################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30680 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _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 '3D HNCACB' . . . 30680 1 2 '3D CBCA(CO)NH' . . . 30680 1 3 '3D 1H-15N TOCSY' . . . 30680 1 4 '3D 1H-15N NOESY' . . . 30680 1 5 '3D 1H-13C NOESY' . . . 30680 1 6 '2D 1H-15N HSQC' . . . 30680 1 7 '3D CBCA(CO)NH' . . . 30680 1 8 '3D HNCACB' . . . 30680 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 ALA HA H 1 4.249 0.020 . 1 . . . . A 1 ALA HA . 30680 1 2 . 1 . 1 1 1 ALA HB1 H 1 1.330 0.020 . 1 . . . . A 1 ALA HB1 . 30680 1 3 . 1 . 1 1 1 ALA HB2 H 1 1.330 0.020 . 1 . . . . A 1 ALA HB2 . 30680 1 4 . 1 . 1 1 1 ALA HB3 H 1 1.330 0.020 . 1 . . . . A 1 ALA HB3 . 30680 1 5 . 1 . 1 1 1 ALA CB C 13 18.564 0.3 . 1 . . . . A 1 ALA CB . 30680 1 6 . 1 . 1 4 4 GLY H H 1 8.692 0.020 . 1 . . . . A 4 GLY H . 30680 1 7 . 1 . 1 4 4 GLY HA2 H 1 4.031 0.020 . 1 . . . . A 4 GLY HA2 . 30680 1 8 . 1 . 1 4 4 GLY HA3 H 1 4.031 0.020 . 1 . . . . A 4 GLY HA3 . 30680 1 9 . 1 . 1 4 4 GLY N N 15 111.227 0.3 . 1 . . . . A 4 GLY N . 30680 1 10 . 1 . 1 5 5 LYS H H 1 8.758 0.020 . 1 . . . . A 5 LYS H . 30680 1 11 . 1 . 1 5 5 LYS HA H 1 4.335 0.020 . 1 . . . . A 5 LYS HA . 30680 1 12 . 1 . 1 5 5 LYS HB2 H 1 1.820 0.020 . 1 . . . . A 5 LYS HB2 . 30680 1 13 . 1 . 1 5 5 LYS HB3 H 1 1.820 0.020 . 1 . . . . A 5 LYS HB3 . 30680 1 14 . 1 . 1 5 5 LYS HG2 H 1 1.420 0.020 . 1 . . . . A 5 LYS HG2 . 30680 1 15 . 1 . 1 5 5 LYS HG3 H 1 1.420 0.020 . 1 . . . . A 5 LYS HG3 . 30680 1 16 . 1 . 1 5 5 LYS CA C 13 56.113 0.3 . 1 . . . . A 5 LYS CA . 30680 1 17 . 1 . 1 5 5 LYS CB C 13 33.357 0.3 . 1 . . . . A 5 LYS CB . 30680 1 18 . 1 . 1 5 5 LYS N N 15 121.037 0.3 . 1 . . . . A 5 LYS N . 30680 1 19 . 1 . 1 6 6 SER H H 1 8.645 0.020 . 1 . . . . A 6 SER H . 30680 1 20 . 1 . 1 6 6 SER HA H 1 4.372 0.020 . 1 . . . . A 6 SER HA . 30680 1 21 . 1 . 1 6 6 SER HB2 H 1 3.822 0.020 . 1 . . . . A 6 SER HB2 . 30680 1 22 . 1 . 1 6 6 SER HB3 H 1 3.822 0.020 . 1 . . . . A 6 SER HB3 . 30680 1 23 . 1 . 1 6 6 SER CA C 13 58.279 0.3 . 1 . . . . A 6 SER CA . 30680 1 24 . 1 . 1 6 6 SER CB C 13 63.823 0.3 . 1 . . . . A 6 SER CB . 30680 1 25 . 1 . 1 6 6 SER N N 15 118.325 0.3 . 1 . . . . A 6 SER N . 30680 1 26 . 1 . 1 7 7 LYS H H 1 8.609 0.020 . 1 . . . . A 7 LYS H . 30680 1 27 . 1 . 1 7 7 LYS HA H 1 4.345 0.020 . 1 . . . . A 7 LYS HA . 30680 1 28 . 1 . 1 7 7 LYS HB2 H 1 1.791 0.020 . 1 . . . . A 7 LYS HB2 . 30680 1 29 . 1 . 1 7 7 LYS HB3 H 1 1.791 0.020 . 1 . . . . A 7 LYS HB3 . 30680 1 30 . 1 . 1 7 7 LYS HG2 H 1 1.700 0.020 . 1 . . . . A 7 LYS HG2 . 30680 1 31 . 1 . 1 7 7 LYS HG3 H 1 1.700 0.020 . 1 . . . . A 7 LYS HG3 . 30680 1 32 . 1 . 1 7 7 LYS CA C 13 56.594 0.3 . 1 . . . . A 7 LYS CA . 30680 1 33 . 1 . 1 7 7 LYS CB C 13 32.876 0.3 . 1 . . . . A 7 LYS CB . 30680 1 34 . 1 . 1 7 7 LYS CG C 13 28.886 0.3 . 1 . . . . A 7 LYS CG . 30680 1 35 . 1 . 1 7 7 LYS N N 15 124.270 0.3 . 1 . . . . A 7 LYS N . 30680 1 36 . 1 . 1 8 8 GLU H H 1 8.448 0.020 . 1 . . . . A 8 GLU H . 30680 1 37 . 1 . 1 8 8 GLU HA H 1 4.342 0.020 . 1 . . . . A 8 GLU HA . 30680 1 38 . 1 . 1 8 8 GLU HB2 H 1 1.983 0.020 . 1 . . . . A 8 GLU HB2 . 30680 1 39 . 1 . 1 8 8 GLU HB3 H 1 1.983 0.020 . 1 . . . . A 8 GLU HB3 . 30680 1 40 . 1 . 1 8 8 GLU HG2 H 1 2.245 0.020 . 2 . . . . A 8 GLU HG2 . 30680 1 41 . 1 . 1 8 8 GLU HG3 H 1 2.189 0.020 . 2 . . . . A 8 GLU HG3 . 30680 1 42 . 1 . 1 8 8 GLU CA C 13 56.267 0.3 . 1 . . . . A 8 GLU CA . 30680 1 43 . 1 . 1 8 8 GLU CB C 13 30.178 0.3 . 1 . . . . A 8 GLU CB . 30680 1 44 . 1 . 1 8 8 GLU CG C 13 35.811 0.3 . 1 . . . . A 8 GLU CG . 30680 1 45 . 1 . 1 8 8 GLU N N 15 123.213 0.3 . 1 . . . . A 8 GLU N . 30680 1 46 . 1 . 1 9 9 ILE H H 1 8.435 0.020 . 1 . . . . A 9 ILE H . 30680 1 47 . 1 . 1 9 9 ILE HA H 1 4.083 0.020 . 1 . . . . A 9 ILE HA . 30680 1 48 . 1 . 1 9 9 ILE HB H 1 1.912 0.020 . 1 . . . . A 9 ILE HB . 30680 1 49 . 1 . 1 9 9 ILE HG21 H 1 0.889 0.020 . 1 . . . . A 9 ILE HG21 . 30680 1 50 . 1 . 1 9 9 ILE HG22 H 1 0.889 0.020 . 1 . . . . A 9 ILE HG22 . 30680 1 51 . 1 . 1 9 9 ILE HG23 H 1 0.889 0.020 . 1 . . . . A 9 ILE HG23 . 30680 1 52 . 1 . 1 9 9 ILE HD11 H 1 0.814 0.020 . 1 . . . . A 9 ILE HD11 . 30680 1 53 . 1 . 1 9 9 ILE HD12 H 1 0.814 0.020 . 1 . . . . A 9 ILE HD12 . 30680 1 54 . 1 . 1 9 9 ILE HD13 H 1 0.814 0.020 . 1 . . . . A 9 ILE HD13 . 30680 1 55 . 1 . 1 9 9 ILE CG2 C 13 17.424 0.3 . 1 . . . . A 9 ILE CG2 . 30680 1 56 . 1 . 1 9 9 ILE CD1 C 13 12.530 0.3 . 1 . . . . A 9 ILE CD1 . 30680 1 57 . 1 . 1 9 9 ILE N N 15 125.625 0.3 . 1 . . . . A 9 ILE N . 30680 1 58 . 1 . 1 10 10 SER H H 1 8.504 0.020 . 1 . . . . A 10 SER H . 30680 1 59 . 1 . 1 10 10 SER HA H 1 4.428 0.020 . 1 . . . . A 10 SER HA . 30680 1 60 . 1 . 1 10 10 SER HB2 H 1 3.872 0.020 . 1 . . . . A 10 SER HB2 . 30680 1 61 . 1 . 1 10 10 SER HB3 H 1 3.872 0.020 . 1 . . . . A 10 SER HB3 . 30680 1 62 . 1 . 1 10 10 SER CA C 13 57.694 0.3 . 1 . . . . A 10 SER CA . 30680 1 63 . 1 . 1 10 10 SER CB C 13 64.417 0.3 . 1 . . . . A 10 SER CB . 30680 1 64 . 1 . 1 10 10 SER N N 15 124.248 0.3 . 1 . . . . A 10 SER N . 30680 1 65 . 1 . 1 11 11 GLN H H 1 9.095 0.020 . 1 . . . . A 11 GLN H . 30680 1 66 . 1 . 1 11 11 GLN HA H 1 3.964 0.020 . 1 . . . . A 11 GLN HA . 30680 1 67 . 1 . 1 11 11 GLN HB2 H 1 2.089 0.020 . 1 . . . . A 11 GLN HB2 . 30680 1 68 . 1 . 1 11 11 GLN HB3 H 1 2.089 0.020 . 1 . . . . A 11 GLN HB3 . 30680 1 69 . 1 . 1 11 11 GLN HG2 H 1 2.457 0.020 . 2 . . . . A 11 GLN HG2 . 30680 1 70 . 1 . 1 11 11 GLN HG3 H 1 2.439 0.020 . 2 . . . . A 11 GLN HG3 . 30680 1 71 . 1 . 1 11 11 GLN HE21 H 1 7.712 0.020 . 1 . . . . A 11 GLN HE21 . 30680 1 72 . 1 . 1 11 11 GLN HE22 H 1 6.983 0.020 . 1 . . . . A 11 GLN HE22 . 30680 1 73 . 1 . 1 11 11 GLN CA C 13 59.044 0.3 . 1 . . . . A 11 GLN CA . 30680 1 74 . 1 . 1 11 11 GLN CB C 13 28.388 0.3 . 1 . . . . A 11 GLN CB . 30680 1 75 . 1 . 1 11 11 GLN CG C 13 33.469 0.3 . 1 . . . . A 11 GLN CG . 30680 1 76 . 1 . 1 11 11 GLN N N 15 121.388 0.3 . 1 . . . . A 11 GLN N . 30680 1 77 . 1 . 1 11 11 GLN NE2 N 15 113.024 0.3 . 1 . . . . A 11 GLN NE2 . 30680 1 78 . 1 . 1 12 12 ASP H H 1 8.526 0.020 . 1 . . . . A 12 ASP H . 30680 1 79 . 1 . 1 12 12 ASP HA H 1 4.525 0.020 . 1 . . . . A 12 ASP HA . 30680 1 80 . 1 . 1 12 12 ASP HB2 H 1 2.595 0.020 . 2 . . . . A 12 ASP HB2 . 30680 1 81 . 1 . 1 12 12 ASP HB3 H 1 2.555 0.020 . 2 . . . . A 12 ASP HB3 . 30680 1 82 . 1 . 1 12 12 ASP CA C 13 57.092 0.3 . 1 . . . . A 12 ASP CA . 30680 1 83 . 1 . 1 12 12 ASP CB C 13 41.411 0.3 . 1 . . . . A 12 ASP CB . 30680 1 84 . 1 . 1 12 12 ASP N N 15 118.523 0.3 . 1 . . . . A 12 ASP N . 30680 1 85 . 1 . 1 13 13 LEU H H 1 7.756 0.020 . 1 . . . . A 13 LEU H . 30680 1 86 . 1 . 1 13 13 LEU HA H 1 4.077 0.020 . 1 . . . . A 13 LEU HA . 30680 1 87 . 1 . 1 13 13 LEU HB2 H 1 1.696 0.020 . 1 . . . . A 13 LEU HB2 . 30680 1 88 . 1 . 1 13 13 LEU HB3 H 1 1.696 0.020 . 1 . . . . A 13 LEU HB3 . 30680 1 89 . 1 . 1 13 13 LEU HG H 1 1.555 0.020 . 1 . . . . A 13 LEU HG . 30680 1 90 . 1 . 1 13 13 LEU HD11 H 1 0.924 0.020 . 2 . . . . A 13 LEU HD11 . 30680 1 91 . 1 . 1 13 13 LEU HD12 H 1 0.924 0.020 . 2 . . . . A 13 LEU HD12 . 30680 1 92 . 1 . 1 13 13 LEU HD13 H 1 0.924 0.020 . 2 . . . . A 13 LEU HD13 . 30680 1 93 . 1 . 1 13 13 LEU HD21 H 1 0.981 0.020 . 2 . . . . A 13 LEU HD21 . 30680 1 94 . 1 . 1 13 13 LEU HD22 H 1 0.981 0.020 . 2 . . . . A 13 LEU HD22 . 30680 1 95 . 1 . 1 13 13 LEU HD23 H 1 0.981 0.020 . 2 . . . . A 13 LEU HD23 . 30680 1 96 . 1 . 1 13 13 LEU CA C 13 56.967 0.3 . 1 . . . . A 13 LEU CA . 30680 1 97 . 1 . 1 13 13 LEU CB C 13 42.065 0.3 . 1 . . . . A 13 LEU CB . 30680 1 98 . 1 . 1 13 13 LEU CD1 C 13 25.033 0.3 . 1 . . . . A 13 LEU CD1 . 30680 1 99 . 1 . 1 13 13 LEU CD2 C 13 24.180 0.3 . 1 . . . . A 13 LEU CD2 . 30680 1 100 . 1 . 1 13 13 LEU N N 15 122.336 0.3 . 1 . . . . A 13 LEU N . 30680 1 101 . 1 . 1 14 14 ARG H H 1 8.425 0.020 . 1 . . . . A 14 ARG H . 30680 1 102 . 1 . 1 14 14 ARG HA H 1 3.698 0.020 . 1 . . . . A 14 ARG HA . 30680 1 103 . 1 . 1 14 14 ARG HB2 H 1 1.911 0.020 . 1 . . . . A 14 ARG HB2 . 30680 1 104 . 1 . 1 14 14 ARG HB3 H 1 1.911 0.020 . 1 . . . . A 14 ARG HB3 . 30680 1 105 . 1 . 1 14 14 ARG HG2 H 1 1.801 0.020 . 1 . . . . A 14 ARG HG2 . 30680 1 106 . 1 . 1 14 14 ARG HG3 H 1 1.801 0.020 . 1 . . . . A 14 ARG HG3 . 30680 1 107 . 1 . 1 14 14 ARG HD2 H 1 3.119 0.020 . 1 . . . . A 14 ARG HD2 . 30680 1 108 . 1 . 1 14 14 ARG HD3 H 1 3.119 0.020 . 1 . . . . A 14 ARG HD3 . 30680 1 109 . 1 . 1 14 14 ARG CA C 13 60.617 0.3 . 1 . . . . A 14 ARG CA . 30680 1 110 . 1 . 1 14 14 ARG CB C 13 29.902 0.3 . 1 . . . . A 14 ARG CB . 30680 1 111 . 1 . 1 14 14 ARG CD C 13 41.879 0.3 . 1 . . . . A 14 ARG CD . 30680 1 112 . 1 . 1 14 14 ARG N N 15 119.375 0.3 . 1 . . . . A 14 ARG N . 30680 1 113 . 1 . 1 15 15 LYS H H 1 7.762 0.020 . 1 . . . . A 15 LYS H . 30680 1 114 . 1 . 1 15 15 LYS HA H 1 3.929 0.020 . 1 . . . . A 15 LYS HA . 30680 1 115 . 1 . 1 15 15 LYS HB2 H 1 1.824 0.020 . 1 . . . . A 15 LYS HB2 . 30680 1 116 . 1 . 1 15 15 LYS HB3 H 1 1.824 0.020 . 1 . . . . A 15 LYS HB3 . 30680 1 117 . 1 . 1 15 15 LYS HD2 H 1 1.280 0.020 . 1 . . . . A 15 LYS HD2 . 30680 1 118 . 1 . 1 15 15 LYS HD3 H 1 1.280 0.020 . 1 . . . . A 15 LYS HD3 . 30680 1 119 . 1 . 1 15 15 LYS HE2 H 1 3.149 0.020 . 1 . . . . A 15 LYS HE2 . 30680 1 120 . 1 . 1 15 15 LYS HE3 H 1 3.149 0.020 . 1 . . . . A 15 LYS HE3 . 30680 1 121 . 1 . 1 15 15 LYS CA C 13 59.686 0.3 . 1 . . . . A 15 LYS CA . 30680 1 122 . 1 . 1 15 15 LYS CB C 13 31.674 0.3 . 1 . . . . A 15 LYS CB . 30680 1 123 . 1 . 1 15 15 LYS N N 15 117.838 0.3 . 1 . . . . A 15 LYS N . 30680 1 124 . 1 . 1 16 16 ARG H H 1 7.687 0.020 . 1 . . . . A 16 ARG H . 30680 1 125 . 1 . 1 16 16 ARG HA H 1 4.063 0.020 . 1 . . . . A 16 ARG HA . 30680 1 126 . 1 . 1 16 16 ARG HB2 H 1 1.987 0.020 . 1 . . . . A 16 ARG HB2 . 30680 1 127 . 1 . 1 16 16 ARG HB3 H 1 1.987 0.020 . 1 . . . . A 16 ARG HB3 . 30680 1 128 . 1 . 1 16 16 ARG HG2 H 1 1.695 0.020 . 1 . . . . A 16 ARG HG2 . 30680 1 129 . 1 . 1 16 16 ARG HG3 H 1 1.695 0.020 . 1 . . . . A 16 ARG HG3 . 30680 1 130 . 1 . 1 16 16 ARG HD2 H 1 3.165 0.020 . 1 . . . . A 16 ARG HD2 . 30680 1 131 . 1 . 1 16 16 ARG HD3 H 1 3.165 0.020 . 1 . . . . A 16 ARG HD3 . 30680 1 132 . 1 . 1 16 16 ARG CA C 13 59.227 0.3 . 1 . . . . A 16 ARG CA . 30680 1 133 . 1 . 1 16 16 ARG CB C 13 30.820 0.3 . 1 . . . . A 16 ARG CB . 30680 1 134 . 1 . 1 16 16 ARG N N 15 118.550 0.3 . 1 . . . . A 16 ARG N . 30680 1 135 . 1 . 1 17 17 ILE H H 1 8.315 0.020 . 1 . . . . A 17 ILE H . 30680 1 136 . 1 . 1 17 17 ILE HA H 1 3.372 0.020 . 1 . . . . A 17 ILE HA . 30680 1 137 . 1 . 1 17 17 ILE HB H 1 2.015 0.020 . 1 . . . . A 17 ILE HB . 30680 1 138 . 1 . 1 17 17 ILE HG12 H 1 0.878 0.020 . 1 . . . . A 17 ILE HG12 . 30680 1 139 . 1 . 1 17 17 ILE HG21 H 1 0.795 0.020 . 1 . . . . A 17 ILE HG21 . 30680 1 140 . 1 . 1 17 17 ILE HG22 H 1 0.795 0.020 . 1 . . . . A 17 ILE HG22 . 30680 1 141 . 1 . 1 17 17 ILE HG23 H 1 0.795 0.020 . 1 . . . . A 17 ILE HG23 . 30680 1 142 . 1 . 1 17 17 ILE HD11 H 1 0.719 0.020 . 1 . . . . A 17 ILE HD11 . 30680 1 143 . 1 . 1 17 17 ILE HD12 H 1 0.719 0.020 . 1 . . . . A 17 ILE HD12 . 30680 1 144 . 1 . 1 17 17 ILE HD13 H 1 0.719 0.020 . 1 . . . . A 17 ILE HD13 . 30680 1 145 . 1 . 1 17 17 ILE CA C 13 66.086 0.3 . 1 . . . . A 17 ILE CA . 30680 1 146 . 1 . 1 17 17 ILE CB C 13 38.488 0.3 . 1 . . . . A 17 ILE CB . 30680 1 147 . 1 . 1 17 17 ILE CG2 C 13 17.424 0.3 . 1 . . . . A 17 ILE CG2 . 30680 1 148 . 1 . 1 17 17 ILE CD1 C 13 14.832 0.3 . 1 . . . . A 17 ILE CD1 . 30680 1 149 . 1 . 1 17 17 ILE N N 15 119.237 0.3 . 1 . . . . A 17 ILE N . 30680 1 150 . 1 . 1 18 18 VAL H H 1 7.764 0.020 . 1 . . . . A 18 VAL H . 30680 1 151 . 1 . 1 18 18 VAL HA H 1 3.225 0.020 . 1 . . . . A 18 VAL HA . 30680 1 152 . 1 . 1 18 18 VAL HB H 1 1.920 0.020 . 1 . . . . A 18 VAL HB . 30680 1 153 . 1 . 1 18 18 VAL HG11 H 1 0.734 0.020 . 2 . . . . A 18 VAL HG11 . 30680 1 154 . 1 . 1 18 18 VAL HG12 H 1 0.734 0.020 . 2 . . . . A 18 VAL HG12 . 30680 1 155 . 1 . 1 18 18 VAL HG13 H 1 0.734 0.020 . 2 . . . . A 18 VAL HG13 . 30680 1 156 . 1 . 1 18 18 VAL HG21 H 1 0.425 0.020 . 2 . . . . A 18 VAL HG21 . 30680 1 157 . 1 . 1 18 18 VAL HG22 H 1 0.425 0.020 . 2 . . . . A 18 VAL HG22 . 30680 1 158 . 1 . 1 18 18 VAL HG23 H 1 0.425 0.020 . 2 . . . . A 18 VAL HG23 . 30680 1 159 . 1 . 1 18 18 VAL CA C 13 67.051 0.3 . 1 . . . . A 18 VAL CA . 30680 1 160 . 1 . 1 18 18 VAL CB C 13 30.875 0.3 . 1 . . . . A 18 VAL CB . 30680 1 161 . 1 . 1 18 18 VAL CG1 C 13 21.654 0.3 . 1 . . . . A 18 VAL CG1 . 30680 1 162 . 1 . 1 18 18 VAL CG2 C 13 20.898 0.3 . 1 . . . . A 18 VAL CG2 . 30680 1 163 . 1 . 1 18 18 VAL N N 15 119.105 0.3 . 1 . . . . A 18 VAL N . 30680 1 164 . 1 . 1 19 19 ASP H H 1 8.625 0.020 . 1 . . . . A 19 ASP H . 30680 1 165 . 1 . 1 19 19 ASP HA H 1 4.471 0.020 . 1 . . . . A 19 ASP HA . 30680 1 166 . 1 . 1 19 19 ASP HB2 H 1 2.730 0.020 . 2 . . . . A 19 ASP HB2 . 30680 1 167 . 1 . 1 19 19 ASP HB3 H 1 2.550 0.020 . 2 . . . . A 19 ASP HB3 . 30680 1 168 . 1 . 1 19 19 ASP CA C 13 57.127 0.3 . 1 . . . . A 19 ASP CA . 30680 1 169 . 1 . 1 19 19 ASP CB C 13 40.311 0.3 . 1 . . . . A 19 ASP CB . 30680 1 170 . 1 . 1 19 19 ASP N N 15 120.318 0.3 . 1 . . . . A 19 ASP N . 30680 1 171 . 1 . 1 20 20 LEU H H 1 8.158 0.020 . 1 . . . . A 20 LEU H . 30680 1 172 . 1 . 1 20 20 LEU HA H 1 4.135 0.020 . 1 . . . . A 20 LEU HA . 30680 1 173 . 1 . 1 20 20 LEU HB2 H 1 1.957 0.020 . 2 . . . . A 20 LEU HB2 . 30680 1 174 . 1 . 1 20 20 LEU HB3 H 1 1.926 0.020 . 2 . . . . A 20 LEU HB3 . 30680 1 175 . 1 . 1 20 20 LEU HG H 1 1.279 0.020 . 1 . . . . A 20 LEU HG . 30680 1 176 . 1 . 1 20 20 LEU HD11 H 1 0.900 0.020 . 2 . . . . A 20 LEU HD11 . 30680 1 177 . 1 . 1 20 20 LEU HD12 H 1 0.900 0.020 . 2 . . . . A 20 LEU HD12 . 30680 1 178 . 1 . 1 20 20 LEU HD13 H 1 0.900 0.020 . 2 . . . . A 20 LEU HD13 . 30680 1 179 . 1 . 1 20 20 LEU HD21 H 1 0.799 0.020 . 2 . . . . A 20 LEU HD21 . 30680 1 180 . 1 . 1 20 20 LEU HD22 H 1 0.799 0.020 . 2 . . . . A 20 LEU HD22 . 30680 1 181 . 1 . 1 20 20 LEU HD23 H 1 0.799 0.020 . 2 . . . . A 20 LEU HD23 . 30680 1 182 . 1 . 1 20 20 LEU CA C 13 57.477 0.3 . 1 . . . . A 20 LEU CA . 30680 1 183 . 1 . 1 20 20 LEU CB C 13 42.787 0.3 . 1 . . . . A 20 LEU CB . 30680 1 184 . 1 . 1 20 20 LEU CD2 C 13 22.351 0.3 . 1 . . . . A 20 LEU CD2 . 30680 1 185 . 1 . 1 20 20 LEU N N 15 120.485 0.3 . 1 . . . . A 20 LEU N . 30680 1 186 . 1 . 1 21 21 TYR H H 1 8.590 0.020 . 1 . . . . A 21 TYR H . 30680 1 187 . 1 . 1 21 21 TYR HA H 1 4.266 0.020 . 1 . . . . A 21 TYR HA . 30680 1 188 . 1 . 1 21 21 TYR HB2 H 1 3.019 0.020 . 2 . . . . A 21 TYR HB2 . 30680 1 189 . 1 . 1 21 21 TYR HB3 H 1 2.863 0.020 . 2 . . . . A 21 TYR HB3 . 30680 1 190 . 1 . 1 21 21 TYR HD1 H 1 6.891 0.020 . 1 . . . . A 21 TYR HD1 . 30680 1 191 . 1 . 1 21 21 TYR HD2 H 1 6.891 0.020 . 1 . . . . A 21 TYR HD2 . 30680 1 192 . 1 . 1 21 21 TYR HE1 H 1 6.798 0.020 . 1 . . . . A 21 TYR HE1 . 30680 1 193 . 1 . 1 21 21 TYR HE2 H 1 6.798 0.020 . 1 . . . . A 21 TYR HE2 . 30680 1 194 . 1 . 1 21 21 TYR CA C 13 61.185 0.3 . 1 . . . . A 21 TYR CA . 30680 1 195 . 1 . 1 21 21 TYR CB C 13 38.866 0.3 . 1 . . . . A 21 TYR CB . 30680 1 196 . 1 . 1 21 21 TYR N N 15 123.434 0.3 . 1 . . . . A 21 TYR N . 30680 1 197 . 1 . 1 22 22 LYS H H 1 9.116 0.020 . 1 . . . . A 22 LYS H . 30680 1 198 . 1 . 1 22 22 LYS HA H 1 3.768 0.020 . 1 . . . . A 22 LYS HA . 30680 1 199 . 1 . 1 22 22 LYS HB2 H 1 1.929 0.020 . 1 . . . . A 22 LYS HB2 . 30680 1 200 . 1 . 1 22 22 LYS HB3 H 1 1.929 0.020 . 1 . . . . A 22 LYS HB3 . 30680 1 201 . 1 . 1 22 22 LYS HG2 H 1 1.630 0.020 . 1 . . . . A 22 LYS HG2 . 30680 1 202 . 1 . 1 22 22 LYS HG3 H 1 1.630 0.020 . 1 . . . . A 22 LYS HG3 . 30680 1 203 . 1 . 1 22 22 LYS HD2 H 1 1.422 0.020 . 1 . . . . A 22 LYS HD2 . 30680 1 204 . 1 . 1 22 22 LYS HD3 H 1 1.422 0.020 . 1 . . . . A 22 LYS HD3 . 30680 1 205 . 1 . 1 22 22 LYS HE2 H 1 3.155 0.020 . 1 . . . . A 22 LYS HE2 . 30680 1 206 . 1 . 1 22 22 LYS HE3 H 1 3.155 0.020 . 1 . . . . A 22 LYS HE3 . 30680 1 207 . 1 . 1 22 22 LYS CA C 13 59.500 0.3 . 1 . . . . A 22 LYS CA . 30680 1 208 . 1 . 1 22 22 LYS CB C 13 32.475 0.3 . 1 . . . . A 22 LYS CB . 30680 1 209 . 1 . 1 22 22 LYS CG C 13 27.816 0.3 . 1 . . . . A 22 LYS CG . 30680 1 210 . 1 . 1 22 22 LYS CD C 13 28.934 0.3 . 1 . . . . A 22 LYS CD . 30680 1 211 . 1 . 1 22 22 LYS N N 15 121.422 0.3 . 1 . . . . A 22 LYS N . 30680 1 212 . 1 . 1 23 23 SER H H 1 7.544 0.020 . 1 . . . . A 23 SER H . 30680 1 213 . 1 . 1 23 23 SER HA H 1 4.447 0.020 . 1 . . . . A 23 SER HA . 30680 1 214 . 1 . 1 23 23 SER HB2 H 1 4.129 0.020 . 2 . . . . A 23 SER HB2 . 30680 1 215 . 1 . 1 23 23 SER HB3 H 1 3.830 0.020 . 2 . . . . A 23 SER HB3 . 30680 1 216 . 1 . 1 23 23 SER CA C 13 58.468 0.3 . 1 . . . . A 23 SER CA . 30680 1 217 . 1 . 1 23 23 SER CB C 13 64.003 0.3 . 1 . . . . A 23 SER CB . 30680 1 218 . 1 . 1 23 23 SER N N 15 111.469 0.3 . 1 . . . . A 23 SER N . 30680 1 219 . 1 . 1 24 24 GLY H H 1 7.524 0.020 . 1 . . . . A 24 GLY H . 30680 1 220 . 1 . 1 24 24 GLY HA2 H 1 4.332 0.020 . 2 . . . . A 24 GLY HA2 . 30680 1 221 . 1 . 1 24 24 GLY HA3 H 1 3.551 0.020 . 2 . . . . A 24 GLY HA3 . 30680 1 222 . 1 . 1 24 24 GLY CA C 13 45.214 0.3 . 1 . . . . A 24 GLY CA . 30680 1 223 . 1 . 1 24 24 GLY N N 15 108.170 0.3 . 1 . . . . A 24 GLY N . 30680 1 224 . 1 . 1 25 25 SER H H 1 7.830 0.020 . 1 . . . . A 25 SER H . 30680 1 225 . 1 . 1 25 25 SER HA H 1 4.395 0.020 . 1 . . . . A 25 SER HA . 30680 1 226 . 1 . 1 25 25 SER HB2 H 1 3.630 0.020 . 2 . . . . A 25 SER HB2 . 30680 1 227 . 1 . 1 25 25 SER HB3 H 1 3.401 0.020 . 2 . . . . A 25 SER HB3 . 30680 1 228 . 1 . 1 25 25 SER CA C 13 59.515 0.3 . 1 . . . . A 25 SER CA . 30680 1 229 . 1 . 1 25 25 SER CB C 13 64.513 0.3 . 1 . . . . A 25 SER CB . 30680 1 230 . 1 . 1 25 25 SER N N 15 117.882 0.3 . 1 . . . . A 25 SER N . 30680 1 231 . 1 . 1 26 26 SER H H 1 8.699 0.020 . 1 . . . . A 26 SER H . 30680 1 232 . 1 . 1 26 26 SER HA H 1 4.277 0.020 . 1 . . . . A 26 SER HA . 30680 1 233 . 1 . 1 26 26 SER HB2 H 1 4.350 0.020 . 1 . . . . A 26 SER HB2 . 30680 1 234 . 1 . 1 26 26 SER HB3 H 1 4.350 0.020 . 1 . . . . A 26 SER HB3 . 30680 1 235 . 1 . 1 26 26 SER CA C 13 57.471 0.3 . 1 . . . . A 26 SER CA . 30680 1 236 . 1 . 1 26 26 SER CB C 13 63.539 0.3 . 1 . . . . A 26 SER CB . 30680 1 237 . 1 . 1 26 26 SER N N 15 120.586 0.3 . 1 . . . . A 26 SER N . 30680 1 238 . 1 . 1 27 27 LEU H H 1 8.966 0.020 . 1 . . . . A 27 LEU H . 30680 1 239 . 1 . 1 27 27 LEU HA H 1 3.866 0.020 . 1 . . . . A 27 LEU HA . 30680 1 240 . 1 . 1 27 27 LEU HB2 H 1 1.866 0.020 . 2 . . . . A 27 LEU HB2 . 30680 1 241 . 1 . 1 27 27 LEU HB3 H 1 1.276 0.020 . 2 . . . . A 27 LEU HB3 . 30680 1 242 . 1 . 1 27 27 LEU HG H 1 1.485 0.020 . 1 . . . . A 27 LEU HG . 30680 1 243 . 1 . 1 27 27 LEU HD11 H 1 0.818 0.020 . 1 . . . . A 27 LEU HD11 . 30680 1 244 . 1 . 1 27 27 LEU HD12 H 1 0.818 0.020 . 1 . . . . A 27 LEU HD12 . 30680 1 245 . 1 . 1 27 27 LEU HD13 H 1 0.818 0.020 . 1 . . . . A 27 LEU HD13 . 30680 1 246 . 1 . 1 27 27 LEU HD21 H 1 0.818 0.020 . 1 . . . . A 27 LEU HD21 . 30680 1 247 . 1 . 1 27 27 LEU HD22 H 1 0.818 0.020 . 1 . . . . A 27 LEU HD22 . 30680 1 248 . 1 . 1 27 27 LEU HD23 H 1 0.818 0.020 . 1 . . . . A 27 LEU HD23 . 30680 1 249 . 1 . 1 27 27 LEU CA C 13 59.269 0.3 . 1 . . . . A 27 LEU CA . 30680 1 250 . 1 . 1 27 27 LEU CB C 13 41.361 0.3 . 1 . . . . A 27 LEU CB . 30680 1 251 . 1 . 1 27 27 LEU CG C 13 27.006 0.3 . 1 . . . . A 27 LEU CG . 30680 1 252 . 1 . 1 27 27 LEU CD1 C 13 25.724 0.3 . 1 . . . . A 27 LEU CD1 . 30680 1 253 . 1 . 1 27 27 LEU CD2 C 13 24.952 0.3 . 1 . . . . A 27 LEU CD2 . 30680 1 254 . 1 . 1 27 27 LEU N N 15 119.317 0.3 . 1 . . . . A 27 LEU N . 30680 1 255 . 1 . 1 28 28 GLY H H 1 9.127 0.020 . 1 . . . . A 28 GLY H . 30680 1 256 . 1 . 1 28 28 GLY HA2 H 1 4.020 0.020 . 2 . . . . A 28 GLY HA2 . 30680 1 257 . 1 . 1 28 28 GLY HA3 H 1 3.650 0.020 . 2 . . . . A 28 GLY HA3 . 30680 1 258 . 1 . 1 28 28 GLY CA C 13 46.727 0.3 . 1 . . . . A 28 GLY CA . 30680 1 259 . 1 . 1 28 28 GLY N N 15 106.692 0.3 . 1 . . . . A 28 GLY N . 30680 1 260 . 1 . 1 29 29 ALA H H 1 8.039 0.020 . 1 . . . . A 29 ALA H . 30680 1 261 . 1 . 1 29 29 ALA HA H 1 4.138 0.020 . 1 . . . . A 29 ALA HA . 30680 1 262 . 1 . 1 29 29 ALA HB1 H 1 1.515 0.020 . 1 . . . . A 29 ALA HB1 . 30680 1 263 . 1 . 1 29 29 ALA HB2 H 1 1.515 0.020 . 1 . . . . A 29 ALA HB2 . 30680 1 264 . 1 . 1 29 29 ALA HB3 H 1 1.515 0.020 . 1 . . . . A 29 ALA HB3 . 30680 1 265 . 1 . 1 29 29 ALA CA C 13 55.016 0.3 . 1 . . . . A 29 ALA CA . 30680 1 266 . 1 . 1 29 29 ALA CB C 13 18.795 0.3 . 1 . . . . A 29 ALA CB . 30680 1 267 . 1 . 1 29 29 ALA N N 15 126.427 0.3 . 1 . . . . A 29 ALA N . 30680 1 268 . 1 . 1 30 30 ILE H H 1 8.444 0.020 . 1 . . . . A 30 ILE H . 30680 1 269 . 1 . 1 30 30 ILE HA H 1 3.692 0.020 . 1 . . . . A 30 ILE HA . 30680 1 270 . 1 . 1 30 30 ILE HB H 1 1.891 0.020 . 1 . . . . A 30 ILE HB . 30680 1 271 . 1 . 1 30 30 ILE HG21 H 1 0.852 0.020 . 1 . . . . A 30 ILE HG21 . 30680 1 272 . 1 . 1 30 30 ILE HG22 H 1 0.852 0.020 . 1 . . . . A 30 ILE HG22 . 30680 1 273 . 1 . 1 30 30 ILE HG23 H 1 0.852 0.020 . 1 . . . . A 30 ILE HG23 . 30680 1 274 . 1 . 1 30 30 ILE HD11 H 1 0.756 0.020 . 1 . . . . A 30 ILE HD11 . 30680 1 275 . 1 . 1 30 30 ILE HD12 H 1 0.756 0.020 . 1 . . . . A 30 ILE HD12 . 30680 1 276 . 1 . 1 30 30 ILE HD13 H 1 0.756 0.020 . 1 . . . . A 30 ILE HD13 . 30680 1 277 . 1 . 1 30 30 ILE CA C 13 65.880 0.3 . 1 . . . . A 30 ILE CA . 30680 1 278 . 1 . 1 30 30 ILE CB C 13 38.832 0.3 . 1 . . . . A 30 ILE CB . 30680 1 279 . 1 . 1 30 30 ILE CG2 C 13 17.871 0.3 . 1 . . . . A 30 ILE CG2 . 30680 1 280 . 1 . 1 30 30 ILE CD1 C 13 13.262 0.3 . 1 . . . . A 30 ILE CD1 . 30680 1 281 . 1 . 1 30 30 ILE N N 15 120.206 0.3 . 1 . . . . A 30 ILE N . 30680 1 282 . 1 . 1 31 31 SER H H 1 7.947 0.020 . 1 . . . . A 31 SER H . 30680 1 283 . 1 . 1 31 31 SER HA H 1 4.218 0.020 . 1 . . . . A 31 SER HA . 30680 1 284 . 1 . 1 31 31 SER HB2 H 1 4.051 0.020 . 2 . . . . A 31 SER HB2 . 30680 1 285 . 1 . 1 31 31 SER HB3 H 1 3.902 0.020 . 2 . . . . A 31 SER HB3 . 30680 1 286 . 1 . 1 31 31 SER CA C 13 60.617 0.3 . 1 . . . . A 31 SER CA . 30680 1 287 . 1 . 1 31 31 SER CB C 13 64.003 0.3 . 1 . . . . A 31 SER CB . 30680 1 288 . 1 . 1 31 31 SER N N 15 112.454 0.3 . 1 . . . . A 31 SER N . 30680 1 289 . 1 . 1 32 32 LYS H H 1 7.864 0.020 . 1 . . . . A 32 LYS H . 30680 1 290 . 1 . 1 32 32 LYS HA H 1 4.063 0.020 . 1 . . . . A 32 LYS HA . 30680 1 291 . 1 . 1 32 32 LYS HB2 H 1 1.865 0.020 . 1 . . . . A 32 LYS HB2 . 30680 1 292 . 1 . 1 32 32 LYS HB3 H 1 1.865 0.020 . 1 . . . . A 32 LYS HB3 . 30680 1 293 . 1 . 1 32 32 LYS HG2 H 1 1.764 0.020 . 1 . . . . A 32 LYS HG2 . 30680 1 294 . 1 . 1 32 32 LYS HG3 H 1 1.764 0.020 . 1 . . . . A 32 LYS HG3 . 30680 1 295 . 1 . 1 32 32 LYS HD2 H 1 1.655 0.020 . 1 . . . . A 32 LYS HD2 . 30680 1 296 . 1 . 1 32 32 LYS HD3 H 1 1.655 0.020 . 1 . . . . A 32 LYS HD3 . 30680 1 297 . 1 . 1 32 32 LYS HE2 H 1 3.138 0.020 . 1 . . . . A 32 LYS HE2 . 30680 1 298 . 1 . 1 32 32 LYS HE3 H 1 3.138 0.020 . 1 . . . . A 32 LYS HE3 . 30680 1 299 . 1 . 1 32 32 LYS CA C 13 58.768 0.3 . 1 . . . . A 32 LYS CA . 30680 1 300 . 1 . 1 32 32 LYS CB C 13 32.748 0.3 . 1 . . . . A 32 LYS CB . 30680 1 301 . 1 . 1 32 32 LYS N N 15 118.236 0.3 . 1 . . . . A 32 LYS N . 30680 1 302 . 1 . 1 33 33 ARG H H 1 8.257 0.020 . 1 . . . . A 33 ARG H . 30680 1 303 . 1 . 1 33 33 ARG HA H 1 4.050 0.020 . 1 . . . . A 33 ARG HA . 30680 1 304 . 1 . 1 33 33 ARG HB2 H 1 1.782 0.020 . 1 . . . . A 33 ARG HB2 . 30680 1 305 . 1 . 1 33 33 ARG HB3 H 1 1.782 0.020 . 1 . . . . A 33 ARG HB3 . 30680 1 306 . 1 . 1 33 33 ARG HG2 H 1 1.668 0.020 . 1 . . . . A 33 ARG HG2 . 30680 1 307 . 1 . 1 33 33 ARG HG3 H 1 1.668 0.020 . 1 . . . . A 33 ARG HG3 . 30680 1 308 . 1 . 1 33 33 ARG HD2 H 1 3.155 0.020 . 1 . . . . A 33 ARG HD2 . 30680 1 309 . 1 . 1 33 33 ARG HD3 H 1 3.155 0.020 . 1 . . . . A 33 ARG HD3 . 30680 1 310 . 1 . 1 33 33 ARG CA C 13 58.119 0.3 . 1 . . . . A 33 ARG CA . 30680 1 311 . 1 . 1 33 33 ARG CB C 13 31.032 0.3 . 1 . . . . A 33 ARG CB . 30680 1 312 . 1 . 1 33 33 ARG CG C 13 26.943 0.3 . 1 . . . . A 33 ARG CG . 30680 1 313 . 1 . 1 33 33 ARG CD C 13 43.069 0.3 . 1 . . . . A 33 ARG CD . 30680 1 314 . 1 . 1 33 33 ARG N N 15 119.175 0.3 . 1 . . . . A 33 ARG N . 30680 1 315 . 1 . 1 34 34 LEU H H 1 8.080 0.020 . 1 . . . . A 34 LEU H . 30680 1 316 . 1 . 1 34 34 LEU HA H 1 4.355 0.020 . 1 . . . . A 34 LEU HA . 30680 1 317 . 1 . 1 34 34 LEU HB2 H 1 1.559 0.020 . 1 . . . . A 34 LEU HB2 . 30680 1 318 . 1 . 1 34 34 LEU HB3 H 1 1.559 0.020 . 1 . . . . A 34 LEU HB3 . 30680 1 319 . 1 . 1 34 34 LEU HG H 1 1.144 0.020 . 1 . . . . A 34 LEU HG . 30680 1 320 . 1 . 1 34 34 LEU HD11 H 1 0.708 0.020 . 2 . . . . A 34 LEU HD11 . 30680 1 321 . 1 . 1 34 34 LEU HD12 H 1 0.708 0.020 . 2 . . . . A 34 LEU HD12 . 30680 1 322 . 1 . 1 34 34 LEU HD13 H 1 0.708 0.020 . 2 . . . . A 34 LEU HD13 . 30680 1 323 . 1 . 1 34 34 LEU HD21 H 1 0.731 0.020 . 2 . . . . A 34 LEU HD21 . 30680 1 324 . 1 . 1 34 34 LEU HD22 H 1 0.731 0.020 . 2 . . . . A 34 LEU HD22 . 30680 1 325 . 1 . 1 34 34 LEU HD23 H 1 0.731 0.020 . 2 . . . . A 34 LEU HD23 . 30680 1 326 . 1 . 1 34 34 LEU CA C 13 53.790 0.3 . 1 . . . . A 34 LEU CA . 30680 1 327 . 1 . 1 34 34 LEU CB C 13 41.968 0.3 . 1 . . . . A 34 LEU CB . 30680 1 328 . 1 . 1 34 34 LEU CD1 C 13 27.223 0.3 . 1 . . . . A 34 LEU CD1 . 30680 1 329 . 1 . 1 34 34 LEU CD2 C 13 23.093 0.3 . 1 . . . . A 34 LEU CD2 . 30680 1 330 . 1 . 1 34 34 LEU N N 15 113.765 0.3 . 1 . . . . A 34 LEU N . 30680 1 331 . 1 . 1 35 35 ALA H H 1 7.683 0.020 . 1 . . . . A 35 ALA H . 30680 1 332 . 1 . 1 35 35 ALA HA H 1 4.049 0.020 . 1 . . . . A 35 ALA HA . 30680 1 333 . 1 . 1 35 35 ALA HB1 H 1 1.368 0.020 . 1 . . . . A 35 ALA HB1 . 30680 1 334 . 1 . 1 35 35 ALA HB2 H 1 1.368 0.020 . 1 . . . . A 35 ALA HB2 . 30680 1 335 . 1 . 1 35 35 ALA HB3 H 1 1.368 0.020 . 1 . . . . A 35 ALA HB3 . 30680 1 336 . 1 . 1 35 35 ALA CA C 13 52.402 0.3 . 1 . . . . A 35 ALA CA . 30680 1 337 . 1 . 1 35 35 ALA CB C 13 16.631 0.3 . 1 . . . . A 35 ALA CB . 30680 1 338 . 1 . 1 35 35 ALA N N 15 122.186 0.3 . 1 . . . . A 35 ALA N . 30680 1 339 . 1 . 1 36 36 VAL H H 1 7.626 0.020 . 1 . . . . A 36 VAL H . 30680 1 340 . 1 . 1 36 36 VAL HA H 1 4.763 0.020 . 1 . . . . A 36 VAL HA . 30680 1 341 . 1 . 1 36 36 VAL HB H 1 1.696 0.020 . 1 . . . . A 36 VAL HB . 30680 1 342 . 1 . 1 36 36 VAL HG11 H 1 0.932 0.020 . 2 . . . . A 36 VAL HG11 . 30680 1 343 . 1 . 1 36 36 VAL HG12 H 1 0.932 0.020 . 2 . . . . A 36 VAL HG12 . 30680 1 344 . 1 . 1 36 36 VAL HG13 H 1 0.932 0.020 . 2 . . . . A 36 VAL HG13 . 30680 1 345 . 1 . 1 36 36 VAL HG21 H 1 0.785 0.020 . 2 . . . . A 36 VAL HG21 . 30680 1 346 . 1 . 1 36 36 VAL HG22 H 1 0.785 0.020 . 2 . . . . A 36 VAL HG22 . 30680 1 347 . 1 . 1 36 36 VAL HG23 H 1 0.785 0.020 . 2 . . . . A 36 VAL HG23 . 30680 1 348 . 1 . 1 36 36 VAL CA C 13 57.251 0.3 . 1 . . . . A 36 VAL CA . 30680 1 349 . 1 . 1 36 36 VAL CB C 13 35.547 0.3 . 1 . . . . A 36 VAL CB . 30680 1 350 . 1 . 1 36 36 VAL CG1 C 13 21.379 0.3 . 1 . . . . A 36 VAL CG1 . 30680 1 351 . 1 . 1 36 36 VAL CG2 C 13 20.347 0.3 . 1 . . . . A 36 VAL CG2 . 30680 1 352 . 1 . 1 36 36 VAL N N 15 115.146 0.3 . 1 . . . . A 36 VAL N . 30680 1 353 . 1 . 1 37 37 PRO HA H 1 4.363 0.020 . 1 . . . . A 37 PRO HA . 30680 1 354 . 1 . 1 37 37 PRO HB2 H 1 1.997 0.020 . 2 . . . . A 37 PRO HB2 . 30680 1 355 . 1 . 1 37 37 PRO HB3 H 1 1.925 0.020 . 2 . . . . A 37 PRO HB3 . 30680 1 356 . 1 . 1 37 37 PRO HG2 H 1 2.092 0.020 . 2 . . . . A 37 PRO HG2 . 30680 1 357 . 1 . 1 37 37 PRO HG3 H 1 1.982 0.020 . 2 . . . . A 37 PRO HG3 . 30680 1 358 . 1 . 1 37 37 PRO HD2 H 1 3.920 0.020 . 2 . . . . A 37 PRO HD2 . 30680 1 359 . 1 . 1 37 37 PRO HD3 H 1 3.555 0.020 . 2 . . . . A 37 PRO HD3 . 30680 1 360 . 1 . 1 37 37 PRO CB C 13 32.882 0.3 . 1 . . . . A 37 PRO CB . 30680 1 361 . 1 . 1 37 37 PRO CG C 13 27.303 0.3 . 1 . . . . A 37 PRO CG . 30680 1 362 . 1 . 1 37 37 PRO CD C 13 50.997 0.3 . 1 . . . . A 37 PRO CD . 30680 1 363 . 1 . 1 38 38 ARG H H 1 9.276 0.020 . 1 . . . . A 38 ARG H . 30680 1 364 . 1 . 1 38 38 ARG HA H 1 3.767 0.020 . 1 . . . . A 38 ARG HA . 30680 1 365 . 1 . 1 38 38 ARG HB2 H 1 1.861 0.020 . 1 . . . . A 38 ARG HB2 . 30680 1 366 . 1 . 1 38 38 ARG HB3 H 1 1.861 0.020 . 1 . . . . A 38 ARG HB3 . 30680 1 367 . 1 . 1 38 38 ARG HG2 H 1 1.689 0.020 . 1 . . . . A 38 ARG HG2 . 30680 1 368 . 1 . 1 38 38 ARG HG3 H 1 1.689 0.020 . 1 . . . . A 38 ARG HG3 . 30680 1 369 . 1 . 1 38 38 ARG HD2 H 1 3.135 0.020 . 1 . . . . A 38 ARG HD2 . 30680 1 370 . 1 . 1 38 38 ARG HD3 H 1 3.135 0.020 . 1 . . . . A 38 ARG HD3 . 30680 1 371 . 1 . 1 38 38 ARG CA C 13 60.222 0.3 . 1 . . . . A 38 ARG CA . 30680 1 372 . 1 . 1 38 38 ARG CB C 13 30.674 0.3 . 1 . . . . A 38 ARG CB . 30680 1 373 . 1 . 1 38 38 ARG CD C 13 43.119 0.3 . 1 . . . . A 38 ARG CD . 30680 1 374 . 1 . 1 38 38 ARG N N 15 127.430 0.3 . 1 . . . . A 38 ARG N . 30680 1 375 . 1 . 1 39 39 SER H H 1 8.957 0.020 . 1 . . . . A 39 SER H . 30680 1 376 . 1 . 1 39 39 SER HA H 1 4.130 0.020 . 1 . . . . A 39 SER HA . 30680 1 377 . 1 . 1 39 39 SER HB2 H 1 3.890 0.020 . 1 . . . . A 39 SER HB2 . 30680 1 378 . 1 . 1 39 39 SER HB3 H 1 3.890 0.020 . 1 . . . . A 39 SER HB3 . 30680 1 379 . 1 . 1 39 39 SER CA C 13 60.514 0.3 . 1 . . . . A 39 SER CA . 30680 1 380 . 1 . 1 39 39 SER CB C 13 61.986 0.3 . 1 . . . . A 39 SER CB . 30680 1 381 . 1 . 1 39 39 SER N N 15 112.851 0.3 . 1 . . . . A 39 SER N . 30680 1 382 . 1 . 1 40 40 SER H H 1 7.202 0.020 . 1 . . . . A 40 SER H . 30680 1 383 . 1 . 1 40 40 SER HA H 1 4.447 0.020 . 1 . . . . A 40 SER HA . 30680 1 384 . 1 . 1 40 40 SER HB2 H 1 3.979 0.020 . 2 . . . . A 40 SER HB2 . 30680 1 385 . 1 . 1 40 40 SER HB3 H 1 3.834 0.020 . 2 . . . . A 40 SER HB3 . 30680 1 386 . 1 . 1 40 40 SER CA C 13 60.188 0.3 . 1 . . . . A 40 SER CA . 30680 1 387 . 1 . 1 40 40 SER CB C 13 63.745 0.3 . 1 . . . . A 40 SER CB . 30680 1 388 . 1 . 1 40 40 SER N N 15 119.089 0.3 . 1 . . . . A 40 SER N . 30680 1 389 . 1 . 1 41 41 VAL H H 1 7.633 0.020 . 1 . . . . A 41 VAL H . 30680 1 390 . 1 . 1 41 41 VAL HA H 1 3.331 0.020 . 1 . . . . A 41 VAL HA . 30680 1 391 . 1 . 1 41 41 VAL HB H 1 2.265 0.020 . 1 . . . . A 41 VAL HB . 30680 1 392 . 1 . 1 41 41 VAL HG11 H 1 0.866 0.020 . 1 . . . . A 41 VAL HG11 . 30680 1 393 . 1 . 1 41 41 VAL HG12 H 1 0.866 0.020 . 1 . . . . A 41 VAL HG12 . 30680 1 394 . 1 . 1 41 41 VAL HG13 H 1 0.866 0.020 . 1 . . . . A 41 VAL HG13 . 30680 1 395 . 1 . 1 41 41 VAL HG21 H 1 0.866 0.020 . 1 . . . . A 41 VAL HG21 . 30680 1 396 . 1 . 1 41 41 VAL HG22 H 1 0.866 0.020 . 1 . . . . A 41 VAL HG22 . 30680 1 397 . 1 . 1 41 41 VAL HG23 H 1 0.866 0.020 . 1 . . . . A 41 VAL HG23 . 30680 1 398 . 1 . 1 41 41 VAL CA C 13 67.157 0.3 . 1 . . . . A 41 VAL CA . 30680 1 399 . 1 . 1 41 41 VAL CB C 13 34.650 0.3 . 1 . . . . A 41 VAL CB . 30680 1 400 . 1 . 1 41 41 VAL CG1 C 13 20.519 0.3 . 1 . . . . A 41 VAL CG1 . 30680 1 401 . 1 . 1 41 41 VAL CG2 C 13 19.556 0.3 . 1 . . . . A 41 VAL CG2 . 30680 1 402 . 1 . 1 41 41 VAL N N 15 121.914 0.3 . 1 . . . . A 41 VAL N . 30680 1 403 . 1 . 1 42 42 GLN H H 1 8.666 0.020 . 1 . . . . A 42 GLN H . 30680 1 404 . 1 . 1 42 42 GLN HA H 1 3.781 0.020 . 1 . . . . A 42 GLN HA . 30680 1 405 . 1 . 1 42 42 GLN HB2 H 1 2.076 0.020 . 1 . . . . A 42 GLN HB2 . 30680 1 406 . 1 . 1 42 42 GLN HB3 H 1 2.076 0.020 . 1 . . . . A 42 GLN HB3 . 30680 1 407 . 1 . 1 42 42 GLN HG2 H 1 2.274 0.020 . 2 . . . . A 42 GLN HG2 . 30680 1 408 . 1 . 1 42 42 GLN HG3 H 1 2.260 0.020 . 2 . . . . A 42 GLN HG3 . 30680 1 409 . 1 . 1 42 42 GLN HE21 H 1 7.542 0.020 . 1 . . . . A 42 GLN HE21 . 30680 1 410 . 1 . 1 42 42 GLN HE22 H 1 7.019 0.020 . 1 . . . . A 42 GLN HE22 . 30680 1 411 . 1 . 1 42 42 GLN CA C 13 59.362 0.3 . 1 . . . . A 42 GLN CA . 30680 1 412 . 1 . 1 42 42 GLN CB C 13 29.184 0.3 . 1 . . . . A 42 GLN CB . 30680 1 413 . 1 . 1 42 42 GLN CG C 13 33.601 0.3 . 1 . . . . A 42 GLN CG . 30680 1 414 . 1 . 1 42 42 GLN N N 15 117.211 0.3 . 1 . . . . A 42 GLN N . 30680 1 415 . 1 . 1 42 42 GLN NE2 N 15 112.418 0.3 . 1 . . . . A 42 GLN NE2 . 30680 1 416 . 1 . 1 43 43 THR H H 1 7.819 0.020 . 1 . . . . A 43 THR H . 30680 1 417 . 1 . 1 43 43 THR HA H 1 4.049 0.020 . 1 . . . . A 43 THR HA . 30680 1 418 . 1 . 1 43 43 THR HB H 1 3.845 0.020 . 1 . . . . A 43 THR HB . 30680 1 419 . 1 . 1 43 43 THR HG21 H 1 1.233 0.020 . 1 . . . . A 43 THR HG21 . 30680 1 420 . 1 . 1 43 43 THR HG22 H 1 1.233 0.020 . 1 . . . . A 43 THR HG22 . 30680 1 421 . 1 . 1 43 43 THR HG23 H 1 1.233 0.020 . 1 . . . . A 43 THR HG23 . 30680 1 422 . 1 . 1 43 43 THR CA C 13 64.573 0.3 . 1 . . . . A 43 THR CA . 30680 1 423 . 1 . 1 43 43 THR CB C 13 67.116 0.3 . 1 . . . . A 43 THR CB . 30680 1 424 . 1 . 1 43 43 THR CG2 C 13 21.847 0.3 . 1 . . . . A 43 THR CG2 . 30680 1 425 . 1 . 1 43 43 THR N N 15 116.246 0.3 . 1 . . . . A 43 THR N . 30680 1 426 . 1 . 1 44 44 ILE H H 1 7.711 0.020 . 1 . . . . A 44 ILE H . 30680 1 427 . 1 . 1 44 44 ILE HA H 1 3.660 0.020 . 1 . . . . A 44 ILE HA . 30680 1 428 . 1 . 1 44 44 ILE HB H 1 1.840 0.020 . 1 . . . . A 44 ILE HB . 30680 1 429 . 1 . 1 44 44 ILE HG12 H 1 1.683 0.020 . 2 . . . . A 44 ILE HG12 . 30680 1 430 . 1 . 1 44 44 ILE HG13 H 1 1.410 0.020 . 2 . . . . A 44 ILE HG13 . 30680 1 431 . 1 . 1 44 44 ILE HG21 H 1 0.836 0.020 . 1 . . . . A 44 ILE HG21 . 30680 1 432 . 1 . 1 44 44 ILE HG22 H 1 0.836 0.020 . 1 . . . . A 44 ILE HG22 . 30680 1 433 . 1 . 1 44 44 ILE HG23 H 1 0.836 0.020 . 1 . . . . A 44 ILE HG23 . 30680 1 434 . 1 . 1 44 44 ILE HD11 H 1 0.756 0.020 . 1 . . . . A 44 ILE HD11 . 30680 1 435 . 1 . 1 44 44 ILE HD12 H 1 0.756 0.020 . 1 . . . . A 44 ILE HD12 . 30680 1 436 . 1 . 1 44 44 ILE HD13 H 1 0.756 0.020 . 1 . . . . A 44 ILE HD13 . 30680 1 437 . 1 . 1 44 44 ILE CA C 13 64.088 0.3 . 1 . . . . A 44 ILE CA . 30680 1 438 . 1 . 1 44 44 ILE CB C 13 38.144 0.3 . 1 . . . . A 44 ILE CB . 30680 1 439 . 1 . 1 44 44 ILE CG1 C 13 27.686 0.3 . 1 . . . . A 44 ILE CG1 . 30680 1 440 . 1 . 1 44 44 ILE CG2 C 13 17.768 0.3 . 1 . . . . A 44 ILE CG2 . 30680 1 441 . 1 . 1 44 44 ILE CD1 C 13 12.299 0.3 . 1 . . . . A 44 ILE CD1 . 30680 1 442 . 1 . 1 44 44 ILE N N 15 122.280 0.3 . 1 . . . . A 44 ILE N . 30680 1 443 . 1 . 1 45 45 VAL H H 1 8.325 0.020 . 1 . . . . A 45 VAL H . 30680 1 444 . 1 . 1 45 45 VAL HA H 1 3.442 0.020 . 1 . . . . A 45 VAL HA . 30680 1 445 . 1 . 1 45 45 VAL HB H 1 1.783 0.020 . 1 . . . . A 45 VAL HB . 30680 1 446 . 1 . 1 45 45 VAL HG11 H 1 0.457 0.020 . 2 . . . . A 45 VAL HG11 . 30680 1 447 . 1 . 1 45 45 VAL HG12 H 1 0.457 0.020 . 2 . . . . A 45 VAL HG12 . 30680 1 448 . 1 . 1 45 45 VAL HG13 H 1 0.457 0.020 . 2 . . . . A 45 VAL HG13 . 30680 1 449 . 1 . 1 45 45 VAL HG21 H 1 0.237 0.020 . 2 . . . . A 45 VAL HG21 . 30680 1 450 . 1 . 1 45 45 VAL HG22 H 1 0.237 0.020 . 2 . . . . A 45 VAL HG22 . 30680 1 451 . 1 . 1 45 45 VAL HG23 H 1 0.237 0.020 . 2 . . . . A 45 VAL HG23 . 30680 1 452 . 1 . 1 45 45 VAL CA C 13 65.948 0.3 . 1 . . . . A 45 VAL CA . 30680 1 453 . 1 . 1 45 45 VAL CB C 13 30.380 0.3 . 1 . . . . A 45 VAL CB . 30680 1 454 . 1 . 1 45 45 VAL CG1 C 13 21.826 0.3 . 1 . . . . A 45 VAL CG1 . 30680 1 455 . 1 . 1 45 45 VAL CG2 C 13 20.072 0.3 . 1 . . . . A 45 VAL CG2 . 30680 1 456 . 1 . 1 45 45 VAL N N 15 118.962 0.3 . 1 . . . . A 45 VAL N . 30680 1 457 . 1 . 1 46 46 ARG H H 1 8.121 0.020 . 1 . . . . A 46 ARG H . 30680 1 458 . 1 . 1 46 46 ARG HA H 1 3.944 0.020 . 1 . . . . A 46 ARG HA . 30680 1 459 . 1 . 1 46 46 ARG HB2 H 1 1.918 0.020 . 1 . . . . A 46 ARG HB2 . 30680 1 460 . 1 . 1 46 46 ARG HB3 H 1 1.918 0.020 . 1 . . . . A 46 ARG HB3 . 30680 1 461 . 1 . 1 46 46 ARG HG2 H 1 1.692 0.020 . 1 . . . . A 46 ARG HG2 . 30680 1 462 . 1 . 1 46 46 ARG HG3 H 1 1.692 0.020 . 1 . . . . A 46 ARG HG3 . 30680 1 463 . 1 . 1 46 46 ARG HD2 H 1 3.054 0.020 . 1 . . . . A 46 ARG HD2 . 30680 1 464 . 1 . 1 46 46 ARG HD3 H 1 3.054 0.020 . 1 . . . . A 46 ARG HD3 . 30680 1 465 . 1 . 1 46 46 ARG CA C 13 59.243 0.3 . 1 . . . . A 46 ARG CA . 30680 1 466 . 1 . 1 46 46 ARG CB C 13 30.147 0.3 . 1 . . . . A 46 ARG CB . 30680 1 467 . 1 . 1 46 46 ARG CD C 13 43.087 0.3 . 1 . . . . A 46 ARG CD . 30680 1 468 . 1 . 1 46 46 ARG N N 15 119.977 0.3 . 1 . . . . A 46 ARG N . 30680 1 469 . 1 . 1 47 47 LYS H H 1 7.883 0.020 . 1 . . . . A 47 LYS H . 30680 1 470 . 1 . 1 47 47 LYS HA H 1 4.128 0.020 . 1 . . . . A 47 LYS HA . 30680 1 471 . 1 . 1 47 47 LYS HB2 H 1 1.867 0.020 . 1 . . . . A 47 LYS HB2 . 30680 1 472 . 1 . 1 47 47 LYS HB3 H 1 1.867 0.020 . 1 . . . . A 47 LYS HB3 . 30680 1 473 . 1 . 1 47 47 LYS CA C 13 58.598 0.3 . 1 . . . . A 47 LYS CA . 30680 1 474 . 1 . 1 47 47 LYS CB C 13 32.637 0.3 . 1 . . . . A 47 LYS CB . 30680 1 475 . 1 . 1 47 47 LYS N N 15 118.110 0.3 . 1 . . . . A 47 LYS N . 30680 1 476 . 1 . 1 48 48 TYR H H 1 7.838 0.020 . 1 . . . . A 48 TYR H . 30680 1 477 . 1 . 1 48 48 TYR HA H 1 4.299 0.020 . 1 . . . . A 48 TYR HA . 30680 1 478 . 1 . 1 48 48 TYR HB2 H 1 3.143 0.020 . 2 . . . . A 48 TYR HB2 . 30680 1 479 . 1 . 1 48 48 TYR HB3 H 1 3.090 0.020 . 2 . . . . A 48 TYR HB3 . 30680 1 480 . 1 . 1 48 48 TYR HD1 H 1 7.094 0.020 . 1 . . . . A 48 TYR HD1 . 30680 1 481 . 1 . 1 48 48 TYR HD2 H 1 7.094 0.020 . 1 . . . . A 48 TYR HD2 . 30680 1 482 . 1 . 1 48 48 TYR HE1 H 1 6.838 0.020 . 1 . . . . A 48 TYR HE1 . 30680 1 483 . 1 . 1 48 48 TYR HE2 H 1 6.838 0.020 . 1 . . . . A 48 TYR HE2 . 30680 1 484 . 1 . 1 48 48 TYR CA C 13 59.895 0.3 . 1 . . . . A 48 TYR CA . 30680 1 485 . 1 . 1 48 48 TYR CB C 13 38.522 0.3 . 1 . . . . A 48 TYR CB . 30680 1 486 . 1 . 1 48 48 TYR N N 15 120.056 0.3 . 1 . . . . A 48 TYR N . 30680 1 487 . 1 . 1 49 49 LYS H H 1 8.178 0.020 . 1 . . . . A 49 LYS H . 30680 1 488 . 1 . 1 49 49 LYS HA H 1 3.861 0.020 . 1 . . . . A 49 LYS HA . 30680 1 489 . 1 . 1 49 49 LYS HB2 H 1 1.878 0.020 . 1 . . . . A 49 LYS HB2 . 30680 1 490 . 1 . 1 49 49 LYS HB3 H 1 1.878 0.020 . 1 . . . . A 49 LYS HB3 . 30680 1 491 . 1 . 1 49 49 LYS HG2 H 1 1.349 0.020 . 1 . . . . A 49 LYS HG2 . 30680 1 492 . 1 . 1 49 49 LYS HG3 H 1 1.349 0.020 . 1 . . . . A 49 LYS HG3 . 30680 1 493 . 1 . 1 49 49 LYS HD2 H 1 1.660 0.020 . 1 . . . . A 49 LYS HD2 . 30680 1 494 . 1 . 1 49 49 LYS HD3 H 1 1.660 0.020 . 1 . . . . A 49 LYS HD3 . 30680 1 495 . 1 . 1 49 49 LYS CA C 13 58.149 0.3 . 1 . . . . A 49 LYS CA . 30680 1 496 . 1 . 1 49 49 LYS CB C 13 31.949 0.3 . 1 . . . . A 49 LYS CB . 30680 1 497 . 1 . 1 49 49 LYS CG C 13 24.755 0.3 . 1 . . . . A 49 LYS CG . 30680 1 498 . 1 . 1 49 49 LYS CD C 13 29.389 0.3 . 1 . . . . A 49 LYS CD . 30680 1 499 . 1 . 1 49 49 LYS N N 15 119.925 0.3 . 1 . . . . A 49 LYS N . 30680 1 500 . 1 . 1 50 50 HIS H H 1 8.154 0.020 . 1 . . . . A 50 HIS H . 30680 1 501 . 1 . 1 50 50 HIS HA H 1 4.611 0.020 . 1 . . . . A 50 HIS HA . 30680 1 502 . 1 . 1 50 50 HIS HB2 H 1 3.004 0.020 . 1 . . . . A 50 HIS HB2 . 30680 1 503 . 1 . 1 50 50 HIS HB3 H 1 3.004 0.020 . 1 . . . . A 50 HIS HB3 . 30680 1 504 . 1 . 1 50 50 HIS CA C 13 55.415 0.3 . 1 . . . . A 50 HIS CA . 30680 1 505 . 1 . 1 50 50 HIS CB C 13 29.891 0.3 . 1 . . . . A 50 HIS CB . 30680 1 506 . 1 . 1 50 50 HIS N N 15 116.746 0.3 . 1 . . . . A 50 HIS N . 30680 1 507 . 1 . 1 51 51 HIS H H 1 8.572 0.020 . 1 . . . . A 51 HIS H . 30680 1 508 . 1 . 1 51 51 HIS HA H 1 4.662 0.020 . 1 . . . . A 51 HIS HA . 30680 1 509 . 1 . 1 51 51 HIS HB2 H 1 3.252 0.020 . 1 . . . . A 51 HIS HB2 . 30680 1 510 . 1 . 1 51 51 HIS HB3 H 1 3.252 0.020 . 1 . . . . A 51 HIS HB3 . 30680 1 511 . 1 . 1 51 51 HIS CA C 13 55.062 0.3 . 1 . . . . A 51 HIS CA . 30680 1 512 . 1 . 1 51 51 HIS CB C 13 29.719 0.3 . 1 . . . . A 51 HIS CB . 30680 1 513 . 1 . 1 51 51 HIS N N 15 120.551 0.3 . 1 . . . . A 51 HIS N . 30680 1 514 . 1 . 1 52 52 GLY H H 1 8.469 0.020 . 1 . . . . A 52 GLY H . 30680 1 515 . 1 . 1 52 52 GLY HA2 H 1 4.016 0.020 . 1 . . . . A 52 GLY HA2 . 30680 1 516 . 1 . 1 52 52 GLY HA3 H 1 4.016 0.020 . 1 . . . . A 52 GLY HA3 . 30680 1 517 . 1 . 1 52 52 GLY CA C 13 45.352 0.3 . 1 . . . . A 52 GLY CA . 30680 1 518 . 1 . 1 52 52 GLY N N 15 110.066 0.3 . 1 . . . . A 52 GLY N . 30680 1 519 . 1 . 1 53 53 THR H H 1 8.157 0.020 . 1 . . . . A 53 THR H . 30680 1 520 . 1 . 1 53 53 THR HA H 1 4.418 0.020 . 1 . . . . A 53 THR HA . 30680 1 521 . 1 . 1 53 53 THR HB H 1 4.243 0.020 . 1 . . . . A 53 THR HB . 30680 1 522 . 1 . 1 53 53 THR HG21 H 1 1.169 0.020 . 1 . . . . A 53 THR HG21 . 30680 1 523 . 1 . 1 53 53 THR HG22 H 1 1.169 0.020 . 1 . . . . A 53 THR HG22 . 30680 1 524 . 1 . 1 53 53 THR HG23 H 1 1.169 0.020 . 1 . . . . A 53 THR HG23 . 30680 1 525 . 1 . 1 53 53 THR CA C 13 61.431 0.3 . 1 . . . . A 53 THR CA . 30680 1 526 . 1 . 1 53 53 THR CB C 13 70.370 0.3 . 1 . . . . A 53 THR CB . 30680 1 527 . 1 . 1 53 53 THR CG2 C 13 21.253 0.3 . 1 . . . . A 53 THR CG2 . 30680 1 528 . 1 . 1 53 53 THR N N 15 113.554 0.3 . 1 . . . . A 53 THR N . 30680 1 529 . 1 . 1 54 54 THR H H 1 8.306 0.020 . 1 . . . . A 54 THR H . 30680 1 530 . 1 . 1 54 54 THR HA H 1 4.271 0.020 . 1 . . . . A 54 THR HA . 30680 1 531 . 1 . 1 54 54 THR HB H 1 4.137 0.020 . 1 . . . . A 54 THR HB . 30680 1 532 . 1 . 1 54 54 THR HG21 H 1 1.099 0.020 . 1 . . . . A 54 THR HG21 . 30680 1 533 . 1 . 1 54 54 THR HG22 H 1 1.099 0.020 . 1 . . . . A 54 THR HG22 . 30680 1 534 . 1 . 1 54 54 THR HG23 H 1 1.099 0.020 . 1 . . . . A 54 THR HG23 . 30680 1 535 . 1 . 1 54 54 THR CA C 13 61.693 0.3 . 1 . . . . A 54 THR CA . 30680 1 536 . 1 . 1 54 54 THR CB C 13 70.125 0.3 . 1 . . . . A 54 THR CB . 30680 1 537 . 1 . 1 54 54 THR CG2 C 13 21.402 0.3 . 1 . . . . A 54 THR CG2 . 30680 1 538 . 1 . 1 54 54 THR N N 15 116.777 0.3 . 1 . . . . A 54 THR N . 30680 1 539 . 1 . 1 55 55 GLN H H 1 8.452 0.020 . 1 . . . . A 55 GLN H . 30680 1 540 . 1 . 1 55 55 GLN HA H 1 4.218 0.020 . 1 . . . . A 55 GLN HA . 30680 1 541 . 1 . 1 55 55 GLN HB2 H 1 1.864 0.020 . 1 . . . . A 55 GLN HB2 . 30680 1 542 . 1 . 1 55 55 GLN HB3 H 1 1.864 0.020 . 1 . . . . A 55 GLN HB3 . 30680 1 543 . 1 . 1 55 55 GLN HG2 H 1 2.230 0.020 . 1 . . . . A 55 GLN HG2 . 30680 1 544 . 1 . 1 55 55 GLN HG3 H 1 2.230 0.020 . 1 . . . . A 55 GLN HG3 . 30680 1 545 . 1 . 1 55 55 GLN HE21 H 1 7.550 0.020 . 1 . . . . A 55 GLN HE21 . 30680 1 546 . 1 . 1 55 55 GLN HE22 H 1 6.905 0.020 . 1 . . . . A 55 GLN HE22 . 30680 1 547 . 1 . 1 55 55 GLN CA C 13 55.974 0.3 . 1 . . . . A 55 GLN CA . 30680 1 548 . 1 . 1 55 55 GLN CB C 13 29.811 0.3 . 1 . . . . A 55 GLN CB . 30680 1 549 . 1 . 1 55 55 GLN CG C 13 33.371 0.3 . 1 . . . . A 55 GLN CG . 30680 1 550 . 1 . 1 55 55 GLN N N 15 123.060 0.3 . 1 . . . . A 55 GLN N . 30680 1 551 . 1 . 1 55 55 GLN NE2 N 15 113.206 0.3 . 1 . . . . A 55 GLN NE2 . 30680 1 552 . 1 . 1 56 56 HIS H H 1 8.631 0.020 . 1 . . . . A 56 HIS H . 30680 1 553 . 1 . 1 56 56 HIS HA H 1 4.593 0.020 . 1 . . . . A 56 HIS HA . 30680 1 554 . 1 . 1 56 56 HIS HB2 H 1 3.155 0.020 . 1 . . . . A 56 HIS HB2 . 30680 1 555 . 1 . 1 56 56 HIS HB3 H 1 3.155 0.020 . 1 . . . . A 56 HIS HB3 . 30680 1 556 . 1 . 1 56 56 HIS CA C 13 60.206 0.3 . 1 . . . . A 56 HIS CA . 30680 1 557 . 1 . 1 56 56 HIS CB C 13 29.791 0.3 . 1 . . . . A 56 HIS CB . 30680 1 558 . 1 . 1 56 56 HIS N N 15 124.124 0.3 . 1 . . . . A 56 HIS N . 30680 1 stop_ save_