################################### # 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 17930 _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 1 '2D 1H-15N HSQC' . . . 17930 1 2 '2D 1H-13C HSQC' . . . 17930 1 3 '3D HNCO' . . . 17930 1 4 '3D HNCACB' . . . 17930 1 5 '3D 1H-13C NOESY aliphatic' . . . 17930 1 6 '3D 1H-13C NOESY aromatic' . . . 17930 1 7 '3D 1H-15N NOESY' . . . 17930 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 21 21 LYS HA H 1 3.993 0.02 . 1 . . . A 716 LYS HA . 17930 1 2 . 1 1 21 21 LYS HB2 H 1 1.747 0.02 . 2 . . . A 716 LYS HB2 . 17930 1 3 . 1 1 21 21 LYS HB3 H 1 1.635 0.02 . 2 . . . A 716 LYS HB3 . 17930 1 4 . 1 1 21 21 LYS HG2 H 1 1.425 0.02 . 2 . . . A 716 LYS HG2 . 17930 1 5 . 1 1 21 21 LYS HG3 H 1 1.425 0.02 . 2 . . . A 716 LYS HG3 . 17930 1 6 . 1 1 21 21 LYS HD2 H 1 1.661 0.02 . 2 . . . A 716 LYS HD2 . 17930 1 7 . 1 1 21 21 LYS HD3 H 1 1.661 0.02 . 2 . . . A 716 LYS HD3 . 17930 1 8 . 1 1 21 21 LYS HE2 H 1 2.952 0.02 . 2 . . . A 716 LYS HE2 . 17930 1 9 . 1 1 21 21 LYS HE3 H 1 2.952 0.02 . 2 . . . A 716 LYS HE3 . 17930 1 10 . 1 1 21 21 LYS H H 1 8.031 0.02 . 1 . . . A 716 LYS H1 . 17930 1 11 . 1 1 21 21 LYS C C 13 178.139 0.02 . 1 . . . A 716 LYS C . 17930 1 12 . 1 1 21 21 LYS CA C 13 57.794 0.02 . 1 . . . A 716 LYS CA . 17930 1 13 . 1 1 21 21 LYS CB C 13 30.045 0.02 . 1 . . . A 716 LYS CB . 17930 1 14 . 1 1 21 21 LYS CG C 13 25.056 0.02 . 1 . . . A 716 LYS CG . 17930 1 15 . 1 1 21 21 LYS CD C 13 29.335 0.02 . 1 . . . A 716 LYS CD . 17930 1 16 . 1 1 21 21 LYS CE C 13 38.525 0.02 . 1 . . . A 716 LYS CE . 17930 1 17 . 1 1 21 21 LYS N N 15 119.767 0.02 . 1 . . . A 716 LYS N . 17930 1 18 . 1 1 22 22 LEU H H 1 7.838 0.02 . 1 . . . A 717 LEU H . 17930 1 19 . 1 1 22 22 LEU HA H 1 4.130 0.02 . 1 . . . A 717 LEU HA . 17930 1 20 . 1 1 22 22 LEU HB2 H 1 1.673 0.02 . 2 . . . A 717 LEU HB2 . 17930 1 21 . 1 1 22 22 LEU HB3 H 1 1.758 0.02 . 2 . . . A 717 LEU HB3 . 17930 1 22 . 1 1 22 22 LEU HG H 1 1.660 0.02 . 1 . . . A 717 LEU HG . 17930 1 23 . 1 1 22 22 LEU HD11 H 1 0.910 0.02 . 2 . . . A 717 LEU HD11 . 17930 1 24 . 1 1 22 22 LEU HD12 H 1 0.910 0.02 . 2 . . . A 717 LEU HD12 . 17930 1 25 . 1 1 22 22 LEU HD13 H 1 0.910 0.02 . 2 . . . A 717 LEU HD13 . 17930 1 26 . 1 1 22 22 LEU HD21 H 1 0.819 0.02 . 2 . . . A 717 LEU HD21 . 17930 1 27 . 1 1 22 22 LEU HD22 H 1 0.819 0.02 . 2 . . . A 717 LEU HD22 . 17930 1 28 . 1 1 22 22 LEU HD23 H 1 0.819 0.02 . 2 . . . A 717 LEU HD23 . 17930 1 29 . 1 1 22 22 LEU C C 13 177.845 0.02 . 1 . . . A 717 LEU C . 17930 1 30 . 1 1 22 22 LEU CA C 13 56.674 0.02 . 1 . . . A 717 LEU CA . 17930 1 31 . 1 1 22 22 LEU CB C 13 41.924 0.02 . 1 . . . A 717 LEU CB . 17930 1 32 . 1 1 22 22 LEU CG C 13 29.000 0.02 . 1 . . . A 717 LEU CG . 17930 1 33 . 1 1 22 22 LEU CD1 C 13 24.690 0.02 . 2 . . . A 717 LEU CD1 . 17930 1 34 . 1 1 22 22 LEU CD2 C 13 23.717 0.02 . 2 . . . A 717 LEU CD2 . 17930 1 35 . 1 1 22 22 LEU N N 15 119.998 0.02 . 1 . . . A 717 LEU N . 17930 1 36 . 1 1 23 23 LEU H H 1 7.727 0.02 . 1 . . . A 718 LEU H . 17930 1 37 . 1 1 23 23 LEU HA H 1 4.057 0.02 . 1 . . . A 718 LEU HA . 17930 1 38 . 1 1 23 23 LEU HB2 H 1 1.813 0.02 . 2 . . . A 718 LEU HB2 . 17930 1 39 . 1 1 23 23 LEU HB3 H 1 1.813 0.02 . 2 . . . A 718 LEU HB3 . 17930 1 40 . 1 1 23 23 LEU HG H 1 1.671 0.02 . 1 . . . A 718 LEU HG . 17930 1 41 . 1 1 23 23 LEU HD11 H 1 0.870 0.02 . 2 . . . A 718 LEU HD11 . 17930 1 42 . 1 1 23 23 LEU HD12 H 1 0.870 0.02 . 2 . . . A 718 LEU HD12 . 17930 1 43 . 1 1 23 23 LEU HD13 H 1 0.870 0.02 . 2 . . . A 718 LEU HD13 . 17930 1 44 . 1 1 23 23 LEU HD21 H 1 0.860 0.02 . 2 . . . A 718 LEU HD21 . 17930 1 45 . 1 1 23 23 LEU HD22 H 1 0.860 0.02 . 2 . . . A 718 LEU HD22 . 17930 1 46 . 1 1 23 23 LEU HD23 H 1 0.860 0.02 . 2 . . . A 718 LEU HD23 . 17930 1 47 . 1 1 23 23 LEU C C 13 177.838 0.02 . 1 . . . A 718 LEU C . 17930 1 48 . 1 1 23 23 LEU CA C 13 56.943 0.02 . 1 . . . A 718 LEU CA . 17930 1 49 . 1 1 23 23 LEU CB C 13 41.806 0.02 . 1 . . . A 718 LEU CB . 17930 1 50 . 1 1 23 23 LEU CG C 13 27.185 0.02 . 1 . . . A 718 LEU CG . 17930 1 51 . 1 1 23 23 LEU CD1 C 13 24.930 0.02 . 2 . . . A 718 LEU CD1 . 17930 1 52 . 1 1 23 23 LEU CD2 C 13 24.274 0.02 . 2 . . . A 718 LEU CD2 . 17930 1 53 . 1 1 23 23 LEU N N 15 118.244 0.02 . 1 . . . A 718 LEU N . 17930 1 54 . 1 1 24 24 ILE H H 1 7.738 0.02 . 1 . . . A 719 ILE H . 17930 1 55 . 1 1 24 24 ILE HA H 1 3.911 0.02 . 1 . . . A 719 ILE HA . 17930 1 56 . 1 1 24 24 ILE HB H 1 1.896 0.02 . 1 . . . A 719 ILE HB . 17930 1 57 . 1 1 24 24 ILE HG12 H 1 1.566 0.02 . 2 . . . A 719 ILE HG12 . 17930 1 58 . 1 1 24 24 ILE HG13 H 1 1.195 0.02 . 2 . . . A 719 ILE HG13 . 17930 1 59 . 1 1 24 24 ILE HG21 H 1 0.916 0.02 . 1 . . . A 719 ILE HG21 . 17930 1 60 . 1 1 24 24 ILE HG22 H 1 0.916 0.02 . 1 . . . A 719 ILE HG22 . 17930 1 61 . 1 1 24 24 ILE HG23 H 1 0.916 0.02 . 1 . . . A 719 ILE HG23 . 17930 1 62 . 1 1 24 24 ILE HD11 H 1 0.743 0.02 . 1 . . . A 719 ILE HD11 . 17930 1 63 . 1 1 24 24 ILE HD12 H 1 0.743 0.02 . 1 . . . A 719 ILE HD12 . 17930 1 64 . 1 1 24 24 ILE HD13 H 1 0.743 0.02 . 1 . . . A 719 ILE HD13 . 17930 1 65 . 1 1 24 24 ILE C C 13 176.887 0.02 . 1 . . . A 719 ILE C . 17930 1 66 . 1 1 24 24 ILE CA C 13 62.960 0.02 . 1 . . . A 719 ILE CA . 17930 1 67 . 1 1 24 24 ILE CB C 13 38.219 0.02 . 1 . . . A 719 ILE CB . 17930 1 68 . 1 1 24 24 ILE CG1 C 13 28.224 0.02 . 1 . . . A 719 ILE CG1 . 17930 1 69 . 1 1 24 24 ILE CG2 C 13 17.685 0.02 . 1 . . . A 719 ILE CG2 . 17930 1 70 . 1 1 24 24 ILE CD1 C 13 13.370 0.02 . 1 . . . A 719 ILE CD1 . 17930 1 71 . 1 1 24 24 ILE N N 15 116.296 0.02 . 1 . . . A 719 ILE N . 17930 1 72 . 1 1 25 25 THR H H 1 7.803 0.02 . 1 . . . A 720 THR H . 17930 1 73 . 1 1 25 25 THR HA H 1 4.161 0.02 . 1 . . . A 720 THR HA . 17930 1 74 . 1 1 25 25 THR HB H 1 4.300 0.02 . 1 . . . A 720 THR HB . 17930 1 75 . 1 1 25 25 THR HG21 H 1 1.195 0.02 . 1 . . . A 720 THR HG21 . 17930 1 76 . 1 1 25 25 THR HG22 H 1 1.195 0.02 . 1 . . . A 720 THR HG22 . 17930 1 77 . 1 1 25 25 THR HG23 H 1 1.195 0.02 . 1 . . . A 720 THR HG23 . 17930 1 78 . 1 1 25 25 THR C C 13 175.578 0.02 . 1 . . . A 720 THR C . 17930 1 79 . 1 1 25 25 THR CA C 13 64.390 0.02 . 1 . . . A 720 THR CA . 17930 1 80 . 1 1 25 25 THR CB C 13 69.027 0.02 . 1 . . . A 720 THR CB . 17930 1 81 . 1 1 25 25 THR CG2 C 13 21.615 0.02 . 1 . . . A 720 THR CG2 . 17930 1 82 . 1 1 25 25 THR N N 15 114.599 0.02 . 1 . . . A 720 THR N . 17930 1 83 . 1 1 26 26 ILE H H 1 7.786 0.02 . 1 . . . A 721 ILE H . 17930 1 84 . 1 1 26 26 ILE HA H 1 3.909 0.02 . 1 . . . A 721 ILE HA . 17930 1 85 . 1 1 26 26 ILE HB H 1 1.945 0.02 . 1 . . . A 721 ILE HB . 17930 1 86 . 1 1 26 26 ILE HG12 H 1 1.123 0.02 . 2 . . . A 721 ILE HG12 . 17930 1 87 . 1 1 26 26 ILE HG13 H 1 1.526 0.02 . 2 . . . A 721 ILE HG13 . 17930 1 88 . 1 1 26 26 ILE HG21 H 1 0.795 0.02 . 1 . . . A 721 ILE HG21 . 17930 1 89 . 1 1 26 26 ILE HG22 H 1 0.795 0.02 . 1 . . . A 721 ILE HG22 . 17930 1 90 . 1 1 26 26 ILE HG23 H 1 0.795 0.02 . 1 . . . A 721 ILE HG23 . 17930 1 91 . 1 1 26 26 ILE HD11 H 1 0.816 0.02 . 1 . . . A 721 ILE HD11 . 17930 1 92 . 1 1 26 26 ILE HD12 H 1 0.816 0.02 . 1 . . . A 721 ILE HD12 . 17930 1 93 . 1 1 26 26 ILE HD13 H 1 0.816 0.02 . 1 . . . A 721 ILE HD13 . 17930 1 94 . 1 1 26 26 ILE C C 13 176.119 0.02 . 1 . . . A 721 ILE C . 17930 1 95 . 1 1 26 26 ILE CA C 13 63.025 0.02 . 1 . . . A 721 ILE CA . 17930 1 96 . 1 1 26 26 ILE CB C 13 38.134 0.02 . 1 . . . A 721 ILE CB . 17930 1 97 . 1 1 26 26 ILE CG1 C 13 27.929 0.02 . 1 . . . A 721 ILE CG1 . 17930 1 98 . 1 1 26 26 ILE CG2 C 13 17.597 0.02 . 1 . . . A 721 ILE CG2 . 17930 1 99 . 1 1 26 26 ILE CD1 C 13 13.254 0.02 . 1 . . . A 721 ILE CD1 . 17930 1 100 . 1 1 26 26 ILE N N 15 119.767 0.02 . 1 . . . A 721 ILE N . 17930 1 101 . 1 1 27 27 HIS H H 1 8.134 0.02 . 1 . . . A 722 HIS H . 17930 1 102 . 1 1 27 27 HIS HA H 1 4.615 0.02 . 1 . . . A 722 HIS HA . 17930 1 103 . 1 1 27 27 HIS HB2 H 1 3.096 0.02 . 2 . . . A 722 HIS HB2 . 17930 1 104 . 1 1 27 27 HIS HB3 H 1 3.267 0.02 . 2 . . . A 722 HIS HB3 . 17930 1 105 . 1 1 27 27 HIS HD2 H 1 7.120 0.02 . 1 . . . A 722 HIS HD2 . 17930 1 106 . 1 1 27 27 HIS CA C 13 57.344 0.02 . 1 . . . A 722 HIS CA . 17930 1 107 . 1 1 27 27 HIS CB C 13 29.375 0.02 . 1 . . . A 722 HIS CB . 17930 1 108 . 1 1 27 27 HIS CD2 C 13 120.340 0.02 . 1 . . . A 722 HIS CD2 . 17930 1 109 . 1 1 27 27 HIS N N 15 118.437 0.02 . 1 . . . A 722 HIS N . 17930 1 110 . 1 1 28 28 ASP H H 1 8.025 0.02 . 1 . . . A 723 ASP H . 17930 1 111 . 1 1 28 28 ASP HA H 1 4.594 0.02 . 1 . . . A 723 ASP HA . 17930 1 112 . 1 1 28 28 ASP HB2 H 1 2.697 0.02 . 2 . . . A 723 ASP HB2 . 17930 1 113 . 1 1 28 28 ASP HB3 H 1 2.732 0.02 . 2 . . . A 723 ASP HB3 . 17930 1 114 . 1 1 28 28 ASP C C 13 176.711 0.02 . 1 . . . A 723 ASP C . 17930 1 115 . 1 1 28 28 ASP CA C 13 54.176 0.02 . 1 . . . A 723 ASP CA . 17930 1 116 . 1 1 28 28 ASP CB C 13 41.480 0.02 . 1 . . . A 723 ASP CB . 17930 1 117 . 1 1 28 28 ASP N N 15 118.080 0.02 . 1 . . . A 723 ASP N . 17930 1 118 . 1 1 29 29 ARG H H 1 8.219 0.02 . 1 . . . A 724 ARG H . 17930 1 119 . 1 1 29 29 ARG HA H 1 4.204 0.02 . 1 . . . A 724 ARG HA . 17930 1 120 . 1 1 29 29 ARG HB2 H 1 1.742 0.02 . 2 . . . A 724 ARG HB2 . 17930 1 121 . 1 1 29 29 ARG HB3 H 1 1.656 0.02 . 2 . . . A 724 ARG HB3 . 17930 1 122 . 1 1 29 29 ARG HD2 H 1 3.159 0.02 . 2 . . . A 724 ARG HD2 . 17930 1 123 . 1 1 29 29 ARG HD3 H 1 3.159 0.02 . 2 . . . A 724 ARG HD3 . 17930 1 124 . 1 1 29 29 ARG C C 13 177.662 0.02 . 1 . . . A 724 ARG C . 17930 1 125 . 1 1 29 29 ARG CA C 13 56.819 0.02 . 1 . . . A 724 ARG CA . 17930 1 126 . 1 1 29 29 ARG CB C 13 32.703 0.02 . 1 . . . A 724 ARG CB . 17930 1 127 . 1 1 29 29 ARG CD C 13 39.026 0.02 . 1 . . . A 724 ARG CD . 17930 1 128 . 1 1 29 29 ARG N N 15 120.693 0.02 . 1 . . . A 724 ARG N . 17930 1 129 . 1 1 30 30 LYS H H 1 8.493 0.02 . 1 . . . A 725 LYS H . 17930 1 130 . 1 1 30 30 LYS HA H 1 4.140 0.02 . 1 . . . A 725 LYS HA . 17930 1 131 . 1 1 30 30 LYS HB2 H 1 1.850 0.02 . 2 . . . A 725 LYS HB2 . 17930 1 132 . 1 1 30 30 LYS HB3 H 1 1.850 0.02 . 2 . . . A 725 LYS HB3 . 17930 1 133 . 1 1 30 30 LYS HG2 H 1 1.432 0.02 . 2 . . . A 725 LYS HG2 . 17930 1 134 . 1 1 30 30 LYS HG3 H 1 1.432 0.02 . 2 . . . A 725 LYS HG3 . 17930 1 135 . 1 1 30 30 LYS HE2 H 1 3.213 0.02 . 2 . . . A 725 LYS HE2 . 17930 1 136 . 1 1 30 30 LYS HE3 H 1 3.213 0.02 . 2 . . . A 725 LYS HE3 . 17930 1 137 . 1 1 30 30 LYS C C 13 178.127 0.02 . 1 . . . A 725 LYS C . 17930 1 138 . 1 1 30 30 LYS CA C 13 57.637 0.02 . 1 . . . A 725 LYS CA . 17930 1 139 . 1 1 30 30 LYS CB C 13 32.190 0.02 . 1 . . . A 725 LYS CB . 17930 1 140 . 1 1 30 30 LYS CG C 13 24.793 0.02 . 1 . . . A 725 LYS CG . 17930 1 141 . 1 1 30 30 LYS CE C 13 42.918 0.02 . 1 . . . A 725 LYS CE . 17930 1 142 . 1 1 30 30 LYS N N 15 121.792 0.02 . 1 . . . A 725 LYS N . 17930 1 143 . 1 1 31 31 GLU H H 1 8.716 0.02 . 1 . . . A 726 GLU H . 17930 1 144 . 1 1 31 31 GLU HA H 1 4.096 0.02 . 1 . . . A 726 GLU HA . 17930 1 145 . 1 1 31 31 GLU HB2 H 1 1.902 0.02 . 2 . . . A 726 GLU HB2 . 17930 1 146 . 1 1 31 31 GLU HB3 H 1 1.937 0.02 . 2 . . . A 726 GLU HB3 . 17930 1 147 . 1 1 31 31 GLU HG2 H 1 2.238 0.02 . 2 . . . A 726 GLU HG2 . 17930 1 148 . 1 1 31 31 GLU HG3 H 1 2.238 0.02 . 2 . . . A 726 GLU HG3 . 17930 1 149 . 1 1 31 31 GLU C C 13 177.688 0.02 . 1 . . . A 726 GLU C . 17930 1 150 . 1 1 31 31 GLU CA C 13 58.406 0.02 . 1 . . . A 726 GLU CA . 17930 1 151 . 1 1 31 31 GLU CB C 13 29.340 0.02 . 1 . . . A 726 GLU CB . 17930 1 152 . 1 1 31 31 GLU CG C 13 36.199 0.02 . 1 . . . A 726 GLU CG . 17930 1 153 . 1 1 31 31 GLU N N 15 119.285 0.02 . 1 . . . A 726 GLU N . 17930 1 154 . 1 1 32 32 PHE H H 1 7.906 0.02 . 1 . . . A 727 PHE H . 17930 1 155 . 1 1 32 32 PHE HA H 1 4.378 0.02 . 1 . . . A 727 PHE HA . 17930 1 156 . 1 1 32 32 PHE HB2 H 1 3.153 0.02 . 2 . . . A 727 PHE HB2 . 17930 1 157 . 1 1 32 32 PHE HB3 H 1 3.153 0.02 . 2 . . . A 727 PHE HB3 . 17930 1 158 . 1 1 32 32 PHE HD1 H 1 7.176 0.02 . 3 . . . A 727 PHE HD1 . 17930 1 159 . 1 1 32 32 PHE HD2 H 1 7.176 0.02 . 3 . . . A 727 PHE HD2 . 17930 1 160 . 1 1 32 32 PHE HE1 H 1 7.215 0.02 . 3 . . . A 727 PHE HE1 . 17930 1 161 . 1 1 32 32 PHE HE2 H 1 7.215 0.02 . 3 . . . A 727 PHE HE2 . 17930 1 162 . 1 1 32 32 PHE C C 13 176.358 0.02 . 1 . . . A 727 PHE C . 17930 1 163 . 1 1 32 32 PHE CA C 13 59.332 0.02 . 1 . . . A 727 PHE CA . 17930 1 164 . 1 1 32 32 PHE CB C 13 39.160 0.02 . 1 . . . A 727 PHE CB . 17930 1 165 . 1 1 32 32 PHE CD1 C 13 131.605 0.02 . 3 . . . A 727 PHE CD1 . 17930 1 166 . 1 1 32 32 PHE CD2 C 13 131.605 0.02 . 3 . . . A 727 PHE CD2 . 17930 1 167 . 1 1 32 32 PHE CE1 C 13 131.660 0.02 . 3 . . . A 727 PHE CE1 . 17930 1 168 . 1 1 32 32 PHE CE2 C 13 131.660 0.02 . 3 . . . A 727 PHE CE2 . 17930 1 169 . 1 1 32 32 PHE N N 15 118.784 0.02 . 1 . . . A 727 PHE N . 17930 1 170 . 1 1 33 33 ALA H H 1 7.951 0.02 . 1 . . . A 728 ALA H . 17930 1 171 . 1 1 33 33 ALA HA H 1 4.158 0.02 . 1 . . . A 728 ALA HA . 17930 1 172 . 1 1 33 33 ALA HB1 H 1 1.440 0.02 . 1 . . . A 728 ALA HB1 . 17930 1 173 . 1 1 33 33 ALA HB2 H 1 1.440 0.02 . 1 . . . A 728 ALA HB2 . 17930 1 174 . 1 1 33 33 ALA HB3 H 1 1.440 0.02 . 1 . . . A 728 ALA HB3 . 17930 1 175 . 1 1 33 33 ALA C C 13 178.513 0.02 . 1 . . . A 728 ALA C . 17930 1 176 . 1 1 33 33 ALA CA C 13 54.083 0.02 . 1 . . . A 728 ALA CA . 17930 1 177 . 1 1 33 33 ALA CB C 13 18.496 0.02 . 1 . . . A 728 ALA CB . 17930 1 178 . 1 1 33 33 ALA N N 15 122.197 0.02 . 1 . . . A 728 ALA N . 17930 1 179 . 1 1 34 34 LYS H H 1 7.814 0.02 . 1 . . . A 729 LYS H . 17930 1 180 . 1 1 34 34 LYS HA H 1 4.096 0.02 . 1 . . . A 729 LYS HA . 17930 1 181 . 1 1 34 34 LYS HB2 H 1 1.767 0.02 . 2 . . . A 729 LYS HB2 . 17930 1 182 . 1 1 34 34 LYS HB3 H 1 1.767 0.02 . 2 . . . A 729 LYS HB3 . 17930 1 183 . 1 1 34 34 LYS HG2 H 1 1.340 0.02 . 2 . . . A 729 LYS HG2 . 17930 1 184 . 1 1 34 34 LYS HG3 H 1 1.340 0.02 . 2 . . . A 729 LYS HG3 . 17930 1 185 . 1 1 34 34 LYS HD2 H 1 1.584 0.02 . 2 . . . A 729 LYS HD2 . 17930 1 186 . 1 1 34 34 LYS HD3 H 1 1.584 0.02 . 2 . . . A 729 LYS HD3 . 17930 1 187 . 1 1 34 34 LYS HE2 H 1 3.077 0.02 . 2 . . . A 729 LYS HE2 . 17930 1 188 . 1 1 34 34 LYS HE3 H 1 3.077 0.02 . 2 . . . A 729 LYS HE3 . 17930 1 189 . 1 1 34 34 LYS C C 13 177.562 0.02 . 1 . . . A 729 LYS C . 17930 1 190 . 1 1 34 34 LYS CA C 13 56.930 0.02 . 1 . . . A 729 LYS CA . 17930 1 191 . 1 1 34 34 LYS CB C 13 30.515 0.02 . 1 . . . A 729 LYS CB . 17930 1 192 . 1 1 34 34 LYS CG C 13 24.787 0.02 . 1 . . . A 729 LYS CG . 17930 1 193 . 1 1 34 34 LYS CD C 13 27.056 0.02 . 1 . . . A 729 LYS CD . 17930 1 194 . 1 1 34 34 LYS CE C 13 38.870 0.02 . 1 . . . A 729 LYS CE . 17930 1 195 . 1 1 34 34 LYS N N 15 117.742 0.02 . 1 . . . A 729 LYS N . 17930 1 196 . 1 1 35 35 PHE H H 1 7.900 0.02 . 1 . . . A 730 PHE H . 17930 1 197 . 1 1 35 35 PHE HA H 1 4.379 0.02 . 1 . . . A 730 PHE HA . 17930 1 198 . 1 1 35 35 PHE HB2 H 1 3.220 0.02 . 2 . . . A 730 PHE HB2 . 17930 1 199 . 1 1 35 35 PHE HB3 H 1 3.106 0.02 . 2 . . . A 730 PHE HB3 . 17930 1 200 . 1 1 35 35 PHE HD1 H 1 7.213 0.02 . 3 . . . A 730 PHE HD1 . 17930 1 201 . 1 1 35 35 PHE HD2 H 1 7.213 0.02 . 3 . . . A 730 PHE HD2 . 17930 1 202 . 1 1 35 35 PHE HE1 H 1 7.165 0.02 . 3 . . . A 730 PHE HE1 . 17930 1 203 . 1 1 35 35 PHE HE2 H 1 7.165 0.02 . 3 . . . A 730 PHE HE2 . 17930 1 204 . 1 1 35 35 PHE C C 13 176.706 0.02 . 1 . . . A 730 PHE C . 17930 1 205 . 1 1 35 35 PHE CA C 13 59.753 0.02 . 1 . . . A 730 PHE CA . 17930 1 206 . 1 1 35 35 PHE CB C 13 39.010 0.02 . 1 . . . A 730 PHE CB . 17930 1 207 . 1 1 35 35 PHE CD1 C 13 131.233 0.02 . 3 . . . A 730 PHE CD1 . 17930 1 208 . 1 1 35 35 PHE CD2 C 13 131.233 0.02 . 3 . . . A 730 PHE CD2 . 17930 1 209 . 1 1 35 35 PHE CE1 C 13 132.178 0.02 . 3 . . . A 730 PHE CE1 . 17930 1 210 . 1 1 35 35 PHE CE2 C 13 132.178 0.02 . 3 . . . A 730 PHE CE2 . 17930 1 211 . 1 1 35 35 PHE N N 15 119.960 0.02 . 1 . . . A 730 PHE N . 17930 1 212 . 1 1 36 36 GLU H H 1 8.174 0.02 . 1 . . . A 731 GLU H . 17930 1 213 . 1 1 36 36 GLU HA H 1 4.065 0.02 . 1 . . . A 731 GLU HA . 17930 1 214 . 1 1 36 36 GLU HB2 H 1 1.989 0.02 . 2 . . . A 731 GLU HB2 . 17930 1 215 . 1 1 36 36 GLU HB3 H 1 1.989 0.02 . 2 . . . A 731 GLU HB3 . 17930 1 216 . 1 1 36 36 GLU HG2 H 1 2.307 0.02 . 2 . . . A 731 GLU HG2 . 17930 1 217 . 1 1 36 36 GLU HG3 H 1 2.205 0.02 . 2 . . . A 731 GLU HG3 . 17930 1 218 . 1 1 36 36 GLU C C 13 177.892 0.02 . 1 . . . A 731 GLU C . 17930 1 219 . 1 1 36 36 GLU CA C 13 57.825 0.02 . 1 . . . A 731 GLU CA . 17930 1 220 . 1 1 36 36 GLU CB C 13 29.349 0.02 . 1 . . . A 731 GLU CB . 17930 1 221 . 1 1 36 36 GLU CG C 13 36.187 0.02 . 1 . . . A 731 GLU CG . 17930 1 222 . 1 1 36 36 GLU N N 15 119.516 0.02 . 1 . . . A 731 GLU N . 17930 1 223 . 1 1 37 37 GLU H H 1 8.145 0.02 . 1 . . . A 732 GLU H . 17930 1 224 . 1 1 37 37 GLU HA H 1 4.050 0.02 . 1 . . . A 732 GLU HA . 17930 1 225 . 1 1 37 37 GLU HB2 H 1 2.043 0.02 . 2 . . . A 732 GLU HB2 . 17930 1 226 . 1 1 37 37 GLU HB3 H 1 2.043 0.02 . 2 . . . A 732 GLU HB3 . 17930 1 227 . 1 1 37 37 GLU HG2 H 1 2.213 0.02 . 2 . . . A 732 GLU HG2 . 17930 1 228 . 1 1 37 37 GLU HG3 H 1 2.213 0.02 . 2 . . . A 732 GLU HG3 . 17930 1 229 . 1 1 37 37 GLU C C 13 178.077 0.02 . 1 . . . A 732 GLU C . 17930 1 230 . 1 1 37 37 GLU CA C 13 58.307 0.02 . 1 . . . A 732 GLU CA . 17930 1 231 . 1 1 37 37 GLU CB C 13 29.388 0.02 . 1 . . . A 732 GLU CB . 17930 1 232 . 1 1 37 37 GLU CG C 13 35.693 0.02 . 1 . . . A 732 GLU CG . 17930 1 233 . 1 1 37 37 GLU N N 15 120.577 0.02 . 1 . . . A 732 GLU N . 17930 1 234 . 1 1 38 38 GLU H H 1 8.152 0.02 . 1 . . . A 733 GLU H . 17930 1 235 . 1 1 38 38 GLU HA H 1 4.056 0.02 . 1 . . . A 733 GLU HA . 17930 1 236 . 1 1 38 38 GLU HB2 H 1 2.028 0.02 . 2 . . . A 733 GLU HB2 . 17930 1 237 . 1 1 38 38 GLU HB3 H 1 2.028 0.02 . 2 . . . A 733 GLU HB3 . 17930 1 238 . 1 1 38 38 GLU HG2 H 1 2.295 0.02 . 2 . . . A 733 GLU HG2 . 17930 1 239 . 1 1 38 38 GLU HG3 H 1 2.295 0.02 . 2 . . . A 733 GLU HG3 . 17930 1 240 . 1 1 38 38 GLU C C 13 177.346 0.02 . 1 . . . A 733 GLU C . 17930 1 241 . 1 1 38 38 GLU CA C 13 58.298 0.02 . 1 . . . A 733 GLU CA . 17930 1 242 . 1 1 38 38 GLU CB C 13 29.447 0.02 . 1 . . . A 733 GLU CB . 17930 1 243 . 1 1 38 38 GLU CG C 13 35.870 0.02 . 1 . . . A 733 GLU CG . 17930 1 244 . 1 1 38 38 GLU N N 15 119.573 0.02 . 1 . . . A 733 GLU N . 17930 1 245 . 1 1 39 39 ARG H H 1 8.008 0.02 . 1 . . . A 734 ARG H . 17930 1 246 . 1 1 39 39 ARG HA H 1 4.032 0.02 . 1 . . . A 734 ARG HA . 17930 1 247 . 1 1 39 39 ARG HB2 H 1 1.851 0.02 . 2 . . . A 734 ARG HB2 . 17930 1 248 . 1 1 39 39 ARG HB3 H 1 1.851 0.02 . 2 . . . A 734 ARG HB3 . 17930 1 249 . 1 1 39 39 ARG HG2 H 1 1.477 0.02 . 2 . . . A 734 ARG HG2 . 17930 1 250 . 1 1 39 39 ARG HG3 H 1 1.477 0.02 . 2 . . . A 734 ARG HG3 . 17930 1 251 . 1 1 39 39 ARG HD2 H 1 3.130 0.02 . 2 . . . A 734 ARG HD2 . 17930 1 252 . 1 1 39 39 ARG HD3 H 1 3.130 0.02 . 2 . . . A 734 ARG HD3 . 17930 1 253 . 1 1 39 39 ARG C C 13 177.328 0.02 . 1 . . . A 734 ARG C . 17930 1 254 . 1 1 39 39 ARG CA C 13 58.397 0.02 . 1 . . . A 734 ARG CA . 17930 1 255 . 1 1 39 39 ARG CB C 13 32.170 0.02 . 1 . . . A 734 ARG CB . 17930 1 256 . 1 1 39 39 ARG CG C 13 27.053 0.02 . 1 . . . A 734 ARG CG . 17930 1 257 . 1 1 39 39 ARG CD C 13 43.342 0.02 . 1 . . . A 734 ARG CD . 17930 1 258 . 1 1 39 39 ARG N N 15 118.803 0.02 . 1 . . . A 734 ARG N . 17930 1 259 . 1 1 40 40 ALA H H 1 7.877 0.02 . 1 . . . A 735 ALA H . 17930 1 260 . 1 1 40 40 ALA HA H 1 4.135 0.02 . 1 . . . A 735 ALA HA . 17930 1 261 . 1 1 40 40 ALA HB1 H 1 1.403 0.02 . 1 . . . A 735 ALA HB1 . 17930 1 262 . 1 1 40 40 ALA HB2 H 1 1.403 0.02 . 1 . . . A 735 ALA HB2 . 17930 1 263 . 1 1 40 40 ALA HB3 H 1 1.403 0.02 . 1 . . . A 735 ALA HB3 . 17930 1 264 . 1 1 40 40 ALA C C 13 178.936 0.02 . 1 . . . A 735 ALA C . 17930 1 265 . 1 1 40 40 ALA CA C 13 53.546 0.02 . 1 . . . A 735 ALA CA . 17930 1 266 . 1 1 40 40 ALA CB C 13 18.647 0.02 . 1 . . . A 735 ALA CB . 17930 1 267 . 1 1 40 40 ALA N N 15 121.734 0.02 . 1 . . . A 735 ALA N . 17930 1 268 . 1 1 41 41 ARG H H 1 7.854 0.02 . 1 . . . A 736 ARG H . 17930 1 269 . 1 1 41 41 ARG HA H 1 4.110 0.02 . 1 . . . A 736 ARG HA . 17930 1 270 . 1 1 41 41 ARG HB2 H 1 1.828 0.02 . 2 . . . A 736 ARG HB2 . 17930 1 271 . 1 1 41 41 ARG HB3 H 1 1.828 0.02 . 2 . . . A 736 ARG HB3 . 17930 1 272 . 1 1 41 41 ARG HG2 H 1 1.660 0.02 . 2 . . . A 736 ARG HG2 . 17930 1 273 . 1 1 41 41 ARG HG3 H 1 1.660 0.02 . 2 . . . A 736 ARG HG3 . 17930 1 274 . 1 1 41 41 ARG HD2 H 1 3.145 0.02 . 2 . . . A 736 ARG HD2 . 17930 1 275 . 1 1 41 41 ARG HD3 H 1 3.145 0.02 . 2 . . . A 736 ARG HD3 . 17930 1 276 . 1 1 41 41 ARG C C 13 176.675 0.02 . 1 . . . A 736 ARG C . 17930 1 277 . 1 1 41 41 ARG CA C 13 56.737 0.02 . 1 . . . A 736 ARG CA . 17930 1 278 . 1 1 41 41 ARG CB C 13 30.573 0.02 . 1 . . . A 736 ARG CB . 17930 1 279 . 1 1 41 41 ARG CG C 13 27.114 0.02 . 1 . . . A 736 ARG CG . 17930 1 280 . 1 1 41 41 ARG CD C 13 42.796 0.02 . 1 . . . A 736 ARG CD . 17930 1 281 . 1 1 41 41 ARG N N 15 118.070 0.02 . 1 . . . A 736 ARG N . 17930 1 282 . 1 1 42 42 ALA H H 1 7.809 0.02 . 1 . . . A 737 ALA H . 17930 1 283 . 1 1 42 42 ALA HA H 1 4.151 0.02 . 1 . . . A 737 ALA HA . 17930 1 284 . 1 1 42 42 ALA HB1 H 1 1.255 0.02 . 1 . . . A 737 ALA HB1 . 17930 1 285 . 1 1 42 42 ALA HB2 H 1 1.255 0.02 . 1 . . . A 737 ALA HB2 . 17930 1 286 . 1 1 42 42 ALA HB3 H 1 1.255 0.02 . 1 . . . A 737 ALA HB3 . 17930 1 287 . 1 1 42 42 ALA C C 13 177.676 0.02 . 1 . . . A 737 ALA C . 17930 1 288 . 1 1 42 42 ALA CA C 13 52.726 0.02 . 1 . . . A 737 ALA CA . 17930 1 289 . 1 1 42 42 ALA CB C 13 18.791 0.02 . 1 . . . A 737 ALA CB . 17930 1 290 . 1 1 42 42 ALA N N 15 122.582 0.02 . 1 . . . A 737 ALA N . 17930 1 291 . 1 1 43 43 LYS H H 1 7.854 0.02 . 1 . . . A 738 LYS H . 17930 1 292 . 1 1 43 43 LYS HA H 1 4.159 0.02 . 1 . . . A 738 LYS HA . 17930 1 293 . 1 1 43 43 LYS HB2 H 1 1.676 0.02 . 2 . . . A 738 LYS HB2 . 17930 1 294 . 1 1 43 43 LYS HB3 H 1 1.676 0.02 . 2 . . . A 738 LYS HB3 . 17930 1 295 . 1 1 43 43 LYS HG2 H 1 1.279 0.02 . 2 . . . A 738 LYS HG2 . 17930 1 296 . 1 1 43 43 LYS HG3 H 1 1.279 0.02 . 2 . . . A 738 LYS HG3 . 17930 1 297 . 1 1 43 43 LYS HE2 H 1 3.144 0.02 . 2 . . . A 738 LYS HE2 . 17930 1 298 . 1 1 43 43 LYS HE3 H 1 3.144 0.02 . 2 . . . A 738 LYS HE3 . 17930 1 299 . 1 1 43 43 LYS C C 13 176.523 0.02 . 1 . . . A 738 LYS C . 17930 1 300 . 1 1 43 43 LYS CA C 13 56.468 0.02 . 1 . . . A 738 LYS CA . 17930 1 301 . 1 1 43 43 LYS CB C 13 32.626 0.02 . 1 . . . A 738 LYS CB . 17930 1 302 . 1 1 43 43 LYS CG C 13 24.501 0.02 . 1 . . . A 738 LYS CG . 17930 1 303 . 1 1 43 43 LYS CE C 13 39.506 0.02 . 1 . . . A 738 LYS CE . 17930 1 304 . 1 1 43 43 LYS N N 15 118.494 0.02 . 1 . . . A 738 LYS N . 17930 1 305 . 1 1 44 44 TRP H H 1 7.967 0.02 . 1 . . . A 739 TRP H . 17930 1 306 . 1 1 44 44 TRP HA H 1 4.599 0.02 . 1 . . . A 739 TRP HA . 17930 1 307 . 1 1 44 44 TRP HB2 H 1 3.275 0.02 . 2 . . . A 739 TRP HB2 . 17930 1 308 . 1 1 44 44 TRP HB3 H 1 3.174 0.02 . 2 . . . A 739 TRP HB3 . 17930 1 309 . 1 1 44 44 TRP HD1 H 1 7.198 0.02 . 1 . . . A 739 TRP HD1 . 17930 1 310 . 1 1 44 44 TRP HE1 H 1 10.304 0.02 . 1 . . . A 739 TRP HE1 . 17930 1 311 . 1 1 44 44 TRP HE3 H 1 7.089 0.02 . 1 . . . A 739 TRP HE3 . 17930 1 312 . 1 1 44 44 TRP HZ2 H 1 7.407 0.02 . 1 . . . A 739 TRP HZ2 . 17930 1 313 . 1 1 44 44 TRP HH2 H 1 7.089 0.02 . 1 . . . A 739 TRP HH2 . 17930 1 314 . 1 1 44 44 TRP C C 13 175.937 0.02 . 1 . . . A 739 TRP C . 17930 1 315 . 1 1 44 44 TRP CA C 13 56.932 0.02 . 1 . . . A 739 TRP CA . 17930 1 316 . 1 1 44 44 TRP CB C 13 29.522 0.02 . 1 . . . A 739 TRP CB . 17930 1 317 . 1 1 44 44 TRP CD1 C 13 127.324 0.02 . 1 . . . A 739 TRP CD1 . 17930 1 318 . 1 1 44 44 TRP CE3 C 13 123.074 0.02 . 1 . . . A 739 TRP CE3 . 17930 1 319 . 1 1 44 44 TRP CZ2 C 13 114.279 0.02 . 1 . . . A 739 TRP CZ2 . 17930 1 320 . 1 1 44 44 TRP CH2 C 13 124.126 0.02 . 1 . . . A 739 TRP CH2 . 17930 1 321 . 1 1 44 44 TRP N N 15 120.538 0.02 . 1 . . . A 739 TRP N . 17930 1 322 . 1 1 44 44 TRP NE1 N 15 129.663 0.02 . 1 . . . A 739 TRP NE1 . 17930 1 323 . 1 1 45 45 ASP H H 1 8.219 0.02 . 1 . . . A 740 ASP H . 17930 1 324 . 1 1 45 45 ASP HA H 1 4.153 0.02 . 1 . . . A 740 ASP HA . 17930 1 325 . 1 1 45 45 ASP HB2 H 1 2.624 0.02 . 2 . . . A 740 ASP HB2 . 17930 1 326 . 1 1 45 45 ASP HB3 H 1 2.547 0.02 . 2 . . . A 740 ASP HB3 . 17930 1 327 . 1 1 45 45 ASP C C 13 176.659 0.02 . 1 . . . A 740 ASP C . 17930 1 328 . 1 1 45 45 ASP CA C 13 54.127 0.02 . 1 . . . A 740 ASP CA . 17930 1 329 . 1 1 45 45 ASP CB C 13 41.026 0.02 . 1 . . . A 740 ASP CB . 17930 1 330 . 1 1 45 45 ASP N N 15 121.078 0.02 . 1 . . . A 740 ASP N . 17930 1 331 . 1 1 46 46 THR H H 1 7.946 0.02 . 1 . . . A 741 THR H . 17930 1 332 . 1 1 46 46 THR HA H 1 4.221 0.02 . 1 . . . A 741 THR HA . 17930 1 333 . 1 1 46 46 THR HB H 1 4.193 0.02 . 1 . . . A 741 THR HB . 17930 1 334 . 1 1 46 46 THR HG21 H 1 1.145 0.02 . 1 . . . A 741 THR HG21 . 17930 1 335 . 1 1 46 46 THR HG22 H 1 1.145 0.02 . 1 . . . A 741 THR HG22 . 17930 1 336 . 1 1 46 46 THR HG23 H 1 1.145 0.02 . 1 . . . A 741 THR HG23 . 17930 1 337 . 1 1 46 46 THR C C 13 174.807 0.02 . 1 . . . A 741 THR C . 17930 1 338 . 1 1 46 46 THR CA C 13 62.439 0.02 . 1 . . . A 741 THR CA . 17930 1 339 . 1 1 46 46 THR CB C 13 69.255 0.02 . 1 . . . A 741 THR CB . 17930 1 340 . 1 1 46 46 THR CG2 C 13 21.642 0.02 . 1 . . . A 741 THR CG2 . 17930 1 341 . 1 1 46 46 THR N N 15 113.655 0.02 . 1 . . . A 741 THR N . 17930 1 342 . 1 1 47 47 ALA H H 1 8.116 0.02 . 1 . . . A 742 ALA H . 17930 1 343 . 1 1 47 47 ALA HA H 1 4.193 0.02 . 1 . . . A 742 ALA HA . 17930 1 344 . 1 1 47 47 ALA HB1 H 1 1.335 0.02 . 1 . . . A 742 ALA HB1 . 17930 1 345 . 1 1 47 47 ALA HB2 H 1 1.335 0.02 . 1 . . . A 742 ALA HB2 . 17930 1 346 . 1 1 47 47 ALA HB3 H 1 1.335 0.02 . 1 . . . A 742 ALA HB3 . 17930 1 347 . 1 1 47 47 ALA C C 13 177.516 0.02 . 1 . . . A 742 ALA C . 17930 1 348 . 1 1 47 47 ALA CA C 13 52.937 0.02 . 1 . . . A 742 ALA CA . 17930 1 349 . 1 1 47 47 ALA CB C 13 18.974 0.02 . 1 . . . A 742 ALA CB . 17930 1 350 . 1 1 47 47 ALA N N 15 124.530 0.02 . 1 . . . A 742 ALA N . 17930 1 351 . 1 1 48 48 ASN H H 1 8.048 0.02 . 1 . . . A 743 ASN H . 17930 1 352 . 1 1 48 48 ASN HA H 1 4.599 0.02 . 1 . . . A 743 ASN HA . 17930 1 353 . 1 1 48 48 ASN HB2 H 1 2.619 0.02 . 2 . . . A 743 ASN HB2 . 17930 1 354 . 1 1 48 48 ASN HB3 H 1 2.619 0.02 . 2 . . . A 743 ASN HB3 . 17930 1 355 . 1 1 48 48 ASN HD21 H 1 7.582 0.02 . 2 . . . A 743 ASN HD21 . 17930 1 356 . 1 1 48 48 ASN HD22 H 1 6.767 0.02 . 2 . . . A 743 ASN HD22 . 17930 1 357 . 1 1 48 48 ASN C C 13 174.308 0.02 . 1 . . . A 743 ASN C . 17930 1 358 . 1 1 48 48 ASN CA C 13 52.868 0.02 . 1 . . . A 743 ASN CA . 17930 1 359 . 1 1 48 48 ASN CB C 13 39.097 0.02 . 1 . . . A 743 ASN CB . 17930 1 360 . 1 1 48 48 ASN N N 15 116.065 0.02 . 1 . . . A 743 ASN N . 17930 1 361 . 1 1 48 48 ASN ND2 N 15 113.147 0.02 . 1 . . . A 743 ASN ND2 . 17930 1 362 . 1 1 49 49 ASN H H 1 8.031 0.02 . 1 . . . A 744 ASN H . 17930 1 363 . 1 1 49 49 ASN HA H 1 4.608 0.02 . 1 . . . A 744 ASN HA . 17930 1 364 . 1 1 49 49 ASN HB2 H 1 2.814 0.02 . 2 . . . A 744 ASN HB2 . 17930 1 365 . 1 1 49 49 ASN HB3 H 1 2.643 0.02 . 2 . . . A 744 ASN HB3 . 17930 1 366 . 1 1 49 49 ASN HD21 H 1 7.693 0.02 . 2 . . . A 744 ASN HD21 . 17930 1 367 . 1 1 49 49 ASN HD22 H 1 6.646 0.02 . 2 . . . A 744 ASN HD22 . 17930 1 368 . 1 1 49 49 ASN CA C 13 50.940 0.02 . 1 . . . A 744 ASN CA . 17930 1 369 . 1 1 49 49 ASN CB C 13 38.799 0.02 . 1 . . . A 744 ASN CB . 17930 1 370 . 1 1 49 49 ASN N N 15 119.536 0.02 . 1 . . . A 744 ASN N . 17930 1 371 . 1 1 49 49 ASN ND2 N 15 112.353 0.02 . 1 . . . A 744 ASN ND2 . 17930 1 372 . 1 1 50 50 PRO HA H 1 4.372 0.02 . 1 . . . A 745 PRO HA . 17930 1 373 . 1 1 50 50 PRO HB2 H 1 1.856 0.02 . 2 . . . A 745 PRO HB2 . 17930 1 374 . 1 1 50 50 PRO HB3 H 1 2.236 0.02 . 2 . . . A 745 PRO HB3 . 17930 1 375 . 1 1 50 50 PRO HG2 H 1 1.973 0.02 . 2 . . . A 745 PRO HG2 . 17930 1 376 . 1 1 50 50 PRO HG3 H 1 1.897 0.02 . 2 . . . A 745 PRO HG3 . 17930 1 377 . 1 1 50 50 PRO HD2 H 1 3.665 0.02 . 2 . . . A 745 PRO HD2 . 17930 1 378 . 1 1 50 50 PRO HD3 H 1 3.764 0.02 . 2 . . . A 745 PRO HD3 . 17930 1 379 . 1 1 50 50 PRO C C 13 177.161 0.02 . 1 . . . A 745 PRO C . 17930 1 380 . 1 1 50 50 PRO CA C 13 63.583 0.02 . 1 . . . A 745 PRO CA . 17930 1 381 . 1 1 50 50 PRO CB C 13 31.941 0.02 . 1 . . . A 745 PRO CB . 17930 1 382 . 1 1 50 50 PRO CG C 13 27.086 0.02 . 1 . . . A 745 PRO CG . 17930 1 383 . 1 1 50 50 PRO CD C 13 50.591 0.02 . 1 . . . A 745 PRO CD . 17930 1 384 . 1 1 51 51 LEU H H 1 8.094 0.02 . 1 . . . A 746 LEU H . 17930 1 385 . 1 1 51 51 LEU HA H 1 4.197 0.02 . 1 . . . A 746 LEU HA . 17930 1 386 . 1 1 51 51 LEU HB2 H 1 1.565 0.02 . 2 . . . A 746 LEU HB2 . 17930 1 387 . 1 1 51 51 LEU HB3 H 1 1.455 0.02 . 2 . . . A 746 LEU HB3 . 17930 1 388 . 1 1 51 51 LEU HG H 1 1.537 0.02 . 1 . . . A 746 LEU HG . 17930 1 389 . 1 1 51 51 LEU HD11 H 1 0.798 0.02 . 1 . . . A 746 LEU HD11 . 17930 1 390 . 1 1 51 51 LEU HD12 H 1 0.798 0.02 . 1 . . . A 746 LEU HD12 . 17930 1 391 . 1 1 51 51 LEU HD13 H 1 0.798 0.02 . 1 . . . A 746 LEU HD13 . 17930 1 392 . 1 1 51 51 LEU HD21 H 1 0.798 0.02 . 1 . . . A 746 LEU MD2 . 17930 1 393 . 1 1 51 51 LEU HD22 H 1 0.798 0.02 . 1 . . . A 746 LEU MD2 . 17930 1 394 . 1 1 51 51 LEU HD23 H 1 0.798 0.02 . 1 . . . A 746 LEU MD2 . 17930 1 395 . 1 1 51 51 LEU C C 13 177.497 0.02 . 1 . . . A 746 LEU C . 17930 1 396 . 1 1 51 51 LEU CA C 13 55.716 0.02 . 1 . . . A 746 LEU CA . 17930 1 397 . 1 1 51 51 LEU CB C 13 41.691 0.02 . 1 . . . A 746 LEU CB . 17930 1 398 . 1 1 51 51 LEU CG C 13 26.938 0.02 . 1 . . . A 746 LEU CG . 17930 1 399 . 1 1 51 51 LEU CD1 C 13 23.382 0.02 . 2 . . . A 746 LEU CD1 . 17930 1 400 . 1 1 51 51 LEU N N 15 119.439 0.02 . 1 . . . A 746 LEU N . 17930 1 401 . 1 1 52 52 PTR C C 13 175.913 0.02 . 1 . . . A 747 PTR C . 17930 1 402 . 1 1 52 52 PTR CA C 13 57.935 0.02 . 1 . . . A 747 PTR CA . 17930 1 403 . 1 1 52 52 PTR CB C 13 38.444 0.02 . 1 . . . A 747 PTR CB . 17930 1 404 . 1 1 52 52 PTR CD1 C 13 132.986 0.02 . 3 . . . A 747 PTR CD1 . 17930 1 405 . 1 1 52 52 PTR CD2 C 13 132.986 0.02 . 3 . . . A 747 PTR CD2 . 17930 1 406 . 1 1 52 52 PTR CE1 C 13 118.110 0.02 . 3 . . . A 747 PTR CE1 . 17930 1 407 . 1 1 52 52 PTR CE2 C 13 118.110 0.02 . 3 . . . A 747 PTR CE2 . 17930 1 408 . 1 1 52 52 PTR H H 1 7.785 0.02 . 1 . . . A 747 PTR H . 17930 1 409 . 1 1 52 52 PTR HA H 1 4.452 0.02 . 1 . . . A 747 PTR HA . 17930 1 410 . 1 1 52 52 PTR HB2 H 1 2.994 0.02 . 2 . . . A 747 PTR HB2 . 17930 1 411 . 1 1 52 52 PTR HB3 H 1 3.098 0.02 . 2 . . . A 747 PTR HB3 . 17930 1 412 . 1 1 52 52 PTR N N 15 119.034 0.02 . 1 . . . A 747 PTR N . 17930 1 413 . 1 1 52 52 PTR HD1 H 1 7.089 0.02 . 3 . . . A 747 PTR QD . 17930 1 414 . 1 1 52 52 PTR HD2 H 1 7.089 0.02 . 3 . . . A 747 PTR QD . 17930 1 415 . 1 1 52 52 PTR HE1 H 1 6.770 0.02 . 3 . . . A 747 PTR QE . 17930 1 416 . 1 1 52 52 PTR HE2 H 1 6.770 0.02 . 3 . . . A 747 PTR QE . 17930 1 417 . 1 1 53 53 LYS H H 1 7.849 0.02 . 1 . . . A 748 LYS H . 17930 1 418 . 1 1 53 53 LYS HA H 1 4.124 0.02 . 1 . . . A 748 LYS HA . 17930 1 419 . 1 1 53 53 LYS HB2 H 1 1.738 0.02 . 2 . . . A 748 LYS HB2 . 17930 1 420 . 1 1 53 53 LYS HB3 H 1 1.671 0.02 . 2 . . . A 748 LYS HB3 . 17930 1 421 . 1 1 53 53 LYS HG2 H 1 1.297 0.02 . 2 . . . A 748 LYS HG2 . 17930 1 422 . 1 1 53 53 LYS HG3 H 1 1.297 0.02 . 2 . . . A 748 LYS HG3 . 17930 1 423 . 1 1 53 53 LYS HD2 H 1 1.594 0.02 . 2 . . . A 748 LYS HD2 . 17930 1 424 . 1 1 53 53 LYS HD3 H 1 1.594 0.02 . 2 . . . A 748 LYS HD3 . 17930 1 425 . 1 1 53 53 LYS C C 13 176.718 0.02 . 1 . . . A 748 LYS C . 17930 1 426 . 1 1 53 53 LYS CA C 13 56.448 0.02 . 1 . . . A 748 LYS CA . 17930 1 427 . 1 1 53 53 LYS CB C 13 32.831 0.02 . 1 . . . A 748 LYS CB . 17930 1 428 . 1 1 53 53 LYS CG C 13 24.553 0.02 . 1 . . . A 748 LYS CG . 17930 1 429 . 1 1 53 53 LYS CD C 13 28.858 0.02 . 1 . . . A 748 LYS CD . 17930 1 430 . 1 1 53 53 LYS N N 15 121.599 0.02 . 1 . . . A 748 LYS N . 17930 1 431 . 1 1 54 54 GLU H H 1 8.216 0.02 . 1 . . . A 749 GLU H . 17930 1 432 . 1 1 54 54 GLU HA H 1 4.206 0.02 . 1 . . . A 749 GLU HA . 17930 1 433 . 1 1 54 54 GLU HB2 H 1 1.940 0.02 . 2 . . . A 749 GLU HB2 . 17930 1 434 . 1 1 54 54 GLU HB3 H 1 2.041 0.02 . 2 . . . A 749 GLU HB3 . 17930 1 435 . 1 1 54 54 GLU HG2 H 1 2.270 0.02 . 2 . . . A 749 GLU HG2 . 17930 1 436 . 1 1 54 54 GLU HG3 H 1 2.270 0.02 . 2 . . . A 749 GLU HG3 . 17930 1 437 . 1 1 54 54 GLU C C 13 176.842 0.02 . 1 . . . A 749 GLU C . 17930 1 438 . 1 1 54 54 GLU CA C 13 56.698 0.02 . 1 . . . A 749 GLU CA . 17930 1 439 . 1 1 54 54 GLU CB C 13 29.905 0.02 . 1 . . . A 749 GLU CB . 17930 1 440 . 1 1 54 54 GLU CG C 13 35.680 0.02 . 1 . . . A 749 GLU CG . 17930 1 441 . 1 1 54 54 GLU N N 15 121.102 0.02 . 1 . . . A 749 GLU N . 17930 1 442 . 1 1 55 55 ALA H H 1 8.339 0.02 . 1 . . . A 750 ALA H . 17930 1 443 . 1 1 55 55 ALA HA H 1 4.275 0.02 . 1 . . . A 750 ALA HA . 17930 1 444 . 1 1 55 55 ALA HB1 H 1 1.392 0.02 . 1 . . . A 750 ALA HB1 . 17930 1 445 . 1 1 55 55 ALA HB2 H 1 1.392 0.02 . 1 . . . A 750 ALA HB2 . 17930 1 446 . 1 1 55 55 ALA HB3 H 1 1.392 0.02 . 1 . . . A 750 ALA HB3 . 17930 1 447 . 1 1 55 55 ALA C C 13 178.080 0.02 . 1 . . . A 750 ALA C . 17930 1 448 . 1 1 55 55 ALA CA C 13 53.212 0.02 . 1 . . . A 750 ALA CA . 17930 1 449 . 1 1 55 55 ALA CB C 13 19.060 0.02 . 1 . . . A 750 ALA CB . 17930 1 450 . 1 1 55 55 ALA N N 15 124.433 0.02 . 1 . . . A 750 ALA N . 17930 1 451 . 1 1 56 56 THR H H 1 8.008 0.02 . 1 . . . A 751 THR H . 17930 1 452 . 1 1 56 56 THR HA H 1 4.225 0.02 . 1 . . . A 751 THR HA . 17930 1 453 . 1 1 56 56 THR HB H 1 4.213 0.02 . 1 . . . A 751 THR HB . 17930 1 454 . 1 1 56 56 THR HG21 H 1 1.125 0.02 . 1 . . . A 751 THR HG21 . 17930 1 455 . 1 1 56 56 THR HG22 H 1 1.125 0.02 . 1 . . . A 751 THR HG22 . 17930 1 456 . 1 1 56 56 THR HG23 H 1 1.125 0.02 . 1 . . . A 751 THR HG23 . 17930 1 457 . 1 1 56 56 THR C C 13 175.174 0.02 . 1 . . . A 751 THR C . 17930 1 458 . 1 1 56 56 THR CA C 13 62.508 0.02 . 1 . . . A 751 THR CA . 17930 1 459 . 1 1 56 56 THR CB C 13 69.600 0.02 . 1 . . . A 751 THR CB . 17930 1 460 . 1 1 56 56 THR CG2 C 13 21.881 0.02 . 1 . . . A 751 THR CG2 . 17930 1 461 . 1 1 56 56 THR N N 15 111.881 0.02 . 1 . . . A 751 THR N . 17930 1 462 . 1 1 57 57 SER H H 1 8.168 0.02 . 1 . . . A 752 SER H . 17930 1 463 . 1 1 57 57 SER HA H 1 4.567 0.02 . 1 . . . A 752 SER HA . 17930 1 464 . 1 1 57 57 SER HB2 H 1 3.868 0.02 . 2 . . . A 752 SER HB2 . 17930 1 465 . 1 1 57 57 SER HB3 H 1 3.803 0.02 . 2 . . . A 752 SER HB3 . 17930 1 466 . 1 1 57 57 SER C C 13 174.988 0.02 . 1 . . . A 752 SER C . 17930 1 467 . 1 1 57 57 SER CA C 13 58.856 0.02 . 1 . . . A 752 SER CA . 17930 1 468 . 1 1 57 57 SER CB C 13 63.705 0.02 . 1 . . . A 752 SER CB . 17930 1 469 . 1 1 57 57 SER N N 15 117.588 0.02 . 1 . . . A 752 SER N . 17930 1 470 . 1 1 58 58 THR H H 1 8.105 0.02 . 1 . . . A 753 THR H . 17930 1 471 . 1 1 58 58 THR HA H 1 4.126 0.02 . 1 . . . A 753 THR HA . 17930 1 472 . 1 1 58 58 THR HB H 1 4.034 0.02 . 1 . . . A 753 THR HB . 17930 1 473 . 1 1 58 58 THR HG21 H 1 1.020 0.02 . 1 . . . A 753 THR HG21 . 17930 1 474 . 1 1 58 58 THR HG22 H 1 1.020 0.02 . 1 . . . A 753 THR HG22 . 17930 1 475 . 1 1 58 58 THR HG23 H 1 1.020 0.02 . 1 . . . A 753 THR HG23 . 17930 1 476 . 1 1 58 58 THR C C 13 174.719 0.02 . 1 . . . A 753 THR C . 17930 1 477 . 1 1 58 58 THR CA C 13 62.889 0.02 . 1 . . . A 753 THR CA . 17930 1 478 . 1 1 58 58 THR CB C 13 69.276 0.02 . 1 . . . A 753 THR CB . 17930 1 479 . 1 1 58 58 THR CG2 C 13 21.497 0.02 . 1 . . . A 753 THR CG2 . 17930 1 480 . 1 1 58 58 THR N N 15 116.798 0.02 . 1 . . . A 753 THR N . 17930 1 481 . 1 1 59 59 PHE H H 1 8.213 0.02 . 1 . . . A 754 PHE H . 17930 1 482 . 1 1 59 59 PHE HA H 1 4.567 0.02 . 1 . . . A 754 PHE HA . 17930 1 483 . 1 1 59 59 PHE HB2 H 1 3.015 0.02 . 2 . . . A 754 PHE HB2 . 17930 1 484 . 1 1 59 59 PHE HB3 H 1 3.164 0.02 . 2 . . . A 754 PHE HB3 . 17930 1 485 . 1 1 59 59 PHE HD1 H 1 7.211 0.02 . 3 . . . A 754 PHE HD1 . 17930 1 486 . 1 1 59 59 PHE HD2 H 1 7.211 0.02 . 3 . . . A 754 PHE HD2 . 17930 1 487 . 1 1 59 59 PHE HE1 H 1 7.214 0.02 . 3 . . . A 754 PHE HE1 . 17930 1 488 . 1 1 59 59 PHE HE2 H 1 7.214 0.02 . 3 . . . A 754 PHE HE2 . 17930 1 489 . 1 1 59 59 PHE C C 13 175.953 0.02 . 1 . . . A 754 PHE C . 17930 1 490 . 1 1 59 59 PHE CA C 13 58.289 0.02 . 1 . . . A 754 PHE CA . 17930 1 491 . 1 1 59 59 PHE CB C 13 39.212 0.02 . 1 . . . A 754 PHE CB . 17930 1 492 . 1 1 59 59 PHE CD1 C 13 131.470 0.02 . 3 . . . A 754 PHE CD1 . 17930 1 493 . 1 1 59 59 PHE CD2 C 13 131.470 0.02 . 3 . . . A 754 PHE CD2 . 17930 1 494 . 1 1 59 59 PHE CE1 C 13 132.127 0.02 . 3 . . . A 754 PHE CE1 . 17930 1 495 . 1 1 59 59 PHE CE2 C 13 132.127 0.02 . 3 . . . A 754 PHE CE2 . 17930 1 496 . 1 1 59 59 PHE N N 15 120.288 0.02 . 1 . . . A 754 PHE N . 17930 1 497 . 1 1 60 60 THR H H 1 7.871 0.02 . 1 . . . A 755 THR H . 17930 1 498 . 1 1 60 60 THR HA H 1 4.159 0.02 . 1 . . . A 755 THR HA . 17930 1 499 . 1 1 60 60 THR HB H 1 4.166 0.02 . 1 . . . A 755 THR HB . 17930 1 500 . 1 1 60 60 THR HG21 H 1 1.154 0.02 . 1 . . . A 755 THR HG21 . 17930 1 501 . 1 1 60 60 THR HG22 H 1 1.154 0.02 . 1 . . . A 755 THR HG22 . 17930 1 502 . 1 1 60 60 THR HG23 H 1 1.154 0.02 . 1 . . . A 755 THR HG23 . 17930 1 503 . 1 1 60 60 THR C C 13 174.225 0.02 . 1 . . . A 755 THR C . 17930 1 504 . 1 1 60 60 THR CA C 13 62.446 0.02 . 1 . . . A 755 THR CA . 17930 1 505 . 1 1 60 60 THR CB C 13 69.403 0.02 . 1 . . . A 755 THR CB . 17930 1 506 . 1 1 60 60 THR CG2 C 13 21.505 0.02 . 1 . . . A 755 THR CG2 . 17930 1 507 . 1 1 60 60 THR N N 15 113.153 0.02 . 1 . . . A 755 THR N . 17930 1 508 . 1 1 61 61 ASN H H 1 8.213 0.02 . 1 . . . A 756 ASN H . 17930 1 509 . 1 1 61 61 ASN HA H 1 4.599 0.02 . 1 . . . A 756 ASN HA . 17930 1 510 . 1 1 61 61 ASN HB2 H 1 2.734 0.02 . 2 . . . A 756 ASN HB2 . 17930 1 511 . 1 1 61 61 ASN HB3 H 1 2.734 0.02 . 2 . . . A 756 ASN HB3 . 17930 1 512 . 1 1 61 61 ASN HD21 H 1 6.822 0.02 . 2 . . . A 756 ASN HD21 . 17930 1 513 . 1 1 61 61 ASN HD22 H 1 7.576 0.02 . 2 . . . A 756 ASN HD22 . 17930 1 514 . 1 1 61 61 ASN C C 13 175.231 0.02 . 1 . . . A 756 ASN C . 17930 1 515 . 1 1 61 61 ASN CA C 13 53.625 0.02 . 1 . . . A 756 ASN CA . 17930 1 516 . 1 1 61 61 ASN CB C 13 38.852 0.02 . 1 . . . A 756 ASN CB . 17930 1 517 . 1 1 61 61 ASN N N 15 119.863 0.02 . 1 . . . A 756 ASN N . 17930 1 518 . 1 1 61 61 ASN ND2 N 15 112.382 0.02 . 1 . . . A 756 ASN ND2 . 17930 1 519 . 1 1 62 62 ILE H H 1 7.860 0.02 . 1 . . . A 757 ILE H . 17930 1 520 . 1 1 62 62 ILE HA H 1 4.133 0.02 . 1 . . . A 757 ILE HA . 17930 1 521 . 1 1 62 62 ILE HB H 1 1.874 0.02 . 1 . . . A 757 ILE HB . 17930 1 522 . 1 1 62 62 ILE HG12 H 1 1.486 0.02 . 2 . . . A 757 ILE HG12 . 17930 1 523 . 1 1 62 62 ILE HG13 H 1 1.158 0.02 . 2 . . . A 757 ILE HG13 . 17930 1 524 . 1 1 62 62 ILE HG21 H 1 0.829 0.02 . 1 . . . A 757 ILE HG21 . 17930 1 525 . 1 1 62 62 ILE HG22 H 1 0.829 0.02 . 1 . . . A 757 ILE HG22 . 17930 1 526 . 1 1 62 62 ILE HG23 H 1 0.829 0.02 . 1 . . . A 757 ILE HG23 . 17930 1 527 . 1 1 62 62 ILE HD11 H 1 0.805 0.02 . 1 . . . A 757 ILE HD11 . 17930 1 528 . 1 1 62 62 ILE HD12 H 1 0.805 0.02 . 1 . . . A 757 ILE HD12 . 17930 1 529 . 1 1 62 62 ILE HD13 H 1 0.805 0.02 . 1 . . . A 757 ILE HD13 . 17930 1 530 . 1 1 62 62 ILE C C 13 175.709 0.02 . 1 . . . A 757 ILE C . 17930 1 531 . 1 1 62 62 ILE CA C 13 61.607 0.02 . 1 . . . A 757 ILE CA . 17930 1 532 . 1 1 62 62 ILE CB C 13 38.445 0.02 . 1 . . . A 757 ILE CB . 17930 1 533 . 1 1 62 62 ILE CG1 C 13 27.450 0.02 . 1 . . . A 757 ILE CG1 . 17930 1 534 . 1 1 62 62 ILE CG2 C 13 17.560 0.02 . 1 . . . A 757 ILE CG2 . 17930 1 535 . 1 1 62 62 ILE CD1 C 13 13.378 0.02 . 1 . . . A 757 ILE CD1 . 17930 1 536 . 1 1 62 62 ILE N N 15 119.671 0.02 . 1 . . . A 757 ILE N . 17930 1 537 . 1 1 63 63 THR H H 1 7.929 0.02 . 1 . . . A 758 THR H . 17930 1 538 . 1 1 63 63 THR HA H 1 4.276 0.02 . 1 . . . A 758 THR HA . 17930 1 539 . 1 1 63 63 THR HB H 1 4.100 0.02 . 1 . . . A 758 THR HB . 17930 1 540 . 1 1 63 63 THR HG21 H 1 1.066 0.02 . 1 . . . A 758 THR HG21 . 17930 1 541 . 1 1 63 63 THR HG22 H 1 1.066 0.02 . 1 . . . A 758 THR HG22 . 17930 1 542 . 1 1 63 63 THR HG23 H 1 1.066 0.02 . 1 . . . A 758 THR HG23 . 17930 1 543 . 1 1 63 63 THR C C 13 173.978 0.02 . 1 . . . A 758 THR C . 17930 1 544 . 1 1 63 63 THR CA C 13 61.620 0.02 . 1 . . . A 758 THR CA . 17930 1 545 . 1 1 63 63 THR CB C 13 69.640 0.02 . 1 . . . A 758 THR CB . 17930 1 546 . 1 1 63 63 THR CG2 C 13 21.265 0.02 . 1 . . . A 758 THR CG2 . 17930 1 547 . 1 1 63 63 THR N N 15 115.737 0.02 . 1 . . . A 758 THR N . 17930 1 548 . 1 1 64 64 TYR H H 1 8.048 0.02 . 1 . . . A 759 TYR H . 17930 1 549 . 1 1 64 64 TYR HA H 1 4.567 0.02 . 1 . . . A 759 TYR HA . 17930 1 550 . 1 1 64 64 TYR HB2 H 1 2.954 0.02 . 2 . . . A 759 TYR HB2 . 17930 1 551 . 1 1 64 64 TYR HB3 H 1 2.954 0.02 . 2 . . . A 759 TYR HB3 . 17930 1 552 . 1 1 64 64 TYR HD1 H 1 7.064 0.02 . 3 . . . A 759 TYR HD1 . 17930 1 553 . 1 1 64 64 TYR HD2 H 1 7.064 0.02 . 3 . . . A 759 TYR HD2 . 17930 1 554 . 1 1 64 64 TYR HE1 H 1 6.771 0.02 . 3 . . . A 759 TYR HE1 . 17930 1 555 . 1 1 64 64 TYR HE2 H 1 6.771 0.02 . 3 . . . A 759 TYR HE2 . 17930 1 556 . 1 1 64 64 TYR C C 13 175.349 0.02 . 1 . . . A 759 TYR C . 17930 1 557 . 1 1 64 64 TYR CA C 13 57.894 0.02 . 1 . . . A 759 TYR CA . 17930 1 558 . 1 1 64 64 TYR CB C 13 38.782 0.02 . 1 . . . A 759 TYR CB . 17930 1 559 . 1 1 64 64 TYR CD1 C 13 132.992 0.02 . 3 . . . A 759 TYR CD1 . 17930 1 560 . 1 1 64 64 TYR CD2 C 13 132.992 0.02 . 3 . . . A 759 TYR CD2 . 17930 1 561 . 1 1 64 64 TYR CE1 C 13 118.143 0.02 . 3 . . . A 759 TYR CE1 . 17930 1 562 . 1 1 64 64 TYR CE2 C 13 118.143 0.02 . 3 . . . A 759 TYR CE2 . 17930 1 563 . 1 1 64 64 TYR N N 15 122.351 0.02 . 1 . . . A 759 TYR N . 17930 1 564 . 1 1 65 65 ARG H H 1 8.111 0.02 . 1 . . . A 760 ARG H . 17930 1 565 . 1 1 65 65 ARG HA H 1 4.266 0.02 . 1 . . . A 760 ARG HA . 17930 1 566 . 1 1 65 65 ARG HB2 H 1 1.832 0.02 . 2 . . . A 760 ARG HB2 . 17930 1 567 . 1 1 65 65 ARG HB3 H 1 1.674 0.02 . 2 . . . A 760 ARG HB3 . 17930 1 568 . 1 1 65 65 ARG HG2 H 1 1.493 0.02 . 2 . . . A 760 ARG HG2 . 17930 1 569 . 1 1 65 65 ARG HG3 H 1 1.493 0.02 . 2 . . . A 760 ARG HG3 . 17930 1 570 . 1 1 65 65 ARG HD2 H 1 2.964 0.02 . 2 . . . A 760 ARG HD2 . 17930 1 571 . 1 1 65 65 ARG HD3 H 1 2.922 0.02 . 2 . . . A 760 ARG HD3 . 17930 1 572 . 1 1 65 65 ARG C C 13 176.141 0.02 . 1 . . . A 760 ARG C . 17930 1 573 . 1 1 65 65 ARG CA C 13 55.718 0.02 . 1 . . . A 760 ARG CA . 17930 1 574 . 1 1 65 65 ARG CB C 13 30.828 0.02 . 1 . . . A 760 ARG CB . 17930 1 575 . 1 1 65 65 ARG CG C 13 26.982 0.02 . 1 . . . A 760 ARG CG . 17930 1 576 . 1 1 65 65 ARG CD C 13 41.888 0.02 . 1 . . . A 760 ARG CD . 17930 1 577 . 1 1 65 65 ARG N N 15 122.717 0.02 . 1 . . . A 760 ARG N . 17930 1 578 . 1 1 66 66 GLY H H 1 7.786 0.02 . 1 . . . A 761 GLY H . 17930 1 579 . 1 1 66 66 GLY HA2 H 1 3.944 0.02 . 2 . . . A 761 GLY HA2 . 17930 1 580 . 1 1 66 66 GLY HA3 H 1 3.892 0.02 . 2 . . . A 761 GLY HA3 . 17930 1 581 . 1 1 66 66 GLY C C 13 173.235 0.02 . 1 . . . A 761 GLY C . 17930 1 582 . 1 1 66 66 GLY CA C 13 45.272 0.02 . 1 . . . A 761 GLY CA . 17930 1 583 . 1 1 66 66 GLY N N 15 109.046 0.02 . 1 . . . A 761 GLY N . 17930 1 584 . 1 1 67 67 THR H H 1 7.569 0.02 . 1 . . . A 762 THR H . 17930 1 585 . 1 1 67 67 THR HA H 1 4.160 0.02 . 1 . . . A 762 THR HA . 17930 1 586 . 1 1 67 67 THR HB H 1 4.174 0.02 . 1 . . . A 762 THR HB . 17930 1 587 . 1 1 67 67 THR HG21 H 1 1.065 0.02 . 1 . . . A 762 THR HG21 . 17930 1 588 . 1 1 67 67 THR HG22 H 1 1.065 0.02 . 1 . . . A 762 THR HG22 . 17930 1 589 . 1 1 67 67 THR HG23 H 1 1.065 0.02 . 1 . . . A 762 THR HG23 . 17930 1 590 . 1 1 67 67 THR CA C 13 62.990 0.02 . 1 . . . A 762 THR CA . 17930 1 591 . 1 1 67 67 THR CB C 13 70.564 0.02 . 1 . . . A 762 THR CB . 17930 1 592 . 1 1 67 67 THR CG2 C 13 21.434 0.02 . 1 . . . A 762 THR CG2 . 17930 1 593 . 1 1 67 67 THR N N 15 117.974 0.02 . 1 . . . A 762 THR N . 17930 1 stop_ save_