000 . . . . . A A 3 SER HA . 30876 1 15 . 1 . 1 3 3 SER HB2 H 1 3.856 0.000 . . . . . A A 3 SER HB2 . 30876 1 16 . 1 . 1 3 3 SER HB3 H 1 3.899 0.000 . . . . . A A 3 SER HB3 . 30876 1 17 . 1 . 1 3 3 SER CA C 13 60.568 0.000 . . . . . A A 3 SER CA . 30876 1 18 . 1 . 1 3 3 SER CB C 13 62.690 0.000 . . . . . A A 3 SER CB . 30876 1 19 . 1 . 1 3 3 SER N N 15 117.543 0.000 . . . . . A A 3 SER N . 30876 1 20 . 1 . 1 4 4 TRP H H 1 8.052 0.002 . . . . . A A 4 TRP H . 30876 1 21 . 1 . 1 4 4 TRP HA H 1 4.292 0.000 . . . . . A A 4 TRP HA . 30876 1 22 . 1 . 1 4 4 TRP HB2 H 1 3.263 0.000 . . . . . A A 4 TRP HB2 . 30876 1 23 . 1 . 1 4 4 TRP HB3 H 1 3.263 0.000 . . . . . A A 4 TRP HB3 . 30876 1 24 . 1 . 1 4 4 TRP HD1 H 1 7.228 0.000 . . . . . A A 4 TRP HD1 . 30876 1 25 . 1 . 1 4 4 TRP HE1 H 1 10.135 0.000 . . . . . A A 4 TRP HE1 . 30876 1 26 . 1 . 1 4 4 TRP HE3 H 1 7.435 0.000 . . . . . A A 4 TRP HE3 . 30876 1 27 . 1 . 1 4 4 TRP HZ2 H 1 7.382 0.000 . . . . . A A 4 TRP HZ2 . 30876 1 28 . 1 . 1 4 4 TRP HZ3 H 1 7.024 0.000 . . . . . A A 4 TRP HZ3 . 30876 1 29 . 1 . 1 4 4 TRP HH2 H 1 7.105 0.000 . . . . . A A 4 TRP HH2 . 30876 1 30 . 1 . 1 4 4 TRP CA C 13 59.911 0.000 . . . . . A A 4 TRP CA . 30876 1 31 . 1 . 1 4 4 TRP CB C 13 28.395 0.000 . . . . . A A 4 TRP CB . 30876 1 32 . 1 . 1 4 4 TRP N N 15 123.916 0.000 . . . . . A A 4 TRP N . 30876 1 33 . 1 . 1 5 5 LEU H H 1 7.721 0.000 . . . . . A A 5 LEU H . 30876 1 34 . 1 . 1 5 5 LEU HA H 1 3.644 0.000 . . . . . A A 5 LEU HA . 30876 1 35 . 1 . 1 5 5 LEU HB2 H 1 1.384 0.000 . . . . . A A 5 LEU HB2 . 30876 1 36 . 1 . 1 5 5 LEU HB3 H 1 1.384 0.000 . . . . . A A 5 LEU HB3 . 30876 1 37 . 1 . 1 5 5 LEU HG H 1 1.359 0.000 . . . . . A A 5 LEU HG . 30876 1 38 . 1 . 1 5 5 LEU HD11 H 1 0.785 0.003 . . . . . A A 5 LEU HD11 . 30876 1 39 . 1 . 1 5 5 LEU HD12 H 1 0.785 0.003 . . . . . A A 5 LEU HD12 . 30876 1 40 . 1 . 1 5 5 LEU HD13 H 1 0.785 0.003 . . . . . A A 5 LEU HD13 . 30876 1 41 . 1 . 1 5 5 LEU HD21 H 1 0.733 0.003 . . . . . A A 5 LEU HD21 . 30876 1 42 . 1 . 1 5 5 LEU HD22 H 1 0.733 0.003 . . . . . A A 5 LEU HD22 . 30876 1 43 . 1 . 1 5 5 LEU HD23 H 1 0.733 0.003 . . . . . A A 5 LEU HD23 . 30876 1 44 . 1 . 1 5 5 LEU CA C 13 56.998 0.000 . . . . . A A 5 LEU CA . 30876 1 45 . 1 . 1 5 5 LEU CB C 13 41.416 0.000 . . . . . A A 5 LEU CB . 30876 1 46 . 1 . 1 5 5 LEU CG C 13 26.562 0.000 . . . . . A A 5 LEU CG . 30876 1 47 . 1 . 1 5 5 LEU CD1 C 13 23.862 0.000 . . . . . A A 5 LEU CD1 . 30876 1 48 . 1 . 1 5 5 LEU CD2 C 13 23.743 0.000 . . . . . A A 5 LEU CD2 . 30876 1 49 . 1 . 1 5 5 LEU N N 15 120.118 0.000 . . . . . A A 5 LEU N . 30876 1 50 . 1 . 1 6 6 CYS H H 1 7.457 0.000 . . . . . A A 6 CYS H . 30876 1 51 . 1 . 1 6 6 CYS HA H 1 4.030 0.000 . . . . . A A 6 CYS HA . 30876 1 52 . 1 . 1 6 6 CYS HB2 H 1 2.842 0.000 . . . . . A A 6 CYS HB2 . 30876 1 53 . 1 . 1 6 6 CYS HB3 H 1 2.997 0.000 . . . . . A A 6 CYS HB3 . 30876 1 54 . 1 . 1 6 6 CYS CA C 13 57.705 0.000 . . . . . A A 6 CYS CA . 30876 1 55 . 1 . 1 6 6 CYS CB C 13 38.809 0.000 . . . . . A A 6 CYS CB . 30876 1 56 . 1 . 1 6 6 CYS N N 15 116.132 0.000 . . . . . A A 6 CYS N . 30876 1 57 . 1 . 1 7 7 VAL H H 1 7.627 0.000 . . . . . A A 7 VAL H . 30876 1 58 . 1 . 1 7 7 VAL HA H 1 3.932 0.000 . . . . . A A 7 VAL HA . 30876 1 59 . 1 . 1 7 7 VAL HB H 1 1.945 0.000 . . . . . A A 7 VAL HB . 30876 1 60 . 1 . 1 7 7 VAL HG11 H 1 0.954 0.000 . . . . . A A 7 VAL HG11 . 30876 1 61 . 1 . 1 7 7 VAL HG12 H 1 0.954 0.000 . . . . . A A 7 VAL HG12 . 30876 1 62 . 1 . 1 7 7 VAL HG13 H 1 0.954 0.000 . . . . . A A 7 VAL HG13 . 30876 1 63 . 1 . 1 7 7 VAL HG21 H 1 0.855 0.000 . . . . . A A 7 VAL HG21 . 30876 1 64 . 1 . 1 7 7 VAL HG22 H 1 0.855 0.000 . . . . . A A 7 VAL HG22 . 30876 1 65 . 1 . 1 7 7 VAL HG23 H 1 0.855 0.000 . . . . . A A 7 VAL HG23 . 30876 1 66 . 1 . 1 7 7 VAL CA C 13 64.926 0.000 . . . . . A A 7 VAL CA . 30876 1 67 . 1 . 1 7 7 VAL CB C 13 32.217 0.687 . . . . . A A 7 VAL CB . 30876 1 68 . 1 . 1 7 7 VAL CG1 C 13 21.819 0.000 . . . . . A A 7 VAL CG1 . 30876 1 69 . 1 . 1 7 7 VAL CG2 C 13 20.716 0.000 . . . . . A A 7 VAL CG2 . 30876 1 70 . 1 . 1 7 7 VAL N N 15 118.357 0.000 . . . . . A A 7 VAL N . 30876 1 71 . 1 . 1 8 8 ARG H H 1 7.991 0.000 . . . . . A A 8 ARG H . 30876 1 72 . 1 . 1 8 8 ARG HA H 1 3.882 0.000 . . . . . A A 8 ARG HA . 30876 1 73 . 1 . 1 8 8 ARG HB2 H 1 1.499 0.000 . . . . . A A 8 ARG HB2 . 30876 1 74 . 1 . 1 8 8 ARG HB3 H 1 1.571 0.003 . . . . . A A 8 ARG HB3 . 30876 1 75 . 1 . 1 8 8 ARG HG2 H 1 1.256 0.003 . . . . . A A 8 ARG HG2 . 30876 1 76 . 1 . 1 8 8 ARG HG3 H 1 1.302 0.003 . . . . . A A 8 ARG HG3 . 30876 1 77 . 1 . 1 8 8 ARG HD2 H 1 2.757 0.002 . . . . . A A 8 ARG HD2 . 30876 1 78 . 1 . 1 8 8 ARG HD3 H 1 2.757 0.002 . . . . . A A 8 ARG HD3 . 30876 1 79 . 1 . 1 8 8 ARG HE H 1 7.001 0.000 . . . . . A A 8 ARG HE . 30876 1 80 . 1 . 1 8 8 ARG CA C 13 58.000 0.000 . . . . . A A 8 ARG CA . 30876 1 81 . 1 . 1 8 8 ARG CB C 13 29.095 0.000 . . . . . A A 8 ARG CB . 30876 1 82 . 1 . 1 8 8 ARG CG C 13 26.381 0.000 . . . . . A A 8 ARG CG . 30876 1 83 . 1 . 1 8 8 ARG CD C 13 42.599 0.000 . . . . . A A 8 ARG CD . 30876 1 84 . 1 . 1 8 8 ARG N N 15 121.875 0.000 . . . . . A A 8 ARG N . 30876 1 85 . 1 . 1 9 9 ARG H H 1 7.349 0.000 . . . . . A A 9 ARG H . 30876 1 86 . 1 . 1 9 9 ARG HA H 1 4.245 0.000 . . . . . A A 9 ARG HA . 30876 1 87 . 1 . 1 9 9 ARG HB2 H 1 1.672 0.000 . . . . . A A 9 ARG HB2 . 30876 1 88 . 1 . 1 9 9 ARG HB3 H 1 1.899 0.000 . . . . . A A 9 ARG HB3 . 30876 1 89 . 1 . 1 9 9 ARG HG2 H 1 1.565 0.000 . . . . . A A 9 ARG HG2 . 30876 1 90 . 1 . 1 9 9 ARG HG3 H 1 1.668 0.000 . . . . . A A 9 ARG HG3 . 30876 1 91 . 1 . 1 9 9 ARG HD2 H 1 2.920 0.000 . . . . . A A 9 ARG HD2 . 30876 1 92 . 1 . 1 9 9 ARG HD3 H 1 2.983 0.000 . . . . . A A 9 ARG HD3 . 30876 1 93 . 1 . 1 9 9 ARG HE H 1 7.002 0.000 . . . . . A A 9 ARG HE . 30876 1 94 . 1 . 1 9 9 ARG CA C 13 57.424 0.000 . . . . . A A 9 ARG CA . 30876 1 95 . 1 . 1 9 9 ARG CB C 13 30.022 0.000 . . . . . A A 9 ARG CB . 30876 1 96 . 1 . 1 9 9 ARG CG C 13 26.814 0.000 . . . . . A A 9 ARG CG . 30876 1 97 . 1 . 1 9 9 ARG CD C 13 43.353 0.026 . . . . . A A 9 ARG CD . 30876 1 98 . 1 . 1 9 9 ARG N N 15 116.607 0.000 . . . . . A A 9 ARG N . 30876 1 99 . 1 . 1 10 10 GLY H H 1 7.851 0.000 . . . . . A A 10 GLY H . 30876 1 100 . 1 . 1 10 10 GLY HA2 H 1 4.082 0.000 . . . . . A A 10 GLY HA2 . 30876 1 101 . 1 . 1 10 10 GLY HA3 H 1 3.709 0.003 . . . . . A A 10 GLY HA3 . 30876 1 102 . 1 . 1 10 10 GLY CA C 13 45.068 0.000 . . . . . A A 10 GLY CA . 30876 1 103 . 1 . 1 10 10 GLY N N 15 107.182 0.000 . . . . . A A 10 GLY N . 30876 1 104 . 1 . 1 11 11 GLY H H 1 7.994 0.000 . . . . . A A 11 GLY H . 30876 1 105 . 1 . 1 11 11 GLY HA2 H 1 4.536 0.000 . . . . . A A 11 GLY HA2 . 30876 1 106 . 1 . 1 11 11 GLY HA3 H 1 3.077 0.003 . . . . . A A 11 GLY HA3 . 30876 1 107 . 1 . 1 11 11 GLY CA C 13 43.362 0.000 . . . . . A A 11 GLY CA . 30876 1 108 . 1 . 1 11 11 GLY N N 15 107.816 0.000 . . . . . A A 11 GLY N . 30876 1 109 . 1 . 1 12 12 ASN H H 1 8.340 0.000 . . . . . A A 12 ASN H . 30876 1 110 . 1 . 1 12 12 ASN HA H 1 4.727 0.000 . . . . . A A 12 ASN HA . 30876 1 111 . 1 . 1 12 12 ASN HB2 H 1 2.239 0.000 . . . . . A A 12 ASN HB2 . 30876 1 112 . 1 . 1 12 12 ASN HB3 H 1 2.239 0.000 . . . . . A A 12 ASN HB3 . 30876 1 113 . 1 . 1 12 12 ASN HD21 H 1 7.318 0.000 . . . . . A A 12 ASN HD21 . 30876 1 114 . 1 . 1 12 12 ASN HD22 H 1 6.731 0.000 . . . . . A A 12 ASN HD22 . 30876 1 115 . 1 . 1 12 12 ASN CA C 13 52.155 0.000 . . . . . A A 12 ASN CA . 30876 1 116 . 1 . 1 12 12 ASN CB C 13 42.582 0.000 . . . . . A A 12 ASN CB . 30876 1 117 . 1 . 1 12 12 ASN N N 15 112.942 0.000 . . . . . A A 12 ASN N . 30876 1 118 . 1 . 1 13 13 CYS H H 1 8.970 0.000 . . . . . A A 13 CYS H . 30876 1 119 . 1 . 1 13 13 CYS HA H 1 5.085 0.000 . . . . . A A 13 CYS HA . 30876 1 120 . 1 . 1 13 13 CYS HB2 H 1 2.629 0.000 . . . . . A A 13 CYS HB2 . 30876 1 121 . 1 . 1 13 13 CYS HB3 H 1 2.698 0.000 . . . . . A A 13 CYS HB3 . 30876 1 122 . 1 . 1 13 13 CYS CA C 13 53.852 0.000 . . . . . A A 13 CYS CA . 30876 1 123 . 1 . 1 13 13 CYS CB C 13 39.333 0.000 . . . . . A A 13 CYS CB . 30876 1 124 . 1 . 1 13 13 CYS N N 15 123.897 0.000 . . . . . A A 13 CYS N . 30876 1 125 . 1 . 1 14 14 ARG H H 1 8.185 0.000 . . . . . A A 14 ARG H . 30876 1 126 . 1 . 1 14 14 ARG HA H 1 4.554 0.000 . . . . . A A 14 ARG HA . 30876 1 127 . 1 . 1 14 14 ARG HB2 H 1 1.434 0.000 . . . . . A A 14 ARG HB2 . 30876 1 128 . 1 . 1 14 14 ARG HB3 H 1 1.738 0.000 . . . . . A A 14 ARG HB3 . 30876 1 129 . 1 . 1 14 14 ARG HG2 H 1 1.423 0.000 . . . . . A A 14 ARG HG2 . 30876 1 130 . 1 . 1 14 14 ARG HG3 H 1 1.554 0.000 . . . . . A A 14 ARG HG3 . 30876 1 131 . 1 . 1 14 14 ARG HD2 H 1 3.038 0.000 . . . . . A A 14 ARG HD2 . 30876 1 132 . 1 . 1 14 14 ARG HD3 H 1 3.196 0.000 . . . . . A A 14 ARG HD3 . 30876 1 133 . 1 . 1 14 14 ARG HE H 1 8.959 0.000 . . . . . A A 14 ARG HE . 30876 1 134 . 1 . 1 14 14 ARG CA C 13 53.886 0.000 . . . . . A A 14 ARG CA . 30876 1 135 . 1 . 1 14 14 ARG CB C 13 32.970 0.000 . . . . . A A 14 ARG CB . 30876 1 136 . 1 . 1 14 14 ARG CG C 13 27.930 0.014 . . . . . A A 14 ARG CG . 30876 1 137 . 1 . 1 14 14 ARG CD C 13 42.853 0.000 . . . . . A A 14 ARG CD . 30876 1 138 . 1 . 1 14 14 ARG N N 15 123.660 0.000 . . . . . A A 14 ARG N . 30876 1 139 . 1 . 1 15 15 PHE H H 1 8.613 0.000 . . . . . A A 15 PHE H . 30876 1 140 . 1 . 1 15 15 PHE HA H 1 4.473 0.000 . . . . . A A 15 PHE HA . 30876 1 141 . 1 . 1 15 15 PHE HB2 H 1 2.948 0.000 . . . . . A A 15 PHE HB2 . 30876 1 142 . 1 . 1 15 15 PHE HB3 H 1 3.060 0.000 . . . . . A A 15 PHE HB3 . 30876 1 143 . 1 . 1 15 15 PHE HD1 H 1 7.227 0.000 . . . . . A A 15 PHE HD1 . 30876 1 144 . 1 . 1 15 15 PHE HD2 H 1 7.227 0.000 . . . . . A A 15 PHE HD2 . 30876 1 145 . 1 . 1 15 15 PHE HE1 H 1 7.258 0.000 . . . . . A A 15 PHE HE1 . 30876 1 146 . 1 . 1 15 15 PHE HE2 H 1 7.258 0.000 . . . . . A A 15 PHE HE2 . 30876 1 147 . 1 . 1 15 15 PHE CA C 13 58.871 0.000 . . . . . A A 15 PHE CA . 30876 1 148 . 1 . 1 15 15 PHE CB C 13 38.680 0.000 . . . . . A A 15 PHE CB . 30876 1 149 . 1 . 1 15 15 PHE N N 15 118.106 0.000 . . . . . A A 15 PHE N . 30876 1 150 . 1 . 1 16 16 GLY H H 1 8.465 0.000 . . . . . A A 16 GLY H . 30876 1 151 . 1 . 1 16 16 GLY HA2 H 1 4.185 0.000 . . . . . A A 16 GLY HA2 . 30876 1 152 . 1 . 1 16 16 GLY HA3 H 1 3.306 0.000 . . . . . A A 16 GLY HA3 . 30876 1 153 . 1 . 1 16 16 GLY CA C 13 47.242 0.000 . . . . . A A 16 GLY CA . 30876 1 154 . 1 . 1 16 16 GLY N N 15 115.018 0.000 . . . . . A A 16 GLY N . 30876 1 155 . 1 . 1 17 17 ARG H H 1 8.172 0.000 . . . . . A A 17 ARG H . 30876 1 156 . 1 . 1 17 17 ARG HA H 1 4.486 0.000 . . . . . A A 17 ARG HA . 30876 1 157 . 1 . 1 17 17 ARG HB2 H 1 1.667 0.000 . . . . . A A 17 ARG HB2 . 30876 1 158 . 1 . 1 17 17 ARG HB3 H 1 1.867 0.000 . . . . . A A 17 ARG HB3 . 30876 1 159 . 1 . 1 17 17 ARG HG2 H 1 1.445 0.003 . . . . . A A 17 ARG HG2 . 30876 1 160 . 1 . 1 17 17 ARG HG3 H 1 1.574 0.003 . . . . . A A 17 ARG HG3 . 30876 1 161 . 1 . 1 17 17 ARG HD2 H 1 3.105 0.000 . . . . . A A 17 ARG HD2 . 30876 1 162 . 1 . 1 17 17 ARG HD3 H 1 3.105 0.000 . . . . . A A 17 ARG HD3 . 30876 1 163 . 1 . 1 17 17 ARG HE H 1 7.071 0.000 . . . . . A A 17 ARG HE . 30876 1 164 . 1 . 1 17 17 ARG CA C 13 54.524 0.000 . . . . . A A 17 ARG CA . 30876 1 165 . 1 . 1 17 17 ARG CB C 13 32.820 0.000 . . . . . A A 17 ARG CB . 30876 1 166 . 1 . 1 17 17 ARG CG C 13 25.401 0.000 . . . . . A A 17 ARG CG . 30876 1 167 . 1 . 1 17 17 ARG CD C 13 43.108 0.000 . . . . . A A 17 ARG CD . 30876 1 168 . 1 . 1 17 17 ARG N N 15 120.837 0.000 . . . . . A A 17 ARG N . 30876 1 169 . 1 . 1 18 18 CYS H H 1 8.566 0.000 . . . . . A A 18 CYS H . 30876 1 170 . 1 . 1 18 18 CYS HA H 1 4.781 0.000 . . . . . A A 18 CYS HA . 30876 1 171 . 1 . 1 18 18 CYS HB2 H 1 2.582 0.004 . . . . . A A 18 CYS HB2 . 30876 1 172 . 1 . 1 18 18 CYS HB3 H 1 3.336 0.000 . . . . . A A 18 CYS HB3 . 30876 1 173 . 1 . 1 18 18 CYS CA C 13 52.297 0.000 . . . . . A A 18 CYS CA . 30876 1 174 . 1 . 1 18 18 CYS CB C 13 36.581 0.000 . . . . . A A 18 CYS CB . 30876 1 175 . 1 . 1 18 18 CYS N N 15 116.886 0.000 . . . . . A A 18 CYS N . 30876 1 176 . 1 . 1 19 19 GLN H H 1 8.522 0.001 . . . . . A A 19 GLN H . 30876 1 177 . 1 . 1 19 19 GLN HA H 1 4.245 0.000 . . . . . A A 19 GLN HA . 30876 1 178 . 1 . 1 19 19 GLN HB2 H 1 1.584 0.003 . . . . . A A 19 GLN HB2 . 30876 1 179 . 1 . 1 19 19 GLN HB3 H 1 2.064 0.000 . . . . . A A 19 GLN HB3 . 30876 1 180 . 1 . 1 19 19 GLN HG2 H 1 2.239 0.000 . . . . . A A 19 GLN HG2 . 30876 1 181 . 1 . 1 19 19 GLN HG3 H 1 2.239 0.000 . . . . . A A 19 GLN HG3 . 30876 1 182 . 1 . 1 19 19 GLN HE21 H 1 7.600 0.000 . . . . . A A 19 GLN HE21 . 30876 1 183 . 1 . 1 19 19 GLN HE22 H 1 6.799 0.000 . . . . . A A 19 GLN HE22 . 30876 1 184 . 1 . 1 19 19 GLN CA C 13 55.459 0.000 . . . . . A A 19 GLN CA . 30876 1 185 . 1 . 1 19 19 GLN CB C 13 29.124 0.000 . . . . . A A 19 GLN CB . 30876 1 186 . 1 . 1 19 19 GLN CG C 13 33.775 0.000 . . . . . A A 19 GLN CG . 30876 1 187 . 1 . 1 19 19 GLN N N 15 118.984 0.000 . . . . . A A 19 GLN N . 30876 1 188 . 1 . 1 20 20 PHE H H 1 8.371 0.000 . . . . . A A 20 PHE H . 30876 1 189 . 1 . 1 20 20 PHE HA H 1 4.111 0.000 . . . . . A A 20 PHE HA . 30876 1 190 . 1 . 1 20 20 PHE HB2 H 1 2.905 0.000 . . . . . A A 20 PHE HB2 . 30876 1 191 . 1 . 1 20 20 PHE HB3 H 1 3.137 0.000 . . . . . A A 20 PHE HB3 . 30876 1 192 . 1 . 1 20 20 PHE HD1 H 1 7.187 0.000 . . . . . A A 20 PHE HD1 . 30876 1 193 . 1 . 1 20 20 PHE HD2 H 1 7.187 0.000 . . . . . A A 20 PHE HD2 . 30876 1 194 . 1 . 1 20 20 PHE HE1 H 1 7.291 0.000 . . . . . A A 20 PHE HE1 . 30876 1 195 . 1 . 1 20 20 PHE HE2 H 1 7.291 0.000 . . . . . A A 20 PHE HE2 . 30876 1 196 . 1 . 1 20 20 PHE CA C 13 60.179 0.000 . . . . . A A 20 PHE CA . 30876 1 197 . 1 . 1 20 20 PHE CB C 13 38.527 0.000 . . . . . A A 20 PHE CB . 30876 1 198 . 1 . 1 20 20 PHE N N 15 120.304 0.000 . . . . . A A 20 PHE N . 30876 1 199 . 1 . 1 21 21 ALA H H 1 8.092 0.000 . . . . . A A 21 ALA H . 30876 1 200 . 1 . 1 21 21 ALA HA H 1 3.861 0.000 . . . . . A A 21 ALA HA . 30876 1 201 . 1 . 1 21 21 ALA HB1 H 1 1.208 0.003 . . . . . A A 21 ALA HB1 . 30876 1 202 . 1 . 1 21 21 ALA HB2 H 1 1.208 0.003 . . . . . A A 21 ALA HB2 . 30876 1 203 . 1 . 1 21 21 ALA HB3 H 1 1.208 0.003 . . . . . A A 21 ALA HB3 . 30876 1 204 . 1 . 1 21 21 ALA CA C 13 52.619 0.000 . . . . . A A 21 ALA CA . 30876 1 205 . 1 . 1 21 21 ALA CB C 13 17.238 0.000 . . . . . A A 21 ALA CB . 30876 1 206 . 1 . 1 21 21 ALA N N 15 121.408 0.000 . . . . . A A 21 ALA N . 30876 1 207 . 1 . 1 22 22 GLU H H 1 7.624 0.000 . . . . . A A 22 GLU H . 30876 1 208 . 1 . 1 22 22 GLU HA H 1 4.443 0.004 . . . . . A A 22 GLU HA . 30876 1 209 . 1 . 1 22 22 GLU HB2 H 1 1.733 0.000 . . . . . A A 22 GLU HB2 . 30876 1 210 . 1 . 1 22 22 GLU HB3 H 1 2.213 0.000 . . . . . A A 22 GLU HB3 . 30876 1 211 . 1 . 1 22 22 GLU HG2 H 1 1.902 0.000 . . . . . A A 22 GLU HG2 . 30876 1 212 . 1 . 1 22 22 GLU HG3 H 1 2.121 0.000 . . . . . A A 22 GLU HG3 . 30876 1 213 . 1 . 1 22 22 GLU CA C 13 54.877 0.000 . . . . . A A 22 GLU CA . 30876 1 214 . 1 . 1 22 22 GLU CB C 13 32.809 0.000 . . . . . A A 22 GLU CB . 30876 1 215 . 1 . 1 22 22 GLU CG C 13 36.750 0.007 . . . . . A A 22 GLU CG . 30876 1 216 . 1 . 1 22 22 GLU N N 15 116.736 0.000 . . . . . A A 22 GLU N . 30876 1 217 . 1 . 1 23 23 ARG H H 1 8.882 0.000 . . . . . A A 23 ARG H . 30876 1 218 . 1 . 1 23 23 ARG HA H 1 4.526 0.000 . . . . . A A 23 ARG HA . 30876 1 219 . 1 . 1 23 23 ARG HB2 H 1 1.531 0.000 . . . . . A A 23 ARG HB2 . 30876 1 220 . 1 . 1 23 23 ARG HB3 H 1 1.531 0.000 . . . . . A A 23 ARG HB3 . 30876 1 221 . 1 . 1 23 23 ARG HG2 H 1 1.342 0.000 . . . . . A A 23 ARG HG2 . 30876 1 222 . 1 . 1 23 23 ARG HG3 H 1 1.393 0.000 . . . . . A A 23 ARG HG3 . 30876 1 223 . 1 . 1 23 23 ARG HD2 H 1 3.020 0.003 . . . . . A A 23 ARG HD2 . 30876 1 224 . 1 . 1 23 23 ARG HD3 H 1 3.020 0.003 . . . . . A A 23 ARG HD3 . 30876 1 225 . 1 . 1 23 23 ARG HE H 1 7.169 0.000 . . . . . A A 23 ARG HE . 30876 1 226 . 1 . 1 23 23 ARG CA C 13 53.419 0.000 . . . . . A A 23 ARG CA . 30876 1 227 . 1 . 1 23 23 ARG CB C 13 32.530 0.000 . . . . . A A 23 ARG CB . 30876 1 228 . 1 . 1 23 23 ARG CG C 13 26.571 0.000 . . . . . A A 23 ARG CG . 30876 1 229 . 1 . 1 23 23 ARG CD C 13 43.125 0.000 . . . . . A A 23 ARG CD . 30876 1 230 . 1 . 1 23 23 ARG N N 15 121.493 0.000 . . . . . A A 23 ARG N . 30876 1 231 . 1 . 1 24 24 GLN H H 1 8.837 0.000 . . . . . A A 24 GLN H . 30876 1 232 . 1 . 1 24 24 GLN HA H 1 4.645 0.000 . . . . . A A 24 GLN HA . 30876 1 233 . 1 . 1 24 24 GLN HB2 H 1 1.949 0.003 . . . . . A A 24 GLN HB2 . 30876 1 234 . 1 . 1 24 24 GLN HB3 H 1 1.949 0.003 . . . . . A A 24 GLN HB3 . 30876 1 235 . 1 . 1 24 24 GLN HG2 H 1 2.299 0.004 . . . . . A A 24 GLN HG2 . 30876 1 236 . 1 . 1 24 24 GLN HG3 H 1 2.447 0.002 . . . . . A A 24 GLN HG3 . 30876 1 237 . 1 . 1 24 24 GLN HE21 H 1 7.115 0.000 . . . . . A A 24 GLN HE21 . 30876 1 238 . 1 . 1 24 24 GLN HE22 H 1 6.753 0.002 . . . . . A A 24 GLN HE22 . 30876 1 239 . 1 . 1 24 24 GLN CB C 13 27.752 0.000 . . . . . A A 24 GLN CB . 30876 1 240 . 1 . 1 24 24 GLN CG C 13 34.597 0.000 . . . . . A A 24 GLN CG . 30876 1 241 . 1 . 1 24 24 GLN N N 15 123.455 0.000 . . . . . A A 24 GLN N . 30876 1 242 . 1 . 1 25 25 ILE H H 1 8.730 0.000 . . . . . A A 25 ILE H . 30876 1 243 . 1 . 1 25 25 ILE HA H 1 4.445 0.000 . . . . . A A 25 ILE HA . 30876 1 244 . 1 . 1 25 25 ILE HB H 1 1.899 0.002 . . . . . A A 25 ILE HB . 30876 1 245 . 1 . 1 25 25 ILE HG12 H 1 0.728 0.000 . . . . . A A 25 ILE HG12 . 30876 1 246 . 1 . 1 25 25 ILE HG13 H 1 1.519 0.000 . . . . . A A 25 ILE HG13 . 30876 1 247 . 1 . 1 25 25 ILE HG21 H 1 0.679 0.000 . . . . . A A 25 ILE HG21 . 30876 1 248 . 1 . 1 25 25 ILE HG22 H 1 0.679 0.000 . . . . . A A 25 ILE HG22 . 30876 1 249 . 1 . 1 25 25 ILE HG23 H 1 0.679 0.000 . . . . . A A 25 ILE HG23 . 30876 1 250 . 1 . 1 25 25 ILE HD11 H 1 0.527 0.000 . . . . . A A 25 ILE HD11 . 30876 1 251 . 1 . 1 25 25 ILE HD12 H 1 0.527 0.000 . . . . . A A 25 ILE HD12 . 30876 1 252 . 1 . 1 25 25 ILE HD13 H 1 0.527 0.000 . . . . . A A 25 ILE HD13 . 30876 1 253 . 1 . 1 25 25 ILE CA C 13 60.709 0.000 . . . . . A A 25 ILE CA . 30876 1 254 . 1 . 1 25 25 ILE CB C 13 38.497 0.000 . . . . . A A 25 ILE CB . 30876 1 255 . 1 . 1 25 25 ILE CG1 C 13 26.557 0.000 . . . . . A A 25 ILE CG1 . 30876 1 256 . 1 . 1 25 25 ILE CG2 C 13 16.831 0.000 . . . . . A A 25 ILE CG2 . 30876 1 257 . 1 . 1 25 25 ILE CD1 C 13 13.472 0.000 . . . . . A A 25 ILE CD1 . 30876 1 258 . 1 . 1 25 25 ILE N N 15 122.595 0.000 . . . . . A A 25 ILE N . 30876 1 259 . 1 . 1 26 26 GLY H H 1 7.586 0.002 . . . . . A A 26 GLY H . 30876 1 260 . 1 . 1 26 26 GLY HA2 H 1 3.979 0.000 . . . . . A A 26 GLY HA2 . 30876 1 261 . 1 . 1 26 26 GLY HA3 H 1 3.884 0.003 . . . . . A A 26 GLY HA3 . 30876 1 262 . 1 . 1 26 26 GLY CA C 13 44.537 0.000 . . . . . A A 26 GLY CA . 30876 1 263 . 1 . 1 26 26 GLY N N 15 108.579 0.000 . . . . . A A 26 GLY N . 30876 1 264 . 1 . 1 27 27 ARG H H 1 8.948 0.000 . . . . . A A 27 ARG H . 30876 1 265 . 1 . 1 27 27 ARG HA H 1 4.546 0.000 . . . . . A A 27 ARG HA . 30876 1 266 . 1 . 1 27 27 ARG HB2 H 1 1.487 0.000 . . . . . A A 27 ARG HB2 . 30876 1 267 . 1 . 1 27 27 ARG HB3 H 1 1.588 0.000 . . . . . A A 27 ARG HB3 . 30876 1 268 . 1 . 1 27 27 ARG HG2 H 1 1.301 0.000 . . . . . A A 27 ARG HG2 . 30876 1 269 . 1 . 1 27 27 ARG HG3 H 1 1.481 0.000 . . . . . A A 27 ARG HG3 . 30876 1 270 . 1 . 1 27 27 ARG HD2 H 1 2.929 0.000 . . . . . A A 27 ARG HD2 . 30876 1 271 . 1 . 1 27 27 ARG HD3 H 1 2.929 0.000 . . . . . A A 27 ARG HD3 . 30876 1 272 . 1 . 1 27 27 ARG HE H 1 6.829 0.000 . . . . . A A 27 ARG HE . 30876 1 273 . 1 . 1 27 27 ARG CA C 13 55.319 0.000 . . . . . A A 27 ARG CA . 30876 1 274 . 1 . 1 27 27 ARG CB C 13 32.047 0.000 . . . . . A A 27 ARG CB . 30876 1 275 . 1 . 1 27 27 ARG CG C 13 26.545 0.000 . . . . . A A 27 ARG CG . 30876 1 276 . 1 . 1 27 27 ARG CD C 13 42.480 0.000 . . . . . A A 27 ARG CD . 30876 1 277 . 1 . 1 27 27 ARG N N 15 121.055 0.000 . . . . . A A 27 ARG N . 30876 1 278 . 1 . 1 28 28 CYS H H 1 8.882 0.000 . . . . . A A 28 CYS H . 30876 1 279 . 1 . 1 28 28 CYS HA H 1 4.227 0.000 . . . . . A A 28 CYS HA . 30876 1 280 . 1 . 1 28 28 CYS HB2 H 1 2.879 0.000 . . . . . A A 28 CYS HB2 . 30876 1 281 . 1 . 1 28 28 CYS HB3 H 1 3.508 0.000 . . . . . A A 28 CYS HB3 . 30876 1 282 . 1 . 1 28 28 CYS CA C 13 58.478 0.000 . . . . . A A 28 CYS CA . 30876 1 283 . 1 . 1 28 28 CYS CB C 13 42.679 0.000 . . . . . A A 28 CYS CB . 30876 1 284 . 1 . 1 28 28 CYS N N 15 118.463 0.000 . . . . . A A 28 CYS N . 30876 1 285 . 1 . 1 29 29 SER H H 1 8.073 0.000 . . . . . A A 29 SER H . 30876 1 286 . 1 . 1 29 29 SER HA H 1 4.395 0.000 . . . . . A A 29 SER HA . 30876 1 287 . 1 . 1 29 29 SER HB2 H 1 3.925 0.003 . . . . . A A 29 SER HB2 . 30876 1 288 . 1 . 1 29 29 SER HB3 H 1 4.010 0.003 . . . . . A A 29 SER HB3 . 30876 1 289 . 1 . 1 29 29 SER CA C 13 57.245 0.000 . . . . . A A 29 SER CA . 30876 1 290 . 1 . 1 29 29 SER CB C 13 64.089 0.000 . . . . . A A 29 SER CB . 30876 1 291 . 1 . 1 29 29 SER N N 15 111.147 0.000 . . . . . A A 29 SER N . 30876 1 292 . 1 . 1 30 30 ALA H H 1 8.825 0.000 . . . . . A A 30 ALA H . 30876 1 293 . 1 . 1 30 30 ALA HA H 1 3.867 0.000 . . . . . A A 30 ALA HA . 30876 1 294 . 1 . 1 30 30 ALA HB1 H 1 0.985 0.000 . . . . . A A 30 ALA HB1 . 30876 1 295 . 1 . 1 30 30 ALA HB2 H 1 0.985 0.000 . . . . . A A 30 ALA HB2 . 30876 1 296 . 1 . 1 30 30 ALA HB3 H 1 0.985 0.000 . . . . . A A 30 ALA HB3 . 30876 1 297 . 1 . 1 30 30 ALA CA C 13 54.817 0.000 . . . . . A A 30 ALA CA . 30876 1 298 . 1 . 1 30 30 ALA CB C 13 17.594 0.000 . . . . . A A 30 ALA CB . 30876 1 299 . 1 . 1 30 30 ALA N N 15 121.795 0.000 . . . . . A A 30 ALA N . 30876 1 300 . 1 . 1 31 31 PHE H H 1 7.815 0.000 . . . . . A A 31 PHE H . 30876 1 301 . 1 . 1 31 31 PHE HA H 1 4.720 0.000 . . . . . A A 31 PHE HA . 30876 1 302 . 1 . 1 31 31 PHE HB2 H 1 2.812 0.000 . . . . . A A 31 PHE HB2 . 30876 1 303 . 1 . 1 31 31 PHE HB3 H 1 3.335 0.000 . . . . . A A 31 PHE HB3 . 30876 1 304 . 1 . 1 31 31 PHE HD1 H 1 7.168 0.000 . . . . . A A 31 PHE HD1 . 30876 1 305 . 1 . 1 31 31 PHE HD2 H 1 7.168 0.000 . . . . . A A 31 PHE HD2 . 30876 1 306 . 1 . 1 31 31 PHE HE1 H 1 7.288 0.000 . . . . . A A 31 PHE HE1 . 30876 1 307 . 1 . 1 31 31 PHE HE2 H 1 7.288 0.000 . . . . . A A 31 PHE HE2 . 30876 1 308 . 1 . 1 31 31 PHE CA C 13 54.983 0.000 . . . . . A A 31 PHE CA . 30876 1 309 . 1 . 1 31 31 PHE CB C 13 39.604 0.000 . . . . . A A 31 PHE CB . 30876 1 310 . 1 . 1 31 31 PHE N N 15 112.434 0.000 . . . . . A A 31 PHE N . 30876 1 311 . 1 . 1 32 32 GLN H H 1 7.142 0.000 . . . . . A A 32 GLN H . 30876 1 312 . 1 . 1 32 32 GLN HA H 1 5.508 0.000 . . . . . A A 32 GLN HA . 30876 1 313 . 1 . 1 32 32 GLN HB2 H 1 1.655 0.000 . . . . . A A 32 GLN HB2 . 30876 1 314 . 1 . 1 32 32 GLN HB3 H 1 1.792 0.000 . . . . . A A 32 GLN HB3 . 30876 1 315 . 1 . 1 32 32 GLN HG2 H 1 1.624 0.000 . . . . . A A 32 GLN HG2 . 30876 1 316 . 1 . 1 32 32 GLN HG3 H 1 1.687 0.000 . . . . . A A 32 GLN HG3 . 30876 1 317 . 1 . 1 32 32 GLN HE21 H 1 6.566 0.000 . . . . . A A 32 GLN HE21 . 30876 1 318 . 1 . 1 32 32 GLN HE22 H 1 6.714 0.000 . . . . . A A 32 GLN HE22 . 30876 1 319 . 1 . 1 32 32 GLN CA C 13 51.767 0.000 . . . . . A A 32 GLN CA . 30876 1 320 . 1 . 1 32 32 GLN CG C 13 33.599 0.000 . . . . . A A 32 GLN CG . 30876 1 321 . 1 . 1 32 32 GLN N N 15 119.873 0.000 . . . . . A A 32 GLN N . 30876 1 322 . 1 . 1 33 33 PRO HA H 1 4.317 0.000 . . . . . A A 33 PRO HA . 30876 1 323 . 1 . 1 33 33 PRO HB2 H 1 1.675 0.000 . . . . . A A 33 PRO HB2 . 30876 1 324 . 1 . 1 33 33 PRO HB3 H 1 2.092 0.000 . . . . . A A 33 PRO HB3 . 30876 1 325 . 1 . 1 33 33 PRO HG2 H 1 1.587 0.000 . . . . . A A 33 PRO HG2 . 30876 1 326 . 1 . 1 33 33 PRO HG3 H 1 1.587 0.000 . . . . . A A 33 PRO HG3 . 30876 1 327 . 1 . 1 33 33 PRO HD2 H 1 3.117 0.000 . . . . . A A 33 PRO HD2 . 30876 1 328 . 1 . 1 33 33 PRO HD3 H 1 4.231 0.000 . . . . . A A 33 PRO HD3 . 30876 1 329 . 1 . 1 33 33 PRO CA C 13 62.724 0.000 . . . . . A A 33 PRO CA . 30876 1 330 . 1 . 1 33 33 PRO CB C 13 31.785 0.000 . . . . . A A 33 PRO CB . 30876 1 331 . 1 . 1 33 33 PRO CG C 13 27.321 0.000 . . . . . A A 33 PRO CG . 30876 1 332 . 1 . 1 33 33 PRO CD C 13 50.374 0.000 . . . . . A A 33 PRO CD . 30876 1 333 . 1 . 1 34 34 CYS H H 1 7.882 0.000 . . . . . A A 34 CYS H . 30876 1 334 . 1 . 1 34 34 CYS HA H 1 4.720 0.001 . . . . . A A 34 CYS HA . 30876 1 335 . 1 . 1 34 34 CYS HB2 H 1 2.115 0.012 . . . . . A A 34 CYS HB2 . 30876 1 336 . 1 . 1 34 34 CYS HB3 H 1 2.476 0.002 . . . . . A A 34 CYS HB3 . 30876 1 337 . 1 . 1 34 34 CYS CA C 13 56.220 0.000 . . . . . A A 34 CYS CA . 30876 1 338 . 1 . 1 34 34 CYS CB C 13 38.358 0.039 . . . . . A A 34 CYS CB . 30876 1 339 . 1 . 1 34 34 CYS N N 15 117.970 0.000 . . . . . A A 34 CYS N . 30876 1 340 . 1 . 1 35 35 CYS H H 1 9.017 0.000 . . . . . A A 35 CYS H . 30876 1 341 . 1 . 1 35 35 CYS HA H 1 5.336 0.000 . . . . . A A 35 CYS HA . 30876 1 342 . 1 . 1 35 35 CYS HB2 H 1 2.658 0.000 . . . . . A A 35 CYS HB2 . 30876 1 343 . 1 . 1 35 35 CYS HB3 H 1 2.885 0.000 . . . . . A A 35 CYS HB3 . 30876 1 344 . 1 . 1 35 35 CYS CA C 13 53.993 0.000 . . . . . A A 35 CYS CA . 30876 1 345 . 1 . 1 35 35 CYS CB C 13 43.938 0.010 . . . . . A A 35 CYS CB . 30876 1 346 . 1 . 1 35 35 CYS N N 15 129.405 0.000 . . . . . A A 35 CYS N . 30876 1 347 . 1 . 1 36 36 GLY H H 1 9.430 0.000 . . . . . A A 36 GLY H . 30876 1 348 . 1 . 1 36 36 GLY HA2 H 1 4.502 0.000 . . . . . A A 36 GLY HA2 . 30876 1 349 . 1 . 1 36 36 GLY HA3 H 1 3.705 0.000 . . . . . A A 36 GLY HA3 . 30876 1 350 . 1 . 1 36 36 GLY CA C 13 44.379 0.000 . . . . . A A 36 GLY CA . 30876 1 351 . 1 . 1 36 36 GLY N N 15 112.777 0.000 . . . . . A A 36 GLY N . 30876 1 352 . 1 . 1 37 37 ARG H H 1 8.189 0.000 . . . . . A A 37 ARG H . 30876 1 353 . 1 . 1 37 37 ARG HA H 1 4.258 0.000 . . . . . A A 37 ARG HA . 30876 1 354 . 1 . 1 37 37 ARG HB2 H 1 1.625 0.000 . . . . . A A 37 ARG HB2 . 30876 1 355 . 1 . 1 37 37 ARG HB3 H 1 1.768 0.000 . . . . . A A 37 ARG HB3 . 30876 1 356 . 1 . 1 37 37 ARG HG2 H 1 1.577 0.000 . . . . . A A 37 ARG HG2 . 30876 1 357 . 1 . 1 37 37 ARG HG3 H 1 1.577 0.000 . . . . . A A 37 ARG HG3 . 30876 1 358 . 1 . 1 37 37 ARG HD2 H 1 3.111 0.000 . . . . . A A 37 ARG HD2 . 30876 1 359 . 1 . 1 37 37 ARG HD3 H 1 3.111 0.000 . . . . . A A 37 ARG HD3 . 30876 1 360 . 1 . 1 37 37 ARG HE H 1 7.144 0.000 . . . . . A A 37 ARG HE . 30876 1 361 . 1 . 1 37 37 ARG CA C 13 55.431 0.000 . . . . . A A 37 ARG CA . 30876 1 362 . 1 . 1 37 37 ARG CB C 13 31.153 0.002 . . . . . A A 37 ARG CB . 30876 1 363 . 1 . 1 37 37 ARG CG C 13 26.487 0.000 . . . . . A A 37 ARG CG . 30876 1 364 . 1 . 1 37 37 ARG CD C 13 42.989 0.000 . . . . . A A 37 ARG CD . 30876 1 stop_ save_