################################### # 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 4097 _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_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one _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 $sample_one . 4097 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 2 2 TYR CA C 13 57.3 0.06 . 1 . . . . . . . . 4097 1 2 . 1 1 2 2 TYR CB C 13 39.4 0.06 . 1 . . . . . . . . 4097 1 3 . 1 1 3 3 GLN N N 15 121.1 0.06 . 1 . . . . . . . . 4097 1 4 . 1 1 3 3 GLN H H 1 8.21 0.02 . 1 . . . . . . . . 4097 1 5 . 1 1 3 3 GLN CA C 13 54.3 0.06 . 1 . . . . . . . . 4097 1 6 . 1 1 3 3 GLN CB C 13 30.9 0.06 . 1 . . . . . . . . 4097 1 7 . 1 1 4 4 LEU N N 15 125.8 0.06 . 1 . . . . . . . . 4097 1 8 . 1 1 4 4 LEU H H 1 8.54 0.02 . 1 . . . . . . . . 4097 1 9 . 1 1 4 4 LEU CA C 13 54.1 0.06 . 1 . . . . . . . . 4097 1 10 . 1 1 4 4 LEU CB C 13 42.1 0.06 . 1 . . . . . . . . 4097 1 11 . 1 1 5 5 GLU N N 15 122.6 0.06 . 1 . . . . . . . . 4097 1 12 . 1 1 5 5 GLU H H 1 9.09 0.02 . 1 . . . . . . . . 4097 1 13 . 1 1 5 5 GLU CA C 13 54.9 0.06 . 1 . . . . . . . . 4097 1 14 . 1 1 5 5 GLU CB C 13 30.6 0.06 . 1 . . . . . . . . 4097 1 15 . 1 1 6 6 LYS N N 15 119.5 0.06 . 1 . . . . . . . . 4097 1 16 . 1 1 6 6 LYS H H 1 8.89 0.02 . 1 . . . . . . . . 4097 1 17 . 1 1 6 6 LYS CA C 13 56.9 0.06 . 1 . . . . . . . . 4097 1 18 . 1 1 6 6 LYS CB C 13 33.3 0.06 . 1 . . . . . . . . 4097 1 19 . 1 1 7 7 GLU N N 15 117.2 0.06 . 1 . . . . . . . . 4097 1 20 . 1 1 7 7 GLU H H 1 7.56 0.02 . 1 . . . . . . . . 4097 1 21 . 1 1 7 7 GLU CA C 13 52.8 0.06 . 1 . . . . . . . . 4097 1 22 . 1 1 8 8 PRO CA C 13 62.1 0.06 . 1 . . . . . . . . 4097 1 23 . 1 1 8 8 PRO CB C 13 31.1 0.06 . 1 . . . . . . . . 4097 1 24 . 1 1 9 9 ILE N N 15 124.9 0.06 . 1 . . . . . . . . 4097 1 25 . 1 1 9 9 ILE H H 1 9.37 0.02 . 1 . . . . . . . . 4097 1 26 . 1 1 9 9 ILE CA C 13 60.9 0.06 . 1 . . . . . . . . 4097 1 27 . 1 1 9 9 ILE CB C 13 38.5 0.06 . 1 . . . . . . . . 4097 1 28 . 1 1 10 10 VAL N N 15 132.3 0.06 . 1 . . . . . . . . 4097 1 29 . 1 1 10 10 VAL H H 1 8.7 0.02 . 1 . . . . . . . . 4097 1 30 . 1 1 10 10 VAL CA C 13 64.9 0.06 . 1 . . . . . . . . 4097 1 31 . 1 1 10 10 VAL CB C 13 31.1 0.06 . 1 . . . . . . . . 4097 1 32 . 1 1 11 11 GLY N N 15 115.1 0.06 . 1 . . . . . . . . 4097 1 33 . 1 1 11 11 GLY H H 1 8.86 0.02 . 1 . . . . . . . . 4097 1 34 . 1 1 11 11 GLY CA C 13 45.1 0.06 . 1 . . . . . . . . 4097 1 35 . 1 1 12 12 ALA N N 15 122.1 0.06 . 1 . . . . . . . . 4097 1 36 . 1 1 12 12 ALA H H 1 7.07 0.02 . 1 . . . . . . . . 4097 1 37 . 1 1 12 12 ALA CA C 13 50.6 0.06 . 1 . . . . . . . . 4097 1 38 . 1 1 12 12 ALA CB C 13 19.1 0.06 . 1 . . . . . . . . 4097 1 39 . 1 1 13 13 GLU N N 15 125.6 0.06 . 1 . . . . . . . . 4097 1 40 . 1 1 13 13 GLU H H 1 8.92 0.02 . 1 . . . . . . . . 4097 1 41 . 1 1 13 13 GLU CA C 13 57.3 0.06 . 1 . . . . . . . . 4097 1 42 . 1 1 13 13 GLU CB C 13 31 0.06 . 1 . . . . . . . . 4097 1 43 . 1 1 14 14 THR N N 15 121.9 0.06 . 1 . . . . . . . . 4097 1 44 . 1 1 14 14 THR H H 1 8.59 0.02 . 1 . . . . . . . . 4097 1 45 . 1 1 14 14 THR CA C 13 61.4 0.06 . 1 . . . . . . . . 4097 1 46 . 1 1 14 14 THR CB C 13 70.1 0.06 . 1 . . . . . . . . 4097 1 47 . 1 1 15 15 PHE N N 15 127.2 0.06 . 1 . . . . . . . . 4097 1 48 . 1 1 15 15 PHE H H 1 9.4 0.02 . 1 . . . . . . . . 4097 1 49 . 1 1 15 15 PHE CA C 13 56 0.06 . 1 . . . . . . . . 4097 1 50 . 1 1 15 15 PHE CB C 13 41 0.06 . 1 . . . . . . . . 4097 1 51 . 1 1 16 16 TYR N N 15 125 0.06 . 1 . . . . . . . . 4097 1 52 . 1 1 16 16 TYR H H 1 9.25 0.02 . 1 . . . . . . . . 4097 1 53 . 1 1 16 16 TYR CA C 13 57.1 0.06 . 1 . . . . . . . . 4097 1 54 . 1 1 17 17 VAL N N 15 114.9 0.06 . 1 . . . . . . . . 4097 1 55 . 1 1 17 17 VAL H H 1 8.42 0.02 . 1 . . . . . . . . 4097 1 56 . 1 1 17 17 VAL CA C 13 58.6 0.06 . 1 . . . . . . . . 4097 1 57 . 1 1 17 17 VAL CB C 13 33.6 0.06 . 1 . . . . . . . . 4097 1 58 . 1 1 18 18 ASP N N 15 118.8 0.06 . 1 . . . . . . . . 4097 1 59 . 1 1 18 18 ASP H H 1 8.59 0.02 . 1 . . . . . . . . 4097 1 60 . 1 1 18 18 ASP CA C 13 52.9 0.06 . 1 . . . . . . . . 4097 1 61 . 1 1 18 18 ASP CB C 13 43.6 0.06 . 1 . . . . . . . . 4097 1 62 . 1 1 19 19 GLY N N 15 108.9 0.06 . 1 . . . . . . . . 4097 1 63 . 1 1 19 19 GLY H H 1 7.96 0.02 . 1 . . . . . . . . 4097 1 64 . 1 1 19 19 GLY CA C 13 45.9 0.06 . 1 . . . . . . . . 4097 1 65 . 1 1 20 20 ALA N N 15 122.8 0.06 . 1 . . . . . . . . 4097 1 66 . 1 1 20 20 ALA H H 1 8.51 0.02 . 1 . . . . . . . . 4097 1 67 . 1 1 20 20 ALA CA C 13 51.8 0.06 . 1 . . . . . . . . 4097 1 68 . 1 1 20 20 ALA CB C 13 22.8 0.06 . 1 . . . . . . . . 4097 1 69 . 1 1 21 21 ALA N N 15 119.9 0.06 . 1 . . . . . . . . 4097 1 70 . 1 1 21 21 ALA H H 1 8.31 0.02 . 1 . . . . . . . . 4097 1 71 . 1 1 21 21 ALA CA C 13 63.5 0.06 . 1 . . . . . . . . 4097 1 72 . 1 1 21 21 ALA CB C 13 22.6 0.06 . 1 . . . . . . . . 4097 1 73 . 1 1 22 22 ASN N N 15 121.2 0.06 . 1 . . . . . . . . 4097 1 74 . 1 1 22 22 ASN H H 1 8.67 0.02 . 1 . . . . . . . . 4097 1 75 . 1 1 22 22 ASN CA C 13 52.3 0.06 . 1 . . . . . . . . 4097 1 76 . 1 1 22 22 ASN CB C 13 40.6 0.06 . 1 . . . . . . . . 4097 1 77 . 1 1 23 23 ARG N N 15 127.9 0.06 . 1 . . . . . . . . 4097 1 78 . 1 1 23 23 ARG H H 1 9.16 0.02 . 1 . . . . . . . . 4097 1 79 . 1 1 23 23 ARG CA C 13 58.7 0.06 . 1 . . . . . . . . 4097 1 80 . 1 1 23 23 ARG CB C 13 30.3 0.06 . 1 . . . . . . . . 4097 1 81 . 1 1 24 24 GLU N N 15 117.5 0.06 . 1 . . . . . . . . 4097 1 82 . 1 1 24 24 GLU H H 1 8.43 0.02 . 1 . . . . . . . . 4097 1 83 . 1 1 24 24 GLU CA C 13 58.7 0.06 . 1 . . . . . . . . 4097 1 84 . 1 1 24 24 GLU CB C 13 29.7 0.06 . 1 . . . . . . . . 4097 1 85 . 1 1 25 25 THR N N 15 108.2 0.06 . 1 . . . . . . . . 4097 1 86 . 1 1 25 25 THR H H 1 8.21 0.02 . 1 . . . . . . . . 4097 1 87 . 1 1 25 25 THR CA C 13 61.9 0.06 . 1 . . . . . . . . 4097 1 88 . 1 1 25 25 THR CB C 13 70.3 0.06 . 1 . . . . . . . . 4097 1 89 . 1 1 26 26 LYS N N 15 115.5 0.06 . 1 . . . . . . . . 4097 1 90 . 1 1 26 26 LYS H H 1 8.12 0.02 . 1 . . . . . . . . 4097 1 91 . 1 1 26 26 LYS CA C 13 57.8 0.06 . 1 . . . . . . . . 4097 1 92 . 1 1 26 26 LYS CB C 13 29 0.06 . 1 . . . . . . . . 4097 1 93 . 1 1 27 27 LEU N N 15 117.6 0.06 . 1 . . . . . . . . 4097 1 94 . 1 1 27 27 LEU H H 1 7.5 0.02 . 1 . . . . . . . . 4097 1 95 . 1 1 27 27 LEU CA C 13 54.1 0.06 . 1 . . . . . . . . 4097 1 96 . 1 1 27 27 LEU CB C 13 45.9 0.06 . 1 . . . . . . . . 4097 1 97 . 1 1 28 28 GLY N N 15 108.7 0.06 . 1 . . . . . . . . 4097 1 98 . 1 1 28 28 GLY H H 1 7.92 0.02 . 1 . . . . . . . . 4097 1 99 . 1 1 28 28 GLY CA C 13 45.9 0.06 . 1 . . . . . . . . 4097 1 100 . 1 1 29 29 LYS N N 15 119.4 0.06 . 1 . . . . . . . . 4097 1 101 . 1 1 29 29 LYS H H 1 9.02 0.02 . 1 . . . . . . . . 4097 1 102 . 1 1 29 29 LYS CA C 13 55.7 0.06 . 1 . . . . . . . . 4097 1 103 . 1 1 30 30 ALA N N 15 121 0.06 . 1 . . . . . . . . 4097 1 104 . 1 1 30 30 ALA H H 1 8.4 0.02 . 1 . . . . . . . . 4097 1 105 . 1 1 30 30 ALA CA C 13 50.1 0.06 . 1 . . . . . . . . 4097 1 106 . 1 1 30 30 ALA CB C 13 21.4 0.06 . 1 . . . . . . . . 4097 1 107 . 1 1 31 31 GLY N N 15 106.2 0.06 . 1 . . . . . . . . 4097 1 108 . 1 1 31 31 GLY H H 1 8.66 0.02 . 1 . . . . . . . . 4097 1 109 . 1 1 31 31 GLY CA C 13 46.8 0.06 . 1 . . . . . . . . 4097 1 110 . 1 1 32 32 TYR N N 15 111.2 0.06 . 1 . . . . . . . . 4097 1 111 . 1 1 32 32 TYR H H 1 8.54 0.02 . 1 . . . . . . . . 4097 1 112 . 1 1 32 32 TYR CA C 13 55.4 0.06 . 1 . . . . . . . . 4097 1 113 . 1 1 32 32 TYR CB C 13 43.3 0.06 . 1 . . . . . . . . 4097 1 114 . 1 1 33 33 VAL N N 15 115.3 0.06 . 1 . . . . . . . . 4097 1 115 . 1 1 33 33 VAL H H 1 8.77 0.02 . 1 . . . . . . . . 4097 1 116 . 1 1 33 33 VAL CA C 13 61 0.06 . 1 . . . . . . . . 4097 1 117 . 1 1 33 33 VAL CB C 13 36.1 0.06 . 1 . . . . . . . . 4097 1 118 . 1 1 34 34 THR N N 15 114.8 0.06 . 1 . . . . . . . . 4097 1 119 . 1 1 34 34 THR H H 1 9.06 0.02 . 1 . . . . . . . . 4097 1 120 . 1 1 34 34 THR CA C 13 57.5 0.06 . 1 . . . . . . . . 4097 1 121 . 1 1 34 34 THR CB C 13 72.8 0.06 . 1 . . . . . . . . 4097 1 122 . 1 1 35 35 ASN N N 15 119 0.06 . 1 . . . . . . . . 4097 1 123 . 1 1 35 35 ASN H H 1 9.14 0.02 . 1 . . . . . . . . 4097 1 124 . 1 1 35 35 ASN CA C 13 54.3 0.06 . 1 . . . . . . . . 4097 1 125 . 1 1 35 35 ASN CB C 13 37.5 0.06 . 1 . . . . . . . . 4097 1 126 . 1 1 36 36 LYS N N 15 118.1 0.06 . 1 . . . . . . . . 4097 1 127 . 1 1 36 36 LYS H H 1 8.04 0.02 . 1 . . . . . . . . 4097 1 128 . 1 1 36 36 LYS CA C 13 55 0.06 . 1 . . . . . . . . 4097 1 129 . 1 1 36 36 LYS CB C 13 32 0.06 . 1 . . . . . . . . 4097 1 130 . 1 1 37 37 GLY N N 15 107.6 0.06 . 1 . . . . . . . . 4097 1 131 . 1 1 37 37 GLY H H 1 7.88 0.02 . 1 . . . . . . . . 4097 1 132 . 1 1 37 37 GLY CA C 13 45.6 0.06 . 1 . . . . . . . . 4097 1 133 . 1 1 38 38 ARG N N 15 118.2 0.06 . 1 . . . . . . . . 4097 1 134 . 1 1 38 38 ARG H H 1 7.24 0.02 . 1 . . . . . . . . 4097 1 135 . 1 1 38 38 ARG CA C 13 56.3 0.06 . 1 . . . . . . . . 4097 1 136 . 1 1 38 38 ARG CB C 13 31.9 0.06 . 1 . . . . . . . . 4097 1 137 . 1 1 39 39 GLN N N 15 117.7 0.06 . 1 . . . . . . . . 4097 1 138 . 1 1 39 39 GLN H H 1 8.56 0.02 . 1 . . . . . . . . 4097 1 139 . 1 1 39 39 GLN CA C 13 54.7 0.06 . 1 . . . . . . . . 4097 1 140 . 1 1 39 39 GLN CB C 13 32.9 0.06 . 1 . . . . . . . . 4097 1 141 . 1 1 40 40 LYS N N 15 123.2 0.06 . 1 . . . . . . . . 4097 1 142 . 1 1 40 40 LYS H H 1 7.91 0.02 . 1 . . . . . . . . 4097 1 143 . 1 1 40 40 LYS CA C 13 56.5 0.06 . 1 . . . . . . . . 4097 1 144 . 1 1 40 40 LYS CB C 13 33.1 0.06 . 1 . . . . . . . . 4097 1 145 . 1 1 41 41 VAL N N 15 123.3 0.06 . 1 . . . . . . . . 4097 1 146 . 1 1 41 41 VAL H H 1 8.24 0.02 . 1 . . . . . . . . 4097 1 147 . 1 1 41 41 VAL CA C 13 60.5 0.06 . 1 . . . . . . . . 4097 1 148 . 1 1 41 41 VAL CB C 13 34.9 0.06 . 1 . . . . . . . . 4097 1 149 . 1 1 42 42 VAL N N 15 124.9 0.06 . 1 . . . . . . . . 4097 1 150 . 1 1 42 42 VAL H H 1 9.35 0.02 . 1 . . . . . . . . 4097 1 151 . 1 1 42 42 VAL CA C 13 57.6 0.06 . 1 . . . . . . . . 4097 1 152 . 1 1 43 43 PRO CA C 13 61.6 0.06 . 1 . . . . . . . . 4097 1 153 . 1 1 43 43 PRO CB C 13 32.3 0.06 . 1 . . . . . . . . 4097 1 154 . 1 1 44 44 LEU N N 15 122.1 0.06 . 1 . . . . . . . . 4097 1 155 . 1 1 44 44 LEU H H 1 8.56 0.02 . 1 . . . . . . . . 4097 1 156 . 1 1 44 44 LEU CA C 13 53.9 0.06 . 1 . . . . . . . . 4097 1 157 . 1 1 44 44 LEU CB C 13 46.9 0.06 . 1 . . . . . . . . 4097 1 158 . 1 1 45 45 THR N N 15 112.1 0.06 . 1 . . . . . . . . 4097 1 159 . 1 1 45 45 THR H H 1 8.23 0.02 . 1 . . . . . . . . 4097 1 160 . 1 1 45 45 THR CA C 13 59.8 0.06 . 1 . . . . . . . . 4097 1 161 . 1 1 45 45 THR CB C 13 71.4 0.06 . 1 . . . . . . . . 4097 1 162 . 1 1 46 46 ASN N N 15 120.7 0.06 . 1 . . . . . . . . 4097 1 163 . 1 1 46 46 ASN H H 1 8.71 0.02 . 1 . . . . . . . . 4097 1 164 . 1 1 46 46 ASN CA C 13 53.9 0.06 . 1 . . . . . . . . 4097 1 165 . 1 1 46 46 ASN CB C 13 37.3 0.06 . 1 . . . . . . . . 4097 1 166 . 1 1 47 47 THR N N 15 114.7 0.06 . 1 . . . . . . . . 4097 1 167 . 1 1 47 47 THR H H 1 9.09 0.02 . 1 . . . . . . . . 4097 1 168 . 1 1 47 47 THR CA C 13 59.8 0.06 . 1 . . . . . . . . 4097 1 169 . 1 1 47 47 THR CB C 13 70.2 0.06 . 1 . . . . . . . . 4097 1 170 . 1 1 48 48 THR N N 15 109.1 0.06 . 1 . . . . . . . . 4097 1 171 . 1 1 48 48 THR H H 1 8.15 0.02 . 1 . . . . . . . . 4097 1 172 . 1 1 48 48 THR CA C 13 58.5 0.06 . 1 . . . . . . . . 4097 1 173 . 1 1 48 48 THR CB C 13 73.1 0.06 . 1 . . . . . . . . 4097 1 174 . 1 1 49 49 ASN N N 15 121.7 0.06 . 1 . . . . . . . . 4097 1 175 . 1 1 49 49 ASN H H 1 9.2 0.02 . 1 . . . . . . . . 4097 1 176 . 1 1 49 49 ASN CA C 13 57.3 0.06 . 1 . . . . . . . . 4097 1 177 . 1 1 49 49 ASN CB C 13 38.2 0.06 . 1 . . . . . . . . 4097 1 178 . 1 1 50 50 GLN N N 15 118.7 0.06 . 1 . . . . . . . . 4097 1 179 . 1 1 50 50 GLN H H 1 8.65 0.02 . 1 . . . . . . . . 4097 1 180 . 1 1 50 50 GLN CA C 13 59.8 0.06 . 1 . . . . . . . . 4097 1 181 . 1 1 50 50 GLN CB C 13 28.4 0.06 . 1 . . . . . . . . 4097 1 182 . 1 1 51 51 LYS N N 15 117.5 0.06 . 1 . . . . . . . . 4097 1 183 . 1 1 51 51 LYS H H 1 7.5 0.02 . 1 . . . . . . . . 4097 1 184 . 1 1 51 51 LYS CA C 13 60.6 0.06 . 1 . . . . . . . . 4097 1 185 . 1 1 51 51 LYS CB C 13 32.4 0.06 . 1 . . . . . . . . 4097 1 186 . 1 1 52 52 THR N N 15 110.7 0.06 . 1 . . . . . . . . 4097 1 187 . 1 1 52 52 THR H H 1 8.33 0.02 . 1 . . . . . . . . 4097 1 188 . 1 1 52 52 THR CA C 13 52.9 0.06 . 1 . . . . . . . . 4097 1 189 . 1 1 52 52 THR CB C 13 68.4 0.06 . 1 . . . . . . . . 4097 1 190 . 1 1 53 53 GLU N N 15 121.4 0.06 . 1 . . . . . . . . 4097 1 191 . 1 1 53 53 GLU H H 1 7.56 0.02 . 1 . . . . . . . . 4097 1 192 . 1 1 53 53 GLU CA C 13 58.8 0.06 . 1 . . . . . . . . 4097 1 193 . 1 1 54 54 LEU N N 15 118.5 0.06 . 1 . . . . . . . . 4097 1 194 . 1 1 54 54 LEU H H 1 7.64 0.02 . 1 . . . . . . . . 4097 1 195 . 1 1 54 54 LEU CA C 13 57.6 0.06 . 1 . . . . . . . . 4097 1 196 . 1 1 54 54 LEU CB C 13 41.8 0.06 . 1 . . . . . . . . 4097 1 197 . 1 1 55 55 GLN N N 15 120.1 0.06 . 1 . . . . . . . . 4097 1 198 . 1 1 55 55 GLN H H 1 8.87 0.02 . 1 . . . . . . . . 4097 1 199 . 1 1 55 55 GLN CA C 13 58.6 0.06 . 1 . . . . . . . . 4097 1 200 . 1 1 55 55 GLN CB C 13 27.4 0.06 . 1 . . . . . . . . 4097 1 201 . 1 1 56 56 ALA N N 15 121.1 0.06 . 1 . . . . . . . . 4097 1 202 . 1 1 56 56 ALA H H 1 8.01 0.02 . 1 . . . . . . . . 4097 1 203 . 1 1 56 56 ALA CA C 13 55.7 0.06 . 1 . . . . . . . . 4097 1 204 . 1 1 56 56 ALA CB C 13 19.1 0.06 . 1 . . . . . . . . 4097 1 205 . 1 1 57 57 ILE N N 15 115.9 0.06 . 1 . . . . . . . . 4097 1 206 . 1 1 57 57 ILE H H 1 7.16 0.02 . 1 . . . . . . . . 4097 1 207 . 1 1 57 57 ILE CA C 13 65.6 0.06 . 1 . . . . . . . . 4097 1 208 . 1 1 57 57 ILE CB C 13 38 0.06 . 1 . . . . . . . . 4097 1 209 . 1 1 58 58 TYR N N 15 119.6 0.06 . 1 . . . . . . . . 4097 1 210 . 1 1 58 58 TYR H H 1 8.22 0.02 . 1 . . . . . . . . 4097 1 211 . 1 1 58 58 TYR CA C 13 61.2 0.06 . 1 . . . . . . . . 4097 1 212 . 1 1 58 58 TYR CB C 13 37.5 0.06 . 1 . . . . . . . . 4097 1 213 . 1 1 59 59 LEU N N 15 118.6 0.06 . 1 . . . . . . . . 4097 1 214 . 1 1 59 59 LEU H H 1 8.43 0.02 . 1 . . . . . . . . 4097 1 215 . 1 1 59 59 LEU CA C 13 57.5 0.06 . 1 . . . . . . . . 4097 1 216 . 1 1 59 59 LEU CB C 13 42.6 0.06 . 1 . . . . . . . . 4097 1 217 . 1 1 60 60 ALA N N 15 118.1 0.06 . 1 . . . . . . . . 4097 1 218 . 1 1 60 60 ALA H H 1 7.43 0.02 . 1 . . . . . . . . 4097 1 219 . 1 1 60 60 ALA CA C 13 53.8 0.06 . 1 . . . . . . . . 4097 1 220 . 1 1 60 60 ALA CB C 13 19.2 0.06 . 1 . . . . . . . . 4097 1 221 . 1 1 61 61 LEU N N 15 116.8 0.06 . 1 . . . . . . . . 4097 1 222 . 1 1 61 61 LEU H H 1 7.84 0.02 . 1 . . . . . . . . 4097 1 223 . 1 1 61 61 LEU CA C 13 57.5 0.06 . 1 . . . . . . . . 4097 1 224 . 1 1 61 61 LEU CB C 13 41.5 0.06 . 1 . . . . . . . . 4097 1 225 . 1 1 62 62 GLN N N 15 118 0.06 . 1 . . . . . . . . 4097 1 226 . 1 1 62 62 GLN H H 1 8.23 0.02 . 1 . . . . . . . . 4097 1 227 . 1 1 62 62 GLN CA C 13 58.9 0.06 . 1 . . . . . . . . 4097 1 228 . 1 1 62 62 GLN CB C 13 30 0.06 . 1 . . . . . . . . 4097 1 229 . 1 1 63 63 ASP N N 15 115.7 0.06 . 1 . . . . . . . . 4097 1 230 . 1 1 63 63 ASP H H 1 7.49 0.02 . 1 . . . . . . . . 4097 1 231 . 1 1 63 63 ASP CA C 13 54.3 0.06 . 1 . . . . . . . . 4097 1 232 . 1 1 63 63 ASP CB C 13 39.3 0.06 . 1 . . . . . . . . 4097 1 233 . 1 1 64 64 SER N N 15 113.2 0.06 . 1 . . . . . . . . 4097 1 234 . 1 1 64 64 SER H H 1 7.06 0.02 . 1 . . . . . . . . 4097 1 235 . 1 1 64 64 SER CA C 13 55.9 0.06 . 1 . . . . . . . . 4097 1 236 . 1 1 64 64 SER CB C 13 67.6 0.06 . 1 . . . . . . . . 4097 1 237 . 1 1 65 65 GLY N N 15 105.3 0.06 . 1 . . . . . . . . 4097 1 238 . 1 1 65 65 GLY H H 1 8.33 0.02 . 1 . . . . . . . . 4097 1 239 . 1 1 65 65 GLY CA C 13 43.8 0.06 . 1 . . . . . . . . 4097 1 240 . 1 1 66 66 LEU N N 15 117.9 0.06 . 1 . . . . . . . . 4097 1 241 . 1 1 66 66 LEU H H 1 8.42 0.02 . 1 . . . . . . . . 4097 1 242 . 1 1 66 66 LEU CA C 13 57.6 0.06 . 1 . . . . . . . . 4097 1 243 . 1 1 66 66 LEU CB C 13 42.9 0.06 . 1 . . . . . . . . 4097 1 244 . 1 1 67 67 GLU N N 15 115.2 0.06 . 1 . . . . . . . . 4097 1 245 . 1 1 67 67 GLU H H 1 7.67 0.02 . 1 . . . . . . . . 4097 1 246 . 1 1 67 67 GLU CA C 13 53.6 0.06 . 1 . . . . . . . . 4097 1 247 . 1 1 67 67 GLU CB C 13 31.3 0.06 . 1 . . . . . . . . 4097 1 248 . 1 1 68 68 VAL N N 15 119.6 0.06 . 1 . . . . . . . . 4097 1 249 . 1 1 68 68 VAL H H 1 8.04 0.02 . 1 . . . . . . . . 4097 1 250 . 1 1 68 68 VAL CA C 13 61 0.06 . 1 . . . . . . . . 4097 1 251 . 1 1 68 68 VAL CB C 13 34.9 0.06 . 1 . . . . . . . . 4097 1 252 . 1 1 69 69 ASN N N 15 123.2 0.06 . 1 . . . . . . . . 4097 1 253 . 1 1 69 69 ASN H H 1 7.79 0.02 . 1 . . . . . . . . 4097 1 254 . 1 1 69 69 ASN CA C 13 51.8 0.06 . 1 . . . . . . . . 4097 1 255 . 1 1 69 69 ASN CB C 13 41.5 0.06 . 1 . . . . . . . . 4097 1 256 . 1 1 70 70 ILE N N 15 125.2 0.06 . 1 . . . . . . . . 4097 1 257 . 1 1 70 70 ILE H H 1 9.76 0.02 . 1 . . . . . . . . 4097 1 258 . 1 1 70 70 ILE CA C 13 60.7 0.06 . 1 . . . . . . . . 4097 1 259 . 1 1 70 70 ILE CB C 13 40.6 0.06 . 1 . . . . . . . . 4097 1 260 . 1 1 71 71 VAL N N 15 126.5 0.06 . 1 . . . . . . . . 4097 1 261 . 1 1 71 71 VAL H H 1 8.91 0.02 . 1 . . . . . . . . 4097 1 262 . 1 1 71 71 VAL CA C 13 60.7 0.06 . 1 . . . . . . . . 4097 1 263 . 1 1 71 71 VAL CB C 13 33.7 0.06 . 1 . . . . . . . . 4097 1 264 . 1 1 75 75 GLN CA C 13 58.3 0.06 . 1 . . . . . . . . 4097 1 265 . 1 1 75 75 GLN CB C 13 27.8 0.06 . 1 . . . . . . . . 4097 1 266 . 1 1 76 76 TYR N N 15 120 0.06 . 1 . . . . . . . . 4097 1 267 . 1 1 76 76 TYR H H 1 8.23 0.02 . 1 . . . . . . . . 4097 1 268 . 1 1 76 76 TYR CA C 13 60 0.06 . 1 . . . . . . . . 4097 1 269 . 1 1 76 76 TYR CB C 13 38.7 0.06 . 1 . . . . . . . . 4097 1 270 . 1 1 77 77 ALA N N 15 121 0.06 . 1 . . . . . . . . 4097 1 271 . 1 1 77 77 ALA H H 1 8.15 0.02 . 1 . . . . . . . . 4097 1 272 . 1 1 77 77 ALA CA C 13 54.2 0.06 . 1 . . . . . . . . 4097 1 273 . 1 1 77 77 ALA CB C 13 18.6 0.06 . 1 . . . . . . . . 4097 1 274 . 1 1 78 78 LEU N N 15 115.5 0.06 . 1 . . . . . . . . 4097 1 275 . 1 1 78 78 LEU H H 1 7.39 0.02 . 1 . . . . . . . . 4097 1 276 . 1 1 78 78 LEU CA C 13 57.6 0.06 . 1 . . . . . . . . 4097 1 277 . 1 1 78 78 LEU CB C 13 41.8 0.06 . 1 . . . . . . . . 4097 1 278 . 1 1 79 79 GLY N N 15 105.1 0.06 . 1 . . . . . . . . 4097 1 279 . 1 1 79 79 GLY H H 1 7.88 0.02 . 1 . . . . . . . . 4097 1 280 . 1 1 79 79 GLY CA C 13 46.6 0.06 . 1 . . . . . . . . 4097 1 281 . 1 1 80 80 ILE N N 15 120.1 0.06 . 1 . . . . . . . . 4097 1 282 . 1 1 80 80 ILE H H 1 7.37 0.02 . 1 . . . . . . . . 4097 1 283 . 1 1 80 80 ILE CA C 13 62.3 0.06 . 1 . . . . . . . . 4097 1 284 . 1 1 80 80 ILE CB C 13 37.5 0.06 . 1 . . . . . . . . 4097 1 285 . 1 1 81 81 ILE N N 15 117.3 0.06 . 1 . . . . . . . . 4097 1 286 . 1 1 81 81 ILE H H 1 7.39 0.02 . 1 . . . . . . . . 4097 1 287 . 1 1 81 81 ILE CA C 13 63.5 0.06 . 1 . . . . . . . . 4097 1 288 . 1 1 82 82 GLN CA C 13 57 0.06 . 1 . . . . . . . . 4097 1 289 . 1 1 82 82 GLN CB C 13 29 0.06 . 1 . . . . . . . . 4097 1 290 . 1 1 83 83 ALA N N 15 121.1 0.06 . 1 . . . . . . . . 4097 1 291 . 1 1 83 83 ALA H H 1 7.44 0.02 . 1 . . . . . . . . 4097 1 292 . 1 1 83 83 ALA CA C 13 52.6 0.06 . 1 . . . . . . . . 4097 1 293 . 1 1 83 83 ALA CB C 13 19 0.06 . 1 . . . . . . . . 4097 1 294 . 1 1 84 84 GLN N N 15 116.4 0.06 . 1 . . . . . . . . 4097 1 295 . 1 1 84 84 GLN H H 1 8.06 0.02 . 1 . . . . . . . . 4097 1 296 . 1 1 84 84 GLN CA C 13 54.7 0.06 . 1 . . . . . . . . 4097 1 297 . 1 1 85 85 PRO CA C 13 63.1 0.06 . 1 . . . . . . . . 4097 1 298 . 1 1 85 85 PRO CB C 13 31.9 0.06 . 1 . . . . . . . . 4097 1 299 . 1 1 86 86 ASP N N 15 119.1 0.06 . 1 . . . . . . . . 4097 1 300 . 1 1 86 86 ASP H H 1 8.3 0.02 . 1 . . . . . . . . 4097 1 301 . 1 1 86 86 ASP CA C 13 53.7 0.06 . 1 . . . . . . . . 4097 1 302 . 1 1 86 86 ASP CB C 13 41.3 0.06 . 1 . . . . . . . . 4097 1 303 . 1 1 87 87 LYS N N 15 120.2 0.06 . 1 . . . . . . . . 4097 1 304 . 1 1 87 87 LYS H H 1 8.21 0.02 . 1 . . . . . . . . 4097 1 305 . 1 1 87 87 LYS CA C 13 56.8 0.06 . 1 . . . . . . . . 4097 1 306 . 1 1 87 87 LYS CB C 13 32.8 0.06 . 1 . . . . . . . . 4097 1 307 . 1 1 88 88 SER N N 15 115.9 0.06 . 1 . . . . . . . . 4097 1 308 . 1 1 88 88 SER H H 1 8.53 0.02 . 1 . . . . . . . . 4097 1 309 . 1 1 88 88 SER CA C 13 58.6 0.06 . 1 . . . . . . . . 4097 1 310 . 1 1 88 88 SER CB C 13 63.8 0.06 . 1 . . . . . . . . 4097 1 311 . 1 1 89 89 GLU N N 15 122.7 0.06 . 1 . . . . . . . . 4097 1 312 . 1 1 89 89 GLU H H 1 8.34 0.02 . 1 . . . . . . . . 4097 1 313 . 1 1 89 89 GLU CA C 13 56.2 0.06 . 1 . . . . . . . . 4097 1 314 . 1 1 89 89 GLU CB C 13 29 0.06 . 1 . . . . . . . . 4097 1 315 . 1 1 90 90 SER N N 15 114.8 0.06 . 1 . . . . . . . . 4097 1 316 . 1 1 90 90 SER H H 1 8.1 0.02 . 1 . . . . . . . . 4097 1 317 . 1 1 90 90 SER CA C 13 57.9 0.06 . 1 . . . . . . . . 4097 1 318 . 1 1 90 90 SER CB C 13 63.3 0.06 . 1 . . . . . . . . 4097 1 319 . 1 1 91 91 GLU N N 15 126.7 0.06 . 1 . . . . . . . . 4097 1 320 . 1 1 91 91 GLU H H 1 8.8 0.02 . 1 . . . . . . . . 4097 1 321 . 1 1 91 91 GLU CA C 13 59.1 0.06 . 1 . . . . . . . . 4097 1 322 . 1 1 91 91 GLU CB C 13 28.6 0.06 . 1 . . . . . . . . 4097 1 323 . 1 1 92 92 LEU N N 15 120 0.06 . 1 . . . . . . . . 4097 1 324 . 1 1 92 92 LEU H H 1 7.88 0.02 . 1 . . . . . . . . 4097 1 325 . 1 1 92 92 LEU CA C 13 57.3 0.06 . 1 . . . . . . . . 4097 1 326 . 1 1 92 92 LEU CB C 13 42.1 0.06 . 1 . . . . . . . . 4097 1 327 . 1 1 93 93 VAL N N 15 118.2 0.06 . 1 . . . . . . . . 4097 1 328 . 1 1 93 93 VAL H H 1 7.57 0.02 . 1 . . . . . . . . 4097 1 329 . 1 1 93 93 VAL CA C 13 67.3 0.06 . 1 . . . . . . . . 4097 1 330 . 1 1 93 93 VAL CB C 13 31.2 0.06 . 1 . . . . . . . . 4097 1 331 . 1 1 94 94 ASN N N 15 117.4 0.06 . 1 . . . . . . . . 4097 1 332 . 1 1 94 94 ASN H H 1 8.01 0.02 . 1 . . . . . . . . 4097 1 333 . 1 1 94 94 ASN CA C 13 56.7 0.06 . 1 . . . . . . . . 4097 1 334 . 1 1 94 94 ASN CB C 13 37.8 0.06 . 1 . . . . . . . . 4097 1 335 . 1 1 95 95 GLN N N 15 119.6 0.06 . 1 . . . . . . . . 4097 1 336 . 1 1 95 95 GLN H H 1 8.16 0.02 . 1 . . . . . . . . 4097 1 337 . 1 1 95 95 GLN CA C 13 59 0.06 . 1 . . . . . . . . 4097 1 338 . 1 1 95 95 GLN CB C 13 27.9 0.06 . 1 . . . . . . . . 4097 1 339 . 1 1 96 96 ILE N N 15 121.5 0.06 . 1 . . . . . . . . 4097 1 340 . 1 1 96 96 ILE H H 1 8.05 0.02 . 1 . . . . . . . . 4097 1 341 . 1 1 96 96 ILE CA C 13 66.2 0.06 . 1 . . . . . . . . 4097 1 342 . 1 1 96 96 ILE CB C 13 37.8 0.06 . 1 . . . . . . . . 4097 1 343 . 1 1 97 97 ILE N N 15 121.4 0.06 . 1 . . . . . . . . 4097 1 344 . 1 1 97 97 ILE H H 1 8.54 0.02 . 1 . . . . . . . . 4097 1 345 . 1 1 97 97 ILE CA C 13 65.5 0.06 . 1 . . . . . . . . 4097 1 346 . 1 1 97 97 ILE CB C 13 37.2 0.06 . 1 . . . . . . . . 4097 1 347 . 1 1 98 98 GLU N N 15 116.4 0.06 . 1 . . . . . . . . 4097 1 348 . 1 1 98 98 GLU H H 1 7.99 0.02 . 1 . . . . . . . . 4097 1 349 . 1 1 98 98 GLU CA C 13 59.1 0.06 . 1 . . . . . . . . 4097 1 350 . 1 1 98 98 GLU CB C 13 28.6 0.06 . 1 . . . . . . . . 4097 1 351 . 1 1 99 99 GLN N N 15 114.9 0.06 . 1 . . . . . . . . 4097 1 352 . 1 1 99 99 GLN H H 1 7.47 0.02 . 1 . . . . . . . . 4097 1 353 . 1 1 99 99 GLN CA C 13 57.4 0.06 . 1 . . . . . . . . 4097 1 354 . 1 1 99 99 GLN CB C 13 29.5 0.06 . 1 . . . . . . . . 4097 1 355 . 1 1 100 100 LEU N N 15 121.5 0.06 . 1 . . . . . . . . 4097 1 356 . 1 1 100 100 LEU H H 1 8.55 0.02 . 1 . . . . . . . . 4097 1 357 . 1 1 100 100 LEU CA C 13 58.5 0.06 . 1 . . . . . . . . 4097 1 358 . 1 1 100 100 LEU CB C 13 41.8 0.06 . 1 . . . . . . . . 4097 1 359 . 1 1 101 101 ILE N N 15 112.4 0.06 . 1 . . . . . . . . 4097 1 360 . 1 1 101 101 ILE H H 1 7.88 0.02 . 1 . . . . . . . . 4097 1 361 . 1 1 101 101 ILE CA C 13 64.1 0.06 . 1 . . . . . . . . 4097 1 362 . 1 1 101 101 ILE CB C 13 38.1 0.06 . 1 . . . . . . . . 4097 1 363 . 1 1 102 102 LYS N N 15 117.2 0.06 . 1 . . . . . . . . 4097 1 364 . 1 1 102 102 LYS H H 1 6.98 0.02 . 1 . . . . . . . . 4097 1 365 . 1 1 102 102 LYS CA C 13 56.7 0.06 . 1 . . . . . . . . 4097 1 366 . 1 1 102 102 LYS CB C 13 33.1 0.06 . 1 . . . . . . . . 4097 1 367 . 1 1 103 103 LYS N N 15 117 0.06 . 1 . . . . . . . . 4097 1 368 . 1 1 103 103 LYS H H 1 7.44 0.02 . 1 . . . . . . . . 4097 1 369 . 1 1 103 103 LYS CA C 13 54.1 0.06 . 1 . . . . . . . . 4097 1 370 . 1 1 103 103 LYS CB C 13 32.7 0.06 . 1 . . . . . . . . 4097 1 371 . 1 1 104 104 GLU N N 15 120.1 0.06 . 1 . . . . . . . . 4097 1 372 . 1 1 104 104 GLU H H 1 9.17 0.02 . 1 . . . . . . . . 4097 1 373 . 1 1 104 104 GLU CA C 13 58 0.06 . 1 . . . . . . . . 4097 1 374 . 1 1 104 104 GLU CB C 13 30.5 0.06 . 1 . . . . . . . . 4097 1 375 . 1 1 105 105 LYS N N 15 115.3 0.06 . 1 . . . . . . . . 4097 1 376 . 1 1 105 105 LYS H H 1 7.72 0.02 . 1 . . . . . . . . 4097 1 377 . 1 1 105 105 LYS CA C 13 56.1 0.06 . 1 . . . . . . . . 4097 1 378 . 1 1 105 105 LYS CB C 13 33.7 0.06 . 1 . . . . . . . . 4097 1 379 . 1 1 106 106 VAL N N 15 120.9 0.06 . 1 . . . . . . . . 4097 1 380 . 1 1 106 106 VAL H H 1 8.86 0.02 . 1 . . . . . . . . 4097 1 381 . 1 1 106 106 VAL CA C 13 60.5 0.06 . 1 . . . . . . . . 4097 1 382 . 1 1 106 106 VAL CB C 13 35.6 0.06 . 1 . . . . . . . . 4097 1 383 . 1 1 107 107 TYR N N 15 129.4 0.06 . 1 . . . . . . . . 4097 1 384 . 1 1 107 107 TYR H H 1 8.5 0.02 . 1 . . . . . . . . 4097 1 385 . 1 1 107 107 TYR CA C 13 56.3 0.06 . 1 . . . . . . . . 4097 1 386 . 1 1 107 107 TYR CB C 13 40.5 0.06 . 1 . . . . . . . . 4097 1 387 . 1 1 108 108 LEU N N 15 128.9 0.06 . 1 . . . . . . . . 4097 1 388 . 1 1 108 108 LEU H H 1 7.94 0.02 . 1 . . . . . . . . 4097 1 389 . 1 1 108 108 LEU CA C 13 52.6 0.06 . 1 . . . . . . . . 4097 1 390 . 1 1 108 108 LEU CB C 13 45.4 0.06 . 1 . . . . . . . . 4097 1 391 . 1 1 109 109 ALA N N 15 124.9 0.06 . 1 . . . . . . . . 4097 1 392 . 1 1 109 109 ALA H H 1 8.53 0.02 . 1 . . . . . . . . 4097 1 393 . 1 1 109 109 ALA CA C 13 50.8 0.06 . 1 . . . . . . . . 4097 1 394 . 1 1 112 112 PRO CA C 13 62.1 0.06 . 1 . . . . . . . . 4097 1 395 . 1 1 112 112 PRO CB C 13 31.9 0.06 . 1 . . . . . . . . 4097 1 396 . 1 1 113 113 ALA N N 15 122.2 0.06 . 1 . . . . . . . . 4097 1 397 . 1 1 113 113 ALA H H 1 8.19 0.02 . 1 . . . . . . . . 4097 1 398 . 1 1 113 113 ALA CA C 13 52.1 0.06 . 1 . . . . . . . . 4097 1 399 . 1 1 113 113 ALA CB C 13 19.5 0.06 . 1 . . . . . . . . 4097 1 400 . 1 1 114 114 HIS N N 15 115.5 0.06 . 1 . . . . . . . . 4097 1 401 . 1 1 114 114 HIS H H 1 8.58 0.02 . 1 . . . . . . . . 4097 1 402 . 1 1 114 114 HIS CA C 13 55.4 0.06 . 1 . . . . . . . . 4097 1 403 . 1 1 114 114 HIS CB C 13 28 0.06 . 1 . . . . . . . . 4097 1 404 . 1 1 115 115 LYS N N 15 120.1 0.06 . 1 . . . . . . . . 4097 1 405 . 1 1 115 115 LYS H H 1 8.19 0.02 . 1 . . . . . . . . 4097 1 406 . 1 1 115 115 LYS CA C 13 55.6 0.06 . 1 . . . . . . . . 4097 1 407 . 1 1 115 115 LYS CB C 13 33.1 0.06 . 1 . . . . . . . . 4097 1 408 . 1 1 116 116 GLY N N 15 110.1 0.06 . 1 . . . . . . . . 4097 1 409 . 1 1 116 116 GLY H H 1 8.58 0.02 . 1 . . . . . . . . 4097 1 410 . 1 1 116 116 GLY CA C 13 45.3 0.06 . 1 . . . . . . . . 4097 1 411 . 1 1 117 117 ILE N N 15 119.7 0.06 . 1 . . . . . . . . 4097 1 412 . 1 1 117 117 ILE H H 1 7.93 0.02 . 1 . . . . . . . . 4097 1 413 . 1 1 117 117 ILE CA C 13 60.8 0.06 . 1 . . . . . . . . 4097 1 414 . 1 1 117 117 ILE CB C 13 42.1 0.06 . 1 . . . . . . . . 4097 1 415 . 1 1 118 118 GLY N N 15 114.3 0.06 . 1 . . . . . . . . 4097 1 416 . 1 1 118 118 GLY H H 1 8.63 0.02 . 1 . . . . . . . . 4097 1 417 . 1 1 118 118 GLY CA C 13 45.9 0.06 . 1 . . . . . . . . 4097 1 418 . 1 1 128 128 SER N N 15 116.2 0.06 . 1 . . . . . . . . 4097 1 419 . 1 1 128 128 SER H H 1 8.37 0.02 . 1 . . . . . . . . 4097 1 420 . 1 1 128 128 SER CA C 13 58.6 0.06 . 1 . . . . . . . . 4097 1 421 . 1 1 128 128 SER CB C 13 63.6 0.06 . 1 . . . . . . . . 4097 1 422 . 1 1 129 129 ALA N N 15 122.4 0.06 . 1 . . . . . . . . 4097 1 423 . 1 1 129 129 ALA H H 1 8.33 0.02 . 1 . . . . . . . . 4097 1 424 . 1 1 129 129 ALA CA C 13 56.3 0.06 . 1 . . . . . . . . 4097 1 425 . 1 1 130 130 GLY N N 15 110.7 0.06 . 1 . . . . . . . . 4097 1 426 . 1 1 130 130 GLY H H 1 8.42 0.02 . 1 . . . . . . . . 4097 1 427 . 1 1 130 130 GLY CA C 13 45.5 0.06 . 1 . . . . . . . . 4097 1 428 . 1 1 131 131 ILE N N 15 120.3 0.06 . 1 . . . . . . . . 4097 1 429 . 1 1 131 131 ILE H H 1 8.06 0.02 . 1 . . . . . . . . 4097 1 430 . 1 1 131 131 ILE CA C 13 60.5 0.06 . 1 . . . . . . . . 4097 1 431 . 1 1 133 133 LYS CA C 13 56.2 0.06 . 1 . . . . . . . . 4097 1 432 . 1 1 133 133 LYS CB C 13 33.2 0.06 . 1 . . . . . . . . 4097 1 433 . 1 1 134 134 ILE N N 15 123.6 0.06 . 1 . . . . . . . . 4097 1 434 . 1 1 134 134 ILE H H 1 8.24 0.02 . 1 . . . . . . . . 4097 1 435 . 1 1 134 134 ILE CA C 13 61 0.06 . 1 . . . . . . . . 4097 1 436 . 1 1 134 134 ILE CB C 13 38.7 0.06 . 1 . . . . . . . . 4097 1 437 . 1 1 135 135 LEU N N 15 131.3 0.06 . 1 . . . . . . . . 4097 1 438 . 1 1 135 135 LEU H H 1 7.93 0.02 . 1 . . . . . . . . 4097 1 439 . 1 1 135 135 LEU CA C 13 56.4 0.06 . 1 . . . . . . . . 4097 1 stop_ save_