################################### # 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 17022 _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 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 17022 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 6 $CARA . . 17022 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 MET HA H 1 3.922 0.020 . 1 . . . . . 1 MET HA . 17022 1 2 . 1 1 1 1 MET HB2 H 1 1.922 0.020 . 1 . . . . . 1 MET HB2 . 17022 1 3 . 1 1 1 1 MET HB3 H 1 1.922 0.020 . 1 . . . . . 1 MET HB3 . 17022 1 4 . 1 1 1 1 MET HE1 H 1 2.045 0.020 . 1 . . . . . 1 MET HE . 17022 1 5 . 1 1 1 1 MET HE2 H 1 2.045 0.020 . 1 . . . . . 1 MET HE . 17022 1 6 . 1 1 1 1 MET HE3 H 1 2.045 0.020 . 1 . . . . . 1 MET HE . 17022 1 7 . 1 1 1 1 MET HG2 H 1 2.493 0.020 . 2 . . . . . 1 MET HG2 . 17022 1 8 . 1 1 1 1 MET HG3 H 1 2.374 0.020 . 2 . . . . . 1 MET HG3 . 17022 1 9 . 1 1 1 1 MET C C 13 172.233 0.200 . 1 . . . . . 1 MET C . 17022 1 10 . 1 1 1 1 MET CA C 13 55.276 0.200 . 1 . . . . . 1 MET CA . 17022 1 11 . 1 1 1 1 MET CB C 13 34.929 0.200 . 1 . . . . . 1 MET CB . 17022 1 12 . 1 1 1 1 MET CE C 13 17.355 0.200 . 1 . . . . . 1 MET CE . 17022 1 13 . 1 1 1 1 MET CG C 13 31.564 0.200 . 1 . . . . . 1 MET CG . 17022 1 14 . 1 1 2 2 LYS H H 1 8.671 0.020 . 1 . . . . . 2 LYS H . 17022 1 15 . 1 1 2 2 LYS HA H 1 4.288 0.020 . 1 . . . . . 2 LYS HA . 17022 1 16 . 1 1 2 2 LYS HB2 H 1 1.809 0.020 . 2 . . . . . 2 LYS HB2 . 17022 1 17 . 1 1 2 2 LYS HB3 H 1 1.759 0.020 . 2 . . . . . 2 LYS HB3 . 17022 1 18 . 1 1 2 2 LYS HD2 H 1 1.821 0.020 . 2 . . . . . 2 LYS HD2 . 17022 1 19 . 1 1 2 2 LYS HD3 H 1 1.788 0.020 . 2 . . . . . 2 LYS HD3 . 17022 1 20 . 1 1 2 2 LYS HE2 H 1 3.080 0.020 . 1 . . . . . 2 LYS HE2 . 17022 1 21 . 1 1 2 2 LYS HE3 H 1 3.080 0.020 . 1 . . . . . 2 LYS HE3 . 17022 1 22 . 1 1 2 2 LYS HG2 H 1 1.577 0.020 . 2 . . . . . 2 LYS HG2 . 17022 1 23 . 1 1 2 2 LYS HG3 H 1 1.538 0.020 . 2 . . . . . 2 LYS HG3 . 17022 1 24 . 1 1 2 2 LYS C C 13 176.731 0.200 . 1 . . . . . 2 LYS C . 17022 1 25 . 1 1 2 2 LYS CA C 13 56.022 0.200 . 1 . . . . . 2 LYS CA . 17022 1 26 . 1 1 2 2 LYS CB C 13 33.087 0.200 . 1 . . . . . 2 LYS CB . 17022 1 27 . 1 1 2 2 LYS CD C 13 29.272 0.200 . 1 . . . . . 2 LYS CD . 17022 1 28 . 1 1 2 2 LYS CE C 13 41.842 0.200 . 1 . . . . . 2 LYS CE . 17022 1 29 . 1 1 2 2 LYS CG C 13 24.653 0.200 . 1 . . . . . 2 LYS CG . 17022 1 30 . 1 1 2 2 LYS N N 15 124.086 0.200 . 1 . . . . . 2 LYS N . 17022 1 31 . 1 1 3 3 ASP H H 1 8.597 0.020 . 1 . . . . . 3 ASP H . 17022 1 32 . 1 1 3 3 ASP HA H 1 4.338 0.020 . 1 . . . . . 3 ASP HA . 17022 1 33 . 1 1 3 3 ASP HB2 H 1 2.716 0.020 . 1 . . . . . 3 ASP HB2 . 17022 1 34 . 1 1 3 3 ASP HB3 H 1 2.716 0.020 . 1 . . . . . 3 ASP HB3 . 17022 1 35 . 1 1 3 3 ASP C C 13 176.145 0.200 . 1 . . . . . 3 ASP C . 17022 1 36 . 1 1 3 3 ASP CA C 13 55.318 0.200 . 1 . . . . . 3 ASP CA . 17022 1 37 . 1 1 3 3 ASP CB C 13 40.431 0.200 . 1 . . . . . 3 ASP CB . 17022 1 38 . 1 1 3 3 ASP N N 15 128.425 0.200 . 1 . . . . . 3 ASP N . 17022 1 39 . 1 1 4 4 GLY H H 1 8.561 0.020 . 1 . . . . . 4 GLY H . 17022 1 40 . 1 1 4 4 GLY HA2 H 1 4.138 0.020 . 2 . . . . . 4 GLY HA2 . 17022 1 41 . 1 1 4 4 GLY HA3 H 1 3.830 0.020 . 2 . . . . . 4 GLY HA3 . 17022 1 42 . 1 1 4 4 GLY C C 13 170.930 0.200 . 1 . . . . . 4 GLY C . 17022 1 43 . 1 1 4 4 GLY CA C 13 44.621 0.200 . 1 . . . . . 4 GLY CA . 17022 1 44 . 1 1 4 4 GLY N N 15 107.914 0.200 . 1 . . . . . 4 GLY N . 17022 1 45 . 1 1 5 5 THR H H 1 7.953 0.020 . 1 . . . . . 5 THR H . 17022 1 46 . 1 1 5 5 THR HA H 1 5.035 0.020 . 1 . . . . . 5 THR HA . 17022 1 47 . 1 1 5 5 THR HB H 1 3.709 0.020 . 1 . . . . . 5 THR HB . 17022 1 48 . 1 1 5 5 THR HG21 H 1 1.076 0.020 . 1 . . . . . 5 THR HG2 . 17022 1 49 . 1 1 5 5 THR HG22 H 1 1.076 0.020 . 1 . . . . . 5 THR HG2 . 17022 1 50 . 1 1 5 5 THR HG23 H 1 1.076 0.020 . 1 . . . . . 5 THR HG2 . 17022 1 51 . 1 1 5 5 THR C C 13 173.625 0.200 . 1 . . . . . 5 THR C . 17022 1 52 . 1 1 5 5 THR CA C 13 61.878 0.200 . 1 . . . . . 5 THR CA . 17022 1 53 . 1 1 5 5 THR CB C 13 69.860 0.200 . 1 . . . . . 5 THR CB . 17022 1 54 . 1 1 5 5 THR CG2 C 13 21.952 0.200 . 1 . . . . . 5 THR CG2 . 17022 1 55 . 1 1 5 5 THR N N 15 116.066 0.200 . 1 . . . . . 5 THR N . 17022 1 56 . 1 1 6 6 TYR H H 1 9.718 0.020 . 1 . . . . . 6 TYR H . 17022 1 57 . 1 1 6 6 TYR HA H 1 4.745 0.020 . 1 . . . . . 6 TYR HA . 17022 1 58 . 1 1 6 6 TYR HB2 H 1 2.425 0.020 . 2 . . . . . 6 TYR HB2 . 17022 1 59 . 1 1 6 6 TYR HB3 H 1 3.048 0.020 . 2 . . . . . 6 TYR HB3 . 17022 1 60 . 1 1 6 6 TYR HD1 H 1 7.069 0.020 . 1 . . . . . 6 TYR HD1 . 17022 1 61 . 1 1 6 6 TYR HD2 H 1 7.069 0.020 . 1 . . . . . 6 TYR HD2 . 17022 1 62 . 1 1 6 6 TYR HE1 H 1 6.586 0.020 . 1 . . . . . 6 TYR HE1 . 17022 1 63 . 1 1 6 6 TYR HE2 H 1 6.586 0.020 . 1 . . . . . 6 TYR HE2 . 17022 1 64 . 1 1 6 6 TYR C C 13 173.625 0.200 . 1 . . . . . 6 TYR C . 17022 1 65 . 1 1 6 6 TYR CA C 13 57.590 0.200 . 1 . . . . . 6 TYR CA . 17022 1 66 . 1 1 6 6 TYR CB C 13 40.588 0.200 . 1 . . . . . 6 TYR CB . 17022 1 67 . 1 1 6 6 TYR CD1 C 13 133.534 0.200 . 1 . . . . . 6 TYR CD1 . 17022 1 68 . 1 1 6 6 TYR CE1 C 13 116.705 0.200 . 1 . . . . . 6 TYR CE1 . 17022 1 69 . 1 1 6 6 TYR N N 15 127.899 0.200 . 1 . . . . . 6 TYR N . 17022 1 70 . 1 1 7 7 TYR H H 1 8.832 0.020 . 1 . . . . . 7 TYR H . 17022 1 71 . 1 1 7 7 TYR HA H 1 5.769 0.020 . 1 . . . . . 7 TYR HA . 17022 1 72 . 1 1 7 7 TYR HB2 H 1 2.940 0.020 . 2 . . . . . 7 TYR HB2 . 17022 1 73 . 1 1 7 7 TYR HB3 H 1 2.699 0.020 . 2 . . . . . 7 TYR HB3 . 17022 1 74 . 1 1 7 7 TYR HD1 H 1 7.158 0.020 . 1 . . . . . 7 TYR HD1 . 17022 1 75 . 1 1 7 7 TYR HD2 H 1 7.158 0.020 . 1 . . . . . 7 TYR HD2 . 17022 1 76 . 1 1 7 7 TYR HE1 H 1 6.583 0.020 . 1 . . . . . 7 TYR HE1 . 17022 1 77 . 1 1 7 7 TYR HE2 H 1 6.583 0.020 . 1 . . . . . 7 TYR HE2 . 17022 1 78 . 1 1 7 7 TYR C C 13 174.446 0.200 . 1 . . . . . 7 TYR C . 17022 1 79 . 1 1 7 7 TYR CA C 13 56.427 0.200 . 1 . . . . . 7 TYR CA . 17022 1 80 . 1 1 7 7 TYR CB C 13 43.244 0.200 . 1 . . . . . 7 TYR CB . 17022 1 81 . 1 1 7 7 TYR CD1 C 13 133.379 0.200 . 1 . . . . . 7 TYR CD1 . 17022 1 82 . 1 1 7 7 TYR CE1 C 13 117.136 0.200 . 1 . . . . . 7 TYR CE1 . 17022 1 83 . 1 1 7 7 TYR N N 15 124.218 0.200 . 1 . . . . . 7 TYR N . 17022 1 84 . 1 1 8 8 ALA H H 1 8.121 0.020 . 1 . . . . . 8 ALA H . 17022 1 85 . 1 1 8 8 ALA HA H 1 4.279 0.020 . 1 . . . . . 8 ALA HA . 17022 1 86 . 1 1 8 8 ALA HB1 H 1 1.169 0.020 . 1 . . . . . 8 ALA HB . 17022 1 87 . 1 1 8 8 ALA HB2 H 1 1.169 0.020 . 1 . . . . . 8 ALA HB . 17022 1 88 . 1 1 8 8 ALA HB3 H 1 1.169 0.020 . 1 . . . . . 8 ALA HB . 17022 1 89 . 1 1 8 8 ALA C C 13 173.157 0.200 . 1 . . . . . 8 ALA C . 17022 1 90 . 1 1 8 8 ALA CA C 13 51.275 0.200 . 1 . . . . . 8 ALA CA . 17022 1 91 . 1 1 8 8 ALA CB C 13 23.868 0.200 . 1 . . . . . 8 ALA CB . 17022 1 92 . 1 1 8 8 ALA N N 15 127.045 0.200 . 1 . . . . . 8 ALA N . 17022 1 93 . 1 1 9 9 GLU H H 1 8.217 0.020 . 1 . . . . . 9 GLU H . 17022 1 94 . 1 1 9 9 GLU HA H 1 5.153 0.020 . 1 . . . . . 9 GLU HA . 17022 1 95 . 1 1 9 9 GLU HB2 H 1 1.809 0.020 . 2 . . . . . 9 GLU HB2 . 17022 1 96 . 1 1 9 9 GLU HB3 H 1 1.967 0.020 . 2 . . . . . 9 GLU HB3 . 17022 1 97 . 1 1 9 9 GLU HG2 H 1 2.280 0.020 . 2 . . . . . 9 GLU HG2 . 17022 1 98 . 1 1 9 9 GLU HG3 H 1 2.073 0.020 . 2 . . . . . 9 GLU HG3 . 17022 1 99 . 1 1 9 9 GLU C C 13 175.383 0.200 . 1 . . . . . 9 GLU C . 17022 1 100 . 1 1 9 9 GLU CA C 13 52.667 0.200 . 1 . . . . . 9 GLU CA . 17022 1 101 . 1 1 9 9 GLU CB C 13 33.400 0.200 . 1 . . . . . 9 GLU CB . 17022 1 102 . 1 1 9 9 GLU CG C 13 34.492 0.200 . 1 . . . . . 9 GLU CG . 17022 1 103 . 1 1 9 9 GLU N N 15 113.765 0.200 . 1 . . . . . 9 GLU N . 17022 1 104 . 1 1 10 10 ALA H H 1 8.517 0.020 . 1 . . . . . 10 ALA H . 17022 1 105 . 1 1 10 10 ALA HA H 1 4.175 0.020 . 1 . . . . . 10 ALA HA . 17022 1 106 . 1 1 10 10 ALA HB1 H 1 1.658 0.020 . 1 . . . . . 10 ALA HB . 17022 1 107 . 1 1 10 10 ALA HB2 H 1 1.658 0.020 . 1 . . . . . 10 ALA HB . 17022 1 108 . 1 1 10 10 ALA HB3 H 1 1.658 0.020 . 1 . . . . . 10 ALA HB . 17022 1 109 . 1 1 10 10 ALA C C 13 176.087 0.200 . 1 . . . . . 10 ALA C . 17022 1 110 . 1 1 10 10 ALA CA C 13 51.888 0.200 . 1 . . . . . 10 ALA CA . 17022 1 111 . 1 1 10 10 ALA CB C 13 20.092 0.200 . 1 . . . . . 10 ALA CB . 17022 1 112 . 1 1 10 10 ALA N N 15 124.021 0.200 . 1 . . . . . 10 ALA N . 17022 1 113 . 1 1 11 11 ASP H H 1 8.392 0.020 . 1 . . . . . 11 ASP H . 17022 1 114 . 1 1 11 11 ASP HA H 1 4.236 0.020 . 1 . . . . . 11 ASP HA . 17022 1 115 . 1 1 11 11 ASP HB2 H 1 2.684 0.020 . 2 . . . . . 11 ASP HB2 . 17022 1 116 . 1 1 11 11 ASP HB3 H 1 2.516 0.020 . 2 . . . . . 11 ASP HB3 . 17022 1 117 . 1 1 11 11 ASP C C 13 175.266 0.200 . 1 . . . . . 11 ASP C . 17022 1 118 . 1 1 11 11 ASP CA C 13 56.540 0.200 . 1 . . . . . 11 ASP CA . 17022 1 119 . 1 1 11 11 ASP CB C 13 41.030 0.200 . 1 . . . . . 11 ASP CB . 17022 1 120 . 1 1 11 11 ASP N N 15 117.972 0.200 . 1 . . . . . 11 ASP N . 17022 1 121 . 1 1 12 12 ASP H H 1 7.660 0.020 . 1 . . . . . 12 ASP H . 17022 1 122 . 1 1 12 12 ASP HA H 1 4.653 0.020 . 1 . . . . . 12 ASP HA . 17022 1 123 . 1 1 12 12 ASP HB2 H 1 2.634 0.020 . 2 . . . . . 12 ASP HB2 . 17022 1 124 . 1 1 12 12 ASP HB3 H 1 2.499 0.020 . 2 . . . . . 12 ASP HB3 . 17022 1 125 . 1 1 12 12 ASP C C 13 175.090 0.200 . 1 . . . . . 12 ASP C . 17022 1 126 . 1 1 12 12 ASP CA C 13 51.578 0.200 . 1 . . . . . 12 ASP CA . 17022 1 127 . 1 1 12 12 ASP CB C 13 43.765 0.200 . 1 . . . . . 12 ASP CB . 17022 1 128 . 1 1 12 12 ASP N N 15 114.159 0.200 . 1 . . . . . 12 ASP N . 17022 1 129 . 1 1 13 13 PHE H H 1 8.685 0.020 . 1 . . . . . 13 PHE H . 17022 1 130 . 1 1 13 13 PHE HA H 1 4.155 0.020 . 1 . . . . . 13 PHE HA . 17022 1 131 . 1 1 13 13 PHE HB2 H 1 2.857 0.020 . 2 . . . . . 13 PHE HB2 . 17022 1 132 . 1 1 13 13 PHE HB3 H 1 2.691 0.020 . 2 . . . . . 13 PHE HB3 . 17022 1 133 . 1 1 13 13 PHE HD1 H 1 7.236 0.020 . 1 . . . . . 13 PHE HD1 . 17022 1 134 . 1 1 13 13 PHE HD2 H 1 7.236 0.020 . 1 . . . . . 13 PHE HD2 . 17022 1 135 . 1 1 13 13 PHE HE1 H 1 7.197 0.020 . 1 . . . . . 13 PHE HE1 . 17022 1 136 . 1 1 13 13 PHE HE2 H 1 7.197 0.020 . 1 . . . . . 13 PHE HE2 . 17022 1 137 . 1 1 13 13 PHE HZ H 1 7.282 0.020 . 1 . . . . . 13 PHE HZ . 17022 1 138 . 1 1 13 13 PHE C C 13 175.911 0.200 . 1 . . . . . 13 PHE C . 17022 1 139 . 1 1 13 13 PHE CA C 13 58.138 0.200 . 1 . . . . . 13 PHE CA . 17022 1 140 . 1 1 13 13 PHE CB C 13 40.275 0.200 . 1 . . . . . 13 PHE CB . 17022 1 141 . 1 1 13 13 PHE CD1 C 13 133.208 0.200 . 1 . . . . . 13 PHE CD1 . 17022 1 142 . 1 1 13 13 PHE CE1 C 13 131.324 0.200 . 1 . . . . . 13 PHE CE1 . 17022 1 143 . 1 1 13 13 PHE CZ C 13 129.717 0.200 . 1 . . . . . 13 PHE CZ . 17022 1 144 . 1 1 13 13 PHE N N 15 118.695 0.200 . 1 . . . . . 13 PHE N . 17022 1 145 . 1 1 14 14 ASP H H 1 8.883 0.020 . 1 . . . . . 14 ASP H . 17022 1 146 . 1 1 14 14 ASP HA H 1 4.670 0.020 . 1 . . . . . 14 ASP HA . 17022 1 147 . 1 1 14 14 ASP HB2 H 1 3.459 0.020 . 2 . . . . . 14 ASP HB2 . 17022 1 148 . 1 1 14 14 ASP HB3 H 1 2.924 0.020 . 2 . . . . . 14 ASP HB3 . 17022 1 149 . 1 1 14 14 ASP C C 13 177.727 0.200 . 1 . . . . . 14 ASP C . 17022 1 150 . 1 1 14 14 ASP CA C 13 52.713 0.200 . 1 . . . . . 14 ASP CA . 17022 1 151 . 1 1 14 14 ASP CB C 13 41.130 0.200 . 1 . . . . . 14 ASP CB . 17022 1 152 . 1 1 14 14 ASP N N 15 122.640 0.200 . 1 . . . . . 14 ASP N . 17022 1 153 . 1 1 15 15 GLU H H 1 9.183 0.020 . 1 . . . . . 15 GLU H . 17022 1 154 . 1 1 15 15 GLU HA H 1 4.204 0.020 . 1 . . . . . 15 GLU HA . 17022 1 155 . 1 1 15 15 GLU HB2 H 1 2.192 0.020 . 2 . . . . . 15 GLU HB2 . 17022 1 156 . 1 1 15 15 GLU HB3 H 1 2.149 0.020 . 2 . . . . . 15 GLU HB3 . 17022 1 157 . 1 1 15 15 GLU HG2 H 1 2.439 0.020 . 2 . . . . . 15 GLU HG2 . 17022 1 158 . 1 1 15 15 GLU HG3 H 1 2.400 0.020 . 2 . . . . . 15 GLU HG3 . 17022 1 159 . 1 1 15 15 GLU C C 13 177.551 0.200 . 1 . . . . . 15 GLU C . 17022 1 160 . 1 1 15 15 GLU CA C 13 59.179 0.200 . 1 . . . . . 15 GLU CA . 17022 1 161 . 1 1 15 15 GLU CB C 13 28.578 0.200 . 1 . . . . . 15 GLU CB . 17022 1 162 . 1 1 15 15 GLU CG C 13 36.037 0.200 . 1 . . . . . 15 GLU CG . 17022 1 163 . 1 1 15 15 GLU N N 15 117.907 0.200 . 1 . . . . . 15 GLU N . 17022 1 164 . 1 1 16 16 SER H H 1 8.466 0.020 . 1 . . . . . 16 SER H . 17022 1 165 . 1 1 16 16 SER HA H 1 4.708 0.020 . 1 . . . . . 16 SER HA . 17022 1 166 . 1 1 16 16 SER HB2 H 1 4.272 0.020 . 2 . . . . . 16 SER HB2 . 17022 1 167 . 1 1 16 16 SER HB3 H 1 4.223 0.020 . 2 . . . . . 16 SER HB3 . 17022 1 168 . 1 1 16 16 SER C C 13 173.508 0.200 . 1 . . . . . 16 SER C . 17022 1 169 . 1 1 16 16 SER CA C 13 58.187 0.200 . 1 . . . . . 16 SER CA . 17022 1 170 . 1 1 16 16 SER CB C 13 64.579 0.200 . 1 . . . . . 16 SER CB . 17022 1 171 . 1 1 16 16 SER N N 15 115.934 0.200 . 1 . . . . . 16 SER N . 17022 1 172 . 1 1 17 17 GLY H H 1 8.239 0.020 . 1 . . . . . 17 GLY H . 17022 1 173 . 1 1 17 17 GLY HA2 H 1 3.963 0.020 . 2 . . . . . 17 GLY HA2 . 17022 1 174 . 1 1 17 17 GLY HA3 H 1 3.381 0.020 . 2 . . . . . 17 GLY HA3 . 17022 1 175 . 1 1 17 17 GLY C C 13 172.512 0.200 . 1 . . . . . 17 GLY C . 17022 1 176 . 1 1 17 17 GLY CA C 13 45.286 0.200 . 1 . . . . . 17 GLY CA . 17022 1 177 . 1 1 17 17 GLY N N 15 109.031 0.200 . 1 . . . . . 17 GLY N . 17022 1 178 . 1 1 18 18 TRP H H 1 8.297 0.020 . 1 . . . . . 18 TRP H . 17022 1 179 . 1 1 18 18 TRP HA H 1 5.420 0.020 . 1 . . . . . 18 TRP HA . 17022 1 180 . 1 1 18 18 TRP HB2 H 1 3.248 0.020 . 2 . . . . . 18 TRP HB2 . 17022 1 181 . 1 1 18 18 TRP HB3 H 1 2.732 0.020 . 2 . . . . . 18 TRP HB3 . 17022 1 182 . 1 1 18 18 TRP HD1 H 1 7.326 0.020 . 1 . . . . . 18 TRP HD1 . 17022 1 183 . 1 1 18 18 TRP HE1 H 1 10.134 0.020 . 1 . . . . . 18 TRP HE1 . 17022 1 184 . 1 1 18 18 TRP HZ2 H 1 7.313 0.020 . 1 . . . . . 18 TRP HZ2 . 17022 1 185 . 1 1 18 18 TRP C C 13 176.673 0.200 . 1 . . . . . 18 TRP C . 17022 1 186 . 1 1 18 18 TRP CA C 13 56.176 0.200 . 1 . . . . . 18 TRP CA . 17022 1 187 . 1 1 18 18 TRP CB C 13 32.618 0.200 . 1 . . . . . 18 TRP CB . 17022 1 188 . 1 1 18 18 TRP CD1 C 13 129.048 0.200 . 1 . . . . . 18 TRP CD1 . 17022 1 189 . 1 1 18 18 TRP CZ2 C 13 114.413 0.200 . 1 . . . . . 18 TRP CZ2 . 17022 1 190 . 1 1 18 18 TRP N N 15 119.221 0.200 . 1 . . . . . 18 TRP N . 17022 1 191 . 1 1 18 18 TRP NE1 N 15 128.902 0.200 . 1 . . . . . 18 TRP NE1 . 17022 1 192 . 1 1 19 19 LYS H H 1 10.122 0.020 . 1 . . . . . 19 LYS H . 17022 1 193 . 1 1 19 19 LYS HA H 1 4.731 0.020 . 1 . . . . . 19 LYS HA . 17022 1 194 . 1 1 19 19 LYS HB2 H 1 0.878 0.020 . 2 . . . . . 19 LYS HB2 . 17022 1 195 . 1 1 19 19 LYS HB3 H 1 1.507 0.020 . 2 . . . . . 19 LYS HB3 . 17022 1 196 . 1 1 19 19 LYS HD2 H 1 1.581 0.020 . 1 . . . . . 19 LYS HD2 . 17022 1 197 . 1 1 19 19 LYS HD3 H 1 1.581 0.020 . 1 . . . . . 19 LYS HD3 . 17022 1 198 . 1 1 19 19 LYS HE2 H 1 2.965 0.020 . 1 . . . . . 19 LYS HE2 . 17022 1 199 . 1 1 19 19 LYS HE3 H 1 2.965 0.020 . 1 . . . . . 19 LYS HE3 . 17022 1 200 . 1 1 19 19 LYS HG2 H 1 1.205 0.020 . 1 . . . . . 19 LYS HG2 . 17022 1 201 . 1 1 19 19 LYS HG3 H 1 1.205 0.020 . 1 . . . . . 19 LYS HG3 . 17022 1 202 . 1 1 19 19 LYS C C 13 174.153 0.200 . 1 . . . . . 19 LYS C . 17022 1 203 . 1 1 19 19 LYS CA C 13 54.770 0.200 . 1 . . . . . 19 LYS CA . 17022 1 204 . 1 1 19 19 LYS CB C 13 35.019 0.200 . 1 . . . . . 19 LYS CB . 17022 1 205 . 1 1 19 19 LYS CD C 13 28.695 0.200 . 1 . . . . . 19 LYS CD . 17022 1 206 . 1 1 19 19 LYS CE C 13 42.155 0.200 . 1 . . . . . 19 LYS CE . 17022 1 207 . 1 1 19 19 LYS CG C 13 24.775 0.200 . 1 . . . . . 19 LYS CG . 17022 1 208 . 1 1 19 19 LYS N N 15 128.294 0.200 . 1 . . . . . 19 LYS N . 17022 1 209 . 1 1 20 20 ASP H H 1 8.195 0.020 . 1 . . . . . 20 ASP H . 17022 1 210 . 1 1 20 20 ASP HA H 1 5.058 0.020 . 1 . . . . . 20 ASP HA . 17022 1 211 . 1 1 20 20 ASP HB2 H 1 2.643 0.020 . 2 . . . . . 20 ASP HB2 . 17022 1 212 . 1 1 20 20 ASP HB3 H 1 2.474 0.020 . 2 . . . . . 20 ASP HB3 . 17022 1 213 . 1 1 20 20 ASP C C 13 174.270 0.200 . 1 . . . . . 20 ASP C . 17022 1 214 . 1 1 20 20 ASP CA C 13 55.945 0.200 . 1 . . . . . 20 ASP CA . 17022 1 215 . 1 1 20 20 ASP CB C 13 44.287 0.200 . 1 . . . . . 20 ASP CB . 17022 1 216 . 1 1 20 20 ASP N N 15 127.702 0.200 . 1 . . . . . 20 ASP N . 17022 1 217 . 1 1 21 21 THR H H 1 9.447 0.020 . 1 . . . . . 21 THR H . 17022 1 218 . 1 1 21 21 THR HA H 1 4.986 0.020 . 1 . . . . . 21 THR HA . 17022 1 219 . 1 1 21 21 THR HB H 1 4.356 0.020 . 1 . . . . . 21 THR HB . 17022 1 220 . 1 1 21 21 THR HG21 H 1 1.357 0.020 . 1 . . . . . 21 THR HG2 . 17022 1 221 . 1 1 21 21 THR HG22 H 1 1.357 0.020 . 1 . . . . . 21 THR HG2 . 17022 1 222 . 1 1 21 21 THR HG23 H 1 1.357 0.020 . 1 . . . . . 21 THR HG2 . 17022 1 223 . 1 1 21 21 THR C C 13 172.981 0.200 . 1 . . . . . 21 THR C . 17022 1 224 . 1 1 21 21 THR CA C 13 59.896 0.200 . 1 . . . . . 21 THR CA . 17022 1 225 . 1 1 21 21 THR CB C 13 72.204 0.200 . 1 . . . . . 21 THR CB . 17022 1 226 . 1 1 21 21 THR CG2 C 13 21.958 0.200 . 1 . . . . . 21 THR CG2 . 17022 1 227 . 1 1 21 21 THR N N 15 111.924 0.200 . 1 . . . . . 21 THR N . 17022 1 228 . 1 1 22 22 VAL H H 1 8.744 0.020 . 1 . . . . . 22 VAL H . 17022 1 229 . 1 1 22 22 VAL HA H 1 5.130 0.020 . 1 . . . . . 22 VAL HA . 17022 1 230 . 1 1 22 22 VAL HB H 1 1.451 0.020 . 1 . . . . . 22 VAL HB . 17022 1 231 . 1 1 22 22 VAL HG11 H 1 0.466 0.020 . 2 . . . . . 22 VAL HG1 . 17022 1 232 . 1 1 22 22 VAL HG12 H 1 0.466 0.020 . 2 . . . . . 22 VAL HG1 . 17022 1 233 . 1 1 22 22 VAL HG13 H 1 0.466 0.020 . 2 . . . . . 22 VAL HG1 . 17022 1 234 . 1 1 22 22 VAL HG21 H 1 0.713 0.020 . 2 . . . . . 22 VAL HG2 . 17022 1 235 . 1 1 22 22 VAL HG22 H 1 0.713 0.020 . 2 . . . . . 22 VAL HG2 . 17022 1 236 . 1 1 22 22 VAL HG23 H 1 0.713 0.020 . 2 . . . . . 22 VAL HG2 . 17022 1 237 . 1 1 22 22 VAL C C 13 173.039 0.200 . 1 . . . . . 22 VAL C . 17022 1 238 . 1 1 22 22 VAL CA C 13 61.505 0.200 . 1 . . . . . 22 VAL CA . 17022 1 239 . 1 1 22 22 VAL CB C 13 36.056 0.200 . 1 . . . . . 22 VAL CB . 17022 1 240 . 1 1 22 22 VAL CG1 C 13 21.804 0.200 . 1 . . . . . 22 VAL CG1 . 17022 1 241 . 1 1 22 22 VAL CG2 C 13 23.653 0.200 . 1 . . . . . 22 VAL CG2 . 17022 1 242 . 1 1 22 22 VAL N N 15 120.273 0.200 . 1 . . . . . 22 VAL N . 17022 1 243 . 1 1 23 23 THR H H 1 8.120 0.020 . 1 . . . . . 23 THR H . 17022 1 244 . 1 1 23 23 THR HA H 1 5.302 0.020 . 1 . . . . . 23 THR HA . 17022 1 245 . 1 1 23 23 THR HB H 1 4.106 0.020 . 1 . . . . . 23 THR HB . 17022 1 246 . 1 1 23 23 THR HG21 H 1 1.276 0.020 . 1 . . . . . 23 THR HG2 . 17022 1 247 . 1 1 23 23 THR HG22 H 1 1.276 0.020 . 1 . . . . . 23 THR HG2 . 17022 1 248 . 1 1 23 23 THR HG23 H 1 1.276 0.020 . 1 . . . . . 23 THR HG2 . 17022 1 249 . 1 1 23 23 THR C C 13 174.739 0.200 . 1 . . . . . 23 THR C . 17022 1 250 . 1 1 23 23 THR CA C 13 61.728 0.200 . 1 . . . . . 23 THR CA . 17022 1 251 . 1 1 23 23 THR CB C 13 70.721 0.200 . 1 . . . . . 23 THR CB . 17022 1 252 . 1 1 23 23 THR CG2 C 13 21.340 0.200 . 1 . . . . . 23 THR CG2 . 17022 1 253 . 1 1 23 23 THR N N 15 120.602 0.200 . 1 . . . . . 23 THR N . 17022 1 254 . 1 1 24 24 ILE H H 1 9.813 0.020 . 1 . . . . . 24 ILE H . 17022 1 255 . 1 1 24 24 ILE HA H 1 4.820 0.020 . 1 . . . . . 24 ILE HA . 17022 1 256 . 1 1 24 24 ILE HB H 1 1.643 0.020 . 1 . . . . . 24 ILE HB . 17022 1 257 . 1 1 24 24 ILE HD11 H 1 0.614 0.020 . 1 . . . . . 24 ILE HD1 . 17022 1 258 . 1 1 24 24 ILE HD12 H 1 0.614 0.020 . 1 . . . . . 24 ILE HD1 . 17022 1 259 . 1 1 24 24 ILE HD13 H 1 0.614 0.020 . 1 . . . . . 24 ILE HD1 . 17022 1 260 . 1 1 24 24 ILE HG12 H 1 1.503 0.020 . 2 . . . . . 24 ILE HG12 . 17022 1 261 . 1 1 24 24 ILE HG13 H 1 0.930 0.020 . 2 . . . . . 24 ILE HG13 . 17022 1 262 . 1 1 24 24 ILE HG21 H 1 0.962 0.020 . 1 . . . . . 24 ILE HG2 . 17022 1 263 . 1 1 24 24 ILE HG22 H 1 0.962 0.020 . 1 . . . . . 24 ILE HG2 . 17022 1 264 . 1 1 24 24 ILE HG23 H 1 0.962 0.020 . 1 . . . . . 24 ILE HG2 . 17022 1 265 . 1 1 24 24 ILE C C 13 173.508 0.200 . 1 . . . . . 24 ILE C . 17022 1 266 . 1 1 24 24 ILE CA C 13 60.204 0.200 . 1 . . . . . 24 ILE CA . 17022 1 267 . 1 1 24 24 ILE CB C 13 42.932 0.200 . 1 . . . . . 24 ILE CB . 17022 1 268 . 1 1 24 24 ILE CD1 C 13 14.337 0.200 . 1 . . . . . 24 ILE CD1 . 17022 1 269 . 1 1 24 24 ILE CG1 C 13 28.607 0.200 . 1 . . . . . 24 ILE CG1 . 17022 1 270 . 1 1 24 24 ILE CG2 C 13 19.217 0.200 . 1 . . . . . 24 ILE CG2 . 17022 1 271 . 1 1 24 24 ILE N N 15 129.477 0.200 . 1 . . . . . 24 ILE N . 17022 1 272 . 1 1 25 25 GLU H H 1 8.737 0.020 . 1 . . . . . 25 GLU H . 17022 1 273 . 1 1 25 25 GLU HA H 1 5.286 0.020 . 1 . . . . . 25 GLU HA . 17022 1 274 . 1 1 25 25 GLU HB2 H 1 1.992 0.020 . 2 . . . . . 25 GLU HB2 . 17022 1 275 . 1 1 25 25 GLU HB3 H 1 1.917 0.020 . 2 . . . . . 25 GLU HB3 . 17022 1 276 . 1 1 25 25 GLU HG2 H 1 2.155 0.020 . 2 . . . . . 25 GLU HG2 . 17022 1 277 . 1 1 25 25 GLU HG3 H 1 2.047 0.020 . 2 . . . . . 25 GLU HG3 . 17022 1 278 . 1 1 25 25 GLU C C 13 175.442 0.200 . 1 . . . . . 25 GLU C . 17022 1 279 . 1 1 25 25 GLU CA C 13 55.092 0.200 . 1 . . . . . 25 GLU CA . 17022 1 280 . 1 1 25 25 GLU CB C 13 31.993 0.200 . 1 . . . . . 25 GLU CB . 17022 1 281 . 1 1 25 25 GLU CG C 13 35.483 0.200 . 1 . . . . . 25 GLU CG . 17022 1 282 . 1 1 25 25 GLU N N 15 127.505 0.200 . 1 . . . . . 25 GLU N . 17022 1 283 . 1 1 26 26 VAL H H 1 9.315 0.020 . 1 . . . . . 26 VAL H . 17022 1 284 . 1 1 26 26 VAL HA H 1 5.003 0.020 . 1 . . . . . 26 VAL HA . 17022 1 285 . 1 1 26 26 VAL HB H 1 2.335 0.020 . 1 . . . . . 26 VAL HB . 17022 1 286 . 1 1 26 26 VAL HG11 H 1 0.635 0.020 . 2 . . . . . 26 VAL HG1 . 17022 1 287 . 1 1 26 26 VAL HG12 H 1 0.635 0.020 . 2 . . . . . 26 VAL HG1 . 17022 1 288 . 1 1 26 26 VAL HG13 H 1 0.635 0.020 . 2 . . . . . 26 VAL HG1 . 17022 1 289 . 1 1 26 26 VAL HG21 H 1 0.830 0.020 . 2 . . . . . 26 VAL HG2 . 17022 1 290 . 1 1 26 26 VAL HG22 H 1 0.830 0.020 . 2 . . . . . 26 VAL HG2 . 17022 1 291 . 1 1 26 26 VAL HG23 H 1 0.830 0.020 . 2 . . . . . 26 VAL HG2 . 17022 1 292 . 1 1 26 26 VAL C C 13 176.087 0.200 . 1 . . . . . 26 VAL C . 17022 1 293 . 1 1 26 26 VAL CA C 13 60.639 0.200 . 1 . . . . . 26 VAL CA . 17022 1 294 . 1 1 26 26 VAL CB C 13 33.999 0.200 . 1 . . . . . 26 VAL CB . 17022 1 295 . 1 1 26 26 VAL CG1 C 13 21.065 0.200 . 1 . . . . . 26 VAL CG1 . 17022 1 296 . 1 1 26 26 VAL CG2 C 13 22.100 0.200 . 1 . . . . . 26 VAL CG2 . 17022 1 297 . 1 1 26 26 VAL N N 15 128.162 0.200 . 1 . . . . . 26 VAL N . 17022 1 298 . 1 1 27 27 LYS H H 1 9.220 0.020 . 1 . . . . . 27 LYS H . 17022 1 299 . 1 1 27 27 LYS HA H 1 4.518 0.020 . 1 . . . . . 27 LYS HA . 17022 1 300 . 1 1 27 27 LYS HB2 H 1 1.604 0.020 . 2 . . . . . 27 LYS HB2 . 17022 1 301 . 1 1 27 27 LYS HB3 H 1 1.751 0.020 . 2 . . . . . 27 LYS HB3 . 17022 1 302 . 1 1 27 27 LYS HD2 H 1 1.700 0.020 . 1 . . . . . 27 LYS HD2 . 17022 1 303 . 1 1 27 27 LYS HD3 H 1 1.700 0.020 . 1 . . . . . 27 LYS HD3 . 17022 1 304 . 1 1 27 27 LYS HE2 H 1 2.969 0.020 . 1 . . . . . 27 LYS HE2 . 17022 1 305 . 1 1 27 27 LYS HE3 H 1 2.969 0.020 . 1 . . . . . 27 LYS HE3 . 17022 1 306 . 1 1 27 27 LYS HG2 H 1 1.352 0.020 . 2 . . . . . 27 LYS HG2 . 17022 1 307 . 1 1 27 27 LYS HG3 H 1 1.415 0.020 . 2 . . . . . 27 LYS HG3 . 17022 1 308 . 1 1 27 27 LYS C C 13 176.555 0.200 . 1 . . . . . 27 LYS C . 17022 1 309 . 1 1 27 27 LYS CA C 13 55.401 0.200 . 1 . . . . . 27 LYS CA . 17022 1 310 . 1 1 27 27 LYS CB C 13 36.746 0.200 . 1 . . . . . 27 LYS CB . 17022 1 311 . 1 1 27 27 LYS CD C 13 28.902 0.200 . 1 . . . . . 27 LYS CD . 17022 1 312 . 1 1 27 27 LYS CE C 13 42.063 0.200 . 1 . . . . . 27 LYS CE . 17022 1 313 . 1 1 27 27 LYS CG C 13 25.206 0.200 . 1 . . . . . 27 LYS CG . 17022 1 314 . 1 1 27 27 LYS N N 15 128.754 0.200 . 1 . . . . . 27 LYS N . 17022 1 315 . 1 1 28 28 ASN H H 1 10.561 0.020 . 1 . . . . . 28 ASN H . 17022 1 316 . 1 1 28 28 ASN HA H 1 4.454 0.020 . 1 . . . . . 28 ASN HA . 17022 1 317 . 1 1 28 28 ASN HB2 H 1 2.865 0.020 . 2 . . . . . 28 ASN HB2 . 17022 1 318 . 1 1 28 28 ASN HB3 H 1 3.065 0.020 . 2 . . . . . 28 ASN HB3 . 17022 1 319 . 1 1 28 28 ASN HD21 H 1 7.606 0.020 . 2 . . . . . 28 ASN HD21 . 17022 1 320 . 1 1 28 28 ASN HD22 H 1 6.992 0.020 . 2 . . . . . 28 ASN HD22 . 17022 1 321 . 1 1 28 28 ASN C C 13 176.438 0.200 . 1 . . . . . 28 ASN C . 17022 1 322 . 1 1 28 28 ASN CA C 13 54.289 0.200 . 1 . . . . . 28 ASN CA . 17022 1 323 . 1 1 28 28 ASN CB C 13 37.453 0.200 . 1 . . . . . 28 ASN CB . 17022 1 324 . 1 1 28 28 ASN N N 15 127.308 0.200 . 1 . . . . . 28 ASN N . 17022 1 325 . 1 1 28 28 ASN ND2 N 15 113.365 0.200 . 1 . . . . . 28 ASN ND2 . 17022 1 326 . 1 1 29 29 GLY H H 1 10.048 0.020 . 1 . . . . . 29 GLY H . 17022 1 327 . 1 1 29 29 GLY HA2 H 1 4.080 0.020 . 2 . . . . . 29 GLY HA2 . 17022 1 328 . 1 1 29 29 GLY HA3 H 1 3.897 0.020 . 2 . . . . . 29 GLY HA3 . 17022 1 329 . 1 1 29 29 GLY C C 13 173.743 0.200 . 1 . . . . . 29 GLY C . 17022 1 330 . 1 1 29 29 GLY CA C 13 45.508 0.200 . 1 . . . . . 29 GLY CA . 17022 1 331 . 1 1 29 29 GLY N N 15 104.955 0.200 . 1 . . . . . 29 GLY N . 17022 1 332 . 1 1 30 30 LYS H H 1 7.506 0.020 . 1 . . . . . 30 LYS H . 17022 1 333 . 1 1 30 30 LYS HA H 1 4.687 0.020 . 1 . . . . . 30 LYS HA . 17022 1 334 . 1 1 30 30 LYS HB2 H 1 1.655 0.020 . 1 . . . . . 30 LYS HB2 . 17022 1 335 . 1 1 30 30 LYS HB3 H 1 1.655 0.020 . 1 . . . . . 30 LYS HB3 . 17022 1 336 . 1 1 30 30 LYS HD2 H 1 1.619 0.020 . 1 . . . . . 30 LYS HD2 . 17022 1 337 . 1 1 30 30 LYS HD3 H 1 1.619 0.020 . 1 . . . . . 30 LYS HD3 . 17022 1 338 . 1 1 30 30 LYS HE2 H 1 2.984 0.020 . 1 . . . . . 30 LYS HE2 . 17022 1 339 . 1 1 30 30 LYS HE3 H 1 2.984 0.020 . 1 . . . . . 30 LYS HE3 . 17022 1 340 . 1 1 30 30 LYS HG2 H 1 1.387 0.020 . 2 . . . . . 30 LYS HG2 . 17022 1 341 . 1 1 30 30 LYS HG3 H 1 1.337 0.020 . 2 . . . . . 30 LYS HG3 . 17022 1 342 . 1 1 30 30 LYS C C 13 175.383 0.200 . 1 . . . . . 30 LYS C . 17022 1 343 . 1 1 30 30 LYS CA C 13 53.729 0.200 . 1 . . . . . 30 LYS CA . 17022 1 344 . 1 1 30 30 LYS CB C 13 35.326 0.200 . 1 . . . . . 30 LYS CB . 17022 1 345 . 1 1 30 30 LYS CD C 13 28.917 0.200 . 1 . . . . . 30 LYS CD . 17022 1 346 . 1 1 30 30 LYS CE C 13 42.082 0.200 . 1 . . . . . 30 LYS CE . 17022 1 347 . 1 1 30 30 LYS CG C 13 24.318 0.200 . 1 . . . . . 30 LYS CG . 17022 1 348 . 1 1 30 30 LYS N N 15 118.630 0.200 . 1 . . . . . 30 LYS N . 17022 1 349 . 1 1 31 31 ILE H H 1 9.843 0.020 . 1 . . . . . 31 ILE H . 17022 1 350 . 1 1 31 31 ILE HA H 1 4.232 0.020 . 1 . . . . . 31 ILE HA . 17022 1 351 . 1 1 31 31 ILE HB H 1 1.705 0.020 . 1 . . . . . 31 ILE HB . 17022 1 352 . 1 1 31 31 ILE HD11 H 1 0.647 0.020 . 1 . . . . . 31 ILE HD1 . 17022 1 353 . 1 1 31 31 ILE HD12 H 1 0.647 0.020 . 1 . . . . . 31 ILE HD1 . 17022 1 354 . 1 1 31 31 ILE HD13 H 1 0.647 0.020 . 1 . . . . . 31 ILE HD1 . 17022 1 355 . 1 1 31 31 ILE HG12 H 1 0.724 0.020 . 2 . . . . . 31 ILE HG12 . 17022 1 356 . 1 1 31 31 ILE HG13 H 1 0.660 0.020 . 2 . . . . . 31 ILE HG13 . 17022 1 357 . 1 1 31 31 ILE HG21 H 1 0.740 0.020 . 1 . . . . . 31 ILE HG2 . 17022 1 358 . 1 1 31 31 ILE HG22 H 1 0.740 0.020 . 1 . . . . . 31 ILE HG2 . 17022 1 359 . 1 1 31 31 ILE HG23 H 1 0.740 0.020 . 1 . . . . . 31 ILE HG2 . 17022 1 360 . 1 1 31 31 ILE C C 13 177.669 0.200 . 1 . . . . . 31 ILE C . 17022 1 361 . 1 1 31 31 ILE CA C 13 63.611 0.200 . 1 . . . . . 31 ILE CA . 17022 1 362 . 1 1 31 31 ILE CB C 13 38.749 0.200 . 1 . . . . . 31 ILE CB . 17022 1 363 . 1 1 31 31 ILE CD1 C 13 14.070 0.200 . 1 . . . . . 31 ILE CD1 . 17022 1 364 . 1 1 31 31 ILE CG1 C 13 27.941 0.200 . 1 . . . . . 31 ILE CG1 . 17022 1 365 . 1 1 31 31 ILE CG2 C 13 18.181 0.200 . 1 . . . . . 31 ILE CG2 . 17022 1 366 . 1 1 31 31 ILE N N 15 123.232 0.200 . 1 . . . . . 31 ILE N . 17022 1 367 . 1 1 32 32 VAL H H 1 9.125 0.020 . 1 . . . . . 32 VAL H . 17022 1 368 . 1 1 32 32 VAL HA H 1 4.612 0.020 . 1 . . . . . 32 VAL HA . 17022 1 369 . 1 1 32 32 VAL HB H 1 2.275 0.020 . 1 . . . . . 32 VAL HB . 17022 1 370 . 1 1 32 32 VAL HG11 H 1 1.032 0.020 . 2 . . . . . 32 VAL HG1 . 17022 1 371 . 1 1 32 32 VAL HG12 H 1 1.032 0.020 . 2 . . . . . 32 VAL HG1 . 17022 1 372 . 1 1 32 32 VAL HG13 H 1 1.032 0.020 . 2 . . . . . 32 VAL HG1 . 17022 1 373 . 1 1 32 32 VAL HG21 H 1 0.844 0.020 . 2 . . . . . 32 VAL HG2 . 17022 1 374 . 1 1 32 32 VAL HG22 H 1 0.844 0.020 . 2 . . . . . 32 VAL HG2 . 17022 1 375 . 1 1 32 32 VAL HG23 H 1 0.844 0.020 . 2 . . . . . 32 VAL HG2 . 17022 1 376 . 1 1 32 32 VAL C C 13 175.676 0.200 . 1 . . . . . 32 VAL C . 17022 1 377 . 1 1 32 32 VAL CA C 13 61.388 0.200 . 1 . . . . . 32 VAL CA . 17022 1 378 . 1 1 32 32 VAL CB C 13 33.556 0.200 . 1 . . . . . 32 VAL CB . 17022 1 379 . 1 1 32 32 VAL CG1 C 13 22.356 0.200 . 1 . . . . . 32 VAL CG1 . 17022 1 380 . 1 1 32 32 VAL CG2 C 13 19.074 0.200 . 1 . . . . . 32 VAL CG2 . 17022 1 381 . 1 1 32 32 VAL N N 15 121.654 0.200 . 1 . . . . . 32 VAL N . 17022 1 382 . 1 1 33 33 SER H H 1 7.587 0.020 . 1 . . . . . 33 SER H . 17022 1 383 . 1 1 33 33 SER HA H 1 4.639 0.020 . 1 . . . . . 33 SER HA . 17022 1 384 . 1 1 33 33 SER HB2 H 1 3.847 0.020 . 2 . . . . . 33 SER HB2 . 17022 1 385 . 1 1 33 33 SER HB3 H 1 3.815 0.020 . 2 . . . . . 33 SER HB3 . 17022 1 386 . 1 1 33 33 SER C C 13 171.926 0.200 . 1 . . . . . 33 SER C . 17022 1 387 . 1 1 33 33 SER CA C 13 57.814 0.200 . 1 . . . . . 33 SER CA . 17022 1 388 . 1 1 33 33 SER CB C 13 64.939 0.200 . 1 . . . . . 33 SER CB . 17022 1 389 . 1 1 33 33 SER N N 15 115.145 0.200 . 1 . . . . . 33 SER N . 17022 1 390 . 1 1 34 34 VAL H H 1 8.905 0.020 . 1 . . . . . 34 VAL H . 17022 1 391 . 1 1 34 34 VAL HA H 1 4.813 0.020 . 1 . . . . . 34 VAL HA . 17022 1 392 . 1 1 34 34 VAL HB H 1 1.975 0.020 . 1 . . . . . 34 VAL HB . 17022 1 393 . 1 1 34 34 VAL HG11 H 1 1.167 0.020 . 2 . . . . . 34 VAL HG1 . 17022 1 394 . 1 1 34 34 VAL HG12 H 1 1.167 0.020 . 2 . . . . . 34 VAL HG1 . 17022 1 395 . 1 1 34 34 VAL HG13 H 1 1.167 0.020 . 2 . . . . . 34 VAL HG1 . 17022 1 396 . 1 1 34 34 VAL HG21 H 1 0.950 0.020 . 2 . . . . . 34 VAL HG2 . 17022 1 397 . 1 1 34 34 VAL HG22 H 1 0.950 0.020 . 2 . . . . . 34 VAL HG2 . 17022 1 398 . 1 1 34 34 VAL HG23 H 1 0.950 0.020 . 2 . . . . . 34 VAL HG2 . 17022 1 399 . 1 1 34 34 VAL C C 13 172.981 0.200 . 1 . . . . . 34 VAL C . 17022 1 400 . 1 1 34 34 VAL CA C 13 60.481 0.200 . 1 . . . . . 34 VAL CA . 17022 1 401 . 1 1 34 34 VAL CB C 13 35.473 0.200 . 1 . . . . . 34 VAL CB . 17022 1 402 . 1 1 34 34 VAL CG1 C 13 22.287 0.200 . 1 . . . . . 34 VAL CG1 . 17022 1 403 . 1 1 34 34 VAL CG2 C 13 23.604 0.200 . 1 . . . . . 34 VAL CG2 . 17022 1 404 . 1 1 34 34 VAL N N 15 123.560 0.200 . 1 . . . . . 34 VAL N . 17022 1 405 . 1 1 35 35 ASP H H 1 9.008 0.020 . 1 . . . . . 35 ASP H . 17022 1 406 . 1 1 35 35 ASP HA H 1 5.272 0.020 . 1 . . . . . 35 ASP HA . 17022 1 407 . 1 1 35 35 ASP HB2 H 1 2.807 0.020 . 2 . . . . . 35 ASP HB2 . 17022 1 408 . 1 1 35 35 ASP HB3 H 1 2.599 0.020 . 2 . . . . . 35 ASP HB3 . 17022 1 409 . 1 1 35 35 ASP C C 13 176.555 0.200 . 1 . . . . . 35 ASP C . 17022 1 410 . 1 1 35 35 ASP CA C 13 52.088 0.200 . 1 . . . . . 35 ASP CA . 17022 1 411 . 1 1 35 35 ASP CB C 13 43.088 0.200 . 1 . . . . . 35 ASP CB . 17022 1 412 . 1 1 35 35 ASP N N 15 124.284 0.200 . 1 . . . . . 35 ASP N . 17022 1 413 . 1 1 36 36 TRP HA H 1 4.288 0.020 . 1 . . . . . 36 TRP HA . 17022 1 414 . 1 1 36 36 TRP HB2 H 1 1.610 0.020 . 2 . . . . . 36 TRP HB2 . 17022 1 415 . 1 1 36 36 TRP HB3 H 1 1.510 0.020 . 2 . . . . . 36 TRP HB3 . 17022 1 416 . 1 1 36 36 TRP HE1 H 1 11.205 0.020 . 1 . . . . . 36 TRP HE1 . 17022 1 417 . 1 1 36 36 TRP C C 13 179.206 0.200 . 1 . . . . . 36 TRP C . 17022 1 418 . 1 1 36 36 TRP CA C 13 55.276 0.200 . 1 . . . . . 36 TRP CA . 17022 1 419 . 1 1 36 36 TRP CB C 13 30.118 0.200 . 1 . . . . . 36 TRP CB . 17022 1 420 . 1 1 36 36 TRP NE1 N 15 133.619 0.200 . 1 . . . . . 36 TRP NE1 . 17022 1 421 . 1 1 37 37 ASN H H 1 8.297 0.020 . 1 . . . . . 37 ASN H . 17022 1 422 . 1 1 37 37 ASN HA H 1 4.961 0.020 . 1 . . . . . 37 ASN HA . 17022 1 423 . 1 1 37 37 ASN HB2 H 1 2.874 0.020 . 2 . . . . . 37 ASN HB2 . 17022 1 424 . 1 1 37 37 ASN HB3 H 1 2.782 0.020 . 2 . . . . . 37 ASN HB3 . 17022 1 425 . 1 1 37 37 ASN HD21 H 1 7.788 0.020 . 2 . . . . . 37 ASN HD21 . 17022 1 426 . 1 1 37 37 ASN HD22 H 1 7.594 0.020 . 2 . . . . . 37 ASN HD22 . 17022 1 427 . 1 1 37 37 ASN C C 13 177.727 0.200 . 1 . . . . . 37 ASN C . 17022 1 428 . 1 1 37 37 ASN CA C 13 50.914 0.200 . 1 . . . . . 37 ASN CA . 17022 1 429 . 1 1 37 37 ASN CB C 13 42.169 0.200 . 1 . . . . . 37 ASN CB . 17022 1 430 . 1 1 37 37 ASN N N 15 120.010 0.200 . 1 . . . . . 37 ASN N . 17022 1 431 . 1 1 37 37 ASN ND2 N 15 112.341 0.200 . 1 . . . . . 37 ASN ND2 . 17022 1 432 . 1 1 38 38 ALA H H 1 9.037 0.020 . 1 . . . . . 38 ALA H . 17022 1 433 . 1 1 38 38 ALA HA H 1 5.244 0.020 . 1 . . . . . 38 ALA HA . 17022 1 434 . 1 1 38 38 ALA HB1 H 1 1.094 0.020 . 1 . . . . . 38 ALA HB . 17022 1 435 . 1 1 38 38 ALA HB2 H 1 1.094 0.020 . 1 . . . . . 38 ALA HB . 17022 1 436 . 1 1 38 38 ALA HB3 H 1 1.094 0.020 . 1 . . . . . 38 ALA HB . 17022 1 437 . 1 1 38 38 ALA C C 13 175.383 0.200 . 1 . . . . . 38 ALA C . 17022 1 438 . 1 1 38 38 ALA CA C 13 52.851 0.200 . 1 . . . . . 38 ALA CA . 17022 1 439 . 1 1 38 38 ALA CB C 13 22.904 0.200 . 1 . . . . . 38 ALA CB . 17022 1 440 . 1 1 38 38 ALA N N 15 118.301 0.200 . 1 . . . . . 38 ALA N . 17022 1 441 . 1 1 39 39 ILE H H 1 8.751 0.020 . 1 . . . . . 39 ILE H . 17022 1 442 . 1 1 39 39 ILE HA H 1 4.936 0.020 . 1 . . . . . 39 ILE HA . 17022 1 443 . 1 1 39 39 ILE HB H 1 1.954 0.020 . 1 . . . . . 39 ILE HB . 17022 1 444 . 1 1 39 39 ILE HD11 H 1 0.947 0.020 . 1 . . . . . 39 ILE HD1 . 17022 1 445 . 1 1 39 39 ILE HD12 H 1 0.947 0.020 . 1 . . . . . 39 ILE HD1 . 17022 1 446 . 1 1 39 39 ILE HD13 H 1 0.947 0.020 . 1 . . . . . 39 ILE HD1 . 17022 1 447 . 1 1 39 39 ILE HG12 H 1 1.287 0.020 . 2 . . . . . 39 ILE HG12 . 17022 1 448 . 1 1 39 39 ILE HG13 H 1 1.691 0.020 . 2 . . . . . 39 ILE HG13 . 17022 1 449 . 1 1 39 39 ILE HG21 H 1 1.099 0.020 . 1 . . . . . 39 ILE HG2 . 17022 1 450 . 1 1 39 39 ILE HG22 H 1 1.099 0.020 . 1 . . . . . 39 ILE HG2 . 17022 1 451 . 1 1 39 39 ILE HG23 H 1 1.099 0.020 . 1 . . . . . 39 ILE HG2 . 17022 1 452 . 1 1 39 39 ILE C C 13 175.676 0.200 . 1 . . . . . 39 ILE C . 17022 1 453 . 1 1 39 39 ILE CA C 13 59.311 0.200 . 1 . . . . . 39 ILE CA . 17022 1 454 . 1 1 39 39 ILE CB C 13 41.347 0.200 . 1 . . . . . 39 ILE CB . 17022 1 455 . 1 1 39 39 ILE CD1 C 13 13.523 0.200 . 1 . . . . . 39 ILE CD1 . 17022 1 456 . 1 1 39 39 ILE CG1 C 13 26.610 0.200 . 1 . . . . . 39 ILE CG1 . 17022 1 457 . 1 1 39 39 ILE CG2 C 13 18.034 0.200 . 1 . . . . . 39 ILE CG2 . 17022 1 458 . 1 1 39 39 ILE N N 15 117.249 0.200 . 1 . . . . . 39 ILE N . 17022 1 459 . 1 1 40 40 ASN H H 1 9.542 0.020 . 1 . . . . . 40 ASN H . 17022 1 460 . 1 1 40 40 ASN HA H 1 4.645 0.020 . 1 . . . . . 40 ASN HA . 17022 1 461 . 1 1 40 40 ASN HB2 H 1 1.693 0.020 . 2 . . . . . 40 ASN HB2 . 17022 1 462 . 1 1 40 40 ASN HB3 H 1 2.433 0.020 . 2 . . . . . 40 ASN HB3 . 17022 1 463 . 1 1 40 40 ASN HD21 H 1 6.445 0.020 . 2 . . . . . 40 ASN HD21 . 17022 1 464 . 1 1 40 40 ASN HD22 H 1 4.043 0.020 . 2 . . . . . 40 ASN HD22 . 17022 1 465 . 1 1 40 40 ASN C C 13 177.200 0.200 . 1 . . . . . 40 ASN C . 17022 1 466 . 1 1 40 40 ASN CA C 13 52.623 0.200 . 1 . . . . . 40 ASN CA . 17022 1 467 . 1 1 40 40 ASN CB C 13 40.744 0.200 . 1 . . . . . 40 ASN CB . 17022 1 468 . 1 1 40 40 ASN N N 15 126.453 0.200 . 1 . . . . . 40 ASN N . 17022 1 469 . 1 1 40 40 ASN ND2 N 15 110.276 0.200 . 1 . . . . . 40 ASN ND2 . 17022 1 470 . 1 1 41 41 LYS H H 1 8.634 0.020 . 1 . . . . . 41 LYS H . 17022 1 471 . 1 1 41 41 LYS HA H 1 2.908 0.020 . 1 . . . . . 41 LYS HA . 17022 1 472 . 1 1 41 41 LYS HB2 H 1 0.495 0.020 . 2 . . . . . 41 LYS HB2 . 17022 1 473 . 1 1 41 41 LYS HB3 H 1 0.646 0.020 . 2 . . . . . 41 LYS HB3 . 17022 1 474 . 1 1 41 41 LYS HD2 H 1 1.229 0.020 . 2 . . . . . 41 LYS HD2 . 17022 1 475 . 1 1 41 41 LYS HD3 H 1 1.182 0.020 . 2 . . . . . 41 LYS HD3 . 17022 1 476 . 1 1 41 41 LYS HE2 H 1 2.738 0.020 . 1 . . . . . 41 LYS HE2 . 17022 1 477 . 1 1 41 41 LYS HE3 H 1 2.738 0.020 . 1 . . . . . 41 LYS HE3 . 17022 1 478 . 1 1 41 41 LYS HG2 H 1 0.608 0.020 . 1 . . . . . 41 LYS HG2 . 17022 1 479 . 1 1 41 41 LYS HG3 H 1 0.608 0.020 . 1 . . . . . 41 LYS HG3 . 17022 1 480 . 1 1 41 41 LYS C C 13 176.262 0.200 . 1 . . . . . 41 LYS C . 17022 1 481 . 1 1 41 41 LYS CA C 13 59.001 0.200 . 1 . . . . . 41 LYS CA . 17022 1 482 . 1 1 41 41 LYS CB C 13 31.264 0.200 . 1 . . . . . 41 LYS CB . 17022 1 483 . 1 1 41 41 LYS CD C 13 29.227 0.200 . 1 . . . . . 41 LYS CD . 17022 1 484 . 1 1 41 41 LYS CE C 13 41.755 0.200 . 1 . . . . . 41 LYS CE . 17022 1 485 . 1 1 41 41 LYS CG C 13 23.209 0.200 . 1 . . . . . 41 LYS CG . 17022 1 486 . 1 1 41 41 LYS N N 15 129.872 0.200 . 1 . . . . . 41 LYS N . 17022 1 487 . 1 1 42 42 ASP H H 1 8.363 0.020 . 1 . . . . . 42 ASP H . 17022 1 488 . 1 1 42 42 ASP HA H 1 4.604 0.020 . 1 . . . . . 42 ASP HA . 17022 1 489 . 1 1 42 42 ASP HB2 H 1 2.707 0.020 . 2 . . . . . 42 ASP HB2 . 17022 1 490 . 1 1 42 42 ASP HB3 H 1 2.250 0.020 . 2 . . . . . 42 ASP HB3 . 17022 1 491 . 1 1 42 42 ASP C C 13 176.380 0.200 . 1 . . . . . 42 ASP C . 17022 1 492 . 1 1 42 42 ASP CA C 13 53.911 0.200 . 1 . . . . . 42 ASP CA . 17022 1 493 . 1 1 42 42 ASP CB C 13 40.802 0.200 . 1 . . . . . 42 ASP CB . 17022 1 494 . 1 1 42 42 ASP N N 15 117.512 0.200 . 1 . . . . . 42 ASP N . 17022 1 495 . 1 1 43 43 GLY H H 1 7.631 0.020 . 1 . . . . . 43 GLY H . 17022 1 496 . 1 1 43 43 GLY HA2 H 1 4.088 0.020 . 2 . . . . . 43 GLY HA2 . 17022 1 497 . 1 1 43 43 GLY HA3 H 1 3.755 0.020 . 2 . . . . . 43 GLY HA3 . 17022 1 498 . 1 1 43 43 GLY C C 13 173.977 0.200 . 1 . . . . . 43 GLY C . 17022 1 499 . 1 1 43 43 GLY CA C 13 44.821 0.200 . 1 . . . . . 43 GLY CA . 17022 1 500 . 1 1 43 43 GLY N N 15 107.782 0.200 . 1 . . . . . 43 GLY N . 17022 1 501 . 1 1 44 44 GLY H H 1 8.319 0.020 . 1 . . . . . 44 GLY H . 17022 1 502 . 1 1 44 44 GLY HA2 H 1 4.046 0.020 . 2 . . . . . 44 GLY HA2 . 17022 1 503 . 1 1 44 44 GLY HA3 H 1 3.838 0.020 . 2 . . . . . 44 GLY HA3 . 17022 1 504 . 1 1 44 44 GLY C C 13 174.036 0.200 . 1 . . . . . 44 GLY C . 17022 1 505 . 1 1 44 44 GLY CA C 13 44.325 0.200 . 1 . . . . . 44 GLY CA . 17022 1 506 . 1 1 44 44 GLY N N 15 107.782 0.200 . 1 . . . . . 44 GLY N . 17022 1 507 . 1 1 45 45 ASP H H 1 8.319 0.020 . 1 . . . . . 45 ASP H . 17022 1 508 . 1 1 45 45 ASP HA H 1 4.580 0.020 . 1 . . . . . 45 ASP HA . 17022 1 509 . 1 1 45 45 ASP HB2 H 1 2.491 0.020 . 2 . . . . . 45 ASP HB2 . 17022 1 510 . 1 1 45 45 ASP HB3 H 1 2.624 0.020 . 2 . . . . . 45 ASP HB3 . 17022 1 511 . 1 1 45 45 ASP C C 13 176.438 0.200 . 1 . . . . . 45 ASP C . 17022 1 512 . 1 1 45 45 ASP CA C 13 55.749 0.200 . 1 . . . . . 45 ASP CA . 17022 1 513 . 1 1 45 45 ASP CB C 13 42.431 0.200 . 1 . . . . . 45 ASP CB . 17022 1 514 . 1 1 45 45 ASP N N 15 121.391 0.200 . 1 . . . . . 45 ASP N . 17022 1 515 . 1 1 46 46 ASP H H 1 8.268 0.020 . 1 . . . . . 46 ASP H . 17022 1 516 . 1 1 46 46 ASP HA H 1 5.020 0.020 . 1 . . . . . 46 ASP HA . 17022 1 517 . 1 1 46 46 ASP HB2 H 1 2.857 0.020 . 2 . . . . . 46 ASP HB2 . 17022 1 518 . 1 1 46 46 ASP HB3 H 1 3.339 0.020 . 2 . . . . . 46 ASP HB3 . 17022 1 519 . 1 1 46 46 ASP C C 13 174.680 0.200 . 1 . . . . . 46 ASP C . 17022 1 520 . 1 1 46 46 ASP CA C 13 53.027 0.200 . 1 . . . . . 46 ASP CA . 17022 1 521 . 1 1 46 46 ASP CB C 13 41.161 0.200 . 1 . . . . . 46 ASP CB . 17022 1 522 . 1 1 46 46 ASP N N 15 117.578 0.200 . 1 . . . . . 46 ASP N . 17022 1 523 . 1 1 47 47 LYS H H 1 8.165 0.020 . 1 . . . . . 47 LYS H . 17022 1 524 . 1 1 47 47 LYS HA H 1 2.843 0.020 . 1 . . . . . 47 LYS HA . 17022 1 525 . 1 1 47 47 LYS HB2 H 1 0.404 0.020 . 2 . . . . . 47 LYS HB2 . 17022 1 526 . 1 1 47 47 LYS HB3 H 1 -0.076 0.020 . 2 . . . . . 47 LYS HB3 . 17022 1 527 . 1 1 47 47 LYS HD2 H 1 -1.179 0.020 . 2 . . . . . 47 LYS HD2 . 17022 1 528 . 1 1 47 47 LYS HD3 H 1 -1.266 0.020 . 2 . . . . . 47 LYS HD3 . 17022 1 529 . 1 1 47 47 LYS HE2 H 1 0.606 0.020 . 2 . . . . . 47 LYS HE2 . 17022 1 530 . 1 1 47 47 LYS HE3 H 1 0.074 0.020 . 2 . . . . . 47 LYS HE3 . 17022 1 531 . 1 1 47 47 LYS HG2 H 1 -0.241 0.020 . 2 . . . . . 47 LYS HG2 . 17022 1 532 . 1 1 47 47 LYS HG3 H 1 -1.261 0.020 . 2 . . . . . 47 LYS HG3 . 17022 1 533 . 1 1 47 47 LYS C C 13 177.551 0.200 . 1 . . . . . 47 LYS C . 17022 1 534 . 1 1 47 47 LYS CA C 13 60.792 0.200 . 1 . . . . . 47 LYS CA . 17022 1 535 . 1 1 47 47 LYS CB C 13 32.306 0.200 . 1 . . . . . 47 LYS CB . 17022 1 536 . 1 1 47 47 LYS CD C 13 27.566 0.200 . 1 . . . . . 47 LYS CD . 17022 1 537 . 1 1 47 47 LYS CE C 13 40.311 0.200 . 1 . . . . . 47 LYS CE . 17022 1 538 . 1 1 47 47 LYS CG C 13 24.244 0.200 . 1 . . . . . 47 LYS CG . 17022 1 539 . 1 1 47 47 LYS N N 15 120.931 0.200 . 1 . . . . . 47 LYS N . 17022 1 540 . 1 1 48 48 ASP H H 1 8.839 0.020 . 1 . . . . . 48 ASP H . 17022 1 541 . 1 1 48 48 ASP HA H 1 4.487 0.020 . 1 . . . . . 48 ASP HA . 17022 1 542 . 1 1 48 48 ASP HB2 H 1 2.683 0.020 . 2 . . . . . 48 ASP HB2 . 17022 1 543 . 1 1 48 48 ASP HB3 H 1 2.560 0.020 . 2 . . . . . 48 ASP HB3 . 17022 1 544 . 1 1 48 48 ASP C C 13 178.489 0.200 . 1 . . . . . 48 ASP C . 17022 1 545 . 1 1 48 48 ASP CA C 13 58.523 0.200 . 1 . . . . . 48 ASP CA . 17022 1 546 . 1 1 48 48 ASP CB C 13 41.213 0.200 . 1 . . . . . 48 ASP CB . 17022 1 547 . 1 1 48 48 ASP N N 15 119.024 0.200 . 1 . . . . . 48 ASP N . 17022 1 548 . 1 1 49 49 THR H H 1 8.121 0.020 . 1 . . . . . 49 THR H . 17022 1 549 . 1 1 49 49 THR HA H 1 3.667 0.020 . 1 . . . . . 49 THR HA . 17022 1 550 . 1 1 49 49 THR HB H 1 4.098 0.020 . 1 . . . . . 49 THR HB . 17022 1 551 . 1 1 49 49 THR HG21 H 1 1.130 0.020 . 1 . . . . . 49 THR HG2 . 17022 1 552 . 1 1 49 49 THR HG22 H 1 1.130 0.020 . 1 . . . . . 49 THR HG2 . 17022 1 553 . 1 1 49 49 THR HG23 H 1 1.130 0.020 . 1 . . . . . 49 THR HG2 . 17022 1 554 . 1 1 49 49 THR C C 13 176.511 0.200 . 1 . . . . . 49 THR C . 17022 1 555 . 1 1 49 49 THR CA C 13 67.169 0.200 . 1 . . . . . 49 THR CA . 17022 1 556 . 1 1 49 49 THR CB C 13 68.300 0.200 . 1 . . . . . 49 THR CB . 17022 1 557 . 1 1 49 49 THR CG2 C 13 20.991 0.200 . 1 . . . . . 49 THR CG2 . 17022 1 558 . 1 1 49 49 THR N N 15 117.315 0.200 . 1 . . . . . 49 THR N . 17022 1 559 . 1 1 50 50 LEU H H 1 8.510 0.020 . 1 . . . . . 50 LEU H . 17022 1 560 . 1 1 50 50 LEU HA H 1 4.221 0.020 . 1 . . . . . 50 LEU HA . 17022 1 561 . 1 1 50 50 LEU HB2 H 1 1.643 0.020 . 2 . . . . . 50 LEU HB2 . 17022 1 562 . 1 1 50 50 LEU HB3 H 1 1.510 0.020 . 2 . . . . . 50 LEU HB3 . 17022 1 563 . 1 1 50 50 LEU HD11 H 1 1.126 0.020 . 2 . . . . . 50 LEU HD1 . 17022 1 564 . 1 1 50 50 LEU HD12 H 1 1.126 0.020 . 2 . . . . . 50 LEU HD1 . 17022 1 565 . 1 1 50 50 LEU HD13 H 1 1.126 0.020 . 2 . . . . . 50 LEU HD1 . 17022 1 566 . 1 1 50 50 LEU HD21 H 1 1.115 0.020 . 2 . . . . . 50 LEU HD2 . 17022 1 567 . 1 1 50 50 LEU HD22 H 1 1.115 0.020 . 2 . . . . . 50 LEU HD2 . 17022 1 568 . 1 1 50 50 LEU HD23 H 1 1.115 0.020 . 2 . . . . . 50 LEU HD2 . 17022 1 569 . 1 1 50 50 LEU HG H 1 1.601 0.020 . 1 . . . . . 50 LEU HG . 17022 1 570 . 1 1 50 50 LEU C C 13 179.720 0.200 . 1 . . . . . 50 LEU C . 17022 1 571 . 1 1 50 50 LEU CA C 13 57.567 0.200 . 1 . . . . . 50 LEU CA . 17022 1 572 . 1 1 50 50 LEU CB C 13 43.027 0.200 . 1 . . . . . 50 LEU CB . 17022 1 573 . 1 1 50 50 LEU CD1 C 13 24.984 0.200 . 1 . . . . . 50 LEU CD1 . 17022 1 574 . 1 1 50 50 LEU CD2 C 13 25.395 0.200 . 1 . . . . . 50 LEU CD2 . 17022 1 575 . 1 1 50 50 LEU CG C 13 26.684 0.200 . 1 . . . . . 50 LEU CG . 17022 1 576 . 1 1 50 50 LEU N N 15 121.522 0.200 . 1 . . . . . 50 LEU N . 17022 1 577 . 1 1 51 51 SER H H 1 8.920 0.020 . 1 . . . . . 51 SER H . 17022 1 578 . 1 1 51 51 SER HA H 1 4.576 0.020 . 1 . . . . . 51 SER HA . 17022 1 579 . 1 1 51 51 SER HB2 H 1 4.102 0.020 . 1 . . . . . 51 SER HB2 . 17022 1 580 . 1 1 51 51 SER HB3 H 1 4.102 0.020 . 1 . . . . . 51 SER HB3 . 17022 1 581 . 1 1 51 51 SER C C 13 179.237 0.200 . 1 . . . . . 51 SER C . 17022 1 582 . 1 1 51 51 SER CA C 13 61.256 0.200 . 1 . . . . . 51 SER CA . 17022 1 583 . 1 1 51 51 SER CB C 13 62.798 0.200 . 1 . . . . . 51 SER CB . 17022 1 584 . 1 1 51 51 SER N N 15 113.239 0.200 . 1 . . . . . 51 SER N . 17022 1 585 . 1 1 52 52 ARG HA H 1 3.489 0.020 . 1 . . . . . 52 ARG HA . 17022 1 586 . 1 1 52 52 ARG HB2 H 1 1.593 0.020 . 1 . . . . . 52 ARG HB2 . 17022 1 587 . 1 1 52 52 ARG HB3 H 1 1.593 0.020 . 1 . . . . . 52 ARG HB3 . 17022 1 588 . 1 1 52 52 ARG C C 13 177.741 0.200 . 1 . . . . . 52 ARG C . 17022 1 589 . 1 1 52 52 ARG CA C 13 59.449 0.200 . 1 . . . . . 52 ARG CA . 17022 1 590 . 1 1 52 52 ARG CB C 13 29.650 0.200 . 1 . . . . . 52 ARG CB . 17022 1 591 . 1 1 52 52 ARG CG C 13 28.828 0.200 . 1 . . . . . 52 ARG CG . 17022 1 592 . 1 1 53 53 ASN H H 1 7.909 0.020 . 1 . . . . . 53 ASN H . 17022 1 593 . 1 1 53 53 ASN HA H 1 4.837 0.020 . 1 . . . . . 53 ASN HA . 17022 1 594 . 1 1 53 53 ASN HB2 H 1 2.949 0.020 . 1 . . . . . 53 ASN HB2 . 17022 1 595 . 1 1 53 53 ASN HB3 H 1 2.949 0.020 . 1 . . . . . 53 ASN HB3 . 17022 1 596 . 1 1 53 53 ASN HD21 H 1 7.645 0.020 . 2 . . . . . 53 ASN HD21 . 17022 1 597 . 1 1 53 53 ASN HD22 H 1 6.784 0.020 . 2 . . . . . 53 ASN HD22 . 17022 1 598 . 1 1 53 53 ASN C C 13 176.204 0.200 . 1 . . . . . 53 ASN C . 17022 1 599 . 1 1 53 53 ASN CA C 13 52.857 0.200 . 1 . . . . . 53 ASN CA . 17022 1 600 . 1 1 53 53 ASN CB C 13 38.556 0.200 . 1 . . . . . 53 ASN CB . 17022 1 601 . 1 1 53 53 ASN N N 15 115.803 0.200 . 1 . . . . . 53 ASN N . 17022 1 602 . 1 1 53 53 ASN ND2 N 15 111.789 0.200 . 1 . . . . . 53 ASN ND2 . 17022 1 603 . 1 1 54 54 GLY H H 1 7.836 0.020 . 1 . . . . . 54 GLY H . 17022 1 604 . 1 1 54 54 GLY HA2 H 1 4.288 0.020 . 2 . . . . . 54 GLY HA2 . 17022 1 605 . 1 1 54 54 GLY HA3 H 1 4.105 0.020 . 2 . . . . . 54 GLY HA3 . 17022 1 606 . 1 1 54 54 GLY C C 13 175.208 0.200 . 1 . . . . . 54 GLY C . 17022 1 607 . 1 1 54 54 GLY CA C 13 46.173 0.200 . 1 . . . . . 54 GLY CA . 17022 1 608 . 1 1 54 54 GLY N N 15 108.111 0.200 . 1 . . . . . 54 GLY N . 17022 1 609 . 1 1 55 55 GLY H H 1 8.663 0.020 . 1 . . . . . 55 GLY H . 17022 1 610 . 1 1 55 55 GLY HA2 H 1 4.370 0.020 . 2 . . . . . 55 GLY HA2 . 17022 1 611 . 1 1 55 55 GLY HA3 H 1 3.739 0.020 . 2 . . . . . 55 GLY HA3 . 17022 1 612 . 1 1 55 55 GLY C C 13 173.274 0.200 . 1 . . . . . 55 GLY C . 17022 1 613 . 1 1 55 55 GLY CA C 13 45.339 0.200 . 1 . . . . . 55 GLY CA . 17022 1 614 . 1 1 55 55 GLY N N 15 107.651 0.200 . 1 . . . . . 55 GLY N . 17022 1 615 . 1 1 56 56 TYR H H 1 8.019 0.020 . 1 . . . . . 56 TYR H . 17022 1 616 . 1 1 56 56 TYR HA H 1 4.802 0.020 . 1 . . . . . 56 TYR HA . 17022 1 617 . 1 1 56 56 TYR HB2 H 1 2.767 0.020 . 2 . . . . . 56 TYR HB2 . 17022 1 618 . 1 1 56 56 TYR HB3 H 1 2.699 0.020 . 2 . . . . . 56 TYR HB3 . 17022 1 619 . 1 1 56 56 TYR HD1 H 1 7.125 0.020 . 1 . . . . . 56 TYR HD1 . 17022 1 620 . 1 1 56 56 TYR HD2 H 1 7.125 0.020 . 1 . . . . . 56 TYR HD2 . 17022 1 621 . 1 1 56 56 TYR HE1 H 1 6.619 0.020 . 1 . . . . . 56 TYR HE1 . 17022 1 622 . 1 1 56 56 TYR HE2 H 1 6.619 0.020 . 1 . . . . . 56 TYR HE2 . 17022 1 623 . 1 1 56 56 TYR C C 13 176.497 0.200 . 1 . . . . . 56 TYR C . 17022 1 624 . 1 1 56 56 TYR CA C 13 57.196 0.200 . 1 . . . . . 56 TYR CA . 17022 1 625 . 1 1 56 56 TYR CB C 13 39.924 0.200 . 1 . . . . . 56 TYR CB . 17022 1 626 . 1 1 56 56 TYR CD1 C 13 132.422 0.200 . 1 . . . . . 56 TYR CD1 . 17022 1 627 . 1 1 56 56 TYR CE1 C 13 117.955 0.200 . 1 . . . . . 56 TYR CE1 . 17022 1 628 . 1 1 56 56 TYR N N 15 122.048 0.200 . 1 . . . . . 56 TYR N . 17022 1 629 . 1 1 57 57 LYS H H 1 8.099 0.020 . 1 . . . . . 57 LYS H . 17022 1 630 . 1 1 57 57 LYS HA H 1 4.396 0.020 . 1 . . . . . 57 LYS HA . 17022 1 631 . 1 1 57 57 LYS HB2 H 1 1.680 0.020 . 2 . . . . . 57 LYS HB2 . 17022 1 632 . 1 1 57 57 LYS HB3 H 1 1.585 0.020 . 2 . . . . . 57 LYS HB3 . 17022 1 633 . 1 1 57 57 LYS HD2 H 1 1.621 0.020 . 1 . . . . . 57 LYS HD2 . 17022 1 634 . 1 1 57 57 LYS HD3 H 1 1.621 0.020 . 1 . . . . . 57 LYS HD3 . 17022 1 635 . 1 1 57 57 LYS HE2 H 1 2.966 0.020 . 1 . . . . . 57 LYS HE2 . 17022 1 636 . 1 1 57 57 LYS HE3 H 1 2.966 0.020 . 1 . . . . . 57 LYS HE3 . 17022 1 637 . 1 1 57 57 LYS HG2 H 1 1.348 0.020 . 2 . . . . . 57 LYS HG2 . 17022 1 638 . 1 1 57 57 LYS HG3 H 1 1.277 0.020 . 2 . . . . . 57 LYS HG3 . 17022 1 639 . 1 1 57 57 LYS C C 13 175.149 0.200 . 1 . . . . . 57 LYS C . 17022 1 640 . 1 1 57 57 LYS CA C 13 54.783 0.200 . 1 . . . . . 57 LYS CA . 17022 1 641 . 1 1 57 57 LYS CB C 13 33.374 0.200 . 1 . . . . . 57 LYS CB . 17022 1 642 . 1 1 57 57 LYS CD C 13 28.902 0.200 . 1 . . . . . 57 LYS CD . 17022 1 643 . 1 1 57 57 LYS CE C 13 42.137 0.200 . 1 . . . . . 57 LYS CE . 17022 1 644 . 1 1 57 57 LYS CG C 13 24.466 0.200 . 1 . . . . . 57 LYS CG . 17022 1 645 . 1 1 57 57 LYS N N 15 128.031 0.200 . 1 . . . . . 57 LYS N . 17022 1 646 . 1 1 58 58 MET H H 1 8.444 0.020 . 1 . . . . . 58 MET H . 17022 1 647 . 1 1 58 58 MET HA H 1 4.313 0.020 . 1 . . . . . 58 MET HA . 17022 1 648 . 1 1 58 58 MET HB2 H 1 1.967 0.020 . 2 . . . . . 58 MET HB2 . 17022 1 649 . 1 1 58 58 MET HB3 H 1 2.075 0.020 . 2 . . . . . 58 MET HB3 . 17022 1 650 . 1 1 58 58 MET HE1 H 1 2.119 0.020 . 1 . . . . . 58 MET HE . 17022 1 651 . 1 1 58 58 MET HE2 H 1 2.119 0.020 . 1 . . . . . 58 MET HE . 17022 1 652 . 1 1 58 58 MET HE3 H 1 2.119 0.020 . 1 . . . . . 58 MET HE . 17022 1 653 . 1 1 58 58 MET HG2 H 1 2.655 0.020 . 2 . . . . . 58 MET HG2 . 17022 1 654 . 1 1 58 58 MET HG3 H 1 2.581 0.020 . 2 . . . . . 58 MET HG3 . 17022 1 655 . 1 1 58 58 MET C C 13 176.087 0.200 . 1 . . . . . 58 MET C . 17022 1 656 . 1 1 58 58 MET CA C 13 55.201 0.200 . 1 . . . . . 58 MET CA . 17022 1 657 . 1 1 58 58 MET CB C 13 33.595 0.200 . 1 . . . . . 58 MET CB . 17022 1 658 . 1 1 58 58 MET CE C 13 17.119 0.200 . 1 . . . . . 58 MET CE . 17022 1 659 . 1 1 58 58 MET CG C 13 32.082 0.200 . 1 . . . . . 58 MET CG . 17022 1 660 . 1 1 58 58 MET N N 15 122.508 0.200 . 1 . . . . . 58 MET N . 17022 1 661 . 1 1 59 59 VAL H H 1 8.180 0.020 . 1 . . . . . 59 VAL H . 17022 1 662 . 1 1 59 59 VAL HA H 1 4.086 0.020 . 1 . . . . . 59 VAL HA . 17022 1 663 . 1 1 59 59 VAL HB H 1 2.085 0.020 . 1 . . . . . 59 VAL HB . 17022 1 664 . 1 1 59 59 VAL HG11 H 1 0.901 0.020 . 1 . . . . . 59 VAL HG1 . 17022 1 665 . 1 1 59 59 VAL HG12 H 1 0.901 0.020 . 1 . . . . . 59 VAL HG1 . 17022 1 666 . 1 1 59 59 VAL HG13 H 1 0.901 0.020 . 1 . . . . . 59 VAL HG1 . 17022 1 667 . 1 1 59 59 VAL HG21 H 1 0.900 0.020 . 1 . . . . . 59 VAL HG2 . 17022 1 668 . 1 1 59 59 VAL HG22 H 1 0.900 0.020 . 1 . . . . . 59 VAL HG2 . 17022 1 669 . 1 1 59 59 VAL HG23 H 1 0.900 0.020 . 1 . . . . . 59 VAL HG2 . 17022 1 670 . 1 1 59 59 VAL C C 13 176.262 0.200 . 1 . . . . . 59 VAL C . 17022 1 671 . 1 1 59 59 VAL CA C 13 62.687 0.200 . 1 . . . . . 59 VAL CA . 17022 1 672 . 1 1 59 59 VAL CB C 13 32.499 0.200 . 1 . . . . . 59 VAL CB . 17022 1 673 . 1 1 59 59 VAL CG1 C 13 21.183 0.200 . 1 . . . . . 59 VAL CG1 . 17022 1 674 . 1 1 59 59 VAL CG2 C 13 20.547 0.200 . 1 . . . . . 59 VAL CG2 . 17022 1 675 . 1 1 59 59 VAL N N 15 120.273 0.200 . 1 . . . . . 59 VAL N . 17022 1 676 . 1 1 60 60 GLU H H 1 8.290 0.020 . 1 . . . . . 60 GLU H . 17022 1 677 . 1 1 60 60 GLU HA H 1 4.315 0.020 . 1 . . . . . 60 GLU HA . 17022 1 678 . 1 1 60 60 GLU HB2 H 1 1.987 0.020 . 2 . . . . . 60 GLU HB2 . 17022 1 679 . 1 1 60 60 GLU HB3 H 1 1.930 0.020 . 2 . . . . . 60 GLU HB3 . 17022 1 680 . 1 1 60 60 GLU HG2 H 1 2.214 0.020 . 2 . . . . . 60 GLU HG2 . 17022 1 681 . 1 1 60 60 GLU HG3 H 1 2.170 0.020 . 2 . . . . . 60 GLU HG3 . 17022 1 682 . 1 1 60 60 GLU C C 13 175.852 0.200 . 1 . . . . . 60 GLU C . 17022 1 683 . 1 1 60 60 GLU CA C 13 56.315 0.200 . 1 . . . . . 60 GLU CA . 17022 1 684 . 1 1 60 60 GLU CB C 13 30.714 0.200 . 1 . . . . . 60 GLU CB . 17022 1 685 . 1 1 60 60 GLU CG C 13 36.370 0.200 . 1 . . . . . 60 GLU CG . 17022 1 686 . 1 1 60 60 GLU N N 15 122.771 0.200 . 1 . . . . . 60 GLU N . 17022 1 687 . 1 1 61 61 TYR H H 1 8.312 0.020 . 1 . . . . . 61 TYR H . 17022 1 688 . 1 1 61 61 TYR HA H 1 4.496 0.020 . 1 . . . . . 61 TYR HA . 17022 1 689 . 1 1 61 61 TYR HB2 H 1 3.048 0.020 . 2 . . . . . 61 TYR HB2 . 17022 1 690 . 1 1 61 61 TYR HB3 H 1 3.007 0.020 . 2 . . . . . 61 TYR HB3 . 17022 1 691 . 1 1 61 61 TYR HD1 H 1 7.082 0.020 . 1 . . . . . 61 TYR HD1 . 17022 1 692 . 1 1 61 61 TYR HD2 H 1 7.082 0.020 . 1 . . . . . 61 TYR HD2 . 17022 1 693 . 1 1 61 61 TYR HE1 H 1 6.806 0.020 . 1 . . . . . 61 TYR HE1 . 17022 1 694 . 1 1 61 61 TYR HE2 H 1 6.806 0.020 . 1 . . . . . 61 TYR HE2 . 17022 1 695 . 1 1 61 61 TYR C C 13 176.492 0.200 . 1 . . . . . 61 TYR C . 17022 1 696 . 1 1 61 61 TYR CA C 13 58.366 0.200 . 1 . . . . . 61 TYR CA . 17022 1 697 . 1 1 61 61 TYR CB C 13 38.713 0.200 . 1 . . . . . 61 TYR CB . 17022 1 698 . 1 1 61 61 TYR CD1 C 13 132.994 0.200 . 1 . . . . . 61 TYR CD1 . 17022 1 699 . 1 1 61 61 TYR CE1 C 13 118.141 0.200 . 1 . . . . . 61 TYR CE1 . 17022 1 700 . 1 1 61 61 TYR N N 15 121.421 0.200 . 1 . . . . . 61 TYR N . 17022 1 701 . 1 1 62 62 GLY H H 1 8.363 0.020 . 1 . . . . . 62 GLY H . 17022 1 702 . 1 1 62 62 GLY HA2 H 1 3.922 0.020 . 2 . . . . . 62 GLY HA2 . 17022 1 703 . 1 1 62 62 GLY HA3 H 1 3.797 0.020 . 2 . . . . . 62 GLY HA3 . 17022 1 704 . 1 1 62 62 GLY C C 13 174.563 0.200 . 1 . . . . . 62 GLY C . 17022 1 705 . 1 1 62 62 GLY CA C 13 45.518 0.200 . 1 . . . . . 62 GLY CA . 17022 1 706 . 1 1 62 62 GLY N N 15 111.398 0.200 . 1 . . . . . 62 GLY N . 17022 1 707 . 1 1 63 63 GLY H H 1 7.982 0.020 . 1 . . . . . 63 GLY H . 17022 1 708 . 1 1 63 63 GLY HA2 H 1 3.951 0.020 . 2 . . . . . 63 GLY HA2 . 17022 1 709 . 1 1 63 63 GLY HA3 H 1 3.886 0.020 . 2 . . . . . 63 GLY HA3 . 17022 1 710 . 1 1 63 63 GLY C C 13 173.684 0.200 . 1 . . . . . 63 GLY C . 17022 1 711 . 1 1 63 63 GLY CA C 13 45.136 0.200 . 1 . . . . . 63 GLY CA . 17022 1 712 . 1 1 63 63 GLY N N 15 108.374 0.200 . 1 . . . . . 63 GLY N . 17022 1 713 . 1 1 64 64 ALA H H 1 8.180 0.020 . 1 . . . . . 64 ALA H . 17022 1 714 . 1 1 64 64 ALA HA H 1 4.310 0.020 . 1 . . . . . 64 ALA HA . 17022 1 715 . 1 1 64 64 ALA HB1 H 1 1.353 0.020 . 1 . . . . . 64 ALA HB . 17022 1 716 . 1 1 64 64 ALA HB2 H 1 1.353 0.020 . 1 . . . . . 64 ALA HB . 17022 1 717 . 1 1 64 64 ALA HB3 H 1 1.353 0.020 . 1 . . . . . 64 ALA HB . 17022 1 718 . 1 1 64 64 ALA C C 13 177.493 0.200 . 1 . . . . . 64 ALA C . 17022 1 719 . 1 1 64 64 ALA CA C 13 52.565 0.200 . 1 . . . . . 64 ALA CA . 17022 1 720 . 1 1 64 64 ALA CB C 13 19.053 0.200 . 1 . . . . . 64 ALA CB . 17022 1 721 . 1 1 64 64 ALA N N 15 123.823 0.200 . 1 . . . . . 64 ALA N . 17022 1 722 . 1 1 65 65 GLN H H 1 8.261 0.020 . 1 . . . . . 65 GLN H . 17022 1 723 . 1 1 65 65 GLN HA H 1 4.338 0.020 . 1 . . . . . 65 GLN HA . 17022 1 724 . 1 1 65 65 GLN HB2 H 1 2.059 0.020 . 2 . . . . . 65 GLN HB2 . 17022 1 725 . 1 1 65 65 GLN HB3 H 1 1.909 0.020 . 2 . . . . . 65 GLN HB3 . 17022 1 726 . 1 1 65 65 GLN HE21 H 1 6.761 0.020 . 2 . . . . . 65 GLN HE21 . 17022 1 727 . 1 1 65 65 GLN HE22 H 1 7.490 0.020 . 2 . . . . . 65 GLN HE22 . 17022 1 728 . 1 1 65 65 GLN HG2 H 1 2.284 0.020 . 1 . . . . . 65 GLN HG2 . 17022 1 729 . 1 1 65 65 GLN HG3 H 1 2.284 0.020 . 1 . . . . . 65 GLN HG3 . 17022 1 730 . 1 1 65 65 GLN C C 13 175.032 0.200 . 1 . . . . . 65 GLN C . 17022 1 731 . 1 1 65 65 GLN CA C 13 55.260 0.200 . 1 . . . . . 65 GLN CA . 17022 1 732 . 1 1 65 65 GLN CB C 13 29.493 0.200 . 1 . . . . . 65 GLN CB . 17022 1 733 . 1 1 65 65 GLN CG C 13 33.686 0.200 . 1 . . . . . 65 GLN CG . 17022 1 734 . 1 1 65 65 GLN N N 15 118.695 0.200 . 1 . . . . . 65 GLN N . 17022 1 735 . 1 1 65 65 GLN NE2 N 15 112.348 0.200 . 1 . . . . . 65 GLN NE2 . 17022 1 736 . 1 1 66 66 ALA H H 1 7.953 0.020 . 1 . . . . . 66 ALA H . 17022 1 737 . 1 1 66 66 ALA HA H 1 4.387 0.020 . 1 . . . . . 66 ALA HA . 17022 1 738 . 1 1 66 66 ALA HB1 H 1 1.286 0.020 . 1 . . . . . 66 ALA HB . 17022 1 739 . 1 1 66 66 ALA HB2 H 1 1.286 0.020 . 1 . . . . . 66 ALA HB . 17022 1 740 . 1 1 66 66 ALA HB3 H 1 1.286 0.020 . 1 . . . . . 66 ALA HB . 17022 1 741 . 1 1 66 66 ALA C C 13 176.965 0.200 . 1 . . . . . 66 ALA C . 17022 1 742 . 1 1 66 66 ALA CA C 13 51.685 0.200 . 1 . . . . . 66 ALA CA . 17022 1 743 . 1 1 66 66 ALA CB C 13 20.230 0.200 . 1 . . . . . 66 ALA CB . 17022 1 744 . 1 1 66 66 ALA N N 15 123.823 0.200 . 1 . . . . . 66 ALA N . 17022 1 745 . 1 1 67 67 GLU H H 1 8.612 0.020 . 1 . . . . . 67 GLU H . 17022 1 746 . 1 1 67 67 GLU HA H 1 4.460 0.020 . 1 . . . . . 67 GLU HA . 17022 1 747 . 1 1 67 67 GLU HB2 H 1 2.246 0.020 . 1 . . . . . 67 GLU HB2 . 17022 1 748 . 1 1 67 67 GLU HB3 H 1 2.246 0.020 . 1 . . . . . 67 GLU HB3 . 17022 1 749 . 1 1 67 67 GLU HG2 H 1 2.542 0.020 . 2 . . . . . 67 GLU HG2 . 17022 1 750 . 1 1 67 67 GLU HG3 H 1 2.457 0.020 . 2 . . . . . 67 GLU HG3 . 17022 1 751 . 1 1 67 67 GLU C C 13 177.493 0.200 . 1 . . . . . 67 GLU C . 17022 1 752 . 1 1 67 67 GLU CA C 13 55.846 0.200 . 1 . . . . . 67 GLU CA . 17022 1 753 . 1 1 67 67 GLU CB C 13 30.482 0.200 . 1 . . . . . 67 GLU CB . 17022 1 754 . 1 1 67 67 GLU CG C 13 36.054 0.200 . 1 . . . . . 67 GLU CG . 17022 1 755 . 1 1 67 67 GLU N N 15 119.419 0.200 . 1 . . . . . 67 GLU N . 17022 1 756 . 1 1 68 68 TRP H H 1 9.963 0.020 . 1 . . . . . 68 TRP H . 17022 1 757 . 1 1 68 68 TRP HA H 1 6.024 0.020 . 1 . . . . . 68 TRP HA . 17022 1 758 . 1 1 68 68 TRP HB2 H 1 3.614 0.020 . 2 . . . . . 68 TRP HB2 . 17022 1 759 . 1 1 68 68 TRP HB3 H 1 3.145 0.020 . 2 . . . . . 68 TRP HB3 . 17022 1 760 . 1 1 68 68 TRP HD1 H 1 8.205 0.020 . 1 . . . . . 68 TRP HD1 . 17022 1 761 . 1 1 68 68 TRP HE1 H 1 11.410 0.020 . 1 . . . . . 68 TRP HE1 . 17022 1 762 . 1 1 68 68 TRP HH2 H 1 7.540 0.020 . 1 . . . . . 68 TRP HH2 . 17022 1 763 . 1 1 68 68 TRP HZ2 H 1 7.673 0.020 . 1 . . . . . 68 TRP HZ2 . 17022 1 764 . 1 1 68 68 TRP HZ3 H 1 6.842 0.020 . 1 . . . . . 68 TRP HZ3 . 17022 1 765 . 1 1 68 68 TRP CA C 13 54.154 0.200 . 1 . . . . . 68 TRP CA . 17022 1 766 . 1 1 68 68 TRP CB C 13 30.825 0.200 . 1 . . . . . 68 TRP CB . 17022 1 767 . 1 1 68 68 TRP CD1 C 13 125.944 0.200 . 1 . . . . . 68 TRP CD1 . 17022 1 768 . 1 1 68 68 TRP CH2 C 13 124.110 0.200 . 1 . . . . . 68 TRP CH2 . 17022 1 769 . 1 1 68 68 TRP CZ2 C 13 113.941 0.200 . 1 . . . . . 68 TRP CZ2 . 17022 1 770 . 1 1 68 68 TRP CZ3 C 13 120.520 0.200 . 1 . . . . . 68 TRP CZ3 . 17022 1 771 . 1 1 68 68 TRP N N 15 132.946 0.200 . 1 . . . . . 68 TRP N . 17022 1 772 . 1 1 68 68 TRP NE1 N 15 129.539 0.200 . 1 . . . . . 68 TRP NE1 . 17022 1 773 . 1 1 71 71 GLN HA H 1 3.722 0.020 . 1 . . . . . 71 GLN HA . 17022 1 774 . 1 1 71 71 GLN C C 13 178.152 0.200 . 1 . . . . . 71 GLN C . 17022 1 775 . 1 1 71 71 GLN CA C 13 55.432 0.200 . 1 . . . . . 71 GLN CA . 17022 1 776 . 1 1 72 72 ALA H H 1 8.334 0.020 . 1 . . . . . 72 ALA H . 17022 1 777 . 1 1 72 72 ALA HA H 1 3.531 0.020 . 1 . . . . . 72 ALA HA . 17022 1 778 . 1 1 72 72 ALA HB1 H 1 -0.024 0.020 . 1 . . . . . 72 ALA HB . 17022 1 779 . 1 1 72 72 ALA HB2 H 1 -0.024 0.020 . 1 . . . . . 72 ALA HB . 17022 1 780 . 1 1 72 72 ALA HB3 H 1 -0.024 0.020 . 1 . . . . . 72 ALA HB . 17022 1 781 . 1 1 72 72 ALA C C 13 179.720 0.200 . 1 . . . . . 72 ALA C . 17022 1 782 . 1 1 72 72 ALA CA C 13 55.179 0.200 . 1 . . . . . 72 ALA CA . 17022 1 783 . 1 1 72 72 ALA CB C 13 17.200 0.200 . 1 . . . . . 72 ALA CB . 17022 1 784 . 1 1 72 72 ALA N N 15 120.536 0.200 . 1 . . . . . 72 ALA N . 17022 1 785 . 1 1 73 73 GLU H H 1 7.338 0.020 . 1 . . . . . 73 GLU H . 17022 1 786 . 1 1 73 73 GLU HA H 1 4.359 0.020 . 1 . . . . . 73 GLU HA . 17022 1 787 . 1 1 73 73 GLU HB2 H 1 2.175 0.020 . 2 . . . . . 73 GLU HB2 . 17022 1 788 . 1 1 73 73 GLU HB3 H 1 2.025 0.020 . 2 . . . . . 73 GLU HB3 . 17022 1 789 . 1 1 73 73 GLU HG2 H 1 2.534 0.020 . 2 . . . . . 73 GLU HG2 . 17022 1 790 . 1 1 73 73 GLU HG3 H 1 2.378 0.020 . 2 . . . . . 73 GLU HG3 . 17022 1 791 . 1 1 73 73 GLU C C 13 180.013 0.200 . 1 . . . . . 73 GLU C . 17022 1 792 . 1 1 73 73 GLU CA C 13 58.742 0.200 . 1 . . . . . 73 GLU CA . 17022 1 793 . 1 1 73 73 GLU CB C 13 29.552 0.200 . 1 . . . . . 73 GLU CB . 17022 1 794 . 1 1 73 73 GLU CG C 13 36.888 0.200 . 1 . . . . . 73 GLU CG . 17022 1 795 . 1 1 73 73 GLU N N 15 116.329 0.200 . 1 . . . . . 73 GLU N . 17022 1 796 . 1 1 74 74 LYS H H 1 7.250 0.020 . 1 . . . . . 74 LYS H . 17022 1 797 . 1 1 74 74 LYS HA H 1 4.096 0.020 . 1 . . . . . 74 LYS HA . 17022 1 798 . 1 1 74 74 LYS HB2 H 1 2.034 0.020 . 2 . . . . . 74 LYS HB2 . 17022 1 799 . 1 1 74 74 LYS HB3 H 1 1.709 0.020 . 2 . . . . . 74 LYS HB3 . 17022 1 800 . 1 1 74 74 LYS HD2 H 1 1.674 0.020 . 1 . . . . . 74 LYS HD2 . 17022 1 801 . 1 1 74 74 LYS HD3 H 1 1.674 0.020 . 1 . . . . . 74 LYS HD3 . 17022 1 802 . 1 1 74 74 LYS HE2 H 1 3.047 0.020 . 1 . . . . . 74 LYS HE2 . 17022 1 803 . 1 1 74 74 LYS HE3 H 1 3.047 0.020 . 1 . . . . . 74 LYS HE3 . 17022 1 804 . 1 1 74 74 LYS HG2 H 1 1.641 0.020 . 1 . . . . . 74 LYS HG2 . 17022 1 805 . 1 1 74 74 LYS HG3 H 1 1.641 0.020 . 1 . . . . . 74 LYS HG3 . 17022 1 806 . 1 1 74 74 LYS C C 13 179.368 0.200 . 1 . . . . . 74 LYS C . 17022 1 807 . 1 1 74 74 LYS CA C 13 58.299 0.200 . 1 . . . . . 74 LYS CA . 17022 1 808 . 1 1 74 74 LYS CB C 13 31.993 0.200 . 1 . . . . . 74 LYS CB . 17022 1 809 . 1 1 74 74 LYS CD C 13 29.272 0.200 . 1 . . . . . 74 LYS CD . 17022 1 810 . 1 1 74 74 LYS CE C 13 42.063 0.200 . 1 . . . . . 74 LYS CE . 17022 1 811 . 1 1 74 74 LYS CG C 13 24.762 0.200 . 1 . . . . . 74 LYS CG . 17022 1 812 . 1 1 74 74 LYS N N 15 118.104 0.200 . 1 . . . . . 74 LYS N . 17022 1 813 . 1 1 75 75 VAL H H 1 7.425 0.020 . 1 . . . . . 75 VAL H . 17022 1 814 . 1 1 75 75 VAL HA H 1 3.456 0.020 . 1 . . . . . 75 VAL HA . 17022 1 815 . 1 1 75 75 VAL HB H 1 1.992 0.020 . 1 . . . . . 75 VAL HB . 17022 1 816 . 1 1 75 75 VAL HG11 H 1 -0.134 0.020 . 2 . . . . . 75 VAL HG1 . 17022 1 817 . 1 1 75 75 VAL HG12 H 1 -0.134 0.020 . 2 . . . . . 75 VAL HG1 . 17022 1 818 . 1 1 75 75 VAL HG13 H 1 -0.134 0.020 . 2 . . . . . 75 VAL HG1 . 17022 1 819 . 1 1 75 75 VAL HG21 H 1 0.915 0.020 . 2 . . . . . 75 VAL HG2 . 17022 1 820 . 1 1 75 75 VAL HG22 H 1 0.915 0.020 . 2 . . . . . 75 VAL HG2 . 17022 1 821 . 1 1 75 75 VAL HG23 H 1 0.915 0.020 . 2 . . . . . 75 VAL HG2 . 17022 1 822 . 1 1 75 75 VAL C C 13 176.731 0.200 . 1 . . . . . 75 VAL C . 17022 1 823 . 1 1 75 75 VAL CA C 13 66.343 0.200 . 1 . . . . . 75 VAL CA . 17022 1 824 . 1 1 75 75 VAL CB C 13 31.556 0.200 . 1 . . . . . 75 VAL CB . 17022 1 825 . 1 1 75 75 VAL CG1 C 13 21.856 0.200 . 1 . . . . . 75 VAL CG1 . 17022 1 826 . 1 1 75 75 VAL CG2 C 13 23.306 0.200 . 1 . . . . . 75 VAL CG2 . 17022 1 827 . 1 1 75 75 VAL N N 15 122.903 0.200 . 1 . . . . . 75 VAL N . 17022 1 828 . 1 1 76 76 GLU H H 1 8.473 0.020 . 1 . . . . . 76 GLU H . 17022 1 829 . 1 1 76 76 GLU HA H 1 3.534 0.020 . 1 . . . . . 76 GLU HA . 17022 1 830 . 1 1 76 76 GLU HB2 H 1 2.050 0.020 . 2 . . . . . 76 GLU HB2 . 17022 1 831 . 1 1 76 76 GLU HB3 H 1 2.408 0.020 . 2 . . . . . 76 GLU HB3 . 17022 1 832 . 1 1 76 76 GLU HG2 H 1 2.543 0.020 . 2 . . . . . 76 GLU HG2 . 17022 1 833 . 1 1 76 76 GLU HG3 H 1 2.092 0.020 . 2 . . . . . 76 GLU HG3 . 17022 1 834 . 1 1 76 76 GLU C C 13 178.489 0.200 . 1 . . . . . 76 GLU C . 17022 1 835 . 1 1 76 76 GLU CA C 13 59.472 0.200 . 1 . . . . . 76 GLU CA . 17022 1 836 . 1 1 76 76 GLU CB C 13 29.025 0.200 . 1 . . . . . 76 GLU CB . 17022 1 837 . 1 1 76 76 GLU CG C 13 36.222 0.200 . 1 . . . . . 76 GLU CG . 17022 1 838 . 1 1 76 76 GLU N N 15 119.353 0.200 . 1 . . . . . 76 GLU N . 17022 1 839 . 1 1 77 77 ALA H H 1 7.828 0.020 . 1 . . . . . 77 ALA H . 17022 1 840 . 1 1 77 77 ALA HA H 1 4.094 0.020 . 1 . . . . . 77 ALA HA . 17022 1 841 . 1 1 77 77 ALA HB1 H 1 1.544 0.020 . 1 . . . . . 77 ALA HB . 17022 1 842 . 1 1 77 77 ALA HB2 H 1 1.544 0.020 . 1 . . . . . 77 ALA HB . 17022 1 843 . 1 1 77 77 ALA HB3 H 1 1.544 0.020 . 1 . . . . . 77 ALA HB . 17022 1 844 . 1 1 77 77 ALA C C 13 180.481 0.200 . 1 . . . . . 77 ALA C . 17022 1 845 . 1 1 77 77 ALA CA C 13 54.689 0.200 . 1 . . . . . 77 ALA CA . 17022 1 846 . 1 1 77 77 ALA CB C 13 18.131 0.200 . 1 . . . . . 77 ALA CB . 17022 1 847 . 1 1 77 77 ALA N N 15 117.578 0.200 . 1 . . . . . 77 ALA N . 17022 1 848 . 1 1 78 78 TYR H H 1 7.872 0.020 . 1 . . . . . 78 TYR H . 17022 1 849 . 1 1 78 78 TYR HA H 1 4.304 0.020 . 1 . . . . . 78 TYR HA . 17022 1 850 . 1 1 78 78 TYR HB2 H 1 3.132 0.020 . 2 . . . . . 78 TYR HB2 . 17022 1 851 . 1 1 78 78 TYR HB3 H 1 3.589 0.020 . 2 . . . . . 78 TYR HB3 . 17022 1 852 . 1 1 78 78 TYR HD1 H 1 7.163 0.020 . 1 . . . . . 78 TYR HD1 . 17022 1 853 . 1 1 78 78 TYR HD2 H 1 7.163 0.020 . 1 . . . . . 78 TYR HD2 . 17022 1 854 . 1 1 78 78 TYR HE1 H 1 6.731 0.020 . 1 . . . . . 78 TYR HE1 . 17022 1 855 . 1 1 78 78 TYR HE2 H 1 6.731 0.020 . 1 . . . . . 78 TYR HE2 . 17022 1 856 . 1 1 78 78 TYR C C 13 177.141 0.200 . 1 . . . . . 78 TYR C . 17022 1 857 . 1 1 78 78 TYR CA C 13 61.578 0.200 . 1 . . . . . 78 TYR CA . 17022 1 858 . 1 1 78 78 TYR CB C 13 38.400 0.200 . 1 . . . . . 78 TYR CB . 17022 1 859 . 1 1 78 78 TYR CD1 C 13 133.224 0.200 . 1 . . . . . 78 TYR CD1 . 17022 1 860 . 1 1 78 78 TYR CE1 C 13 117.886 0.200 . 1 . . . . . 78 TYR CE1 . 17022 1 861 . 1 1 78 78 TYR N N 15 121.588 0.200 . 1 . . . . . 78 TYR N . 17022 1 862 . 1 1 79 79 LEU H H 1 7.953 0.020 . 1 . . . . . 79 LEU H . 17022 1 863 . 1 1 79 79 LEU HA H 1 4.296 0.020 . 1 . . . . . 79 LEU HA . 17022 1 864 . 1 1 79 79 LEU HB2 H 1 2.292 0.020 . 2 . . . . . 79 LEU HB2 . 17022 1 865 . 1 1 79 79 LEU HB3 H 1 1.601 0.020 . 2 . . . . . 79 LEU HB3 . 17022 1 866 . 1 1 79 79 LEU HD11 H 1 0.903 0.020 . 2 . . . . . 79 LEU HD1 . 17022 1 867 . 1 1 79 79 LEU HD12 H 1 0.903 0.020 . 2 . . . . . 79 LEU HD1 . 17022 1 868 . 1 1 79 79 LEU HD13 H 1 0.903 0.020 . 2 . . . . . 79 LEU HD1 . 17022 1 869 . 1 1 79 79 LEU HD21 H 1 0.811 0.020 . 2 . . . . . 79 LEU HD2 . 17022 1 870 . 1 1 79 79 LEU HD22 H 1 0.811 0.020 . 2 . . . . . 79 LEU HD2 . 17022 1 871 . 1 1 79 79 LEU HD23 H 1 0.811 0.020 . 2 . . . . . 79 LEU HD2 . 17022 1 872 . 1 1 79 79 LEU HG H 1 1.620 0.020 . 1 . . . . . 79 LEU HG . 17022 1 873 . 1 1 79 79 LEU C C 13 178.723 0.200 . 1 . . . . . 79 LEU C . 17022 1 874 . 1 1 79 79 LEU CA C 13 57.751 0.200 . 1 . . . . . 79 LEU CA . 17022 1 875 . 1 1 79 79 LEU CB C 13 40.168 0.200 . 1 . . . . . 79 LEU CB . 17022 1 876 . 1 1 79 79 LEU CD1 C 13 24.964 0.200 . 1 . . . . . 79 LEU CD1 . 17022 1 877 . 1 1 79 79 LEU CD2 C 13 23.465 0.200 . 1 . . . . . 79 LEU CD2 . 17022 1 878 . 1 1 79 79 LEU CG C 13 27.054 0.200 . 1 . . . . . 79 LEU CG . 17022 1 879 . 1 1 79 79 LEU N N 15 119.221 0.200 . 1 . . . . . 79 LEU N . 17022 1 880 . 1 1 80 80 VAL H H 1 7.770 0.020 . 1 . . . . . 80 VAL H . 17022 1 881 . 1 1 80 80 VAL HA H 1 3.285 0.020 . 1 . . . . . 80 VAL HA . 17022 1 882 . 1 1 80 80 VAL HB H 1 2.170 0.020 . 1 . . . . . 80 VAL HB . 17022 1 883 . 1 1 80 80 VAL HG11 H 1 0.913 0.020 . 2 . . . . . 80 VAL HG1 . 17022 1 884 . 1 1 80 80 VAL HG12 H 1 0.913 0.020 . 2 . . . . . 80 VAL HG1 . 17022 1 885 . 1 1 80 80 VAL HG13 H 1 0.913 0.020 . 2 . . . . . 80 VAL HG1 . 17022 1 886 . 1 1 80 80 VAL HG21 H 1 0.909 0.020 . 2 . . . . . 80 VAL HG2 . 17022 1 887 . 1 1 80 80 VAL HG22 H 1 0.909 0.020 . 2 . . . . . 80 VAL HG2 . 17022 1 888 . 1 1 80 80 VAL HG23 H 1 0.909 0.020 . 2 . . . . . 80 VAL HG2 . 17022 1 889 . 1 1 80 80 VAL C C 13 177.962 0.200 . 1 . . . . . 80 VAL C . 17022 1 890 . 1 1 80 80 VAL CA C 13 66.892 0.200 . 1 . . . . . 80 VAL CA . 17022 1 891 . 1 1 80 80 VAL CB C 13 31.212 0.200 . 1 . . . . . 80 VAL CB . 17022 1 892 . 1 1 80 80 VAL CG1 C 13 21.435 0.200 . 1 . . . . . 80 VAL CG1 . 17022 1 893 . 1 1 80 80 VAL CG2 C 13 23.283 0.200 . 1 . . . . . 80 VAL CG2 . 17022 1 894 . 1 1 80 80 VAL N N 15 119.747 0.200 . 1 . . . . . 80 VAL N . 17022 1 895 . 1 1 81 81 GLU H H 1 8.121 0.020 . 1 . . . . . 81 GLU H . 17022 1 896 . 1 1 81 81 GLU HA H 1 4.038 0.020 . 1 . . . . . 81 GLU HA . 17022 1 897 . 1 1 81 81 GLU HB2 H 1 2.084 0.020 . 1 . . . . . 81 GLU HB2 . 17022 1 898 . 1 1 81 81 GLU HB3 H 1 2.084 0.020 . 1 . . . . . 81 GLU HB3 . 17022 1 899 . 1 1 81 81 GLU HG2 H 1 2.042 0.020 . 2 . . . . . 81 GLU HG2 . 17022 1 900 . 1 1 81 81 GLU HG3 H 1 2.271 0.020 . 2 . . . . . 81 GLU HG3 . 17022 1 901 . 1 1 81 81 GLU C C 13 178.723 0.200 . 1 . . . . . 81 GLU C . 17022 1 902 . 1 1 81 81 GLU CA C 13 59.546 0.200 . 1 . . . . . 81 GLU CA . 17022 1 903 . 1 1 81 81 GLU CB C 13 29.493 0.200 . 1 . . . . . 81 GLU CB . 17022 1 904 . 1 1 81 81 GLU CG C 13 35.927 0.200 . 1 . . . . . 81 GLU CG . 17022 1 905 . 1 1 81 81 GLU N N 15 120.405 0.200 . 1 . . . . . 81 GLU N . 17022 1 906 . 1 1 82 82 LYS H H 1 8.473 0.020 . 1 . . . . . 82 LYS H . 17022 1 907 . 1 1 82 82 LYS HA H 1 4.048 0.020 . 1 . . . . . 82 LYS HA . 17022 1 908 . 1 1 82 82 LYS HB2 H 1 1.709 0.020 . 2 . . . . . 82 LYS HB2 . 17022 1 909 . 1 1 82 82 LYS HB3 H 1 1.817 0.020 . 2 . . . . . 82 LYS HB3 . 17022 1 910 . 1 1 82 82 LYS HD2 H 1 1.712 0.020 . 1 . . . . . 82 LYS HD2 . 17022 1 911 . 1 1 82 82 LYS HD3 H 1 1.712 0.020 . 1 . . . . . 82 LYS HD3 . 17022 1 912 . 1 1 82 82 LYS HE2 H 1 3.053 0.020 . 1 . . . . . 82 LYS HE2 . 17022 1 913 . 1 1 82 82 LYS HE3 H 1 3.053 0.020 . 1 . . . . . 82 LYS HE3 . 17022 1 914 . 1 1 82 82 LYS HG2 H 1 1.282 0.020 . 1 . . . . . 82 LYS HG2 . 17022 1 915 . 1 1 82 82 LYS HG3 H 1 1.282 0.020 . 1 . . . . . 82 LYS HG3 . 17022 1 916 . 1 1 82 82 LYS C C 13 179.134 0.200 . 1 . . . . . 82 LYS C . 17022 1 917 . 1 1 82 82 LYS CA C 13 56.450 0.200 . 1 . . . . . 82 LYS CA . 17022 1 918 . 1 1 82 82 LYS CB C 13 33.244 0.200 . 1 . . . . . 82 LYS CB . 17022 1 919 . 1 1 82 82 LYS CD C 13 29.139 0.200 . 1 . . . . . 82 LYS CD . 17022 1 920 . 1 1 82 82 LYS CE C 13 42.008 0.200 . 1 . . . . . 82 LYS CE . 17022 1 921 . 1 1 82 82 LYS CG C 13 24.775 0.200 . 1 . . . . . 82 LYS CG . 17022 1 922 . 1 1 82 82 LYS N N 15 115.080 0.200 . 1 . . . . . 82 LYS N . 17022 1 923 . 1 1 83 83 GLN H H 1 8.971 0.020 . 1 . . . . . 83 GLN H . 17022 1 924 . 1 1 83 83 GLN HA H 1 3.400 0.020 . 1 . . . . . 83 GLN HA . 17022 1 925 . 1 1 83 83 GLN HB2 H 1 2.516 0.020 . 2 . . . . . 83 GLN HB2 . 17022 1 926 . 1 1 83 83 GLN HB3 H 1 2.408 0.020 . 2 . . . . . 83 GLN HB3 . 17022 1 927 . 1 1 83 83 GLN HE21 H 1 9.102 0.020 . 2 . . . . . 83 GLN HE21 . 17022 1 928 . 1 1 83 83 GLN HE22 H 1 8.218 0.020 . 2 . . . . . 83 GLN HE22 . 17022 1 929 . 1 1 83 83 GLN HG2 H 1 2.207 0.020 . 2 . . . . . 83 GLN HG2 . 17022 1 930 . 1 1 83 83 GLN HG3 H 1 2.396 0.020 . 2 . . . . . 83 GLN HG3 . 17022 1 931 . 1 1 83 83 GLN C C 13 173.801 0.200 . 1 . . . . . 83 GLN C . 17022 1 932 . 1 1 83 83 GLN CA C 13 58.454 0.200 . 1 . . . . . 83 GLN CA . 17022 1 933 . 1 1 83 83 GLN CB C 13 26.056 0.200 . 1 . . . . . 83 GLN CB . 17022 1 934 . 1 1 83 83 GLN CG C 13 33.339 0.200 . 1 . . . . . 83 GLN CG . 17022 1 935 . 1 1 83 83 GLN N N 15 111.267 0.200 . 1 . . . . . 83 GLN N . 17022 1 936 . 1 1 83 83 GLN NE2 N 15 119.679 0.200 . 1 . . . . . 83 GLN NE2 . 17022 1 937 . 1 1 84 84 ASP H H 1 6.671 0.020 . 1 . . . . . 84 ASP H . 17022 1 938 . 1 1 84 84 ASP HA H 1 4.938 0.020 . 1 . . . . . 84 ASP HA . 17022 1 939 . 1 1 84 84 ASP HB2 H 1 2.761 0.020 . 2 . . . . . 84 ASP HB2 . 17022 1 940 . 1 1 84 84 ASP HB3 H 1 2.664 0.020 . 2 . . . . . 84 ASP HB3 . 17022 1 941 . 1 1 84 84 ASP C C 13 175.676 0.200 . 1 . . . . . 84 ASP C . 17022 1 942 . 1 1 84 84 ASP CA C 13 50.316 0.200 . 1 . . . . . 84 ASP CA . 17022 1 943 . 1 1 84 84 ASP CB C 13 42.597 0.200 . 1 . . . . . 84 ASP CB . 17022 1 944 . 1 1 84 84 ASP N N 15 115.277 0.200 . 1 . . . . . 84 ASP N . 17022 1 945 . 1 1 85 85 PRO HA H 1 4.545 0.020 . 1 . . . . . 85 PRO HA . 17022 1 946 . 1 1 85 85 PRO HB2 H 1 2.333 0.020 . 2 . . . . . 85 PRO HB2 . 17022 1 947 . 1 1 85 85 PRO HB3 H 1 1.809 0.020 . 2 . . . . . 85 PRO HB3 . 17022 1 948 . 1 1 85 85 PRO HD2 H 1 4.188 0.020 . 2 . . . . . 85 PRO HD2 . 17022 1 949 . 1 1 85 85 PRO HD3 H 1 3.415 0.020 . 2 . . . . . 85 PRO HD3 . 17022 1 950 . 1 1 85 85 PRO HG2 H 1 1.877 0.020 . 2 . . . . . 85 PRO HG2 . 17022 1 951 . 1 1 85 85 PRO HG3 H 1 1.767 0.020 . 2 . . . . . 85 PRO HG3 . 17022 1 952 . 1 1 85 85 PRO C C 13 174.401 0.200 . 1 . . . . . 85 PRO C . 17022 1 953 . 1 1 85 85 PRO CA C 13 63.714 0.200 . 1 . . . . . 85 PRO CA . 17022 1 954 . 1 1 85 85 PRO CB C 13 31.993 0.200 . 1 . . . . . 85 PRO CB . 17022 1 955 . 1 1 85 85 PRO CD C 13 50.344 0.200 . 1 . . . . . 85 PRO CD . 17022 1 956 . 1 1 85 85 PRO CG C 13 26.758 0.200 . 1 . . . . . 85 PRO CG . 17022 1 957 . 1 1 86 86 THR H H 1 8.539 0.020 . 1 . . . . . 86 THR H . 17022 1 958 . 1 1 86 86 THR HA H 1 4.382 0.020 . 1 . . . . . 86 THR HA . 17022 1 959 . 1 1 86 86 THR HB H 1 4.324 0.020 . 1 . . . . . 86 THR HB . 17022 1 960 . 1 1 86 86 THR HG21 H 1 1.116 0.020 . 1 . . . . . 86 THR HG2 . 17022 1 961 . 1 1 86 86 THR HG22 H 1 1.116 0.020 . 1 . . . . . 86 THR HG2 . 17022 1 962 . 1 1 86 86 THR HG23 H 1 1.116 0.020 . 1 . . . . . 86 THR HG2 . 17022 1 963 . 1 1 86 86 THR C C 13 175.325 0.200 . 1 . . . . . 86 THR C . 17022 1 964 . 1 1 86 86 THR CA C 13 61.794 0.200 . 1 . . . . . 86 THR CA . 17022 1 965 . 1 1 86 86 THR CB C 13 69.694 0.200 . 1 . . . . . 86 THR CB . 17022 1 966 . 1 1 86 86 THR CG2 C 13 21.657 0.200 . 1 . . . . . 86 THR CG2 . 17022 1 967 . 1 1 86 86 THR N N 15 108.966 0.200 . 1 . . . . . 86 THR N . 17022 1 968 . 1 1 87 87 ASP H H 1 7.462 0.020 . 1 . . . . . 87 ASP H . 17022 1 969 . 1 1 87 87 ASP HA H 1 4.602 0.020 . 1 . . . . . 87 ASP HA . 17022 1 970 . 1 1 87 87 ASP HB2 H 1 2.208 0.020 . 2 . . . . . 87 ASP HB2 . 17022 1 971 . 1 1 87 87 ASP HB3 H 1 2.940 0.020 . 2 . . . . . 87 ASP HB3 . 17022 1 972 . 1 1 87 87 ASP C C 13 173.215 0.200 . 1 . . . . . 87 ASP C . 17022 1 973 . 1 1 87 87 ASP CA C 13 52.513 0.200 . 1 . . . . . 87 ASP CA . 17022 1 974 . 1 1 87 87 ASP CB C 13 38.713 0.200 . 1 . . . . . 87 ASP CB . 17022 1 975 . 1 1 87 87 ASP N N 15 124.547 0.200 . 1 . . . . . 87 ASP N . 17022 1 976 . 1 1 88 88 ILE H H 1 7.528 0.020 . 1 . . . . . 88 ILE H . 17022 1 977 . 1 1 88 88 ILE HA H 1 4.055 0.020 . 1 . . . . . 88 ILE HA . 17022 1 978 . 1 1 88 88 ILE HB H 1 0.755 0.020 . 1 . . . . . 88 ILE HB . 17022 1 979 . 1 1 88 88 ILE HD11 H 1 0.187 0.020 . 1 . . . . . 88 ILE HD1 . 17022 1 980 . 1 1 88 88 ILE HD12 H 1 0.187 0.020 . 1 . . . . . 88 ILE HD1 . 17022 1 981 . 1 1 88 88 ILE HD13 H 1 0.187 0.020 . 1 . . . . . 88 ILE HD1 . 17022 1 982 . 1 1 88 88 ILE HG12 H 1 0.035 0.020 . 2 . . . . . 88 ILE HG12 . 17022 1 983 . 1 1 88 88 ILE HG13 H 1 -0.239 0.020 . 2 . . . . . 88 ILE HG13 . 17022 1 984 . 1 1 88 88 ILE HG21 H 1 -0.085 0.020 . 1 . . . . . 88 ILE HG2 . 17022 1 985 . 1 1 88 88 ILE HG22 H 1 -0.085 0.020 . 1 . . . . . 88 ILE HG2 . 17022 1 986 . 1 1 88 88 ILE HG23 H 1 -0.085 0.020 . 1 . . . . . 88 ILE HG2 . 17022 1 987 . 1 1 88 88 ILE C C 13 171.223 0.200 . 1 . . . . . 88 ILE C . 17022 1 988 . 1 1 88 88 ILE CA C 13 57.106 0.200 . 1 . . . . . 88 ILE CA . 17022 1 989 . 1 1 88 88 ILE CB C 13 39.387 0.200 . 1 . . . . . 88 ILE CB . 17022 1 990 . 1 1 88 88 ILE CD1 C 13 13.841 0.200 . 1 . . . . . 88 ILE CD1 . 17022 1 991 . 1 1 88 88 ILE CG1 C 13 27.349 0.200 . 1 . . . . . 88 ILE CG1 . 17022 1 992 . 1 1 88 88 ILE CG2 C 13 15.815 0.200 . 1 . . . . . 88 ILE CG2 . 17022 1 993 . 1 1 88 88 ILE N N 15 120.733 0.200 . 1 . . . . . 88 ILE N . 17022 1 994 . 1 1 89 89 LYS H H 1 6.708 0.020 . 1 . . . . . 89 LYS H . 17022 1 995 . 1 1 89 89 LYS HA H 1 4.354 0.020 . 1 . . . . . 89 LYS HA . 17022 1 996 . 1 1 89 89 LYS HB2 H 1 1.626 0.020 . 2 . . . . . 89 LYS HB2 . 17022 1 997 . 1 1 89 89 LYS HB3 H 1 1.485 0.020 . 2 . . . . . 89 LYS HB3 . 17022 1 998 . 1 1 89 89 LYS HD2 H 1 1.680 0.020 . 1 . . . . . 89 LYS HD2 . 17022 1 999 . 1 1 89 89 LYS HD3 H 1 1.680 0.020 . 1 . . . . . 89 LYS HD3 . 17022 1 1000 . 1 1 89 89 LYS HE2 H 1 2.970 0.020 . 1 . . . . . 89 LYS HE2 . 17022 1 1001 . 1 1 89 89 LYS HE3 H 1 2.970 0.020 . 1 . . . . . 89 LYS HE3 . 17022 1 1002 . 1 1 89 89 LYS HG2 H 1 1.314 0.020 . 2 . . . . . 89 LYS HG2 . 17022 1 1003 . 1 1 89 89 LYS HG3 H 1 1.232 0.020 . 2 . . . . . 89 LYS HG3 . 17022 1 1004 . 1 1 89 89 LYS C C 13 175.559 0.200 . 1 . . . . . 89 LYS C . 17022 1 1005 . 1 1 89 89 LYS CA C 13 53.820 0.200 . 1 . . . . . 89 LYS CA . 17022 1 1006 . 1 1 89 89 LYS CB C 13 34.650 0.200 . 1 . . . . . 89 LYS CB . 17022 1 1007 . 1 1 89 89 LYS CD C 13 28.917 0.200 . 1 . . . . . 89 LYS CD . 17022 1 1008 . 1 1 89 89 LYS CE C 13 42.063 0.200 . 1 . . . . . 89 LYS CE . 17022 1 1009 . 1 1 89 89 LYS CG C 13 24.331 0.200 . 1 . . . . . 89 LYS CG . 17022 1 1010 . 1 1 89 89 LYS N N 15 124.086 0.200 . 1 . . . . . 89 LYS N . 17022 1 1011 . 1 1 90 90 TYR H H 1 9.059 0.020 . 1 . . . . . 90 TYR H . 17022 1 1012 . 1 1 90 90 TYR HA H 1 4.837 0.020 . 1 . . . . . 90 TYR HA . 17022 1 1013 . 1 1 90 90 TYR HB2 H 1 3.547 0.020 . 2 . . . . . 90 TYR HB2 . 17022 1 1014 . 1 1 90 90 TYR HB3 H 1 2.807 0.020 . 2 . . . . . 90 TYR HB3 . 17022 1 1015 . 1 1 90 90 TYR HD1 H 1 6.891 0.020 . 1 . . . . . 90 TYR HD1 . 17022 1 1016 . 1 1 90 90 TYR HD2 H 1 6.891 0.020 . 1 . . . . . 90 TYR HD2 . 17022 1 1017 . 1 1 90 90 TYR HE1 H 1 6.500 0.020 . 1 . . . . . 90 TYR HE1 . 17022 1 1018 . 1 1 90 90 TYR HE2 H 1 6.500 0.020 . 1 . . . . . 90 TYR HE2 . 17022 1 1019 . 1 1 90 90 TYR C C 13 175.794 0.200 . 1 . . . . . 90 TYR C . 17022 1 1020 . 1 1 90 90 TYR CA C 13 57.917 0.200 . 1 . . . . . 90 TYR CA . 17022 1 1021 . 1 1 90 90 TYR CB C 13 40.119 0.200 . 1 . . . . . 90 TYR CB . 17022 1 1022 . 1 1 90 90 TYR CD1 C 13 132.077 0.200 . 1 . . . . . 90 TYR CD1 . 17022 1 1023 . 1 1 90 90 TYR CE1 C 13 117.508 0.200 . 1 . . . . . 90 TYR CE1 . 17022 1 1024 . 1 1 90 90 TYR N N 15 126.256 0.200 . 1 . . . . . 90 TYR N . 17022 1 1025 . 1 1 91 91 LYS H H 1 9.022 0.020 . 1 . . . . . 91 LYS H . 17022 1 1026 . 1 1 91 91 LYS HA H 1 4.612 0.020 . 1 . . . . . 91 LYS HA . 17022 1 1027 . 1 1 91 91 LYS HB2 H 1 2.000 0.020 . 2 . . . . . 91 LYS HB2 . 17022 1 1028 . 1 1 91 91 LYS HB3 H 1 1.560 0.020 . 2 . . . . . 91 LYS HB3 . 17022 1 1029 . 1 1 91 91 LYS HD2 H 1 1.561 0.020 . 2 . . . . . 91 LYS HD2 . 17022 1 1030 . 1 1 91 91 LYS HD3 H 1 1.468 0.020 . 2 . . . . . 91 LYS HD3 . 17022 1 1031 . 1 1 91 91 LYS HE2 H 1 2.764 0.020 . 2 . . . . . 91 LYS HE2 . 17022 1 1032 . 1 1 91 91 LYS HE3 H 1 2.924 0.020 . 2 . . . . . 91 LYS HE3 . 17022 1 1033 . 1 1 91 91 LYS HG2 H 1 1.147 0.020 . 1 . . . . . 91 LYS HG2 . 17022 1 1034 . 1 1 91 91 LYS HG3 H 1 1.147 0.020 . 1 . . . . . 91 LYS HG3 . 17022 1 1035 . 1 1 91 91 LYS C C 13 174.622 0.200 . 1 . . . . . 91 LYS C . 17022 1 1036 . 1 1 91 91 LYS CA C 13 55.329 0.200 . 1 . . . . . 91 LYS CA . 17022 1 1037 . 1 1 91 91 LYS CB C 13 33.712 0.200 . 1 . . . . . 91 LYS CB . 17022 1 1038 . 1 1 91 91 LYS CD C 13 29.296 0.200 . 1 . . . . . 91 LYS CD . 17022 1 1039 . 1 1 91 91 LYS CE C 13 41.424 0.200 . 1 . . . . . 91 LYS CE . 17022 1 1040 . 1 1 91 91 LYS CG C 13 23.331 0.200 . 1 . . . . . 91 LYS CG . 17022 1 1041 . 1 1 91 91 LYS N N 15 119.287 0.200 . 1 . . . . . 91 LYS N . 17022 1 1042 . 1 1 92 92 ASP H H 1 7.792 0.020 . 1 . . . . . 92 ASP H . 17022 1 1043 . 1 1 92 92 ASP HA H 1 4.758 0.020 . 1 . . . . . 92 ASP HA . 17022 1 1044 . 1 1 92 92 ASP HB2 H 1 3.289 0.020 . 2 . . . . . 92 ASP HB2 . 17022 1 1045 . 1 1 92 92 ASP HB3 H 1 2.965 0.020 . 2 . . . . . 92 ASP HB3 . 17022 1 1046 . 1 1 92 92 ASP C C 13 176.028 0.200 . 1 . . . . . 92 ASP C . 17022 1 1047 . 1 1 92 92 ASP CA C 13 52.213 0.200 . 1 . . . . . 92 ASP CA . 17022 1 1048 . 1 1 92 92 ASP CB C 13 41.966 0.200 . 1 . . . . . 92 ASP CB . 17022 1 1049 . 1 1 92 92 ASP N N 15 118.301 0.200 . 1 . . . . . 92 ASP N . 17022 1 1050 . 1 1 93 93 ASN HA H 1 4.712 0.020 . 1 . . . . . 93 ASN HA . 17022 1 1051 . 1 1 93 93 ASN HB2 H 1 2.899 0.020 . 2 . . . . . 93 ASN HB2 . 17022 1 1052 . 1 1 93 93 ASN HB3 H 1 2.766 0.020 . 2 . . . . . 93 ASN HB3 . 17022 1 1053 . 1 1 93 93 ASN HD21 H 1 7.645 0.020 . 2 . . . . . 93 ASN HD21 . 17022 1 1054 . 1 1 93 93 ASN HD22 H 1 6.943 0.020 . 2 . . . . . 93 ASN HD22 . 17022 1 1055 . 1 1 93 93 ASN C C 13 175.749 0.200 . 1 . . . . . 93 ASN C . 17022 1 1056 . 1 1 93 93 ASN CA C 13 54.156 0.200 . 1 . . . . . 93 ASN CA . 17022 1 1057 . 1 1 93 93 ASN CB C 13 38.244 0.200 . 1 . . . . . 93 ASN CB . 17022 1 1058 . 1 1 93 93 ASN ND2 N 15 113.050 0.200 . 1 . . . . . 93 ASN ND2 . 17022 1 1059 . 1 1 94 94 ASP H H 1 8.011 0.020 . 1 . . . . . 94 ASP H . 17022 1 1060 . 1 1 94 94 ASP HA H 1 4.640 0.020 . 1 . . . . . 94 ASP HA . 17022 1 1061 . 1 1 94 94 ASP HB2 H 1 2.564 0.020 . 2 . . . . . 94 ASP HB2 . 17022 1 1062 . 1 1 94 94 ASP HB3 H 1 2.428 0.020 . 2 . . . . . 94 ASP HB3 . 17022 1 1063 . 1 1 94 94 ASP C C 13 175.676 0.200 . 1 . . . . . 94 ASP C . 17022 1 1064 . 1 1 94 94 ASP CA C 13 54.469 0.200 . 1 . . . . . 94 ASP CA . 17022 1 1065 . 1 1 94 94 ASP CB C 13 42.143 0.200 . 1 . . . . . 94 ASP CB . 17022 1 1066 . 1 1 94 94 ASP N N 15 118.432 0.200 . 1 . . . . . 94 ASP N . 17022 1 1067 . 1 1 95 95 GLY H H 1 7.836 0.020 . 1 . . . . . 95 GLY H . 17022 1 1068 . 1 1 95 95 GLY HA2 H 1 3.290 0.020 . 2 . . . . . 95 GLY HA2 . 17022 1 1069 . 1 1 95 95 GLY HA3 H 1 3.988 0.020 . 2 . . . . . 95 GLY HA3 . 17022 1 1070 . 1 1 95 95 GLY C C 13 175.501 0.200 . 1 . . . . . 95 GLY C . 17022 1 1071 . 1 1 95 95 GLY CA C 13 46.913 0.200 . 1 . . . . . 95 GLY CA . 17022 1 1072 . 1 1 95 95 GLY N N 15 103.706 0.200 . 1 . . . . . 95 GLY N . 17022 1 1073 . 1 1 96 96 HIS H H 1 8.920 0.020 . 1 . . . . . 96 HIS H . 17022 1 1074 . 1 1 96 96 HIS HA H 1 4.886 0.020 . 1 . . . . . 96 HIS HA . 17022 1 1075 . 1 1 96 96 HIS HB2 H 1 3.015 0.020 . 2 . . . . . 96 HIS HB2 . 17022 1 1076 . 1 1 96 96 HIS HB3 H 1 3.473 0.020 . 2 . . . . . 96 HIS HB3 . 17022 1 1077 . 1 1 96 96 HIS HD2 H 1 7.336 0.020 . 1 . . . . . 96 HIS HD2 . 17022 1 1078 . 1 1 96 96 HIS C C 13 174.446 0.200 . 1 . . . . . 96 HIS C . 17022 1 1079 . 1 1 96 96 HIS CA C 13 57.985 0.200 . 1 . . . . . 96 HIS CA . 17022 1 1080 . 1 1 96 96 HIS CB C 13 28.868 0.200 . 1 . . . . . 96 HIS CB . 17022 1 1081 . 1 1 96 96 HIS CD2 C 13 119.931 0.200 . 1 . . . . . 96 HIS CD2 . 17022 1 1082 . 1 1 96 96 HIS N N 15 117.907 0.200 . 1 . . . . . 96 HIS N . 17022 1 1083 . 1 1 96 96 HIS ND1 N 15 181.595 0.200 . 1 . . . . . 96 HIS ND1 . 17022 1 1084 . 1 1 96 96 HIS NE2 N 15 185.507 0.200 . 1 . . . . . 96 HIS NE2 . 17022 1 1085 . 1 1 97 97 THR H H 1 9.931 0.020 . 1 . . . . . 97 THR H . 17022 1 1086 . 1 1 97 97 THR HA H 1 4.787 0.020 . 1 . . . . . 97 THR HA . 17022 1 1087 . 1 1 97 97 THR HB H 1 3.894 0.020 . 1 . . . . . 97 THR HB . 17022 1 1088 . 1 1 97 97 THR HG21 H 1 1.187 0.020 . 1 . . . . . 97 THR HG2 . 17022 1 1089 . 1 1 97 97 THR HG22 H 1 1.187 0.020 . 1 . . . . . 97 THR HG2 . 17022 1 1090 . 1 1 97 97 THR HG23 H 1 1.187 0.020 . 1 . . . . . 97 THR HG2 . 17022 1 1091 . 1 1 97 97 THR C C 13 171.340 0.200 . 1 . . . . . 97 THR C . 17022 1 1092 . 1 1 97 97 THR CA C 13 60.812 0.200 . 1 . . . . . 97 THR CA . 17022 1 1093 . 1 1 97 97 THR CB C 13 70.797 0.200 . 1 . . . . . 97 THR CB . 17022 1 1094 . 1 1 97 97 THR CG2 C 13 19.512 0.200 . 1 . . . . . 97 THR CG2 . 17022 1 1095 . 1 1 97 97 THR N N 15 117.315 0.200 . 1 . . . . . 97 THR N . 17022 1 1096 . 1 1 98 98 ASP H H 1 9.000 0.020 . 1 . . . . . 98 ASP H . 17022 1 1097 . 1 1 98 98 ASP HA H 1 5.101 0.020 . 1 . . . . . 98 ASP HA . 17022 1 1098 . 1 1 98 98 ASP HB2 H 1 2.807 0.020 . 2 . . . . . 98 ASP HB2 . 17022 1 1099 . 1 1 98 98 ASP HB3 H 1 2.450 0.020 . 2 . . . . . 98 ASP HB3 . 17022 1 1100 . 1 1 98 98 ASP C C 13 177.200 0.200 . 1 . . . . . 98 ASP C . 17022 1 1101 . 1 1 98 98 ASP CA C 13 54.374 0.200 . 1 . . . . . 98 ASP CA . 17022 1 1102 . 1 1 98 98 ASP CB C 13 41.838 0.200 . 1 . . . . . 98 ASP CB . 17022 1 1103 . 1 1 98 98 ASP N N 15 126.453 0.200 . 1 . . . . . 98 ASP N . 17022 1 1104 . 1 1 99 99 ALA H H 1 8.502 0.020 . 1 . . . . . 99 ALA H . 17022 1 1105 . 1 1 99 99 ALA HA H 1 4.113 0.020 . 1 . . . . . 99 ALA HA . 17022 1 1106 . 1 1 99 99 ALA HB1 H 1 1.303 0.020 . 1 . . . . . 99 ALA HB . 17022 1 1107 . 1 1 99 99 ALA HB2 H 1 1.303 0.020 . 1 . . . . . 99 ALA HB . 17022 1 1108 . 1 1 99 99 ALA HB3 H 1 1.303 0.020 . 1 . . . . . 99 ALA HB . 17022 1 1109 . 1 1 99 99 ALA C C 13 176.321 0.200 . 1 . . . . . 99 ALA C . 17022 1 1110 . 1 1 99 99 ALA CA C 13 53.912 0.200 . 1 . . . . . 99 ALA CA . 17022 1 1111 . 1 1 99 99 ALA CB C 13 20.408 0.200 . 1 . . . . . 99 ALA CB . 17022 1 1112 . 1 1 99 99 ALA N N 15 122.574 0.200 . 1 . . . . . 99 ALA N . 17022 1 1113 . 1 1 100 100 ILE H H 1 7.513 0.020 . 1 . . . . . 100 ILE H . 17022 1 1114 . 1 1 100 100 ILE HA H 1 4.146 0.020 . 1 . . . . . 100 ILE HA . 17022 1 1115 . 1 1 100 100 ILE HB H 1 1.539 0.020 . 1 . . . . . 100 ILE HB . 17022 1 1116 . 1 1 100 100 ILE HD11 H 1 0.529 0.020 . 1 . . . . . 100 ILE HD1 . 17022 1 1117 . 1 1 100 100 ILE HD12 H 1 0.529 0.020 . 1 . . . . . 100 ILE HD1 . 17022 1 1118 . 1 1 100 100 ILE HD13 H 1 0.529 0.020 . 1 . . . . . 100 ILE HD1 . 17022 1 1119 . 1 1 100 100 ILE HG12 H 1 0.845 0.020 . 2 . . . . . 100 ILE HG12 . 17022 1 1120 . 1 1 100 100 ILE HG13 H 1 0.137 0.020 . 2 . . . . . 100 ILE HG13 . 17022 1 1121 . 1 1 100 100 ILE HG21 H 1 0.589 0.020 . 1 . . . . . 100 ILE HG2 . 17022 1 1122 . 1 1 100 100 ILE HG22 H 1 0.589 0.020 . 1 . . . . . 100 ILE HG2 . 17022 1 1123 . 1 1 100 100 ILE HG23 H 1 0.589 0.020 . 1 . . . . . 100 ILE HG2 . 17022 1 1124 . 1 1 100 100 ILE C C 13 174.856 0.200 . 1 . . . . . 100 ILE C . 17022 1 1125 . 1 1 100 100 ILE CA C 13 59.582 0.200 . 1 . . . . . 100 ILE CA . 17022 1 1126 . 1 1 100 100 ILE CB C 13 38.764 0.200 . 1 . . . . . 100 ILE CB . 17022 1 1127 . 1 1 100 100 ILE CD1 C 13 15.365 0.200 . 1 . . . . . 100 ILE CD1 . 17022 1 1128 . 1 1 100 100 ILE CG1 C 13 25.797 0.200 . 1 . . . . . 100 ILE CG1 . 17022 1 1129 . 1 1 100 100 ILE CG2 C 13 18.034 0.200 . 1 . . . . . 100 ILE CG2 . 17022 1 1130 . 1 1 100 100 ILE N N 15 116.394 0.200 . 1 . . . . . 100 ILE N . 17022 1 1131 . 1 1 101 101 SER H H 1 8.737 0.020 . 1 . . . . . 101 SER H . 17022 1 1132 . 1 1 101 101 SER HA H 1 4.105 0.020 . 1 . . . . . 101 SER HA . 17022 1 1133 . 1 1 101 101 SER HB2 H 1 3.845 0.020 . 2 . . . . . 101 SER HB2 . 17022 1 1134 . 1 1 101 101 SER HB3 H 1 3.823 0.020 . 2 . . . . . 101 SER HB3 . 17022 1 1135 . 1 1 101 101 SER C C 13 175.911 0.200 . 1 . . . . . 101 SER C . 17022 1 1136 . 1 1 101 101 SER CA C 13 60.329 0.200 . 1 . . . . . 101 SER CA . 17022 1 1137 . 1 1 101 101 SER CB C 13 62.525 0.200 . 1 . . . . . 101 SER CB . 17022 1 1138 . 1 1 101 101 SER N N 15 123.823 0.200 . 1 . . . . . 101 SER N . 17022 1 1139 . 1 1 102 102 GLY H H 1 8.883 0.020 . 1 . . . . . 102 GLY H . 17022 1 1140 . 1 1 102 102 GLY HA2 H 1 4.116 0.020 . 2 . . . . . 102 GLY HA2 . 17022 1 1141 . 1 1 102 102 GLY HA3 H 1 3.622 0.020 . 2 . . . . . 102 GLY HA3 . 17022 1 1142 . 1 1 102 102 GLY C C 13 173.508 0.200 . 1 . . . . . 102 GLY C . 17022 1 1143 . 1 1 102 102 GLY CA C 13 45.314 0.200 . 1 . . . . . 102 GLY CA . 17022 1 1144 . 1 1 102 102 GLY N N 15 113.568 0.200 . 1 . . . . . 102 GLY N . 17022 1 1145 . 1 1 103 103 ALA H H 1 8.011 0.020 . 1 . . . . . 103 ALA H . 17022 1 1146 . 1 1 103 103 ALA HA H 1 5.144 0.020 . 1 . . . . . 103 ALA HA . 17022 1 1147 . 1 1 103 103 ALA HB1 H 1 1.114 0.020 . 1 . . . . . 103 ALA HB . 17022 1 1148 . 1 1 103 103 ALA HB2 H 1 1.114 0.020 . 1 . . . . . 103 ALA HB . 17022 1 1149 . 1 1 103 103 ALA HB3 H 1 1.114 0.020 . 1 . . . . . 103 ALA HB . 17022 1 1150 . 1 1 103 103 ALA C C 13 176.497 0.200 . 1 . . . . . 103 ALA C . 17022 1 1151 . 1 1 103 103 ALA CA C 13 50.404 0.200 . 1 . . . . . 103 ALA CA . 17022 1 1152 . 1 1 103 103 ALA CB C 13 18.348 0.200 . 1 . . . . . 103 ALA CB . 17022 1 1153 . 1 1 103 103 ALA N N 15 122.903 0.200 . 1 . . . . . 103 ALA N . 17022 1 1154 . 1 1 104 104 THR H H 1 9.044 0.020 . 1 . . . . . 104 THR H . 17022 1 1155 . 1 1 104 104 THR HA H 1 4.645 0.020 . 1 . . . . . 104 THR HA . 17022 1 1156 . 1 1 104 104 THR HB H 1 4.430 0.020 . 1 . . . . . 104 THR HB . 17022 1 1157 . 1 1 104 104 THR HG21 H 1 1.122 0.020 . 1 . . . . . 104 THR HG2 . 17022 1 1158 . 1 1 104 104 THR HG22 H 1 1.122 0.020 . 1 . . . . . 104 THR HG2 . 17022 1 1159 . 1 1 104 104 THR HG23 H 1 1.122 0.020 . 1 . . . . . 104 THR HG2 . 17022 1 1160 . 1 1 104 104 THR C C 13 175.969 0.200 . 1 . . . . . 104 THR C . 17022 1 1161 . 1 1 104 104 THR CA C 13 61.477 0.200 . 1 . . . . . 104 THR CA . 17022 1 1162 . 1 1 104 104 THR CB C 13 69.313 0.200 . 1 . . . . . 104 THR CB . 17022 1 1163 . 1 1 104 104 THR CG2 C 13 21.929 0.200 . 1 . . . . . 104 THR CG2 . 17022 1 1164 . 1 1 104 104 THR N N 15 115.408 0.200 . 1 . . . . . 104 THR N . 17022 1 1165 . 1 1 105 105 ILE H H 1 7.228 0.020 . 1 . . . . . 105 ILE H . 17022 1 1166 . 1 1 105 105 ILE HA H 1 4.542 0.020 . 1 . . . . . 105 ILE HA . 17022 1 1167 . 1 1 105 105 ILE HB H 1 2.328 0.020 . 1 . . . . . 105 ILE HB . 17022 1 1168 . 1 1 105 105 ILE HD11 H 1 0.618 0.020 . 1 . . . . . 105 ILE HD1 . 17022 1 1169 . 1 1 105 105 ILE HD12 H 1 0.618 0.020 . 1 . . . . . 105 ILE HD1 . 17022 1 1170 . 1 1 105 105 ILE HD13 H 1 0.618 0.020 . 1 . . . . . 105 ILE HD1 . 17022 1 1171 . 1 1 105 105 ILE HG12 H 1 1.279 0.020 . 2 . . . . . 105 ILE HG12 . 17022 1 1172 . 1 1 105 105 ILE HG13 H 1 1.158 0.020 . 2 . . . . . 105 ILE HG13 . 17022 1 1173 . 1 1 105 105 ILE HG21 H 1 1.049 0.020 . 1 . . . . . 105 ILE HG2 . 17022 1 1174 . 1 1 105 105 ILE HG22 H 1 1.049 0.020 . 1 . . . . . 105 ILE HG2 . 17022 1 1175 . 1 1 105 105 ILE HG23 H 1 1.049 0.020 . 1 . . . . . 105 ILE HG2 . 17022 1 1176 . 1 1 105 105 ILE C C 13 175.911 0.200 . 1 . . . . . 105 ILE C . 17022 1 1177 . 1 1 105 105 ILE CA C 13 61.069 0.200 . 1 . . . . . 105 ILE CA . 17022 1 1178 . 1 1 105 105 ILE CB C 13 40.036 0.200 . 1 . . . . . 105 ILE CB . 17022 1 1179 . 1 1 105 105 ILE CD1 C 13 14.337 0.200 . 1 . . . . . 105 ILE CD1 . 17022 1 1180 . 1 1 105 105 ILE CG1 C 13 23.505 0.200 . 1 . . . . . 105 ILE CG1 . 17022 1 1181 . 1 1 105 105 ILE CG2 C 13 18.255 0.200 . 1 . . . . . 105 ILE CG2 . 17022 1 1182 . 1 1 105 105 ILE N N 15 115.014 0.200 . 1 . . . . . 105 ILE N . 17022 1 1183 . 1 1 106 106 LYS H H 1 8.707 0.020 . 1 . . . . . 106 LYS H . 17022 1 1184 . 1 1 106 106 LYS HA H 1 3.747 0.020 . 1 . . . . . 106 LYS HA . 17022 1 1185 . 1 1 106 106 LYS HB2 H 1 1.859 0.020 . 2 . . . . . 106 LYS HB2 . 17022 1 1186 . 1 1 106 106 LYS HB3 H 1 1.809 0.020 . 2 . . . . . 106 LYS HB3 . 17022 1 1187 . 1 1 106 106 LYS HD2 H 1 1.517 0.020 . 1 . . . . . 106 LYS HD2 . 17022 1 1188 . 1 1 106 106 LYS HD3 H 1 1.517 0.020 . 1 . . . . . 106 LYS HD3 . 17022 1 1189 . 1 1 106 106 LYS HE2 H 1 3.005 0.020 . 1 . . . . . 106 LYS HE2 . 17022 1 1190 . 1 1 106 106 LYS HE3 H 1 3.005 0.020 . 1 . . . . . 106 LYS HE3 . 17022 1 1191 . 1 1 106 106 LYS HG2 H 1 1.326 0.020 . 1 . . . . . 106 LYS HG2 . 17022 1 1192 . 1 1 106 106 LYS HG3 H 1 1.326 0.020 . 1 . . . . . 106 LYS HG3 . 17022 1 1193 . 1 1 106 106 LYS C C 13 179.016 0.200 . 1 . . . . . 106 LYS C . 17022 1 1194 . 1 1 106 106 LYS CA C 13 58.208 0.200 . 1 . . . . . 106 LYS CA . 17022 1 1195 . 1 1 106 106 LYS CB C 13 32.618 0.200 . 1 . . . . . 106 LYS CB . 17022 1 1196 . 1 1 106 106 LYS CD C 13 29.986 0.200 . 1 . . . . . 106 LYS CD . 17022 1 1197 . 1 1 106 106 LYS CE C 13 42.137 0.200 . 1 . . . . . 106 LYS CE . 17022 1 1198 . 1 1 106 106 LYS CG C 13 24.910 0.200 . 1 . . . . . 106 LYS CG . 17022 1 1199 . 1 1 106 106 LYS N N 15 120.733 0.200 . 1 . . . . . 106 LYS N . 17022 1 1200 . 1 1 107 107 VAL H H 1 8.422 0.020 . 1 . . . . . 107 VAL H . 17022 1 1201 . 1 1 107 107 VAL HA H 1 5.028 0.020 . 1 . . . . . 107 VAL HA . 17022 1 1202 . 1 1 107 107 VAL HB H 1 2.695 0.020 . 1 . . . . . 107 VAL HB . 17022 1 1203 . 1 1 107 107 VAL HG11 H 1 1.079 0.020 . 2 . . . . . 107 VAL HG1 . 17022 1 1204 . 1 1 107 107 VAL HG12 H 1 1.079 0.020 . 2 . . . . . 107 VAL HG1 . 17022 1 1205 . 1 1 107 107 VAL HG13 H 1 1.079 0.020 . 2 . . . . . 107 VAL HG1 . 17022 1 1206 . 1 1 107 107 VAL HG21 H 1 1.194 0.020 . 2 . . . . . 107 VAL HG2 . 17022 1 1207 . 1 1 107 107 VAL HG22 H 1 1.194 0.020 . 2 . . . . . 107 VAL HG2 . 17022 1 1208 . 1 1 107 107 VAL HG23 H 1 1.194 0.020 . 2 . . . . . 107 VAL HG2 . 17022 1 1209 . 1 1 107 107 VAL C C 13 176.204 0.200 . 1 . . . . . 107 VAL C . 17022 1 1210 . 1 1 107 107 VAL CA C 13 60.790 0.200 . 1 . . . . . 107 VAL CA . 17022 1 1211 . 1 1 107 107 VAL CB C 13 33.376 0.200 . 1 . . . . . 107 VAL CB . 17022 1 1212 . 1 1 107 107 VAL CG1 C 13 22.209 0.200 . 1 . . . . . 107 VAL CG1 . 17022 1 1213 . 1 1 107 107 VAL CG2 C 13 19.159 0.200 . 1 . . . . . 107 VAL CG2 . 17022 1 1214 . 1 1 107 107 VAL N N 15 112.713 0.200 . 1 . . . . . 107 VAL N . 17022 1 1215 . 1 1 108 108 LYS H H 1 7.242 0.020 . 1 . . . . . 108 LYS H . 17022 1 1216 . 1 1 108 108 LYS HA H 1 4.773 0.020 . 1 . . . . . 108 LYS HA . 17022 1 1217 . 1 1 108 108 LYS HB2 H 1 1.676 0.020 . 2 . . . . . 108 LYS HB2 . 17022 1 1218 . 1 1 108 108 LYS HB3 H 1 1.235 0.020 . 2 . . . . . 108 LYS HB3 . 17022 1 1219 . 1 1 108 108 LYS HD2 H 1 1.678 0.020 . 1 . . . . . 108 LYS HD2 . 17022 1 1220 . 1 1 108 108 LYS HD3 H 1 1.678 0.020 . 1 . . . . . 108 LYS HD3 . 17022 1 1221 . 1 1 108 108 LYS HE2 H 1 2.966 0.020 . 1 . . . . . 108 LYS HE2 . 17022 1 1222 . 1 1 108 108 LYS HE3 H 1 2.966 0.020 . 1 . . . . . 108 LYS HE3 . 17022 1 1223 . 1 1 108 108 LYS HG2 H 1 1.247 0.020 . 1 . . . . . 108 LYS HG2 . 17022 1 1224 . 1 1 108 108 LYS HG3 H 1 1.247 0.020 . 1 . . . . . 108 LYS HG3 . 17022 1 1225 . 1 1 108 108 LYS C C 13 177.083 0.200 . 1 . . . . . 108 LYS C . 17022 1 1226 . 1 1 108 108 LYS CA C 13 59.438 0.200 . 1 . . . . . 108 LYS CA . 17022 1 1227 . 1 1 108 108 LYS CB C 13 33.678 0.200 . 1 . . . . . 108 LYS CB . 17022 1 1228 . 1 1 108 108 LYS CD C 13 28.962 0.200 . 1 . . . . . 108 LYS CD . 17022 1 1229 . 1 1 108 108 LYS CE C 13 42.137 0.200 . 1 . . . . . 108 LYS CE . 17022 1 1230 . 1 1 108 108 LYS CG C 13 24.466 0.200 . 1 . . . . . 108 LYS CG . 17022 1 1231 . 1 1 108 108 LYS N N 15 124.875 0.200 . 1 . . . . . 108 LYS N . 17022 1 1232 . 1 1 109 109 LYS H H 1 8.737 0.020 . 1 . . . . . 109 LYS H . 17022 1 1233 . 1 1 109 109 LYS HA H 1 4.006 0.020 . 1 . . . . . 109 LYS HA . 17022 1 1234 . 1 1 109 109 LYS HB2 H 1 1.901 0.020 . 2 . . . . . 109 LYS HB2 . 17022 1 1235 . 1 1 109 109 LYS HB3 H 1 1.751 0.020 . 2 . . . . . 109 LYS HB3 . 17022 1 1236 . 1 1 109 109 LYS HD2 H 1 1.819 0.020 . 2 . . . . . 109 LYS HD2 . 17022 1 1237 . 1 1 109 109 LYS HD3 H 1 1.795 0.020 . 2 . . . . . 109 LYS HD3 . 17022 1 1238 . 1 1 109 109 LYS HE2 H 1 3.091 0.020 . 1 . . . . . 109 LYS HE2 . 17022 1 1239 . 1 1 109 109 LYS HE3 H 1 3.091 0.020 . 1 . . . . . 109 LYS HE3 . 17022 1 1240 . 1 1 109 109 LYS HG2 H 1 1.616 0.020 . 2 . . . . . 109 LYS HG2 . 17022 1 1241 . 1 1 109 109 LYS HG3 H 1 1.564 0.020 . 2 . . . . . 109 LYS HG3 . 17022 1 1242 . 1 1 109 109 LYS C C 13 178.430 0.200 . 1 . . . . . 109 LYS C . 17022 1 1243 . 1 1 109 109 LYS CA C 13 59.230 0.200 . 1 . . . . . 109 LYS CA . 17022 1 1244 . 1 1 109 109 LYS CB C 13 32.306 0.200 . 1 . . . . . 109 LYS CB . 17022 1 1245 . 1 1 109 109 LYS CD C 13 29.298 0.200 . 1 . . . . . 109 LYS CD . 17022 1 1246 . 1 1 109 109 LYS CE C 13 41.842 0.200 . 1 . . . . . 109 LYS CE . 17022 1 1247 . 1 1 109 109 LYS CG C 13 25.058 0.200 . 1 . . . . . 109 LYS CG . 17022 1 1248 . 1 1 109 109 LYS N N 15 116.131 0.200 . 1 . . . . . 109 LYS N . 17022 1 1249 . 1 1 110 110 PHE H H 1 6.568 0.020 . 1 . . . . . 110 PHE H . 17022 1 1250 . 1 1 110 110 PHE HA H 1 3.036 0.020 . 1 . . . . . 110 PHE HA . 17022 1 1251 . 1 1 110 110 PHE HB2 H 1 0.329 0.020 . 2 . . . . . 110 PHE HB2 . 17022 1 1252 . 1 1 110 110 PHE HB3 H 1 2.059 0.020 . 2 . . . . . 110 PHE HB3 . 17022 1 1253 . 1 1 110 110 PHE HD1 H 1 5.421 0.020 . 1 . . . . . 110 PHE HD1 . 17022 1 1254 . 1 1 110 110 PHE HD2 H 1 5.421 0.020 . 1 . . . . . 110 PHE HD2 . 17022 1 1255 . 1 1 110 110 PHE HE1 H 1 6.408 0.020 . 1 . . . . . 110 PHE HE1 . 17022 1 1256 . 1 1 110 110 PHE HE2 H 1 6.408 0.020 . 1 . . . . . 110 PHE HE2 . 17022 1 1257 . 1 1 110 110 PHE HZ H 1 6.697 0.020 . 1 . . . . . 110 PHE HZ . 17022 1 1258 . 1 1 110 110 PHE C C 13 175.676 0.200 . 1 . . . . . 110 PHE C . 17022 1 1259 . 1 1 110 110 PHE CA C 13 60.960 0.200 . 1 . . . . . 110 PHE CA . 17022 1 1260 . 1 1 110 110 PHE CB C 13 35.900 0.200 . 1 . . . . . 110 PHE CB . 17022 1 1261 . 1 1 110 110 PHE CD1 C 13 131.979 0.200 . 1 . . . . . 110 PHE CD1 . 17022 1 1262 . 1 1 110 110 PHE CE1 C 13 129.187 0.200 . 1 . . . . . 110 PHE CE1 . 17022 1 1263 . 1 1 110 110 PHE CZ C 13 127.214 0.200 . 1 . . . . . 110 PHE CZ . 17022 1 1264 . 1 1 110 110 PHE N N 15 114.751 0.200 . 1 . . . . . 110 PHE N . 17022 1 1265 . 1 1 111 111 PHE H H 1 7.132 0.020 . 1 . . . . . 111 PHE H . 17022 1 1266 . 1 1 111 111 PHE HA H 1 3.464 0.020 . 1 . . . . . 111 PHE HA . 17022 1 1267 . 1 1 111 111 PHE HB2 H 1 3.115 0.020 . 2 . . . . . 111 PHE HB2 . 17022 1 1268 . 1 1 111 111 PHE HB3 H 1 3.248 0.020 . 2 . . . . . 111 PHE HB3 . 17022 1 1269 . 1 1 111 111 PHE HD1 H 1 7.567 0.020 . 1 . . . . . 111 PHE HD1 . 17022 1 1270 . 1 1 111 111 PHE HD2 H 1 7.567 0.020 . 1 . . . . . 111 PHE HD2 . 17022 1 1271 . 1 1 111 111 PHE HE1 H 1 7.141 0.020 . 1 . . . . . 111 PHE HE1 . 17022 1 1272 . 1 1 111 111 PHE HE2 H 1 7.141 0.020 . 1 . . . . . 111 PHE HE2 . 17022 1 1273 . 1 1 111 111 PHE C C 13 178.430 0.200 . 1 . . . . . 111 PHE C . 17022 1 1274 . 1 1 111 111 PHE CA C 13 63.753 0.200 . 1 . . . . . 111 PHE CA . 17022 1 1275 . 1 1 111 111 PHE CB C 13 38.244 0.200 . 1 . . . . . 111 PHE CB . 17022 1 1276 . 1 1 111 111 PHE CD1 C 13 132.717 0.200 . 1 . . . . . 111 PHE CD1 . 17022 1 1277 . 1 1 111 111 PHE CE1 C 13 129.888 0.200 . 1 . . . . . 111 PHE CE1 . 17022 1 1278 . 1 1 111 111 PHE N N 15 117.512 0.200 . 1 . . . . . 111 PHE N . 17022 1 1279 . 1 1 112 112 ASP H H 1 8.861 0.020 . 1 . . . . . 112 ASP H . 17022 1 1280 . 1 1 112 112 ASP HA H 1 4.188 0.020 . 1 . . . . . 112 ASP HA . 17022 1 1281 . 1 1 112 112 ASP HB2 H 1 2.670 0.020 . 2 . . . . . 112 ASP HB2 . 17022 1 1282 . 1 1 112 112 ASP HB3 H 1 2.493 0.020 . 2 . . . . . 112 ASP HB3 . 17022 1 1283 . 1 1 112 112 ASP C C 13 179.954 0.200 . 1 . . . . . 112 ASP C . 17022 1 1284 . 1 1 112 112 ASP CA C 13 57.502 0.200 . 1 . . . . . 112 ASP CA . 17022 1 1285 . 1 1 112 112 ASP CB C 13 39.799 0.200 . 1 . . . . . 112 ASP CB . 17022 1 1286 . 1 1 112 112 ASP N N 15 120.602 0.200 . 1 . . . . . 112 ASP N . 17022 1 1287 . 1 1 113 113 LEU H H 1 7.828 0.020 . 1 . . . . . 113 LEU H . 17022 1 1288 . 1 1 113 113 LEU HA H 1 3.841 0.020 . 1 . . . . . 113 LEU HA . 17022 1 1289 . 1 1 113 113 LEU HB2 H 1 1.726 0.020 . 2 . . . . . 113 LEU HB2 . 17022 1 1290 . 1 1 113 113 LEU HB3 H 1 0.803 0.020 . 2 . . . . . 113 LEU HB3 . 17022 1 1291 . 1 1 113 113 LEU HD11 H 1 0.427 0.020 . 1 . . . . . 113 LEU HD1 . 17022 1 1292 . 1 1 113 113 LEU HD12 H 1 0.427 0.020 . 1 . . . . . 113 LEU HD1 . 17022 1 1293 . 1 1 113 113 LEU HD13 H 1 0.427 0.020 . 1 . . . . . 113 LEU HD1 . 17022 1 1294 . 1 1 113 113 LEU HD21 H 1 0.427 0.020 . 1 . . . . . 113 LEU HD2 . 17022 1 1295 . 1 1 113 113 LEU HD22 H 1 0.427 0.020 . 1 . . . . . 113 LEU HD2 . 17022 1 1296 . 1 1 113 113 LEU HD23 H 1 0.427 0.020 . 1 . . . . . 113 LEU HD2 . 17022 1 1297 . 1 1 113 113 LEU HG H 1 0.579 0.020 . 1 . . . . . 113 LEU HG . 17022 1 1298 . 1 1 113 113 LEU C C 13 178.196 0.200 . 1 . . . . . 113 LEU C . 17022 1 1299 . 1 1 113 113 LEU CA C 13 57.165 0.200 . 1 . . . . . 113 LEU CA . 17022 1 1300 . 1 1 113 113 LEU CB C 13 41.178 0.200 . 1 . . . . . 113 LEU CB . 17022 1 1301 . 1 1 113 113 LEU CD1 C 13 22.987 0.200 . 1 . . . . . 113 LEU CD1 . 17022 1 1302 . 1 1 113 113 LEU CG C 13 26.684 0.200 . 1 . . . . . 113 LEU CG . 17022 1 1303 . 1 1 113 113 LEU N N 15 121.062 0.200 . 1 . . . . . 113 LEU N . 17022 1 1304 . 1 1 114 114 ALA H H 1 8.583 0.020 . 1 . . . . . 114 ALA H . 17022 1 1305 . 1 1 114 114 ALA HA H 1 3.481 0.020 . 1 . . . . . 114 ALA HA . 17022 1 1306 . 1 1 114 114 ALA HB1 H 1 0.672 0.020 . 1 . . . . . 114 ALA HB . 17022 1 1307 . 1 1 114 114 ALA HB2 H 1 0.672 0.020 . 1 . . . . . 114 ALA HB . 17022 1 1308 . 1 1 114 114 ALA HB3 H 1 0.672 0.020 . 1 . . . . . 114 ALA HB . 17022 1 1309 . 1 1 114 114 ALA C C 13 178.841 0.200 . 1 . . . . . 114 ALA C . 17022 1 1310 . 1 1 114 114 ALA CA C 13 54.938 0.200 . 1 . . . . . 114 ALA CA . 17022 1 1311 . 1 1 114 114 ALA CB C 13 17.483 0.200 . 1 . . . . . 114 ALA CB . 17022 1 1312 . 1 1 114 114 ALA N N 15 122.574 0.200 . 1 . . . . . 114 ALA N . 17022 1 1313 . 1 1 115 115 GLN H H 1 7.975 0.020 . 1 . . . . . 115 GLN H . 17022 1 1314 . 1 1 115 115 GLN HA H 1 3.705 0.020 . 1 . . . . . 115 GLN HA . 17022 1 1315 . 1 1 115 115 GLN HB2 H 1 2.002 0.020 . 2 . . . . . 115 GLN HB2 . 17022 1 1316 . 1 1 115 115 GLN HB3 H 1 2.039 0.020 . 2 . . . . . 115 GLN HB3 . 17022 1 1317 . 1 1 115 115 GLN HE21 H 1 7.176 0.020 . 2 . . . . . 115 GLN HE21 . 17022 1 1318 . 1 1 115 115 GLN HE22 H 1 6.950 0.020 . 2 . . . . . 115 GLN HE22 . 17022 1 1319 . 1 1 115 115 GLN HG2 H 1 2.174 0.020 . 2 . . . . . 115 GLN HG2 . 17022 1 1320 . 1 1 115 115 GLN HG3 H 1 2.490 0.020 . 2 . . . . . 115 GLN HG3 . 17022 1 1321 . 1 1 115 115 GLN C C 13 178.489 0.200 . 1 . . . . . 115 GLN C . 17022 1 1322 . 1 1 115 115 GLN CA C 13 58.864 0.200 . 1 . . . . . 115 GLN CA . 17022 1 1323 . 1 1 115 115 GLN CB C 13 28.302 0.200 . 1 . . . . . 115 GLN CB . 17022 1 1324 . 1 1 115 115 GLN CG C 13 34.078 0.200 . 1 . . . . . 115 GLN CG . 17022 1 1325 . 1 1 115 115 GLN N N 15 114.948 0.200 . 1 . . . . . 115 GLN N . 17022 1 1326 . 1 1 115 115 GLN NE2 N 15 111.142 0.200 . 1 . . . . . 115 GLN NE2 . 17022 1 1327 . 1 1 116 116 LYS H H 1 7.396 0.020 . 1 . . . . . 116 LYS H . 17022 1 1328 . 1 1 116 116 LYS HA H 1 3.872 0.020 . 1 . . . . . 116 LYS HA . 17022 1 1329 . 1 1 116 116 LYS HB2 H 1 1.801 0.020 . 1 . . . . . 116 LYS HB2 . 17022 1 1330 . 1 1 116 116 LYS HB3 H 1 1.801 0.020 . 1 . . . . . 116 LYS HB3 . 17022 1 1331 . 1 1 116 116 LYS HD2 H 1 1.646 0.020 . 2 . . . . . 116 LYS HD2 . 17022 1 1332 . 1 1 116 116 LYS HD3 H 1 1.516 0.020 . 2 . . . . . 116 LYS HD3 . 17022 1 1333 . 1 1 116 116 LYS HE2 H 1 3.008 0.020 . 1 . . . . . 116 LYS HE2 . 17022 1 1334 . 1 1 116 116 LYS HE3 H 1 3.008 0.020 . 1 . . . . . 116 LYS HE3 . 17022 1 1335 . 1 1 116 116 LYS HG2 H 1 1.327 0.020 . 1 . . . . . 116 LYS HG2 . 17022 1 1336 . 1 1 116 116 LYS HG3 H 1 1.327 0.020 . 1 . . . . . 116 LYS HG3 . 17022 1 1337 . 1 1 116 116 LYS C C 13 179.016 0.200 . 1 . . . . . 116 LYS C . 17022 1 1338 . 1 1 116 116 LYS CA C 13 59.614 0.200 . 1 . . . . . 116 LYS CA . 17022 1 1339 . 1 1 116 116 LYS CB C 13 32.618 0.200 . 1 . . . . . 116 LYS CB . 17022 1 1340 . 1 1 116 116 LYS CD C 13 29.992 0.200 . 1 . . . . . 116 LYS CD . 17022 1 1341 . 1 1 116 116 LYS CE C 13 42.137 0.200 . 1 . . . . . 116 LYS CE . 17022 1 1342 . 1 1 116 116 LYS CG C 13 24.836 0.200 . 1 . . . . . 116 LYS CG . 17022 1 1343 . 1 1 116 116 LYS N N 15 120.076 0.200 . 1 . . . . . 116 LYS N . 17022 1 1344 . 1 1 117 117 ALA H H 1 8.678 0.020 . 1 . . . . . 117 ALA H . 17022 1 1345 . 1 1 117 117 ALA HA H 1 3.949 0.020 . 1 . . . . . 117 ALA HA . 17022 1 1346 . 1 1 117 117 ALA HB1 H 1 1.171 0.020 . 1 . . . . . 117 ALA HB . 17022 1 1347 . 1 1 117 117 ALA HB2 H 1 1.171 0.020 . 1 . . . . . 117 ALA HB . 17022 1 1348 . 1 1 117 117 ALA HB3 H 1 1.171 0.020 . 1 . . . . . 117 ALA HB . 17022 1 1349 . 1 1 117 117 ALA C C 13 179.368 0.200 . 1 . . . . . 117 ALA C . 17022 1 1350 . 1 1 117 117 ALA CA C 13 54.813 0.200 . 1 . . . . . 117 ALA CA . 17022 1 1351 . 1 1 117 117 ALA CB C 13 17.715 0.200 . 1 . . . . . 117 ALA CB . 17022 1 1352 . 1 1 117 117 ALA N N 15 121.062 0.200 . 1 . . . . . 117 ALA N . 17022 1 1353 . 1 1 118 118 LEU H H 1 7.330 0.020 . 1 . . . . . 118 LEU H . 17022 1 1354 . 1 1 118 118 LEU HA H 1 3.830 0.020 . 1 . . . . . 118 LEU HA . 17022 1 1355 . 1 1 118 118 LEU HB2 H 1 1.560 0.020 . 2 . . . . . 118 LEU HB2 . 17022 1 1356 . 1 1 118 118 LEU HB3 H 1 1.443 0.020 . 2 . . . . . 118 LEU HB3 . 17022 1 1357 . 1 1 118 118 LEU HD11 H 1 0.633 0.020 . 2 . . . . . 118 LEU HD1 . 17022 1 1358 . 1 1 118 118 LEU HD12 H 1 0.633 0.020 . 2 . . . . . 118 LEU HD1 . 17022 1 1359 . 1 1 118 118 LEU HD13 H 1 0.633 0.020 . 2 . . . . . 118 LEU HD1 . 17022 1 1360 . 1 1 118 118 LEU HD21 H 1 0.262 0.020 . 2 . . . . . 118 LEU HD2 . 17022 1 1361 . 1 1 118 118 LEU HD22 H 1 0.262 0.020 . 2 . . . . . 118 LEU HD2 . 17022 1 1362 . 1 1 118 118 LEU HD23 H 1 0.262 0.020 . 2 . . . . . 118 LEU HD2 . 17022 1 1363 . 1 1 118 118 LEU HG H 1 1.518 0.020 . 1 . . . . . 118 LEU HG . 17022 1 1364 . 1 1 118 118 LEU C C 13 178.137 0.200 . 1 . . . . . 118 LEU C . 17022 1 1365 . 1 1 118 118 LEU CA C 13 55.017 0.200 . 1 . . . . . 118 LEU CA . 17022 1 1366 . 1 1 118 118 LEU CB C 13 41.423 0.200 . 1 . . . . . 118 LEU CB . 17022 1 1367 . 1 1 118 118 LEU CD1 C 13 25.366 0.200 . 1 . . . . . 118 LEU CD1 . 17022 1 1368 . 1 1 118 118 LEU CD2 C 13 21.831 0.200 . 1 . . . . . 118 LEU CD2 . 17022 1 1369 . 1 1 118 118 LEU CG C 13 26.733 0.200 . 1 . . . . . 118 LEU CG . 17022 1 1370 . 1 1 118 118 LEU N N 15 112.844 0.200 . 1 . . . . . 118 LEU N . 17022 1 1371 . 1 1 119 119 LYS H H 1 7.513 0.020 . 1 . . . . . 119 LYS H . 17022 1 1372 . 1 1 119 119 LYS HA H 1 4.038 0.020 . 1 . . . . . 119 LYS HA . 17022 1 1373 . 1 1 119 119 LYS HB2 H 1 1.959 0.020 . 2 . . . . . 119 LYS HB2 . 17022 1 1374 . 1 1 119 119 LYS HB3 H 1 1.859 0.020 . 2 . . . . . 119 LYS HB3 . 17022 1 1375 . 1 1 119 119 LYS HD2 H 1 1.048 0.020 . 1 . . . . . 119 LYS HD2 . 17022 1 1376 . 1 1 119 119 LYS HD3 H 1 1.048 0.020 . 1 . . . . . 119 LYS HD3 . 17022 1 1377 . 1 1 119 119 LYS HE2 H 1 2.814 0.020 . 2 . . . . . 119 LYS HE2 . 17022 1 1378 . 1 1 119 119 LYS HE3 H 1 2.785 0.020 . 2 . . . . . 119 LYS HE3 . 17022 1 1379 . 1 1 119 119 LYS HG2 H 1 1.508 0.020 . 1 . . . . . 119 LYS HG2 . 17022 1 1380 . 1 1 119 119 LYS HG3 H 1 1.508 0.020 . 1 . . . . . 119 LYS HG3 . 17022 1 1381 . 1 1 119 119 LYS C C 13 178.079 0.200 . 1 . . . . . 119 LYS C . 17022 1 1382 . 1 1 119 119 LYS CA C 13 59.216 0.200 . 1 . . . . . 119 LYS CA . 17022 1 1383 . 1 1 119 119 LYS CB C 13 32.150 0.200 . 1 . . . . . 119 LYS CB . 17022 1 1384 . 1 1 119 119 LYS CD C 13 29.257 0.200 . 1 . . . . . 119 LYS CD . 17022 1 1385 . 1 1 119 119 LYS CE C 13 42.211 0.200 . 1 . . . . . 119 LYS CE . 17022 1 1386 . 1 1 119 119 LYS CG C 13 24.318 0.200 . 1 . . . . . 119 LYS CG . 17022 1 1387 . 1 1 119 119 LYS N N 15 122.377 0.200 . 1 . . . . . 119 LYS N . 17022 1 1388 . 1 1 120 120 ASP H H 1 8.217 0.020 . 1 . . . . . 120 ASP H . 17022 1 1389 . 1 1 120 120 ASP HA H 1 4.770 0.020 . 1 . . . . . 120 ASP HA . 17022 1 1390 . 1 1 120 120 ASP HB2 H 1 2.957 0.020 . 2 . . . . . 120 ASP HB2 . 17022 1 1391 . 1 1 120 120 ASP HB3 H 1 2.741 0.020 . 2 . . . . . 120 ASP HB3 . 17022 1 1392 . 1 1 120 120 ASP C C 13 176.614 0.200 . 1 . . . . . 120 ASP C . 17022 1 1393 . 1 1 120 120 ASP CA C 13 55.143 0.200 . 1 . . . . . 120 ASP CA . 17022 1 1394 . 1 1 120 120 ASP CB C 13 40.900 0.200 . 1 . . . . . 120 ASP CB . 17022 1 1395 . 1 1 120 120 ASP N N 15 118.235 0.200 . 1 . . . . . 120 ASP N . 17022 1 1396 . 1 1 121 121 ALA H H 1 7.609 0.020 . 1 . . . . . 121 ALA H . 17022 1 1397 . 1 1 121 121 ALA HA H 1 4.254 0.020 . 1 . . . . . 121 ALA HA . 17022 1 1398 . 1 1 121 121 ALA HB1 H 1 1.044 0.020 . 1 . . . . . 121 ALA HB . 17022 1 1399 . 1 1 121 121 ALA HB2 H 1 1.044 0.020 . 1 . . . . . 121 ALA HB . 17022 1 1400 . 1 1 121 121 ALA HB3 H 1 1.044 0.020 . 1 . . . . . 121 ALA HB . 17022 1 1401 . 1 1 121 121 ALA C C 13 177.786 0.200 . 1 . . . . . 121 ALA C . 17022 1 1402 . 1 1 121 121 ALA CA C 13 53.436 0.200 . 1 . . . . . 121 ALA CA . 17022 1 1403 . 1 1 121 121 ALA CB C 13 19.024 0.200 . 1 . . . . . 121 ALA CB . 17022 1 1404 . 1 1 121 121 ALA N N 15 121.917 0.200 . 1 . . . . . 121 ALA N . 17022 1 1405 . 1 1 122 122 GLU H H 1 7.916 0.020 . 1 . . . . . 122 GLU H . 17022 1 1406 . 1 1 122 122 GLU HA H 1 4.329 0.020 . 1 . . . . . 122 GLU HA . 17022 1 1407 . 1 1 122 122 GLU HB2 H 1 2.092 0.020 . 2 . . . . . 122 GLU HB2 . 17022 1 1408 . 1 1 122 122 GLU HB3 H 1 1.926 0.020 . 2 . . . . . 122 GLU HB3 . 17022 1 1409 . 1 1 122 122 GLU HG2 H 1 2.296 0.020 . 2 . . . . . 122 GLU HG2 . 17022 1 1410 . 1 1 122 122 GLU HG3 H 1 2.178 0.020 . 2 . . . . . 122 GLU HG3 . 17022 1 1411 . 1 1 122 122 GLU C C 13 176.497 0.200 . 1 . . . . . 122 GLU C . 17022 1 1412 . 1 1 122 122 GLU CA C 13 56.139 0.200 . 1 . . . . . 122 GLU CA . 17022 1 1413 . 1 1 122 122 GLU CB C 13 30.118 0.200 . 1 . . . . . 122 GLU CB . 17022 1 1414 . 1 1 122 122 GLU CG C 13 36.000 0.200 . 1 . . . . . 122 GLU CG . 17022 1 1415 . 1 1 122 122 GLU N N 15 117.118 0.200 . 1 . . . . . 122 GLU N . 17022 1 1416 . 1 1 123 123 LYS H H 1 7.975 0.020 . 1 . . . . . 123 LYS H . 17022 1 1417 . 1 1 123 123 LYS HA H 1 4.246 0.020 . 1 . . . . . 123 LYS HA . 17022 1 1418 . 1 1 123 123 LYS HB2 H 1 1.762 0.020 . 2 . . . . . 123 LYS HB2 . 17022 1 1419 . 1 1 123 123 LYS HB3 H 1 1.830 0.020 . 2 . . . . . 123 LYS HB3 . 17022 1 1420 . 1 1 123 123 LYS HD2 H 1 1.683 0.020 . 1 . . . . . 123 LYS HD2 . 17022 1 1421 . 1 1 123 123 LYS HD3 H 1 1.683 0.020 . 1 . . . . . 123 LYS HD3 . 17022 1 1422 . 1 1 123 123 LYS HE2 H 1 3.044 0.020 . 1 . . . . . 123 LYS HE2 . 17022 1 1423 . 1 1 123 123 LYS HE3 H 1 3.044 0.020 . 1 . . . . . 123 LYS HE3 . 17022 1 1424 . 1 1 123 123 LYS HG2 H 1 1.466 0.020 . 2 . . . . . 123 LYS HG2 . 17022 1 1425 . 1 1 123 123 LYS HG3 H 1 1.379 0.020 . 2 . . . . . 123 LYS HG3 . 17022 1 1426 . 1 1 123 123 LYS C C 13 176.497 0.200 . 1 . . . . . 123 LYS C . 17022 1 1427 . 1 1 123 123 LYS CA C 13 56.728 0.200 . 1 . . . . . 123 LYS CA . 17022 1 1428 . 1 1 123 123 LYS CB C 13 32.982 0.200 . 1 . . . . . 123 LYS CB . 17022 1 1429 . 1 1 123 123 LYS CD C 13 29.124 0.200 . 1 . . . . . 123 LYS CD . 17022 1 1430 . 1 1 123 123 LYS CE C 13 42.063 0.200 . 1 . . . . . 123 LYS CE . 17022 1 1431 . 1 1 123 123 LYS CG C 13 24.855 0.200 . 1 . . . . . 123 LYS CG . 17022 1 1432 . 1 1 123 123 LYS N N 15 121.325 0.200 . 1 . . . . . 123 LYS N . 17022 1 1433 . 1 1 124 124 LEU H H 1 8.239 0.020 . 1 . . . . . 124 LEU H . 17022 1 1434 . 1 1 124 124 LEU HA H 1 4.288 0.020 . 1 . . . . . 124 LEU HA . 17022 1 1435 . 1 1 124 124 LEU HB2 H 1 1.606 0.020 . 2 . . . . . 124 LEU HB2 . 17022 1 1436 . 1 1 124 124 LEU HB3 H 1 1.511 0.020 . 2 . . . . . 124 LEU HB3 . 17022 1 1437 . 1 1 124 124 LEU HD11 H 1 0.895 0.020 . 2 . . . . . 124 LEU HD1 . 17022 1 1438 . 1 1 124 124 LEU HD12 H 1 0.895 0.020 . 2 . . . . . 124 LEU HD1 . 17022 1 1439 . 1 1 124 124 LEU HD13 H 1 0.895 0.020 . 2 . . . . . 124 LEU HD1 . 17022 1 1440 . 1 1 124 124 LEU HD21 H 1 0.830 0.020 . 2 . . . . . 124 LEU HD2 . 17022 1 1441 . 1 1 124 124 LEU HD22 H 1 0.830 0.020 . 2 . . . . . 124 LEU HD2 . 17022 1 1442 . 1 1 124 124 LEU HD23 H 1 0.830 0.020 . 2 . . . . . 124 LEU HD2 . 17022 1 1443 . 1 1 124 124 LEU HG H 1 1.568 0.020 . 1 . . . . . 124 LEU HG . 17022 1 1444 . 1 1 124 124 LEU C C 13 177.258 0.200 . 1 . . . . . 124 LEU C . 17022 1 1445 . 1 1 124 124 LEU CA C 13 55.143 0.200 . 1 . . . . . 124 LEU CA . 17022 1 1446 . 1 1 124 124 LEU CB C 13 42.307 0.200 . 1 . . . . . 124 LEU CB . 17022 1 1447 . 1 1 124 124 LEU CD1 C 13 24.923 0.200 . 1 . . . . . 124 LEU CD1 . 17022 1 1448 . 1 1 124 124 LEU CD2 C 13 23.370 0.200 . 1 . . . . . 124 LEU CD2 . 17022 1 1449 . 1 1 124 124 LEU CG C 13 26.980 0.200 . 1 . . . . . 124 LEU CG . 17022 1 1450 . 1 1 124 124 LEU N N 15 123.100 0.200 . 1 . . . . . 124 LEU N . 17022 1 1451 . 1 1 125 125 GLU H H 1 8.297 0.020 . 1 . . . . . 125 GLU H . 17022 1 1452 . 1 1 125 125 GLU HA H 1 4.204 0.020 . 1 . . . . . 125 GLU HA . 17022 1 1453 . 1 1 125 125 GLU HB2 H 1 1.902 0.020 . 2 . . . . . 125 GLU HB2 . 17022 1 1454 . 1 1 125 125 GLU HB3 H 1 1.855 0.020 . 2 . . . . . 125 GLU HB3 . 17022 1 1455 . 1 1 125 125 GLU HG2 H 1 2.182 0.020 . 2 . . . . . 125 GLU HG2 . 17022 1 1456 . 1 1 125 125 GLU HG3 H 1 2.118 0.020 . 2 . . . . . 125 GLU HG3 . 17022 1 1457 . 1 1 125 125 GLU C C 13 176.087 0.200 . 1 . . . . . 125 GLU C . 17022 1 1458 . 1 1 125 125 GLU CA C 13 56.455 0.200 . 1 . . . . . 125 GLU CA . 17022 1 1459 . 1 1 125 125 GLU CB C 13 30.357 0.200 . 1 . . . . . 125 GLU CB . 17022 1 1460 . 1 1 125 125 GLU CG C 13 36.074 0.200 . 1 . . . . . 125 GLU CG . 17022 1 1461 . 1 1 125 125 GLU N N 15 121.062 0.200 . 1 . . . . . 125 GLU N . 17022 1 1462 . 1 1 126 126 HIS H H 1 8.261 0.020 . 1 . . . . . 126 HIS H . 17022 1 1463 . 1 1 126 126 HIS C C 13 174.856 0.200 . 1 . . . . . 126 HIS C . 17022 1 1464 . 1 1 126 126 HIS CA C 13 55.787 0.200 . 1 . . . . . 126 HIS CA . 17022 1 1465 . 1 1 126 126 HIS CB C 13 30.275 0.200 . 1 . . . . . 126 HIS CB . 17022 1 1466 . 1 1 126 126 HIS N N 15 119.682 0.200 . 1 . . . . . 126 HIS N . 17022 1 stop_ save_