################################### # 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 28002 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 28002 1 2 '3D CBCA(CO)NH' . . . 28002 1 3 '3D HNCA' . . . 28002 1 4 '3D HNCACB' . . . 28002 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 4 4 GLU CA C 13 56.626 . . 9 . . . . . 4 E CA . 28002 1 2 . 1 1 4 4 GLU CB C 13 30.276 . . 9 . . . . . 4 E CB . 28002 1 3 . 1 1 5 5 ASP H H 1 8.273 . . 9 . . . . . 5 D H . 28002 1 4 . 1 1 5 5 ASP CA C 13 54.464 . . 9 . . . . . 5 D CA . 28002 1 5 . 1 1 5 5 ASP CB C 13 41.066 . . 9 . . . . . 5 D CB . 28002 1 6 . 1 1 5 5 ASP N N 15 121.031 . . 9 . . . . . 5 D N . 28002 1 7 . 1 1 6 6 LYS H H 1 7.972 . . 9 . . . . . 6 K H . 28002 1 8 . 1 1 6 6 LYS CA C 13 55.365 . . 9 . . . . . 6 K CA . 28002 1 9 . 1 1 6 6 LYS CB C 13 35.427 . . 9 . . . . . 6 K CB . 28002 1 10 . 1 1 6 6 LYS N N 15 119.717 . . 9 . . . . . 6 K N . 28002 1 11 . 1 1 7 7 ILE H H 1 8.966 . . 9 . . . . . 7 I H . 28002 1 12 . 1 1 7 7 ILE CA C 13 58.988 . . 9 . . . . . 7 I CA . 28002 1 13 . 1 1 7 7 ILE CB C 13 40.682 . . 9 . . . . . 7 I CB . 28002 1 14 . 1 1 7 7 ILE N N 15 118.638 . . 9 . . . . . 7 I N . 28002 1 15 . 1 1 8 8 THR H H 1 8.874 . . 9 . . . . . 8 T H . 28002 1 16 . 1 1 8 8 THR CA C 13 63.240 . . 9 . . . . . 8 T CA . 28002 1 17 . 1 1 8 8 THR CB C 13 69.119 . . 9 . . . . . 8 T CB . 28002 1 18 . 1 1 8 8 THR N N 15 121.819 . . 9 . . . . . 8 T N . 28002 1 19 . 1 1 9 9 VAL H H 1 8.504 . . 9 . . . . . 9 V H . 28002 1 20 . 1 1 9 9 VAL CA C 13 61.037 . . 9 . . . . . 9 V CA . 28002 1 21 . 1 1 9 9 VAL CB C 13 35.476 . . 9 . . . . . 9 V CB . 28002 1 22 . 1 1 9 9 VAL N N 15 124.760 . . 9 . . . . . 9 V N . 28002 1 23 . 1 1 10 10 HIS H H 1 8.606 . . 9 . . . . . 10 H H . 28002 1 24 . 1 1 10 10 HIS CA C 13 54.253 . . 9 . . . . . 10 H CA . 28002 1 25 . 1 1 10 10 HIS CB C 13 31.504 . . 9 . . . . . 10 H CB . 28002 1 26 . 1 1 10 10 HIS N N 15 125.651 . . 9 . . . . . 10 H N . 28002 1 27 . 1 1 11 11 PHE H H 1 9.576 . . 9 . . . . . 11 F H . 28002 1 28 . 1 1 11 11 PHE CA C 13 55.705 . . 9 . . . . . 11 F CA . 28002 1 29 . 1 1 11 11 PHE CB C 13 41.667 . . 9 . . . . . 11 F CB . 28002 1 30 . 1 1 11 11 PHE N N 15 122.505 . . 9 . . . . . 11 F N . 28002 1 31 . 1 1 12 12 ILE H H 1 9.029 . . 9 . . . . . 12 I H . 28002 1 32 . 1 1 12 12 ILE CA C 13 60.400 . . 9 . . . . . 12 I CA . 28002 1 33 . 1 1 12 12 ILE CB C 13 37.017 . . 9 . . . . . 12 I CB . 28002 1 34 . 1 1 12 12 ILE N N 15 122.951 . . 9 . . . . . 12 I N . 28002 1 35 . 1 1 13 13 ASN H H 1 8.912 . . 9 . . . . . 13 N H . 28002 1 36 . 1 1 13 13 ASN CA C 13 51.289 . . 9 . . . . . 13 N CA . 28002 1 37 . 1 1 13 13 ASN CB C 13 38.855 . . 9 . . . . . 13 N CB . 28002 1 38 . 1 1 13 13 ASN N N 15 125.062 . . 9 . . . . . 13 N N . 28002 1 39 . 1 1 14 14 ARG H H 1 8.590 . . 9 . . . . . 14 R H . 28002 1 40 . 1 1 14 14 ARG CA C 13 59.233 . . 9 . . . . . 14 R CA . 28002 1 41 . 1 1 14 14 ARG CB C 13 29.644 . . 9 . . . . . 14 R CB . 28002 1 42 . 1 1 14 14 ARG N N 15 119.017 . . 9 . . . . . 14 R N . 28002 1 43 . 1 1 15 15 ASP H H 1 7.687 . . 9 . . . . . 15 D H . 28002 1 44 . 1 1 15 15 ASP CA C 13 53.583 . . 9 . . . . . 15 D CA . 28002 1 45 . 1 1 15 15 ASP CB C 13 40.768 . . 9 . . . . . 15 D CB . 28002 1 46 . 1 1 15 15 ASP N N 15 116.124 . . 9 . . . . . 15 D N . 28002 1 47 . 1 1 16 16 GLY H H 1 8.180 . . 9 . . . . . 16 G H . 28002 1 48 . 1 1 16 16 GLY CA C 13 45.232 . . 9 . . . . . 16 G CA . 28002 1 49 . 1 1 16 16 GLY N N 15 108.341 . . 9 . . . . . 16 G N . 28002 1 50 . 1 1 17 17 GLU H H 1 7.970 . . 9 . . . . . 17 E H . 28002 1 51 . 1 1 17 17 GLU CA C 13 57.005 . . 9 . . . . . 17 E CA . 28002 1 52 . 1 1 17 17 GLU CB C 13 30.382 . . 9 . . . . . 17 E CB . 28002 1 53 . 1 1 17 17 GLU N N 15 122.346 . . 9 . . . . . 17 E N . 28002 1 54 . 1 1 18 18 THR H H 1 8.657 . . 9 . . . . . 18 T H . 28002 1 55 . 1 1 18 18 THR CA C 13 63.008 . . 9 . . . . . 18 T CA . 28002 1 56 . 1 1 18 18 THR CB C 13 69.167 . . 9 . . . . . 18 T CB . 28002 1 57 . 1 1 18 18 THR N N 15 119.233 . . 9 . . . . . 18 T N . 28002 1 58 . 1 1 19 19 LEU H H 1 10.020 . . 9 . . . . . 19 L H . 28002 1 59 . 1 1 19 19 LEU CA C 13 53.420 . . 9 . . . . . 19 L CA . 28002 1 60 . 1 1 19 19 LEU CB C 13 42.719 . . 9 . . . . . 19 L CB . 28002 1 61 . 1 1 19 19 LEU N N 15 131.274 . . 9 . . . . . 19 L N . 28002 1 62 . 1 1 20 20 THR H H 1 8.813 . . 9 . . . . . 20 T H . 28002 1 63 . 1 1 20 20 THR CA C 13 63.955 . . 9 . . . . . 20 T CA . 28002 1 64 . 1 1 20 20 THR CB C 13 70.082 . . 9 . . . . . 20 T CB . 28002 1 65 . 1 1 20 20 THR N N 15 122.991 . . 9 . . . . . 20 T N . 28002 1 66 . 1 1 21 21 THR H H 1 8.840 . . 9 . . . . . 21 T H . 28002 1 67 . 1 1 21 21 THR CA C 13 60.177 . . 9 . . . . . 21 T CA . 28002 1 68 . 1 1 21 21 THR CB C 13 70.553 . . 9 . . . . . 21 T CB . 28002 1 69 . 1 1 21 21 THR N N 15 122.608 . . 9 . . . . . 21 T N . 28002 1 70 . 1 1 22 22 LYS H H 1 7.989 . . 9 . . . . . 22 K H . 28002 1 71 . 1 1 22 22 LYS CA C 13 53.929 . . 9 . . . . . 22 K CA . 28002 1 72 . 1 1 22 22 LYS CB C 13 35.899 . . 9 . . . . . 22 K CB . 28002 1 73 . 1 1 22 22 LYS N N 15 118.364 . . 9 . . . . . 22 K N . 28002 1 74 . 1 1 23 23 GLY H H 1 8.879 . . 9 . . . . . 23 G H . 28002 1 75 . 1 1 23 23 GLY CA C 13 43.931 . . 9 . . . . . 23 G CA . 28002 1 76 . 1 1 23 23 GLY N N 15 107.554 . . 9 . . . . . 23 G N . 28002 1 77 . 1 1 24 24 LYS H H 1 8.799 . . 9 . . . . . 24 K H . 28002 1 78 . 1 1 24 24 LYS CA C 13 55.046 . . 9 . . . . . 24 K CA . 28002 1 79 . 1 1 24 24 LYS CB C 13 33.342 . . 9 . . . . . 24 K CB . 28002 1 80 . 1 1 24 24 LYS N N 15 121.470 . . 9 . . . . . 24 K N . 28002 1 81 . 1 1 25 25 VAL H H 1 8.374 . . 9 . . . . . 25 V H . 28002 1 82 . 1 1 25 25 VAL CA C 13 65.639 . . 9 . . . . . 25 V CA . 28002 1 83 . 1 1 25 25 VAL CB C 13 31.485 . . 9 . . . . . 25 V CB . 28002 1 84 . 1 1 25 25 VAL N N 15 122.229 . . 9 . . . . . 25 V N . 28002 1 85 . 1 1 26 26 GLY H H 1 8.843 . . 9 . . . . . 26 G H . 28002 1 86 . 1 1 26 26 GLY CA C 13 45.134 . . 9 . . . . . 26 G CA . 28002 1 87 . 1 1 26 26 GLY N N 15 116.747 . . 9 . . . . . 26 G N . 28002 1 88 . 1 1 27 27 ASP H H 1 8.181 . . 9 . . . . . 27 D H . 28002 1 89 . 1 1 27 27 ASP CA C 13 54.750 . . 9 . . . . . 27 D CA . 28002 1 90 . 1 1 27 27 ASP CB C 13 41.575 . . 9 . . . . . 27 D CB . 28002 1 91 . 1 1 27 27 ASP N N 15 123.140 . . 9 . . . . . 27 D N . 28002 1 92 . 1 1 28 28 SER H H 1 9.748 . . 9 . . . . . 28 S H . 28002 1 93 . 1 1 28 28 SER CA C 13 58.388 . . 9 . . . . . 28 S CA . 28002 1 94 . 1 1 28 28 SER CB C 13 65.970 . . 9 . . . . . 28 S CB . 28002 1 95 . 1 1 28 28 SER N N 15 118.357 . . 9 . . . . . 28 S N . 28002 1 96 . 1 1 29 29 LEU H H 1 8.229 . . 9 . . . . . 29 L H . 28002 1 97 . 1 1 29 29 LEU CA C 13 58.011 . . 9 . . . . . 29 L CA . 28002 1 98 . 1 1 29 29 LEU CB C 13 40.720 . . 9 . . . . . 29 L CB . 28002 1 99 . 1 1 29 29 LEU N N 15 119.346 . . 9 . . . . . 29 L N . 28002 1 100 . 1 1 30 30 LEU H H 1 7.287 . . 9 . . . . . 30 L H . 28002 1 101 . 1 1 30 30 LEU CA C 13 54.874 . . 9 . . . . . 30 L CA . 28002 1 102 . 1 1 30 30 LEU CB C 13 42.495 . . 9 . . . . . 30 L CB . 28002 1 103 . 1 1 30 30 LEU N N 15 116.890 . . 9 . . . . . 30 L N . 28002 1 104 . 1 1 31 31 ASP H H 1 8.102 . . 9 . . . . . 31 D H . 28002 1 105 . 1 1 31 31 ASP CA C 13 58.168 . . 9 . . . . . 31 D CA . 28002 1 106 . 1 1 31 31 ASP CB C 13 41.139 . . 9 . . . . . 31 D CB . 28002 1 107 . 1 1 31 31 ASP N N 15 124.823 . . 9 . . . . . 31 D N . 28002 1 108 . 1 1 32 32 VAL H H 1 7.791 . . 9 . . . . . 32 V H . 28002 1 109 . 1 1 32 32 VAL CA C 13 66.199 . . 9 . . . . . 32 V CA . 28002 1 110 . 1 1 32 32 VAL CB C 13 32.092 . . 9 . . . . . 32 V CB . 28002 1 111 . 1 1 32 32 VAL N N 15 117.223 . . 9 . . . . . 32 V N . 28002 1 112 . 1 1 33 33 VAL H H 1 7.490 . . 9 . . . . . 33 V H . 28002 1 113 . 1 1 33 33 VAL CA C 13 67.223 . . 9 . . . . . 33 V CA . 28002 1 114 . 1 1 33 33 VAL CB C 13 32.182 . . 9 . . . . . 33 V CB . 28002 1 115 . 1 1 33 33 VAL N N 15 121.589 . . 9 . . . . . 33 V N . 28002 1 116 . 1 1 34 34 VAL H H 1 8.403 . . 9 . . . . . 34 V H . 28002 1 117 . 1 1 34 34 VAL CA C 13 66.280 . . 9 . . . . . 34 V CA . 28002 1 118 . 1 1 34 34 VAL CB C 13 32.467 . . 9 . . . . . 34 V CB . 28002 1 119 . 1 1 34 34 VAL N N 15 118.737 . . 9 . . . . . 34 V N . 28002 1 120 . 1 1 35 35 GLU H H 1 9.146 . . 9 . . . . . 35 E H . 28002 1 121 . 1 1 35 35 GLU CA C 13 59.303 . . 9 . . . . . 35 E CA . 28002 1 122 . 1 1 35 35 GLU CB C 13 29.456 . . 9 . . . . . 35 E CB . 28002 1 123 . 1 1 35 35 GLU N N 15 120.451 . . 9 . . . . . 35 E N . 28002 1 124 . 1 1 36 36 ASN H H 1 7.201 . . 9 . . . . . 36 N H . 28002 1 125 . 1 1 36 36 ASN CA C 13 53.480 . . 9 . . . . . 36 N CA . 28002 1 126 . 1 1 36 36 ASN CB C 13 39.558 . . 9 . . . . . 36 N CB . 28002 1 127 . 1 1 36 36 ASN N N 15 111.526 . . 9 . . . . . 36 N N . 28002 1 128 . 1 1 37 37 ASN H H 1 7.867 . . 9 . . . . . 37 N H . 28002 1 129 . 1 1 37 37 ASN CA C 13 54.031 . . 9 . . . . . 37 N CA . 28002 1 130 . 1 1 37 37 ASN CB C 13 37.345 . . 9 . . . . . 37 N CB . 28002 1 131 . 1 1 37 37 ASN N N 15 117.548 . . 9 . . . . . 37 N N . 28002 1 132 . 1 1 38 38 LEU H H 1 7.778 . . 9 . . . . . 38 L H . 28002 1 133 . 1 1 38 38 LEU CA C 13 55.518 . . 9 . . . . . 38 L CA . 28002 1 134 . 1 1 38 38 LEU CB C 13 42.045 . . 9 . . . . . 38 L CB . 28002 1 135 . 1 1 38 38 LEU N N 15 115.451 . . 9 . . . . . 38 L N . 28002 1 136 . 1 1 39 39 ASP H H 1 8.565 . . 9 . . . . . 39 D H . 28002 1 137 . 1 1 39 39 ASP CA C 13 53.704 . . 9 . . . . . 39 D CA . 28002 1 138 . 1 1 39 39 ASP CB C 13 39.829 . . 9 . . . . . 39 D CB . 28002 1 139 . 1 1 39 39 ASP N N 15 122.820 . . 9 . . . . . 39 D N . 28002 1 140 . 1 1 40 40 ILE H H 1 7.602 . . 9 . . . . . 40 I H . 28002 1 141 . 1 1 40 40 ILE CA C 13 60.065 . . 9 . . . . . 40 I CA . 28002 1 142 . 1 1 40 40 ILE CB C 13 38.417 . . 9 . . . . . 40 I CB . 28002 1 143 . 1 1 40 40 ILE N N 15 123.851 . . 9 . . . . . 40 I N . 28002 1 144 . 1 1 41 41 ASP H H 1 8.543 . . 9 . . . . . 41 D H . 28002 1 145 . 1 1 41 41 ASP CA C 13 56.796 . . 9 . . . . . 41 D CA . 28002 1 146 . 1 1 41 41 ASP CB C 13 41.859 . . 9 . . . . . 41 D CB . 28002 1 147 . 1 1 41 41 ASP N N 15 127.546 . . 9 . . . . . 41 D N . 28002 1 148 . 1 1 42 42 GLY H H 1 9.001 . . 9 . . . . . 42 G H . 28002 1 149 . 1 1 42 42 GLY CA C 13 46.198 . . 9 . . . . . 42 G CA . 28002 1 150 . 1 1 42 42 GLY N N 15 113.790 . . 9 . . . . . 42 G N . 28002 1 151 . 1 1 43 43 PHE H H 1 7.667 . . 9 . . . . . 43 F H . 28002 1 152 . 1 1 43 43 PHE CA C 13 59.069 . . 9 . . . . . 43 F CA . 28002 1 153 . 1 1 43 43 PHE CB C 13 41.242 . . 9 . . . . . 43 F CB . 28002 1 154 . 1 1 43 43 PHE N N 15 120.938 . . 9 . . . . . 43 F N . 28002 1 155 . 1 1 44 44 GLY H H 1 8.512 . . 9 . . . . . 44 G H . 28002 1 156 . 1 1 44 44 GLY CA C 13 58.711 . . 9 . . . . . 44 G CA . 28002 1 157 . 1 1 44 44 GLY N N 15 114.030 . . 9 . . . . . 44 G N . 28002 1 158 . 1 1 56 56 HIS CA C 13 54.977 . . 9 . . . . . 56 H CA . 28002 1 159 . 1 1 56 56 HIS CB C 13 30.393 . . 9 . . . . . 56 H CB . 28002 1 160 . 1 1 57 57 LEU H H 1 9.404 . . 9 . . . . . 57 L H . 28002 1 161 . 1 1 57 57 LEU CA C 13 53.628 . . 9 . . . . . 57 L CA . 28002 1 162 . 1 1 57 57 LEU CB C 13 49.478 . . 9 . . . . . 57 L CB . 28002 1 163 . 1 1 57 57 LEU N N 15 128.360 . . 9 . . . . . 57 L N . 28002 1 164 . 1 1 58 58 ILE H H 1 8.561 . . 9 . . . . . 58 I H . 28002 1 165 . 1 1 58 58 ILE CA C 13 61.364 . . 9 . . . . . 58 I CA . 28002 1 166 . 1 1 58 58 ILE CB C 13 40.168 . . 9 . . . . . 58 I CB . 28002 1 167 . 1 1 58 58 ILE N N 15 119.839 . . 9 . . . . . 58 I N . 28002 1 168 . 1 1 59 59 PHE H H 1 8.724 . . 9 . . . . . 59 F H . 28002 1 169 . 1 1 59 59 PHE CA C 13 58.472 . . 9 . . . . . 59 F CA . 28002 1 170 . 1 1 59 59 PHE CB C 13 43.266 . . 9 . . . . . 59 F CB . 28002 1 171 . 1 1 59 59 PHE N N 15 127.481 . . 9 . . . . . 59 F N . 28002 1 172 . 1 1 60 60 GLU H H 1 9.049 . . 9 . . . . . 60 E H . 28002 1 173 . 1 1 60 60 GLU CA C 13 56.847 . . 9 . . . . . 60 E CA . 28002 1 174 . 1 1 60 60 GLU CB C 13 32.258 . . 9 . . . . . 60 E CB . 28002 1 175 . 1 1 60 60 GLU N N 15 118.839 . . 9 . . . . . 60 E N . 28002 1 176 . 1 1 61 61 ASP H H 1 9.278 . . 9 . . . . . 61 D H . 28002 1 177 . 1 1 61 61 ASP CA C 13 59.131 . . 9 . . . . . 61 D CA . 28002 1 178 . 1 1 61 61 ASP N N 15 123.700 . . 9 . . . . . 61 D N . 28002 1 179 . 1 1 62 62 HIS CA C 13 58.655 . . 9 . . . . . 62 H CA . 28002 1 180 . 1 1 62 62 HIS CB C 13 29.466 . . 9 . . . . . 62 H CB . 28002 1 181 . 1 1 63 63 ILE H H 1 6.336 . . 9 . . . . . 63 I H . 28002 1 182 . 1 1 63 63 ILE CA C 13 59.925 . . 9 . . . . . 63 I CA . 28002 1 183 . 1 1 63 63 ILE CB C 13 36.520 . . 9 . . . . . 63 I CB . 28002 1 184 . 1 1 63 63 ILE N N 15 119.973 . . 9 . . . . . 63 I N . 28002 1 185 . 1 1 64 64 TYR H H 1 8.666 . . 9 . . . . . 64 Y H . 28002 1 186 . 1 1 64 64 TYR CA C 13 61.774 . . 9 . . . . . 64 Y CA . 28002 1 187 . 1 1 64 64 TYR CB C 13 39.578 . . 9 . . . . . 64 Y CB . 28002 1 188 . 1 1 64 64 TYR N N 15 119.920 . . 9 . . . . . 64 Y N . 28002 1 189 . 1 1 65 65 GLU H H 1 7.809 . . 9 . . . . . 65 E H . 28002 1 190 . 1 1 65 65 GLU CA C 13 58.162 . . 9 . . . . . 65 E CA . 28002 1 191 . 1 1 65 65 GLU CB C 13 29.999 . . 9 . . . . . 65 E CB . 28002 1 192 . 1 1 65 65 GLU N N 15 113.284 . . 9 . . . . . 65 E N . 28002 1 193 . 1 1 66 66 LYS H H 1 7.277 . . 9 . . . . . 66 K H . 28002 1 194 . 1 1 66 66 LYS CA C 13 54.946 . . 9 . . . . . 66 K CA . 28002 1 195 . 1 1 66 66 LYS CB C 13 33.258 . . 9 . . . . . 66 K CB . 28002 1 196 . 1 1 66 66 LYS N N 15 116.069 . . 9 . . . . . 66 K N . 28002 1 197 . 1 1 67 67 LEU H H 1 6.826 . . 9 . . . . . 67 L H . 28002 1 198 . 1 1 67 67 LEU CA C 13 48.513 . . 9 . . . . . 67 L CA . 28002 1 199 . 1 1 67 67 LEU CB C 13 46.719 . . 9 . . . . . 67 L CB . 28002 1 200 . 1 1 67 67 LEU N N 15 119.710 . . 9 . . . . . 67 L N . 28002 1 201 . 1 1 68 68 ASP H H 1 8.855 . . 9 . . . . . 68 D H . 28002 1 202 . 1 1 68 68 ASP CA C 13 54.688 . . 9 . . . . . 68 D CA . 28002 1 203 . 1 1 68 68 ASP CB C 13 41.559 . . 9 . . . . . 68 D CB . 28002 1 204 . 1 1 68 68 ASP N N 15 121.976 . . 9 . . . . . 68 D N . 28002 1 205 . 1 1 69 69 ALA H H 1 8.169 . . 9 . . . . . 69 A H . 28002 1 206 . 1 1 69 69 ALA CA C 13 52.641 . . 9 . . . . . 69 A CA . 28002 1 207 . 1 1 69 69 ALA CB C 13 18.769 . . 9 . . . . . 69 A CB . 28002 1 208 . 1 1 69 69 ALA N N 15 122.032 . . 9 . . . . . 69 A N . 28002 1 209 . 1 1 70 70 ILE H H 1 8.351 . . 9 . . . . . 70 I H . 28002 1 210 . 1 1 70 70 ILE CA C 13 63.119 . . 9 . . . . . 70 I CA . 28002 1 211 . 1 1 70 70 ILE CB C 13 39.277 . . 9 . . . . . 70 I CB . 28002 1 212 . 1 1 70 70 ILE N N 15 123.975 . . 9 . . . . . 70 I N . 28002 1 213 . 1 1 71 71 THR H H 1 8.102 . . 9 . . . . . 71 T H . 28002 1 214 . 1 1 71 71 THR CA C 13 61.123 . . 9 . . . . . 71 T CA . 28002 1 215 . 1 1 71 71 THR CB C 13 72.148 . . 9 . . . . . 71 T CB . 28002 1 216 . 1 1 71 71 THR N N 15 119.076 . . 9 . . . . . 71 T N . 28002 1 217 . 1 1 72 72 ASP H H 1 8.980 . . 9 . . . . . 72 D H . 28002 1 218 . 1 1 72 72 ASP CA C 13 57.913 . . 9 . . . . . 72 D CA . 28002 1 219 . 1 1 72 72 ASP CB C 13 40.556 . . 9 . . . . . 72 D CB . 28002 1 220 . 1 1 72 72 ASP N N 15 122.566 . . 9 . . . . . 72 D N . 28002 1 221 . 1 1 73 73 GLU H H 1 8.975 . . 9 . . . . . 73 E H . 28002 1 222 . 1 1 73 73 GLU CA C 13 60.646 . . 9 . . . . . 73 E CA . 28002 1 223 . 1 1 73 73 GLU CB C 13 29.270 . . 9 . . . . . 73 E CB . 28002 1 224 . 1 1 73 73 GLU N N 15 117.334 . . 9 . . . . . 73 E N . 28002 1 225 . 1 1 74 74 GLU H H 1 7.531 . . 9 . . . . . 74 E H . 28002 1 226 . 1 1 74 74 GLU CA C 13 59.330 . . 9 . . . . . 74 E CA . 28002 1 227 . 1 1 74 74 GLU CB C 13 29.186 . . 9 . . . . . 74 E CB . 28002 1 228 . 1 1 74 74 GLU N N 15 119.621 . . 9 . . . . . 74 E N . 28002 1 229 . 1 1 75 75 ASN H H 1 8.589 . . 9 . . . . . 75 N H . 28002 1 230 . 1 1 75 75 ASN CA C 13 57.095 . . 9 . . . . . 75 N CA . 28002 1 231 . 1 1 75 75 ASN CB C 13 39.169 . . 9 . . . . . 75 N CB . 28002 1 232 . 1 1 75 75 ASN N N 15 119.789 . . 9 . . . . . 75 N N . 28002 1 233 . 1 1 76 76 ASP H H 1 8.287 . . 9 . . . . . 76 D H . 28002 1 234 . 1 1 76 76 ASP CA C 13 57.614 . . 9 . . . . . 76 D CA . 28002 1 235 . 1 1 76 76 ASP CB C 13 40.719 . . 9 . . . . . 76 D CB . 28002 1 236 . 1 1 76 76 ASP N N 15 117.243 . . 9 . . . . . 76 D N . 28002 1 237 . 1 1 77 77 MET H H 1 7.054 . . 9 . . . . . 77 M H . 28002 1 238 . 1 1 77 77 MET CA C 13 50.355 . . 9 . . . . . 77 M CA . 28002 1 239 . 1 1 77 77 MET CB C 13 34.403 . . 9 . . . . . 77 M CB . 28002 1 240 . 1 1 77 77 MET N N 15 116.029 . . 9 . . . . . 77 M N . 28002 1 241 . 1 1 78 78 LEU H H 1 8.827 . . 9 . . . . . 78 L H . 28002 1 242 . 1 1 78 78 LEU CA C 13 51.206 . . 9 . . . . . 78 L CA . 28002 1 243 . 1 1 78 78 LEU CB C 13 41.420 . . 9 . . . . . 78 L CB . 28002 1 244 . 1 1 78 78 LEU N N 15 123.628 . . 9 . . . . . 78 L N . 28002 1 245 . 1 1 79 79 ASP H H 1 7.994 . . 9 . . . . . 79 D H . 28002 1 246 . 1 1 79 79 ASP CA C 13 56.906 . . 9 . . . . . 79 D CA . 28002 1 247 . 1 1 79 79 ASP CB C 13 41.417 . . 9 . . . . . 79 D CB . 28002 1 248 . 1 1 79 79 ASP N N 15 116.740 . . 9 . . . . . 79 D N . 28002 1 249 . 1 1 80 80 LEU H H 1 7.064 . . 9 . . . . . 80 L H . 28002 1 250 . 1 1 80 80 LEU CA C 13 51.071 . . 9 . . . . . 80 L CA . 28002 1 251 . 1 1 80 80 LEU CB C 13 42.403 . . 9 . . . . . 80 L CB . 28002 1 252 . 1 1 80 80 LEU N N 15 116.652 . . 9 . . . . . 80 L N . 28002 1 253 . 1 1 81 81 ALA H H 1 7.848 . . 9 . . . . . 81 A H . 28002 1 254 . 1 1 81 81 ALA CA C 13 52.367 . . 9 . . . . . 81 A CA . 28002 1 255 . 1 1 81 81 ALA CB C 13 19.104 . . 9 . . . . . 81 A CB . 28002 1 256 . 1 1 81 81 ALA N N 15 124.194 . . 9 . . . . . 81 A N . 28002 1 257 . 1 1 82 82 TYR H H 1 8.325 . . 9 . . . . . 82 Y H . 28002 1 258 . 1 1 82 82 TYR CA C 13 58.278 . . 9 . . . . . 82 Y CA . 28002 1 259 . 1 1 82 82 TYR CB C 13 38.870 . . 9 . . . . . 82 Y CB . 28002 1 260 . 1 1 82 82 TYR N N 15 123.006 . . 9 . . . . . 82 Y N . 28002 1 261 . 1 1 83 83 GLY H H 1 8.382 . . 9 . . . . . 83 G H . 28002 1 262 . 1 1 83 83 GLY CA C 13 46.466 . . 9 . . . . . 83 G CA . 28002 1 263 . 1 1 83 83 GLY N N 15 112.978 . . 9 . . . . . 83 G N . 28002 1 264 . 1 1 84 84 LEU H H 1 7.245 . . 9 . . . . . 84 L H . 28002 1 265 . 1 1 84 84 LEU CA C 13 56.898 . . 9 . . . . . 84 L CA . 28002 1 266 . 1 1 84 84 LEU CB C 13 42.756 . . 9 . . . . . 84 L CB . 28002 1 267 . 1 1 84 84 LEU N N 15 118.487 . . 9 . . . . . 84 L N . 28002 1 268 . 1 1 85 85 THR H H 1 8.855 . . 9 . . . . . 85 T H . 28002 1 269 . 1 1 85 85 THR CA C 13 60.127 . . 9 . . . . . 85 T CA . 28002 1 270 . 1 1 85 85 THR CB C 13 74.476 . . 9 . . . . . 85 T CB . 28002 1 271 . 1 1 85 85 THR N N 15 117.610 . . 9 . . . . . 85 T N . 28002 1 272 . 1 1 86 86 ASP H H 1 8.513 . . 9 . . . . . 86 D H . 28002 1 273 . 1 1 86 86 ASP CA C 13 54.337 . . 9 . . . . . 86 D CA . 28002 1 274 . 1 1 86 86 ASP CB C 13 39.704 . . 9 . . . . . 86 D CB . 28002 1 275 . 1 1 86 86 ASP N N 15 117.877 . . 9 . . . . . 86 D N . 28002 1 276 . 1 1 87 87 ARG H H 1 8.316 . . 9 . . . . . 87 R H . 28002 1 277 . 1 1 87 87 ARG CA C 13 53.797 . . 9 . . . . . 87 R CA . 28002 1 278 . 1 1 87 87 ARG CB C 13 30.011 . . 9 . . . . . 87 R CB . 28002 1 279 . 1 1 87 87 ARG N N 15 119.587 . . 9 . . . . . 87 R N . 28002 1 280 . 1 1 88 88 SER H H 1 7.040 . . 9 . . . . . 88 S H . 28002 1 281 . 1 1 88 88 SER CA C 13 60.674 . . 9 . . . . . 88 S CA . 28002 1 282 . 1 1 88 88 SER CB C 13 65.342 . . 9 . . . . . 88 S CB . 28002 1 283 . 1 1 88 88 SER N N 15 120.042 . . 9 . . . . . 88 S N . 28002 1 284 . 1 1 89 89 ARG H H 1 9.382 . . 9 . . . . . 89 R H . 28002 1 285 . 1 1 89 89 ARG CA C 13 52.828 . . 9 . . . . . 89 R CA . 28002 1 286 . 1 1 89 89 ARG CB C 13 34.088 . . 9 . . . . . 89 R CB . 28002 1 287 . 1 1 89 89 ARG N N 15 118.277 . . 9 . . . . . 89 R N . 28002 1 288 . 1 1 90 90 LEU H H 1 9.252 . . 9 . . . . . 90 L H . 28002 1 289 . 1 1 90 90 LEU CA C 13 58.172 . . 9 . . . . . 90 L CA . 28002 1 290 . 1 1 90 90 LEU CB C 13 39.439 . . 9 . . . . . 90 L CB . 28002 1 291 . 1 1 90 90 LEU N N 15 120.535 . . 9 . . . . . 90 L N . 28002 1 292 . 1 1 91 91 GLY H H 1 8.449 . . 9 . . . . . 91 G H . 28002 1 293 . 1 1 91 91 GLY CA C 13 45.410 . . 9 . . . . . 91 G CA . 28002 1 294 . 1 1 91 91 GLY N N 15 110.624 . . 9 . . . . . 91 G N . 28002 1 295 . 1 1 92 92 CYS H H 1 8.068 . . 9 . . . . . 92 C H . 28002 1 296 . 1 1 92 92 CYS CA C 13 56.323 . . 9 . . . . . 92 C CA . 28002 1 297 . 1 1 92 92 CYS CB C 13 33.272 . . 9 . . . . . 92 C CB . 28002 1 298 . 1 1 92 92 CYS N N 15 120.980 . . 9 . . . . . 92 C N . 28002 1 299 . 1 1 93 93 GLN H H 1 8.288 . . 9 . . . . . 93 Q H . 28002 1 300 . 1 1 93 93 GLN CA C 13 54.174 . . 9 . . . . . 93 Q CA . 28002 1 301 . 1 1 93 93 GLN CB C 13 29.988 . . 9 . . . . . 93 Q CB . 28002 1 302 . 1 1 93 93 GLN N N 15 115.383 . . 9 . . . . . 93 Q N . 28002 1 303 . 1 1 94 94 ILE H H 1 7.350 . . 9 . . . . . 94 I H . 28002 1 304 . 1 1 94 94 ILE C C 13 47.852 . . 9 . . . . . 94 I C . 28002 1 305 . 1 1 94 94 ILE N N 15 121.091 . . 9 . . . . . 94 I N . 28002 1 306 . 1 1 95 95 CYS H H 1 8.082 . . 9 . . . . . 95 C H . 28002 1 307 . 1 1 95 95 CYS CB C 13 43.155 . . 9 . . . . . 95 C CB . 28002 1 308 . 1 1 95 95 CYS N N 15 123.728 . . 9 . . . . . 95 C N . 28002 1 309 . 1 1 96 96 LEU H H 1 8.981 . . 9 . . . . . 96 L H . 28002 1 310 . 1 1 96 96 LEU CA C 13 52.303 . . 9 . . . . . 96 L CA . 28002 1 311 . 1 1 96 96 LEU CB C 13 42.355 . . 9 . . . . . 96 L CB . 28002 1 312 . 1 1 96 96 LEU N N 15 120.849 . . 9 . . . . . 96 L N . 28002 1 313 . 1 1 97 97 THR H H 1 7.804 . . 9 . . . . . 97 T H . 28002 1 314 . 1 1 97 97 THR CA C 13 59.350 . . 9 . . . . . 97 T CA . 28002 1 315 . 1 1 97 97 THR CB C 13 71.601 . . 9 . . . . . 97 T CB . 28002 1 316 . 1 1 97 97 THR N N 15 113.626 . . 9 . . . . . 97 T N . 28002 1 317 . 1 1 98 98 LYS H H 1 9.163 . . 9 . . . . . 98 K H . 28002 1 318 . 1 1 98 98 LYS CB C 13 31.993 . . 9 . . . . . 98 K CB . 28002 1 319 . 1 1 98 98 LYS N N 15 121.094 . . 9 . . . . . 98 K N . 28002 1 320 . 1 1 99 99 SER CA C 13 60.303 . . 9 . . . . . 99 S CA . 28002 1 321 . 1 1 99 99 SER CB C 13 62.680 . . 9 . . . . . 99 S CB . 28002 1 322 . 1 1 100 100 MET H H 1 7.675 . . 9 . . . . . 100 M H . 28002 1 323 . 1 1 100 100 MET CA C 13 56.750 . . 9 . . . . . 100 M CA . 28002 1 324 . 1 1 100 100 MET CB C 13 32.374 . . 9 . . . . . 100 M CB . 28002 1 325 . 1 1 100 100 MET N N 15 120.217 . . 9 . . . . . 100 M N . 28002 1 326 . 1 1 101 101 ASP H H 1 7.206 . . 9 . . . . . 101 D H . 28002 1 327 . 1 1 101 101 ASP CA C 13 57.008 . . 9 . . . . . 101 D CA . 28002 1 328 . 1 1 101 101 ASP CB C 13 41.125 . . 9 . . . . . 101 D CB . 28002 1 329 . 1 1 101 101 ASP N N 15 117.875 . . 9 . . . . . 101 D N . 28002 1 330 . 1 1 102 102 ASN H H 1 9.975 . . 9 . . . . . 102 N H . 28002 1 331 . 1 1 102 102 ASN CA C 13 55.757 . . 9 . . . . . 102 N CA . 28002 1 332 . 1 1 102 102 ASN CB C 13 37.996 . . 9 . . . . . 102 N CB . 28002 1 333 . 1 1 102 102 ASN N N 15 122.417 . . 9 . . . . . 102 N N . 28002 1 334 . 1 1 103 103 MET H H 1 8.402 . . 9 . . . . . 103 M H . 28002 1 335 . 1 1 103 103 MET CA C 13 56.566 . . 9 . . . . . 103 M CA . 28002 1 336 . 1 1 103 103 MET CB C 13 31.436 . . 9 . . . . . 103 M CB . 28002 1 337 . 1 1 103 103 MET N N 15 118.039 . . 9 . . . . . 103 M N . 28002 1 338 . 1 1 104 104 THR H H 1 8.634 . . 9 . . . . . 104 T H . 28002 1 339 . 1 1 104 104 THR CA C 13 63.934 . . 9 . . . . . 104 T CA . 28002 1 340 . 1 1 104 104 THR CB C 13 70.476 . . 9 . . . . . 104 T CB . 28002 1 341 . 1 1 104 104 THR N N 15 117.013 . . 9 . . . . . 104 T N . 28002 1 342 . 1 1 105 105 VAL H H 1 9.124 . . 9 . . . . . 105 V H . 28002 1 343 . 1 1 105 105 VAL CA C 13 58.341 . . 9 . . . . . 105 V CA . 28002 1 344 . 1 1 105 105 VAL CB C 13 34.325 . . 9 . . . . . 105 V CB . 28002 1 345 . 1 1 105 105 VAL N N 15 122.496 . . 9 . . . . . 105 V N . 28002 1 346 . 1 1 106 106 ARG H H 1 8.403 . . 9 . . . . . 106 R H . 28002 1 347 . 1 1 106 106 ARG CA C 13 54.621 . . 9 . . . . . 106 R CA . 28002 1 348 . 1 1 106 106 ARG CB C 13 33.568 . . 9 . . . . . 106 R CB . 28002 1 349 . 1 1 106 106 ARG N N 15 120.888 . . 9 . . . . . 106 R N . 28002 1 350 . 1 1 107 107 VAL H H 1 8.396 . . 9 . . . . . 107 V H . 28002 1 351 . 1 1 107 107 VAL CA C 13 59.654 . . 9 . . . . . 107 V CA . 28002 1 352 . 1 1 107 107 VAL CB C 13 32.210 . . 9 . . . . . 107 V CB . 28002 1 353 . 1 1 107 107 VAL N N 15 124.384 . . 9 . . . . . 107 V N . 28002 1 354 . 1 1 108 108 PRO CA C 13 62.862 . . 9 . . . . . 108 P CA . 28002 1 355 . 1 1 108 108 PRO CB C 13 32.330 . . 9 . . . . . 108 P CB . 28002 1 356 . 1 1 109 109 GLU H H 1 8.649 . . 9 . . . . . 109 E H . 28002 1 357 . 1 1 109 109 GLU CA C 13 57.262 . . 9 . . . . . 109 E CA . 28002 1 358 . 1 1 109 109 GLU CB C 13 30.794 . . 9 . . . . . 109 E CB . 28002 1 359 . 1 1 109 109 GLU N N 15 120.791 . . 9 . . . . . 109 E N . 28002 1 360 . 1 1 110 110 THR H H 1 8.324 . . 9 . . . . . 110 T H . 28002 1 361 . 1 1 110 110 THR CA C 13 61.136 . . 9 . . . . . 110 T CA . 28002 1 362 . 1 1 110 110 THR CB C 13 70.309 . . 9 . . . . . 110 T CB . 28002 1 363 . 1 1 110 110 THR N N 15 113.644 . . 9 . . . . . 110 T N . 28002 1 364 . 1 1 111 111 VAL H H 1 7.859 . . 9 . . . . . 111 V H . 28002 1 365 . 1 1 111 111 VAL CA C 13 61.885 . . 9 . . . . . 111 V CA . 28002 1 366 . 1 1 111 111 VAL CB C 13 32.987 . . 9 . . . . . 111 V CB . 28002 1 367 . 1 1 111 111 VAL N N 15 120.992 . . 9 . . . . . 111 V N . 28002 1 368 . 1 1 112 112 ALA H H 1 8.170 . . 9 . . . . . 112 A H . 28002 1 369 . 1 1 112 112 ALA CA C 13 52.678 . . 9 . . . . . 112 A CA . 28002 1 370 . 1 1 112 112 ALA CB C 13 19.296 . . 9 . . . . . 112 A CB . 28002 1 371 . 1 1 112 112 ALA N N 15 127.087 . . 9 . . . . . 112 A N . 28002 1 372 . 1 1 113 113 ASP H H 1 8.152 . . 9 . . . . . 113 D H . 28002 1 373 . 1 1 113 113 ASP CA C 13 51.091 . . 9 . . . . . 113 D CA . 28002 1 374 . 1 1 113 113 ASP CB C 13 41.389 . . 9 . . . . . 113 D CB . 28002 1 375 . 1 1 113 113 ASP N N 15 119.705 . . 9 . . . . . 113 D N . 28002 1 376 . 1 1 114 114 ALA H H 1 8.239 . . 9 . . . . . 114 A H . 28002 1 377 . 1 1 114 114 ALA CA C 13 52.932 . . 9 . . . . . 114 A CA . 28002 1 378 . 1 1 114 114 ALA CB C 13 19.074 . . 9 . . . . . 114 A CB . 28002 1 379 . 1 1 114 114 ALA N N 15 125.127 . . 9 . . . . . 114 A N . 28002 1 380 . 1 1 115 115 ARG H H 1 8.290 . . 9 . . . . . 115 R H . 28002 1 381 . 1 1 115 115 ARG CA C 13 43.603 . . 9 . . . . . 115 R CA . 28002 1 382 . 1 1 115 115 ARG CB C 13 30.504 . . 9 . . . . . 115 R CB . 28002 1 383 . 1 1 115 115 ARG N N 15 119.454 . . 9 . . . . . 115 R N . 28002 1 384 . 1 1 116 116 GLN H H 1 9.422 . . 9 . . . . . 116 Q H . 28002 1 385 . 1 1 116 116 GLN N N 15 128.199 . . 9 . . . . . 116 Q N . 28002 1 386 . 1 1 117 117 SER H H 1 7.965 . . 9 . . . . . 117 S H . 28002 1 387 . 1 1 117 117 SER CA C 13 60.172 . . 9 . . . . . 117 S CA . 28002 1 388 . 1 1 117 117 SER CB C 13 63.717 . . 9 . . . . . 117 S CB . 28002 1 389 . 1 1 117 117 SER N N 15 123.295 . . 9 . . . . . 117 S N . 28002 1 390 . 1 1 118 118 ILE H H 1 8.094 . . 9 . . . . . 118 I H . 28002 1 391 . 1 1 118 118 ILE CA C 13 61.317 . . 9 . . . . . 118 I CA . 28002 1 392 . 1 1 118 118 ILE CB C 13 39.050 . . 9 . . . . . 118 I CB . 28002 1 393 . 1 1 118 118 ILE N N 15 121.961 . . 9 . . . . . 118 I N . 28002 1 394 . 1 1 119 119 ASP H H 1 8.367 . . 9 . . . . . 119 D H . 28002 1 395 . 1 1 119 119 ASP CA C 13 54.325 . . 9 . . . . . 119 D CA . 28002 1 396 . 1 1 119 119 ASP CB C 13 41.248 . . 9 . . . . . 119 D CB . 28002 1 397 . 1 1 119 119 ASP N N 15 124.277 . . 9 . . . . . 119 D N . 28002 1 398 . 1 1 120 120 VAL H H 1 8.019 . . 9 . . . . . 120 V H . 28002 1 399 . 1 1 120 120 VAL CA C 13 57.581 . . 9 . . . . . 120 V CA . 28002 1 400 . 1 1 120 120 VAL CB C 13 32.609 . . 9 . . . . . 120 V CB . 28002 1 401 . 1 1 120 120 VAL N N 15 120.253 . . 9 . . . . . 120 V N . 28002 1 402 . 1 1 121 121 GLY H H 1 8.425 . . 9 . . . . . 121 G H . 28002 1 403 . 1 1 121 121 GLY CA C 13 45.391 . . 9 . . . . . 121 G CA . 28002 1 404 . 1 1 121 121 GLY N N 15 116.244 . . 9 . . . . . 121 G N . 28002 1 405 . 1 1 123 123 THR CA C 13 61.777 . . 9 . . . . . 123 T CA . 28002 1 406 . 1 1 123 123 THR CB C 13 69.966 . . 9 . . . . . 123 T CB . 28002 1 407 . 1 1 124 124 SER H H 1 7.966 . . 9 . . . . . 124 S H . 28002 1 408 . 1 1 124 124 SER CA C 13 60.044 . . 9 . . . . . 124 S CA . 28002 1 409 . 1 1 124 124 SER CB C 13 64.837 . . 9 . . . . . 124 S CB . 28002 1 410 . 1 1 124 124 SER N N 15 123.358 . . 9 . . . . . 124 S N . 28002 1 stop_ save_