################################### # 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 34113 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _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 DQF-COSY' . . . 34113 1 2 '2D 1H-1H TOCSY' . . . 34113 1 3 '2D 1H-1H NOESY' . . . 34113 1 4 '2D 1H-1H TOCSY' . . . 34113 1 5 '2D 1H-1H NOESY' . . . 34113 1 6 '2D 1H-13C HSQC' . . . 34113 1 7 '2D 1H-13C HMBC' . . . 34113 1 8 '2D 1H-13C TOCSY-HSQC' . . . 34113 1 9 '2D 1H-15N HSQC' . . . 34113 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 ARG HA H 1 4.109 0.020 . 1 . . . . A 1 ARG HA . 34113 1 2 . 1 1 1 1 ARG HB2 H 1 1.979 0.020 . 2 . . . . A 1 ARG HB2 . 34113 1 3 . 1 1 1 1 ARG HB3 H 1 1.979 0.020 . 2 . . . . A 1 ARG HB3 . 34113 1 4 . 1 1 1 1 ARG HG2 H 1 1.682 0.020 . 2 . . . . A 1 ARG HG2 . 34113 1 5 . 1 1 1 1 ARG HG3 H 1 1.682 0.020 . 2 . . . . A 1 ARG HG3 . 34113 1 6 . 1 1 1 1 ARG HD2 H 1 3.241 0.020 . 2 . . . . A 1 ARG HD2 . 34113 1 7 . 1 1 1 1 ARG HD3 H 1 3.241 0.020 . 2 . . . . A 1 ARG HD3 . 34113 1 8 . 1 1 1 1 ARG HE H 1 7.319 0.020 . 1 . . . . A 1 ARG HE . 34113 1 9 . 1 1 1 1 ARG C C 13 172.212 0.400 . 1 . . . . A 1 ARG C . 34113 1 10 . 1 1 1 1 ARG CA C 13 55.883 0.400 . 1 . . . . A 1 ARG CA . 34113 1 11 . 1 1 1 1 ARG CB C 13 31.196 0.400 . 1 . . . . A 1 ARG CB . 34113 1 12 . 1 1 1 1 ARG CG C 13 26.907 0.400 . 1 . . . . A 1 ARG CG . 34113 1 13 . 1 1 1 1 ARG CD C 13 43.471 0.400 . 1 . . . . A 1 ARG CD . 34113 1 14 . 1 1 1 1 ARG NE N 15 89.009 0.400 . 1 . . . . A 1 ARG NE . 34113 1 15 . 1 1 2 2 MET H H 1 8.746 0.020 . 1 . . . . A 2 MET H . 34113 1 16 . 1 1 2 2 MET HA H 1 5.101 0.020 . 1 . . . . A 2 MET HA . 34113 1 17 . 1 1 2 2 MET HB2 H 1 2.044 0.020 . 1 . . . . A 2 MET HB2 . 34113 1 18 . 1 1 2 2 MET HB3 H 1 1.831 0.020 . 1 . . . . A 2 MET HB3 . 34113 1 19 . 1 1 2 2 MET HG2 H 1 2.515 0.020 . 1 . . . . A 2 MET HG2 . 34113 1 20 . 1 1 2 2 MET HG3 H 1 2.571 0.020 . 1 . . . . A 2 MET HG3 . 34113 1 21 . 1 1 2 2 MET C C 13 175.649 0.400 . 1 . . . . A 2 MET C . 34113 1 22 . 1 1 2 2 MET CA C 13 54.349 0.400 . 1 . . . . A 2 MET CA . 34113 1 23 . 1 1 2 2 MET CB C 13 34.238 0.400 . 1 . . . . A 2 MET CB . 34113 1 24 . 1 1 2 2 MET CG C 13 32.547 0.400 . 1 . . . . A 2 MET CG . 34113 1 25 . 1 1 2 2 MET N N 15 121.109 0.400 . 1 . . . . A 2 MET N . 34113 1 26 . 1 1 3 3 CYS H H 1 9.312 0.020 . 1 . . . . A 3 CYS H . 34113 1 27 . 1 1 3 3 CYS HA H 1 4.989 0.020 . 1 . . . . A 3 CYS HA . 34113 1 28 . 1 1 3 3 CYS HB2 H 1 3.064 0.020 . 1 . . . . A 3 CYS HB2 . 34113 1 29 . 1 1 3 3 CYS HB3 H 1 2.932 0.020 . 1 . . . . A 3 CYS HB3 . 34113 1 30 . 1 1 3 3 CYS C C 13 173.476 0.400 . 1 . . . . A 3 CYS C . 34113 1 31 . 1 1 3 3 CYS CA C 13 60.158 0.400 . 1 . . . . A 3 CYS CA . 34113 1 32 . 1 1 3 3 CYS CB C 13 39.492 0.400 . 1 . . . . A 3 CYS CB . 34113 1 33 . 1 1 3 3 CYS N N 15 124.616 0.400 . 1 . . . . A 3 CYS N . 34113 1 34 . 1 1 4 4 LYS H H 1 8.553 0.020 . 1 . . . . A 4 LYS H . 34113 1 35 . 1 1 4 4 LYS HA H 1 4.841 0.020 . 1 . . . . A 4 LYS HA . 34113 1 36 . 1 1 4 4 LYS HB2 H 1 1.152 0.020 . 1 . . . . A 4 LYS HB2 . 34113 1 37 . 1 1 4 4 LYS HB3 H 1 1.205 0.020 . 1 . . . . A 4 LYS HB3 . 34113 1 38 . 1 1 4 4 LYS HG2 H 1 0.696 0.020 . 1 . . . . A 4 LYS HG2 . 34113 1 39 . 1 1 4 4 LYS HG3 H 1 0.907 0.020 . 1 . . . . A 4 LYS HG3 . 34113 1 40 . 1 1 4 4 LYS HD2 H 1 0.993 0.020 . 1 . . . . A 4 LYS HD2 . 34113 1 41 . 1 1 4 4 LYS HD3 H 1 1.169 0.020 . 1 . . . . A 4 LYS HD3 . 34113 1 42 . 1 1 4 4 LYS HE2 H 1 2.236 0.020 . 1 . . . . A 4 LYS HE2 . 34113 1 43 . 1 1 4 4 LYS HE3 H 1 2.241 0.020 . 1 . . . . A 4 LYS HE3 . 34113 1 44 . 1 1 4 4 LYS C C 13 175.639 0.400 . 1 . . . . A 4 LYS C . 34113 1 45 . 1 1 4 4 LYS CA C 13 54.759 0.400 . 1 . . . . A 4 LYS CA . 34113 1 46 . 1 1 4 4 LYS CB C 13 35.806 0.400 . 1 . . . . A 4 LYS CB . 34113 1 47 . 1 1 4 4 LYS CG C 13 23.901 0.400 . 1 . . . . A 4 LYS CG . 34113 1 48 . 1 1 4 4 LYS CD C 13 29.839 0.400 . 1 . . . . A 4 LYS CD . 34113 1 49 . 1 1 4 4 LYS CE C 13 41.468 0.400 . 1 . . . . A 4 LYS CE . 34113 1 50 . 1 1 4 4 LYS N N 15 123.715 0.400 . 1 . . . . A 4 LYS N . 34113 1 51 . 1 1 5 5 THR H H 1 8.889 0.020 . 1 . . . . A 5 THR H . 34113 1 52 . 1 1 5 5 THR HA H 1 4.818 0.020 . 1 . . . . A 5 THR HA . 34113 1 53 . 1 1 5 5 THR HB H 1 3.608 0.020 . 1 . . . . A 5 THR HB . 34113 1 54 . 1 1 5 5 THR HG21 H 1 1.109 0.020 . 1 . . . . A 5 THR HG21 . 34113 1 55 . 1 1 5 5 THR HG22 H 1 1.109 0.020 . 1 . . . . A 5 THR HG22 . 34113 1 56 . 1 1 5 5 THR HG23 H 1 1.109 0.020 . 1 . . . . A 5 THR HG23 . 34113 1 57 . 1 1 5 5 THR C C 13 170.679 0.400 . 1 . . . . A 5 THR C . 34113 1 58 . 1 1 5 5 THR CA C 13 59.349 0.400 . 1 . . . . A 5 THR CA . 34113 1 59 . 1 1 5 5 THR CB C 13 72.823 0.400 . 1 . . . . A 5 THR CB . 34113 1 60 . 1 1 5 5 THR CG2 C 13 20.706 0.400 . 1 . . . . A 5 THR CG2 . 34113 1 61 . 1 1 5 5 THR N N 15 120.718 0.400 . 1 . . . . A 5 THR N . 34113 1 62 . 1 1 6 6 PRO HA H 1 3.823 0.020 . 1 . . . . A 6 PRO HA . 34113 1 63 . 1 1 6 6 PRO HB2 H 1 1.829 0.020 . 1 . . . . A 6 PRO HB2 . 34113 1 64 . 1 1 6 6 PRO HB3 H 1 1.703 0.020 . 1 . . . . A 6 PRO HB3 . 34113 1 65 . 1 1 6 6 PRO HG2 H 1 1.841 0.020 . 1 . . . . A 6 PRO HG2 . 34113 1 66 . 1 1 6 6 PRO HG3 H 1 2.078 0.020 . 1 . . . . A 6 PRO HG3 . 34113 1 67 . 1 1 6 6 PRO HD2 H 1 3.828 0.020 . 2 . . . . A 6 PRO HD2 . 34113 1 68 . 1 1 6 6 PRO HD3 H 1 3.828 0.020 . 2 . . . . A 6 PRO HD3 . 34113 1 69 . 1 1 6 6 PRO CA C 13 63.185 0.400 . 1 . . . . A 6 PRO CA . 34113 1 70 . 1 1 6 6 PRO CB C 13 31.588 0.400 . 1 . . . . A 6 PRO CB . 34113 1 71 . 1 1 6 6 PRO CG C 13 27.606 0.400 . 1 . . . . A 6 PRO CG . 34113 1 72 . 1 1 6 6 PRO CD C 13 51.121 0.400 . 1 . . . . A 6 PRO CD . 34113 1 73 . 1 1 7 7 SER H H 1 7.838 0.020 . 1 . . . . A 7 SER H . 34113 1 74 . 1 1 7 7 SER HA H 1 4.290 0.020 . 1 . . . . A 7 SER HA . 34113 1 75 . 1 1 7 7 SER HB2 H 1 3.359 0.020 . 1 . . . . A 7 SER HB2 . 34113 1 76 . 1 1 7 7 SER HB3 H 1 3.859 0.020 . 1 . . . . A 7 SER HB3 . 34113 1 77 . 1 1 7 7 SER C C 13 177.291 0.400 . 1 . . . . A 7 SER C . 34113 1 78 . 1 1 7 7 SER CA C 13 58.776 0.400 . 1 . . . . A 7 SER CA . 34113 1 79 . 1 1 7 7 SER CB C 13 63.681 0.400 . 1 . . . . A 7 SER CB . 34113 1 80 . 1 1 7 7 SER N N 15 116.918 0.400 . 1 . . . . A 7 SER N . 34113 1 81 . 1 1 8 8 GLY H H 1 10.629 0.020 . 1 . . . . A 8 GLY H . 34113 1 82 . 1 1 8 8 GLY HA2 H 1 4.223 0.020 . 1 . . . . A 8 GLY HA2 . 34113 1 83 . 1 1 8 8 GLY HA3 H 1 3.735 0.020 . 1 . . . . A 8 GLY HA3 . 34113 1 84 . 1 1 8 8 GLY C C 13 174.876 0.400 . 1 . . . . A 8 GLY C . 34113 1 85 . 1 1 8 8 GLY CA C 13 45.574 0.400 . 1 . . . . A 8 GLY CA . 34113 1 86 . 1 1 8 8 GLY N N 15 119.990 0.400 . 1 . . . . A 8 GLY N . 34113 1 87 . 1 1 9 9 LYS H H 1 7.948 0.020 . 1 . . . . A 9 LYS H . 34113 1 88 . 1 1 9 9 LYS HA H 1 4.329 0.020 . 1 . . . . A 9 LYS HA . 34113 1 89 . 1 1 9 9 LYS HB2 H 1 1.536 0.020 . 1 . . . . A 9 LYS HB2 . 34113 1 90 . 1 1 9 9 LYS HB3 H 1 1.677 0.020 . 1 . . . . A 9 LYS HB3 . 34113 1 91 . 1 1 9 9 LYS HG2 H 1 1.258 0.020 . 1 . . . . A 9 LYS HG2 . 34113 1 92 . 1 1 9 9 LYS HG3 H 1 1.353 0.020 . 1 . . . . A 9 LYS HG3 . 34113 1 93 . 1 1 9 9 LYS HD2 H 1 1.592 0.020 . 2 . . . . A 9 LYS HD2 . 34113 1 94 . 1 1 9 9 LYS HD3 H 1 1.592 0.020 . 2 . . . . A 9 LYS HD3 . 34113 1 95 . 1 1 9 9 LYS HE2 H 1 2.952 0.020 . 2 . . . . A 9 LYS HE2 . 34113 1 96 . 1 1 9 9 LYS HE3 H 1 2.952 0.020 . 2 . . . . A 9 LYS HE3 . 34113 1 97 . 1 1 9 9 LYS C C 13 176.653 0.400 . 1 . . . . A 9 LYS C . 34113 1 98 . 1 1 9 9 LYS CA C 13 56.225 0.400 . 1 . . . . A 9 LYS CA . 34113 1 99 . 1 1 9 9 LYS CB C 13 34.839 0.400 . 1 . . . . A 9 LYS CB . 34113 1 100 . 1 1 9 9 LYS CG C 13 25.348 0.400 . 1 . . . . A 9 LYS CG . 34113 1 101 . 1 1 9 9 LYS CD C 13 29.142 0.400 . 1 . . . . A 9 LYS CD . 34113 1 102 . 1 1 9 9 LYS CE C 13 42.166 0.400 . 1 . . . . A 9 LYS CE . 34113 1 103 . 1 1 9 9 LYS N N 15 119.077 0.400 . 1 . . . . A 9 LYS N . 34113 1 104 . 1 1 10 10 PHE H H 1 8.153 0.020 . 1 . . . . A 10 PHE H . 34113 1 105 . 1 1 10 10 PHE HA H 1 4.060 0.020 . 1 . . . . A 10 PHE HA . 34113 1 106 . 1 1 10 10 PHE HB2 H 1 2.914 0.020 . 1 . . . . A 10 PHE HB2 . 34113 1 107 . 1 1 10 10 PHE HB3 H 1 2.988 0.020 . 1 . . . . A 10 PHE HB3 . 34113 1 108 . 1 1 10 10 PHE HD1 H 1 7.073 0.020 . 3 . . . . A 10 PHE HD1 . 34113 1 109 . 1 1 10 10 PHE HD2 H 1 7.073 0.020 . 3 . . . . A 10 PHE HD2 . 34113 1 110 . 1 1 10 10 PHE HE1 H 1 6.959 0.020 . 3 . . . . A 10 PHE HE1 . 34113 1 111 . 1 1 10 10 PHE HE2 H 1 6.959 0.020 . 3 . . . . A 10 PHE HE2 . 34113 1 112 . 1 1 10 10 PHE HZ H 1 7.518 0.020 . 1 . . . . A 10 PHE HZ . 34113 1 113 . 1 1 10 10 PHE CA C 13 59.655 0.400 . 1 . . . . A 10 PHE CA . 34113 1 114 . 1 1 10 10 PHE CB C 13 39.012 0.400 . 1 . . . . A 10 PHE CB . 34113 1 115 . 1 1 10 10 PHE CD1 C 13 132.443 0.400 . 1 . . . . A 10 PHE CD1 . 34113 1 116 . 1 1 10 10 PHE CE2 C 13 130.738 0.400 . 1 . . . . A 10 PHE CE2 . 34113 1 117 . 1 1 10 10 PHE CZ C 13 130.635 0.400 . 1 . . . . A 10 PHE CZ . 34113 1 118 . 1 1 10 10 PHE N N 15 122.302 0.400 . 1 . . . . A 10 PHE N . 34113 1 119 . 1 1 11 11 LYS H H 1 7.856 0.020 . 1 . . . . A 11 LYS H . 34113 1 120 . 1 1 11 11 LYS HA H 1 4.444 0.020 . 1 . . . . A 11 LYS HA . 34113 1 121 . 1 1 11 11 LYS HB2 H 1 1.511 0.020 . 1 . . . . A 11 LYS HB2 . 34113 1 122 . 1 1 11 11 LYS HB3 H 1 1.649 0.020 . 1 . . . . A 11 LYS HB3 . 34113 1 123 . 1 1 11 11 LYS HG2 H 1 1.257 0.020 . 1 . . . . A 11 LYS HG2 . 34113 1 124 . 1 1 11 11 LYS HG3 H 1 1.307 0.020 . 1 . . . . A 11 LYS HG3 . 34113 1 125 . 1 1 11 11 LYS HD2 H 1 1.511 0.020 . 1 . . . . A 11 LYS HD2 . 34113 1 126 . 1 1 11 11 LYS HD3 H 1 1.560 0.020 . 1 . . . . A 11 LYS HD3 . 34113 1 127 . 1 1 11 11 LYS HE2 H 1 2.913 0.020 . 2 . . . . A 11 LYS HE2 . 34113 1 128 . 1 1 11 11 LYS HE3 H 1 2.913 0.020 . 2 . . . . A 11 LYS HE3 . 34113 1 129 . 1 1 11 11 LYS C C 13 173.350 0.400 . 1 . . . . A 11 LYS C . 34113 1 130 . 1 1 11 11 LYS CA C 13 55.220 0.400 . 1 . . . . A 11 LYS CA . 34113 1 131 . 1 1 11 11 LYS CB C 13 34.195 0.400 . 1 . . . . A 11 LYS CB . 34113 1 132 . 1 1 11 11 LYS CG C 13 24.461 0.400 . 1 . . . . A 11 LYS CG . 34113 1 133 . 1 1 11 11 LYS CD C 13 28.879 0.400 . 1 . . . . A 11 LYS CD . 34113 1 134 . 1 1 11 11 LYS CE C 13 42.213 0.400 . 1 . . . . A 11 LYS CE . 34113 1 135 . 1 1 11 11 LYS N N 15 127.915 0.400 . 1 . . . . A 11 LYS N . 34113 1 136 . 1 1 12 12 GLY H H 1 7.993 0.020 . 1 . . . . A 12 GLY H . 34113 1 137 . 1 1 12 12 GLY HA2 H 1 3.954 0.020 . 1 . . . . A 12 GLY HA2 . 34113 1 138 . 1 1 12 12 GLY HA3 H 1 3.686 0.020 . 1 . . . . A 12 GLY HA3 . 34113 1 139 . 1 1 12 12 GLY C C 13 175.541 0.400 . 1 . . . . A 12 GLY C . 34113 1 140 . 1 1 12 12 GLY CA C 13 44.102 0.400 . 1 . . . . A 12 GLY CA . 34113 1 141 . 1 1 13 13 TYR H H 1 8.254 0.020 . 1 . . . . A 13 TYR H . 34113 1 142 . 1 1 13 13 TYR HA H 1 4.665 0.020 . 1 . . . . A 13 TYR HA . 34113 1 143 . 1 1 13 13 TYR HB2 H 1 3.017 0.020 . 1 . . . . A 13 TYR HB2 . 34113 1 144 . 1 1 13 13 TYR HB3 H 1 2.914 0.020 . 1 . . . . A 13 TYR HB3 . 34113 1 145 . 1 1 13 13 TYR HD1 H 1 7.173 0.020 . 3 . . . . A 13 TYR HD1 . 34113 1 146 . 1 1 13 13 TYR HD2 H 1 7.173 0.020 . 3 . . . . A 13 TYR HD2 . 34113 1 147 . 1 1 13 13 TYR HE1 H 1 6.836 0.020 . 3 . . . . A 13 TYR HE1 . 34113 1 148 . 1 1 13 13 TYR HE2 H 1 6.836 0.020 . 3 . . . . A 13 TYR HE2 . 34113 1 149 . 1 1 13 13 TYR CA C 13 57.787 0.400 . 1 . . . . A 13 TYR CA . 34113 1 150 . 1 1 13 13 TYR CB C 13 38.713 0.400 . 1 . . . . A 13 TYR CB . 34113 1 151 . 1 1 13 13 TYR CD1 C 13 133.039 0.400 . 1 . . . . A 13 TYR CD1 . 34113 1 152 . 1 1 13 13 TYR CE1 C 13 118.274 0.400 . 1 . . . . A 13 TYR CE1 . 34113 1 153 . 1 1 13 13 TYR N N 15 119.314 0.400 . 1 . . . . A 13 TYR N . 34113 1 154 . 1 1 14 14 CYS H H 1 8.483 0.020 . 1 . . . . A 14 CYS H . 34113 1 155 . 1 1 14 14 CYS HA H 1 4.692 0.020 . 1 . . . . A 14 CYS HA . 34113 1 156 . 1 1 14 14 CYS HB2 H 1 2.904 0.020 . 2 . . . . A 14 CYS HB2 . 34113 1 157 . 1 1 14 14 CYS HB3 H 1 2.904 0.020 . 2 . . . . A 14 CYS HB3 . 34113 1 158 . 1 1 14 14 CYS C C 13 173.121 0.400 . 1 . . . . A 14 CYS C . 34113 1 159 . 1 1 14 14 CYS CA C 13 62.337 0.400 . 1 . . . . A 14 CYS CA . 34113 1 160 . 1 1 14 14 CYS CB C 13 38.843 0.400 . 1 . . . . A 14 CYS CB . 34113 1 161 . 1 1 14 14 CYS N N 15 125.967 0.400 . 1 . . . . A 14 CYS N . 34113 1 162 . 1 1 15 15 VAL H H 1 8.393 0.020 . 1 . . . . A 15 VAL H . 34113 1 163 . 1 1 15 15 VAL HA H 1 4.355 0.020 . 1 . . . . A 15 VAL HA . 34113 1 164 . 1 1 15 15 VAL HB H 1 2.265 0.020 . 1 . . . . A 15 VAL HB . 34113 1 165 . 1 1 15 15 VAL HG11 H 1 0.963 0.020 . 2 . . . . A 15 VAL HG11 . 34113 1 166 . 1 1 15 15 VAL HG12 H 1 0.963 0.020 . 2 . . . . A 15 VAL HG12 . 34113 1 167 . 1 1 15 15 VAL HG13 H 1 0.963 0.020 . 2 . . . . A 15 VAL HG13 . 34113 1 168 . 1 1 15 15 VAL HG21 H 1 0.987 0.020 . 2 . . . . A 15 VAL HG21 . 34113 1 169 . 1 1 15 15 VAL HG22 H 1 0.987 0.020 . 2 . . . . A 15 VAL HG22 . 34113 1 170 . 1 1 15 15 VAL HG23 H 1 0.987 0.020 . 2 . . . . A 15 VAL HG23 . 34113 1 171 . 1 1 15 15 VAL C C 13 174.952 0.400 . 1 . . . . A 15 VAL C . 34113 1 172 . 1 1 15 15 VAL CA C 13 62.406 0.400 . 1 . . . . A 15 VAL CA . 34113 1 173 . 1 1 15 15 VAL CB C 13 33.735 0.400 . 1 . . . . A 15 VAL CB . 34113 1 174 . 1 1 15 15 VAL CG1 C 13 21.451 0.400 . 1 . . . . A 15 VAL CG1 . 34113 1 175 . 1 1 15 15 VAL CG2 C 13 20.042 0.400 . 1 . . . . A 15 VAL CG2 . 34113 1 176 . 1 1 15 15 VAL N N 15 121.674 0.400 . 1 . . . . A 15 VAL N . 34113 1 177 . 1 1 16 16 ASN H H 1 8.036 0.020 . 1 . . . . A 16 ASN H . 34113 1 178 . 1 1 16 16 ASN HA H 1 4.921 0.020 . 1 . . . . A 16 ASN HA . 34113 1 179 . 1 1 16 16 ASN HB2 H 1 2.826 0.020 . 1 . . . . A 16 ASN HB2 . 34113 1 180 . 1 1 16 16 ASN HB3 H 1 3.073 0.020 . 1 . . . . A 16 ASN HB3 . 34113 1 181 . 1 1 16 16 ASN HD21 H 1 7.675 0.020 . 1 . . . . A 16 ASN HD21 . 34113 1 182 . 1 1 16 16 ASN HD22 H 1 6.990 0.020 . 1 . . . . A 16 ASN HD22 . 34113 1 183 . 1 1 16 16 ASN C C 13 176.455 0.400 . 1 . . . . A 16 ASN C . 34113 1 184 . 1 1 16 16 ASN CA C 13 52.536 0.400 . 1 . . . . A 16 ASN CA . 34113 1 185 . 1 1 16 16 ASN CB C 13 40.543 0.400 . 1 . . . . A 16 ASN CB . 34113 1 186 . 1 1 16 16 ASN N N 15 119.380 0.400 . 1 . . . . A 16 ASN N . 34113 1 187 . 1 1 16 16 ASN ND2 N 15 113.416 0.400 . 1 . . . . A 16 ASN ND2 . 34113 1 188 . 1 1 17 17 ASN H H 1 9.115 0.020 . 1 . . . . A 17 ASN H . 34113 1 189 . 1 1 17 17 ASN HA H 1 4.424 0.020 . 1 . . . . A 17 ASN HA . 34113 1 190 . 1 1 17 17 ASN HB2 H 1 2.887 0.020 . 1 . . . . A 17 ASN HB2 . 34113 1 191 . 1 1 17 17 ASN HB3 H 1 2.978 0.020 . 1 . . . . A 17 ASN HB3 . 34113 1 192 . 1 1 17 17 ASN HD21 H 1 7.617 0.020 . 1 . . . . A 17 ASN HD21 . 34113 1 193 . 1 1 17 17 ASN HD22 H 1 6.992 0.020 . 1 . . . . A 17 ASN HD22 . 34113 1 194 . 1 1 17 17 ASN C C 13 177.326 0.400 . 1 . . . . A 17 ASN C . 34113 1 195 . 1 1 17 17 ASN CA C 13 56.779 0.400 . 1 . . . . A 17 ASN CA . 34113 1 196 . 1 1 17 17 ASN CB C 13 38.893 0.400 . 1 . . . . A 17 ASN CB . 34113 1 197 . 1 1 17 17 ASN CG C 13 175.317 0.400 . 1 . . . . A 17 ASN CG . 34113 1 198 . 1 1 17 17 ASN N N 15 124.384 0.400 . 1 . . . . A 17 ASN N . 34113 1 199 . 1 1 17 17 ASN ND2 N 15 112.570 0.400 . 1 . . . . A 17 ASN ND2 . 34113 1 200 . 1 1 18 18 THR H H 1 8.319 0.020 . 1 . . . . A 18 THR H . 34113 1 201 . 1 1 18 18 THR HA H 1 3.870 0.020 . 1 . . . . A 18 THR HA . 34113 1 202 . 1 1 18 18 THR HB H 1 4.257 0.020 . 1 . . . . A 18 THR HB . 34113 1 203 . 1 1 18 18 THR HG21 H 1 1.247 0.020 . 1 . . . . A 18 THR HG21 . 34113 1 204 . 1 1 18 18 THR HG22 H 1 1.247 0.020 . 1 . . . . A 18 THR HG22 . 34113 1 205 . 1 1 18 18 THR HG23 H 1 1.247 0.020 . 1 . . . . A 18 THR HG23 . 34113 1 206 . 1 1 18 18 THR C C 13 175.476 0.400 . 1 . . . . A 18 THR C . 34113 1 207 . 1 1 18 18 THR CA C 13 66.857 0.400 . 1 . . . . A 18 THR CA . 34113 1 208 . 1 1 18 18 THR CB C 13 68.408 0.400 . 1 . . . . A 18 THR CB . 34113 1 209 . 1 1 18 18 THR CG2 C 13 22.262 0.400 . 1 . . . . A 18 THR CG2 . 34113 1 210 . 1 1 18 18 THR N N 15 117.398 0.400 . 1 . . . . A 18 THR N . 34113 1 211 . 1 1 19 19 ASN H H 1 7.954 0.020 . 1 . . . . A 19 ASN H . 34113 1 212 . 1 1 19 19 ASN HA H 1 4.579 0.020 . 1 . . . . A 19 ASN HA . 34113 1 213 . 1 1 19 19 ASN HB2 H 1 2.986 0.020 . 1 . . . . A 19 ASN HB2 . 34113 1 214 . 1 1 19 19 ASN HB3 H 1 3.070 0.020 . 1 . . . . A 19 ASN HB3 . 34113 1 215 . 1 1 19 19 ASN HD21 H 1 7.019 0.020 . 1 . . . . A 19 ASN HD21 . 34113 1 216 . 1 1 19 19 ASN HD22 H 1 7.665 0.020 . 1 . . . . A 19 ASN HD22 . 34113 1 217 . 1 1 19 19 ASN C C 13 175.803 0.400 . 1 . . . . A 19 ASN C . 34113 1 218 . 1 1 19 19 ASN CA C 13 56.249 0.400 . 1 . . . . A 19 ASN CA . 34113 1 219 . 1 1 19 19 ASN CB C 13 38.191 0.400 . 1 . . . . A 19 ASN CB . 34113 1 220 . 1 1 19 19 ASN N N 15 120.001 0.400 . 1 . . . . A 19 ASN N . 34113 1 221 . 1 1 19 19 ASN ND2 N 15 111.794 0.400 . 1 . . . . A 19 ASN ND2 . 34113 1 222 . 1 1 20 20 CYS H H 1 7.306 0.020 . 1 . . . . A 20 CYS H . 34113 1 223 . 1 1 20 20 CYS HA H 1 4.464 0.020 . 1 . . . . A 20 CYS HA . 34113 1 224 . 1 1 20 20 CYS HB2 H 1 2.465 0.020 . 1 . . . . A 20 CYS HB2 . 34113 1 225 . 1 1 20 20 CYS HB3 H 1 2.827 0.020 . 1 . . . . A 20 CYS HB3 . 34113 1 226 . 1 1 20 20 CYS C C 13 174.674 0.400 . 1 . . . . A 20 CYS C . 34113 1 227 . 1 1 20 20 CYS CA C 13 57.713 0.400 . 1 . . . . A 20 CYS CA . 34113 1 228 . 1 1 20 20 CYS CB C 13 36.109 0.400 . 1 . . . . A 20 CYS CB . 34113 1 229 . 1 1 20 20 CYS N N 15 116.869 0.400 . 1 . . . . A 20 CYS N . 34113 1 230 . 1 1 21 21 LYS H H 1 8.508 0.020 . 1 . . . . A 21 LYS H . 34113 1 231 . 1 1 21 21 LYS HA H 1 3.544 0.020 . 1 . . . . A 21 LYS HA . 34113 1 232 . 1 1 21 21 LYS HB2 H 1 2.063 0.020 . 2 . . . . A 21 LYS HB2 . 34113 1 233 . 1 1 21 21 LYS HB3 H 1 2.063 0.020 . 2 . . . . A 21 LYS HB3 . 34113 1 234 . 1 1 21 21 LYS HG2 H 1 1.353 0.020 . 1 . . . . A 21 LYS HG2 . 34113 1 235 . 1 1 21 21 LYS HG3 H 1 1.602 0.020 . 1 . . . . A 21 LYS HG3 . 34113 1 236 . 1 1 21 21 LYS HD2 H 1 1.805 0.020 . 2 . . . . A 21 LYS HD2 . 34113 1 237 . 1 1 21 21 LYS HD3 H 1 1.805 0.020 . 2 . . . . A 21 LYS HD3 . 34113 1 238 . 1 1 21 21 LYS HE2 H 1 3.056 0.020 . 1 . . . . A 21 LYS HE2 . 34113 1 239 . 1 1 21 21 LYS HE3 H 1 3.094 0.020 . 1 . . . . A 21 LYS HE3 . 34113 1 240 . 1 1 21 21 LYS C C 13 178.010 0.400 . 1 . . . . A 21 LYS C . 34113 1 241 . 1 1 21 21 LYS CA C 13 60.930 0.400 . 1 . . . . A 21 LYS CA . 34113 1 242 . 1 1 21 21 LYS CB C 13 31.894 0.400 . 1 . . . . A 21 LYS CB . 34113 1 243 . 1 1 21 21 LYS CG C 13 25.244 0.400 . 1 . . . . A 21 LYS CG . 34113 1 244 . 1 1 21 21 LYS CD C 13 30.051 0.400 . 1 . . . . A 21 LYS CD . 34113 1 245 . 1 1 21 21 LYS CE C 13 42.247 0.400 . 1 . . . . A 21 LYS CE . 34113 1 246 . 1 1 21 21 LYS N N 15 121.202 0.400 . 1 . . . . A 21 LYS N . 34113 1 247 . 1 1 22 22 ASN H H 1 8.286 0.020 . 1 . . . . A 22 ASN H . 34113 1 248 . 1 1 22 22 ASN HA H 1 4.465 0.020 . 1 . . . . A 22 ASN HA . 34113 1 249 . 1 1 22 22 ASN HB2 H 1 3.018 0.020 . 1 . . . . A 22 ASN HB2 . 34113 1 250 . 1 1 22 22 ASN HB3 H 1 2.892 0.020 . 1 . . . . A 22 ASN HB3 . 34113 1 251 . 1 1 22 22 ASN HD21 H 1 7.652 0.020 . 1 . . . . A 22 ASN HD21 . 34113 1 252 . 1 1 22 22 ASN HD22 H 1 6.877 0.020 . 1 . . . . A 22 ASN HD22 . 34113 1 253 . 1 1 22 22 ASN CA C 13 56.282 0.400 . 1 . . . . A 22 ASN CA . 34113 1 254 . 1 1 22 22 ASN CB C 13 37.636 0.400 . 1 . . . . A 22 ASN CB . 34113 1 255 . 1 1 22 22 ASN CG C 13 175.779 0.400 . 1 . . . . A 22 ASN CG . 34113 1 256 . 1 1 22 22 ASN N N 15 116.570 0.400 . 1 . . . . A 22 ASN N . 34113 1 257 . 1 1 22 22 ASN ND2 N 15 111.474 0.400 . 1 . . . . A 22 ASN ND2 . 34113 1 258 . 1 1 23 23 VAL H H 1 8.176 0.020 . 1 . . . . A 23 VAL H . 34113 1 259 . 1 1 23 23 VAL HA H 1 3.850 0.020 . 1 . . . . A 23 VAL HA . 34113 1 260 . 1 1 23 23 VAL HB H 1 2.333 0.020 . 1 . . . . A 23 VAL HB . 34113 1 261 . 1 1 23 23 VAL HG11 H 1 1.061 0.020 . 2 . . . . A 23 VAL HG11 . 34113 1 262 . 1 1 23 23 VAL HG12 H 1 1.061 0.020 . 2 . . . . A 23 VAL HG12 . 34113 1 263 . 1 1 23 23 VAL HG13 H 1 1.061 0.020 . 2 . . . . A 23 VAL HG13 . 34113 1 264 . 1 1 23 23 VAL HG21 H 1 1.181 0.020 . 2 . . . . A 23 VAL HG21 . 34113 1 265 . 1 1 23 23 VAL HG22 H 1 1.181 0.020 . 2 . . . . A 23 VAL HG22 . 34113 1 266 . 1 1 23 23 VAL HG23 H 1 1.181 0.020 . 2 . . . . A 23 VAL HG23 . 34113 1 267 . 1 1 23 23 VAL C C 13 180.054 0.400 . 1 . . . . A 23 VAL C . 34113 1 268 . 1 1 23 23 VAL CA C 13 67.010 0.400 . 1 . . . . A 23 VAL CA . 34113 1 269 . 1 1 23 23 VAL CB C 13 31.908 0.400 . 1 . . . . A 23 VAL CB . 34113 1 270 . 1 1 23 23 VAL CG1 C 13 22.451 0.400 . 1 . . . . A 23 VAL CG1 . 34113 1 271 . 1 1 23 23 VAL CG2 C 13 23.418 0.400 . 1 . . . . A 23 VAL CG2 . 34113 1 272 . 1 1 23 23 VAL N N 15 122.323 0.400 . 1 . . . . A 23 VAL N . 34113 1 273 . 1 1 24 24 CYS H H 1 9.012 0.020 . 1 . . . . A 24 CYS H . 34113 1 274 . 1 1 24 24 CYS HA H 1 4.596 0.020 . 1 . . . . A 24 CYS HA . 34113 1 275 . 1 1 24 24 CYS HB2 H 1 2.890 0.020 . 1 . . . . A 24 CYS HB2 . 34113 1 276 . 1 1 24 24 CYS HB3 H 1 2.613 0.020 . 1 . . . . A 24 CYS HB3 . 34113 1 277 . 1 1 24 24 CYS CA C 13 59.830 0.400 . 1 . . . . A 24 CYS CA . 34113 1 278 . 1 1 24 24 CYS CB C 13 37.402 0.400 . 1 . . . . A 24 CYS CB . 34113 1 279 . 1 1 24 24 CYS N N 15 121.525 0.400 . 1 . . . . A 24 CYS N . 34113 1 280 . 1 1 25 25 ARG H H 1 8.392 0.020 . 1 . . . . A 25 ARG H . 34113 1 281 . 1 1 25 25 ARG HA H 1 5.100 0.020 . 1 . . . . A 25 ARG HA . 34113 1 282 . 1 1 25 25 ARG HB2 H 1 2.058 0.020 . 2 . . . . A 25 ARG HB2 . 34113 1 283 . 1 1 25 25 ARG HB3 H 1 2.058 0.020 . 2 . . . . A 25 ARG HB3 . 34113 1 284 . 1 1 25 25 ARG HG2 H 1 1.854 0.020 . 2 . . . . A 25 ARG HG2 . 34113 1 285 . 1 1 25 25 ARG HG3 H 1 1.854 0.020 . 2 . . . . A 25 ARG HG3 . 34113 1 286 . 1 1 25 25 ARG HD2 H 1 3.236 0.020 . 1 . . . . A 25 ARG HD2 . 34113 1 287 . 1 1 25 25 ARG HD3 H 1 3.307 0.020 . 1 . . . . A 25 ARG HD3 . 34113 1 288 . 1 1 25 25 ARG HE H 1 7.180 0.020 . 1 . . . . A 25 ARG HE . 34113 1 289 . 1 1 25 25 ARG C C 13 181.334 0.400 . 1 . . . . A 25 ARG C . 34113 1 290 . 1 1 25 25 ARG CA C 13 59.352 0.400 . 1 . . . . A 25 ARG CA . 34113 1 291 . 1 1 25 25 ARG CB C 13 29.706 0.400 . 1 . . . . A 25 ARG CB . 34113 1 292 . 1 1 25 25 ARG CG C 13 27.871 0.400 . 1 . . . . A 25 ARG CG . 34113 1 293 . 1 1 25 25 ARG CD C 13 43.768 0.400 . 1 . . . . A 25 ARG CD . 34113 1 294 . 1 1 25 25 ARG N N 15 121.674 0.400 . 1 . . . . A 25 ARG N . 34113 1 295 . 1 1 25 25 ARG NE N 15 89.623 0.400 . 1 . . . . A 25 ARG NE . 34113 1 296 . 1 1 26 26 THR H H 1 7.949 0.020 . 1 . . . . A 26 THR H . 34113 1 297 . 1 1 26 26 THR HA H 1 4.431 0.020 . 1 . . . . A 26 THR HA . 34113 1 298 . 1 1 26 26 THR HB H 1 4.476 0.020 . 1 . . . . A 26 THR HB . 34113 1 299 . 1 1 26 26 THR HG21 H 1 1.456 0.020 . 1 . . . . A 26 THR HG21 . 34113 1 300 . 1 1 26 26 THR HG22 H 1 1.456 0.020 . 1 . . . . A 26 THR HG22 . 34113 1 301 . 1 1 26 26 THR HG23 H 1 1.456 0.020 . 1 . . . . A 26 THR HG23 . 34113 1 302 . 1 1 26 26 THR C C 13 175.520 0.400 . 1 . . . . A 26 THR C . 34113 1 303 . 1 1 26 26 THR CA C 13 64.816 0.400 . 1 . . . . A 26 THR CA . 34113 1 304 . 1 1 26 26 THR CB C 13 69.287 0.400 . 1 . . . . A 26 THR CB . 34113 1 305 . 1 1 26 26 THR CG2 C 13 21.886 0.400 . 1 . . . . A 26 THR CG2 . 34113 1 306 . 1 1 26 26 THR N N 15 114.053 0.400 . 1 . . . . A 26 THR N . 34113 1 307 . 1 1 27 27 GLU H H 1 7.733 0.020 . 1 . . . . A 27 GLU H . 34113 1 308 . 1 1 27 27 GLU HA H 1 4.481 0.020 . 1 . . . . A 27 GLU HA . 34113 1 309 . 1 1 27 27 GLU HB2 H 1 2.621 0.020 . 1 . . . . A 27 GLU HB2 . 34113 1 310 . 1 1 27 27 GLU HB3 H 1 2.654 0.020 . 1 . . . . A 27 GLU HB3 . 34113 1 311 . 1 1 27 27 GLU HG2 H 1 2.207 0.020 . 1 . . . . A 27 GLU HG2 . 34113 1 312 . 1 1 27 27 GLU HG3 H 1 2.542 0.020 . 1 . . . . A 27 GLU HG3 . 34113 1 313 . 1 1 27 27 GLU C C 13 175.770 0.400 . 1 . . . . A 27 GLU C . 34113 1 314 . 1 1 27 27 GLU CA C 13 56.780 0.400 . 1 . . . . A 27 GLU CA . 34113 1 315 . 1 1 27 27 GLU CB C 13 31.349 0.400 . 1 . . . . A 27 GLU CB . 34113 1 316 . 1 1 27 27 GLU CG C 13 38.250 0.400 . 1 . . . . A 27 GLU CG . 34113 1 317 . 1 1 27 27 GLU N N 15 120.826 0.400 . 1 . . . . A 27 GLU N . 34113 1 318 . 1 1 28 28 GLY H H 1 7.749 0.020 . 1 . . . . A 28 GLY H . 34113 1 319 . 1 1 28 28 GLY HA2 H 1 3.697 0.020 . 1 . . . . A 28 GLY HA2 . 34113 1 320 . 1 1 28 28 GLY HA3 H 1 4.129 0.020 . 1 . . . . A 28 GLY HA3 . 34113 1 321 . 1 1 28 28 GLY C C 13 174.037 0.400 . 1 . . . . A 28 GLY C . 34113 1 322 . 1 1 28 28 GLY CA C 13 45.312 0.400 . 1 . . . . A 28 GLY CA . 34113 1 323 . 1 1 28 28 GLY N N 15 105.459 0.400 . 1 . . . . A 28 GLY N . 34113 1 324 . 1 1 29 29 PHE H H 1 8.152 0.020 . 1 . . . . A 29 PHE H . 34113 1 325 . 1 1 29 29 PHE HA H 1 4.976 0.020 . 1 . . . . A 29 PHE HA . 34113 1 326 . 1 1 29 29 PHE HB2 H 1 2.656 0.020 . 1 . . . . A 29 PHE HB2 . 34113 1 327 . 1 1 29 29 PHE HB3 H 1 3.513 0.020 . 1 . . . . A 29 PHE HB3 . 34113 1 328 . 1 1 29 29 PHE HD1 H 1 7.210 0.020 . 3 . . . . A 29 PHE HD1 . 34113 1 329 . 1 1 29 29 PHE HD2 H 1 7.210 0.020 . 3 . . . . A 29 PHE HD2 . 34113 1 330 . 1 1 29 29 PHE HE1 H 1 7.317 0.020 . 3 . . . . A 29 PHE HE1 . 34113 1 331 . 1 1 29 29 PHE HE2 H 1 7.317 0.020 . 3 . . . . A 29 PHE HE2 . 34113 1 332 . 1 1 29 29 PHE HZ H 1 7.256 0.020 . 1 . . . . A 29 PHE HZ . 34113 1 333 . 1 1 29 29 PHE C C 13 175.799 0.400 . 1 . . . . A 29 PHE C . 34113 1 334 . 1 1 29 29 PHE CA C 13 55.441 0.400 . 1 . . . . A 29 PHE CA . 34113 1 335 . 1 1 29 29 PHE CB C 13 40.397 0.400 . 1 . . . . A 29 PHE CB . 34113 1 336 . 1 1 29 29 PHE CD1 C 13 132.266 0.400 . 1 . . . . A 29 PHE CD1 . 34113 1 337 . 1 1 29 29 PHE CE1 C 13 132.004 0.400 . 1 . . . . A 29 PHE CE1 . 34113 1 338 . 1 1 29 29 PHE CZ C 13 130.455 0.400 . 1 . . . . A 29 PHE CZ . 34113 1 339 . 1 1 29 29 PHE N N 15 120.249 0.400 . 1 . . . . A 29 PHE N . 34113 1 340 . 1 1 30 30 PRO HA H 1 4.500 0.020 . 1 . . . . A 30 PRO HA . 34113 1 341 . 1 1 30 30 PRO HB2 H 1 2.419 0.020 . 1 . . . . A 30 PRO HB2 . 34113 1 342 . 1 1 30 30 PRO HB3 H 1 2.048 0.020 . 1 . . . . A 30 PRO HB3 . 34113 1 343 . 1 1 30 30 PRO HG2 H 1 2.264 0.020 . 2 . . . . A 30 PRO HG2 . 34113 1 344 . 1 1 30 30 PRO HG3 H 1 2.264 0.020 . 2 . . . . A 30 PRO HG3 . 34113 1 345 . 1 1 30 30 PRO HD2 H 1 4.812 0.020 . 1 . . . . A 30 PRO HD2 . 34113 1 346 . 1 1 30 30 PRO HD3 H 1 3.910 0.020 . 1 . . . . A 30 PRO HD3 . 34113 1 347 . 1 1 30 30 PRO C C 13 176.977 0.400 . 1 . . . . A 30 PRO C . 34113 1 348 . 1 1 30 30 PRO CA C 13 64.211 0.400 . 1 . . . . A 30 PRO CA . 34113 1 349 . 1 1 30 30 PRO CB C 13 32.432 0.400 . 1 . . . . A 30 PRO CB . 34113 1 350 . 1 1 30 30 PRO CG C 13 27.849 0.400 . 1 . . . . A 30 PRO CG . 34113 1 351 . 1 1 30 30 PRO CD C 13 50.365 0.400 . 1 . . . . A 30 PRO CD . 34113 1 352 . 1 1 31 31 THR H H 1 7.406 0.020 . 1 . . . . A 31 THR H . 34113 1 353 . 1 1 31 31 THR HA H 1 4.572 0.020 . 1 . . . . A 31 THR HA . 34113 1 354 . 1 1 31 31 THR HB H 1 4.216 0.020 . 1 . . . . A 31 THR HB . 34113 1 355 . 1 1 31 31 THR HG21 H 1 1.003 0.020 . 1 . . . . A 31 THR HG21 . 34113 1 356 . 1 1 31 31 THR HG22 H 1 1.003 0.020 . 1 . . . . A 31 THR HG22 . 34113 1 357 . 1 1 31 31 THR HG23 H 1 1.003 0.020 . 1 . . . . A 31 THR HG23 . 34113 1 358 . 1 1 31 31 THR C C 13 172.098 0.400 . 1 . . . . A 31 THR C . 34113 1 359 . 1 1 31 31 THR CA C 13 60.074 0.400 . 1 . . . . A 31 THR CA . 34113 1 360 . 1 1 31 31 THR CB C 13 68.830 0.400 . 1 . . . . A 31 THR CB . 34113 1 361 . 1 1 31 31 THR CG2 C 13 19.696 0.400 . 1 . . . . A 31 THR CG2 . 34113 1 362 . 1 1 31 31 THR N N 15 107.973 0.400 . 1 . . . . A 31 THR N . 34113 1 363 . 1 1 32 32 GLY H H 1 7.930 0.020 . 1 . . . . A 32 GLY H . 34113 1 364 . 1 1 32 32 GLY HA2 H 1 4.926 0.020 . 1 . . . . A 32 GLY HA2 . 34113 1 365 . 1 1 32 32 GLY HA3 H 1 4.298 0.020 . 1 . . . . A 32 GLY HA3 . 34113 1 366 . 1 1 32 32 GLY C C 13 170.558 0.400 . 1 . . . . A 32 GLY C . 34113 1 367 . 1 1 32 32 GLY CA C 13 46.844 0.400 . 1 . . . . A 32 GLY CA . 34113 1 368 . 1 1 32 32 GLY N N 15 108.438 0.400 . 1 . . . . A 32 GLY N . 34113 1 369 . 1 1 33 33 SER H H 1 9.342 0.020 . 1 . . . . A 33 SER H . 34113 1 370 . 1 1 33 33 SER HA H 1 4.296 0.020 . 1 . . . . A 33 SER HA . 34113 1 371 . 1 1 33 33 SER HB2 H 1 3.695 0.020 . 1 . . . . A 33 SER HB2 . 34113 1 372 . 1 1 33 33 SER HB3 H 1 3.796 0.020 . 1 . . . . A 33 SER HB3 . 34113 1 373 . 1 1 33 33 SER C C 13 173.579 0.400 . 1 . . . . A 33 SER C . 34113 1 374 . 1 1 33 33 SER CA C 13 58.528 0.400 . 1 . . . . A 33 SER CA . 34113 1 375 . 1 1 33 33 SER CB C 13 65.332 0.400 . 1 . . . . A 33 SER CB . 34113 1 376 . 1 1 33 33 SER N N 15 112.871 0.400 . 1 . . . . A 33 SER N . 34113 1 377 . 1 1 34 34 CYS H H 1 8.648 0.020 . 1 . . . . A 34 CYS H . 34113 1 378 . 1 1 34 34 CYS HA H 1 5.178 0.020 . 1 . . . . A 34 CYS HA . 34113 1 379 . 1 1 34 34 CYS HB2 H 1 2.576 0.020 . 2 . . . . A 34 CYS HB2 . 34113 1 380 . 1 1 34 34 CYS HB3 H 1 2.576 0.020 . 2 . . . . A 34 CYS HB3 . 34113 1 381 . 1 1 34 34 CYS C C 13 174.724 0.400 . 1 . . . . A 34 CYS C . 34113 1 382 . 1 1 34 34 CYS CA C 13 52.950 0.400 . 1 . . . . A 34 CYS CA . 34113 1 383 . 1 1 34 34 CYS CB C 13 37.303 0.400 . 1 . . . . A 34 CYS CB . 34113 1 384 . 1 1 34 34 CYS N N 15 121.829 0.400 . 1 . . . . A 34 CYS N . 34113 1 385 . 1 1 35 35 ASP H H 1 8.829 0.020 . 1 . . . . A 35 ASP H . 34113 1 386 . 1 1 35 35 ASP HA H 1 4.882 0.020 . 1 . . . . A 35 ASP HA . 34113 1 387 . 1 1 35 35 ASP HB2 H 1 2.634 0.020 . 1 . . . . A 35 ASP HB2 . 34113 1 388 . 1 1 35 35 ASP HB3 H 1 2.812 0.020 . 1 . . . . A 35 ASP HB3 . 34113 1 389 . 1 1 35 35 ASP C C 13 175.737 0.400 . 1 . . . . A 35 ASP C . 34113 1 390 . 1 1 35 35 ASP CA C 13 53.340 0.400 . 1 . . . . A 35 ASP CA . 34113 1 391 . 1 1 35 35 ASP CB C 13 42.829 0.400 . 1 . . . . A 35 ASP CB . 34113 1 392 . 1 1 35 35 ASP CG C 13 179.351 0.400 . 1 . . . . A 35 ASP CG . 34113 1 393 . 1 1 35 35 ASP N N 15 123.984 0.400 . 1 . . . . A 35 ASP N . 34113 1 394 . 1 1 36 36 PHE H H 1 8.552 0.020 . 1 . . . . A 36 PHE H . 34113 1 395 . 1 1 36 36 PHE HA H 1 4.466 0.020 . 1 . . . . A 36 PHE HA . 34113 1 396 . 1 1 36 36 PHE HB2 H 1 2.881 0.020 . 1 . . . . A 36 PHE HB2 . 34113 1 397 . 1 1 36 36 PHE HB3 H 1 3.103 0.020 . 1 . . . . A 36 PHE HB3 . 34113 1 398 . 1 1 36 36 PHE HD1 H 1 7.151 0.020 . 3 . . . . A 36 PHE HD1 . 34113 1 399 . 1 1 36 36 PHE HD2 H 1 7.151 0.020 . 3 . . . . A 36 PHE HD2 . 34113 1 400 . 1 1 36 36 PHE HE1 H 1 7.291 0.020 . 3 . . . . A 36 PHE HE1 . 34113 1 401 . 1 1 36 36 PHE HE2 H 1 7.291 0.020 . 3 . . . . A 36 PHE HE2 . 34113 1 402 . 1 1 36 36 PHE HZ H 1 7.178 0.020 . 1 . . . . A 36 PHE HZ . 34113 1 403 . 1 1 36 36 PHE C C 13 175.836 0.400 . 1 . . . . A 36 PHE C . 34113 1 404 . 1 1 36 36 PHE CA C 13 58.796 0.400 . 1 . . . . A 36 PHE CA . 34113 1 405 . 1 1 36 36 PHE CB C 13 39.234 0.400 . 1 . . . . A 36 PHE CB . 34113 1 406 . 1 1 36 36 PHE CD1 C 13 131.431 0.400 . 1 . . . . A 36 PHE CD1 . 34113 1 407 . 1 1 36 36 PHE CE2 C 13 131.552 0.400 . 1 . . . . A 36 PHE CE2 . 34113 1 408 . 1 1 36 36 PHE CZ C 13 129.918 0.400 . 1 . . . . A 36 PHE CZ . 34113 1 409 . 1 1 36 36 PHE N N 15 121.324 0.400 . 1 . . . . A 36 PHE N . 34113 1 410 . 1 1 37 37 HIS H H 1 8.233 0.020 . 1 . . . . A 37 HIS H . 34113 1 411 . 1 1 37 37 HIS HA H 1 4.554 0.020 . 1 . . . . A 37 HIS HA . 34113 1 412 . 1 1 37 37 HIS HB2 H 1 3.323 0.020 . 1 . . . . A 37 HIS HB2 . 34113 1 413 . 1 1 37 37 HIS HB3 H 1 3.199 0.020 . 1 . . . . A 37 HIS HB3 . 34113 1 414 . 1 1 37 37 HIS HD2 H 1 7.275 0.020 . 1 . . . . A 37 HIS HD2 . 34113 1 415 . 1 1 37 37 HIS HE1 H 1 8.437 0.020 . 1 . . . . A 37 HIS HE1 . 34113 1 416 . 1 1 37 37 HIS C C 13 174.115 0.400 . 1 . . . . A 37 HIS C . 34113 1 417 . 1 1 37 37 HIS CA C 13 56.462 0.400 . 1 . . . . A 37 HIS CA . 34113 1 418 . 1 1 37 37 HIS CB C 13 29.978 0.400 . 1 . . . . A 37 HIS CB . 34113 1 419 . 1 1 37 37 HIS CD2 C 13 119.986 0.400 . 1 . . . . A 37 HIS CD2 . 34113 1 420 . 1 1 37 37 HIS CE1 C 13 136.893 0.400 . 1 . . . . A 37 HIS CE1 . 34113 1 421 . 1 1 37 37 HIS N N 15 121.634 0.400 . 1 . . . . A 37 HIS N . 34113 1 422 . 1 1 38 38 VAL H H 1 7.914 0.020 . 1 . . . . A 38 VAL H . 34113 1 423 . 1 1 38 38 VAL HA H 1 3.833 0.020 . 1 . . . . A 38 VAL HA . 34113 1 424 . 1 1 38 38 VAL HB H 1 2.139 0.020 . 1 . . . . A 38 VAL HB . 34113 1 425 . 1 1 38 38 VAL HG11 H 1 0.815 0.020 . 2 . . . . A 38 VAL HG11 . 34113 1 426 . 1 1 38 38 VAL HG12 H 1 0.815 0.020 . 2 . . . . A 38 VAL HG12 . 34113 1 427 . 1 1 38 38 VAL HG13 H 1 0.815 0.020 . 2 . . . . A 38 VAL HG13 . 34113 1 428 . 1 1 38 38 VAL HG21 H 1 0.916 0.020 . 2 . . . . A 38 VAL HG21 . 34113 1 429 . 1 1 38 38 VAL HG22 H 1 0.916 0.020 . 2 . . . . A 38 VAL HG22 . 34113 1 430 . 1 1 38 38 VAL HG23 H 1 0.916 0.020 . 2 . . . . A 38 VAL HG23 . 34113 1 431 . 1 1 38 38 VAL C C 13 175.861 0.400 . 1 . . . . A 38 VAL C . 34113 1 432 . 1 1 38 38 VAL CA C 13 64.016 0.400 . 1 . . . . A 38 VAL CA . 34113 1 433 . 1 1 38 38 VAL CB C 13 32.142 0.400 . 1 . . . . A 38 VAL CB . 34113 1 434 . 1 1 38 38 VAL CG1 C 13 20.711 0.400 . 1 . . . . A 38 VAL CG1 . 34113 1 435 . 1 1 38 38 VAL CG2 C 13 21.049 0.400 . 1 . . . . A 38 VAL CG2 . 34113 1 436 . 1 1 38 38 VAL N N 15 120.453 0.400 . 1 . . . . A 38 VAL N . 34113 1 437 . 1 1 39 39 ALA H H 1 8.666 0.020 . 1 . . . . A 39 ALA H . 34113 1 438 . 1 1 39 39 ALA HA H 1 4.334 0.020 . 1 . . . . A 39 ALA HA . 34113 1 439 . 1 1 39 39 ALA HB1 H 1 1.429 0.020 . 1 . . . . A 39 ALA HB1 . 34113 1 440 . 1 1 39 39 ALA HB2 H 1 1.429 0.020 . 1 . . . . A 39 ALA HB2 . 34113 1 441 . 1 1 39 39 ALA HB3 H 1 1.429 0.020 . 1 . . . . A 39 ALA HB3 . 34113 1 442 . 1 1 39 39 ALA C C 13 177.559 0.400 . 1 . . . . A 39 ALA C . 34113 1 443 . 1 1 39 39 ALA CA C 13 53.174 0.400 . 1 . . . . A 39 ALA CA . 34113 1 444 . 1 1 39 39 ALA CB C 13 18.866 0.400 . 1 . . . . A 39 ALA CB . 34113 1 445 . 1 1 39 39 ALA N N 15 125.729 0.400 . 1 . . . . A 39 ALA N . 34113 1 446 . 1 1 40 40 GLY H H 1 7.979 0.020 . 1 . . . . A 40 GLY H . 34113 1 447 . 1 1 40 40 GLY HA2 H 1 3.831 0.020 . 1 . . . . A 40 GLY HA2 . 34113 1 448 . 1 1 40 40 GLY HA3 H 1 4.022 0.020 . 1 . . . . A 40 GLY HA3 . 34113 1 449 . 1 1 40 40 GLY C C 13 173.023 0.400 . 1 . . . . A 40 GLY C . 34113 1 450 . 1 1 40 40 GLY CA C 13 45.437 0.400 . 1 . . . . A 40 GLY CA . 34113 1 451 . 1 1 40 40 GLY N N 15 108.297 0.400 . 1 . . . . A 40 GLY N . 34113 1 452 . 1 1 41 41 ARG H H 1 8.109 0.020 . 1 . . . . A 41 ARG H . 34113 1 453 . 1 1 41 41 ARG HA H 1 4.489 0.020 . 1 . . . . A 41 ARG HA . 34113 1 454 . 1 1 41 41 ARG HB2 H 1 1.692 0.020 . 1 . . . . A 41 ARG HB2 . 34113 1 455 . 1 1 41 41 ARG HB3 H 1 1.830 0.020 . 1 . . . . A 41 ARG HB3 . 34113 1 456 . 1 1 41 41 ARG HG2 H 1 1.460 0.020 . 1 . . . . A 41 ARG HG2 . 34113 1 457 . 1 1 41 41 ARG HG3 H 1 1.655 0.020 . 1 . . . . A 41 ARG HG3 . 34113 1 458 . 1 1 41 41 ARG HD2 H 1 3.046 0.020 . 2 . . . . A 41 ARG HD2 . 34113 1 459 . 1 1 41 41 ARG HD3 H 1 3.046 0.020 . 2 . . . . A 41 ARG HD3 . 34113 1 460 . 1 1 41 41 ARG HE H 1 6.974 0.020 . 1 . . . . A 41 ARG HE . 34113 1 461 . 1 1 41 41 ARG CA C 13 56.793 0.400 . 1 . . . . A 41 ARG CA . 34113 1 462 . 1 1 41 41 ARG CB C 13 30.960 0.400 . 1 . . . . A 41 ARG CB . 34113 1 463 . 1 1 41 41 ARG CG C 13 27.904 0.400 . 1 . . . . A 41 ARG CG . 34113 1 464 . 1 1 41 41 ARG CD C 13 43.922 0.400 . 1 . . . . A 41 ARG CD . 34113 1 465 . 1 1 41 41 ARG N N 15 119.276 0.400 . 1 . . . . A 41 ARG N . 34113 1 466 . 1 1 41 41 ARG NE N 15 88.906 0.400 . 1 . . . . A 41 ARG NE . 34113 1 467 . 1 1 42 42 LYS H H 1 8.209 0.020 . 1 . . . . A 42 LYS H . 34113 1 468 . 1 1 42 42 LYS HA H 1 4.497 0.020 . 1 . . . . A 42 LYS HA . 34113 1 469 . 1 1 42 42 LYS HB2 H 1 1.496 0.020 . 2 . . . . A 42 LYS HB2 . 34113 1 470 . 1 1 42 42 LYS HB3 H 1 1.496 0.020 . 2 . . . . A 42 LYS HB3 . 34113 1 471 . 1 1 42 42 LYS HG2 H 1 1.177 0.020 . 1 . . . . A 42 LYS HG2 . 34113 1 472 . 1 1 42 42 LYS HG3 H 1 1.331 0.020 . 1 . . . . A 42 LYS HG3 . 34113 1 473 . 1 1 42 42 LYS HD2 H 1 1.494 0.020 . 2 . . . . A 42 LYS HD2 . 34113 1 474 . 1 1 42 42 LYS HD3 H 1 1.494 0.020 . 2 . . . . A 42 LYS HD3 . 34113 1 475 . 1 1 42 42 LYS HE2 H 1 2.804 0.020 . 2 . . . . A 42 LYS HE2 . 34113 1 476 . 1 1 42 42 LYS HE3 H 1 2.804 0.020 . 2 . . . . A 42 LYS HE3 . 34113 1 477 . 1 1 42 42 LYS CA C 13 54.934 0.400 . 1 . . . . A 42 LYS CA . 34113 1 478 . 1 1 42 42 LYS CB C 13 35.864 0.400 . 1 . . . . A 42 LYS CB . 34113 1 479 . 1 1 42 42 LYS CG C 13 24.980 0.400 . 1 . . . . A 42 LYS CG . 34113 1 480 . 1 1 42 42 LYS CD C 13 28.773 0.400 . 1 . . . . A 42 LYS CD . 34113 1 481 . 1 1 42 42 LYS CE C 13 42.054 0.400 . 1 . . . . A 42 LYS CE . 34113 1 482 . 1 1 42 42 LYS N N 15 121.632 0.400 . 1 . . . . A 42 LYS N . 34113 1 483 . 1 1 43 43 CYS H H 1 8.902 0.020 . 1 . . . . A 43 CYS H . 34113 1 484 . 1 1 43 43 CYS HA H 1 4.667 0.020 . 1 . . . . A 43 CYS HA . 34113 1 485 . 1 1 43 43 CYS HB2 H 1 2.044 0.020 . 1 . . . . A 43 CYS HB2 . 34113 1 486 . 1 1 43 43 CYS HB3 H 1 1.725 0.020 . 1 . . . . A 43 CYS HB3 . 34113 1 487 . 1 1 43 43 CYS CA C 13 54.830 0.400 . 1 . . . . A 43 CYS CA . 34113 1 488 . 1 1 43 43 CYS CB C 13 35.822 0.400 . 1 . . . . A 43 CYS CB . 34113 1 489 . 1 1 43 43 CYS N N 15 119.719 0.400 . 1 . . . . A 43 CYS N . 34113 1 490 . 1 1 44 44 TYR H H 1 8.534 0.020 . 1 . . . . A 44 TYR H . 34113 1 491 . 1 1 44 44 TYR HA H 1 4.435 0.020 . 1 . . . . A 44 TYR HA . 34113 1 492 . 1 1 44 44 TYR HB2 H 1 2.865 0.020 . 1 . . . . A 44 TYR HB2 . 34113 1 493 . 1 1 44 44 TYR HB3 H 1 2.205 0.020 . 1 . . . . A 44 TYR HB3 . 34113 1 494 . 1 1 44 44 TYR HD1 H 1 6.702 0.020 . 3 . . . . A 44 TYR HD1 . 34113 1 495 . 1 1 44 44 TYR HD2 H 1 6.702 0.020 . 3 . . . . A 44 TYR HD2 . 34113 1 496 . 1 1 44 44 TYR HE1 H 1 6.676 0.020 . 3 . . . . A 44 TYR HE1 . 34113 1 497 . 1 1 44 44 TYR HE2 H 1 6.676 0.020 . 3 . . . . A 44 TYR HE2 . 34113 1 498 . 1 1 44 44 TYR CA C 13 57.523 0.400 . 1 . . . . A 44 TYR CA . 34113 1 499 . 1 1 44 44 TYR CB C 13 41.338 0.400 . 1 . . . . A 44 TYR CB . 34113 1 500 . 1 1 44 44 TYR CD1 C 13 132.737 0.400 . 1 . . . . A 44 TYR CD1 . 34113 1 501 . 1 1 44 44 TYR CE1 C 13 118.181 0.400 . 1 . . . . A 44 TYR CE1 . 34113 1 502 . 1 1 44 44 TYR N N 15 120.265 0.400 . 1 . . . . A 44 TYR N . 34113 1 503 . 1 1 45 45 CYS H H 1 8.744 0.020 . 1 . . . . A 45 CYS H . 34113 1 504 . 1 1 45 45 CYS HA H 1 5.192 0.020 . 1 . . . . A 45 CYS HA . 34113 1 505 . 1 1 45 45 CYS HB2 H 1 0.991 0.020 . 1 . . . . A 45 CYS HB2 . 34113 1 506 . 1 1 45 45 CYS HB3 H 1 2.217 0.020 . 1 . . . . A 45 CYS HB3 . 34113 1 507 . 1 1 45 45 CYS C C 13 174.135 0.400 . 1 . . . . A 45 CYS C . 34113 1 508 . 1 1 45 45 CYS CA C 13 51.238 0.400 . 1 . . . . A 45 CYS CA . 34113 1 509 . 1 1 45 45 CYS CB C 13 35.871 0.400 . 1 . . . . A 45 CYS CB . 34113 1 510 . 1 1 45 45 CYS N N 15 118.501 0.400 . 1 . . . . A 45 CYS N . 34113 1 511 . 1 1 46 46 TYR H H 1 8.133 0.020 . 1 . . . . A 46 TYR H . 34113 1 512 . 1 1 46 46 TYR HA H 1 5.550 0.020 . 1 . . . . A 46 TYR HA . 34113 1 513 . 1 1 46 46 TYR HB2 H 1 2.562 0.020 . 1 . . . . A 46 TYR HB2 . 34113 1 514 . 1 1 46 46 TYR HB3 H 1 2.702 0.020 . 1 . . . . A 46 TYR HB3 . 34113 1 515 . 1 1 46 46 TYR HD1 H 1 6.775 0.020 . 3 . . . . A 46 TYR HD1 . 34113 1 516 . 1 1 46 46 TYR HD2 H 1 6.775 0.020 . 3 . . . . A 46 TYR HD2 . 34113 1 517 . 1 1 46 46 TYR HE1 H 1 6.664 0.020 . 3 . . . . A 46 TYR HE1 . 34113 1 518 . 1 1 46 46 TYR HE2 H 1 6.664 0.020 . 3 . . . . A 46 TYR HE2 . 34113 1 519 . 1 1 46 46 TYR C C 13 174.593 0.400 . 1 . . . . A 46 TYR C . 34113 1 520 . 1 1 46 46 TYR CA C 13 56.430 0.400 . 1 . . . . A 46 TYR CA . 34113 1 521 . 1 1 46 46 TYR CB C 13 42.168 0.400 . 1 . . . . A 46 TYR CB . 34113 1 522 . 1 1 46 46 TYR CD1 C 13 132.357 0.400 . 1 . . . . A 46 TYR CD1 . 34113 1 523 . 1 1 46 46 TYR CE1 C 13 118.510 0.400 . 1 . . . . A 46 TYR CE1 . 34113 1 524 . 1 1 46 46 TYR N N 15 119.783 0.400 . 1 . . . . A 46 TYR N . 34113 1 525 . 1 1 47 47 LYS H H 1 8.533 0.020 . 1 . . . . A 47 LYS H . 34113 1 526 . 1 1 47 47 LYS HA H 1 4.938 0.020 . 1 . . . . A 47 LYS HA . 34113 1 527 . 1 1 47 47 LYS HB2 H 1 2.046 0.020 . 1 . . . . A 47 LYS HB2 . 34113 1 528 . 1 1 47 47 LYS HB3 H 1 2.110 0.020 . 1 . . . . A 47 LYS HB3 . 34113 1 529 . 1 1 47 47 LYS HG2 H 1 1.430 0.020 . 1 . . . . A 47 LYS HG2 . 34113 1 530 . 1 1 47 47 LYS HG3 H 1 1.662 0.020 . 1 . . . . A 47 LYS HG3 . 34113 1 531 . 1 1 47 47 LYS HD2 H 1 1.547 0.020 . 1 . . . . A 47 LYS HD2 . 34113 1 532 . 1 1 47 47 LYS HD3 H 1 1.591 0.020 . 1 . . . . A 47 LYS HD3 . 34113 1 533 . 1 1 47 47 LYS HE2 H 1 2.852 0.020 . 1 . . . . A 47 LYS HE2 . 34113 1 534 . 1 1 47 47 LYS HE3 H 1 2.896 0.020 . 1 . . . . A 47 LYS HE3 . 34113 1 535 . 1 1 47 47 LYS C C 13 172.520 0.400 . 1 . . . . A 47 LYS C . 34113 1 536 . 1 1 47 47 LYS CA C 13 53.861 0.400 . 1 . . . . A 47 LYS CA . 34113 1 537 . 1 1 47 47 LYS CB C 13 35.001 0.400 . 1 . . . . A 47 LYS CB . 34113 1 538 . 1 1 47 47 LYS CG C 13 22.932 0.400 . 1 . . . . A 47 LYS CG . 34113 1 539 . 1 1 47 47 LYS CD C 13 29.823 0.400 . 1 . . . . A 47 LYS CD . 34113 1 540 . 1 1 47 47 LYS CE C 13 42.128 0.400 . 1 . . . . A 47 LYS CE . 34113 1 541 . 1 1 47 47 LYS N N 15 115.910 0.400 . 1 . . . . A 47 LYS N . 34113 1 542 . 1 1 48 48 PRO HA H 1 5.038 0.020 . 1 . . . . A 48 PRO HA . 34113 1 543 . 1 1 48 48 PRO HB2 H 1 2.394 0.020 . 1 . . . . A 48 PRO HB2 . 34113 1 544 . 1 1 48 48 PRO HB3 H 1 1.910 0.020 . 1 . . . . A 48 PRO HB3 . 34113 1 545 . 1 1 48 48 PRO HG2 H 1 2.194 0.020 . 1 . . . . A 48 PRO HG2 . 34113 1 546 . 1 1 48 48 PRO HG3 H 1 1.991 0.020 . 1 . . . . A 48 PRO HG3 . 34113 1 547 . 1 1 48 48 PRO HD2 H 1 3.812 0.020 . 1 . . . . A 48 PRO HD2 . 34113 1 548 . 1 1 48 48 PRO HD3 H 1 3.718 0.020 . 1 . . . . A 48 PRO HD3 . 34113 1 549 . 1 1 48 48 PRO C C 13 176.587 0.400 . 1 . . . . A 48 PRO C . 34113 1 550 . 1 1 48 48 PRO CA C 13 63.770 0.400 . 1 . . . . A 48 PRO CA . 34113 1 551 . 1 1 48 48 PRO CB C 13 31.951 0.400 . 1 . . . . A 48 PRO CB . 34113 1 552 . 1 1 48 48 PRO CG C 13 28.195 0.400 . 1 . . . . A 48 PRO CG . 34113 1 553 . 1 1 48 48 PRO CD C 13 51.094 0.400 . 1 . . . . A 48 PRO CD . 34113 1 554 . 1 1 49 49 CYS H H 1 8.693 0.020 . 1 . . . . A 49 CYS H . 34113 1 555 . 1 1 49 49 CYS HA H 1 4.981 0.020 . 1 . . . . A 49 CYS HA . 34113 1 556 . 1 1 49 49 CYS HB2 H 1 3.339 0.020 . 1 . . . . A 49 CYS HB2 . 34113 1 557 . 1 1 49 49 CYS HB3 H 1 3.129 0.020 . 1 . . . . A 49 CYS HB3 . 34113 1 558 . 1 1 49 49 CYS C C 13 170.894 0.400 . 1 . . . . A 49 CYS C . 34113 1 559 . 1 1 49 49 CYS CA C 13 53.514 0.400 . 1 . . . . A 49 CYS CA . 34113 1 560 . 1 1 49 49 CYS CB C 13 42.184 0.400 . 1 . . . . A 49 CYS CB . 34113 1 561 . 1 1 49 49 CYS N N 15 121.441 0.400 . 1 . . . . A 49 CYS N . 34113 1 562 . 1 1 50 50 PRO HA H 1 4.234 0.020 . 1 . . . . A 50 PRO HA . 34113 1 563 . 1 1 50 50 PRO HB2 H 1 1.892 0.020 . 1 . . . . A 50 PRO HB2 . 34113 1 564 . 1 1 50 50 PRO HB3 H 1 2.257 0.020 . 1 . . . . A 50 PRO HB3 . 34113 1 565 . 1 1 50 50 PRO HG2 H 1 1.969 0.020 . 1 . . . . A 50 PRO HG2 . 34113 1 566 . 1 1 50 50 PRO HG3 H 1 2.044 0.020 . 1 . . . . A 50 PRO HG3 . 34113 1 567 . 1 1 50 50 PRO HD2 H 1 3.682 0.020 . 1 . . . . A 50 PRO HD2 . 34113 1 568 . 1 1 50 50 PRO HD3 H 1 3.747 0.020 . 1 . . . . A 50 PRO HD3 . 34113 1 569 . 1 1 50 50 PRO C C 13 181.984 0.400 . 1 . . . . A 50 PRO C . 34113 1 570 . 1 1 50 50 PRO CA C 13 65.147 0.400 . 1 . . . . A 50 PRO CA . 34113 1 571 . 1 1 50 50 PRO CB C 13 32.009 0.400 . 1 . . . . A 50 PRO CB . 34113 1 572 . 1 1 50 50 PRO CG C 13 27.498 0.400 . 1 . . . . A 50 PRO CG . 34113 1 573 . 1 1 50 50 PRO CD C 13 50.404 0.400 . 1 . . . . A 50 PRO CD . 34113 1 stop_ save_