################################### # 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 25238 _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 $chemical_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 3 '2D 1H-1H NOESY' . . . 25238 1 6 '2D 1H-13C HSQC' . . . 25238 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 HA H 1 4.334 0.01 . . . . . B 1 ASP HA . 25238 1 2 . 1 1 1 1 ASP HB2 H 1 2.808 0.01 . . . . . B 1 ASP HB2 . 25238 1 3 . 1 1 1 1 ASP HB3 H 1 2.871 0.01 . . . . . B 1 ASP HB3 . 25238 1 4 . 1 1 1 1 ASP CA C 13 52.822 0.1 . . . . . B 1 ASP CA . 25238 1 5 . 1 1 2 2 SER H H 1 8.842 0.01 . . . . . B 2 SER H . 25238 1 6 . 1 1 2 2 SER HA H 1 4.607 0.01 . . . . . B 2 SER HA . 25238 1 7 . 1 1 2 2 SER HB2 H 1 3.759 0.01 . . . . . B 2 SER HB2 . 25238 1 8 . 1 1 2 2 SER HB3 H 1 3.929 0.01 . . . . . B 2 SER HB3 . 25238 1 9 . 1 1 2 2 SER CA C 13 57.930 0.1 . . . . . B 2 SER CA . 25238 1 10 . 1 1 2 2 SER CB C 13 63.461 0.1 . . . . . B 2 SER CB . 25238 1 11 . 1 1 3 3 TRP H H 1 8.366 0.01 . . . . . B 3 TRP H . 25238 1 12 . 1 1 3 3 TRP HA H 1 4.430 0.01 . . . . . B 3 TRP HA . 25238 1 13 . 1 1 3 3 TRP HB2 H 1 3.297 0.01 . . . . . B 3 TRP HB2 . 25238 1 14 . 1 1 3 3 TRP HB3 H 1 3.420 0.01 . . . . . B 3 TRP HB3 . 25238 1 15 . 1 1 3 3 TRP HD1 H 1 7.473 0.01 . . . . . B 3 TRP HD1 . 25238 1 16 . 1 1 3 3 TRP HE1 H 1 10.314 0.01 . . . . . B 3 TRP HE1 . 25238 1 17 . 1 1 3 3 TRP HE3 H 1 7.372 0.01 . . . . . B 3 TRP HE3 . 25238 1 18 . 1 1 3 3 TRP HZ2 H 1 7.491 0.01 . . . . . B 3 TRP HZ2 . 25238 1 19 . 1 1 3 3 TRP HH2 H 1 7.158 0.01 . . . . . B 3 TRP HH2 . 25238 1 20 . 1 1 3 3 TRP CA C 13 58.797 0.1 . . . . . B 3 TRP CA . 25238 1 21 . 1 1 3 3 TRP CB C 13 28.185 0.1 . . . . . B 3 TRP CB . 25238 1 22 . 1 1 5 5 GLU H H 1 7.520 0.01 . . . . . B 5 GLU H . 25238 1 23 . 1 1 5 5 GLU HA H 1 4.348 0.01 . . . . . B 5 GLU HA . 25238 1 24 . 1 1 5 5 GLU HB2 H 1 1.961 0.01 . . . . . B 5 GLU HB2 . 25238 1 25 . 1 1 5 5 GLU HB3 H 1 2.309 0.01 . . . . . B 5 GLU HB3 . 25238 1 26 . 1 1 5 5 GLU HG2 H 1 2.380 0.01 . . . . . B 5 GLU HG2 . 25238 1 27 . 1 1 5 5 GLU HG3 H 1 2.380 0.01 . . . . . B 5 GLU HG3 . 25238 1 28 . 1 1 5 5 GLU CA C 13 55.284 0.1 . . . . . B 5 GLU CA . 25238 1 29 . 1 1 6 6 GLU H H 1 7.449 0.01 . . . . . B 6 GLU H . 25238 1 30 . 1 1 6 6 GLU HA H 1 4.151 0.01 . . . . . B 6 GLU HA . 25238 1 31 . 1 1 6 6 GLU HB2 H 1 2.045 0.01 . . . . . B 6 GLU HB2 . 25238 1 32 . 1 1 6 6 GLU HB3 H 1 2.117 0.01 . . . . . B 6 GLU HB3 . 25238 1 33 . 1 1 6 6 GLU HG2 H 1 2.494 0.01 . . . . . B 6 GLU HG2 . 25238 1 34 . 1 1 6 6 GLU HG3 H 1 2.662 0.01 . . . . . B 6 GLU HG3 . 25238 1 35 . 1 1 6 6 GLU CA C 13 56.333 0.1 . . . . . B 6 GLU CA . 25238 1 36 . 1 1 7 7 VAL H H 1 8.435 0.01 . . . . . B 7 VAL H . 25238 1 37 . 1 1 7 7 VAL HA H 1 4.214 0.01 . . . . . B 7 VAL HA . 25238 1 38 . 1 1 7 7 VAL HB H 1 1.888 0.01 . . . . . B 7 VAL HB . 25238 1 39 . 1 1 7 7 VAL HG11 H 1 0.917 0.01 . . . . . B 7 VAL HG11 . 25238 1 40 . 1 1 7 7 VAL HG12 H 1 0.917 0.01 . . . . . B 7 VAL HG12 . 25238 1 41 . 1 1 7 7 VAL HG13 H 1 0.917 0.01 . . . . . B 7 VAL HG13 . 25238 1 42 . 1 1 7 7 VAL HG21 H 1 0.786 0.01 . . . . . B 7 VAL HG21 . 25238 1 43 . 1 1 7 7 VAL HG22 H 1 0.786 0.01 . . . . . B 7 VAL HG22 . 25238 1 44 . 1 1 7 7 VAL HG23 H 1 0.786 0.01 . . . . . B 7 VAL HG23 . 25238 1 45 . 1 1 7 7 VAL CA C 13 61.977 0.1 . . . . . B 7 VAL CA . 25238 1 46 . 1 1 8 8 ILE H H 1 9.040 0.01 . . . . . B 8 ILE H . 25238 1 47 . 1 1 8 8 ILE HA H 1 4.535 0.01 . . . . . B 8 ILE HA . 25238 1 48 . 1 1 8 8 ILE HB H 1 1.794 0.01 . . . . . B 8 ILE HB . 25238 1 49 . 1 1 8 8 ILE HG21 H 1 0.812 0.01 . . . . . B 8 ILE HG21 . 25238 1 50 . 1 1 8 8 ILE HG22 H 1 0.812 0.01 . . . . . B 8 ILE HG22 . 25238 1 51 . 1 1 8 8 ILE HG23 H 1 0.812 0.01 . . . . . B 8 ILE HG23 . 25238 1 52 . 1 1 8 8 ILE HD11 H 1 0.740 0.01 . . . . . B 8 ILE HD11 . 25238 1 53 . 1 1 8 8 ILE HD12 H 1 0.740 0.01 . . . . . B 8 ILE HD12 . 25238 1 54 . 1 1 8 8 ILE HD13 H 1 0.740 0.01 . . . . . B 8 ILE HD13 . 25238 1 55 . 1 1 8 8 ILE CA C 13 58.671 0.1 . . . . . B 8 ILE CA . 25238 1 56 . 1 1 8 8 ILE CB C 13 41.003 0.1 . . . . . B 8 ILE CB . 25238 1 57 . 1 1 8 8 ILE CG2 C 13 14.768 0.1 . . . . . B 8 ILE CG2 . 25238 1 58 . 1 1 8 8 ILE CD1 C 13 14.05 0.1 . . . . . B 8 ILE CD1 . 25238 1 59 . 1 1 9 9 LYS H H 1 8.365 0.01 . . . . . B 9 LYS H . 25238 1 60 . 1 1 9 9 LYS HA H 1 5.350 0.01 . . . . . B 9 LYS HA . 25238 1 61 . 1 1 9 9 LYS HB2 H 1 1.395 0.01 . . . . . B 9 LYS HB2 . 25238 1 62 . 1 1 9 9 LYS HB3 H 1 1.811 0.01 . . . . . B 9 LYS HB3 . 25238 1 63 . 1 1 9 9 LYS HG2 H 1 1.105 0.01 . . . . . B 9 LYS HG2 . 25238 1 64 . 1 1 9 9 LYS HG3 H 1 1.260 0.01 . . . . . B 9 LYS HG3 . 25238 1 65 . 1 1 9 9 LYS HD2 H 1 1.514 0.01 . . . . . B 9 LYS HD2 . 25238 1 66 . 1 1 9 9 LYS HD3 H 1 1.514 0.01 . . . . . B 9 LYS HD3 . 25238 1 67 . 1 1 9 9 LYS HE2 H 1 2.786 0.01 . . . . . B 9 LYS HE2 . 25238 1 68 . 1 1 9 9 LYS HE3 H 1 2.786 0.01 . . . . . B 9 LYS HE3 . 25238 1 69 . 1 1 9 9 LYS HZ1 H 1 7.519 0.01 . . . . . B 9 LYS HZ1 . 25238 1 70 . 1 1 9 9 LYS HZ2 H 1 7.519 0.01 . . . . . B 9 LYS HZ2 . 25238 1 71 . 1 1 9 9 LYS HZ3 H 1 7.519 0.01 . . . . . B 9 LYS HZ3 . 25238 1 72 . 1 1 9 9 LYS CA C 13 55.154 0.1 . . . . . B 9 LYS CA . 25238 1 73 . 1 1 9 9 LYS CB C 13 33.725 0.1 . . . . . B 9 LYS CB . 25238 1 74 . 1 1 9 9 LYS CG C 13 24.848 0.1 . . . . . B 9 LYS CG . 25238 1 75 . 1 1 9 9 LYS CE C 13 41.841 0.1 . . . . . B 9 LYS CE . 25238 1 76 . 1 1 10 10 LEU H H 1 7.034 0.01 . . . . . B 10 LEU H . 25238 1 77 . 1 1 10 10 LEU HA H 1 4.714 0.01 . . . . . B 10 LEU HA . 25238 1 78 . 1 1 10 10 LEU HB2 H 1 1.085 0.01 . . . . . B 10 LEU HB2 . 25238 1 79 . 1 1 10 10 LEU HB3 H 1 1.331 0.01 . . . . . B 10 LEU HB3 . 25238 1 80 . 1 1 10 10 LEU HG H 1 1.481 0.01 . . . . . B 10 LEU HG . 25238 1 81 . 1 1 10 10 LEU HD11 H 1 0.992 0.01 . . . . . B 10 LEU HD11 . 25238 1 82 . 1 1 10 10 LEU HD12 H 1 0.992 0.01 . . . . . B 10 LEU HD12 . 25238 1 83 . 1 1 10 10 LEU HD13 H 1 0.992 0.01 . . . . . B 10 LEU HD13 . 25238 1 84 . 1 1 10 10 LEU HD21 H 1 0.809 0.01 . . . . . B 10 LEU HD21 . 25238 1 85 . 1 1 10 10 LEU HD22 H 1 0.809 0.01 . . . . . B 10 LEU HD22 . 25238 1 86 . 1 1 10 10 LEU HD23 H 1 0.809 0.01 . . . . . B 10 LEU HD23 . 25238 1 87 . 1 1 10 10 LEU CA C 13 53.229 0.1 . . . . . B 10 LEU CA . 25238 1 88 . 1 1 10 10 LEU CB C 13 48.544 0.1 . . . . . B 10 LEU CB . 25238 1 89 . 1 1 11 11 CYS H H 1 8.377 0.01 . . . . . B 11 CYS H . 25238 1 90 . 1 1 11 11 CYS HA H 1 4.966 0.01 . . . . . B 11 CYS HA . 25238 1 91 . 1 1 11 11 CYS HB2 H 1 2.977 0.01 . . . . . B 11 CYS HB2 . 25238 1 92 . 1 1 11 11 CYS HB3 H 1 3.203 0.01 . . . . . B 11 CYS HB3 . 25238 1 93 . 1 1 11 11 CYS CA C 13 54.937 0.1 . . . . . B 11 CYS CA . 25238 1 94 . 1 1 11 11 CYS CB C 13 49.359 0.1 . . . . . B 11 CYS CB . 25238 1 95 . 1 1 12 12 GLY H H 1 8.738 0.01 . . . . . B 12 GLY H . 25238 1 96 . 1 1 12 12 GLY HA2 H 1 4.122 0.01 . . . . . B 12 GLY HA2 . 25238 1 97 . 1 1 12 12 GLY HA3 H 1 3.899 0.01 . . . . . B 12 GLY HA3 . 25238 1 98 . 1 1 12 12 GLY CA C 13 45.806 0.1 . . . . . B 12 GLY CA . 25238 1 99 . 1 1 13 13 ARG H H 1 9.178 0.01 . . . . . B 13 ARG H . 25238 1 100 . 1 1 13 13 ARG HA H 1 4.040 0.01 . . . . . B 13 ARG HA . 25238 1 101 . 1 1 13 13 ARG HB2 H 1 1.924 0.01 . . . . . B 13 ARG HB2 . 25238 1 102 . 1 1 13 13 ARG HB3 H 1 1.924 0.01 . . . . . B 13 ARG HB3 . 25238 1 103 . 1 1 13 13 ARG HG2 H 1 1.757 0.01 . . . . . B 13 ARG HG2 . 25238 1 104 . 1 1 13 13 ARG HG3 H 1 1.757 0.01 . . . . . B 13 ARG HG3 . 25238 1 105 . 1 1 13 13 ARG HD2 H 1 3.233 0.01 . . . . . B 13 ARG HD2 . 25238 1 106 . 1 1 13 13 ARG HD3 H 1 3.233 0.01 . . . . . B 13 ARG HD3 . 25238 1 107 . 1 1 13 13 ARG HE H 1 7.270 0.01 . . . . . B 13 ARG HE . 25238 1 108 . 1 1 13 13 ARG CA C 13 58.438 0.1 . . . . . B 13 ARG CA . 25238 1 109 . 1 1 14 14 GLU H H 1 8.202 0.01 . . . . . B 14 GLU H . 25238 1 110 . 1 1 14 14 GLU HA H 1 4.115 0.01 . . . . . B 14 GLU HA . 25238 1 111 . 1 1 14 14 GLU HB2 H 1 2.159 0.01 . . . . . B 14 GLU HB2 . 25238 1 112 . 1 1 14 14 GLU HB3 H 1 2.357 0.01 . . . . . B 14 GLU HB3 . 25238 1 113 . 1 1 14 14 GLU HG2 H 1 2.517 0.01 . . . . . B 14 GLU HG2 . 25238 1 114 . 1 1 14 14 GLU HG3 H 1 2.561 0.01 . . . . . B 14 GLU HG3 . 25238 1 115 . 1 1 14 14 GLU CA C 13 58.998 0.1 . . . . . B 14 GLU CA . 25238 1 116 . 1 1 15 15 LEU H H 1 7.043 0.01 . . . . . B 15 LEU H . 25238 1 117 . 1 1 15 15 LEU HA H 1 3.965 0.01 . . . . . B 15 LEU HA . 25238 1 118 . 1 1 15 15 LEU HB2 H 1 0.930 0.01 . . . . . B 15 LEU HB2 . 25238 1 119 . 1 1 15 15 LEU HB3 H 1 1.900 0.01 . . . . . B 15 LEU HB3 . 25238 1 120 . 1 1 15 15 LEU HG H 1 1.595 0.01 . . . . . B 15 LEU HG . 25238 1 121 . 1 1 15 15 LEU HD11 H 1 0.927 0.01 . . . . . B 15 LEU HD11 . 25238 1 122 . 1 1 15 15 LEU HD12 H 1 0.927 0.01 . . . . . B 15 LEU HD12 . 25238 1 123 . 1 1 15 15 LEU HD13 H 1 0.927 0.01 . . . . . B 15 LEU HD13 . 25238 1 124 . 1 1 15 15 LEU HD21 H 1 0.878 0.01 . . . . . B 15 LEU HD21 . 25238 1 125 . 1 1 15 15 LEU HD22 H 1 0.878 0.01 . . . . . B 15 LEU HD22 . 25238 1 126 . 1 1 15 15 LEU HD23 H 1 0.878 0.01 . . . . . B 15 LEU HD23 . 25238 1 127 . 1 1 15 15 LEU CA C 13 57.164 0.1 . . . . . B 15 LEU CA . 25238 1 128 . 1 1 15 15 LEU CB C 13 40.062 0.1 . . . . . B 15 LEU CB . 25238 1 129 . 1 1 15 15 LEU CD2 C 13 18.899 0.1 . . . . . B 15 LEU CD2 . 25238 1 130 . 1 1 16 16 VAL H H 1 7.377 0.01 . . . . . B 16 VAL H . 25238 1 131 . 1 1 16 16 VAL HA H 1 3.685 0.01 . . . . . B 16 VAL HA . 25238 1 132 . 1 1 16 16 VAL HB H 1 2.135 0.01 . . . . . B 16 VAL HB . 25238 1 133 . 1 1 16 16 VAL HG11 H 1 1.039 0.01 . . . . . B 16 VAL HG11 . 25238 1 134 . 1 1 16 16 VAL HG12 H 1 1.039 0.01 . . . . . B 16 VAL HG12 . 25238 1 135 . 1 1 16 16 VAL HG13 H 1 1.039 0.01 . . . . . B 16 VAL HG13 . 25238 1 136 . 1 1 16 16 VAL HG21 H 1 0.963 0.01 . . . . . B 16 VAL HG21 . 25238 1 137 . 1 1 16 16 VAL HG22 H 1 0.963 0.01 . . . . . B 16 VAL HG22 . 25238 1 138 . 1 1 16 16 VAL HG23 H 1 0.963 0.01 . . . . . B 16 VAL HG23 . 25238 1 139 . 1 1 16 16 VAL CA C 13 58.028 0.1 . . . . . B 16 VAL CA . 25238 1 140 . 1 1 17 17 ARG H H 1 7.820 0.01 . . . . . B 17 ARG H . 25238 1 141 . 1 1 17 17 ARG HA H 1 3.954 0.01 . . . . . B 17 ARG HA . 25238 1 142 . 1 1 17 17 ARG HB2 H 1 1.853 0.01 . . . . . B 17 ARG HB2 . 25238 1 143 . 1 1 17 17 ARG HB3 H 1 1.906 0.01 . . . . . B 17 ARG HB3 . 25238 1 144 . 1 1 17 17 ARG HG2 H 1 1.515 0.01 . . . . . B 17 ARG HG2 . 25238 1 145 . 1 1 17 17 ARG HG3 H 1 1.515 0.01 . . . . . B 17 ARG HG3 . 25238 1 146 . 1 1 17 17 ARG HD2 H 1 3.209 0.01 . . . . . B 17 ARG HD2 . 25238 1 147 . 1 1 17 17 ARG HD3 H 1 3.209 0.01 . . . . . B 17 ARG HD3 . 25238 1 148 . 1 1 17 17 ARG HE H 1 7.344 0.01 . . . . . B 17 ARG HE . 25238 1 149 . 1 1 17 17 ARG CA C 13 59.304 0.1 . . . . . B 17 ARG CA . 25238 1 150 . 1 1 18 18 ALA H H 1 7.729 0.01 . . . . . B 18 ALA H . 25238 1 151 . 1 1 18 18 ALA HA H 1 4.168 0.01 . . . . . B 18 ALA HA . 25238 1 152 . 1 1 18 18 ALA HB1 H 1 1.430 0.01 . . . . . B 18 ALA HB1 . 25238 1 153 . 1 1 18 18 ALA HB2 H 1 1.430 0.01 . . . . . B 18 ALA HB2 . 25238 1 154 . 1 1 18 18 ALA HB3 H 1 1.430 0.01 . . . . . B 18 ALA HB3 . 25238 1 155 . 1 1 18 18 ALA CA C 13 54.742 0.1 . . . . . B 18 ALA CA . 25238 1 156 . 1 1 18 18 ALA CB C 13 17.994 0.1 . . . . . B 18 ALA CB . 25238 1 157 . 1 1 19 19 GLN H H 1 8.617 0.01 . . . . . B 19 GLN H . 25238 1 158 . 1 1 19 19 GLN HA H 1 3.848 0.01 . . . . . B 19 GLN HA . 25238 1 159 . 1 1 19 19 GLN HB2 H 1 2.144 0.01 . . . . . B 19 GLN HB2 . 25238 1 160 . 1 1 19 19 GLN HB3 H 1 2.401 0.01 . . . . . B 19 GLN HB3 . 25238 1 161 . 1 1 19 19 GLN HG2 H 1 2.232 0.01 . . . . . B 19 GLN HG2 . 25238 1 162 . 1 1 19 19 GLN HG3 H 1 2.232 0.01 . . . . . B 19 GLN HG3 . 25238 1 163 . 1 1 19 19 GLN HE21 H 1 6.666 0.01 . . . . . B 19 GLN HE21 . 25238 1 164 . 1 1 19 19 GLN HE22 H 1 6.588 0.01 . . . . . B 19 GLN HE22 . 25238 1 165 . 1 1 19 19 GLN CA C 13 59.171 0.1 . . . . . B 19 GLN CA . 25238 1 166 . 1 1 20 20 ILE H H 1 8.079 0.01 . . . . . B 20 ILE H . 25238 1 167 . 1 1 20 20 ILE HA H 1 3.639 0.01 . . . . . B 20 ILE HA . 25238 1 168 . 1 1 20 20 ILE HB H 1 1.865 0.01 . . . . . B 20 ILE HB . 25238 1 169 . 1 1 20 20 ILE HG12 H 1 1.794 0.01 . . . . . B 20 ILE HG12 . 25238 1 170 . 1 1 20 20 ILE HG13 H 1 1.794 0.01 . . . . . B 20 ILE HG13 . 25238 1 171 . 1 1 20 20 ILE HG21 H 1 1.103 0.01 . . . . . B 20 ILE HG21 . 25238 1 172 . 1 1 20 20 ILE HG22 H 1 1.103 0.01 . . . . . B 20 ILE HG22 . 25238 1 173 . 1 1 20 20 ILE HG23 H 1 1.103 0.01 . . . . . B 20 ILE HG23 . 25238 1 174 . 1 1 20 20 ILE HD11 H 1 0.907 0.01 . . . . . B 20 ILE HD11 . 25238 1 175 . 1 1 20 20 ILE HD12 H 1 0.907 0.01 . . . . . B 20 ILE HD12 . 25238 1 176 . 1 1 20 20 ILE HD13 H 1 0.907 0.01 . . . . . B 20 ILE HD13 . 25238 1 177 . 1 1 20 20 ILE CA C 13 64.962 0.1 . . . . . B 20 ILE CA . 25238 1 178 . 1 1 20 20 ILE CB C 13 38.269 0.1 . . . . . B 20 ILE CB . 25238 1 179 . 1 1 21 21 ALA H H 1 7.630 0.01 . . . . . B 21 ALA H . 25238 1 180 . 1 1 21 21 ALA HA H 1 4.147 0.01 . . . . . B 21 ALA HA . 25238 1 181 . 1 1 21 21 ALA HB1 H 1 1.505 0.01 . . . . . B 21 ALA HB1 . 25238 1 182 . 1 1 21 21 ALA HB2 H 1 1.505 0.01 . . . . . B 21 ALA HB2 . 25238 1 183 . 1 1 21 21 ALA HB3 H 1 1.505 0.01 . . . . . B 21 ALA HB3 . 25238 1 184 . 1 1 21 21 ALA CA C 13 54.742 0.1 . . . . . B 21 ALA CA . 25238 1 185 . 1 1 21 21 ALA CB C 13 17.824 0.1 . . . . . B 21 ALA CB . 25238 1 186 . 1 1 22 22 ILE H H 1 8.356 0.01 . . . . . B 22 ILE H . 25238 1 187 . 1 1 22 22 ILE HA H 1 3.716 0.01 . . . . . B 22 ILE HA . 25238 1 188 . 1 1 22 22 ILE HB H 1 2.005 0.01 . . . . . B 22 ILE HB . 25238 1 189 . 1 1 22 22 ILE HG12 H 1 2.008 0.01 . . . . . B 22 ILE HG12 . 25238 1 190 . 1 1 22 22 ILE HG13 H 1 2.008 0.01 . . . . . B 22 ILE HG13 . 25238 1 191 . 1 1 22 22 ILE HG21 H 1 1.265 0.01 . . . . . B 22 ILE HG21 . 25238 1 192 . 1 1 22 22 ILE HG22 H 1 1.265 0.01 . . . . . B 22 ILE HG22 . 25238 1 193 . 1 1 22 22 ILE HG23 H 1 1.265 0.01 . . . . . B 22 ILE HG23 . 25238 1 194 . 1 1 22 22 ILE HD11 H 1 0.987 0.01 . . . . . B 22 ILE HD11 . 25238 1 195 . 1 1 22 22 ILE HD12 H 1 0.987 0.01 . . . . . B 22 ILE HD12 . 25238 1 196 . 1 1 22 22 ILE HD13 H 1 0.987 0.01 . . . . . B 22 ILE HD13 . 25238 1 197 . 1 1 22 22 ILE CA C 13 64.769 0.1 . . . . . B 22 ILE CA . 25238 1 198 . 1 1 22 22 ILE CB C 13 38.571 0.1 . . . . . B 22 ILE CB . 25238 1 199 . 1 1 23 23 CYS H H 1 8.501 0.01 . . . . . B 23 CYS H . 25238 1 200 . 1 1 23 23 CYS HA H 1 4.850 0.01 . . . . . B 23 CYS HA . 25238 1 201 . 1 1 23 23 CYS HB2 H 1 2.924 0.01 . . . . . B 23 CYS HB2 . 25238 1 202 . 1 1 23 23 CYS HB3 H 1 3.382 0.01 . . . . . B 23 CYS HB3 . 25238 1 203 . 1 1 23 23 CYS CA C 13 54.909 0.1 . . . . . B 23 CYS CA . 25238 1 204 . 1 1 24 24 GLY H H 1 8.088 0.01 . . . . . B 24 GLY H . 25238 1 205 . 1 1 24 24 GLY HA2 H 1 3.961 0.01 . . . . . B 24 GLY HA2 . 25238 1 206 . 1 1 24 24 GLY HA3 H 1 3.822 0.01 . . . . . B 24 GLY HA3 . 25238 1 207 . 1 1 24 24 GLY CA C 13 46.825 0.1 . . . . . B 24 GLY CA . 25238 1 208 . 1 1 25 25 MET H H 1 7.712 0.01 . . . . . B 25 MET H . 25238 1 209 . 1 1 25 25 MET HA H 1 4.403 0.01 . . . . . B 25 MET HA . 25238 1 210 . 1 1 25 25 MET HB2 H 1 2.416 0.01 . . . . . B 25 MET HB2 . 25238 1 211 . 1 1 25 25 MET HB3 H 1 2.416 0.01 . . . . . B 25 MET HB3 . 25238 1 212 . 1 1 25 25 MET HG2 H 1 1.984 0.01 . . . . . B 25 MET HG2 . 25238 1 213 . 1 1 25 25 MET HG3 H 1 1.984 0.01 . . . . . B 25 MET HG3 . 25238 1 214 . 1 1 25 25 MET CA C 13 55.772 0.1 . . . . . B 25 MET CA . 25238 1 215 . 1 1 26 26 SER H H 1 8.217 0.01 . . . . . B 26 SER H . 25238 1 216 . 1 1 26 26 SER HA H 1 4.478 0.01 . . . . . B 26 SER HA . 25238 1 217 . 1 1 26 26 SER HB2 H 1 3.791 0.01 . . . . . B 26 SER HB2 . 25238 1 218 . 1 1 26 26 SER HB3 H 1 3.845 0.01 . . . . . B 26 SER HB3 . 25238 1 219 . 1 1 26 26 SER CA C 13 58.797 0.1 . . . . . B 26 SER CA . 25238 1 220 . 1 1 26 26 SER CB C 13 63.511 0.1 . . . . . B 26 SER CB . 25238 1 221 . 1 1 27 27 THR H H 1 7.935 0.01 . . . . . B 27 THR H . 25238 1 222 . 1 1 27 27 THR HA H 1 4.324 0.01 . . . . . B 27 THR HA . 25238 1 223 . 1 1 27 27 THR HB H 1 4.174 0.01 . . . . . B 27 THR HB . 25238 1 224 . 1 1 27 27 THR HG21 H 1 1.133 0.01 . . . . . B 27 THR HG21 . 25238 1 225 . 1 1 27 27 THR HG22 H 1 1.133 0.01 . . . . . B 27 THR HG22 . 25238 1 226 . 1 1 27 27 THR HG23 H 1 1.133 0.01 . . . . . B 27 THR HG23 . 25238 1 227 . 1 1 27 27 THR CA C 13 61.945 0.1 . . . . . B 27 THR CA . 25238 1 228 . 1 1 27 27 THR CB C 13 69.47 0.1 . . . . . B 27 THR CB . 25238 1 229 . 1 1 27 27 THR CG2 C 13 21.262 0.1 . . . . . B 27 THR CG2 . 25238 1 230 . 1 1 28 28 TRP H H 1 8.098 0.01 . . . . . B 28 TRP H . 25238 1 231 . 1 1 28 28 TRP HA H 1 4.738 0.01 . . . . . B 28 TRP HA . 25238 1 232 . 1 1 28 28 TRP HB2 H 1 3.208 0.01 . . . . . B 28 TRP HB2 . 25238 1 233 . 1 1 28 28 TRP HB3 H 1 3.308 0.01 . . . . . B 28 TRP HB3 . 25238 1 234 . 1 1 28 28 TRP HD1 H 1 7.289 0.01 . . . . . B 28 TRP HD1 . 25238 1 235 . 1 1 28 28 TRP HE1 H 1 10.108 0.01 . . . . . B 28 TRP HE1 . 25238 1 236 . 1 1 28 28 TRP HE3 H 1 7.619 0.01 . . . . . B 28 TRP HE3 . 25238 1 237 . 1 1 28 28 TRP HZ2 H 1 7.337 0.01 . . . . . B 28 TRP HZ2 . 25238 1 238 . 1 1 28 28 TRP HH2 H 1 7.059 0.01 . . . . . B 28 TRP HH2 . 25238 1 239 . 1 1 28 28 TRP CA C 13 57.327 0.1 . . . . . B 28 TRP CA . 25238 1 240 . 1 1 28 28 TRP CB C 13 29.432 0.1 . . . . . B 28 TRP CB . 25238 1 241 . 1 1 29 29 SER H H 1 7.991 0.01 . . . . . B 29 SER H . 25238 1 242 . 1 1 29 29 SER HA H 1 4.293 0.01 . . . . . B 29 SER HA . 25238 1 243 . 1 1 29 29 SER HB2 H 1 3.751 0.01 . . . . . B 29 SER HB2 . 25238 1 244 . 1 1 29 29 SER HB3 H 1 3.652 0.01 . . . . . B 29 SER HB3 . 25238 1 245 . 1 1 29 29 SER CA C 13 57.817 0.1 . . . . . B 29 SER CA . 25238 1 246 . 1 1 29 29 SER CB C 13 63.644 0.1 . . . . . B 29 SER CB . 25238 1 247 . 2 2 1 1 PCA CA C 13 59.309 0.1 . . . . . A 1 PCA CA . 25238 1 248 . 2 2 1 1 PCA HA H 1 4.447 0.01 . . . . . A 1 PCA HA . 25238 1 249 . 2 2 1 1 PCA CB C 13 31.558 0.1 . . . . . A 1 PCA CB . 25238 1 250 . 2 2 1 1 PCA HB2 H 1 2.404 0.01 . . . . . A 1 PCA HB2 . 25238 1 251 . 2 2 1 1 PCA HB3 H 1 2.121 0.01 . . . . . A 1 PCA HB3 . 25238 1 252 . 2 2 1 1 PCA CG C 13 27.817 0.1 . . . . . A 1 PCA CG . 25238 1 253 . 2 2 1 1 PCA HG2 H 1 2.602 0.01 . . . . . A 1 PCA HG2 . 25238 1 254 . 2 2 1 1 PCA HG3 H 1 2.158 0.01 . . . . . A 1 PCA HG3 . 25238 1 255 . 2 2 2 2 LEU CA C 13 58.287 0.1 . . . . . A 2 LEU CA . 25238 1 256 . 2 2 2 2 LEU HA H 1 4.584 0.01 . . . . . A 2 LEU HA . 25238 1 257 . 2 2 2 2 LEU CB C 13 42.435 0.1 . . . . . A 2 LEU CB . 25238 1 258 . 2 2 2 2 LEU HB2 H 1 1.762 0.01 . . . . . A 2 LEU HB2 . 25238 1 259 . 2 2 2 2 LEU HB3 H 1 1.710 0.01 . . . . . A 2 LEU HB3 . 25238 1 260 . 2 2 2 2 LEU HD11 H 1 0.978 0.1 . . . . . A 2 LEU HD11 . 25238 1 261 . 2 2 2 2 LEU HD12 H 1 0.978 0.1 . . . . . A 2 LEU HD12 . 25238 1 262 . 2 2 2 2 LEU HD13 H 1 0.978 0.1 . . . . . A 2 LEU HD13 . 25238 1 263 . 2 2 3 3 TYR CA C 13 66.270 0.1 . . . . . A 3 TYR CA . 25238 1 264 . 2 2 3 3 TYR HA H 1 3.654 0.01 . . . . . A 3 TYR HA . 25238 1 265 . 2 2 3 3 TYR HB2 H 1 2.935 0.01 . . . . . A 3 TYR HB2 . 25238 1 266 . 2 2 3 3 TYR HB3 H 1 2.720 0.01 . . . . . A 3 TYR HB3 . 25238 1 267 . 2 2 3 3 TYR HD1 H 1 6.320 0.01 . . . . . A 3 TYR HD1 . 25238 1 268 . 2 2 3 3 TYR HD2 H 1 6.320 0.01 . . . . . A 3 TYR HD2 . 25238 1 269 . 2 2 3 3 TYR HE1 H 1 6.609 0.01 . . . . . A 3 TYR HE1 . 25238 1 270 . 2 2 3 3 TYR HE2 H 1 6.609 0.01 . . . . . A 3 TYR HE2 . 25238 1 271 . 2 2 4 4 SER CA C 13 61.716 0.1 . . . . . A 4 SER CA . 25238 1 272 . 2 2 4 4 SER HA H 1 4.149 0.01 . . . . . A 4 SER HA . 25238 1 273 . 2 2 4 4 SER CB C 13 61.268 0.1 . . . . . A 4 SER CB . 25238 1 274 . 2 2 4 4 SER HB2 H 1 3.934 0.01 . . . . . A 4 SER HB2 . 25238 1 275 . 2 2 4 4 SER HB3 H 1 3.886 0.01 . . . . . A 4 SER HB3 . 25238 1 276 . 2 2 5 5 ALA CA C 13 54.507 0.1 . . . . . A 5 ALA CA . 25238 1 277 . 2 2 5 5 ALA HA H 1 4.245 0.01 . . . . . A 5 ALA HA . 25238 1 278 . 2 2 5 5 ALA HB1 H 1 1.516 0.01 . . . . . A 5 ALA HB1 . 25238 1 279 . 2 2 5 5 ALA HB2 H 1 1.516 0.01 . . . . . A 5 ALA HB2 . 25238 1 280 . 2 2 5 5 ALA HB3 H 1 1.516 0.01 . . . . . A 5 ALA HB3 . 25238 1 281 . 2 2 5 5 ALA CB C 13 18.182 0.1 . . . . . A 5 ALA CB . 25238 1 282 . 2 2 6 6 LEU CA C 13 57.112 0.1 . . . . . A 6 LEU CA . 25238 1 283 . 2 2 6 6 LEU HA H 1 4.196 0.01 . . . . . A 6 LEU HA . 25238 1 284 . 2 2 6 6 LEU CB C 13 41.003 0.1 . . . . . A 6 LEU CB . 25238 1 285 . 2 2 6 6 LEU HB2 H 1 1.595 0.01 . . . . . A 6 LEU HB2 . 25238 1 286 . 2 2 6 6 LEU HB3 H 1 1.435 0.01 . . . . . A 6 LEU HB3 . 25238 1 287 . 2 2 6 6 LEU HG H 1 1.588 0.01 . . . . . A 6 LEU HG . 25238 1 288 . 2 2 6 6 LEU HD11 H 1 1.046 0.01 . . . . . A 6 LEU HD11 . 25238 1 289 . 2 2 6 6 LEU HD12 H 1 1.046 0.01 . . . . . A 6 LEU HD12 . 25238 1 290 . 2 2 6 6 LEU HD13 H 1 1.046 0.01 . . . . . A 6 LEU HD13 . 25238 1 291 . 2 2 6 6 LEU HD21 H 1 0.939 0.01 . . . . . A 6 LEU HD21 . 25238 1 292 . 2 2 6 6 LEU HD22 H 1 0.939 0.01 . . . . . A 6 LEU HD22 . 25238 1 293 . 2 2 6 6 LEU HD23 H 1 0.939 0.01 . . . . . A 6 LEU HD23 . 25238 1 294 . 2 2 7 7 ALA CA C 13 55.284 0.1 . . . . . A 7 ALA CA . 25238 1 295 . 2 2 7 7 ALA HA H 1 3.501 0.01 . . . . . A 7 ALA HA . 25238 1 296 . 2 2 7 7 ALA HB1 H 1 1.091 0.01 . . . . . A 7 ALA HB1 . 25238 1 297 . 2 2 7 7 ALA HB2 H 1 1.091 0.01 . . . . . A 7 ALA HB2 . 25238 1 298 . 2 2 7 7 ALA HB3 H 1 1.091 0.01 . . . . . A 7 ALA HB3 . 25238 1 299 . 2 2 8 8 ASN CA C 13 56.364 0.1 . . . . . A 8 ASN CA . 25238 1 300 . 2 2 8 8 ASN HA H 1 4.403 0.01 . . . . . A 8 ASN HA . 25238 1 301 . 2 2 8 8 ASN HB2 H 1 2.866 0.01 . . . . . A 8 ASN HB2 . 25238 1 302 . 2 2 8 8 ASN HB3 H 1 2.866 0.01 . . . . . A 8 ASN HB3 . 25238 1 303 . 2 2 8 8 ASN HD21 H 1 7.678 0.01 . . . . . A 8 ASN HD21 . 25238 1 304 . 2 2 8 8 ASN HD22 H 1 7.018 0.01 . . . . . A 8 ASN HD22 . 25238 1 305 . 2 2 9 9 LYS CA C 13 59.99 0.1 . . . . . A 9 LYS CA . 25238 1 306 . 2 2 9 9 LYS HA H 1 4.253 0.01 . . . . . A 9 LYS HA . 25238 1 307 . 2 2 9 9 LYS CB C 13 32.289 0.1 . . . . . A 9 LYS CB . 25238 1 308 . 2 2 9 9 LYS HB2 H 1 2.174 0.01 . . . . . A 9 LYS HB2 . 25238 1 309 . 2 2 9 9 LYS HB3 H 1 2.078 0.01 . . . . . A 9 LYS HB3 . 25238 1 310 . 2 2 9 9 LYS HG2 H 1 1.583 0.01 . . . . . A 9 LYS HG2 . 25238 1 311 . 2 2 9 9 LYS HG3 H 1 1.521 0.01 . . . . . A 9 LYS HG3 . 25238 1 312 . 2 2 9 9 LYS HD2 H 1 1.775 0.01 . . . . . A 9 LYS HD2 . 25238 1 313 . 2 2 9 9 LYS HD3 H 1 1.739 0.01 . . . . . A 9 LYS HD3 . 25238 1 314 . 2 2 9 9 LYS HE2 H 1 3.054 0.01 . . . . . A 9 LYS HE2 . 25238 1 315 . 2 2 9 9 LYS HE3 H 1 3.054 0.01 . . . . . A 9 LYS HE3 . 25238 1 316 . 2 2 9 9 LYS HZ1 H 1 7.672 0.01 . . . . . A 9 LYS HZ1 . 25238 1 317 . 2 2 9 9 LYS HZ2 H 1 7.672 0.01 . . . . . A 9 LYS HZ2 . 25238 1 318 . 2 2 9 9 LYS HZ3 H 1 7.672 0.01 . . . . . A 9 LYS HZ3 . 25238 1 319 . 2 2 10 10 CYS CA C 13 57.536 0.1 . . . . . A 10 CYS CA . 25238 1 320 . 2 2 10 10 CYS HA H 1 4.093 0.01 . . . . . A 10 CYS HA . 25238 1 321 . 2 2 10 10 CYS CB C 13 43.049 0.1 . . . . . A 10 CYS CB . 25238 1 322 . 2 2 10 10 CYS HB2 H 1 3.197 0.01 . . . . . A 10 CYS HB2 . 25238 1 323 . 2 2 10 10 CYS HB3 H 1 2.941 0.01 . . . . . A 10 CYS HB3 . 25238 1 324 . 2 2 11 11 CYS CA C 13 55.847 0.1 . . . . . A 11 CYS CA . 25238 1 325 . 2 2 11 11 CYS HA H 1 4.443 0.01 . . . . . A 11 CYS HA . 25238 1 326 . 2 2 11 11 CYS CB C 13 39.443 0.1 . . . . . A 11 CYS CB . 25238 1 327 . 2 2 11 11 CYS HB2 H 1 3.575 0.01 . . . . . A 11 CYS HB2 . 25238 1 328 . 2 2 11 11 CYS HB3 H 1 2.572 0.01 . . . . . A 11 CYS HB3 . 25238 1 329 . 2 2 12 12 HIS CA C 13 54.965 0.1 . . . . . A 12 HIS CA . 25238 1 330 . 2 2 12 12 HIS HA H 1 4.592 0.01 . . . . . A 12 HIS HA . 25238 1 331 . 2 2 12 12 HIS HB2 H 1 3.383 0.01 . . . . . A 12 HIS HB2 . 25238 1 332 . 2 2 12 12 HIS HB3 H 1 3.219 0.01 . . . . . A 12 HIS HB3 . 25238 1 333 . 2 2 12 12 HIS HD2 H 1 7.392 0.01 . . . . . A 12 HIS HD2 . 25238 1 334 . 2 2 12 12 HIS HE1 H 1 8.650 0.01 . . . . . A 12 HIS HE1 . 25238 1 335 . 2 2 13 13 VAL CA C 13 62.826 0.1 . . . . . A 13 VAL CA . 25238 1 336 . 2 2 13 13 VAL HA H 1 4.420 0.01 . . . . . A 13 VAL HA . 25238 1 337 . 2 2 13 13 VAL HB H 1 2.298 0.01 . . . . . A 13 VAL HB . 25238 1 338 . 2 2 13 13 VAL HG11 H 1 1.070 0.01 . . . . . A 13 VAL HG11 . 25238 1 339 . 2 2 13 13 VAL HG12 H 1 1.070 0.01 . . . . . A 13 VAL HG12 . 25238 1 340 . 2 2 13 13 VAL HG13 H 1 1.070 0.01 . . . . . A 13 VAL HG13 . 25238 1 341 . 2 2 13 13 VAL HG21 H 1 1.027 0.01 . . . . . A 13 VAL HG21 . 25238 1 342 . 2 2 13 13 VAL HG22 H 1 1.027 0.01 . . . . . A 13 VAL HG22 . 25238 1 343 . 2 2 13 13 VAL HG23 H 1 1.027 0.01 . . . . . A 13 VAL HG23 . 25238 1 344 . 2 2 14 14 GLY CA C 13 43.534 0.1 . . . . . A 14 GLY CA . 25238 1 345 . 2 2 14 14 GLY HA3 H 1 4.624 0.01 . . . . . A 14 GLY HA3 . 25238 1 346 . 2 2 14 14 GLY HA2 H 1 4.280 0.01 . . . . . A 14 GLY HA2 . 25238 1 347 . 2 2 15 15 CYS CA C 13 53.425 0.1 . . . . . A 15 CYS CA . 25238 1 348 . 2 2 15 15 CYS HA H 1 5.182 0.01 . . . . . A 15 CYS HA . 25238 1 349 . 2 2 15 15 CYS HB2 H 1 4.002 0.01 . . . . . A 15 CYS HB2 . 25238 1 350 . 2 2 15 15 CYS HB3 H 1 2.608 0.01 . . . . . A 15 CYS HB3 . 25238 1 351 . 2 2 16 16 THR CA C 13 60.128 0.1 . . . . . A 16 THR CA . 25238 1 352 . 2 2 16 16 THR HA H 1 4.948 0.01 . . . . . A 16 THR HA . 25238 1 353 . 2 2 16 16 THR CB C 13 70.587 0.1 . . . . . A 16 THR CB . 25238 1 354 . 2 2 16 16 THR HB H 1 4.655 0.01 . . . . . A 16 THR HB . 25238 1 355 . 2 2 16 16 THR HG21 H 1 1.300 0.01 . . . . . A 16 THR HG21 . 25238 1 356 . 2 2 16 16 THR HG22 H 1 1.300 0.01 . . . . . A 16 THR HG22 . 25238 1 357 . 2 2 16 16 THR HG23 H 1 1.300 0.01 . . . . . A 16 THR HG23 . 25238 1 358 . 2 2 17 17 LYS CA C 13 61.127 0.1 . . . . . A 17 LYS CA . 25238 1 359 . 2 2 17 17 LYS HA H 1 3.978 0.01 . . . . . A 17 LYS HA . 25238 1 360 . 2 2 17 17 LYS HB2 H 1 2.192 0.01 . . . . . A 17 LYS HB2 . 25238 1 361 . 2 2 17 17 LYS HB3 H 1 1.791 0.01 . . . . . A 17 LYS HB3 . 25238 1 362 . 2 2 17 17 LYS HG2 H 1 1.656 0.01 . . . . . A 17 LYS HG2 . 25238 1 363 . 2 2 17 17 LYS HG3 H 1 1.179 0.01 . . . . . A 17 LYS HG3 . 25238 1 364 . 2 2 17 17 LYS HD2 H 1 0.885 0.01 . . . . . A 17 LYS HD2 . 25238 1 365 . 2 2 17 17 LYS HD3 H 1 0.885 0.01 . . . . . A 17 LYS HD3 . 25238 1 366 . 2 2 17 17 LYS HE2 H 1 2.828 0.01 . . . . . A 17 LYS HE2 . 25238 1 367 . 2 2 17 17 LYS HE3 H 1 2.828 0.01 . . . . . A 17 LYS HE3 . 25238 1 368 . 2 2 18 18 ARG CA C 13 59.056 0.1 . . . . . A 18 ARG CA . 25238 1 369 . 2 2 18 18 ARG HA H 1 3.857 0.01 . . . . . A 18 ARG HA . 25238 1 370 . 2 2 18 18 ARG HB2 H 1 1.836 0.01 . . . . . A 18 ARG HB2 . 25238 1 371 . 2 2 18 18 ARG HB3 H 1 1.569 0.01 . . . . . A 18 ARG HB3 . 25238 1 372 . 2 2 18 18 ARG HG3 H 1 1.687 0.01 . . . . . A 18 ARG HG2 . 25238 1 373 . 2 2 18 18 ARG HG2 H 1 1.687 0.01 . . . . . A 18 ARG HG3 . 25238 1 374 . 2 2 18 18 ARG CD C 13 42.823 0.1 . . . . . A 18 ARG CD . 25238 1 375 . 2 2 18 18 ARG HD2 H 1 3.059 0.01 . . . . . A 18 ARG HD2 . 25238 1 376 . 2 2 18 18 ARG HD3 H 1 3.012 0.01 . . . . . A 18 ARG HD3 . 25238 1 377 . 2 2 18 18 ARG HE H 1 7.573 0.01 . . . . . A 18 ARG HE . 25238 1 378 . 2 2 19 19 SER HA H 1 4.155 0.01 . . . . . A 19 SER HA . 25238 1 379 . 2 2 19 19 SER CB C 13 62.362 0.1 . . . . . A 19 SER CB . 25238 1 380 . 2 2 19 19 SER HB2 H 1 4.073 0.01 . . . . . A 19 SER HB2 . 25238 1 381 . 2 2 19 19 SER HB3 H 1 3.972 0.01 . . . . . A 19 SER HB3 . 25238 1 382 . 2 2 20 20 LEU CA C 13 57.112 0.1 . . . . . A 20 LEU CA . 25238 1 383 . 2 2 20 20 LEU HA H 1 4.462 0.01 . . . . . A 20 LEU HA . 25238 1 384 . 2 2 20 20 LEU CB C 13 42.014 0.1 . . . . . A 20 LEU CB . 25238 1 385 . 2 2 20 20 LEU HB2 H 1 2.008 0.01 . . . . . A 20 LEU HB2 . 25238 1 386 . 2 2 20 20 LEU HB3 H 1 1.750 0.01 . . . . . A 20 LEU HB3 . 25238 1 387 . 2 2 20 20 LEU HG H 1 1.903 0.01 . . . . . A 20 LEU HG . 25238 1 388 . 2 2 20 20 LEU HD11 H 1 0.964 0.01 . . . . . A 20 LEU HD11 . 25238 1 389 . 2 2 20 20 LEU HD12 H 1 0.964 0.01 . . . . . A 20 LEU HD12 . 25238 1 390 . 2 2 20 20 LEU HD13 H 1 0.964 0.01 . . . . . A 20 LEU HD13 . 25238 1 391 . 2 2 20 20 LEU HD21 H 1 0.839 0.01 . . . . . A 20 LEU HD21 . 25238 1 392 . 2 2 20 20 LEU HD22 H 1 0.839 0.01 . . . . . A 20 LEU HD22 . 25238 1 393 . 2 2 20 20 LEU HD23 H 1 0.839 0.01 . . . . . A 20 LEU HD23 . 25238 1 394 . 2 2 21 21 ALA CA C 13 53.861 0.1 . . . . . A 21 ALA CA . 25238 1 395 . 2 2 21 21 ALA HA H 1 4.329 0.01 . . . . . A 21 ALA HA . 25238 1 396 . 2 2 21 21 ALA HB1 H 1 1.469 0.01 . . . . . A 21 ALA HB1 . 25238 1 397 . 2 2 21 21 ALA HB2 H 1 1.469 0.01 . . . . . A 21 ALA HB2 . 25238 1 398 . 2 2 21 21 ALA HB3 H 1 1.469 0.01 . . . . . A 21 ALA HB3 . 25238 1 399 . 2 2 21 21 ALA CB C 13 17.394 0.1 . . . . . A 21 ALA CB . 25238 1 400 . 2 2 22 22 ARG CA C 13 57.401 0.1 . . . . . A 22 ARG CA . 25238 1 401 . 2 2 22 22 ARG HA H 1 4.067 0.01 . . . . . A 22 ARG HA . 25238 1 402 . 2 2 22 22 ARG HB2 H 1 1.589 0.01 . . . . . A 22 ARG HB2 . 25238 1 403 . 2 2 22 22 ARG HB3 H 1 1.589 0.01 . . . . . A 22 ARG HB3 . 25238 1 404 . 2 2 22 22 ARG HG2 H 1 1.707 0.01 . . . . . A 22 ARG HG2 . 25238 1 405 . 2 2 22 22 ARG HG3 H 1 1.472 0.01 . . . . . A 22 ARG HG3 . 25238 1 406 . 2 2 22 22 ARG HD2 H 1 3.078 0.01 . . . . . A 22 ARG HD2 . 25238 1 407 . 2 2 22 22 ARG HD3 H 1 3.007 0.01 . . . . . A 22 ARG HD3 . 25238 1 408 . 2 2 22 22 ARG HE H 1 7.151 0.01 . . . . . A 22 ARG HE . 25238 1 409 . 2 2 23 23 PHE CA C 13 54.98 0.1 . . . . . A 23 PHE CA . 25238 1 410 . 2 2 23 23 PHE HA H 1 4.585 0.01 . . . . . A 23 PHE HA . 25238 1 411 . 2 2 23 23 PHE CB C 13 38.561 0.1 . . . . . A 23 PHE CB . 25238 1 412 . 2 2 23 23 PHE HB2 H 1 3.427 0.01 . . . . . A 23 PHE HB2 . 25238 1 413 . 2 2 23 23 PHE HB3 H 1 2.860 0.01 . . . . . A 23 PHE HB3 . 25238 1 414 . 2 2 23 23 PHE HD1 H 1 7.507 0.01 . . . . . A 23 PHE HD1 . 25238 1 415 . 2 2 23 23 PHE HD2 H 1 7.507 0.01 . . . . . A 23 PHE HD2 . 25238 1 416 . 2 2 23 23 PHE HE1 H 1 7.481 0.01 . . . . . A 23 PHE HE1 . 25238 1 417 . 2 2 23 23 PHE HE2 H 1 7.481 0.01 . . . . . A 23 PHE HE2 . 25238 1 418 . 2 2 24 24 CYS CA C 13 54.362 0.1 . . . . . A 24 CYS CA . 25238 1 419 . 2 2 24 24 CYS HA H 1 4.675 0.01 . . . . . A 24 CYS HA . 25238 1 420 . 2 2 24 24 CYS HB2 H 1 3.214 0.01 . . . . . A 24 CYS HB2 . 25238 1 stop_ save_