################################### # 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 25612 _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' . . . 25612 1 3 '3D HNCO' . . . 25612 1 5 '3D HNCACB' . . . 25612 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 25612 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 4 $AutoAssign . . 25612 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 2 2 VAL H H 1 8.175 0.020 . 1 . . . . . 2 VAL H . 25612 1 2 . 1 1 2 2 VAL HA H 1 3.562 0.020 . 1 . . . . . 2 VAL HA . 25612 1 3 . 1 1 2 2 VAL HB H 1 1.907 0.020 . 1 . . . . . 2 VAL HB . 25612 1 4 . 1 1 2 2 VAL HG11 H 1 0.775 0.020 . 2 . . . . . 2 VAL HG11 . 25612 1 5 . 1 1 2 2 VAL HG12 H 1 0.775 0.020 . 2 . . . . . 2 VAL HG12 . 25612 1 6 . 1 1 2 2 VAL HG13 H 1 0.775 0.020 . 2 . . . . . 2 VAL HG13 . 25612 1 7 . 1 1 2 2 VAL HG21 H 1 0.814 0.020 . 2 . . . . . 2 VAL HG21 . 25612 1 8 . 1 1 2 2 VAL HG22 H 1 0.814 0.020 . 2 . . . . . 2 VAL HG22 . 25612 1 9 . 1 1 2 2 VAL HG23 H 1 0.814 0.020 . 2 . . . . . 2 VAL HG23 . 25612 1 10 . 1 1 2 2 VAL C C 13 171.111 0.400 . 1 . . . . . 2 VAL C . 25612 1 11 . 1 1 2 2 VAL CA C 13 61.505 0.400 . 1 . . . . . 2 VAL CA . 25612 1 12 . 1 1 2 2 VAL CB C 13 32.731 0.400 . 1 . . . . . 2 VAL CB . 25612 1 13 . 1 1 2 2 VAL CG1 C 13 20.486 0.400 . 1 . . . . . 2 VAL CG1 . 25612 1 14 . 1 1 2 2 VAL CG2 C 13 20.226 0.400 . 1 . . . . . 2 VAL CG2 . 25612 1 15 . 1 1 3 3 ASP H H 1 8.774 0.020 . 1 . . . . . 3 ASP H . 25612 1 16 . 1 1 3 3 ASP HA H 1 5.267 0.020 . 1 . . . . . 3 ASP HA . 25612 1 17 . 1 1 3 3 ASP HB2 H 1 2.389 0.020 . 2 . . . . . 3 ASP HB2 . 25612 1 18 . 1 1 3 3 ASP HB3 H 1 2.622 0.020 . 2 . . . . . 3 ASP HB3 . 25612 1 19 . 1 1 3 3 ASP C C 13 174.883 0.400 . 1 . . . . . 3 ASP C . 25612 1 20 . 1 1 3 3 ASP CA C 13 53.401 0.400 . 1 . . . . . 3 ASP CA . 25612 1 21 . 1 1 3 3 ASP CB C 13 41.911 0.400 . 1 . . . . . 3 ASP CB . 25612 1 22 . 1 1 3 3 ASP N N 15 127.782 0.400 . 1 . . . . . 3 ASP N . 25612 1 23 . 1 1 4 4 LEU H H 1 8.860 0.020 . 1 . . . . . 4 LEU H . 25612 1 24 . 1 1 4 4 LEU HA H 1 5.041 0.020 . 1 . . . . . 4 LEU HA . 25612 1 25 . 1 1 4 4 LEU HB2 H 1 1.179 0.020 . 2 . . . . . 4 LEU HB2 . 25612 1 26 . 1 1 4 4 LEU HB3 H 1 1.620 0.020 . 2 . . . . . 4 LEU HB3 . 25612 1 27 . 1 1 4 4 LEU HG H 1 1.497 0.020 . 1 . . . . . 4 LEU HG . 25612 1 28 . 1 1 4 4 LEU HD11 H 1 0.751 0.020 . 2 . . . . . 4 LEU HD11 . 25612 1 29 . 1 1 4 4 LEU HD12 H 1 0.751 0.020 . 2 . . . . . 4 LEU HD12 . 25612 1 30 . 1 1 4 4 LEU HD13 H 1 0.751 0.020 . 2 . . . . . 4 LEU HD13 . 25612 1 31 . 1 1 4 4 LEU HD21 H 1 0.720 0.020 . 2 . . . . . 4 LEU HD21 . 25612 1 32 . 1 1 4 4 LEU HD22 H 1 0.720 0.020 . 2 . . . . . 4 LEU HD22 . 25612 1 33 . 1 1 4 4 LEU HD23 H 1 0.720 0.020 . 2 . . . . . 4 LEU HD23 . 25612 1 34 . 1 1 4 4 LEU C C 13 175.087 0.400 . 1 . . . . . 4 LEU C . 25612 1 35 . 1 1 4 4 LEU CA C 13 53.573 0.400 . 1 . . . . . 4 LEU CA . 25612 1 36 . 1 1 4 4 LEU CB C 13 44.479 0.400 . 1 . . . . . 4 LEU CB . 25612 1 37 . 1 1 4 4 LEU CG C 13 27.672 0.400 . 1 . . . . . 4 LEU CG . 25612 1 38 . 1 1 4 4 LEU CD1 C 13 25.721 0.400 . 1 . . . . . 4 LEU CD1 . 25612 1 39 . 1 1 4 4 LEU CD2 C 13 25.074 0.400 . 1 . . . . . 4 LEU CD2 . 25612 1 40 . 1 1 4 4 LEU N N 15 121.715 0.400 . 1 . . . . . 4 LEU N . 25612 1 41 . 1 1 5 5 LYS H H 1 8.863 0.020 . 1 . . . . . 5 LYS H . 25612 1 42 . 1 1 5 5 LYS HA H 1 5.397 0.020 . 1 . . . . . 5 LYS HA . 25612 1 43 . 1 1 5 5 LYS HB2 H 1 1.580 0.020 . 2 . . . . . 5 LYS HB2 . 25612 1 44 . 1 1 5 5 LYS HB3 H 1 1.677 0.020 . 2 . . . . . 5 LYS HB3 . 25612 1 45 . 1 1 5 5 LYS HG2 H 1 1.187 0.020 . 2 . . . . . 5 LYS HG2 . 25612 1 46 . 1 1 5 5 LYS HG3 H 1 1.329 0.020 . 2 . . . . . 5 LYS HG3 . 25612 1 47 . 1 1 5 5 LYS HD2 H 1 1.563 0.020 . 2 . . . . . 5 LYS HD2 . 25612 1 48 . 1 1 5 5 LYS HD3 H 1 1.566 0.020 . 2 . . . . . 5 LYS HD3 . 25612 1 49 . 1 1 5 5 LYS HE2 H 1 2.816 0.020 . 2 . . . . . 5 LYS HE2 . 25612 1 50 . 1 1 5 5 LYS HE3 H 1 2.807 0.020 . 2 . . . . . 5 LYS HE3 . 25612 1 51 . 1 1 5 5 LYS C C 13 175.266 0.400 . 1 . . . . . 5 LYS C . 25612 1 52 . 1 1 5 5 LYS CA C 13 54.751 0.400 . 1 . . . . . 5 LYS CA . 25612 1 53 . 1 1 5 5 LYS CB C 13 34.781 0.400 . 1 . . . . . 5 LYS CB . 25612 1 54 . 1 1 5 5 LYS CG C 13 25.103 0.400 . 1 . . . . . 5 LYS CG . 25612 1 55 . 1 1 5 5 LYS CD C 13 29.184 0.400 . 1 . . . . . 5 LYS CD . 25612 1 56 . 1 1 5 5 LYS CE C 13 41.160 0.400 . 1 . . . . . 5 LYS CE . 25612 1 57 . 1 1 5 5 LYS N N 15 122.519 0.400 . 1 . . . . . 5 LYS N . 25612 1 58 . 1 1 6 6 ILE H H 1 9.271 0.020 . 1 . . . . . 6 ILE H . 25612 1 59 . 1 1 6 6 ILE HA H 1 4.648 0.020 . 1 . . . . . 6 ILE HA . 25612 1 60 . 1 1 6 6 ILE HB H 1 1.699 0.020 . 1 . . . . . 6 ILE HB . 25612 1 61 . 1 1 6 6 ILE HG12 H 1 1.422 0.020 . 2 . . . . . 6 ILE HG12 . 25612 1 62 . 1 1 6 6 ILE HG13 H 1 1.030 0.020 . 2 . . . . . 6 ILE HG13 . 25612 1 63 . 1 1 6 6 ILE HG21 H 1 0.838 0.020 . 1 . . . . . 6 ILE HG21 . 25612 1 64 . 1 1 6 6 ILE HG22 H 1 0.838 0.020 . 1 . . . . . 6 ILE HG22 . 25612 1 65 . 1 1 6 6 ILE HG23 H 1 0.838 0.020 . 1 . . . . . 6 ILE HG23 . 25612 1 66 . 1 1 6 6 ILE HD11 H 1 0.740 0.020 . 1 . . . . . 6 ILE HD11 . 25612 1 67 . 1 1 6 6 ILE HD12 H 1 0.740 0.020 . 1 . . . . . 6 ILE HD12 . 25612 1 68 . 1 1 6 6 ILE HD13 H 1 0.740 0.020 . 1 . . . . . 6 ILE HD13 . 25612 1 69 . 1 1 6 6 ILE C C 13 174.399 0.400 . 1 . . . . . 6 ILE C . 25612 1 70 . 1 1 6 6 ILE CA C 13 59.953 0.400 . 1 . . . . . 6 ILE CA . 25612 1 71 . 1 1 6 6 ILE CB C 13 41.376 0.400 . 1 . . . . . 6 ILE CB . 25612 1 72 . 1 1 6 6 ILE CG1 C 13 28.742 0.400 . 1 . . . . . 6 ILE CG1 . 25612 1 73 . 1 1 6 6 ILE CG2 C 13 18.768 0.400 . 1 . . . . . 6 ILE CG2 . 25612 1 74 . 1 1 6 6 ILE CD1 C 13 16.063 0.400 . 1 . . . . . 6 ILE CD1 . 25612 1 75 . 1 1 6 6 ILE N N 15 125.951 0.400 . 1 . . . . . 6 ILE N . 25612 1 76 . 1 1 7 7 ASP H H 1 8.265 0.020 . 1 . . . . . 7 ASP H . 25612 1 77 . 1 1 7 7 ASP HA H 1 4.943 0.020 . 1 . . . . . 7 ASP HA . 25612 1 78 . 1 1 7 7 ASP HB2 H 1 2.654 0.020 . 2 . . . . . 7 ASP HB2 . 25612 1 79 . 1 1 7 7 ASP HB3 H 1 2.599 0.020 . 2 . . . . . 7 ASP HB3 . 25612 1 80 . 1 1 7 7 ASP C C 13 175.648 0.400 . 1 . . . . . 7 ASP C . 25612 1 81 . 1 1 7 7 ASP CA C 13 54.261 0.400 . 1 . . . . . 7 ASP CA . 25612 1 82 . 1 1 7 7 ASP CB C 13 40.497 0.400 . 1 . . . . . 7 ASP CB . 25612 1 83 . 1 1 7 7 ASP N N 15 127.145 0.400 . 1 . . . . . 7 ASP N . 25612 1 84 . 1 1 8 8 VAL H H 1 8.504 0.020 . 1 . . . . . 8 VAL H . 25612 1 85 . 1 1 8 8 VAL HA H 1 4.628 0.020 . 1 . . . . . 8 VAL HA . 25612 1 86 . 1 1 8 8 VAL HB H 1 2.140 0.020 . 1 . . . . . 8 VAL HB . 25612 1 87 . 1 1 8 8 VAL HG11 H 1 0.904 0.020 . 2 . . . . . 8 VAL HG11 . 25612 1 88 . 1 1 8 8 VAL HG12 H 1 0.904 0.020 . 2 . . . . . 8 VAL HG12 . 25612 1 89 . 1 1 8 8 VAL HG13 H 1 0.904 0.020 . 2 . . . . . 8 VAL HG13 . 25612 1 90 . 1 1 8 8 VAL HG21 H 1 0.839 0.020 . 2 . . . . . 8 VAL HG21 . 25612 1 91 . 1 1 8 8 VAL HG22 H 1 0.839 0.020 . 2 . . . . . 8 VAL HG22 . 25612 1 92 . 1 1 8 8 VAL HG23 H 1 0.839 0.020 . 2 . . . . . 8 VAL HG23 . 25612 1 93 . 1 1 8 8 VAL C C 13 175.444 0.400 . 1 . . . . . 8 VAL C . 25612 1 94 . 1 1 8 8 VAL CA C 13 60.014 0.400 . 1 . . . . . 8 VAL CA . 25612 1 95 . 1 1 8 8 VAL CB C 13 34.799 0.400 . 1 . . . . . 8 VAL CB . 25612 1 96 . 1 1 8 8 VAL CG1 C 13 22.762 0.400 . 1 . . . . . 8 VAL CG1 . 25612 1 97 . 1 1 8 8 VAL CG2 C 13 19.652 0.400 . 1 . . . . . 8 VAL CG2 . 25612 1 98 . 1 1 8 8 VAL N N 15 118.371 0.400 . 1 . . . . . 8 VAL N . 25612 1 99 . 1 1 9 9 SER H H 1 9.070 0.020 . 1 . . . . . 9 SER H . 25612 1 100 . 1 1 9 9 SER HA H 1 4.333 0.020 . 1 . . . . . 9 SER HA . 25612 1 101 . 1 1 9 9 SER HB2 H 1 3.816 0.020 . 2 . . . . . 9 SER HB2 . 25612 1 102 . 1 1 9 9 SER HB3 H 1 3.785 0.020 . 2 . . . . . 9 SER HB3 . 25612 1 103 . 1 1 9 9 SER C C 13 173.838 0.400 . 1 . . . . . 9 SER C . 25612 1 104 . 1 1 9 9 SER CA C 13 59.433 0.400 . 1 . . . . . 9 SER CA . 25612 1 105 . 1 1 9 9 SER CB C 13 64.100 0.400 . 1 . . . . . 9 SER CB . 25612 1 106 . 1 1 9 9 SER N N 15 119.097 0.400 . 1 . . . . . 9 SER N . 25612 1 107 . 1 1 10 10 ASP H H 1 7.600 0.020 . 1 . . . . . 10 ASP H . 25612 1 108 . 1 1 10 10 ASP HA H 1 4.646 0.020 . 1 . . . . . 10 ASP HA . 25612 1 109 . 1 1 10 10 ASP HB2 H 1 2.988 0.020 . 2 . . . . . 10 ASP HB2 . 25612 1 110 . 1 1 10 10 ASP HB3 H 1 2.889 0.020 . 2 . . . . . 10 ASP HB3 . 25612 1 111 . 1 1 10 10 ASP C C 13 175.368 0.400 . 1 . . . . . 10 ASP C . 25612 1 112 . 1 1 10 10 ASP CA C 13 53.463 0.400 . 1 . . . . . 10 ASP CA . 25612 1 113 . 1 1 10 10 ASP CB C 13 42.608 0.400 . 1 . . . . . 10 ASP CB . 25612 1 114 . 1 1 10 10 ASP N N 15 117.373 0.400 . 1 . . . . . 10 ASP N . 25612 1 115 . 1 1 11 11 ASP H H 1 8.692 0.020 . 1 . . . . . 11 ASP H . 25612 1 116 . 1 1 11 11 ASP HA H 1 4.395 0.020 . 1 . . . . . 11 ASP HA . 25612 1 117 . 1 1 11 11 ASP HB2 H 1 2.768 0.020 . 2 . . . . . 11 ASP HB2 . 25612 1 118 . 1 1 11 11 ASP HB3 H 1 2.637 0.020 . 2 . . . . . 11 ASP HB3 . 25612 1 119 . 1 1 11 11 ASP C C 13 177.790 0.400 . 1 . . . . . 11 ASP C . 25612 1 120 . 1 1 11 11 ASP CA C 13 57.312 0.400 . 1 . . . . . 11 ASP CA . 25612 1 121 . 1 1 11 11 ASP CB C 13 40.940 0.400 . 1 . . . . . 11 ASP CB . 25612 1 122 . 1 1 11 11 ASP N N 15 120.820 0.400 . 1 . . . . . 11 ASP N . 25612 1 123 . 1 1 12 12 GLU H H 1 8.325 0.020 . 1 . . . . . 12 GLU H . 25612 1 124 . 1 1 12 12 GLU HA H 1 4.095 0.020 . 1 . . . . . 12 GLU HA . 25612 1 125 . 1 1 12 12 GLU HB2 H 1 2.079 0.020 . 2 . . . . . 12 GLU HB2 . 25612 1 126 . 1 1 12 12 GLU HB3 H 1 2.129 0.020 . 2 . . . . . 12 GLU HB3 . 25612 1 127 . 1 1 12 12 GLU HG2 H 1 2.344 0.020 . 2 . . . . . 12 GLU HG2 . 25612 1 128 . 1 1 12 12 GLU HG3 H 1 2.220 0.020 . 2 . . . . . 12 GLU HG3 . 25612 1 129 . 1 1 12 12 GLU C C 13 179.243 0.400 . 1 . . . . . 12 GLU C . 25612 1 130 . 1 1 12 12 GLU CA C 13 59.462 0.400 . 1 . . . . . 12 GLU CA . 25612 1 131 . 1 1 12 12 GLU CB C 13 28.898 0.400 . 1 . . . . . 12 GLU CB . 25612 1 132 . 1 1 12 12 GLU CG C 13 36.605 0.400 . 1 . . . . . 12 GLU CG . 25612 1 133 . 1 1 12 12 GLU N N 15 121.717 0.400 . 1 . . . . . 12 GLU N . 25612 1 134 . 1 1 13 13 GLU H H 1 8.531 0.020 . 1 . . . . . 13 GLU H . 25612 1 135 . 1 1 13 13 GLU HA H 1 3.977 0.020 . 1 . . . . . 13 GLU HA . 25612 1 136 . 1 1 13 13 GLU HB2 H 1 2.209 0.020 . 2 . . . . . 13 GLU HB2 . 25612 1 137 . 1 1 13 13 GLU HB3 H 1 2.090 0.020 . 2 . . . . . 13 GLU HB3 . 25612 1 138 . 1 1 13 13 GLU HG2 H 1 2.205 0.020 . 2 . . . . . 13 GLU HG2 . 25612 1 139 . 1 1 13 13 GLU HG3 H 1 2.362 0.020 . 2 . . . . . 13 GLU HG3 . 25612 1 140 . 1 1 13 13 GLU C C 13 178.376 0.400 . 1 . . . . . 13 GLU C . 25612 1 141 . 1 1 13 13 GLU CA C 13 59.429 0.400 . 1 . . . . . 13 GLU CA . 25612 1 142 . 1 1 13 13 GLU CB C 13 30.260 0.400 . 1 . . . . . 13 GLU CB . 25612 1 143 . 1 1 13 13 GLU CG C 13 37.572 0.400 . 1 . . . . . 13 GLU CG . 25612 1 144 . 1 1 13 13 GLU N N 15 121.729 0.400 . 1 . . . . . 13 GLU N . 25612 1 145 . 1 1 14 14 ALA H H 1 8.089 0.020 . 1 . . . . . 14 ALA H . 25612 1 146 . 1 1 14 14 ALA HA H 1 3.929 0.020 . 1 . . . . . 14 ALA HA . 25612 1 147 . 1 1 14 14 ALA HB1 H 1 1.517 0.020 . 1 . . . . . 14 ALA HB1 . 25612 1 148 . 1 1 14 14 ALA HB2 H 1 1.517 0.020 . 1 . . . . . 14 ALA HB2 . 25612 1 149 . 1 1 14 14 ALA HB3 H 1 1.517 0.020 . 1 . . . . . 14 ALA HB3 . 25612 1 150 . 1 1 14 14 ALA C C 13 178.605 0.400 . 1 . . . . . 14 ALA C . 25612 1 151 . 1 1 14 14 ALA CA C 13 55.464 0.400 . 1 . . . . . 14 ALA CA . 25612 1 152 . 1 1 14 14 ALA CB C 13 17.807 0.400 . 1 . . . . . 14 ALA CB . 25612 1 153 . 1 1 14 14 ALA N N 15 119.585 0.400 . 1 . . . . . 14 ALA N . 25612 1 154 . 1 1 15 15 GLU H H 1 8.152 0.020 . 1 . . . . . 15 GLU H . 25612 1 155 . 1 1 15 15 GLU HA H 1 3.982 0.020 . 1 . . . . . 15 GLU HA . 25612 1 156 . 1 1 15 15 GLU HB2 H 1 2.127 0.020 . 2 . . . . . 15 GLU HB2 . 25612 1 157 . 1 1 15 15 GLU HB3 H 1 2.122 0.020 . 2 . . . . . 15 GLU HB3 . 25612 1 158 . 1 1 15 15 GLU HG2 H 1 2.371 0.020 . 2 . . . . . 15 GLU HG2 . 25612 1 159 . 1 1 15 15 GLU HG3 H 1 2.403 0.020 . 2 . . . . . 15 GLU HG3 . 25612 1 160 . 1 1 15 15 GLU C C 13 179.039 0.400 . 1 . . . . . 15 GLU C . 25612 1 161 . 1 1 15 15 GLU CA C 13 59.047 0.400 . 1 . . . . . 15 GLU CA . 25612 1 162 . 1 1 15 15 GLU CB C 13 28.912 0.400 . 1 . . . . . 15 GLU CB . 25612 1 163 . 1 1 15 15 GLU CG C 13 35.899 0.400 . 1 . . . . . 15 GLU CG . 25612 1 164 . 1 1 15 15 GLU N N 15 115.995 0.400 . 1 . . . . . 15 GLU N . 25612 1 165 . 1 1 16 16 LYS H H 1 7.824 0.020 . 1 . . . . . 16 LYS H . 25612 1 166 . 1 1 16 16 LYS HA H 1 4.001 0.020 . 1 . . . . . 16 LYS HA . 25612 1 167 . 1 1 16 16 LYS HB2 H 1 1.938 0.020 . 2 . . . . . 16 LYS HB2 . 25612 1 168 . 1 1 16 16 LYS HB3 H 1 2.024 0.020 . 2 . . . . . 16 LYS HB3 . 25612 1 169 . 1 1 16 16 LYS HG2 H 1 1.735 0.020 . 2 . . . . . 16 LYS HG2 . 25612 1 170 . 1 1 16 16 LYS HG3 H 1 1.443 0.020 . 2 . . . . . 16 LYS HG3 . 25612 1 171 . 1 1 16 16 LYS HD2 H 1 1.738 0.020 . 1 . . . . . 16 LYS HD2 . 25612 1 172 . 1 1 16 16 LYS HD3 H 1 1.737 0.020 . 1 . . . . . 16 LYS HD3 . 25612 1 173 . 1 1 16 16 LYS HE2 H 1 2.965 0.020 . 2 . . . . . 16 LYS HE2 . 25612 1 174 . 1 1 16 16 LYS HE3 H 1 2.984 0.020 . 2 . . . . . 16 LYS HE3 . 25612 1 175 . 1 1 16 16 LYS C C 13 179.396 0.400 . 1 . . . . . 16 LYS C . 25612 1 176 . 1 1 16 16 LYS CA C 13 59.588 0.400 . 1 . . . . . 16 LYS CA . 25612 1 177 . 1 1 16 16 LYS CB C 13 32.772 0.400 . 1 . . . . . 16 LYS CB . 25612 1 178 . 1 1 16 16 LYS CG C 13 25.602 0.400 . 1 . . . . . 16 LYS CG . 25612 1 179 . 1 1 16 16 LYS CD C 13 29.402 0.400 . 1 . . . . . 16 LYS CD . 25612 1 180 . 1 1 16 16 LYS CE C 13 41.780 0.400 . 1 . . . . . 16 LYS CE . 25612 1 181 . 1 1 16 16 LYS N N 15 119.577 0.400 . 1 . . . . . 16 LYS N . 25612 1 182 . 1 1 17 17 ILE H H 1 8.115 0.020 . 1 . . . . . 17 ILE H . 25612 1 183 . 1 1 17 17 ILE HA H 1 3.578 0.020 . 1 . . . . . 17 ILE HA . 25612 1 184 . 1 1 17 17 ILE HB H 1 1.938 0.020 . 1 . . . . . 17 ILE HB . 25612 1 185 . 1 1 17 17 ILE HG12 H 1 2.007 0.020 . 2 . . . . . 17 ILE HG12 . 25612 1 186 . 1 1 17 17 ILE HG13 H 1 0.873 0.020 . 2 . . . . . 17 ILE HG13 . 25612 1 187 . 1 1 17 17 ILE HG21 H 1 0.830 0.020 . 1 . . . . . 17 ILE HG21 . 25612 1 188 . 1 1 17 17 ILE HG22 H 1 0.830 0.020 . 1 . . . . . 17 ILE HG22 . 25612 1 189 . 1 1 17 17 ILE HG23 H 1 0.830 0.020 . 1 . . . . . 17 ILE HG23 . 25612 1 190 . 1 1 17 17 ILE HD11 H 1 0.818 0.020 . 1 . . . . . 17 ILE HD11 . 25612 1 191 . 1 1 17 17 ILE HD12 H 1 0.818 0.020 . 1 . . . . . 17 ILE HD12 . 25612 1 192 . 1 1 17 17 ILE HD13 H 1 0.818 0.020 . 1 . . . . . 17 ILE HD13 . 25612 1 193 . 1 1 17 17 ILE C C 13 176.872 0.400 . 1 . . . . . 17 ILE C . 25612 1 194 . 1 1 17 17 ILE CA C 13 66.011 0.400 . 1 . . . . . 17 ILE CA . 25612 1 195 . 1 1 17 17 ILE CB C 13 38.080 0.400 . 1 . . . . . 17 ILE CB . 25612 1 196 . 1 1 17 17 ILE CG1 C 13 29.251 0.400 . 1 . . . . . 17 ILE CG1 . 25612 1 197 . 1 1 17 17 ILE CG2 C 13 17.823 0.400 . 1 . . . . . 17 ILE CG2 . 25612 1 198 . 1 1 17 17 ILE CD1 C 13 14.423 0.400 . 1 . . . . . 17 ILE CD1 . 25612 1 199 . 1 1 17 17 ILE N N 15 119.975 0.400 . 1 . . . . . 17 ILE N . 25612 1 200 . 1 1 18 18 ILE H H 1 8.636 0.020 . 1 . . . . . 18 ILE H . 25612 1 201 . 1 1 18 18 ILE HA H 1 3.359 0.020 . 1 . . . . . 18 ILE HA . 25612 1 202 . 1 1 18 18 ILE HB H 1 1.849 0.020 . 1 . . . . . 18 ILE HB . 25612 1 203 . 1 1 18 18 ILE HG12 H 1 1.901 0.020 . 2 . . . . . 18 ILE HG12 . 25612 1 204 . 1 1 18 18 ILE HG13 H 1 0.796 0.020 . 2 . . . . . 18 ILE HG13 . 25612 1 205 . 1 1 18 18 ILE HG21 H 1 0.910 0.020 . 1 . . . . . 18 ILE HG21 . 25612 1 206 . 1 1 18 18 ILE HG22 H 1 0.910 0.020 . 1 . . . . . 18 ILE HG22 . 25612 1 207 . 1 1 18 18 ILE HG23 H 1 0.910 0.020 . 1 . . . . . 18 ILE HG23 . 25612 1 208 . 1 1 18 18 ILE HD11 H 1 0.771 0.020 . 1 . . . . . 18 ILE HD11 . 25612 1 209 . 1 1 18 18 ILE HD12 H 1 0.771 0.020 . 1 . . . . . 18 ILE HD12 . 25612 1 210 . 1 1 18 18 ILE HD13 H 1 0.771 0.020 . 1 . . . . . 18 ILE HD13 . 25612 1 211 . 1 1 18 18 ILE C C 13 177.203 0.400 . 1 . . . . . 18 ILE C . 25612 1 212 . 1 1 18 18 ILE CA C 13 66.524 0.400 . 1 . . . . . 18 ILE CA . 25612 1 213 . 1 1 18 18 ILE CB C 13 37.854 0.400 . 1 . . . . . 18 ILE CB . 25612 1 214 . 1 1 18 18 ILE CG1 C 13 30.288 0.400 . 1 . . . . . 18 ILE CG1 . 25612 1 215 . 1 1 18 18 ILE CG2 C 13 17.136 0.400 . 1 . . . . . 18 ILE CG2 . 25612 1 216 . 1 1 18 18 ILE CD1 C 13 13.200 0.400 . 1 . . . . . 18 ILE CD1 . 25612 1 217 . 1 1 18 18 ILE N N 15 119.725 0.400 . 1 . . . . . 18 ILE N . 25612 1 218 . 1 1 19 19 ARG H H 1 8.290 0.020 . 1 . . . . . 19 ARG H . 25612 1 219 . 1 1 19 19 ARG HA H 1 3.959 0.020 . 1 . . . . . 19 ARG HA . 25612 1 220 . 1 1 19 19 ARG HB2 H 1 1.992 0.020 . 2 . . . . . 19 ARG HB2 . 25612 1 221 . 1 1 19 19 ARG HB3 H 1 1.927 0.020 . 2 . . . . . 19 ARG HB3 . 25612 1 222 . 1 1 19 19 ARG HG2 H 1 1.626 0.020 . 2 . . . . . 19 ARG HG2 . 25612 1 223 . 1 1 19 19 ARG HG3 H 1 1.826 0.020 . 2 . . . . . 19 ARG HG3 . 25612 1 224 . 1 1 19 19 ARG HD2 H 1 3.236 0.020 . 2 . . . . . 19 ARG HD2 . 25612 1 225 . 1 1 19 19 ARG HD3 H 1 3.238 0.020 . 2 . . . . . 19 ARG HD3 . 25612 1 226 . 1 1 19 19 ARG C C 13 178.554 0.400 . 1 . . . . . 19 ARG C . 25612 1 227 . 1 1 19 19 ARG CA C 13 59.504 0.400 . 1 . . . . . 19 ARG CA . 25612 1 228 . 1 1 19 19 ARG CB C 13 29.797 0.400 . 1 . . . . . 19 ARG CB . 25612 1 229 . 1 1 19 19 ARG CG C 13 27.310 0.400 . 1 . . . . . 19 ARG CG . 25612 1 230 . 1 1 19 19 ARG CD C 13 43.432 0.400 . 1 . . . . . 19 ARG CD . 25612 1 231 . 1 1 19 19 ARG N N 15 118.535 0.400 . 1 . . . . . 19 ARG N . 25612 1 232 . 1 1 20 20 GLU H H 1 7.514 0.020 . 1 . . . . . 20 GLU H . 25612 1 233 . 1 1 20 20 GLU HA H 1 4.036 0.020 . 1 . . . . . 20 GLU HA . 25612 1 234 . 1 1 20 20 GLU HB2 H 1 2.106 0.020 . 2 . . . . . 20 GLU HB2 . 25612 1 235 . 1 1 20 20 GLU HB3 H 1 2.189 0.020 . 2 . . . . . 20 GLU HB3 . 25612 1 236 . 1 1 20 20 GLU HG2 H 1 2.199 0.020 . 2 . . . . . 20 GLU HG2 . 25612 1 237 . 1 1 20 20 GLU HG3 H 1 2.485 0.020 . 2 . . . . . 20 GLU HG3 . 25612 1 238 . 1 1 20 20 GLU C C 13 179.447 0.400 . 1 . . . . . 20 GLU C . 25612 1 239 . 1 1 20 20 GLU CA C 13 58.816 0.400 . 1 . . . . . 20 GLU CA . 25612 1 240 . 1 1 20 20 GLU CB C 13 29.212 0.400 . 1 . . . . . 20 GLU CB . 25612 1 241 . 1 1 20 20 GLU CG C 13 35.050 0.400 . 1 . . . . . 20 GLU CG . 25612 1 242 . 1 1 20 20 GLU N N 15 118.975 0.400 . 1 . . . . . 20 GLU N . 25612 1 243 . 1 1 21 21 ILE H H 1 8.314 0.020 . 1 . . . . . 21 ILE H . 25612 1 244 . 1 1 21 21 ILE HA H 1 4.170 0.020 . 1 . . . . . 21 ILE HA . 25612 1 245 . 1 1 21 21 ILE HB H 1 2.312 0.020 . 1 . . . . . 21 ILE HB . 25612 1 246 . 1 1 21 21 ILE HG12 H 1 1.788 0.020 . 2 . . . . . 21 ILE HG12 . 25612 1 247 . 1 1 21 21 ILE HG13 H 1 1.343 0.020 . 2 . . . . . 21 ILE HG13 . 25612 1 248 . 1 1 21 21 ILE HG21 H 1 1.019 0.020 . 1 . . . . . 21 ILE HG21 . 25612 1 249 . 1 1 21 21 ILE HG22 H 1 1.019 0.020 . 1 . . . . . 21 ILE HG22 . 25612 1 250 . 1 1 21 21 ILE HG23 H 1 1.019 0.020 . 1 . . . . . 21 ILE HG23 . 25612 1 251 . 1 1 21 21 ILE HD11 H 1 0.764 0.020 . 1 . . . . . 21 ILE HD11 . 25612 1 252 . 1 1 21 21 ILE HD12 H 1 0.764 0.020 . 1 . . . . . 21 ILE HD12 . 25612 1 253 . 1 1 21 21 ILE HD13 H 1 0.764 0.020 . 1 . . . . . 21 ILE HD13 . 25612 1 254 . 1 1 21 21 ILE C C 13 178.172 0.400 . 1 . . . . . 21 ILE C . 25612 1 255 . 1 1 21 21 ILE CA C 13 62.301 0.400 . 1 . . . . . 21 ILE CA . 25612 1 256 . 1 1 21 21 ILE CB C 13 35.852 0.400 . 1 . . . . . 21 ILE CB . 25612 1 257 . 1 1 21 21 ILE CG1 C 13 26.988 0.400 . 1 . . . . . 21 ILE CG1 . 25612 1 258 . 1 1 21 21 ILE CG2 C 13 17.360 0.400 . 1 . . . . . 21 ILE CG2 . 25612 1 259 . 1 1 21 21 ILE CD1 C 13 10.184 0.400 . 1 . . . . . 21 ILE CD1 . 25612 1 260 . 1 1 21 21 ILE N N 15 118.778 0.400 . 1 . . . . . 21 ILE N . 25612 1 261 . 1 1 22 22 ARG H H 1 8.837 0.020 . 1 . . . . . 22 ARG H . 25612 1 262 . 1 1 22 22 ARG HA H 1 4.026 0.020 . 1 . . . . . 22 ARG HA . 25612 1 263 . 1 1 22 22 ARG HB2 H 1 1.981 0.020 . 2 . . . . . 22 ARG HB2 . 25612 1 264 . 1 1 22 22 ARG HB3 H 1 1.844 0.020 . 2 . . . . . 22 ARG HB3 . 25612 1 265 . 1 1 22 22 ARG HG2 H 1 1.734 0.020 . 2 . . . . . 22 ARG HG2 . 25612 1 266 . 1 1 22 22 ARG HG3 H 1 1.892 0.020 . 2 . . . . . 22 ARG HG3 . 25612 1 267 . 1 1 22 22 ARG HD2 H 1 3.205 0.020 . 2 . . . . . 22 ARG HD2 . 25612 1 268 . 1 1 22 22 ARG HD3 H 1 3.249 0.020 . 2 . . . . . 22 ARG HD3 . 25612 1 269 . 1 1 22 22 ARG C C 13 177.509 0.400 . 1 . . . . . 22 ARG C . 25612 1 270 . 1 1 22 22 ARG CA C 13 58.404 0.400 . 1 . . . . . 22 ARG CA . 25612 1 271 . 1 1 22 22 ARG CB C 13 29.383 0.400 . 1 . . . . . 22 ARG CB . 25612 1 272 . 1 1 22 22 ARG CG C 13 27.950 0.400 . 1 . . . . . 22 ARG CG . 25612 1 273 . 1 1 22 22 ARG CD C 13 43.100 0.400 . 1 . . . . . 22 ARG CD . 25612 1 274 . 1 1 22 22 ARG N N 15 118.602 0.400 . 1 . . . . . 22 ARG N . 25612 1 275 . 1 1 23 23 GLU H H 1 7.590 0.020 . 1 . . . . . 23 GLU H . 25612 1 276 . 1 1 23 23 GLU HA H 1 3.973 0.020 . 1 . . . . . 23 GLU HA . 25612 1 277 . 1 1 23 23 GLU HB2 H 1 2.020 0.020 . 2 . . . . . 23 GLU HB2 . 25612 1 278 . 1 1 23 23 GLU HB3 H 1 2.138 0.020 . 2 . . . . . 23 GLU HB3 . 25612 1 279 . 1 1 23 23 GLU HG2 H 1 2.373 0.020 . 2 . . . . . 23 GLU HG2 . 25612 1 280 . 1 1 23 23 GLU HG3 H 1 2.257 0.020 . 2 . . . . . 23 GLU HG3 . 25612 1 281 . 1 1 23 23 GLU C C 13 177.458 0.400 . 1 . . . . . 23 GLU C . 25612 1 282 . 1 1 23 23 GLU CA C 13 58.636 0.400 . 1 . . . . . 23 GLU CA . 25612 1 283 . 1 1 23 23 GLU CB C 13 29.583 0.400 . 1 . . . . . 23 GLU CB . 25612 1 284 . 1 1 23 23 GLU CG C 13 36.010 0.400 . 1 . . . . . 23 GLU CG . 25612 1 285 . 1 1 23 23 GLU N N 15 116.718 0.400 . 1 . . . . . 23 GLU N . 25612 1 286 . 1 1 24 24 GLN H H 1 6.954 0.020 . 1 . . . . . 24 GLN H . 25612 1 287 . 1 1 24 24 GLN HA H 1 3.990 0.020 . 1 . . . . . 24 GLN HA . 25612 1 288 . 1 1 24 24 GLN HB2 H 1 1.227 0.020 . 2 . . . . . 24 GLN HB2 . 25612 1 289 . 1 1 24 24 GLN HB3 H 1 0.829 0.020 . 2 . . . . . 24 GLN HB3 . 25612 1 290 . 1 1 24 24 GLN HG2 H 1 1.525 0.020 . 2 . . . . . 24 GLN HG2 . 25612 1 291 . 1 1 24 24 GLN HG3 H 1 1.941 0.020 . 2 . . . . . 24 GLN HG3 . 25612 1 292 . 1 1 24 24 GLN HE21 H 1 7.689 0.020 . 2 . . . . . 24 GLN HE21 . 25612 1 293 . 1 1 24 24 GLN HE22 H 1 6.700 0.020 . 2 . . . . . 24 GLN HE22 . 25612 1 294 . 1 1 24 24 GLN C C 13 175.062 0.400 . 1 . . . . . 24 GLN C . 25612 1 295 . 1 1 24 24 GLN CA C 13 55.992 0.400 . 1 . . . . . 24 GLN CA . 25612 1 296 . 1 1 24 24 GLN CB C 13 29.740 0.400 . 1 . . . . . 24 GLN CB . 25612 1 297 . 1 1 24 24 GLN CG C 13 34.088 0.400 . 1 . . . . . 24 GLN CG . 25612 1 298 . 1 1 24 24 GLN N N 15 114.802 0.400 . 1 . . . . . 24 GLN N . 25612 1 299 . 1 1 24 24 GLN NE2 N 15 112.275 0.400 . 1 . . . . . 24 GLN NE2 . 25612 1 300 . 1 1 25 25 TRP H H 1 8.920 0.020 . 1 . . . . . 25 TRP H . 25612 1 301 . 1 1 25 25 TRP HA H 1 5.006 0.020 . 1 . . . . . 25 TRP HA . 25612 1 302 . 1 1 25 25 TRP HB2 H 1 3.214 0.020 . 2 . . . . . 25 TRP HB2 . 25612 1 303 . 1 1 25 25 TRP HB3 H 1 3.082 0.020 . 2 . . . . . 25 TRP HB3 . 25612 1 304 . 1 1 25 25 TRP HD1 H 1 7.218 0.020 . 1 . . . . . 25 TRP HD1 . 25612 1 305 . 1 1 25 25 TRP HE1 H 1 10.230 0.020 . 1 . . . . . 25 TRP HE1 . 25612 1 306 . 1 1 25 25 TRP HE3 H 1 8.202 0.020 . 1 . . . . . 25 TRP HE3 . 25612 1 307 . 1 1 25 25 TRP HZ2 H 1 7.266 0.020 . 1 . . . . . 25 TRP HZ2 . 25612 1 308 . 1 1 25 25 TRP HZ3 H 1 6.794 0.020 . 1 . . . . . 25 TRP HZ3 . 25612 1 309 . 1 1 25 25 TRP HH2 H 1 6.755 0.020 . 1 . . . . . 25 TRP HH2 . 25612 1 310 . 1 1 25 25 TRP CA C 13 57.645 0.400 . 1 . . . . . 25 TRP CA . 25612 1 311 . 1 1 25 25 TRP CB C 13 28.522 0.400 . 1 . . . . . 25 TRP CB . 25612 1 312 . 1 1 25 25 TRP CD1 C 13 126.779 0.400 . 1 . . . . . 25 TRP CD1 . 25612 1 313 . 1 1 25 25 TRP CE3 C 13 122.515 0.400 . 1 . . . . . 25 TRP CE3 . 25612 1 314 . 1 1 25 25 TRP CZ2 C 13 113.717 0.400 . 1 . . . . . 25 TRP CZ2 . 25612 1 315 . 1 1 25 25 TRP CZ3 C 13 120.436 0.400 . 1 . . . . . 25 TRP CZ3 . 25612 1 316 . 1 1 25 25 TRP CH2 C 13 123.265 0.400 . 1 . . . . . 25 TRP CH2 . 25612 1 317 . 1 1 25 25 TRP N N 15 119.538 0.400 . 1 . . . . . 25 TRP N . 25612 1 318 . 1 1 25 25 TRP NE1 N 15 129.609 0.400 . 1 . . . . . 25 TRP NE1 . 25612 1 319 . 1 1 26 26 PRO HA H 1 4.601 0.020 . 1 . . . . . 26 PRO HA . 25612 1 320 . 1 1 26 26 PRO HB2 H 1 2.483 0.020 . 2 . . . . . 26 PRO HB2 . 25612 1 321 . 1 1 26 26 PRO HB3 H 1 1.946 0.020 . 2 . . . . . 26 PRO HB3 . 25612 1 322 . 1 1 26 26 PRO HG2 H 1 2.022 0.020 . 2 . . . . . 26 PRO HG2 . 25612 1 323 . 1 1 26 26 PRO HG3 H 1 1.916 0.020 . 2 . . . . . 26 PRO HG3 . 25612 1 324 . 1 1 26 26 PRO HD2 H 1 3.172 0.020 . 2 . . . . . 26 PRO HD2 . 25612 1 325 . 1 1 26 26 PRO HD3 H 1 3.617 0.020 . 2 . . . . . 26 PRO HD3 . 25612 1 326 . 1 1 26 26 PRO C C 13 178.121 0.400 . 1 . . . . . 26 PRO C . 25612 1 327 . 1 1 26 26 PRO CA C 13 65.051 0.400 . 1 . . . . . 26 PRO CA . 25612 1 328 . 1 1 26 26 PRO CB C 13 32.000 0.400 . 1 . . . . . 26 PRO CB . 25612 1 329 . 1 1 26 26 PRO CG C 13 27.140 0.400 . 1 . . . . . 26 PRO CG . 25612 1 330 . 1 1 26 26 PRO CD C 13 50.021 0.400 . 1 . . . . . 26 PRO CD . 25612 1 331 . 1 1 27 27 LYS H H 1 8.768 0.020 . 1 . . . . . 27 LYS H . 25612 1 332 . 1 1 27 27 LYS HA H 1 4.479 0.020 . 1 . . . . . 27 LYS HA . 25612 1 333 . 1 1 27 27 LYS HB2 H 1 2.072 0.020 . 2 . . . . . 27 LYS HB2 . 25612 1 334 . 1 1 27 27 LYS HB3 H 1 1.769 0.020 . 2 . . . . . 27 LYS HB3 . 25612 1 335 . 1 1 27 27 LYS HG2 H 1 1.459 0.020 . 2 . . . . . 27 LYS HG2 . 25612 1 336 . 1 1 27 27 LYS HG3 H 1 1.372 0.020 . 2 . . . . . 27 LYS HG3 . 25612 1 337 . 1 1 27 27 LYS HD2 H 1 1.669 0.020 . 2 . . . . . 27 LYS HD2 . 25612 1 338 . 1 1 27 27 LYS HD3 H 1 1.673 0.020 . 2 . . . . . 27 LYS HD3 . 25612 1 339 . 1 1 27 27 LYS HE2 H 1 2.975 0.020 . 1 . . . . . 27 LYS HE2 . 25612 1 340 . 1 1 27 27 LYS HE3 H 1 2.975 0.020 . 1 . . . . . 27 LYS HE3 . 25612 1 341 . 1 1 27 27 LYS C C 13 176.744 0.400 . 1 . . . . . 27 LYS C . 25612 1 342 . 1 1 27 27 LYS CA C 13 54.717 0.400 . 1 . . . . . 27 LYS CA . 25612 1 343 . 1 1 27 27 LYS CB C 13 31.719 0.400 . 1 . . . . . 27 LYS CB . 25612 1 344 . 1 1 27 27 LYS CG C 13 24.910 0.400 . 1 . . . . . 27 LYS CG . 25612 1 345 . 1 1 27 27 LYS CD C 13 28.512 0.400 . 1 . . . . . 27 LYS CD . 25612 1 346 . 1 1 27 27 LYS CE C 13 41.780 0.400 . 1 . . . . . 27 LYS CE . 25612 1 347 . 1 1 27 27 LYS N N 15 115.537 0.400 . 1 . . . . . 27 LYS N . 25612 1 348 . 1 1 28 28 ALA H H 1 7.677 0.020 . 1 . . . . . 28 ALA H . 25612 1 349 . 1 1 28 28 ALA HA H 1 4.305 0.020 . 1 . . . . . 28 ALA HA . 25612 1 350 . 1 1 28 28 ALA HB1 H 1 1.384 0.020 . 1 . . . . . 28 ALA HB1 . 25612 1 351 . 1 1 28 28 ALA HB2 H 1 1.384 0.020 . 1 . . . . . 28 ALA HB2 . 25612 1 352 . 1 1 28 28 ALA HB3 H 1 1.384 0.020 . 1 . . . . . 28 ALA HB3 . 25612 1 353 . 1 1 28 28 ALA C C 13 177.993 0.400 . 1 . . . . . 28 ALA C . 25612 1 354 . 1 1 28 28 ALA CA C 13 52.585 0.400 . 1 . . . . . 28 ALA CA . 25612 1 355 . 1 1 28 28 ALA CB C 13 18.712 0.400 . 1 . . . . . 28 ALA CB . 25612 1 356 . 1 1 28 28 ALA N N 15 123.662 0.400 . 1 . . . . . 28 ALA N . 25612 1 357 . 1 1 29 29 THR H H 1 8.953 0.020 . 1 . . . . . 29 THR H . 25612 1 358 . 1 1 29 29 THR HA H 1 4.240 0.020 . 1 . . . . . 29 THR HA . 25612 1 359 . 1 1 29 29 THR HB H 1 4.111 0.020 . 1 . . . . . 29 THR HB . 25612 1 360 . 1 1 29 29 THR HG21 H 1 1.179 0.020 . 1 . . . . . 29 THR HG21 . 25612 1 361 . 1 1 29 29 THR HG22 H 1 1.179 0.020 . 1 . . . . . 29 THR HG22 . 25612 1 362 . 1 1 29 29 THR HG23 H 1 1.179 0.020 . 1 . . . . . 29 THR HG23 . 25612 1 363 . 1 1 29 29 THR C C 13 173.048 0.400 . 1 . . . . . 29 THR C . 25612 1 364 . 1 1 29 29 THR CA C 13 63.146 0.400 . 1 . . . . . 29 THR CA . 25612 1 365 . 1 1 29 29 THR CB C 13 68.819 0.400 . 1 . . . . . 29 THR CB . 25612 1 366 . 1 1 29 29 THR CG2 C 13 21.652 0.400 . 1 . . . . . 29 THR CG2 . 25612 1 367 . 1 1 29 29 THR N N 15 120.525 0.400 . 1 . . . . . 29 THR N . 25612 1 368 . 1 1 30 30 VAL H H 1 8.416 0.020 . 1 . . . . . 30 VAL H . 25612 1 369 . 1 1 30 30 VAL HA H 1 4.780 0.020 . 1 . . . . . 30 VAL HA . 25612 1 370 . 1 1 30 30 VAL HB H 1 1.939 0.020 . 1 . . . . . 30 VAL HB . 25612 1 371 . 1 1 30 30 VAL HG11 H 1 0.850 0.020 . 2 . . . . . 30 VAL HG11 . 25612 1 372 . 1 1 30 30 VAL HG12 H 1 0.850 0.020 . 2 . . . . . 30 VAL HG12 . 25612 1 373 . 1 1 30 30 VAL HG13 H 1 0.850 0.020 . 2 . . . . . 30 VAL HG13 . 25612 1 374 . 1 1 30 30 VAL HG21 H 1 0.840 0.020 . 2 . . . . . 30 VAL HG21 . 25612 1 375 . 1 1 30 30 VAL HG22 H 1 0.840 0.020 . 2 . . . . . 30 VAL HG22 . 25612 1 376 . 1 1 30 30 VAL HG23 H 1 0.840 0.020 . 2 . . . . . 30 VAL HG23 . 25612 1 377 . 1 1 30 30 VAL C C 13 175.138 0.400 . 1 . . . . . 30 VAL C . 25612 1 378 . 1 1 30 30 VAL CA C 13 60.468 0.400 . 1 . . . . . 30 VAL CA . 25612 1 379 . 1 1 30 30 VAL CB C 13 33.710 0.400 . 1 . . . . . 30 VAL CB . 25612 1 380 . 1 1 30 30 VAL CG1 C 13 21.180 0.400 . 1 . . . . . 30 VAL CG1 . 25612 1 381 . 1 1 30 30 VAL CG2 C 13 20.944 0.400 . 1 . . . . . 30 VAL CG2 . 25612 1 382 . 1 1 30 30 VAL N N 15 127.607 0.400 . 1 . . . . . 30 VAL N . 25612 1 383 . 1 1 31 31 THR H H 1 8.775 0.020 . 1 . . . . . 31 THR H . 25612 1 384 . 1 1 31 31 THR HA H 1 4.650 0.020 . 1 . . . . . 31 THR HA . 25612 1 385 . 1 1 31 31 THR HB H 1 4.023 0.020 . 1 . . . . . 31 THR HB . 25612 1 386 . 1 1 31 31 THR HG21 H 1 1.117 0.020 . 1 . . . . . 31 THR HG21 . 25612 1 387 . 1 1 31 31 THR HG22 H 1 1.117 0.020 . 1 . . . . . 31 THR HG22 . 25612 1 388 . 1 1 31 31 THR HG23 H 1 1.117 0.020 . 1 . . . . . 31 THR HG23 . 25612 1 389 . 1 1 31 31 THR C C 13 172.615 0.400 . 1 . . . . . 31 THR C . 25612 1 390 . 1 1 31 31 THR CA C 13 60.641 0.400 . 1 . . . . . 31 THR CA . 25612 1 391 . 1 1 31 31 THR CB C 13 71.524 0.400 . 1 . . . . . 31 THR CB . 25612 1 392 . 1 1 31 31 THR CG2 C 13 21.274 0.400 . 1 . . . . . 31 THR CG2 . 25612 1 393 . 1 1 31 31 THR N N 15 120.920 0.400 . 1 . . . . . 31 THR N . 25612 1 394 . 1 1 32 32 ARG H H 1 8.757 0.020 . 1 . . . . . 32 ARG H . 25612 1 395 . 1 1 32 32 ARG HA H 1 5.213 0.020 . 1 . . . . . 32 ARG HA . 25612 1 396 . 1 1 32 32 ARG HB2 H 1 2.044 0.020 . 2 . . . . . 32 ARG HB2 . 25612 1 397 . 1 1 32 32 ARG HB3 H 1 1.694 0.020 . 2 . . . . . 32 ARG HB3 . 25612 1 398 . 1 1 32 32 ARG HG2 H 1 1.735 0.020 . 2 . . . . . 32 ARG HG2 . 25612 1 399 . 1 1 32 32 ARG HG3 H 1 1.581 0.020 . 2 . . . . . 32 ARG HG3 . 25612 1 400 . 1 1 32 32 ARG HD2 H 1 3.117 0.020 . 2 . . . . . 32 ARG HD2 . 25612 1 401 . 1 1 32 32 ARG HD3 H 1 3.066 0.020 . 2 . . . . . 32 ARG HD3 . 25612 1 402 . 1 1 32 32 ARG C C 13 176.387 0.400 . 1 . . . . . 32 ARG C . 25612 1 403 . 1 1 32 32 ARG CA C 13 53.871 0.400 . 1 . . . . . 32 ARG CA . 25612 1 404 . 1 1 32 32 ARG CB C 13 30.449 0.400 . 1 . . . . . 32 ARG CB . 25612 1 405 . 1 1 32 32 ARG CG C 13 26.819 0.400 . 1 . . . . . 32 ARG CG . 25612 1 406 . 1 1 32 32 ARG CD C 13 42.207 0.400 . 1 . . . . . 32 ARG CD . 25612 1 407 . 1 1 32 32 ARG N N 15 123.505 0.400 . 1 . . . . . 32 ARG N . 25612 1 408 . 1 1 33 33 THR H H 1 8.403 0.020 . 1 . . . . . 33 THR H . 25612 1 409 . 1 1 33 33 THR HA H 1 4.481 0.020 . 1 . . . . . 33 THR HA . 25612 1 410 . 1 1 33 33 THR HB H 1 4.174 0.020 . 1 . . . . . 33 THR HB . 25612 1 411 . 1 1 33 33 THR HG21 H 1 1.048 0.020 . 1 . . . . . 33 THR HG21 . 25612 1 412 . 1 1 33 33 THR HG22 H 1 1.048 0.020 . 1 . . . . . 33 THR HG22 . 25612 1 413 . 1 1 33 33 THR HG23 H 1 1.048 0.020 . 1 . . . . . 33 THR HG23 . 25612 1 414 . 1 1 33 33 THR C C 13 172.334 0.400 . 1 . . . . . 33 THR C . 25612 1 415 . 1 1 33 33 THR CA C 13 60.710 0.400 . 1 . . . . . 33 THR CA . 25612 1 416 . 1 1 33 33 THR CB C 13 69.273 0.400 . 1 . . . . . 33 THR CB . 25612 1 417 . 1 1 33 33 THR CG2 C 13 20.756 0.400 . 1 . . . . . 33 THR CG2 . 25612 1 418 . 1 1 33 33 THR N N 15 117.278 0.400 . 1 . . . . . 33 THR N . 25612 1 419 . 1 1 34 34 ASN H H 1 7.987 0.020 . 1 . . . . . 34 ASN H . 25612 1 420 . 1 1 34 34 ASN HA H 1 4.661 0.020 . 1 . . . . . 34 ASN HA . 25612 1 421 . 1 1 34 34 ASN HB2 H 1 2.938 0.020 . 2 . . . . . 34 ASN HB2 . 25612 1 422 . 1 1 34 34 ASN HB3 H 1 2.614 0.020 . 2 . . . . . 34 ASN HB3 . 25612 1 423 . 1 1 34 34 ASN HD21 H 1 7.664 0.020 . 2 . . . . . 34 ASN HD21 . 25612 1 424 . 1 1 34 34 ASN HD22 H 1 6.950 0.020 . 2 . . . . . 34 ASN HD22 . 25612 1 425 . 1 1 34 34 ASN C C 13 176.362 0.400 . 1 . . . . . 34 ASN C . 25612 1 426 . 1 1 34 34 ASN CA C 13 53.833 0.400 . 1 . . . . . 34 ASN CA . 25612 1 427 . 1 1 34 34 ASN CB C 13 41.820 0.400 . 1 . . . . . 34 ASN CB . 25612 1 428 . 1 1 34 34 ASN N N 15 127.725 0.400 . 1 . . . . . 34 ASN N . 25612 1 429 . 1 1 34 34 ASN ND2 N 15 112.952 0.400 . 1 . . . . . 34 ASN ND2 . 25612 1 430 . 1 1 35 35 GLY H H 1 8.419 0.020 . 1 . . . . . 35 GLY H . 25612 1 431 . 1 1 35 35 GLY HA2 H 1 3.653 0.020 . 2 . . . . . 35 GLY HA2 . 25612 1 432 . 1 1 35 35 GLY HA3 H 1 4.176 0.020 . 2 . . . . . 35 GLY HA3 . 25612 1 433 . 1 1 35 35 GLY C C 13 174.040 0.400 . 1 . . . . . 35 GLY C . 25612 1 434 . 1 1 35 35 GLY CA C 13 45.555 0.400 . 1 . . . . . 35 GLY CA . 25612 1 435 . 1 1 35 35 GLY N N 15 112.162 0.400 . 1 . . . . . 35 GLY N . 25612 1 436 . 1 1 36 36 ASP H H 1 7.867 0.020 . 1 . . . . . 36 ASP H . 25612 1 437 . 1 1 36 36 ASP HA H 1 5.358 0.020 . 1 . . . . . 36 ASP HA . 25612 1 438 . 1 1 36 36 ASP HB2 H 1 2.658 0.020 . 2 . . . . . 36 ASP HB2 . 25612 1 439 . 1 1 36 36 ASP HB3 H 1 2.642 0.020 . 2 . . . . . 36 ASP HB3 . 25612 1 440 . 1 1 36 36 ASP C C 13 176.184 0.400 . 1 . . . . . 36 ASP C . 25612 1 441 . 1 1 36 36 ASP CA C 13 53.624 0.400 . 1 . . . . . 36 ASP CA . 25612 1 442 . 1 1 36 36 ASP CB C 13 42.643 0.400 . 1 . . . . . 36 ASP CB . 25612 1 443 . 1 1 36 36 ASP N N 15 118.367 0.400 . 1 . . . . . 36 ASP N . 25612 1 444 . 1 1 37 37 ILE H H 1 8.697 0.020 . 1 . . . . . 37 ILE H . 25612 1 445 . 1 1 37 37 ILE HA H 1 4.741 0.020 . 1 . . . . . 37 ILE HA . 25612 1 446 . 1 1 37 37 ILE HB H 1 1.643 0.020 . 1 . . . . . 37 ILE HB . 25612 1 447 . 1 1 37 37 ILE HG12 H 1 0.939 0.020 . 2 . . . . . 37 ILE HG12 . 25612 1 448 . 1 1 37 37 ILE HG13 H 1 1.652 0.020 . 2 . . . . . 37 ILE HG13 . 25612 1 449 . 1 1 37 37 ILE HG21 H 1 0.777 0.020 . 1 . . . . . 37 ILE HG21 . 25612 1 450 . 1 1 37 37 ILE HG22 H 1 0.777 0.020 . 1 . . . . . 37 ILE HG22 . 25612 1 451 . 1 1 37 37 ILE HG23 H 1 0.777 0.020 . 1 . . . . . 37 ILE HG23 . 25612 1 452 . 1 1 37 37 ILE HD11 H 1 0.836 0.020 . 1 . . . . . 37 ILE HD11 . 25612 1 453 . 1 1 37 37 ILE HD12 H 1 0.836 0.020 . 1 . . . . . 37 ILE HD12 . 25612 1 454 . 1 1 37 37 ILE HD13 H 1 0.836 0.020 . 1 . . . . . 37 ILE HD13 . 25612 1 455 . 1 1 37 37 ILE C C 13 173.711 0.400 . 1 . . . . . 37 ILE C . 25612 1 456 . 1 1 37 37 ILE CA C 13 60.495 0.400 . 1 . . . . . 37 ILE CA . 25612 1 457 . 1 1 37 37 ILE CB C 13 40.712 0.400 . 1 . . . . . 37 ILE CB . 25612 1 458 . 1 1 37 37 ILE CG1 C 13 27.374 0.400 . 1 . . . . . 37 ILE CG1 . 25612 1 459 . 1 1 37 37 ILE CG2 C 13 17.729 0.400 . 1 . . . . . 37 ILE CG2 . 25612 1 460 . 1 1 37 37 ILE CD1 C 13 14.514 0.400 . 1 . . . . . 37 ILE CD1 . 25612 1 461 . 1 1 37 37 ILE N N 15 118.568 0.400 . 1 . . . . . 37 ILE N . 25612 1 462 . 1 1 38 38 LYS H H 1 9.089 0.020 . 1 . . . . . 38 LYS H . 25612 1 463 . 1 1 38 38 LYS HA H 1 5.383 0.020 . 1 . . . . . 38 LYS HA . 25612 1 464 . 1 1 38 38 LYS HB2 H 1 1.757 0.020 . 2 . . . . . 38 LYS HB2 . 25612 1 465 . 1 1 38 38 LYS HB3 H 1 1.399 0.020 . 2 . . . . . 38 LYS HB3 . 25612 1 466 . 1 1 38 38 LYS HG2 H 1 1.250 0.020 . 2 . . . . . 38 LYS HG2 . 25612 1 467 . 1 1 38 38 LYS HG3 H 1 1.206 0.020 . 2 . . . . . 38 LYS HG3 . 25612 1 468 . 1 1 38 38 LYS HD2 H 1 1.450 0.020 . 2 . . . . . 38 LYS HD2 . 25612 1 469 . 1 1 38 38 LYS HD3 H 1 1.557 0.020 . 2 . . . . . 38 LYS HD3 . 25612 1 470 . 1 1 38 38 LYS HE2 H 1 2.775 0.020 . 2 . . . . . 38 LYS HE2 . 25612 1 471 . 1 1 38 38 LYS HE3 H 1 2.767 0.020 . 2 . . . . . 38 LYS HE3 . 25612 1 472 . 1 1 38 38 LYS C C 13 174.552 0.400 . 1 . . . . . 38 LYS C . 25612 1 473 . 1 1 38 38 LYS CA C 13 54.305 0.400 . 1 . . . . . 38 LYS CA . 25612 1 474 . 1 1 38 38 LYS CB C 13 34.682 0.400 . 1 . . . . . 38 LYS CB . 25612 1 475 . 1 1 38 38 LYS CG C 13 24.910 0.400 . 1 . . . . . 38 LYS CG . 25612 1 476 . 1 1 38 38 LYS CD C 13 29.279 0.400 . 1 . . . . . 38 LYS CD . 25612 1 477 . 1 1 38 38 LYS CE C 13 41.495 0.400 . 1 . . . . . 38 LYS CE . 25612 1 478 . 1 1 38 38 LYS N N 15 127.000 0.400 . 1 . . . . . 38 LYS N . 25612 1 479 . 1 1 39 39 LEU H H 1 9.124 0.020 . 1 . . . . . 39 LEU H . 25612 1 480 . 1 1 39 39 LEU HA H 1 4.966 0.020 . 1 . . . . . 39 LEU HA . 25612 1 481 . 1 1 39 39 LEU HB2 H 1 1.511 0.020 . 2 . . . . . 39 LEU HB2 . 25612 1 482 . 1 1 39 39 LEU HB3 H 1 1.524 0.020 . 2 . . . . . 39 LEU HB3 . 25612 1 483 . 1 1 39 39 LEU HG H 1 1.507 0.020 . 1 . . . . . 39 LEU HG . 25612 1 484 . 1 1 39 39 LEU HD11 H 1 0.715 0.020 . 2 . . . . . 39 LEU HD11 . 25612 1 485 . 1 1 39 39 LEU HD12 H 1 0.715 0.020 . 2 . . . . . 39 LEU HD12 . 25612 1 486 . 1 1 39 39 LEU HD13 H 1 0.715 0.020 . 2 . . . . . 39 LEU HD13 . 25612 1 487 . 1 1 39 39 LEU HD21 H 1 0.775 0.020 . 2 . . . . . 39 LEU HD21 . 25612 1 488 . 1 1 39 39 LEU HD22 H 1 0.775 0.020 . 2 . . . . . 39 LEU HD22 . 25612 1 489 . 1 1 39 39 LEU HD23 H 1 0.775 0.020 . 2 . . . . . 39 LEU HD23 . 25612 1 490 . 1 1 39 39 LEU C C 13 174.501 0.400 . 1 . . . . . 39 LEU C . 25612 1 491 . 1 1 39 39 LEU CA C 13 53.122 0.400 . 1 . . . . . 39 LEU CA . 25612 1 492 . 1 1 39 39 LEU CB C 13 44.895 0.400 . 1 . . . . . 39 LEU CB . 25612 1 493 . 1 1 39 39 LEU CG C 13 26.770 0.400 . 1 . . . . . 39 LEU CG . 25612 1 494 . 1 1 39 39 LEU CD1 C 13 25.753 0.400 . 1 . . . . . 39 LEU CD1 . 25612 1 495 . 1 1 39 39 LEU CD2 C 13 25.734 0.400 . 1 . . . . . 39 LEU CD2 . 25612 1 496 . 1 1 39 39 LEU N N 15 126.188 0.400 . 1 . . . . . 39 LEU N . 25612 1 497 . 1 1 40 40 ASP H H 1 8.039 0.020 . 1 . . . . . 40 ASP H . 25612 1 498 . 1 1 40 40 ASP HA H 1 5.035 0.020 . 1 . . . . . 40 ASP HA . 25612 1 499 . 1 1 40 40 ASP HB2 H 1 2.463 0.020 . 2 . . . . . 40 ASP HB2 . 25612 1 500 . 1 1 40 40 ASP HB3 H 1 2.670 0.020 . 2 . . . . . 40 ASP HB3 . 25612 1 501 . 1 1 40 40 ASP C C 13 174.093 0.400 . 1 . . . . . 40 ASP C . 25612 1 502 . 1 1 40 40 ASP CA C 13 52.858 0.400 . 1 . . . . . 40 ASP CA . 25612 1 503 . 1 1 40 40 ASP CB C 13 42.110 0.400 . 1 . . . . . 40 ASP CB . 25612 1 504 . 1 1 40 40 ASP N N 15 121.917 0.400 . 1 . . . . . 40 ASP N . 25612 1 505 . 1 1 41 41 ALA H H 1 8.563 0.020 . 1 . . . . . 41 ALA H . 25612 1 506 . 1 1 41 41 ALA HA H 1 4.591 0.020 . 1 . . . . . 41 ALA HA . 25612 1 507 . 1 1 41 41 ALA HB1 H 1 1.281 0.020 . 1 . . . . . 41 ALA HB1 . 25612 1 508 . 1 1 41 41 ALA HB2 H 1 1.281 0.020 . 1 . . . . . 41 ALA HB2 . 25612 1 509 . 1 1 41 41 ALA HB3 H 1 1.281 0.020 . 1 . . . . . 41 ALA HB3 . 25612 1 510 . 1 1 41 41 ALA C C 13 177.968 0.400 . 1 . . . . . 41 ALA C . 25612 1 511 . 1 1 41 41 ALA CA C 13 49.812 0.400 . 1 . . . . . 41 ALA CA . 25612 1 512 . 1 1 41 41 ALA CB C 13 21.039 0.400 . 1 . . . . . 41 ALA CB . 25612 1 513 . 1 1 41 41 ALA N N 15 125.037 0.400 . 1 . . . . . 41 ALA N . 25612 1 514 . 1 1 42 42 GLN H H 1 9.312 0.020 . 1 . . . . . 42 GLN H . 25612 1 515 . 1 1 42 42 GLN HA H 1 4.051 0.020 . 1 . . . . . 42 GLN HA . 25612 1 516 . 1 1 42 42 GLN HB2 H 1 2.153 0.020 . 2 . . . . . 42 GLN HB2 . 25612 1 517 . 1 1 42 42 GLN HB3 H 1 2.060 0.020 . 2 . . . . . 42 GLN HB3 . 25612 1 518 . 1 1 42 42 GLN HG2 H 1 2.438 0.020 . 2 . . . . . 42 GLN HG2 . 25612 1 519 . 1 1 42 42 GLN HG3 H 1 2.539 0.020 . 2 . . . . . 42 GLN HG3 . 25612 1 520 . 1 1 42 42 GLN HE21 H 1 7.740 0.020 . 2 . . . . . 42 GLN HE21 . 25612 1 521 . 1 1 42 42 GLN HE22 H 1 6.839 0.020 . 2 . . . . . 42 GLN HE22 . 25612 1 522 . 1 1 42 42 GLN C C 13 176.591 0.400 . 1 . . . . . 42 GLN C . 25612 1 523 . 1 1 42 42 GLN CA C 13 58.089 0.400 . 1 . . . . . 42 GLN CA . 25612 1 524 . 1 1 42 42 GLN CB C 13 29.814 0.400 . 1 . . . . . 42 GLN CB . 25612 1 525 . 1 1 42 42 GLN CG C 13 34.207 0.400 . 1 . . . . . 42 GLN CG . 25612 1 526 . 1 1 42 42 GLN N N 15 120.537 0.400 . 1 . . . . . 42 GLN N . 25612 1 527 . 1 1 42 42 GLN NE2 N 15 113.631 0.400 . 1 . . . . . 42 GLN NE2 . 25612 1 528 . 1 1 43 43 THR H H 1 7.093 0.020 . 1 . . . . . 43 THR H . 25612 1 529 . 1 1 43 43 THR HA H 1 4.731 0.020 . 1 . . . . . 43 THR HA . 25612 1 530 . 1 1 43 43 THR HB H 1 4.671 0.020 . 1 . . . . . 43 THR HB . 25612 1 531 . 1 1 43 43 THR HG21 H 1 1.234 0.020 . 1 . . . . . 43 THR HG21 . 25612 1 532 . 1 1 43 43 THR HG22 H 1 1.234 0.020 . 1 . . . . . 43 THR HG22 . 25612 1 533 . 1 1 43 43 THR HG23 H 1 1.234 0.020 . 1 . . . . . 43 THR HG23 . 25612 1 534 . 1 1 43 43 THR CA C 13 58.158 0.400 . 1 . . . . . 43 THR CA . 25612 1 535 . 1 1 43 43 THR CB C 13 73.558 0.400 . 1 . . . . . 43 THR CB . 25612 1 536 . 1 1 43 43 THR CG2 C 13 21.699 0.400 . 1 . . . . . 43 THR CG2 . 25612 1 537 . 1 1 43 43 THR N N 15 103.287 0.400 . 1 . . . . . 43 THR N . 25612 1 538 . 1 1 44 44 GLU HA H 1 4.260 0.020 . 1 . . . . . 44 GLU HA . 25612 1 539 . 1 1 45 45 LYS HA H 1 4.135 0.020 . 1 . . . . . 45 LYS HA . 25612 1 540 . 1 1 45 45 LYS HB2 H 1 1.874 0.020 . 2 . . . . . 45 LYS HB2 . 25612 1 541 . 1 1 45 45 LYS HB3 H 1 1.801 0.020 . 2 . . . . . 45 LYS HB3 . 25612 1 542 . 1 1 45 45 LYS HG2 H 1 1.496 0.020 . 2 . . . . . 45 LYS HG2 . 25612 1 543 . 1 1 45 45 LYS HG3 H 1 1.571 0.020 . 2 . . . . . 45 LYS HG3 . 25612 1 544 . 1 1 45 45 LYS HD2 H 1 1.723 0.020 . 1 . . . . . 45 LYS HD2 . 25612 1 545 . 1 1 45 45 LYS HD3 H 1 1.724 0.020 . 1 . . . . . 45 LYS HD3 . 25612 1 546 . 1 1 45 45 LYS HE2 H 1 3.010 0.020 . 2 . . . . . 45 LYS HE2 . 25612 1 547 . 1 1 45 45 LYS HE3 H 1 3.007 0.020 . 2 . . . . . 45 LYS HE3 . 25612 1 548 . 1 1 45 45 LYS C C 13 179.268 0.400 . 1 . . . . . 45 LYS C . 25612 1 549 . 1 1 45 45 LYS CA C 13 58.877 0.400 . 1 . . . . . 45 LYS CA . 25612 1 550 . 1 1 45 45 LYS CB C 13 31.470 0.400 . 1 . . . . . 45 LYS CB . 25612 1 551 . 1 1 45 45 LYS CG C 13 24.910 0.400 . 1 . . . . . 45 LYS CG . 25612 1 552 . 1 1 45 45 LYS CD C 13 28.503 0.400 . 1 . . . . . 45 LYS CD . 25612 1 553 . 1 1 45 45 LYS CE C 13 41.780 0.400 . 1 . . . . . 45 LYS CE . 25612 1 554 . 1 1 46 46 GLU H H 1 8.008 0.020 . 1 . . . . . 46 GLU H . 25612 1 555 . 1 1 46 46 GLU HA H 1 4.089 0.020 . 1 . . . . . 46 GLU HA . 25612 1 556 . 1 1 46 46 GLU HB2 H 1 2.128 0.020 . 2 . . . . . 46 GLU HB2 . 25612 1 557 . 1 1 46 46 GLU HB3 H 1 2.049 0.020 . 2 . . . . . 46 GLU HB3 . 25612 1 558 . 1 1 46 46 GLU HG2 H 1 2.135 0.020 . 2 . . . . . 46 GLU HG2 . 25612 1 559 . 1 1 46 46 GLU HG3 H 1 2.297 0.020 . 2 . . . . . 46 GLU HG3 . 25612 1 560 . 1 1 46 46 GLU C C 13 177.713 0.400 . 1 . . . . . 46 GLU C . 25612 1 561 . 1 1 46 46 GLU CA C 13 59.408 0.400 . 1 . . . . . 46 GLU CA . 25612 1 562 . 1 1 46 46 GLU CB C 13 30.261 0.400 . 1 . . . . . 46 GLU CB . 25612 1 563 . 1 1 46 46 GLU CG C 13 37.502 0.400 . 1 . . . . . 46 GLU CG . 25612 1 564 . 1 1 46 46 GLU N N 15 120.787 0.400 . 1 . . . . . 46 GLU N . 25612 1 565 . 1 1 47 47 ALA H H 1 8.171 0.020 . 1 . . . . . 47 ALA H . 25612 1 566 . 1 1 47 47 ALA HA H 1 3.674 0.020 . 1 . . . . . 47 ALA HA . 25612 1 567 . 1 1 47 47 ALA HB1 H 1 1.334 0.020 . 1 . . . . . 47 ALA HB1 . 25612 1 568 . 1 1 47 47 ALA HB2 H 1 1.334 0.020 . 1 . . . . . 47 ALA HB2 . 25612 1 569 . 1 1 47 47 ALA HB3 H 1 1.334 0.020 . 1 . . . . . 47 ALA HB3 . 25612 1 570 . 1 1 47 47 ALA C C 13 178.988 0.400 . 1 . . . . . 47 ALA C . 25612 1 571 . 1 1 47 47 ALA CA C 13 54.853 0.400 . 1 . . . . . 47 ALA CA . 25612 1 572 . 1 1 47 47 ALA CB C 13 17.556 0.400 . 1 . . . . . 47 ALA CB . 25612 1 573 . 1 1 47 47 ALA N N 15 121.162 0.400 . 1 . . . . . 47 ALA N . 25612 1 574 . 1 1 48 48 GLU H H 1 7.922 0.020 . 1 . . . . . 48 GLU H . 25612 1 575 . 1 1 48 48 GLU HA H 1 4.101 0.020 . 1 . . . . . 48 GLU HA . 25612 1 576 . 1 1 48 48 GLU HB2 H 1 2.198 0.020 . 2 . . . . . 48 GLU HB2 . 25612 1 577 . 1 1 48 48 GLU HB3 H 1 2.171 0.020 . 2 . . . . . 48 GLU HB3 . 25612 1 578 . 1 1 48 48 GLU HG2 H 1 2.202 0.020 . 2 . . . . . 48 GLU HG2 . 25612 1 579 . 1 1 48 48 GLU HG3 H 1 2.483 0.020 . 2 . . . . . 48 GLU HG3 . 25612 1 580 . 1 1 48 48 GLU C C 13 179.243 0.400 . 1 . . . . . 48 GLU C . 25612 1 581 . 1 1 48 48 GLU CA C 13 59.134 0.400 . 1 . . . . . 48 GLU CA . 25612 1 582 . 1 1 48 48 GLU CB C 13 29.496 0.400 . 1 . . . . . 48 GLU CB . 25612 1 583 . 1 1 48 48 GLU CG C 13 36.010 0.400 . 1 . . . . . 48 GLU CG . 25612 1 584 . 1 1 48 48 GLU N N 15 118.010 0.400 . 1 . . . . . 48 GLU N . 25612 1 585 . 1 1 49 49 LYS H H 1 7.577 0.020 . 1 . . . . . 49 LYS H . 25612 1 586 . 1 1 49 49 LYS HA H 1 4.103 0.020 . 1 . . . . . 49 LYS HA . 25612 1 587 . 1 1 49 49 LYS HB2 H 1 2.276 0.020 . 1 . . . . . 49 LYS HB2 . 25612 1 588 . 1 1 49 49 LYS HB3 H 1 2.275 0.020 . 1 . . . . . 49 LYS HB3 . 25612 1 589 . 1 1 49 49 LYS HG2 H 1 1.649 0.020 . 2 . . . . . 49 LYS HG2 . 25612 1 590 . 1 1 49 49 LYS HG3 H 1 1.890 0.020 . 2 . . . . . 49 LYS HG3 . 25612 1 591 . 1 1 49 49 LYS HD2 H 1 1.893 0.020 . 1 . . . . . 49 LYS HD2 . 25612 1 592 . 1 1 49 49 LYS HD3 H 1 1.892 0.020 . 1 . . . . . 49 LYS HD3 . 25612 1 593 . 1 1 49 49 LYS HE2 H 1 3.034 0.020 . 2 . . . . . 49 LYS HE2 . 25612 1 594 . 1 1 49 49 LYS HE3 H 1 3.037 0.020 . 2 . . . . . 49 LYS HE3 . 25612 1 595 . 1 1 49 49 LYS C C 13 180.007 0.400 . 1 . . . . . 49 LYS C . 25612 1 596 . 1 1 49 49 LYS CA C 13 59.527 0.400 . 1 . . . . . 49 LYS CA . 25612 1 597 . 1 1 49 49 LYS CB C 13 32.941 0.400 . 1 . . . . . 49 LYS CB . 25612 1 598 . 1 1 49 49 LYS CG C 13 25.668 0.400 . 1 . . . . . 49 LYS CG . 25612 1 599 . 1 1 49 49 LYS CD C 13 29.402 0.400 . 1 . . . . . 49 LYS CD . 25612 1 600 . 1 1 49 49 LYS CE C 13 41.953 0.400 . 1 . . . . . 49 LYS CE . 25612 1 601 . 1 1 49 49 LYS N N 15 119.676 0.400 . 1 . . . . . 49 LYS N . 25612 1 602 . 1 1 50 50 MET H H 1 8.646 0.020 . 1 . . . . . 50 MET H . 25612 1 603 . 1 1 50 50 MET HA H 1 3.740 0.020 . 1 . . . . . 50 MET HA . 25612 1 604 . 1 1 50 50 MET HB2 H 1 1.292 0.020 . 2 . . . . . 50 MET HB2 . 25612 1 605 . 1 1 50 50 MET HB3 H 1 1.657 0.020 . 2 . . . . . 50 MET HB3 . 25612 1 606 . 1 1 50 50 MET HG2 H 1 1.637 0.020 . 2 . . . . . 50 MET HG2 . 25612 1 607 . 1 1 50 50 MET HG3 H 1 0.485 0.020 . 2 . . . . . 50 MET HG3 . 25612 1 608 . 1 1 50 50 MET HE1 H 1 1.189 0.020 . 1 . . . . . 50 MET HE1 . 25612 1 609 . 1 1 50 50 MET HE2 H 1 1.189 0.020 . 1 . . . . . 50 MET HE2 . 25612 1 610 . 1 1 50 50 MET HE3 H 1 1.189 0.020 . 1 . . . . . 50 MET HE3 . 25612 1 611 . 1 1 50 50 MET C C 13 177.560 0.400 . 1 . . . . . 50 MET C . 25612 1 612 . 1 1 50 50 MET CA C 13 60.040 0.400 . 1 . . . . . 50 MET CA . 25612 1 613 . 1 1 50 50 MET CB C 13 32.109 0.400 . 1 . . . . . 50 MET CB . 25612 1 614 . 1 1 50 50 MET CG C 13 32.070 0.400 . 1 . . . . . 50 MET CG . 25612 1 615 . 1 1 50 50 MET CE C 13 17.361 0.400 . 1 . . . . . 50 MET CE . 25612 1 616 . 1 1 50 50 MET N N 15 122.341 0.400 . 1 . . . . . 50 MET N . 25612 1 617 . 1 1 51 51 GLU H H 1 8.330 0.020 . 1 . . . . . 51 GLU H . 25612 1 618 . 1 1 51 51 GLU HA H 1 3.559 0.020 . 1 . . . . . 51 GLU HA . 25612 1 619 . 1 1 51 51 GLU HB2 H 1 2.132 0.020 . 2 . . . . . 51 GLU HB2 . 25612 1 620 . 1 1 51 51 GLU HB3 H 1 2.066 0.020 . 2 . . . . . 51 GLU HB3 . 25612 1 621 . 1 1 51 51 GLU HG2 H 1 2.283 0.020 . 2 . . . . . 51 GLU HG2 . 25612 1 622 . 1 1 51 51 GLU HG3 H 1 2.052 0.020 . 2 . . . . . 51 GLU HG3 . 25612 1 623 . 1 1 51 51 GLU C C 13 177.739 0.400 . 1 . . . . . 51 GLU C . 25612 1 624 . 1 1 51 51 GLU CA C 13 60.131 0.400 . 1 . . . . . 51 GLU CA . 25612 1 625 . 1 1 51 51 GLU CB C 13 29.184 0.400 . 1 . . . . . 51 GLU CB . 25612 1 626 . 1 1 51 51 GLU CG C 13 36.511 0.400 . 1 . . . . . 51 GLU CG . 25612 1 627 . 1 1 51 51 GLU N N 15 119.475 0.400 . 1 . . . . . 51 GLU N . 25612 1 628 . 1 1 52 52 LYS H H 1 7.502 0.020 . 1 . . . . . 52 LYS H . 25612 1 629 . 1 1 52 52 LYS HA H 1 3.904 0.020 . 1 . . . . . 52 LYS HA . 25612 1 630 . 1 1 52 52 LYS HB2 H 1 1.962 0.020 . 2 . . . . . 52 LYS HB2 . 25612 1 631 . 1 1 52 52 LYS HB3 H 1 1.921 0.020 . 2 . . . . . 52 LYS HB3 . 25612 1 632 . 1 1 52 52 LYS HG2 H 1 1.483 0.020 . 2 . . . . . 52 LYS HG2 . 25612 1 633 . 1 1 52 52 LYS HG3 H 1 1.697 0.020 . 2 . . . . . 52 LYS HG3 . 25612 1 634 . 1 1 52 52 LYS HD2 H 1 1.704 0.020 . 1 . . . . . 52 LYS HD2 . 25612 1 635 . 1 1 52 52 LYS HD3 H 1 1.703 0.020 . 1 . . . . . 52 LYS HD3 . 25612 1 636 . 1 1 52 52 LYS HE2 H 1 2.995 0.020 . 1 . . . . . 52 LYS HE2 . 25612 1 637 . 1 1 52 52 LYS HE3 H 1 2.995 0.020 . 1 . . . . . 52 LYS HE3 . 25612 1 638 . 1 1 52 52 LYS C C 13 178.733 0.400 . 1 . . . . . 52 LYS C . 25612 1 639 . 1 1 52 52 LYS CA C 13 59.408 0.400 . 1 . . . . . 52 LYS CA . 25612 1 640 . 1 1 52 52 LYS CB C 13 32.209 0.400 . 1 . . . . . 52 LYS CB . 25612 1 641 . 1 1 52 52 LYS CG C 13 25.433 0.400 . 1 . . . . . 52 LYS CG . 25612 1 642 . 1 1 52 52 LYS CD C 13 28.780 0.400 . 1 . . . . . 52 LYS CD . 25612 1 643 . 1 1 52 52 LYS CE C 13 41.780 0.400 . 1 . . . . . 52 LYS CE . 25612 1 644 . 1 1 52 52 LYS N N 15 116.912 0.400 . 1 . . . . . 52 LYS N . 25612 1 645 . 1 1 53 53 ALA H H 1 7.822 0.020 . 1 . . . . . 53 ALA H . 25612 1 646 . 1 1 53 53 ALA HA H 1 4.243 0.020 . 1 . . . . . 53 ALA HA . 25612 1 647 . 1 1 53 53 ALA HB1 H 1 1.774 0.020 . 1 . . . . . 53 ALA HB1 . 25612 1 648 . 1 1 53 53 ALA HB2 H 1 1.774 0.020 . 1 . . . . . 53 ALA HB2 . 25612 1 649 . 1 1 53 53 ALA HB3 H 1 1.774 0.020 . 1 . . . . . 53 ALA HB3 . 25612 1 650 . 1 1 53 53 ALA C C 13 179.625 0.400 . 1 . . . . . 53 ALA C . 25612 1 651 . 1 1 53 53 ALA CA C 13 54.852 0.400 . 1 . . . . . 53 ALA CA . 25612 1 652 . 1 1 53 53 ALA CB C 13 18.305 0.400 . 1 . . . . . 53 ALA CB . 25612 1 653 . 1 1 53 53 ALA N N 15 122.586 0.400 . 1 . . . . . 53 ALA N . 25612 1 654 . 1 1 54 54 VAL H H 1 8.295 0.020 . 1 . . . . . 54 VAL H . 25612 1 655 . 1 1 54 54 VAL HA H 1 3.404 0.020 . 1 . . . . . 54 VAL HA . 25612 1 656 . 1 1 54 54 VAL HB H 1 2.180 0.020 . 1 . . . . . 54 VAL HB . 25612 1 657 . 1 1 54 54 VAL HG11 H 1 0.820 0.020 . 2 . . . . . 54 VAL HG11 . 25612 1 658 . 1 1 54 54 VAL HG12 H 1 0.820 0.020 . 2 . . . . . 54 VAL HG12 . 25612 1 659 . 1 1 54 54 VAL HG13 H 1 0.820 0.020 . 2 . . . . . 54 VAL HG13 . 25612 1 660 . 1 1 54 54 VAL HG21 H 1 0.938 0.020 . 2 . . . . . 54 VAL HG21 . 25612 1 661 . 1 1 54 54 VAL HG22 H 1 0.938 0.020 . 2 . . . . . 54 VAL HG22 . 25612 1 662 . 1 1 54 54 VAL HG23 H 1 0.938 0.020 . 2 . . . . . 54 VAL HG23 . 25612 1 663 . 1 1 54 54 VAL C C 13 178.019 0.400 . 1 . . . . . 54 VAL C . 25612 1 664 . 1 1 54 54 VAL CA C 13 66.661 0.400 . 1 . . . . . 54 VAL CA . 25612 1 665 . 1 1 54 54 VAL CB C 13 31.100 0.400 . 1 . . . . . 54 VAL CB . 25612 1 666 . 1 1 54 54 VAL CG1 C 13 21.699 0.400 . 1 . . . . . 54 VAL CG1 . 25612 1 667 . 1 1 54 54 VAL CG2 C 13 22.359 0.400 . 1 . . . . . 54 VAL CG2 . 25612 1 668 . 1 1 54 54 VAL N N 15 117.225 0.400 . 1 . . . . . 54 VAL N . 25612 1 669 . 1 1 55 55 LYS H H 1 8.038 0.020 . 1 . . . . . 55 LYS H . 25612 1 670 . 1 1 55 55 LYS HA H 1 4.103 0.020 . 1 . . . . . 55 LYS HA . 25612 1 671 . 1 1 55 55 LYS HB2 H 1 1.898 0.020 . 2 . . . . . 55 LYS HB2 . 25612 1 672 . 1 1 55 55 LYS HB3 H 1 1.819 0.020 . 2 . . . . . 55 LYS HB3 . 25612 1 673 . 1 1 55 55 LYS HG2 H 1 1.632 0.020 . 2 . . . . . 55 LYS HG2 . 25612 1 674 . 1 1 55 55 LYS HG3 H 1 1.473 0.020 . 2 . . . . . 55 LYS HG3 . 25612 1 675 . 1 1 55 55 LYS HD2 H 1 1.699 0.020 . 2 . . . . . 55 LYS HD2 . 25612 1 676 . 1 1 55 55 LYS HD3 H 1 1.729 0.020 . 2 . . . . . 55 LYS HD3 . 25612 1 677 . 1 1 55 55 LYS HE2 H 1 3.013 0.020 . 2 . . . . . 55 LYS HE2 . 25612 1 678 . 1 1 55 55 LYS HE3 H 1 2.930 0.020 . 2 . . . . . 55 LYS HE3 . 25612 1 679 . 1 1 55 55 LYS C C 13 177.484 0.400 . 1 . . . . . 55 LYS C . 25612 1 680 . 1 1 55 55 LYS CA C 13 57.868 0.400 . 1 . . . . . 55 LYS CA . 25612 1 681 . 1 1 55 55 LYS CB C 13 32.232 0.400 . 1 . . . . . 55 LYS CB . 25612 1 682 . 1 1 55 55 LYS CG C 13 26.564 0.400 . 1 . . . . . 55 LYS CG . 25612 1 683 . 1 1 55 55 LYS CD C 13 29.396 0.400 . 1 . . . . . 55 LYS CD . 25612 1 684 . 1 1 55 55 LYS CE C 13 41.780 0.400 . 1 . . . . . 55 LYS CE . 25612 1 685 . 1 1 55 55 LYS N N 15 117.350 0.400 . 1 . . . . . 55 LYS N . 25612 1 686 . 1 1 56 56 LYS H H 1 7.456 0.020 . 1 . . . . . 56 LYS H . 25612 1 687 . 1 1 56 56 LYS HA H 1 4.006 0.020 . 1 . . . . . 56 LYS HA . 25612 1 688 . 1 1 56 56 LYS HB2 H 1 1.962 0.020 . 2 . . . . . 56 LYS HB2 . 25612 1 689 . 1 1 56 56 LYS HB3 H 1 2.035 0.020 . 2 . . . . . 56 LYS HB3 . 25612 1 690 . 1 1 56 56 LYS HG2 H 1 1.340 0.020 . 2 . . . . . 56 LYS HG2 . 25612 1 691 . 1 1 56 56 LYS HG3 H 1 1.584 0.020 . 2 . . . . . 56 LYS HG3 . 25612 1 692 . 1 1 56 56 LYS HD2 H 1 1.664 0.020 . 2 . . . . . 56 LYS HD2 . 25612 1 693 . 1 1 56 56 LYS HD3 H 1 1.726 0.020 . 2 . . . . . 56 LYS HD3 . 25612 1 694 . 1 1 56 56 LYS HE2 H 1 2.944 0.020 . 2 . . . . . 56 LYS HE2 . 25612 1 695 . 1 1 56 56 LYS HE3 H 1 2.942 0.020 . 2 . . . . . 56 LYS HE3 . 25612 1 696 . 1 1 56 56 LYS C C 13 177.764 0.400 . 1 . . . . . 56 LYS C . 25612 1 697 . 1 1 56 56 LYS CA C 13 58.861 0.400 . 1 . . . . . 56 LYS CA . 25612 1 698 . 1 1 56 56 LYS CB C 13 32.220 0.400 . 1 . . . . . 56 LYS CB . 25612 1 699 . 1 1 56 56 LYS CG C 13 24.773 0.400 . 1 . . . . . 56 LYS CG . 25612 1 700 . 1 1 56 56 LYS CD C 13 29.355 0.400 . 1 . . . . . 56 LYS CD . 25612 1 701 . 1 1 56 56 LYS CE C 13 41.780 0.400 . 1 . . . . . 56 LYS CE . 25612 1 702 . 1 1 56 56 LYS N N 15 118.850 0.400 . 1 . . . . . 56 LYS N . 25612 1 703 . 1 1 57 57 VAL H H 1 7.070 0.020 . 1 . . . . . 57 VAL H . 25612 1 704 . 1 1 57 57 VAL HA H 1 4.055 0.020 . 1 . . . . . 57 VAL HA . 25612 1 705 . 1 1 57 57 VAL HB H 1 2.127 0.020 . 1 . . . . . 57 VAL HB . 25612 1 706 . 1 1 57 57 VAL HG11 H 1 0.942 0.020 . 2 . . . . . 57 VAL HG11 . 25612 1 707 . 1 1 57 57 VAL HG12 H 1 0.942 0.020 . 2 . . . . . 57 VAL HG12 . 25612 1 708 . 1 1 57 57 VAL HG13 H 1 0.942 0.020 . 2 . . . . . 57 VAL HG13 . 25612 1 709 . 1 1 57 57 VAL HG21 H 1 1.020 0.020 . 2 . . . . . 57 VAL HG21 . 25612 1 710 . 1 1 57 57 VAL HG22 H 1 1.020 0.020 . 2 . . . . . 57 VAL HG22 . 25612 1 711 . 1 1 57 57 VAL HG23 H 1 1.020 0.020 . 2 . . . . . 57 VAL HG23 . 25612 1 712 . 1 1 57 57 VAL C C 13 175.546 0.400 . 1 . . . . . 57 VAL C . 25612 1 713 . 1 1 57 57 VAL CA C 13 62.870 0.400 . 1 . . . . . 57 VAL CA . 25612 1 714 . 1 1 57 57 VAL CB C 13 32.643 0.400 . 1 . . . . . 57 VAL CB . 25612 1 715 . 1 1 57 57 VAL CG1 C 13 22.217 0.400 . 1 . . . . . 57 VAL CG1 . 25612 1 716 . 1 1 57 57 VAL CG2 C 13 20.992 0.400 . 1 . . . . . 57 VAL CG2 . 25612 1 717 . 1 1 57 57 VAL N N 15 114.412 0.400 . 1 . . . . . 57 VAL N . 25612 1 718 . 1 1 58 58 LYS H H 1 8.584 0.020 . 1 . . . . . 58 LYS H . 25612 1 719 . 1 1 58 58 LYS HA H 1 4.758 0.020 . 1 . . . . . 58 LYS HA . 25612 1 720 . 1 1 58 58 LYS HB2 H 1 1.804 0.020 . 2 . . . . . 58 LYS HB2 . 25612 1 721 . 1 1 58 58 LYS HB3 H 1 1.271 0.020 . 2 . . . . . 58 LYS HB3 . 25612 1 722 . 1 1 58 58 LYS HG2 H 1 1.117 0.020 . 2 . . . . . 58 LYS HG2 . 25612 1 723 . 1 1 58 58 LYS HG3 H 1 1.449 0.020 . 2 . . . . . 58 LYS HG3 . 25612 1 724 . 1 1 58 58 LYS HD2 H 1 1.645 0.020 . 2 . . . . . 58 LYS HD2 . 25612 1 725 . 1 1 58 58 LYS HD3 H 1 1.310 0.020 . 2 . . . . . 58 LYS HD3 . 25612 1 726 . 1 1 58 58 LYS HE2 H 1 3.066 0.020 . 2 . . . . . 58 LYS HE2 . 25612 1 727 . 1 1 58 58 LYS HE3 H 1 2.813 0.020 . 2 . . . . . 58 LYS HE3 . 25612 1 728 . 1 1 58 58 LYS CA C 13 53.392 0.400 . 1 . . . . . 58 LYS CA . 25612 1 729 . 1 1 58 58 LYS CB C 13 34.154 0.400 . 1 . . . . . 58 LYS CB . 25612 1 730 . 1 1 58 58 LYS CG C 13 25.668 0.400 . 1 . . . . . 58 LYS CG . 25612 1 731 . 1 1 58 58 LYS CD C 13 29.449 0.400 . 1 . . . . . 58 LYS CD . 25612 1 732 . 1 1 58 58 LYS CE C 13 42.515 0.400 . 1 . . . . . 58 LYS CE . 25612 1 733 . 1 1 58 58 LYS N N 15 121.959 0.400 . 1 . . . . . 58 LYS N . 25612 1 734 . 1 1 59 59 PRO HA H 1 4.664 0.020 . 1 . . . . . 59 PRO HA . 25612 1 735 . 1 1 59 59 PRO HB2 H 1 1.907 0.020 . 2 . . . . . 59 PRO HB2 . 25612 1 736 . 1 1 59 59 PRO HB3 H 1 2.418 0.020 . 2 . . . . . 59 PRO HB3 . 25612 1 737 . 1 1 59 59 PRO HG2 H 1 2.032 0.020 . 1 . . . . . 59 PRO HG2 . 25612 1 738 . 1 1 59 59 PRO HG3 H 1 2.032 0.020 . 1 . . . . . 59 PRO HG3 . 25612 1 739 . 1 1 59 59 PRO HD2 H 1 3.777 0.020 . 2 . . . . . 59 PRO HD2 . 25612 1 740 . 1 1 59 59 PRO HD3 H 1 3.360 0.020 . 2 . . . . . 59 PRO HD3 . 25612 1 741 . 1 1 59 59 PRO C C 13 177.433 0.400 . 1 . . . . . 59 PRO C . 25612 1 742 . 1 1 59 59 PRO CA C 13 64.914 0.400 . 1 . . . . . 59 PRO CA . 25612 1 743 . 1 1 59 59 PRO CB C 13 31.759 0.400 . 1 . . . . . 59 PRO CB . 25612 1 744 . 1 1 59 59 PRO CG C 13 27.007 0.400 . 1 . . . . . 59 PRO CG . 25612 1 745 . 1 1 59 59 PRO CD C 13 50.111 0.400 . 1 . . . . . 59 PRO CD . 25612 1 746 . 1 1 60 60 ASN H H 1 8.231 0.020 . 1 . . . . . 60 ASN H . 25612 1 747 . 1 1 60 60 ASN HA H 1 4.818 0.020 . 1 . . . . . 60 ASN HA . 25612 1 748 . 1 1 60 60 ASN HB2 H 1 2.992 0.020 . 2 . . . . . 60 ASN HB2 . 25612 1 749 . 1 1 60 60 ASN HB3 H 1 2.790 0.020 . 2 . . . . . 60 ASN HB3 . 25612 1 750 . 1 1 60 60 ASN HD21 H 1 7.561 0.020 . 2 . . . . . 60 ASN HD21 . 25612 1 751 . 1 1 60 60 ASN HD22 H 1 6.959 0.020 . 2 . . . . . 60 ASN HD22 . 25612 1 752 . 1 1 60 60 ASN C C 13 175.160 0.400 . 1 . . . . . 60 ASN C . 25612 1 753 . 1 1 60 60 ASN CA C 13 51.961 0.400 . 1 . . . . . 60 ASN CA . 25612 1 754 . 1 1 60 60 ASN CB C 13 36.979 0.400 . 1 . . . . . 60 ASN CB . 25612 1 755 . 1 1 60 60 ASN N N 15 113.498 0.400 . 1 . . . . . 60 ASN N . 25612 1 756 . 1 1 60 60 ASN ND2 N 15 111.645 0.400 . 1 . . . . . 60 ASN ND2 . 25612 1 757 . 1 1 61 61 ALA H H 1 7.783 0.020 . 1 . . . . . 61 ALA H . 25612 1 758 . 1 1 61 61 ALA HA H 1 4.129 0.020 . 1 . . . . . 61 ALA HA . 25612 1 759 . 1 1 61 61 ALA HB1 H 1 1.273 0.020 . 1 . . . . . 61 ALA HB1 . 25612 1 760 . 1 1 61 61 ALA HB2 H 1 1.273 0.020 . 1 . . . . . 61 ALA HB2 . 25612 1 761 . 1 1 61 61 ALA HB3 H 1 1.273 0.020 . 1 . . . . . 61 ALA HB3 . 25612 1 762 . 1 1 61 61 ALA C C 13 176.974 0.400 . 1 . . . . . 61 ALA C . 25612 1 763 . 1 1 61 61 ALA CA C 13 52.946 0.400 . 1 . . . . . 61 ALA CA . 25612 1 764 . 1 1 61 61 ALA CB C 13 18.945 0.400 . 1 . . . . . 61 ALA CB . 25612 1 765 . 1 1 61 61 ALA N N 15 121.662 0.400 . 1 . . . . . 61 ALA N . 25612 1 766 . 1 1 62 62 THR H H 1 9.311 0.020 . 1 . . . . . 62 THR H . 25612 1 767 . 1 1 62 62 THR HA H 1 4.306 0.020 . 1 . . . . . 62 THR HA . 25612 1 768 . 1 1 62 62 THR HB H 1 4.089 0.020 . 1 . . . . . 62 THR HB . 25612 1 769 . 1 1 62 62 THR HG21 H 1 1.136 0.020 . 1 . . . . . 62 THR HG21 . 25612 1 770 . 1 1 62 62 THR HG22 H 1 1.136 0.020 . 1 . . . . . 62 THR HG22 . 25612 1 771 . 1 1 62 62 THR HG23 H 1 1.136 0.020 . 1 . . . . . 62 THR HG23 . 25612 1 772 . 1 1 62 62 THR C C 13 172.946 0.400 . 1 . . . . . 62 THR C . 25612 1 773 . 1 1 62 62 THR CA C 13 62.097 0.400 . 1 . . . . . 62 THR CA . 25612 1 774 . 1 1 62 62 THR CB C 13 69.363 0.400 . 1 . . . . . 62 THR CB . 25612 1 775 . 1 1 62 62 THR CG2 C 13 21.237 0.400 . 1 . . . . . 62 THR CG2 . 25612 1 776 . 1 1 62 62 THR N N 15 120.549 0.400 . 1 . . . . . 62 THR N . 25612 1 777 . 1 1 63 63 ILE H H 1 8.580 0.020 . 1 . . . . . 63 ILE H . 25612 1 778 . 1 1 63 63 ILE HA H 1 4.664 0.020 . 1 . . . . . 63 ILE HA . 25612 1 779 . 1 1 63 63 ILE HB H 1 1.772 0.020 . 1 . . . . . 63 ILE HB . 25612 1 780 . 1 1 63 63 ILE HG12 H 1 1.473 0.020 . 2 . . . . . 63 ILE HG12 . 25612 1 781 . 1 1 63 63 ILE HG13 H 1 0.965 0.020 . 2 . . . . . 63 ILE HG13 . 25612 1 782 . 1 1 63 63 ILE HG21 H 1 0.708 0.020 . 1 . . . . . 63 ILE HG21 . 25612 1 783 . 1 1 63 63 ILE HG22 H 1 0.708 0.020 . 1 . . . . . 63 ILE HG22 . 25612 1 784 . 1 1 63 63 ILE HG23 H 1 0.708 0.020 . 1 . . . . . 63 ILE HG23 . 25612 1 785 . 1 1 63 63 ILE HD11 H 1 0.827 0.020 . 1 . . . . . 63 ILE HD11 . 25612 1 786 . 1 1 63 63 ILE HD12 H 1 0.827 0.020 . 1 . . . . . 63 ILE HD12 . 25612 1 787 . 1 1 63 63 ILE HD13 H 1 0.827 0.020 . 1 . . . . . 63 ILE HD13 . 25612 1 788 . 1 1 63 63 ILE C C 13 175.342 0.400 . 1 . . . . . 63 ILE C . 25612 1 789 . 1 1 63 63 ILE CA C 13 60.127 0.400 . 1 . . . . . 63 ILE CA . 25612 1 790 . 1 1 63 63 ILE CB C 13 39.375 0.400 . 1 . . . . . 63 ILE CB . 25612 1 791 . 1 1 63 63 ILE CG1 C 13 27.960 0.400 . 1 . . . . . 63 ILE CG1 . 25612 1 792 . 1 1 63 63 ILE CG2 C 13 18.201 0.400 . 1 . . . . . 63 ILE CG2 . 25612 1 793 . 1 1 63 63 ILE CD1 C 13 14.467 0.400 . 1 . . . . . 63 ILE CD1 . 25612 1 794 . 1 1 63 63 ILE N N 15 126.975 0.400 . 1 . . . . . 63 ILE N . 25612 1 795 . 1 1 64 64 ARG H H 1 9.046 0.020 . 1 . . . . . 64 ARG H . 25612 1 796 . 1 1 64 64 ARG HA H 1 4.654 0.020 . 1 . . . . . 64 ARG HA . 25612 1 797 . 1 1 64 64 ARG HB2 H 1 1.792 0.020 . 2 . . . . . 64 ARG HB2 . 25612 1 798 . 1 1 64 64 ARG HB3 H 1 1.684 0.020 . 2 . . . . . 64 ARG HB3 . 25612 1 799 . 1 1 64 64 ARG HG2 H 1 1.528 0.020 . 2 . . . . . 64 ARG HG2 . 25612 1 800 . 1 1 64 64 ARG HG3 H 1 1.598 0.020 . 2 . . . . . 64 ARG HG3 . 25612 1 801 . 1 1 64 64 ARG HD2 H 1 3.183 0.020 . 2 . . . . . 64 ARG HD2 . 25612 1 802 . 1 1 64 64 ARG HD3 H 1 3.078 0.020 . 2 . . . . . 64 ARG HD3 . 25612 1 803 . 1 1 64 64 ARG C C 13 175.087 0.400 . 1 . . . . . 64 ARG C . 25612 1 804 . 1 1 64 64 ARG CA C 13 55.260 0.400 . 1 . . . . . 64 ARG CA . 25612 1 805 . 1 1 64 64 ARG CB C 13 31.591 0.400 . 1 . . . . . 64 ARG CB . 25612 1 806 . 1 1 64 64 ARG CG C 13 27.310 0.400 . 1 . . . . . 64 ARG CG . 25612 1 807 . 1 1 64 64 ARG CD C 13 43.100 0.400 . 1 . . . . . 64 ARG CD . 25612 1 808 . 1 1 64 64 ARG N N 15 128.037 0.400 . 1 . . . . . 64 ARG N . 25612 1 809 . 1 1 65 65 LYS H H 1 8.818 0.020 . 1 . . . . . 65 LYS H . 25612 1 810 . 1 1 65 65 LYS HA H 1 5.253 0.020 . 1 . . . . . 65 LYS HA . 25612 1 811 . 1 1 65 65 LYS HB2 H 1 1.595 0.020 . 2 . . . . . 65 LYS HB2 . 25612 1 812 . 1 1 65 65 LYS HB3 H 1 1.716 0.020 . 2 . . . . . 65 LYS HB3 . 25612 1 813 . 1 1 65 65 LYS HG2 H 1 1.242 0.020 . 2 . . . . . 65 LYS HG2 . 25612 1 814 . 1 1 65 65 LYS HG3 H 1 1.324 0.020 . 2 . . . . . 65 LYS HG3 . 25612 1 815 . 1 1 65 65 LYS HD2 H 1 1.568 0.020 . 2 . . . . . 65 LYS HD2 . 25612 1 816 . 1 1 65 65 LYS HD3 H 1 1.565 0.020 . 2 . . . . . 65 LYS HD3 . 25612 1 817 . 1 1 65 65 LYS HE2 H 1 2.828 0.020 . 1 . . . . . 65 LYS HE2 . 25612 1 818 . 1 1 65 65 LYS HE3 H 1 2.828 0.020 . 1 . . . . . 65 LYS HE3 . 25612 1 819 . 1 1 65 65 LYS C C 13 176.209 0.400 . 1 . . . . . 65 LYS C . 25612 1 820 . 1 1 65 65 LYS CA C 13 55.138 0.400 . 1 . . . . . 65 LYS CA . 25612 1 821 . 1 1 65 65 LYS CB C 13 34.064 0.400 . 1 . . . . . 65 LYS CB . 25612 1 822 . 1 1 65 65 LYS CG C 13 24.631 0.400 . 1 . . . . . 65 LYS CG . 25612 1 823 . 1 1 65 65 LYS CD C 13 28.780 0.400 . 1 . . . . . 65 LYS CD . 25612 1 824 . 1 1 65 65 LYS CE C 13 41.588 0.400 . 1 . . . . . 65 LYS CE . 25612 1 825 . 1 1 65 65 LYS N N 15 125.975 0.400 . 1 . . . . . 65 LYS N . 25612 1 826 . 1 1 66 66 THR H H 1 8.635 0.020 . 1 . . . . . 66 THR H . 25612 1 827 . 1 1 66 66 THR HA H 1 4.527 0.020 . 1 . . . . . 66 THR HA . 25612 1 828 . 1 1 66 66 THR HB H 1 4.224 0.020 . 1 . . . . . 66 THR HB . 25612 1 829 . 1 1 66 66 THR HG21 H 1 1.162 0.020 . 1 . . . . . 66 THR HG21 . 25612 1 830 . 1 1 66 66 THR HG22 H 1 1.162 0.020 . 1 . . . . . 66 THR HG22 . 25612 1 831 . 1 1 66 66 THR HG23 H 1 1.162 0.020 . 1 . . . . . 66 THR HG23 . 25612 1 832 . 1 1 66 66 THR C C 13 173.915 0.400 . 1 . . . . . 66 THR C . 25612 1 833 . 1 1 66 66 THR CA C 13 61.368 0.400 . 1 . . . . . 66 THR CA . 25612 1 834 . 1 1 66 66 THR CB C 13 70.613 0.400 . 1 . . . . . 66 THR CB . 25612 1 835 . 1 1 66 66 THR CG2 C 13 21.746 0.400 . 1 . . . . . 66 THR CG2 . 25612 1 836 . 1 1 66 66 THR N N 15 117.100 0.400 . 1 . . . . . 66 THR N . 25612 1 837 . 1 1 67 67 GLY H H 1 8.612 0.020 . 1 . . . . . 67 GLY H . 25612 1 838 . 1 1 67 67 GLY HA2 H 1 3.939 0.020 . 2 . . . . . 67 GLY HA2 . 25612 1 839 . 1 1 67 67 GLY HA3 H 1 4.112 0.020 . 2 . . . . . 67 GLY HA3 . 25612 1 840 . 1 1 67 67 GLY C C 13 174.399 0.400 . 1 . . . . . 67 GLY C . 25612 1 841 . 1 1 67 67 GLY CA C 13 44.964 0.400 . 1 . . . . . 67 GLY CA . 25612 1 842 . 1 1 67 67 GLY N N 15 110.581 0.400 . 1 . . . . . 67 GLY N . 25612 1 843 . 1 1 68 68 GLY H H 1 8.421 0.020 . 1 . . . . . 68 GLY H . 25612 1 844 . 1 1 68 68 GLY HA2 H 1 3.946 0.020 . 2 . . . . . 68 GLY HA2 . 25612 1 845 . 1 1 68 68 GLY HA3 H 1 4.037 0.020 . 2 . . . . . 68 GLY HA3 . 25612 1 846 . 1 1 68 68 GLY C C 13 174.040 0.400 . 1 . . . . . 68 GLY C . 25612 1 847 . 1 1 68 68 GLY CA C 13 44.874 0.400 . 1 . . . . . 68 GLY CA . 25612 1 848 . 1 1 68 68 GLY N N 15 108.425 0.400 . 1 . . . . . 68 GLY N . 25612 1 849 . 1 1 69 69 SER H H 1 8.501 0.020 . 1 . . . . . 69 SER H . 25612 1 850 . 1 1 69 69 SER HA H 1 4.430 0.020 . 1 . . . . . 69 SER HA . 25612 1 851 . 1 1 69 69 SER HB2 H 1 3.837 0.020 . 2 . . . . . 69 SER HB2 . 25612 1 852 . 1 1 69 69 SER HB3 H 1 3.871 0.020 . 2 . . . . . 69 SER HB3 . 25612 1 853 . 1 1 69 69 SER C C 13 174.530 0.400 . 1 . . . . . 69 SER C . 25612 1 854 . 1 1 69 69 SER CA C 13 58.442 0.400 . 1 . . . . . 69 SER CA . 25612 1 855 . 1 1 69 69 SER CB C 13 63.695 0.400 . 1 . . . . . 69 SER CB . 25612 1 856 . 1 1 69 69 SER N N 15 116.081 0.400 . 1 . . . . . 69 SER N . 25612 1 857 . 1 1 70 70 LEU H H 1 8.407 0.020 . 1 . . . . . 70 LEU H . 25612 1 858 . 1 1 70 70 LEU HA H 1 4.316 0.020 . 1 . . . . . 70 LEU HA . 25612 1 859 . 1 1 70 70 LEU HB2 H 1 1.524 0.020 . 2 . . . . . 70 LEU HB2 . 25612 1 860 . 1 1 70 70 LEU HB3 H 1 1.590 0.020 . 2 . . . . . 70 LEU HB3 . 25612 1 861 . 1 1 70 70 LEU HG H 1 1.583 0.020 . 1 . . . . . 70 LEU HG . 25612 1 862 . 1 1 70 70 LEU HD11 H 1 0.888 0.020 . 2 . . . . . 70 LEU HD11 . 25612 1 863 . 1 1 70 70 LEU HD12 H 1 0.888 0.020 . 2 . . . . . 70 LEU HD12 . 25612 1 864 . 1 1 70 70 LEU HD13 H 1 0.888 0.020 . 2 . . . . . 70 LEU HD13 . 25612 1 865 . 1 1 70 70 LEU HD21 H 1 0.820 0.020 . 2 . . . . . 70 LEU HD21 . 25612 1 866 . 1 1 70 70 LEU HD22 H 1 0.820 0.020 . 2 . . . . . 70 LEU HD22 . 25612 1 867 . 1 1 70 70 LEU HD23 H 1 0.820 0.020 . 2 . . . . . 70 LEU HD23 . 25612 1 868 . 1 1 70 70 LEU C C 13 177.101 0.400 . 1 . . . . . 70 LEU C . 25612 1 869 . 1 1 70 70 LEU CA C 13 54.991 0.400 . 1 . . . . . 70 LEU CA . 25612 1 870 . 1 1 70 70 LEU CB C 13 41.971 0.400 . 1 . . . . . 70 LEU CB . 25612 1 871 . 1 1 70 70 LEU CG C 13 26.770 0.400 . 1 . . . . . 70 LEU CG . 25612 1 872 . 1 1 70 70 LEU CD1 C 13 24.614 0.400 . 1 . . . . . 70 LEU CD1 . 25612 1 873 . 1 1 70 70 LEU CD2 C 13 23.160 0.400 . 1 . . . . . 70 LEU CD2 . 25612 1 874 . 1 1 70 70 LEU N N 15 124.037 0.400 . 1 . . . . . 70 LEU N . 25612 1 875 . 1 1 71 71 GLU H H 1 8.304 0.020 . 1 . . . . . 71 GLU H . 25612 1 876 . 1 1 71 71 GLU HA H 1 4.163 0.020 . 1 . . . . . 71 GLU HA . 25612 1 877 . 1 1 71 71 GLU HB2 H 1 1.888 0.020 . 2 . . . . . 71 GLU HB2 . 25612 1 878 . 1 1 71 71 GLU HB3 H 1 1.815 0.020 . 2 . . . . . 71 GLU HB3 . 25612 1 879 . 1 1 71 71 GLU HG2 H 1 2.167 0.020 . 2 . . . . . 71 GLU HG2 . 25612 1 880 . 1 1 71 71 GLU HG3 H 1 2.098 0.020 . 2 . . . . . 71 GLU HG3 . 25612 1 881 . 1 1 71 71 GLU CA C 13 56.554 0.400 . 1 . . . . . 71 GLU CA . 25612 1 882 . 1 1 71 71 GLU CB C 13 29.799 0.400 . 1 . . . . . 71 GLU CB . 25612 1 883 . 1 1 71 71 GLU CG C 13 36.010 0.400 . 1 . . . . . 71 GLU CG . 25612 1 884 . 1 1 71 71 GLU N N 15 121.072 0.400 . 1 . . . . . 71 GLU N . 25612 1 stop_ save_