################################### # 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 19868 _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' . . . 19868 1 2 '3D HNCO' . . . 19868 1 3 '3D HN(CA)CO' . . . 19868 1 4 '3D HNCACB' . . . 19868 1 5 '3D HN(CO)CACB' . . . 19868 1 6 '3D HNCA' . . . 19868 1 7 '3D HN(CO)CA' . . . 19868 1 8 '3D HNCO' . . . 19868 1 9 '3D HNCA' . . . 19868 1 10 '3D HN(CO)CACB' . . . 19868 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 3 3 ARG C C 13 176.196 0.05 . 1 . . . . . 3 ARG C . 19868 1 2 . 1 . 1 3 3 ARG CA C 13 56.251 0.1 . 1 . . . . . 3 ARG CA . 19868 1 3 . 1 . 1 3 3 ARG CB C 13 30.956 0.1 . 1 . . . . . 3 ARG CB . 19868 1 4 . 1 . 1 4 4 THR H H 1 8.455 0.01 . 1 . . . . . 4 THR H . 19868 1 5 . 1 . 1 4 4 THR C C 13 174.516 0.05 . 1 . . . . . 4 THR C . 19868 1 6 . 1 . 1 4 4 THR CA C 13 61.737 0.1 . 1 . . . . . 4 THR CA . 19868 1 7 . 1 . 1 4 4 THR CB C 13 70.223 0.1 . 1 . . . . . 4 THR CB . 19868 1 8 . 1 . 1 4 4 THR N N 15 117.049 0.05 . 1 . . . . . 4 THR N . 19868 1 9 . 1 . 1 5 5 LYS H H 1 8.452 0.01 . 1 . . . . . 5 LYS H . 19868 1 10 . 1 . 1 5 5 LYS C C 13 176.44 0.05 . 1 . . . . . 5 LYS C . 19868 1 11 . 1 . 1 5 5 LYS CA C 13 56.621 0.1 . 1 . . . . . 5 LYS CA . 19868 1 12 . 1 . 1 5 5 LYS CB C 13 33.112 0.1 . 1 . . . . . 5 LYS CB . 19868 1 13 . 1 . 1 5 5 LYS N N 15 123.911 0.05 . 1 . . . . . 5 LYS N . 19868 1 14 . 1 . 1 6 6 ALA H H 1 8.386 0.01 . 1 . . . . . 6 ALA H . 19868 1 15 . 1 . 1 6 6 ALA C C 13 177.515 0.05 . 1 . . . . . 6 ALA C . 19868 1 16 . 1 . 1 6 6 ALA CA C 13 52.702 0.1 . 1 . . . . . 6 ALA CA . 19868 1 17 . 1 . 1 6 6 ALA CB C 13 19.266 0.1 . 1 . . . . . 6 ALA CB . 19868 1 18 . 1 . 1 6 6 ALA N N 15 125.419 0.05 . 1 . . . . . 6 ALA N . 19868 1 19 . 1 . 1 7 7 ASP H H 1 8.241 0.01 . 1 . . . . . 7 ASP H . 19868 1 20 . 1 . 1 7 7 ASP C C 13 176.253 0.05 . 1 . . . . . 7 ASP C . 19868 1 21 . 1 . 1 7 7 ASP CA C 13 54.432 0.1 . 1 . . . . . 7 ASP CA . 19868 1 22 . 1 . 1 7 7 ASP CB C 13 41.208 0.1 . 1 . . . . . 7 ASP CB . 19868 1 23 . 1 . 1 7 7 ASP N N 15 119.288 0.05 . 1 . . . . . 7 ASP N . 19868 1 24 . 1 . 1 8 8 SER H H 1 8.134 0.01 . 1 . . . . . 8 SER H . 19868 1 25 . 1 . 1 8 8 SER C C 13 174.145 0.05 . 1 . . . . . 8 SER C . 19868 1 26 . 1 . 1 8 8 SER CA C 13 58.277 0.1 . 1 . . . . . 8 SER CA . 19868 1 27 . 1 . 1 8 8 SER CB C 13 63.968 0.1 . 1 . . . . . 8 SER CB . 19868 1 28 . 1 . 1 8 8 SER N N 15 115.57 0.05 . 1 . . . . . 8 SER N . 19868 1 29 . 1 . 1 9 9 VAL H H 1 8.143 0.01 . 1 . . . . . 9 VAL H . 19868 1 30 . 1 . 1 9 9 VAL CA C 13 60.128 0.1 . 1 . . . . . 9 VAL CA . 19868 1 31 . 1 . 1 9 9 VAL N N 15 122.959 0.05 . 1 . . . . . 9 VAL N . 19868 1 32 . 1 . 1 10 10 PRO C C 13 177.545 0.05 . 1 . . . . . 10 PRO C . 19868 1 33 . 1 . 1 10 10 PRO CA C 13 63.653 0.1 . 1 . . . . . 10 PRO CA . 19868 1 34 . 1 . 1 10 10 PRO CB C 13 32.205 0.1 . 1 . . . . . 10 PRO CB . 19868 1 35 . 1 . 1 11 11 GLY H H 1 8.516 0.01 . 1 . . . . . 11 GLY H . 19868 1 36 . 1 . 1 11 11 GLY C C 13 174.418 0.05 . 1 . . . . . 11 GLY C . 19868 1 37 . 1 . 1 11 11 GLY CA C 13 45.514 0.1 . 1 . . . . . 11 GLY CA . 19868 1 38 . 1 . 1 11 11 GLY N N 15 109.239 0.05 . 1 . . . . . 11 GLY N . 19868 1 39 . 1 . 1 12 12 THR H H 1 7.919 0.01 . 1 . . . . . 12 THR H . 19868 1 40 . 1 . 1 12 12 THR C C 13 174.313 0.05 . 1 . . . . . 12 THR C . 19868 1 41 . 1 . 1 12 12 THR CA C 13 62.238 0.1 . 1 . . . . . 12 THR CA . 19868 1 42 . 1 . 1 12 12 THR CB C 13 69.922 0.1 . 1 . . . . . 12 THR CB . 19868 1 43 . 1 . 1 12 12 THR N N 15 113.394 0.05 . 1 . . . . . 12 THR N . 19868 1 44 . 1 . 1 13 13 TYR H H 1 8.233 0.01 . 1 . . . . . 13 TYR H . 19868 1 45 . 1 . 1 13 13 TYR C C 13 175.449 0.05 . 1 . . . . . 13 TYR C . 19868 1 46 . 1 . 1 13 13 TYR CA C 13 58.06 0.1 . 1 . . . . . 13 TYR CA . 19868 1 47 . 1 . 1 13 13 TYR CB C 13 38.829 0.1 . 1 . . . . . 13 TYR CB . 19868 1 48 . 1 . 1 13 13 TYR N N 15 122.785 0.05 . 1 . . . . . 13 TYR N . 19868 1 49 . 1 . 1 14 14 ARG H H 1 8.104 0.01 . 1 . . . . . 14 ARG H . 19868 1 50 . 1 . 1 14 14 ARG C C 13 175.47 0.05 . 1 . . . . . 14 ARG C . 19868 1 51 . 1 . 1 14 14 ARG CA C 13 55.818 0.1 . 1 . . . . . 14 ARG CA . 19868 1 52 . 1 . 1 14 14 ARG CB C 13 31.101 0.1 . 1 . . . . . 14 ARG CB . 19868 1 53 . 1 . 1 14 14 ARG N N 15 123.337 0.05 . 1 . . . . . 14 ARG N . 19868 1 54 . 1 . 1 15 15 LYS H H 1 8.244 0.01 . 1 . . . . . 15 LYS H . 19868 1 55 . 1 . 1 15 15 LYS C C 13 176.382 0.05 . 1 . . . . . 15 LYS C . 19868 1 56 . 1 . 1 15 15 LYS CA C 13 56.46 0.1 . 1 . . . . . 15 LYS CA . 19868 1 57 . 1 . 1 15 15 LYS CB C 13 33.073 0.1 . 1 . . . . . 15 LYS CB . 19868 1 58 . 1 . 1 15 15 LYS N N 15 123.369 0.05 . 1 . . . . . 15 LYS N . 19868 1 59 . 1 . 1 16 16 VAL H H 1 8.231 0.01 . 1 . . . . . 16 VAL H . 19868 1 60 . 1 . 1 16 16 VAL C C 13 176.065 0.05 . 1 . . . . . 16 VAL C . 19868 1 61 . 1 . 1 16 16 VAL CA C 13 62.346 0.1 . 1 . . . . . 16 VAL CA . 19868 1 62 . 1 . 1 16 16 VAL CB C 13 32.862 0.1 . 1 . . . . . 16 VAL CB . 19868 1 63 . 1 . 1 16 16 VAL N N 15 122.904 0.05 . 1 . . . . . 16 VAL N . 19868 1 64 . 1 . 1 17 17 VAL H H 1 8.255 0.01 . 1 . . . . . 17 VAL H . 19868 1 65 . 1 . 1 17 17 VAL C C 13 175.708 0.05 . 1 . . . . . 17 VAL C . 19868 1 66 . 1 . 1 17 17 VAL CA C 13 62.187 0.1 . 1 . . . . . 17 VAL CA . 19868 1 67 . 1 . 1 17 17 VAL CB C 13 32.881 0.1 . 1 . . . . . 17 VAL CB . 19868 1 68 . 1 . 1 17 17 VAL N N 15 124.92 0.05 . 1 . . . . . 17 VAL N . 19868 1 69 . 1 . 1 18 18 ALA H H 1 8.364 0.01 . 1 . . . . . 18 ALA H . 19868 1 70 . 1 . 1 18 18 ALA C C 13 177.248 0.05 . 1 . . . . . 18 ALA C . 19868 1 71 . 1 . 1 18 18 ALA CA C 13 52.358 0.1 . 1 . . . . . 18 ALA CA . 19868 1 72 . 1 . 1 18 18 ALA CB C 13 19.374 0.1 . 1 . . . . . 18 ALA CB . 19868 1 73 . 1 . 1 18 18 ALA N N 15 128.262 0.05 . 1 . . . . . 18 ALA N . 19868 1 74 . 1 . 1 19 19 ALA H H 1 8.259 0.01 . 1 . . . . . 19 ALA H . 19868 1 75 . 1 . 1 19 19 ALA C C 13 177.583 0.05 . 1 . . . . . 19 ALA C . 19868 1 76 . 1 . 1 19 19 ALA CA C 13 52.408 0.1 . 1 . . . . . 19 ALA CA . 19868 1 77 . 1 . 1 19 19 ALA N N 15 123.684 0.05 . 1 . . . . . 19 ALA N . 19868 1 78 . 1 . 1 20 20 ARG H H 1 8.268 0.01 . 1 . . . . . 20 ARG H . 19868 1 79 . 1 . 1 20 20 ARG C C 13 175.686 0.05 . 1 . . . . . 20 ARG C . 19868 1 80 . 1 . 1 20 20 ARG CA C 13 55.687 0.1 . 1 . . . . . 20 ARG CA . 19868 1 81 . 1 . 1 20 20 ARG CB C 13 31.048 0.1 . 1 . . . . . 20 ARG CB . 19868 1 82 . 1 . 1 20 20 ARG N N 15 120.467 0.05 . 1 . . . . . 20 ARG N . 19868 1 83 . 1 . 1 21 21 ALA H H 1 8.331 0.01 . 1 . . . . . 21 ALA H . 19868 1 84 . 1 . 1 21 21 ALA CA C 13 50.534 0.1 . 1 . . . . . 21 ALA CA . 19868 1 85 . 1 . 1 21 21 ALA N N 15 126.879 0.05 . 1 . . . . . 21 ALA N . 19868 1 86 . 1 . 1 22 22 PRO C C 13 176.812 0.05 . 1 . . . . . 22 PRO C . 19868 1 87 . 1 . 1 22 22 PRO CA C 13 62.937 0.1 . 1 . . . . . 22 PRO CA . 19868 1 88 . 1 . 1 22 22 PRO CB C 13 32.139 0.1 . 1 . . . . . 22 PRO CB . 19868 1 89 . 1 . 1 23 23 ARG H H 1 8.418 0.01 . 1 . . . . . 23 ARG H . 19868 1 90 . 1 . 1 23 23 ARG C C 13 176.234 0.05 . 1 . . . . . 23 ARG C . 19868 1 91 . 1 . 1 23 23 ARG CA C 13 56.133 0.1 . 1 . . . . . 23 ARG CA . 19868 1 92 . 1 . 1 23 23 ARG CB C 13 31.012 0.1 . 1 . . . . . 23 ARG CB . 19868 1 93 . 1 . 1 23 23 ARG N N 15 121.592 0.05 . 1 . . . . . 23 ARG N . 19868 1 94 . 1 . 1 24 24 LYS H H 1 8.398 0.01 . 1 . . . . . 24 LYS H . 19868 1 95 . 1 . 1 24 24 LYS C C 13 176.208 0.05 . 1 . . . . . 24 LYS C . 19868 1 96 . 1 . 1 24 24 LYS CA C 13 56.248 0.1 . 1 . . . . . 24 LYS CA . 19868 1 97 . 1 . 1 24 24 LYS CB C 13 33.181 0.1 . 1 . . . . . 24 LYS CB . 19868 1 98 . 1 . 1 24 24 LYS N N 15 123.453 0.05 . 1 . . . . . 24 LYS N . 19868 1 99 . 1 . 1 25 25 VAL H H 1 8.271 0.01 . 1 . . . . . 25 VAL H . 19868 1 100 . 1 . 1 25 25 VAL C C 13 176.082 0.05 . 1 . . . . . 25 VAL C . 19868 1 101 . 1 . 1 25 25 VAL CA C 13 62.223 0.1 . 1 . . . . . 25 VAL CA . 19868 1 102 . 1 . 1 25 25 VAL CB C 13 32.869 0.1 . 1 . . . . . 25 VAL CB . 19868 1 103 . 1 . 1 25 25 VAL N N 15 122.71 0.05 . 1 . . . . . 25 VAL N . 19868 1 104 . 1 . 1 26 26 LEU H H 1 8.447 0.01 . 1 . . . . . 26 LEU H . 19868 1 105 . 1 . 1 26 26 LEU C C 13 177.77 0.05 . 1 . . . . . 26 LEU C . 19868 1 106 . 1 . 1 26 26 LEU CA C 13 55.255 0.1 . 1 . . . . . 26 LEU CA . 19868 1 107 . 1 . 1 26 26 LEU CB C 13 42.447 0.1 . 1 . . . . . 26 LEU CB . 19868 1 108 . 1 . 1 26 26 LEU N N 15 126.802 0.05 . 1 . . . . . 26 LEU N . 19868 1 109 . 1 . 1 27 27 GLY H H 1 8.46 0.01 . 1 . . . . . 27 GLY H . 19868 1 110 . 1 . 1 27 27 GLY C C 13 174.117 0.05 . 1 . . . . . 27 GLY C . 19868 1 111 . 1 . 1 27 27 GLY CA C 13 45.344 0.1 . 1 . . . . . 27 GLY CA . 19868 1 112 . 1 . 1 27 27 GLY N N 15 110.108 0.05 . 1 . . . . . 27 GLY N . 19868 1 113 . 1 . 1 28 28 SER H H 1 8.245 0.01 . 1 . . . . . 28 SER H . 19868 1 114 . 1 . 1 28 28 SER C C 13 174.911 0.05 . 1 . . . . . 28 SER C . 19868 1 115 . 1 . 1 28 28 SER CA C 13 58.217 0.1 . 1 . . . . . 28 SER CA . 19868 1 116 . 1 . 1 28 28 SER CB C 13 64.071 0.1 . 1 . . . . . 28 SER CB . 19868 1 117 . 1 . 1 28 28 SER N N 15 115.406 0.05 . 1 . . . . . 28 SER N . 19868 1 118 . 1 . 1 29 29 SER H H 1 8.514 0.01 . 1 . . . . . 29 SER H . 19868 1 119 . 1 . 1 29 29 SER C C 13 174.991 0.05 . 1 . . . . . 29 SER C . 19868 1 120 . 1 . 1 29 29 SER CA C 13 58.57 0.1 . 1 . . . . . 29 SER CA . 19868 1 121 . 1 . 1 29 29 SER CB C 13 63.823 0.1 . 1 . . . . . 29 SER CB . 19868 1 122 . 1 . 1 29 29 SER N N 15 117.986 0.05 . 1 . . . . . 29 SER N . 19868 1 123 . 1 . 1 30 30 THR H H 1 8.244 0.01 . 1 . . . . . 30 THR H . 19868 1 124 . 1 . 1 30 30 THR C C 13 174.74 0.05 . 1 . . . . . 30 THR C . 19868 1 125 . 1 . 1 30 30 THR CA C 13 62.028 0.1 . 1 . . . . . 30 THR CA . 19868 1 126 . 1 . 1 30 30 THR CB C 13 69.713 0.1 . 1 . . . . . 30 THR CB . 19868 1 127 . 1 . 1 30 30 THR N N 15 115.529 0.05 . 1 . . . . . 30 THR N . 19868 1 128 . 1 . 1 31 31 SER H H 1 8.298 0.01 . 1 . . . . . 31 SER H . 19868 1 129 . 1 . 1 31 31 SER C C 13 174.444 0.05 . 1 . . . . . 31 SER C . 19868 1 130 . 1 . 1 31 31 SER CA C 13 58.445 0.1 . 1 . . . . . 31 SER CA . 19868 1 131 . 1 . 1 31 31 SER CB C 13 63.895 0.1 . 1 . . . . . 31 SER CB . 19868 1 132 . 1 . 1 31 31 SER N N 15 118.068 0.05 . 1 . . . . . 31 SER N . 19868 1 133 . 1 . 1 32 32 ALA H H 1 8.389 0.01 . 1 . . . . . 32 ALA H . 19868 1 134 . 1 . 1 32 32 ALA C C 13 178.087 0.05 . 1 . . . . . 32 ALA C . 19868 1 135 . 1 . 1 32 32 ALA CA C 13 52.841 0.1 . 1 . . . . . 32 ALA CA . 19868 1 136 . 1 . 1 32 32 ALA CB C 13 19.316 0.1 . 1 . . . . . 32 ALA CB . 19868 1 137 . 1 . 1 32 32 ALA N N 15 126.165 0.05 . 1 . . . . . 32 ALA N . 19868 1 138 . 1 . 1 33 33 THR H H 1 8.129 0.01 . 1 . . . . . 33 THR H . 19868 1 139 . 1 . 1 33 33 THR C C 13 174.503 0.05 . 1 . . . . . 33 THR C . 19868 1 140 . 1 . 1 33 33 THR CA C 13 61.98 0.1 . 1 . . . . . 33 THR CA . 19868 1 141 . 1 . 1 33 33 THR CB C 13 69.765 0.1 . 1 . . . . . 33 THR CB . 19868 1 142 . 1 . 1 33 33 THR N N 15 112.746 0.05 . 1 . . . . . 33 THR N . 19868 1 143 . 1 . 1 34 34 ASN H H 1 8.396 0.01 . 1 . . . . . 34 ASN H . 19868 1 144 . 1 . 1 34 34 ASN C C 13 175.384 0.05 . 1 . . . . . 34 ASN C . 19868 1 145 . 1 . 1 34 34 ASN CA C 13 53.364 0.1 . 1 . . . . . 34 ASN CA . 19868 1 146 . 1 . 1 34 34 ASN CB C 13 38.99 0.1 . 1 . . . . . 34 ASN CB . 19868 1 147 . 1 . 1 34 34 ASN N N 15 120.932 0.05 . 1 . . . . . 34 ASN N . 19868 1 148 . 1 . 1 35 35 SER H H 1 8.338 0.01 . 1 . . . . . 35 SER H . 19868 1 149 . 1 . 1 35 35 SER CA C 13 58.711 0.1 . 1 . . . . . 35 SER CA . 19868 1 150 . 1 . 1 35 35 SER N N 15 116.292 0.05 . 1 . . . . . 35 SER N . 19868 1 151 . 1 . 1 36 36 THR C C 13 174.782 0.05 . 1 . . . . . 36 THR C . 19868 1 152 . 1 . 1 36 36 THR CA C 13 62.066 0.1 . 1 . . . . . 36 THR CA . 19868 1 153 . 1 . 1 36 36 THR CB C 13 69.713 0.1 . 1 . . . . . 36 THR CB . 19868 1 154 . 1 . 1 37 37 SER H H 1 8.314 0.01 . 1 . . . . . 37 SER H . 19868 1 155 . 1 . 1 37 37 SER C C 13 174.806 0.05 . 1 . . . . . 37 SER C . 19868 1 156 . 1 . 1 37 37 SER CA C 13 58.49 0.1 . 1 . . . . . 37 SER CA . 19868 1 157 . 1 . 1 37 37 SER CB C 13 63.846 0.1 . 1 . . . . . 37 SER CB . 19868 1 158 . 1 . 1 37 37 SER N N 15 118.275 0.05 . 1 . . . . . 37 SER N . 19868 1 159 . 1 . 1 38 38 VAL H H 1 8.185 0.01 . 1 . . . . . 38 VAL H . 19868 1 160 . 1 . 1 38 38 VAL C C 13 176.562 0.05 . 1 . . . . . 38 VAL C . 19868 1 161 . 1 . 1 38 38 VAL CA C 13 62.787 0.1 . 1 . . . . . 38 VAL CA . 19868 1 162 . 1 . 1 38 38 VAL CB C 13 32.665 0.1 . 1 . . . . . 38 VAL CB . 19868 1 163 . 1 . 1 38 38 VAL N N 15 121.667 0.05 . 1 . . . . . 38 VAL N . 19868 1 164 . 1 . 1 39 39 SER H H 1 8.362 0.01 . 1 . . . . . 39 SER H . 19868 1 165 . 1 . 1 39 39 SER C C 13 174.941 0.05 . 1 . . . . . 39 SER C . 19868 1 166 . 1 . 1 39 39 SER CA C 13 58.698 0.1 . 1 . . . . . 39 SER CA . 19868 1 167 . 1 . 1 39 39 SER CB C 13 63.741 0.1 . 1 . . . . . 39 SER CB . 19868 1 168 . 1 . 1 39 39 SER N N 15 118.687 0.05 . 1 . . . . . 39 SER N . 19868 1 169 . 1 . 1 40 40 SER H H 1 8.306 0.01 . 1 . . . . . 40 SER H . 19868 1 170 . 1 . 1 40 40 SER C C 13 174.65 0.05 . 1 . . . . . 40 SER C . 19868 1 171 . 1 . 1 40 40 SER CA C 13 58.559 0.1 . 1 . . . . . 40 SER CA . 19868 1 172 . 1 . 1 40 40 SER CB C 13 63.753 0.1 . 1 . . . . . 40 SER CB . 19868 1 173 . 1 . 1 40 40 SER N N 15 118.12 0.05 . 1 . . . . . 40 SER N . 19868 1 174 . 1 . 1 41 41 ARG H H 1 8.25 0.01 . 1 . . . . . 41 ARG H . 19868 1 175 . 1 . 1 41 41 ARG C C 13 176.234 0.05 . 1 . . . . . 41 ARG C . 19868 1 176 . 1 . 1 41 41 ARG N N 15 122.857 0.05 . 1 . . . . . 41 ARG N . 19868 1 177 . 1 . 1 42 42 LYS H H 1 8.398 0.01 . 1 . . . . . 42 LYS H . 19868 1 178 . 1 . 1 42 42 LYS C C 13 176.476 0.05 . 1 . . . . . 42 LYS C . 19868 1 179 . 1 . 1 42 42 LYS CA C 13 56.55 0.1 . 1 . . . . . 42 LYS CA . 19868 1 180 . 1 . 1 42 42 LYS CB C 13 33.057 0.1 . 1 . . . . . 42 LYS CB . 19868 1 181 . 1 . 1 42 42 LYS N N 15 123.449 0.05 . 1 . . . . . 42 LYS N . 19868 1 182 . 1 . 1 43 43 ALA H H 1 8.345 0.01 . 1 . . . . . 43 ALA H . 19868 1 183 . 1 . 1 43 43 ALA C C 13 177.753 0.05 . 1 . . . . . 43 ALA C . 19868 1 184 . 1 . 1 43 43 ALA CA C 13 52.82 0.1 . 1 . . . . . 43 ALA CA . 19868 1 185 . 1 . 1 43 43 ALA CB C 13 19.225 0.1 . 1 . . . . . 43 ALA CB . 19868 1 186 . 1 . 1 43 43 ALA N N 15 125.244 0.05 . 1 . . . . . 43 ALA N . 19868 1 187 . 1 . 1 44 44 GLU H H 1 8.388 0.01 . 1 . . . . . 44 GLU H . 19868 1 188 . 1 . 1 44 44 GLU C C 13 176.359 0.05 . 1 . . . . . 44 GLU C . 19868 1 189 . 1 . 1 44 44 GLU CA C 13 56.679 0.1 . 1 . . . . . 44 GLU CA . 19868 1 190 . 1 . 1 44 44 GLU CB C 13 30.447 0.1 . 1 . . . . . 44 GLU CB . 19868 1 191 . 1 . 1 44 44 GLU N N 15 120.094 0.05 . 1 . . . . . 44 GLU N . 19868 1 192 . 1 . 1 45 45 ASN H H 1 8.427 0.01 . 1 . . . . . 45 ASN H . 19868 1 193 . 1 . 1 45 45 ASN C C 13 175.299 0.05 . 1 . . . . . 45 ASN C . 19868 1 194 . 1 . 1 45 45 ASN CA C 13 53.268 0.1 . 1 . . . . . 45 ASN CA . 19868 1 195 . 1 . 1 45 45 ASN CB C 13 38.894 0.1 . 1 . . . . . 45 ASN CB . 19868 1 196 . 1 . 1 45 45 ASN N N 15 119.872 0.05 . 1 . . . . . 45 ASN N . 19868 1 197 . 1 . 1 46 46 LYS H H 1 8.272 0.01 . 1 . . . . . 46 LYS H . 19868 1 198 . 1 . 1 46 46 LYS C C 13 176.283 0.05 . 1 . . . . . 46 LYS C . 19868 1 199 . 1 . 1 46 46 LYS CA C 13 56.826 0.1 . 1 . . . . . 46 LYS CA . 19868 1 200 . 1 . 1 46 46 LYS CB C 13 32.952 0.1 . 1 . . . . . 46 LYS CB . 19868 1 201 . 1 . 1 46 46 LYS N N 15 121.89 0.05 . 1 . . . . . 46 LYS N . 19868 1 202 . 1 . 1 47 47 TYR H H 1 8.221 0.01 . 1 . . . . . 47 TYR H . 19868 1 203 . 1 . 1 47 47 TYR C C 13 175.818 0.05 . 1 . . . . . 47 TYR C . 19868 1 204 . 1 . 1 47 47 TYR CA C 13 57.721 0.1 . 1 . . . . . 47 TYR CA . 19868 1 205 . 1 . 1 47 47 TYR CB C 13 38.637 0.1 . 1 . . . . . 47 TYR CB . 19868 1 206 . 1 . 1 47 47 TYR N N 15 120.594 0.05 . 1 . . . . . 47 TYR N . 19868 1 207 . 1 . 1 48 48 ALA H H 1 8.217 0.01 . 1 . . . . . 48 ALA H . 19868 1 208 . 1 . 1 48 48 ALA C C 13 177.927 0.05 . 1 . . . . . 48 ALA C . 19868 1 209 . 1 . 1 48 48 ALA CA C 13 52.645 0.1 . 1 . . . . . 48 ALA CA . 19868 1 210 . 1 . 1 48 48 ALA CB C 13 19.329 0.1 . 1 . . . . . 48 ALA CB . 19868 1 211 . 1 . 1 48 48 ALA N N 15 126.276 0.05 . 1 . . . . . 48 ALA N . 19868 1 212 . 1 . 1 49 49 GLY H H 1 7.912 0.01 . 1 . . . . . 49 GLY H . 19868 1 213 . 1 . 1 49 49 GLY C C 13 174.519 0.05 . 1 . . . . . 49 GLY C . 19868 1 214 . 1 . 1 49 49 GLY CA C 13 45.454 0.1 . 1 . . . . . 49 GLY CA . 19868 1 215 . 1 . 1 49 49 GLY N N 15 107.616 0.05 . 1 . . . . . 49 GLY N . 19868 1 216 . 1 . 1 50 50 GLY H H 1 8.2 0.01 . 1 . . . . . 50 GLY H . 19868 1 217 . 1 . 1 50 50 GLY C C 13 173.532 0.05 . 1 . . . . . 50 GLY C . 19868 1 218 . 1 . 1 50 50 GLY CA C 13 45.026 0.1 . 1 . . . . . 50 GLY CA . 19868 1 219 . 1 . 1 50 50 GLY N N 15 108.115 0.05 . 1 . . . . . 50 GLY N . 19868 1 220 . 1 . 1 51 51 ASN H H 1 8.346 0.01 . 1 . . . . . 51 ASN H . 19868 1 221 . 1 . 1 51 51 ASN CA C 13 51.252 0.1 . 1 . . . . . 51 ASN CA . 19868 1 222 . 1 . 1 51 51 ASN N N 15 119.628 0.05 . 1 . . . . . 51 ASN N . 19868 1 223 . 1 . 1 75 75 ASP C C 13 176.607 0.05 . 1 . . . . . 75 ASP C . 19868 1 224 . 1 . 1 75 75 ASP CA C 13 54.803 0.1 . 1 . . . . . 75 ASP CA . 19868 1 225 . 1 . 1 75 75 ASP CB C 13 41.141 0.1 . 1 . . . . . 75 ASP CB . 19868 1 226 . 1 . 1 76 76 SER H H 1 8.255 0.01 . 1 . . . . . 76 SER H . 19868 1 227 . 1 . 1 76 76 SER C C 13 174.94 0.05 . 1 . . . . . 76 SER C . 19868 1 228 . 1 . 1 76 76 SER CA C 13 58.984 0.1 . 1 . . . . . 76 SER CA . 19868 1 229 . 1 . 1 76 76 SER CB C 13 63.721 0.1 . 1 . . . . . 76 SER CB . 19868 1 230 . 1 . 1 76 76 SER N N 15 115.884 0.05 . 1 . . . . . 76 SER N . 19868 1 231 . 1 . 1 77 77 GLU H H 1 8.388 0.01 . 1 . . . . . 77 GLU H . 19868 1 232 . 1 . 1 77 77 GLU C C 13 176.869 0.05 . 1 . . . . . 77 GLU C . 19868 1 233 . 1 . 1 77 77 GLU CA C 13 56.975 0.1 . 1 . . . . . 77 GLU CA . 19868 1 234 . 1 . 1 77 77 GLU CB C 13 29.976 0.1 . 1 . . . . . 77 GLU CB . 19868 1 235 . 1 . 1 77 77 GLU N N 15 122.29 0.05 . 1 . . . . . 77 GLU N . 19868 1 236 . 1 . 1 78 78 LYS H H 1 8.118 0.01 . 1 . . . . . 78 LYS H . 19868 1 237 . 1 . 1 78 78 LYS C C 13 176.892 0.05 . 1 . . . . . 78 LYS C . 19868 1 238 . 1 . 1 78 78 LYS CA C 13 56.685 0.1 . 1 . . . . . 78 LYS CA . 19868 1 239 . 1 . 1 78 78 LYS CB C 13 33.04 0.1 . 1 . . . . . 78 LYS CB . 19868 1 240 . 1 . 1 78 78 LYS N N 15 121.214 0.05 . 1 . . . . . 78 LYS N . 19868 1 241 . 1 . 1 79 79 GLU H H 1 8.338 0.01 . 1 . . . . . 79 GLU H . 19868 1 242 . 1 . 1 79 79 GLU C C 13 176.343 0.05 . 1 . . . . . 79 GLU C . 19868 1 243 . 1 . 1 79 79 GLU CA C 13 56.837 0.1 . 1 . . . . . 79 GLU CA . 19868 1 244 . 1 . 1 79 79 GLU CB C 13 30.191 0.1 . 1 . . . . . 79 GLU CB . 19868 1 245 . 1 . 1 79 79 GLU N N 15 120.905 0.05 . 1 . . . . . 79 GLU N . 19868 1 246 . 1 . 1 80 80 ASN H H 1 8.396 0.01 . 1 . . . . . 80 ASN H . 19868 1 247 . 1 . 1 80 80 ASN C C 13 174.956 0.05 . 1 . . . . . 80 ASN C . 19868 1 248 . 1 . 1 80 80 ASN CA C 13 53.323 0.1 . 1 . . . . . 80 ASN CA . 19868 1 249 . 1 . 1 80 80 ASN CB C 13 38.918 0.1 . 1 . . . . . 80 ASN CB . 19868 1 250 . 1 . 1 80 80 ASN N N 15 119.219 0.05 . 1 . . . . . 80 ASN N . 19868 1 251 . 1 . 1 81 81 GLN H H 1 8.261 0.01 . 1 . . . . . 81 GLN H . 19868 1 252 . 1 . 1 81 81 GLN C C 13 175.694 0.05 . 1 . . . . . 81 GLN C . 19868 1 253 . 1 . 1 81 81 GLN CA C 13 55.731 0.1 . 1 . . . . . 81 GLN CA . 19868 1 254 . 1 . 1 81 81 GLN CB C 13 29.556 0.1 . 1 . . . . . 81 GLN CB . 19868 1 255 . 1 . 1 81 81 GLN N N 15 120.578 0.05 . 1 . . . . . 81 GLN N . 19868 1 256 . 1 . 1 82 82 ILE H H 1 8.283 0.01 . 1 . . . . . 82 ILE H . 19868 1 257 . 1 . 1 82 82 ILE CA C 13 58.827 0.1 . 1 . . . . . 82 ILE CA . 19868 1 258 . 1 . 1 82 82 ILE N N 15 124.042 0.05 . 1 . . . . . 82 ILE N . 19868 1 259 . 1 . 1 83 83 PRO C C 13 177.079 0.05 . 1 . . . . . 83 PRO C . 19868 1 260 . 1 . 1 83 83 PRO CA C 13 63.446 0.1 . 1 . . . . . 83 PRO CA . 19868 1 261 . 1 . 1 83 83 PRO CB C 13 32.163 0.1 . 1 . . . . . 83 PRO CB . 19868 1 262 . 1 . 1 84 84 GLU H H 1 8.564 0.01 . 1 . . . . . 84 GLU H . 19868 1 263 . 1 . 1 84 84 GLU C C 13 176.797 0.05 . 1 . . . . . 84 GLU C . 19868 1 264 . 1 . 1 84 84 GLU CA C 13 56.989 0.1 . 1 . . . . . 84 GLU CA . 19868 1 265 . 1 . 1 84 84 GLU CB C 13 30.325 0.1 . 1 . . . . . 84 GLU CB . 19868 1 266 . 1 . 1 84 84 GLU N N 15 121.298 0.05 . 1 . . . . . 84 GLU N . 19868 1 267 . 1 . 1 85 85 GLU H H 1 8.46 0.01 . 1 . . . . . 85 GLU H . 19868 1 268 . 1 . 1 85 85 GLU C C 13 176.44 0.05 . 1 . . . . . 85 GLU C . 19868 1 269 . 1 . 1 85 85 GLU CA C 13 56.535 0.1 . 1 . . . . . 85 GLU CA . 19868 1 270 . 1 . 1 85 85 GLU CB C 13 30.276 0.1 . 1 . . . . . 85 GLU CB . 19868 1 271 . 1 . 1 85 85 GLU N N 15 121.842 0.05 . 1 . . . . . 85 GLU N . 19868 1 272 . 1 . 1 86 86 ALA H H 1 8.385 0.01 . 1 . . . . . 86 ALA H . 19868 1 273 . 1 . 1 86 86 ALA C C 13 178.52 0.05 . 1 . . . . . 86 ALA C . 19868 1 274 . 1 . 1 86 86 ALA CA C 13 52.782 0.1 . 1 . . . . . 86 ALA CA . 19868 1 275 . 1 . 1 86 86 ALA CB C 13 19.169 0.1 . 1 . . . . . 86 ALA CB . 19868 1 276 . 1 . 1 86 86 ALA N N 15 125.42 0.05 . 1 . . . . . 86 ALA N . 19868 1 277 . 1 . 1 87 87 GLY H H 1 8.43 0.01 . 1 . . . . . 87 GLY H . 19868 1 278 . 1 . 1 87 87 GLY C C 13 174.662 0.05 . 1 . . . . . 87 GLY C . 19868 1 279 . 1 . 1 87 87 GLY CA C 13 45.54 0.1 . 1 . . . . . 87 GLY CA . 19868 1 280 . 1 . 1 87 87 GLY N N 15 108.087 0.05 . 1 . . . . . 87 GLY N . 19868 1 281 . 1 . 1 88 88 SER H H 1 8.23 0.01 . 1 . . . . . 88 SER H . 19868 1 282 . 1 . 1 88 88 SER C C 13 175.084 0.05 . 1 . . . . . 88 SER C . 19868 1 283 . 1 . 1 88 88 SER CA C 13 58.598 0.1 . 1 . . . . . 88 SER CA . 19868 1 284 . 1 . 1 88 88 SER CB C 13 63.915 0.1 . 1 . . . . . 88 SER CB . 19868 1 285 . 1 . 1 88 88 SER N N 15 115.526 0.05 . 1 . . . . . 88 SER N . 19868 1 286 . 1 . 1 89 89 SER H H 1 8.435 0.01 . 1 . . . . . 89 SER H . 19868 1 287 . 1 . 1 89 89 SER C C 13 175.209 0.05 . 1 . . . . . 89 SER C . 19868 1 288 . 1 . 1 89 89 SER CA C 13 58.855 0.1 . 1 . . . . . 89 SER CA . 19868 1 289 . 1 . 1 89 89 SER CB C 13 63.848 0.1 . 1 . . . . . 89 SER CB . 19868 1 290 . 1 . 1 89 89 SER N N 15 117.624 0.05 . 1 . . . . . 89 SER N . 19868 1 291 . 1 . 1 90 90 GLY H H 1 8.427 0.01 . 1 . . . . . 90 GLY H . 19868 1 292 . 1 . 1 90 90 GLY C C 13 174.421 0.05 . 1 . . . . . 90 GLY C . 19868 1 293 . 1 . 1 90 90 GLY CA C 13 45.577 0.1 . 1 . . . . . 90 GLY CA . 19868 1 294 . 1 . 1 90 90 GLY N N 15 110.568 0.05 . 1 . . . . . 90 GLY N . 19868 1 295 . 1 . 1 91 91 LEU H H 1 8.131 0.01 . 1 . . . . . 91 LEU H . 19868 1 296 . 1 . 1 91 91 LEU C C 13 178.186 0.05 . 1 . . . . . 91 LEU C . 19868 1 297 . 1 . 1 91 91 LEU CA C 13 55.557 0.1 . 1 . . . . . 91 LEU CA . 19868 1 298 . 1 . 1 91 91 LEU CB C 13 42.372 0.1 . 1 . . . . . 91 LEU CB . 19868 1 299 . 1 . 1 91 91 LEU N N 15 121.551 0.05 . 1 . . . . . 91 LEU N . 19868 1 300 . 1 . 1 92 92 GLY H H 1 8.491 0.01 . 1 . . . . . 92 GLY H . 19868 1 301 . 1 . 1 92 92 GLY C C 13 174.44 0.05 . 1 . . . . . 92 GLY C . 19868 1 302 . 1 . 1 92 92 GLY CA C 13 45.608 0.1 . 1 . . . . . 92 GLY CA . 19868 1 303 . 1 . 1 92 92 GLY N N 15 109.476 0.05 . 1 . . . . . 92 GLY N . 19868 1 304 . 1 . 1 93 93 LYS H H 1 8.113 0.01 . 1 . . . . . 93 LYS H . 19868 1 305 . 1 . 1 93 93 LYS C C 13 176.615 0.05 . 1 . . . . . 93 LYS C . 19868 1 306 . 1 . 1 93 93 LYS CA C 13 56.418 0.1 . 1 . . . . . 93 LYS CA . 19868 1 307 . 1 . 1 93 93 LYS CB C 13 33.074 0.1 . 1 . . . . . 93 LYS CB . 19868 1 308 . 1 . 1 93 93 LYS N N 15 120.779 0.05 . 1 . . . . . 93 LYS N . 19868 1 309 . 1 . 1 94 94 ALA H H 1 8.26 0.01 . 1 . . . . . 94 ALA H . 19868 1 310 . 1 . 1 94 94 ALA C C 13 177.794 0.05 . 1 . . . . . 94 ALA C . 19868 1 311 . 1 . 1 94 94 ALA CA C 13 52.649 0.1 . 1 . . . . . 94 ALA CA . 19868 1 312 . 1 . 1 94 94 ALA CB C 13 19.26 0.1 . 1 . . . . . 94 ALA CB . 19868 1 313 . 1 . 1 94 94 ALA N N 15 124.476 0.05 . 1 . . . . . 94 ALA N . 19868 1 314 . 1 . 1 95 95 LYS H H 1 8.257 0.01 . 1 . . . . . 95 LYS H . 19868 1 315 . 1 . 1 95 95 LYS C C 13 176.64 0.05 . 1 . . . . . 95 LYS C . 19868 1 316 . 1 . 1 95 95 LYS CA C 13 56.384 0.1 . 1 . . . . . 95 LYS CA . 19868 1 317 . 1 . 1 95 95 LYS CB C 13 33.125 0.1 . 1 . . . . . 95 LYS CB . 19868 1 318 . 1 . 1 95 95 LYS N N 15 120.7 0.05 . 1 . . . . . 95 LYS N . 19868 1 319 . 1 . 1 96 96 ARG H H 1 8.295 0.01 . 1 . . . . . 96 ARG H . 19868 1 320 . 1 . 1 96 96 ARG C C 13 176.234 0.05 . 1 . . . . . 96 ARG C . 19868 1 321 . 1 . 1 96 96 ARG CA C 13 56.21 0.1 . 1 . . . . . 96 ARG CA . 19868 1 322 . 1 . 1 96 96 ARG CB C 13 31.012 0.1 . 1 . . . . . 96 ARG CB . 19868 1 323 . 1 . 1 96 96 ARG N N 15 122.33 0.05 . 1 . . . . . 96 ARG N . 19868 1 324 . 1 . 1 97 97 LYS H H 1 8.398 0.01 . 1 . . . . . 97 LYS H . 19868 1 325 . 1 . 1 97 97 LYS C C 13 176.11 0.05 . 1 . . . . . 97 LYS C . 19868 1 326 . 1 . 1 97 97 LYS CA C 13 56.248 0.1 . 1 . . . . . 97 LYS CA . 19868 1 327 . 1 . 1 97 97 LYS CB C 13 33.112 0.1 . 1 . . . . . 97 LYS CB . 19868 1 328 . 1 . 1 97 97 LYS N N 15 123.452 0.05 . 1 . . . . . 97 LYS N . 19868 1 329 . 1 . 1 98 98 ALA H H 1 8.385 0.01 . 1 . . . . . 98 ALA H . 19868 1 330 . 1 . 1 98 98 ALA C C 13 177.244 0.05 . 1 . . . . . 98 ALA C . 19868 1 331 . 1 . 1 98 98 ALA CA C 13 52.958 0.1 . 1 . . . . . 98 ALA CA . 19868 1 332 . 1 . 1 98 98 ALA CB C 13 19.347 0.1 . 1 . . . . . 98 ALA CB . 19868 1 333 . 1 . 1 98 98 ALA N N 15 125.449 0.05 . 1 . . . . . 98 ALA N . 19868 1 334 . 1 . 1 99 99 CYS H H 1 8.378 0.01 . 1 . . . . . 99 CYS H . 19868 1 335 . 1 . 1 99 99 CYS CA C 13 56.503 0.1 . 1 . . . . . 99 CYS CA . 19868 1 336 . 1 . 1 99 99 CYS N N 15 120.545 0.05 . 1 . . . . . 99 CYS N . 19868 1 337 . 1 . 1 100 100 PRO C C 13 176.68 0.05 . 1 . . . . . 100 PRO C . 19868 1 338 . 1 . 1 100 100 PRO CA C 13 63.27 0.1 . 1 . . . . . 100 PRO CA . 19868 1 339 . 1 . 1 100 100 PRO CB C 13 32.122 0.1 . 1 . . . . . 100 PRO CB . 19868 1 340 . 1 . 1 101 101 LEU H H 1 8.289 0.01 . 1 . . . . . 101 LEU H . 19868 1 341 . 1 . 1 101 101 LEU C C 13 177.149 0.05 . 1 . . . . . 101 LEU C . 19868 1 342 . 1 . 1 101 101 LEU CA C 13 55.277 0.1 . 1 . . . . . 101 LEU CA . 19868 1 343 . 1 . 1 101 101 LEU CB C 13 42.318 0.1 . 1 . . . . . 101 LEU CB . 19868 1 344 . 1 . 1 101 101 LEU N N 15 121.913 0.05 . 1 . . . . . 101 LEU N . 19868 1 345 . 1 . 1 102 102 GLN H H 1 8.302 0.01 . 1 . . . . . 102 GLN H . 19868 1 346 . 1 . 1 102 102 GLN CA C 13 53.419 0.1 . 1 . . . . . 102 GLN CA . 19868 1 347 . 1 . 1 102 102 GLN N N 15 121.799 0.05 . 1 . . . . . 102 GLN N . 19868 1 348 . 1 . 1 103 103 PRO C C 13 176.395 0.05 . 1 . . . . . 103 PRO C . 19868 1 349 . 1 . 1 103 103 PRO CA C 13 63.233 0.1 . 1 . . . . . 103 PRO CA . 19868 1 350 . 1 . 1 103 103 PRO CB C 13 32.176 0.1 . 1 . . . . . 103 PRO CB . 19868 1 351 . 1 . 1 104 104 ASP H H 1 8.425 0.01 . 1 . . . . . 104 ASP H . 19868 1 352 . 1 . 1 104 104 ASP C C 13 176.19 0.05 . 1 . . . . . 104 ASP C . 19868 1 353 . 1 . 1 104 104 ASP CA C 13 54.218 0.1 . 1 . . . . . 104 ASP CA . 19868 1 354 . 1 . 1 104 104 ASP CB C 13 41.202 0.1 . 1 . . . . . 104 ASP CB . 19868 1 355 . 1 . 1 104 104 ASP N N 15 120.074 0.05 . 1 . . . . . 104 ASP N . 19868 1 356 . 1 . 1 105 105 HIS H H 1 8.418 0.01 . 1 . . . . . 105 HIS H . 19868 1 357 . 1 . 1 105 105 HIS C C 13 175.054 0.05 . 1 . . . . . 105 HIS C . 19868 1 358 . 1 . 1 105 105 HIS CA C 13 55.661 0.1 . 1 . . . . . 105 HIS CA . 19868 1 359 . 1 . 1 105 105 HIS CB C 13 29.346 0.1 . 1 . . . . . 105 HIS CB . 19868 1 360 . 1 . 1 105 105 HIS N N 15 119.181 0.05 . 1 . . . . . 105 HIS N . 19868 1 361 . 1 . 1 106 106 THR H H 1 8.315 0.01 . 1 . . . . . 106 THR H . 19868 1 362 . 1 . 1 106 106 THR C C 13 174.573 0.05 . 1 . . . . . 106 THR C . 19868 1 363 . 1 . 1 106 106 THR CA C 13 62.663 0.1 . 1 . . . . . 106 THR CA . 19868 1 364 . 1 . 1 106 106 THR CB C 13 69.777 0.1 . 1 . . . . . 106 THR CB . 19868 1 365 . 1 . 1 106 106 THR N N 15 115.408 0.05 . 1 . . . . . 106 THR N . 19868 1 366 . 1 . 1 107 107 ASN H H 1 8.536 0.01 . 1 . . . . . 107 ASN H . 19868 1 367 . 1 . 1 107 107 ASN C C 13 174.928 0.05 . 1 . . . . . 107 ASN C . 19868 1 368 . 1 . 1 107 107 ASN CA C 13 53.398 0.1 . 1 . . . . . 107 ASN CA . 19868 1 369 . 1 . 1 107 107 ASN CB C 13 39.042 0.1 . 1 . . . . . 107 ASN CB . 19868 1 370 . 1 . 1 107 107 ASN N N 15 120.376 0.05 . 1 . . . . . 107 ASN N . 19868 1 371 . 1 . 1 108 108 ASP H H 1 8.238 0.01 . 1 . . . . . 108 ASP H . 19868 1 372 . 1 . 1 108 108 ASP C C 13 176.21 0.05 . 1 . . . . . 108 ASP C . 19868 1 373 . 1 . 1 108 108 ASP CA C 13 54.656 0.1 . 1 . . . . . 108 ASP CA . 19868 1 374 . 1 . 1 108 108 ASP CB C 13 41.123 0.1 . 1 . . . . . 108 ASP CB . 19868 1 375 . 1 . 1 108 108 ASP N N 15 120.868 0.05 . 1 . . . . . 108 ASP N . 19868 1 376 . 1 . 1 109 109 GLU H H 1 8.321 0.01 . 1 . . . . . 109 GLU H . 19868 1 377 . 1 . 1 109 109 GLU C C 13 176.345 0.05 . 1 . . . . . 109 GLU C . 19868 1 378 . 1 . 1 109 109 GLU CA C 13 56.685 0.1 . 1 . . . . . 109 GLU CA . 19868 1 379 . 1 . 1 109 109 GLU CB C 13 30.155 0.1 . 1 . . . . . 109 GLU CB . 19868 1 380 . 1 . 1 109 109 GLU N N 15 120.839 0.05 . 1 . . . . . 109 GLU N . 19868 1 381 . 1 . 1 110 110 LYS H H 1 8.287 0.01 . 1 . . . . . 110 LYS H . 19868 1 382 . 1 . 1 110 110 LYS C C 13 175.696 0.05 . 1 . . . . . 110 LYS C . 19868 1 383 . 1 . 1 110 110 LYS CA C 13 56.21 0.1 . 1 . . . . . 110 LYS CA . 19868 1 384 . 1 . 1 110 110 LYS CB C 13 33.201 0.1 . 1 . . . . . 110 LYS CB . 19868 1 385 . 1 . 1 110 110 LYS N N 15 122.509 0.05 . 1 . . . . . 110 LYS N . 19868 1 386 . 1 . 1 111 111 GLU H H 1 8.026 0.01 . 1 . . . . . 111 GLU H . 19868 1 387 . 1 . 1 111 111 GLU CA C 13 58.114 0.1 . 1 . . . . . 111 GLU CA . 19868 1 388 . 1 . 1 111 111 GLU N N 15 127.169 0.05 . 1 . . . . . 111 GLU N . 19868 1 stop_ save_