################################### # 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 18772 _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 2 '3D CBCA(CO)NH' . . . 18772 1 3 '3D HNCA' . . . 18772 1 4 '3D HNCO' . . . 18772 1 5 '3D H(CA)CO(CA)NH' . . . 18772 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 SER C C 13 173.48 0.31 . 1 . . . . 3 SER C . 18772 1 2 . 1 1 3 3 SER CA C 13 57.66 0.31 . 1 . . . . 3 SER CA . 18772 1 3 . 1 1 3 3 SER CB C 13 63.79 0.31 . 1 . . . . 3 SER CB . 18772 1 4 . 1 1 4 4 LEU H H 1 7.57 0.03 . 1 . . . . 4 LEU H . 18772 1 5 . 1 1 4 4 LEU C C 13 175.18 0.31 . 1 . . . . 4 LEU C . 18772 1 6 . 1 1 4 4 LEU CA C 13 52.34 0.31 . 1 . . . . 4 LEU CA . 18772 1 7 . 1 1 4 4 LEU CB C 13 43.12 0.31 . 1 . . . . 4 LEU CB . 18772 1 8 . 1 1 4 4 LEU N N 15 123.03 0.14 . 1 . . . . 4 LEU N . 18772 1 9 . 1 1 5 5 PRO CA C 13 62.91 0.31 . 1 . . . . 5 PRO CA . 18772 1 10 . 1 1 5 5 PRO CB C 13 32.06 0.31 . 1 . . . . 5 PRO CB . 18772 1 11 . 1 1 6 6 THR H H 1 7.59 0.03 . 1 . . . . 6 THR H . 18772 1 12 . 1 1 6 6 THR C C 13 174.34 0.31 . 1 . . . . 6 THR C . 18772 1 13 . 1 1 6 6 THR CA C 13 60.98 0.31 . 1 . . . . 6 THR CA . 18772 1 14 . 1 1 6 6 THR CB C 13 69.79 0.31 . 1 . . . . 6 THR CB . 18772 1 15 . 1 1 6 6 THR N N 15 112.56 0.14 . 1 . . . . 6 THR N . 18772 1 16 . 1 1 7 7 SER H H 1 7.81 0.03 . 1 . . . . 7 SER H . 18772 1 17 . 1 1 7 7 SER C C 13 173.89 0.31 . 1 . . . . 7 SER C . 18772 1 18 . 1 1 7 7 SER CA C 13 57.87 0.31 . 1 . . . . 7 SER CA . 18772 1 19 . 1 1 7 7 SER CB C 13 63.99 0.31 . 1 . . . . 7 SER CB . 18772 1 20 . 1 1 7 7 SER N N 15 117.51 0.14 . 1 . . . . 7 SER N . 18772 1 21 . 1 1 8 8 ASN C C 13 175.58 0.31 . 1 . . . . 8 ASN C . 18772 1 22 . 1 1 8 8 ASN CA C 13 53.73 0.31 . 1 . . . . 8 ASN CA . 18772 1 23 . 1 1 8 8 ASN CB C 13 38.84 0.31 . 1 . . . . 8 ASN CB . 18772 1 24 . 1 1 9 9 GLU H H 1 8.08 0.03 . 1 . . . . 9 GLU H . 18772 1 25 . 1 1 9 9 GLU C C 13 177.22 0.31 . 1 . . . . 9 GLU C . 18772 1 26 . 1 1 9 9 GLU CA C 13 58.19 0.31 . 1 . . . . 9 GLU CA . 18772 1 27 . 1 1 9 9 GLU CB C 13 29.57 0.31 . 1 . . . . 9 GLU CB . 18772 1 28 . 1 1 9 9 GLU N N 15 120.76 0.14 . 1 . . . . 9 GLU N . 18772 1 29 . 1 1 10 10 TYR H H 1 7.67 0.03 . 1 . . . . 10 TYR H . 18772 1 30 . 1 1 10 10 TYR C C 13 177.03 0.31 . 1 . . . . 10 TYR C . 18772 1 31 . 1 1 10 10 TYR CA C 13 59.74 0.31 . 1 . . . . 10 TYR CA . 18772 1 32 . 1 1 10 10 TYR CB C 13 38.17 0.31 . 1 . . . . 10 TYR CB . 18772 1 33 . 1 1 10 10 TYR N N 15 120.62 0.14 . 1 . . . . 10 TYR N . 18772 1 34 . 1 1 11 11 GLN H H 1 7.78 0.03 . 1 . . . . 11 GLN H . 18772 1 35 . 1 1 11 11 GLN C C 13 177.77 0.31 . 1 . . . . 11 GLN C . 18772 1 36 . 1 1 11 11 GLN CA C 13 57.76 0.31 . 1 . . . . 11 GLN CA . 18772 1 37 . 1 1 11 11 GLN CB C 13 28.56 0.31 . 1 . . . . 11 GLN CB . 18772 1 38 . 1 1 11 11 GLN N N 15 118.93 0.14 . 1 . . . . 11 GLN N . 18772 1 39 . 1 1 12 12 ASN H H 1 7.81 0.03 . 1 . . . . 12 ASN H . 18772 1 40 . 1 1 12 12 ASN C C 13 176.20 0.31 . 1 . . . . 12 ASN C . 18772 1 41 . 1 1 12 12 ASN CA C 13 56.14 0.31 . 1 . . . . 12 ASN CA . 18772 1 42 . 1 1 12 12 ASN CB C 13 38.63 0.31 . 1 . . . . 12 ASN CB . 18772 1 43 . 1 1 12 12 ASN N N 15 120.06 0.14 . 1 . . . . 12 ASN N . 18772 1 44 . 1 1 13 13 GLU H H 1 7.65 0.03 . 1 . . . . 13 GLU H . 18772 1 45 . 1 1 13 13 GLU C C 13 177.81 0.31 . 1 . . . . 13 GLU C . 18772 1 46 . 1 1 13 13 GLU CA C 13 58.59 0.31 . 1 . . . . 13 GLU CA . 18772 1 47 . 1 1 13 13 GLU CB C 13 29.53 0.31 . 1 . . . . 13 GLU CB . 18772 1 48 . 1 1 13 13 GLU N N 15 120.20 0.14 . 1 . . . . 13 GLU N . 18772 1 49 . 1 1 14 14 LYS H H 1 7.54 0.03 . 1 . . . . 14 LYS H . 18772 1 50 . 1 1 14 14 LYS C C 13 178.40 0.31 . 1 . . . . 14 LYS C . 18772 1 51 . 1 1 14 14 LYS CA C 13 58.84 0.31 . 1 . . . . 14 LYS CA . 18772 1 52 . 1 1 14 14 LYS CB C 13 32.60 0.31 . 1 . . . . 14 LYS CB . 18772 1 53 . 1 1 14 14 LYS N N 15 119.91 0.14 . 1 . . . . 14 LYS N . 18772 1 54 . 1 1 15 15 LEU H H 1 7.21 0.03 . 1 . . . . 15 LEU H . 18772 1 55 . 1 1 15 15 LEU C C 13 177.61 0.31 . 1 . . . . 15 LEU C . 18772 1 56 . 1 1 15 15 LEU CA C 13 57.06 0.31 . 1 . . . . 15 LEU CA . 18772 1 57 . 1 1 15 15 LEU CB C 13 41.45 0.31 . 1 . . . . 15 LEU CB . 18772 1 58 . 1 1 15 15 LEU N N 15 120.48 0.14 . 1 . . . . 15 LEU N . 18772 1 59 . 1 1 16 16 ALA H H 1 7.84 0.03 . 1 . . . . 16 ALA H . 18772 1 60 . 1 1 16 16 ALA C C 13 179.58 0.31 . 1 . . . . 16 ALA C . 18772 1 61 . 1 1 16 16 ALA CA C 13 55.14 0.31 . 1 . . . . 16 ALA CA . 18772 1 62 . 1 1 16 16 ALA CB C 13 17.98 0.31 . 1 . . . . 16 ALA CB . 18772 1 63 . 1 1 16 16 ALA N N 15 121.33 0.14 . 1 . . . . 16 ALA N . 18772 1 64 . 1 1 17 17 ASN H H 1 7.73 0.03 . 1 . . . . 17 ASN H . 18772 1 65 . 1 1 17 17 ASN C C 13 178.26 0.31 . 1 . . . . 17 ASN C . 18772 1 66 . 1 1 17 17 ASN CA C 13 55.66 0.31 . 1 . . . . 17 ASN CA . 18772 1 67 . 1 1 17 17 ASN CB C 13 38.09 0.31 . 1 . . . . 17 ASN CB . 18772 1 68 . 1 1 17 17 ASN N N 15 116.52 0.14 . 1 . . . . 17 ASN N . 18772 1 69 . 1 1 18 18 GLU H H 1 7.89 0.03 . 1 . . . . 18 GLU H . 18772 1 70 . 1 1 18 18 GLU C C 13 179.50 0.31 . 1 . . . . 18 GLU C . 18772 1 71 . 1 1 18 18 GLU CA C 13 58.94 0.31 . 1 . . . . 18 GLU CA . 18772 1 72 . 1 1 18 18 GLU CB C 13 29.85 0.31 . 1 . . . . 18 GLU CB . 18772 1 73 . 1 1 18 18 GLU N N 15 122.74 0.14 . 1 . . . . 18 GLU N . 18772 1 74 . 1 1 19 19 LEU H H 1 8.39 0.03 . 1 . . . . 19 LEU H . 18772 1 75 . 1 1 19 19 LEU C C 13 177.56 0.31 . 1 . . . . 19 LEU C . 18772 1 76 . 1 1 19 19 LEU CA C 13 57.51 0.31 . 1 . . . . 19 LEU CA . 18772 1 77 . 1 1 19 19 LEU CB C 13 42.17 0.31 . 1 . . . . 19 LEU CB . 18772 1 78 . 1 1 19 19 LEU N N 15 121.61 0.14 . 1 . . . . 19 LEU N . 18772 1 79 . 1 1 20 20 LYS H H 1 8.27 0.03 . 1 . . . . 20 LYS H . 18772 1 80 . 1 1 20 20 LYS C C 13 178.11 0.31 . 1 . . . . 20 LYS C . 18772 1 81 . 1 1 20 20 LYS CA C 13 59.98 0.31 . 1 . . . . 20 LYS CA . 18772 1 82 . 1 1 20 20 LYS CB C 13 32.33 0.31 . 1 . . . . 20 LYS CB . 18772 1 83 . 1 1 20 20 LYS N N 15 120.62 0.14 . 1 . . . . 20 LYS N . 18772 1 84 . 1 1 21 21 SER H H 1 7.54 0.03 . 1 . . . . 21 SER H . 18772 1 85 . 1 1 21 21 SER C C 13 177.21 0.31 . 1 . . . . 21 SER C . 18772 1 86 . 1 1 21 21 SER CA C 13 61.87 0.31 . 1 . . . . 21 SER CA . 18772 1 87 . 1 1 21 21 SER N N 15 113.98 0.14 . 1 . . . . 21 SER N . 18772 1 88 . 1 1 22 22 LEU H H 1 7.33 0.03 . 1 . . . . 22 LEU H . 18772 1 89 . 1 1 22 22 LEU C C 13 175.03 0.31 . 1 . . . . 22 LEU C . 18772 1 90 . 1 1 22 22 LEU CA C 13 57.56 0.31 . 1 . . . . 22 LEU CA . 18772 1 91 . 1 1 22 22 LEU CB C 13 42.97 0.31 . 1 . . . . 22 LEU CB . 18772 1 92 . 1 1 22 22 LEU N N 15 121.33 0.14 . 1 . . . . 22 LEU N . 18772 1 93 . 1 1 23 23 LEU H H 1 8.25 0.03 . 1 . . . . 23 LEU H . 18772 1 94 . 1 1 23 23 LEU C C 13 179.08 0.31 . 1 . . . . 23 LEU C . 18772 1 95 . 1 1 23 23 LEU CA C 13 57.60 0.31 . 1 . . . . 23 LEU CA . 18772 1 96 . 1 1 23 23 LEU CB C 13 42.03 0.31 . 1 . . . . 23 LEU CB . 18772 1 97 . 1 1 23 23 LEU N N 15 125.29 0.14 . 1 . . . . 23 LEU N . 18772 1 98 . 1 1 24 24 ASP H H 1 7.82 0.03 . 1 . . . . 24 ASP H . 18772 1 99 . 1 1 24 24 ASP C C 13 177.17 0.31 . 1 . . . . 24 ASP C . 18772 1 100 . 1 1 24 24 ASP CA C 13 56.78 0.31 . 1 . . . . 24 ASP CA . 18772 1 101 . 1 1 24 24 ASP CB C 13 40.15 0.31 . 1 . . . . 24 ASP CB . 18772 1 102 . 1 1 24 24 ASP N N 15 122.18 0.14 . 1 . . . . 24 ASP N . 18772 1 103 . 1 1 25 25 GLU H H 1 6.94 0.03 . 1 . . . . 25 GLU H . 18772 1 104 . 1 1 25 25 GLU C C 13 176.22 0.31 . 1 . . . . 25 GLU C . 18772 1 105 . 1 1 25 25 GLU CA C 13 55.06 0.31 . 1 . . . . 25 GLU CA . 18772 1 106 . 1 1 25 25 GLU CB C 13 29.81 0.31 . 1 . . . . 25 GLU CB . 18772 1 107 . 1 1 25 25 GLU N N 15 116.66 0.14 . 1 . . . . 25 GLU N . 18772 1 108 . 1 1 26 26 LEU H H 1 7.29 0.03 . 1 . . . . 26 LEU H . 18772 1 109 . 1 1 26 26 LEU C C 13 177.93 0.31 . 1 . . . . 26 LEU C . 18772 1 110 . 1 1 26 26 LEU CA C 13 59.02 0.31 . 1 . . . . 26 LEU CA . 18772 1 111 . 1 1 26 26 LEU CB C 13 42.99 0.31 . 1 . . . . 26 LEU CB . 18772 1 112 . 1 1 26 26 LEU N N 15 124.02 0.14 . 1 . . . . 26 LEU N . 18772 1 113 . 1 1 27 27 ASN H H 1 8.08 0.03 . 1 . . . . 27 ASN H . 18772 1 114 . 1 1 27 27 ASN C C 13 177.45 0.31 . 1 . . . . 27 ASN C . 18772 1 115 . 1 1 27 27 ASN CA C 13 56.61 0.31 . 1 . . . . 27 ASN CA . 18772 1 116 . 1 1 27 27 ASN CB C 13 37.99 0.31 . 1 . . . . 27 ASN CB . 18772 1 117 . 1 1 27 27 ASN N N 15 116.10 0.14 . 1 . . . . 27 ASN N . 18772 1 118 . 1 1 28 28 VAL H H 1 7.46 0.03 . 1 . . . . 28 VAL H . 18772 1 119 . 1 1 28 28 VAL C C 13 178.07 0.31 . 1 . . . . 28 VAL C . 18772 1 120 . 1 1 28 28 VAL CA C 13 65.36 0.31 . 1 . . . . 28 VAL CA . 18772 1 121 . 1 1 28 28 VAL CB C 13 31.69 0.31 . 1 . . . . 28 VAL CB . 18772 1 122 . 1 1 28 28 VAL N N 15 118.22 0.14 . 1 . . . . 28 VAL N . 18772 1 123 . 1 1 29 29 ASN H H 1 6.97 0.03 . 1 . . . . 29 ASN H . 18772 1 124 . 1 1 29 29 ASN C C 13 176.16 0.31 . 1 . . . . 29 ASN C . 18772 1 125 . 1 1 29 29 ASN CA C 13 56.61 0.31 . 1 . . . . 29 ASN CA . 18772 1 126 . 1 1 29 29 ASN CB C 13 39.95 0.31 . 1 . . . . 29 ASN CB . 18772 1 127 . 1 1 29 29 ASN N N 15 120.82 0.14 . 1 . . . . 29 ASN N . 18772 1 128 . 1 1 30 30 GLU H H 1 8.71 0.03 . 1 . . . . 30 GLU H . 18772 1 129 . 1 1 30 30 GLU C C 13 180.92 0.31 . 1 . . . . 30 GLU C . 18772 1 130 . 1 1 30 30 GLU CA C 13 60.06 0.31 . 1 . . . . 30 GLU CA . 18772 1 131 . 1 1 30 30 GLU CB C 13 29.39 0.31 . 1 . . . . 30 GLU CB . 18772 1 132 . 1 1 30 30 GLU N N 15 120.78 0.14 . 1 . . . . 30 GLU N . 18772 1 133 . 1 1 31 31 LEU H H 1 7.92 0.03 . 1 . . . . 31 LEU H . 18772 1 134 . 1 1 31 31 LEU C C 13 179.70 0.31 . 1 . . . . 31 LEU C . 18772 1 135 . 1 1 31 31 LEU CA C 13 57.61 0.31 . 1 . . . . 31 LEU CA . 18772 1 136 . 1 1 31 31 LEU CB C 13 41.57 0.31 . 1 . . . . 31 LEU CB . 18772 1 137 . 1 1 31 31 LEU N N 15 122.88 0.14 . 1 . . . . 31 LEU N . 18772 1 138 . 1 1 32 32 ALA H H 1 7.11 0.03 . 1 . . . . 32 ALA H . 18772 1 139 . 1 1 32 32 ALA C C 13 178.40 0.31 . 1 . . . . 32 ALA C . 18772 1 140 . 1 1 32 32 ALA CA C 13 53.90 0.31 . 1 . . . . 32 ALA CA . 18772 1 141 . 1 1 32 32 ALA CB C 13 18.49 0.31 . 1 . . . . 32 ALA CB . 18772 1 142 . 1 1 32 32 ALA N N 15 121.75 0.14 . 1 . . . . 32 ALA N . 18772 1 143 . 1 1 33 33 THR H H 1 7.13 0.03 . 1 . . . . 33 THR H . 18772 1 144 . 1 1 33 33 THR C C 13 176.12 0.31 . 1 . . . . 33 THR C . 18772 1 145 . 1 1 33 33 THR CA C 13 63.45 0.31 . 1 . . . . 33 THR CA . 18772 1 146 . 1 1 33 33 THR CB C 13 69.98 0.31 . 1 . . . . 33 THR CB . 18772 1 147 . 1 1 33 33 THR N N 15 105.07 0.14 . 1 . . . . 33 THR N . 18772 1 148 . 1 1 34 34 GLY H H 1 7.52 0.03 . 1 . . . . 34 GLY H . 18772 1 149 . 1 1 34 34 GLY CA C 13 47.43 0.31 . 1 . . . . 34 GLY CA . 18772 1 150 . 1 1 34 34 GLY N N 15 110.16 0.14 . 1 . . . . 34 GLY N . 18772 1 151 . 1 1 35 35 SER C C 13 173.51 0.31 . 1 . . . . 35 SER C . 18772 1 152 . 1 1 35 35 SER CA C 13 57.56 0.31 . 1 . . . . 35 SER CA . 18772 1 153 . 1 1 35 35 SER CB C 13 63.68 0.31 . 1 . . . . 35 SER CB . 18772 1 154 . 1 1 36 36 LEU H H 1 7.07 0.03 . 1 . . . . 36 LEU H . 18772 1 155 . 1 1 36 36 LEU C C 13 175.57 0.31 . 1 . . . . 36 LEU C . 18772 1 156 . 1 1 36 36 LEU CA C 13 52.67 0.31 . 1 . . . . 36 LEU CA . 18772 1 157 . 1 1 36 36 LEU CB C 13 43.86 0.31 . 1 . . . . 36 LEU CB . 18772 1 158 . 1 1 36 36 LEU N N 15 121.19 0.14 . 1 . . . . 36 LEU N . 18772 1 159 . 1 1 37 37 ASN H H 1 7.87 0.03 . 1 . . . . 37 ASN H . 18772 1 160 . 1 1 37 37 ASN C C 13 176.03 0.31 . 1 . . . . 37 ASN C . 18772 1 161 . 1 1 37 37 ASN CA C 13 53.10 0.31 . 1 . . . . 37 ASN CA . 18772 1 162 . 1 1 37 37 ASN CB C 13 39.62 0.31 . 1 . . . . 37 ASN CB . 18772 1 163 . 1 1 37 37 ASN N N 15 115.96 0.14 . 1 . . . . 37 ASN N . 18772 1 164 . 1 1 38 38 THR C C 13 174.34 0.31 . 1 . . . . 38 THR C . 18772 1 165 . 1 1 38 38 THR CA C 13 65.83 0.31 . 1 . . . . 38 THR CA . 18772 1 166 . 1 1 38 38 THR CB C 13 69.18 0.31 . 1 . . . . 38 THR CB . 18772 1 167 . 1 1 39 39 TYR H H 1 8.11 0.03 . 1 . . . . 39 TYR H . 18772 1 168 . 1 1 39 39 TYR C C 13 177.88 0.31 . 1 . . . . 39 TYR C . 18772 1 169 . 1 1 39 39 TYR CA C 13 61.26 0.31 . 1 . . . . 39 TYR CA . 18772 1 170 . 1 1 39 39 TYR CB C 13 38.20 0.31 . 1 . . . . 39 TYR CB . 18772 1 171 . 1 1 39 39 TYR N N 15 121.89 0.14 . 1 . . . . 39 TYR N . 18772 1 172 . 1 1 40 40 TYR H H 1 7.40 0.03 . 1 . . . . 40 TYR H . 18772 1 173 . 1 1 40 40 TYR C C 13 176.82 0.31 . 1 . . . . 40 TYR C . 18772 1 174 . 1 1 40 40 TYR CA C 13 62.12 0.31 . 1 . . . . 40 TYR CA . 18772 1 175 . 1 1 40 40 TYR CB C 13 38.19 0.31 . 1 . . . . 40 TYR CB . 18772 1 176 . 1 1 40 40 TYR N N 15 119.21 0.14 . 1 . . . . 40 TYR N . 18772 1 177 . 1 1 41 41 LYS H H 1 7.02 0.03 . 1 . . . . 41 LYS H . 18772 1 178 . 1 1 41 41 LYS C C 13 178.37 0.31 . 1 . . . . 41 LYS C . 18772 1 179 . 1 1 41 41 LYS CA C 13 59.14 0.31 . 1 . . . . 41 LYS CA . 18772 1 180 . 1 1 41 41 LYS CB C 13 33.45 0.31 . 1 . . . . 41 LYS CB . 18772 1 181 . 1 1 41 41 LYS N N 15 118.08 0.14 . 1 . . . . 41 LYS N . 18772 1 182 . 1 1 42 42 ARG H H 1 7.97 0.03 . 1 . . . . 42 ARG H . 18772 1 183 . 1 1 42 42 ARG C C 13 178.57 0.31 . 1 . . . . 42 ARG C . 18772 1 184 . 1 1 42 42 ARG CA C 13 58.44 0.31 . 1 . . . . 42 ARG CA . 18772 1 185 . 1 1 42 42 ARG CB C 13 30.30 0.31 . 1 . . . . 42 ARG CB . 18772 1 186 . 1 1 42 42 ARG N N 15 117.09 0.14 . 1 . . . . 42 ARG N . 18772 1 187 . 1 1 43 43 THR H H 1 7.48 0.03 . 1 . . . . 43 THR H . 18772 1 188 . 1 1 43 43 THR C C 13 177.25 0.31 . 1 . . . . 43 THR C . 18772 1 189 . 1 1 43 43 THR CA C 13 66.55 0.31 . 1 . . . . 43 THR CA . 18772 1 190 . 1 1 43 43 THR N N 15 115.11 0.14 . 1 . . . . 43 THR N . 18772 1 191 . 1 1 44 44 ILE H H 1 7.95 0.03 . 1 . . . . 44 ILE H . 18772 1 192 . 1 1 44 44 ILE C C 13 175.51 0.31 . 1 . . . . 44 ILE C . 18772 1 193 . 1 1 44 44 ILE CA C 13 63.53 0.31 . 1 . . . . 44 ILE CA . 18772 1 194 . 1 1 44 44 ILE CB C 13 36.92 0.31 . 1 . . . . 44 ILE CB . 18772 1 195 . 1 1 44 44 ILE N N 15 123.45 0.14 . 1 . . . . 44 ILE N . 18772 1 196 . 1 1 45 45 LYS H H 1 6.58 0.03 . 1 . . . . 45 LYS H . 18772 1 197 . 1 1 45 45 LYS C C 13 179.11 0.31 . 1 . . . . 45 LYS C . 18772 1 198 . 1 1 45 45 LYS CA C 13 58.84 0.31 . 1 . . . . 45 LYS CA . 18772 1 199 . 1 1 45 45 LYS CB C 13 32.08 0.31 . 1 . . . . 45 LYS CB . 18772 1 200 . 1 1 45 45 LYS N N 15 123.03 0.14 . 1 . . . . 45 LYS N . 18772 1 201 . 1 1 46 46 ILE H H 1 7.40 0.03 . 1 . . . . 46 ILE H . 18772 1 202 . 1 1 46 46 ILE C C 13 178.40 0.31 . 1 . . . . 46 ILE C . 18772 1 203 . 1 1 46 46 ILE CA C 13 63.83 0.31 . 1 . . . . 46 ILE CA . 18772 1 204 . 1 1 46 46 ILE CB C 13 38.30 0.31 . 1 . . . . 46 ILE CB . 18772 1 205 . 1 1 46 46 ILE N N 15 119.21 0.14 . 1 . . . . 46 ILE N . 18772 1 206 . 1 1 47 47 SER H H 1 8.11 0.03 . 1 . . . . 47 SER H . 18772 1 207 . 1 1 47 47 SER C C 13 176.99 0.31 . 1 . . . . 47 SER C . 18772 1 208 . 1 1 47 47 SER CA C 13 61.98 0.31 . 1 . . . . 47 SER CA . 18772 1 209 . 1 1 47 47 SER N N 15 116.24 0.14 . 1 . . . . 47 SER N . 18772 1 210 . 1 1 48 48 GLY H H 1 8.17 0.03 . 1 . . . . 48 GLY H . 18772 1 211 . 1 1 48 48 GLY CA C 13 47.57 0.31 . 1 . . . . 48 GLY CA . 18772 1 212 . 1 1 48 48 GLY N N 15 111.15 0.14 . 1 . . . . 48 GLY N . 18772 1 213 . 1 1 49 49 GLN H H 1 7.37 0.03 . 1 . . . . 49 GLN H . 18772 1 214 . 1 1 49 49 GLN C C 13 178.57 0.31 . 1 . . . . 49 GLN C . 18772 1 215 . 1 1 49 49 GLN CA C 13 58.80 0.31 . 1 . . . . 49 GLN CA . 18772 1 216 . 1 1 49 49 GLN CB C 13 28.53 0.31 . 1 . . . . 49 GLN CB . 18772 1 217 . 1 1 49 49 GLN N N 15 121.75 0.14 . 1 . . . . 49 GLN N . 18772 1 218 . 1 1 50 50 LYS H H 1 7.89 0.03 . 1 . . . . 50 LYS H . 18772 1 219 . 1 1 50 50 LYS C C 13 179.50 0.31 . 1 . . . . 50 LYS C . 18772 1 220 . 1 1 50 50 LYS CA C 13 59.43 0.31 . 1 . . . . 50 LYS CA . 18772 1 221 . 1 1 50 50 LYS CB C 13 32.64 0.31 . 1 . . . . 50 LYS CB . 18772 1 222 . 1 1 50 50 LYS N N 15 119.21 0.14 . 1 . . . . 50 LYS N . 18772 1 223 . 1 1 51 51 ALA H H 1 7.59 0.03 . 1 . . . . 51 ALA H . 18772 1 224 . 1 1 51 51 ALA C C 13 177.62 0.31 . 1 . . . . 51 ALA C . 18772 1 225 . 1 1 51 51 ALA CA C 13 54.76 0.31 . 1 . . . . 51 ALA CA . 18772 1 226 . 1 1 51 51 ALA CB C 13 19.76 0.31 . 1 . . . . 51 ALA CB . 18772 1 227 . 1 1 51 51 ALA N N 15 121.47 0.14 . 1 . . . . 51 ALA N . 18772 1 228 . 1 1 52 52 MET H H 1 7.81 0.03 . 1 . . . . 52 MET H . 18772 1 229 . 1 1 52 52 MET C C 13 178.68 0.31 . 1 . . . . 52 MET C . 18772 1 230 . 1 1 52 52 MET CA C 13 58.71 0.31 . 1 . . . . 52 MET CA . 18772 1 231 . 1 1 52 52 MET CB C 13 32.17 0.31 . 1 . . . . 52 MET CB . 18772 1 232 . 1 1 52 52 MET N N 15 118.93 0.14 . 1 . . . . 52 MET N . 18772 1 233 . 1 1 53 53 TYR H H 1 7.65 0.03 . 1 . . . . 53 TYR H . 18772 1 234 . 1 1 53 53 TYR C C 13 178.24 0.31 . 1 . . . . 53 TYR C . 18772 1 235 . 1 1 53 53 TYR CA C 13 60.47 0.31 . 1 . . . . 53 TYR CA . 18772 1 236 . 1 1 53 53 TYR CB C 13 37.78 0.31 . 1 . . . . 53 TYR CB . 18772 1 237 . 1 1 53 53 TYR N N 15 119.21 0.14 . 1 . . . . 53 TYR N . 18772 1 238 . 1 1 54 54 ALA H H 1 7.97 0.03 . 1 . . . . 54 ALA H . 18772 1 239 . 1 1 54 54 ALA C C 13 179.62 0.31 . 1 . . . . 54 ALA C . 18772 1 240 . 1 1 54 54 ALA CA C 13 54.48 0.31 . 1 . . . . 54 ALA CA . 18772 1 241 . 1 1 54 54 ALA CB C 13 18.45 0.31 . 1 . . . . 54 ALA CB . 18772 1 242 . 1 1 54 54 ALA N N 15 122.46 0.14 . 1 . . . . 54 ALA N . 18772 1 243 . 1 1 55 55 LEU H H 1 7.87 0.03 . 1 . . . . 55 LEU H . 18772 1 244 . 1 1 55 55 LEU C C 13 178.34 0.31 . 1 . . . . 55 LEU C . 18772 1 245 . 1 1 55 55 LEU CA C 13 57.49 0.31 . 1 . . . . 55 LEU CA . 18772 1 246 . 1 1 55 55 LEU CB C 13 41.99 0.31 . 1 . . . . 55 LEU CB . 18772 1 247 . 1 1 55 55 LEU N N 15 119.49 0.14 . 1 . . . . 55 LEU N . 18772 1 248 . 1 1 56 56 LYS H H 1 7.07 0.03 . 1 . . . . 56 LYS H . 18772 1 249 . 1 1 56 56 LYS C C 13 177.88 0.31 . 1 . . . . 56 LYS C . 18772 1 250 . 1 1 56 56 LYS CA C 13 58.34 0.31 . 1 . . . . 56 LYS CA . 18772 1 251 . 1 1 56 56 LYS CB C 13 32.21 0.31 . 1 . . . . 56 LYS CB . 18772 1 252 . 1 1 56 56 LYS N N 15 117.79 0.14 . 1 . . . . 56 LYS N . 18772 1 253 . 1 1 57 57 SER H H 1 7.26 0.03 . 1 . . . . 57 SER H . 18772 1 254 . 1 1 57 57 SER C C 13 174.25 0.31 . 1 . . . . 57 SER C . 18772 1 255 . 1 1 57 57 SER CA C 13 59.98 0.31 . 1 . . . . 57 SER CA . 18772 1 256 . 1 1 57 57 SER CB C 13 63.94 0.31 . 1 . . . . 57 SER CB . 18772 1 257 . 1 1 57 57 SER N N 15 113.41 0.14 . 1 . . . . 57 SER N . 18772 1 258 . 1 1 58 58 LYS H H 1 7.18 0.03 . 1 . . . . 58 LYS H . 18772 1 259 . 1 1 58 58 LYS C C 13 173.90 0.31 . 1 . . . . 58 LYS C . 18772 1 260 . 1 1 58 58 LYS CA C 13 57.23 0.31 . 1 . . . . 58 LYS CA . 18772 1 261 . 1 1 58 58 LYS CB C 13 30.16 0.31 . 1 . . . . 58 LYS CB . 18772 1 262 . 1 1 58 58 LYS N N 15 115.81 0.14 . 1 . . . . 58 LYS N . 18772 1 263 . 1 1 59 59 ASP H H 1 7.46 0.03 . 1 . . . . 59 ASP H . 18772 1 264 . 1 1 59 59 ASP C C 13 175.56 0.31 . 1 . . . . 59 ASP C . 18772 1 265 . 1 1 59 59 ASP CA C 13 53.17 0.31 . 1 . . . . 59 ASP CA . 18772 1 266 . 1 1 59 59 ASP CB C 13 43.18 0.31 . 1 . . . . 59 ASP CB . 18772 1 267 . 1 1 59 59 ASP N N 15 119.77 0.14 . 1 . . . . 59 ASP N . 18772 1 268 . 1 1 60 60 PHE H H 1 8.66 0.03 . 1 . . . . 60 PHE H . 18772 1 269 . 1 1 60 60 PHE C C 13 177.23 0.31 . 1 . . . . 60 PHE C . 18772 1 270 . 1 1 60 60 PHE CA C 13 62.44 0.31 . 1 . . . . 60 PHE CA . 18772 1 271 . 1 1 60 60 PHE CB C 13 39.69 0.31 . 1 . . . . 60 PHE CB . 18772 1 272 . 1 1 60 60 PHE N N 15 129.39 0.14 . 1 . . . . 60 PHE N . 18772 1 273 . 1 1 61 61 LYS H H 1 7.97 0.03 . 1 . . . . 61 LYS H . 18772 1 274 . 1 1 61 61 LYS C C 13 179.27 0.31 . 1 . . . . 61 LYS C . 18772 1 275 . 1 1 61 61 LYS CA C 13 59.66 0.31 . 1 . . . . 61 LYS CA . 18772 1 276 . 1 1 61 61 LYS CB C 13 31.96 0.31 . 1 . . . . 61 LYS CB . 18772 1 277 . 1 1 61 61 LYS N N 15 121.19 0.14 . 1 . . . . 61 LYS N . 18772 1 278 . 1 1 62 62 LYS H H 1 8.06 0.03 . 1 . . . . 62 LYS H . 18772 1 279 . 1 1 62 62 LYS C C 13 180.53 0.31 . 1 . . . . 62 LYS C . 18772 1 280 . 1 1 62 62 LYS CA C 13 59.20 0.31 . 1 . . . . 62 LYS CA . 18772 1 281 . 1 1 62 62 LYS CB C 13 32.27 0.31 . 1 . . . . 62 LYS CB . 18772 1 282 . 1 1 62 62 LYS N N 15 119.07 0.14 . 1 . . . . 62 LYS N . 18772 1 283 . 1 1 63 63 MET H H 1 8.52 0.03 . 1 . . . . 63 MET H . 18772 1 284 . 1 1 63 63 MET C C 13 176.71 0.31 . 1 . . . . 63 MET C . 18772 1 285 . 1 1 63 63 MET CA C 13 60.26 0.31 . 1 . . . . 63 MET CA . 18772 1 286 . 1 1 63 63 MET CB C 13 34.35 0.31 . 1 . . . . 63 MET CB . 18772 1 287 . 1 1 63 63 MET N N 15 118.22 0.14 . 1 . . . . 63 MET N . 18772 1 288 . 1 1 64 64 SER H H 1 7.87 0.03 . 1 . . . . 64 SER H . 18772 1 289 . 1 1 64 64 SER C C 13 173.92 0.31 . 1 . . . . 64 SER C . 18772 1 290 . 1 1 64 64 SER CA C 13 62.12 0.31 . 1 . . . . 64 SER CA . 18772 1 291 . 1 1 64 64 SER N N 15 116.38 0.14 . 1 . . . . 64 SER N . 18772 1 292 . 1 1 65 65 GLU H H 1 7.46 0.03 . 1 . . . . 65 GLU H . 18772 1 293 . 1 1 65 65 GLU C C 13 178.11 0.31 . 1 . . . . 65 GLU C . 18772 1 294 . 1 1 65 65 GLU CA C 13 58.79 0.31 . 1 . . . . 65 GLU CA . 18772 1 295 . 1 1 65 65 GLU CB C 13 29.82 0.31 . 1 . . . . 65 GLU CB . 18772 1 296 . 1 1 65 65 GLU N N 15 121.75 0.14 . 1 . . . . 65 GLU N . 18772 1 297 . 1 1 66 66 ALA H H 1 7.62 0.03 . 1 . . . . 66 ALA H . 18772 1 298 . 1 1 66 66 ALA C C 13 179.11 0.31 . 1 . . . . 66 ALA C . 18772 1 299 . 1 1 66 66 ALA CA C 13 54.06 0.31 . 1 . . . . 66 ALA CA . 18772 1 300 . 1 1 66 66 ALA CB C 13 18.87 0.31 . 1 . . . . 66 ALA CB . 18772 1 301 . 1 1 66 66 ALA N N 15 120.06 0.14 . 1 . . . . 66 ALA N . 18772 1 302 . 1 1 67 67 LYS H H 1 8.00 0.03 . 1 . . . . 67 LYS H . 18772 1 303 . 1 1 67 67 LYS C C 13 176.52 0.31 . 1 . . . . 67 LYS C . 18772 1 304 . 1 1 67 67 LYS CA C 13 59.66 0.31 . 1 . . . . 67 LYS CA . 18772 1 305 . 1 1 67 67 LYS CB C 13 32.29 0.31 . 1 . . . . 67 LYS CB . 18772 1 306 . 1 1 67 67 LYS N N 15 119.63 0.14 . 1 . . . . 67 LYS N . 18772 1 307 . 1 1 68 68 TYR H H 1 7.07 0.03 . 1 . . . . 68 TYR H . 18772 1 308 . 1 1 68 68 TYR C C 13 177.84 0.31 . 1 . . . . 68 TYR C . 18772 1 309 . 1 1 68 68 TYR CA C 13 60.82 0.31 . 1 . . . . 68 TYR CA . 18772 1 310 . 1 1 68 68 TYR CB C 13 37.80 0.31 . 1 . . . . 68 TYR CB . 18772 1 311 . 1 1 68 68 TYR N N 15 117.65 0.14 . 1 . . . . 68 TYR N . 18772 1 312 . 1 1 69 69 GLN H H 1 7.65 0.03 . 1 . . . . 69 GLN H . 18772 1 313 . 1 1 69 69 GLN C C 13 178.16 0.31 . 1 . . . . 69 GLN C . 18772 1 314 . 1 1 69 69 GLN CA C 13 58.16 0.31 . 1 . . . . 69 GLN CA . 18772 1 315 . 1 1 69 69 GLN CB C 13 27.87 0.31 . 1 . . . . 69 GLN CB . 18772 1 316 . 1 1 69 69 GLN N N 15 117.37 0.14 . 1 . . . . 69 GLN N . 18772 1 317 . 1 1 70 70 LEU H H 1 7.78 0.03 . 1 . . . . 70 LEU H . 18772 1 318 . 1 1 70 70 LEU C C 13 176.06 0.31 . 1 . . . . 70 LEU C . 18772 1 319 . 1 1 70 70 LEU CA C 13 56.48 0.31 . 1 . . . . 70 LEU CA . 18772 1 320 . 1 1 70 70 LEU CB C 13 42.30 0.31 . 1 . . . . 70 LEU CB . 18772 1 321 . 1 1 70 70 LEU N N 15 121.05 0.14 . 1 . . . . 70 LEU N . 18772 1 322 . 1 1 71 71 GLN H H 1 7.57 0.03 . 1 . . . . 71 GLN H . 18772 1 323 . 1 1 71 71 GLN C C 13 177.83 0.31 . 1 . . . . 71 GLN C . 18772 1 324 . 1 1 71 71 GLN CA C 13 58.52 0.31 . 1 . . . . 71 GLN CA . 18772 1 325 . 1 1 71 71 GLN CB C 13 28.91 0.31 . 1 . . . . 71 GLN CB . 18772 1 326 . 1 1 71 71 GLN N N 15 115.67 0.14 . 1 . . . . 71 GLN N . 18772 1 327 . 1 1 72 72 LYS H H 1 7.32 0.03 . 1 . . . . 72 LYS H . 18772 1 328 . 1 1 72 72 LYS C C 13 178.41 0.31 . 1 . . . . 72 LYS C . 18772 1 329 . 1 1 72 72 LYS CA C 13 59.24 0.31 . 1 . . . . 72 LYS CA . 18772 1 330 . 1 1 72 72 LYS CB C 13 32.77 0.31 . 1 . . . . 72 LYS CB . 18772 1 331 . 1 1 72 72 LYS N N 15 118.64 0.14 . 1 . . . . 72 LYS N . 18772 1 332 . 1 1 73 73 ILE H H 1 7.26 0.03 . 1 . . . . 73 ILE H . 18772 1 333 . 1 1 73 73 ILE C C 13 176.83 0.31 . 1 . . . . 73 ILE C . 18772 1 334 . 1 1 73 73 ILE CA C 13 59.96 0.31 . 1 . . . . 73 ILE CA . 18772 1 335 . 1 1 73 73 ILE CB C 13 37.54 0.31 . 1 . . . . 73 ILE CB . 18772 1 336 . 1 1 73 73 ILE N N 15 116.95 0.14 . 1 . . . . 73 ILE N . 18772 1 337 . 1 1 74 74 TYR H H 1 7.97 0.03 . 1 . . . . 74 TYR H . 18772 1 338 . 1 1 74 74 TYR C C 13 178.88 0.31 . 1 . . . . 74 TYR C . 18772 1 339 . 1 1 74 74 TYR CA C 13 58.16 0.31 . 1 . . . . 74 TYR CA . 18772 1 340 . 1 1 74 74 TYR CB C 13 35.10 0.31 . 1 . . . . 74 TYR CB . 18772 1 341 . 1 1 74 74 TYR N N 15 124.16 0.14 . 1 . . . . 74 TYR N . 18772 1 342 . 1 1 75 75 ASN H H 1 7.95 0.03 . 1 . . . . 75 ASN H . 18772 1 343 . 1 1 75 75 ASN C C 13 177.32 0.31 . 1 . . . . 75 ASN C . 18772 1 344 . 1 1 75 75 ASN CA C 13 56.01 0.31 . 1 . . . . 75 ASN CA . 18772 1 345 . 1 1 75 75 ASN CB C 13 38.26 0.31 . 1 . . . . 75 ASN CB . 18772 1 346 . 1 1 75 75 ASN N N 15 119.35 0.14 . 1 . . . . 75 ASN N . 18772 1 347 . 1 1 76 76 GLU H H 1 8.17 0.03 . 1 . . . . 76 GLU H . 18772 1 348 . 1 1 76 76 GLU C C 13 180.06 0.31 . 1 . . . . 76 GLU C . 18772 1 349 . 1 1 76 76 GLU CA C 13 59.43 0.31 . 1 . . . . 76 GLU CA . 18772 1 350 . 1 1 76 76 GLU CB C 13 30.23 0.31 . 1 . . . . 76 GLU CB . 18772 1 351 . 1 1 76 76 GLU N N 15 121.19 0.14 . 1 . . . . 76 GLU N . 18772 1 352 . 1 1 77 77 ILE H H 1 8.36 0.03 . 1 . . . . 77 ILE H . 18772 1 353 . 1 1 77 77 ILE C C 13 175.86 0.31 . 1 . . . . 77 ILE C . 18772 1 354 . 1 1 77 77 ILE CA C 13 65.58 0.31 . 1 . . . . 77 ILE CA . 18772 1 355 . 1 1 77 77 ILE CB C 13 38.57 0.31 . 1 . . . . 77 ILE CB . 18772 1 356 . 1 1 77 77 ILE N N 15 122.46 0.14 . 1 . . . . 77 ILE N . 18772 1 357 . 1 1 78 78 ASP H H 1 7.32 0.03 . 1 . . . . 78 ASP H . 18772 1 358 . 1 1 78 78 ASP C C 13 178.38 0.31 . 1 . . . . 78 ASP C . 18772 1 359 . 1 1 78 78 ASP CA C 13 57.56 0.31 . 1 . . . . 78 ASP CA . 18772 1 360 . 1 1 78 78 ASP CB C 13 42.02 0.31 . 1 . . . . 78 ASP CB . 18772 1 361 . 1 1 78 78 ASP N N 15 118.78 0.14 . 1 . . . . 78 ASP N . 18772 1 362 . 1 1 79 79 GLU H H 1 7.68 0.03 . 1 . . . . 79 GLU H . 18772 1 363 . 1 1 79 79 GLU C C 13 178.81 0.31 . 1 . . . . 79 GLU C . 18772 1 364 . 1 1 79 79 GLU CA C 13 58.79 0.31 . 1 . . . . 79 GLU CA . 18772 1 365 . 1 1 79 79 GLU CB C 13 29.83 0.31 . 1 . . . . 79 GLU CB . 18772 1 366 . 1 1 79 79 GLU N N 15 116.38 0.14 . 1 . . . . 79 GLU N . 18772 1 367 . 1 1 80 80 ALA H H 1 7.65 0.03 . 1 . . . . 80 ALA H . 18772 1 368 . 1 1 80 80 ALA C C 13 180.19 0.31 . 1 . . . . 80 ALA C . 18772 1 369 . 1 1 80 80 ALA CA C 13 54.29 0.31 . 1 . . . . 80 ALA CA . 18772 1 370 . 1 1 80 80 ALA CB C 13 18.73 0.31 . 1 . . . . 80 ALA CB . 18772 1 371 . 1 1 80 80 ALA N N 15 122.74 0.14 . 1 . . . . 80 ALA N . 18772 1 372 . 1 1 81 81 LEU H H 1 7.63 0.03 . 1 . . . . 81 LEU H . 18772 1 373 . 1 1 81 81 LEU C C 13 178.41 0.31 . 1 . . . . 81 LEU C . 18772 1 374 . 1 1 81 81 LEU CA C 13 56.19 0.31 . 1 . . . . 81 LEU CA . 18772 1 375 . 1 1 81 81 LEU CB C 13 42.16 0.31 . 1 . . . . 81 LEU CB . 18772 1 376 . 1 1 81 81 LEU N N 15 117.94 0.14 . 1 . . . . 81 LEU N . 18772 1 377 . 1 1 82 82 LYS H H 1 7.13 0.03 . 1 . . . . 82 LYS H . 18772 1 378 . 1 1 82 82 LYS C C 13 176.61 0.31 . 1 . . . . 82 LYS C . 18772 1 379 . 1 1 82 82 LYS CA C 13 57.08 0.31 . 1 . . . . 82 LYS CA . 18772 1 380 . 1 1 82 82 LYS CB C 13 32.94 0.31 . 1 . . . . 82 LYS CB . 18772 1 381 . 1 1 82 82 LYS N N 15 118.36 0.14 . 1 . . . . 82 LYS N . 18772 1 382 . 1 1 83 83 SER H H 1 7.28 0.03 . 1 . . . . 83 SER H . 18772 1 383 . 1 1 83 83 SER C C 13 173.09 0.31 . 1 . . . . 83 SER C . 18772 1 384 . 1 1 83 83 SER CA C 13 58.28 0.31 . 1 . . . . 83 SER CA . 18772 1 385 . 1 1 83 83 SER CB C 13 63.85 0.31 . 1 . . . . 83 SER CB . 18772 1 386 . 1 1 83 83 SER N N 15 115.25 0.14 . 1 . . . . 83 SER N . 18772 1 387 . 1 1 84 84 LYS H H 1 7.35 0.03 . 1 . . . . 84 LYS H . 18772 1 388 . 1 1 84 84 LYS C C 13 174.81 0.31 . 1 . . . . 84 LYS C . 18772 1 389 . 1 1 84 84 LYS CA C 13 55.85 0.31 . 1 . . . . 84 LYS CA . 18772 1 390 . 1 1 84 84 LYS CB C 13 32.82 0.31 . 1 . . . . 84 LYS CB . 18772 1 391 . 1 1 84 84 LYS N N 15 122.32 0.14 . 1 . . . . 84 LYS N . 18772 1 392 . 1 1 85 85 TYR H H 1 7.13 0.03 . 1 . . . . 85 TYR H . 18772 1 393 . 1 1 85 85 TYR C C 13 180.09 0.31 . 1 . . . . 85 TYR C . 18772 1 394 . 1 1 85 85 TYR CA C 13 58.60 0.31 . 1 . . . . 85 TYR CA . 18772 1 395 . 1 1 85 85 TYR CB C 13 39.46 0.31 . 1 . . . . 85 TYR CB . 18772 1 396 . 1 1 85 85 TYR N N 15 125.71 0.14 . 1 . . . . 85 TYR N . 18772 1 stop_ save_