################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52649 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'mouse cGAS NTD (1-147)' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D CBCANH' . . . 52649 1 2 '3D HNCO' . . . 52649 1 3 '3D HNCA' . . . 52649 1 4 '3D HNCACO' . . . 52649 1 5 '4D HN(COCA)NH' . . . 52649 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52649 1 2 $software_2 . . 52649 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 5 5 PRO CA C 13 63.921 0 . . . . . . . 4 PRO CA . 52649 1 2 . 1 . 1 5 5 PRO CB C 13 32.358 0 . . . . . . . 4 PRO CB . 52649 1 3 . 1 . 1 5 5 PRO C C 13 177.5826091 0 . . . . . . . 4 PRO CO . 52649 1 4 . 1 . 1 6 6 ARG H H 1 8.38057961 0 . . . . . . . 5 ARG H . 52649 1 5 . 1 . 1 6 6 ARG C C 13 176.8566752 0 . . . . . . . 5 ARG CO . 52649 1 6 . 1 . 1 6 6 ARG CA C 13 56.7687022 0 . . . . . . . 5 ARG CA . 52649 1 7 . 1 . 1 6 6 ARG CB C 13 30.18070955 0 . . . . . . . 5 ARG CB . 52649 1 8 . 1 . 1 6 6 ARG N N 15 119.166 0 . . . . . . . 5 ARG N . 52649 1 9 . 1 . 1 7 7 ARG H H 1 7.959240422 0 . . . . . . . 6 ARG H . 52649 1 10 . 1 . 1 7 7 ARG C C 13 176.1938059 0 . . . . . . . 6 ARG CO . 52649 1 11 . 1 . 1 7 7 ARG CA C 13 56.157 0 . . . . . . . 6 ARG CA . 52649 1 12 . 1 . 1 7 7 ARG CB C 13 30.592 0 . . . . . . . 6 ARG CB . 52649 1 13 . 1 . 1 7 7 ARG N N 15 120.2375 0 . . . . . . . 6 ARG N . 52649 1 14 . 1 . 1 8 8 ARG H H 1 8.206 0 . . . . . . . 7 ARG H . 52649 1 15 . 1 . 1 8 8 ARG C C 13 176.581142 0 . . . . . . . 7 ARG CO . 52649 1 16 . 1 . 1 8 8 ARG CA C 13 56.21200263 0 . . . . . . . 7 ARG CA . 52649 1 17 . 1 . 1 8 8 ARG CB C 13 30.803 0 . . . . . . . 7 ARG CB . 52649 1 18 . 1 . 1 8 8 ARG N N 15 121.94 0 . . . . . . . 7 ARG N . 52649 1 19 . 1 . 1 9 9 THR H H 1 8.258 0 . . . . . . . 8 THR H . 52649 1 20 . 1 . 1 9 9 THR C C 13 174.6075298 0 . . . . . . . 8 THR CO . 52649 1 21 . 1 . 1 9 9 THR CA C 13 61.801 0 . . . . . . . 8 THR CA . 52649 1 22 . 1 . 1 9 9 THR CB C 13 69.774 0 . . . . . . . 8 THR CB . 52649 1 23 . 1 . 1 9 9 THR N N 15 115.65 0 . . . . . . . 8 THR N . 52649 1 24 . 1 . 1 10 10 THR H H 1 8.151724911 0 . . . . . . . 9 THR H . 52649 1 25 . 1 . 1 10 10 THR C C 13 173.905 0 . . . . . . . 9 THR CO . 52649 1 26 . 1 . 1 10 10 THR CA C 13 61.694 0 . . . . . . . 9 THR CA . 52649 1 27 . 1 . 1 10 10 THR CB C 13 69.875 0 . . . . . . . 9 THR CB . 52649 1 28 . 1 . 1 10 10 THR N N 15 116.515 0 . . . . . . . 9 THR N . 52649 1 29 . 1 . 1 11 11 ALA H H 1 8.325 0 . . . . . . . 10 ALA H . 52649 1 30 . 1 . 1 11 11 ALA C C 13 175.4280174 0 . . . . . . . 10 ALA CO . 52649 1 31 . 1 . 1 11 11 ALA CA C 13 50.653 0 . . . . . . . 10 ALA CA . 52649 1 32 . 1 . 1 11 11 ALA CB C 13 18.161 0 . . . . . . . 10 ALA CB . 52649 1 33 . 1 . 1 11 11 ALA N N 15 128.308 0 . . . . . . . 10 ALA N . 52649 1 34 . 1 . 1 12 12 PRO C C 13 176.927 0 . . . . . . . 11 PRO CO . 52649 1 35 . 1 . 1 12 12 PRO CA C 13 63.068 0 . . . . . . . 11 PRO CA . 52649 1 36 . 1 . 1 12 12 PRO CB C 13 32.399 0 . . . . . . . 11 PRO CA . 52649 1 37 . 1 . 1 13 13 ARG H H 1 8.408 0 . . . . . . . 12 ARG H . 52649 1 38 . 1 . 1 13 13 ARG C C 13 176.0844076 0 . . . . . . . 12 ARG CO . 52649 1 39 . 1 . 1 13 13 ARG CA C 13 55.98772492 0 . . . . . . . 12 ARG CA . 52649 1 40 . 1 . 1 13 13 ARG CB C 13 30.62372431 0 . . . . . . . 12 ARG CB . 52649 1 41 . 1 . 1 13 13 ARG N N 15 121.393 0 . . . . . . . 12 ARG N . 52649 1 42 . 1 . 1 14 14 ALA H H 1 8.303092074 0 . . . . . . . 13 ALA H . 52649 1 43 . 1 . 1 14 14 ALA C C 13 177.562 0 . . . . . . . 13 ALA CO . 52649 1 44 . 1 . 1 14 14 ALA CA C 13 52.314 0 . . . . . . . 13 ALA CA . 52649 1 45 . 1 . 1 14 14 ALA CB C 13 19.424 0 . . . . . . . 13 ALA CB . 52649 1 46 . 1 . 1 14 14 ALA N N 15 125.532 0 . . . . . . . 13 ALA N . 52649 1 47 . 1 . 1 15 15 LYS H H 1 8.328 0 . . . . . . . 14 LYS H . 52649 1 48 . 1 . 1 15 15 LYS C C 13 176.414 0 . . . . . . . 14 LYS CO . 52649 1 49 . 1 . 1 15 15 LYS CA C 13 56.113 0 . . . . . . . 14 LYS CA . 52649 1 50 . 1 . 1 15 15 LYS CB C 13 33.204 0 . . . . . . . 14 LYS CB . 52649 1 51 . 1 . 1 15 15 LYS N N 15 121.393 0 . . . . . . . 14 LYS N . 52649 1 52 . 1 . 1 16 16 LYS H H 1 8.385464052 0 . . . . . . . 15 LYS H . 52649 1 53 . 1 . 1 16 16 LYS C C 13 174.554 0 . . . . . . . 15 LYS CO . 52649 1 54 . 1 . 1 16 16 LYS CA C 13 54.2860198 0 . . . . . . . 15 LYS CA . 52649 1 55 . 1 . 1 16 16 LYS CB C 13 32.637 0 . . . . . . . 15 LYS CB . 52649 1 56 . 1 . 1 16 16 LYS N N 15 124.522 0 . . . . . . . 15 LYS N . 52649 1 57 . 1 . 1 17 17 PRO C C 13 176.946 0 . . . . . . . 16 PRO CO . 52649 1 58 . 1 . 1 17 17 PRO CB C 13 32.167 0 . . . . . . . 16 PRO CB . 52649 1 59 . 1 . 1 17 17 PRO CA C 13 63.178 0 . . . . . . . 16 PRO CA . 52649 1 60 . 1 . 1 18 18 SER H H 1 8.416 0 . . . . . . . 17 SER H . 52649 1 61 . 1 . 1 18 18 SER C C 13 174.334 0 . . . . . . . 17 SER CO . 52649 1 62 . 1 . 1 18 18 SER CA C 13 58.274 0 . . . . . . . 17 SER CA . 52649 1 63 . 1 . 1 18 18 SER CB C 13 63.888 0 . . . . . . . 17 SER CB . 52649 1 64 . 1 . 1 18 18 SER N N 15 116.588 0 . . . . . . . 17 SER N . 52649 1 65 . 1 . 1 19 19 ALA H H 1 8.374 0 . . . . . . . 18 ALA H . 52649 1 66 . 1 . 1 19 19 ALA C C 13 177.613 0 . . . . . . . 18 ALA CO . 52649 1 67 . 1 . 1 19 19 ALA CA C 13 52.382 0 . . . . . . . 18 ALA CA . 52649 1 68 . 1 . 1 19 19 ALA CB C 13 19.337 0 . . . . . . . 18 ALA CB . 52649 1 69 . 1 . 1 19 19 ALA N N 15 126.55 0 . . . . . . . 18 ALA N . 52649 1 70 . 1 . 1 20 20 LYS H H 1 8.279 0 . . . . . . . 19 LYS H . 52649 1 71 . 1 . 1 20 20 LYS C C 13 176.4126027 0 . . . . . . . 19 LYS CO . 52649 1 72 . 1 . 1 20 20 LYS CA C 13 56.201 0 . . . . . . . 19 LYS CA . 52649 1 73 . 1 . 1 20 20 LYS CB C 13 33.08485664 0 . . . . . . . 19 LYS CB . 52649 1 74 . 1 . 1 20 20 LYS N N 15 121.0027831 0 . . . . . . . 19 LYS N . 52649 1 75 . 1 . 1 21 21 ARG H H 1 8.337082402 0 . . . . . . . 20 ARG H . 52649 1 76 . 1 . 1 21 21 ARG C C 13 175.594 0 . . . . . . . 20 ARG CO . 52649 1 77 . 1 . 1 21 21 ARG CA C 13 55.73707612 0 . . . . . . . 20 ARG CA . 52649 1 78 . 1 . 1 21 21 ARG CB C 13 31.046 0 . . . . . . . 20 ARG CB . 52649 1 79 . 1 . 1 21 21 ARG N N 15 123.034 0 . . . . . . . 20 ARG N . 52649 1 80 . 1 . 1 22 22 ALA H H 1 8.417 0 . . . . . . . 21 ALA H . 52649 1 81 . 1 . 1 22 22 ALA C C 13 176.317 0 . . . . . . . 21 ALA CO . 52649 1 82 . 1 . 1 22 22 ALA CA C 13 50.527 0 . . . . . . . 21 ALA CA . 52649 1 83 . 1 . 1 22 22 ALA CB C 13 18.137 0 . . . . . . . 21 ALA CB . 52649 1 84 . 1 . 1 22 22 ALA N N 15 127.566 0 . . . . . . . 21 ALA N . 52649 1 85 . 1 . 1 23 23 PRO CA C 13 63.087 0 . . . . . . . 22 PRO CA . 52649 1 86 . 1 . 1 23 23 PRO CB C 13 32.104 0 . . . . . . . 22 PRO CB . 52649 1 87 . 1 . 1 23 23 PRO C C 13 177.089 0 . . . . . . . 22 PRO CO . 52649 1 88 . 1 . 1 24 24 THR H H 1 8.235 0 . . . . . . . 23 THR H . 52649 1 89 . 1 . 1 24 24 THR C C 13 174.381 0 . . . . . . . 23 THR CO . 52649 1 90 . 1 . 1 24 24 THR CA C 13 61.93 0 . . . . . . . 23 THR CA . 52649 1 91 . 1 . 1 24 24 THR CB C 13 69.876 0 . . . . . . . 23 THR CB . 52649 1 92 . 1 . 1 24 24 THR N N 15 114.981 0 . . . . . . . 23 THR N . 52649 1 93 . 1 . 1 25 25 GLN H H 1 8.415196892 0 . . . . . . . 24 GLN H . 52649 1 94 . 1 . 1 25 25 GLN C C 13 174.008388 0 . . . . . . . 24 GLN CO . 52649 1 95 . 1 . 1 25 25 GLN CA C 13 53.729 0 . . . . . . . 24 GLN CA . 52649 1 96 . 1 . 1 25 25 GLN CB C 13 29.096 0 . . . . . . . 24 GLN CB . 52649 1 97 . 1 . 1 25 25 GLN N N 15 123.767 0 . . . . . . . 24 GLN N . 52649 1 98 . 1 . 1 26 26 PRO C C 13 177.378 0 . . . . . . . 25 PRO CO . 52649 1 99 . 1 . 1 26 26 PRO CA C 13 63.224 0 . . . . . . . 25 PRO CA . 52649 1 100 . 1 . 1 27 27 SER H H 1 8.464139774 0 . . . . . . . 26 SER H . 52649 1 101 . 1 . 1 27 27 SER C C 13 174.887 0 . . . . . . . 26 SER CO . 52649 1 102 . 1 . 1 27 27 SER CA C 13 58.663 0 . . . . . . . 26 SER CA . 52649 1 103 . 1 . 1 27 27 SER CB C 13 63.773 0 . . . . . . . 26 SER CB . 52649 1 104 . 1 . 1 27 27 SER N N 15 115.924 0 . . . . . . . 26 SER N . 52649 1 105 . 1 . 1 28 28 ARG H H 1 8.462913052 0 . . . . . . . 27 ARG H . 52649 1 106 . 1 . 1 28 28 ARG C C 13 176.525 0 . . . . . . . 27 ARG CO . 52649 1 107 . 1 . 1 28 28 ARG CA C 13 56.286 0 . . . . . . . 27 ARG CA . 52649 1 108 . 1 . 1 28 28 ARG CB C 13 30.795 0 . . . . . . . 27 ARG CB . 52649 1 109 . 1 . 1 28 28 ARG N N 15 123.1128089 0 . . . . . . . 27 ARG N . 52649 1 110 . 1 . 1 29 29 THR H H 1 8.17 0 . . . . . . . 28 THR H . 52649 1 111 . 1 . 1 29 29 THR C C 13 174.4981314 0 . . . . . . . 28 THR CO . 52649 1 112 . 1 . 1 29 29 THR CA C 13 62.073 0 . . . . . . . 28 THR CA . 52649 1 113 . 1 . 1 29 29 THR CB C 13 69.73564664 0 . . . . . . . 28 THR CB . 52649 1 114 . 1 . 1 29 29 THR N N 15 115.455 0 . . . . . . . 28 THR N . 52649 1 115 . 1 . 1 30 30 ARG H H 1 8.346 0 . . . . . . . 29 ARG H . 52649 1 116 . 1 . 1 30 30 ARG C C 13 175.9430746 0 . . . . . . . 29 ARG CO . 52649 1 117 . 1 . 1 30 30 ARG CA C 13 56.06610609 0 . . . . . . . 29 ARG CA . 52649 1 118 . 1 . 1 30 30 ARG CB C 13 30.84 0 . . . . . . . 29 ARG CB . 52649 1 119 . 1 . 1 30 30 ARG N N 15 123.776 0 . . . . . . . 29 ARG N . 52649 1 120 . 1 . 1 31 31 ALA H H 1 8.336 0 . . . . . . . 30 ALA H . 52649 1 121 . 1 . 1 31 31 ALA C C 13 177.6706838 0 . . . . . . . 30 ALA CO . 52649 1 122 . 1 . 1 31 31 ALA CA C 13 52.564 0 . . . . . . . 30 ALA CA . 52649 1 123 . 1 . 1 31 31 ALA CB C 13 19.158461 0 . . . . . . . 30 ALA CB . 52649 1 124 . 1 . 1 31 31 ALA N N 15 125.534 0 . . . . . . . 30 ALA N . 52649 1 125 . 1 . 1 32 32 HIS H H 1 8.341 0 . . . . . . . 31 HIS H . 52649 1 126 . 1 . 1 32 32 HIS C C 13 174.83455 0 . . . . . . . 31 HIS CO . 52649 1 127 . 1 . 1 32 32 HIS CA C 13 55.94891008 0 . . . . . . . 31 HIS CA . 52649 1 128 . 1 . 1 32 32 HIS CB C 13 30.07 0 . . . . . . . 31 HIS CB . 52649 1 129 . 1 . 1 32 32 HIS N N 15 118.541 0 . . . . . . . 31 HIS N . 52649 1 130 . 1 . 1 33 33 ALA H H 1 8.301 0 . . . . . . . 32 ALA H . 52649 1 131 . 1 . 1 33 33 ALA C C 13 177.781 0 . . . . . . . 32 ALA CO . 52649 1 132 . 1 . 1 33 33 ALA CA C 13 52.713 0 . . . . . . . 32 ALA CA . 52649 1 133 . 1 . 1 33 33 ALA CB C 13 19.432 0 . . . . . . . 32 ALA CB . 52649 1 134 . 1 . 1 33 33 ALA N N 15 125.3473 0 . . . . . . . 32 ALA N . 52649 1 135 . 1 . 1 34 34 GLU H H 1 8.519 0 . . . . . . . 33 GLU H . 52649 1 136 . 1 . 1 34 34 GLU C C 13 176.777 0 . . . . . . . 33 GLU CO . 52649 1 137 . 1 . 1 34 34 GLU CA C 13 56.767135 0 . . . . . . . 33 GLU CA . 52649 1 138 . 1 . 1 34 34 GLU CB C 13 30.315 0 . . . . . . . 33 GLU CB . 52649 1 139 . 1 . 1 34 34 GLU N N 15 120.026 0 . . . . . . . 33 GLU N . 52649 1 140 . 1 . 1 35 35 SER H H 1 8.369 0 . . . . . . . 34 SER H . 52649 1 141 . 1 . 1 35 35 SER C C 13 174.5242092 0 . . . . . . . 34 SER CO . 52649 1 142 . 1 . 1 35 35 SER CA C 13 58.498 0 . . . . . . . 34 SER CA . 52649 1 143 . 1 . 1 35 35 SER CB C 13 63.70663841 0 . . . . . . . 34 SER CB . 52649 1 144 . 1 . 1 35 35 SER N N 15 116.51032 0 . . . . . . . 34 SER N . 52649 1 145 . 1 . 1 36 36 CYS H H 1 8.3535924 0 . . . . . . . 35 CYS H . 52649 1 146 . 1 . 1 36 36 CYS C C 13 174.662 0 . . . . . . . 35 CYS CO . 52649 1 147 . 1 . 1 36 36 CYS CA C 13 58.415 0 . . . . . . . 35 CYS CA . 52649 1 148 . 1 . 1 36 36 CYS CB C 13 28.354 0 . . . . . . . 35 CYS CB . 52649 1 149 . 1 . 1 36 36 CYS N N 15 120.69 0 . . . . . . . 35 CYS N . 52649 1 150 . 1 . 1 37 37 GLY H H 1 8.293 0 . . . . . . . 36 GLY H . 52649 1 151 . 1 . 1 37 37 GLY C C 13 171.8178716 0 . . . . . . . 36 GLY CO . 52649 1 152 . 1 . 1 37 37 GLY CA C 13 44.721 0 . . . . . . . 36 GLY CA . 52649 1 153 . 1 . 1 37 37 GLY N N 15 110.767 0 . . . . . . . 36 GLY N . 52649 1 154 . 1 . 1 38 38 PRO C C 13 177.277 0 . . . . . . . 37 PRO CO . 52649 1 155 . 1 . 1 38 38 PRO CB C 13 32.269 0 . . . . . . . 37 PRO CB . 52649 1 156 . 1 . 1 38 38 PRO CA C 13 63.349 0 . . . . . . . 37 PRO CA . 52649 1 157 . 1 . 1 39 39 GLN H H 1 8.535451839 0 . . . . . . . 38 GLN H . 52649 1 158 . 1 . 1 39 39 GLN C C 13 176.249 0 . . . . . . . 38 GLN CO . 52649 1 159 . 1 . 1 39 39 GLN CA C 13 55.918 0 . . . . . . . 38 GLN CA . 52649 1 160 . 1 . 1 39 39 GLN CB C 13 29.228 0 . . . . . . . 38 GLN CB . 52649 1 161 . 1 . 1 39 39 GLN N N 15 120.69 0 . . . . . . . 38 GLN N . 52649 1 162 . 1 . 1 40 40 ARG H H 1 8.399 0 . . . . . . . 39 ARG H . 52649 1 163 . 1 . 1 40 40 ARG C C 13 176.854 0 . . . . . . . 39 ARG CO . 52649 1 164 . 1 . 1 40 40 ARG CA C 13 56.405 0 . . . . . . . 39 ARG CA . 52649 1 165 . 1 . 1 40 40 ARG CB C 13 30.854 0 . . . . . . . 39 ARG CB . 52649 1 166 . 1 . 1 40 40 ARG N N 15 122.253 0 . . . . . . . 39 ARG N . 52649 1 167 . 1 . 1 41 41 GLY H H 1 8.453 0 . . . . . . . 40 GLY H . 52649 1 168 . 1 . 1 41 41 GLY C C 13 174.007 0 . . . . . . . 40 GLY CO . 52649 1 169 . 1 . 1 41 41 GLY CA C 13 45.25 0 . . . . . . . 40 GLY CA . 52649 1 170 . 1 . 1 41 41 GLY N N 15 110.025 0 . . . . . . . 40 GLY N . 52649 1 171 . 1 . 1 44 44 SER H H 1 8.27 0 . . . . . . . 43 SER H . 52649 1 172 . 1 . 1 44 44 SER C C 13 174.553 0 . . . . . . . 43 SER CO . 52649 1 173 . 1 . 1 44 44 SER CA C 13 58.408 0 . . . . . . . 43 SER CA . 52649 1 174 . 1 . 1 44 44 SER CB C 13 63.841 0 . . . . . . . 43 SER CB . 52649 1 175 . 1 . 1 44 44 SER N N 15 116.864 0 . . . . . . . 43 SER N . 52649 1 176 . 1 . 1 45 45 ARG H H 1 8.367 0 . . . . . . . 44 ARG H . 52649 1 177 . 1 . 1 45 45 ARG C C 13 176.304 0 . . . . . . . 44 ARG CO . 52649 1 178 . 1 . 1 45 45 ARG CA C 13 56.302 0 . . . . . . . 44 ARG CA . 52649 1 179 . 1 . 1 45 45 ARG CB C 13 30.821 0 . . . . . . . 44 ARG CB . 52649 1 180 . 1 . 1 45 45 ARG N N 15 123.151 0 . . . . . . . 44 ARG N . 52649 1 181 . 1 . 1 46 46 ARG H H 1 8.346512304 0 . . . . . . . 45 ARG H . 52649 1 182 . 1 . 1 46 46 ARG C C 13 176.032 0 . . . . . . . 45 ARG CO . 52649 1 183 . 1 . 1 46 46 ARG CA C 13 56.3080192 0 . . . . . . . 45 ARG CA . 52649 1 184 . 1 . 1 46 46 ARG CB C 13 30.902 0 . . . . . . . 45 ARG CB . 52649 1 185 . 1 . 1 46 46 ARG N N 15 122.604 0 . . . . . . . 45 ARG N . 52649 1 186 . 1 . 1 47 47 ALA H H 1 8.395 0 . . . . . . . 46 ALA H . 52649 1 187 . 1 . 1 47 47 ALA C C 13 177.836 0 . . . . . . . 46 ALA CO . 52649 1 188 . 1 . 1 47 47 ALA CA C 13 52.66 0 . . . . . . . 46 ALA CA . 52649 1 189 . 1 . 1 47 47 ALA CB C 13 19.229 0 . . . . . . . 46 ALA CB . 52649 1 190 . 1 . 1 47 47 ALA N N 15 125.3 0 . . . . . . . 46 ALA N . 52649 1 191 . 1 . 1 48 48 GLU H H 1 8.401 0 . . . . . . . 47 GLU H . 52649 1 192 . 1 . 1 48 48 GLU C C 13 176.689 0 . . . . . . . 47 GLU CO . 52649 1 193 . 1 . 1 48 48 GLU CA C 13 57.009 0 . . . . . . . 47 GLU CA . 52649 1 194 . 1 . 1 48 48 GLU CB C 13 30.477 0 . . . . . . . 47 GLU CB . 52649 1 195 . 1 . 1 48 48 GLU N N 15 120.338 0 . . . . . . . 47 GLU N . 52649 1 196 . 1 . 1 49 49 ARG H H 1 8.323 0 . . . . . . . 48 ARG H . 52649 1 197 . 1 . 1 49 49 ARG C C 13 176.142 0 . . . . . . . 48 ARG CO . 52649 1 198 . 1 . 1 49 49 ARG CA C 13 56.152 0 . . . . . . . 48 ARG CA . 52649 1 199 . 1 . 1 49 49 ARG CB C 13 30.838 0 . . . . . . . 48 ARG CB . 52649 1 200 . 1 . 1 49 49 ARG N N 15 120.885 0 . . . . . . . 48 ARG N . 52649 1 201 . 1 . 1 50 50 ASP H H 1 8.353100312 0 . . . . . . . 49 ASP H . 52649 1 202 . 1 . 1 50 50 ASP C C 13 176.744 0 . . . . . . . 49 ASP CO . 52649 1 203 . 1 . 1 50 50 ASP CA C 13 54.792 0 . . . . . . . 49 ASP CA . 52649 1 204 . 1 . 1 50 50 ASP CB C 13 41.268 0 . . . . . . . 49 ASP CB . 52649 1 205 . 1 . 1 50 50 ASP N N 15 121.354 0 . . . . . . . 49 ASP N . 52649 1 206 . 1 . 1 51 51 GLY H H 1 8.318226167 0 . . . . . . . 50 GLY H . 52649 1 207 . 1 . 1 51 51 GLY C C 13 174.0058388 0 . . . . . . . 50 GLY CO . 52649 1 208 . 1 . 1 51 51 GLY CA C 13 45.524 0 . . . . . . . 50 GLY CA . 52649 1 209 . 1 . 1 51 51 GLY N N 15 109.243 0 . . . . . . . 50 GLY N . 52649 1 210 . 1 . 1 52 52 ASP H H 1 8.247 0 . . . . . . . 51 ASP H . 52649 1 211 . 1 . 1 52 52 ASP C C 13 176.8521961 0 . . . . . . . 51 ASP CO . 52649 1 212 . 1 . 1 52 52 ASP CA C 13 54.48 0 . . . . . . . 51 ASP CA . 52649 1 213 . 1 . 1 52 52 ASP CB C 13 41.351 0 . . . . . . . 51 ASP CB . 52649 1 214 . 1 . 1 52 52 ASP N N 15 120.69 0 . . . . . . . 51 ASP N . 52649 1 215 . 1 . 1 53 53 THR H H 1 8.223 0 . . . . . . . 52 THR H . 52649 1 216 . 1 . 1 53 53 THR C C 13 174.937 0 . . . . . . . 52 THR CO . 52649 1 217 . 1 . 1 53 53 THR CA C 13 61.798 0 . . . . . . . 52 THR CA . 52649 1 218 . 1 . 1 53 53 THR CB C 13 69.532 0 . . . . . . . 52 THR CB . 52649 1 219 . 1 . 1 53 53 THR N N 15 114.166 0 . . . . . . . 52 THR N . 52649 1 220 . 1 . 1 54 54 THR H H 1 8.203 0 . . . . . . . 53 THR H . 52649 1 221 . 1 . 1 54 54 THR C C 13 174.61 0 . . . . . . . 53 THR CO . 52649 1 222 . 1 . 1 54 54 THR CA C 13 62.517 0 . . . . . . . 53 THR CA . 52649 1 223 . 1 . 1 54 54 THR CB C 13 69.64 0 . . . . . . . 53 THR CB . 52649 1 224 . 1 . 1 54 54 THR N N 15 116.51 0 . . . . . . . 53 THR N . 52649 1 225 . 1 . 1 55 55 GLU H H 1 8.388 0 . . . . . . . 54 GLU H . 52649 1 226 . 1 . 1 55 55 GLU C C 13 176.088 0 . . . . . . . 54 GLU CO . 52649 1 227 . 1 . 1 55 55 GLU CA C 13 56.423 0 . . . . . . . 54 GLU CA . 52649 1 228 . 1 . 1 55 55 GLU CB C 13 30.399 0 . . . . . . . 54 GLU CB . 52649 1 229 . 1 . 1 55 55 GLU N N 15 123.698 0 . . . . . . . 54 GLU N . 52649 1 230 . 1 . 1 56 56 LYS H H 1 8.335098487 0 . . . . . . . 55 LYS H . 52649 1 231 . 1 . 1 56 56 LYS C C 13 174.391 0 . . . . . . . 55 LYS CO . 52649 1 232 . 1 . 1 56 56 LYS CA C 13 54.195 0 . . . . . . . 55 LYS CA . 52649 1 233 . 1 . 1 56 56 LYS CB C 13 32.417 0 . . . . . . . 55 LYS CB . 52649 1 234 . 1 . 1 56 56 LYS N N 15 124.323 0 . . . . . . . 55 LYS N . 52649 1 235 . 1 . 1 57 57 PRO C C 13 176.854 0 . . . . . . . 56 PRO CO . 52649 1 236 . 1 . 1 57 57 PRO CB C 13 32.494 0 . . . . . . . 56 PRO CB . 52649 1 237 . 1 . 1 57 57 PRO CA C 13 63.124 0 . . . . . . . 56 PRO CA . 52649 1 238 . 1 . 1 58 58 ARG H H 1 8.464 0 . . . . . . . 57 ARG H . 52649 1 239 . 1 . 1 58 58 ARG C C 13 175.868 0 . . . . . . . 57 ARG CO . 52649 1 240 . 1 . 1 58 58 ARG CA C 13 55.832 0 . . . . . . . 57 ARG CA . 52649 1 241 . 1 . 1 58 58 ARG CB C 13 30.774 0 . . . . . . . 57 ARG CB . 52649 1 242 . 1 . 1 58 58 ARG N N 15 122.096 0 . . . . . . . 57 ARG N . 52649 1 243 . 1 . 1 59 59 ALA H H 1 8.367 0 . . . . . . . 58 ALA H . 52649 1 244 . 1 . 1 59 59 ALA C C 13 175.593 0 . . . . . . . 58 ALA CO . 52649 1 245 . 1 . 1 59 59 ALA CA C 13 50.453 0 . . . . . . . 58 ALA CA . 52649 1 246 . 1 . 1 59 59 ALA CB C 13 18.223 0 . . . . . . . 58 ALA CB . 52649 1 247 . 1 . 1 59 59 ALA N N 15 127.019 0 . . . . . . . 58 ALA N . 52649 1 248 . 1 . 1 60 60 PRO C C 13 177.191 0 . . . . . . . 59 PRO CO . 52649 1 249 . 1 . 1 60 60 PRO CB C 13 32.142 0 . . . . . . . 59 PRO CB . 52649 1 250 . 1 . 1 60 60 PRO CA C 13 63.23 0 . . . . . . . 59 PRO CA . 52649 1 251 . 1 . 1 61 61 GLY H H 1 8.23 0 . . . . . . . 60 GLY H . 52649 1 252 . 1 . 1 61 61 GLY C C 13 171.766 0 . . . . . . . 60 GLY CO . 52649 1 253 . 1 . 1 61 61 GLY CA C 13 44.484 0 . . . . . . . 60 GLY CA . 52649 1 254 . 1 . 1 61 61 GLY N N 15 108.892 0 . . . . . . . 60 GLY N . 52649 1 255 . 1 . 1 62 62 PRO C C 13 176.1303735 0 . . . . . . . 61 PRO CO . 52649 1 256 . 1 . 1 62 62 PRO CA C 13 63.089 0 . . . . . . . 61 PRO CA . 52649 1 257 . 1 . 1 63 63 ARG H H 1 8.442 0 . . . . . . . 62 ARG H . 52649 1 258 . 1 . 1 63 63 ARG C C 13 176.234 0 . . . . . . . 62 ARG CO . 52649 1 259 . 1 . 1 63 63 ARG CA C 13 56.031 0 . . . . . . . 62 ARG CA . 52649 1 260 . 1 . 1 63 63 ARG CB C 13 30.782 0 . . . . . . . 62 ARG CB . 52649 1 261 . 1 . 1 63 63 ARG N N 15 121.467 0 . . . . . . . 62 ARG N . 52649 1 262 . 1 . 1 64 64 VAL H H 1 8.089 0 . . . . . . . 63 VAL H . 52649 1 263 . 1 . 1 64 64 VAL C C 13 175.5709882 0 . . . . . . . 63 VAL CO . 52649 1 264 . 1 . 1 64 64 VAL CA C 13 62.046 0 . . . . . . . 63 VAL CA . 52649 1 265 . 1 . 1 64 64 VAL CB C 13 30.781 0 . . . . . . . 63 VAL CB . 52649 1 266 . 1 . 1 64 64 VAL N N 15 121.467 0 . . . . . . . 63 VAL N . 52649 1 267 . 1 . 1 65 65 HIS H H 1 8.504 0 . . . . . . . 64 HIS H . 52649 1 268 . 1 . 1 65 65 HIS C C 13 173.133 0 . . . . . . . 64 HIS CO . 52649 1 269 . 1 . 1 65 65 HIS CA C 13 53.847 0 . . . . . . . 64 HIS CA . 52649 1 270 . 1 . 1 65 65 HIS CB C 13 29.861 0 . . . . . . . 64 HIS CB . 52649 1 271 . 1 . 1 65 65 HIS N N 15 124.518 0 . . . . . . . 64 HIS N . 52649 1 272 . 1 . 1 66 66 PRO C C 13 176.542 0 . . . . . . . 65 PRO CO . 52649 1 273 . 1 . 1 66 66 PRO CB C 13 32.121 0 . . . . . . . 65 PRO CB . 52649 1 274 . 1 . 1 66 66 PRO CA C 13 63.08701886 0 . . . . . . . 65 PRO CA . 52649 1 275 . 1 . 1 67 67 ALA H H 1 8.405 0 . . . . . . . 66 ALA H . 52649 1 276 . 1 . 1 67 67 ALA C C 13 177.726 0 . . . . . . . 66 ALA CO . 52649 1 277 . 1 . 1 67 67 ALA CA C 13 52.373 0 . . . . . . . 66 ALA CA . 52649 1 278 . 1 . 1 67 67 ALA CB C 13 19.207 0 . . . . . . . 66 ALA CB . 52649 1 279 . 1 . 1 67 67 ALA N N 15 124.753 0 . . . . . . . 66 ALA N . 52649 1 280 . 1 . 1 68 68 ARG H H 1 8.089032299 0 . . . . . . . 67 ARG H . 52649 1 281 . 1 . 1 68 68 ARG C C 13 175.924 0 . . . . . . . 67 ARG CO . 52649 1 282 . 1 . 1 68 68 ARG CA C 13 62.229 0 . . . . . . . 67 ARG CA . 52649 1 283 . 1 . 1 68 68 ARG CB C 13 33.069 0 . . . . . . . 67 ARG CB . 52649 1 284 . 1 . 1 68 68 ARG N N 15 119.833 0 . . . . . . . 67 ARG N . 52649 1 285 . 1 . 1 69 69 ALA H H 1 8.418 0 . . . . . . . 68 ALA H . 52649 1 286 . 1 . 1 69 69 ALA C C 13 178.055 0 . . . . . . . 68 ALA CO . 52649 1 287 . 1 . 1 69 69 ALA CA C 13 52.822 0 . . . . . . . 68 ALA CA . 52649 1 288 . 1 . 1 69 69 ALA CB C 13 19.155 0 . . . . . . . 68 ALA CB . 52649 1 289 . 1 . 1 69 69 ALA N N 15 125.69 0 . . . . . . . 68 ALA N . 52649 1 290 . 1 . 1 70 70 THR H H 1 8.07644401 0 . . . . . . . 69 THR H . 52649 1 291 . 1 . 1 70 70 THR C C 13 174.664 0 . . . . . . . 69 THR CO . 52649 1 292 . 1 . 1 70 70 THR CA C 13 62.158 0 . . . . . . . 69 THR CA . 52649 1 293 . 1 . 1 70 70 THR CB C 13 69.697 0 . . . . . . . 69 THR CB . 52649 1 294 . 1 . 1 70 70 THR N N 15 113.005 0 . . . . . . . 69 THR N . 52649 1 295 . 1 . 1 71 71 GLU H H 1 8.393 0 . . . . . . . 70 GLU H . 52649 1 296 . 1 . 1 71 71 GLU C C 13 176.415 0 . . . . . . . 70 GLU CO . 52649 1 297 . 1 . 1 71 71 GLU CA C 13 56.67 0 . . . . . . . 70 GLU CA . 52649 1 298 . 1 . 1 71 71 GLU CB C 13 30.225 0 . . . . . . . 70 GLU CB . 52649 1 299 . 1 . 1 71 71 GLU N N 15 123.151 0 . . . . . . . 70 GLU N . 52649 1 300 . 1 . 1 72 72 LEU H H 1 8.264 0 . . . . . . . 71 LEU H . 52649 1 301 . 1 . 1 72 72 LEU C C 13 177.649 0 . . . . . . . 71 LEU CO . 52649 1 302 . 1 . 1 72 72 LEU CA C 13 55.348 0 . . . . . . . 71 LEU CA . 52649 1 303 . 1 . 1 72 72 LEU CB C 13 42.656 0 . . . . . . . 71 LEU CB . 52649 1 304 . 1 . 1 72 72 LEU N N 15 122.839 0 . . . . . . . 71 LEU N . 52649 1 305 . 1 . 1 73 73 THR H H 1 8.061 0 . . . . . . . 72 THR H . 52649 1 306 . 1 . 1 73 73 THR C C 13 174.639 0 . . . . . . . 72 THR CO . 52649 1 307 . 1 . 1 73 73 THR CA C 13 61.875 0 . . . . . . . 72 THR CA . 52649 1 308 . 1 . 1 73 73 THR CB C 13 69.747 0 . . . . . . . 72 THR CB . 52649 1 309 . 1 . 1 73 73 THR N N 15 114.555 0 . . . . . . . 72 THR N . 52649 1 310 . 1 . 1 74 74 LYS H H 1 8.325 0 . . . . . . . 73 LYS H . 52649 1 311 . 1 . 1 74 74 LYS C C 13 176.359035 0 . . . . . . . 73 LYS CO . 52649 1 312 . 1 . 1 74 74 LYS CA C 13 56.68748114 0 . . . . . . . 73 LYS CA . 52649 1 313 . 1 . 1 74 74 LYS CB C 13 32.953 0 . . . . . . . 73 LYS CB . 52649 1 314 . 1 . 1 74 74 LYS N N 15 123.464 0 . . . . . . . 73 LYS N . 52649 1 315 . 1 . 1 75 75 ASP H H 1 8.295 0 . . . . . . . 74 ASP H . 52649 1 316 . 1 . 1 75 75 ASP C C 13 175.7232489 0 . . . . . . . 74 ASP CO . 52649 1 317 . 1 . 1 75 75 ASP CA C 13 54.498 0 . . . . . . . 74 ASP CA . 52649 1 318 . 1 . 1 75 75 ASP CB C 13 41.182 0 . . . . . . . 74 ASP CB . 52649 1 319 . 1 . 1 75 75 ASP N N 15 121.041 0 . . . . . . . 74 ASP N . 52649 1 320 . 1 . 1 76 76 ALA H H 1 8.104 0 . . . . . . . 75 ALA H . 52649 1 321 . 1 . 1 76 76 ALA C C 13 177.456 0 . . . . . . . 75 ALA CO . 52649 1 322 . 1 . 1 76 76 ALA CA C 13 52.388 0 . . . . . . . 75 ALA CA . 52649 1 323 . 1 . 1 76 76 ALA CB C 13 19.339 0 . . . . . . . 75 ALA CB . 52649 1 324 . 1 . 1 76 76 ALA N N 15 123.971 0 . . . . . . . 75 ALA N . 52649 1 325 . 1 . 1 77 77 GLN H H 1 8.304 0 . . . . . . . 76 GLN H . 52649 1 326 . 1 . 1 77 77 GLN C C 13 174.126383 0 . . . . . . . 76 GLN CO . 52649 1 327 . 1 . 1 77 77 GLN CA C 13 53.603 0 . . . . . . . 76 GLN CA . 52649 1 328 . 1 . 1 77 77 GLN CB C 13 28.978 0 . . . . . . . 76 GLN CB . 52649 1 329 . 1 . 1 77 77 GLN N N 15 120.612 0 . . . . . . . 76 GLN N . 52649 1 330 . 1 . 1 78 78 PRO C C 13 177.0676839 0 . . . . . . . 77 PRO CO . 52649 1 331 . 1 . 1 78 78 PRO CB C 13 32.13 0 . . . . . . . 77 PRO CB . 52649 1 332 . 1 . 1 78 78 PRO CA C 13 63.372 0 . . . . . . . 77 PRO CA . 52649 1 333 . 1 . 1 79 79 SER H H 1 8.471 0 . . . . . . . 78 SER H . 52649 1 334 . 1 . 1 79 79 SER C C 13 174.61 0 . . . . . . . 78 SER CO . 52649 1 335 . 1 . 1 79 79 SER CA C 13 58.418 0 . . . . . . . 78 SER CA . 52649 1 336 . 1 . 1 79 79 SER CB C 13 64.0844285 0 . . . . . . . 78 SER CB . 52649 1 337 . 1 . 1 79 79 SER N N 15 116.314 0 . . . . . . . 78 SER N . 52649 1 338 . 1 . 1 80 80 ALA H H 1 8.415 0 . . . . . . . 79 ALA H . 52649 1 339 . 1 . 1 80 80 ALA C C 13 178.044073 0 . . . . . . . 79 ALA CO . 52649 1 340 . 1 . 1 80 80 ALA CA C 13 52.907 0 . . . . . . . 79 ALA CA . 52649 1 341 . 1 . 1 80 80 ALA CB C 13 19.152 0 . . . . . . . 79 ALA CB . 52649 1 342 . 1 . 1 80 80 ALA N N 15 125.925 0 . . . . . . . 79 ALA N . 52649 1 343 . 1 . 1 81 81 MET H H 1 8.268 0 . . . . . . . 80 MET H . 52649 1 344 . 1 . 1 81 81 MET C C 13 176.251 0 . . . . . . . 80 MET CO . 52649 1 345 . 1 . 1 81 81 MET CA C 13 55.811 0 . . . . . . . 80 MET CA . 52649 1 346 . 1 . 1 81 81 MET CB C 13 32.854 0 . . . . . . . 80 MET CB . 52649 1 347 . 1 . 1 81 81 MET N N 15 118.658 0 . . . . . . . 80 MET N . 52649 1 348 . 1 . 1 82 82 ASP H H 1 8.196 0 . . . . . . . 81 ASP H . 52649 1 349 . 1 . 1 82 82 ASP C C 13 176.393 0 . . . . . . . 81 ASP CO . 52649 1 350 . 1 . 1 82 82 ASP CA C 13 54.457 0 . . . . . . . 81 ASP CA . 52649 1 351 . 1 . 1 82 82 ASP CB C 13 41.216 0 . . . . . . . 81 ASP CB . 52649 1 352 . 1 . 1 82 82 ASP N N 15 121.159 0 . . . . . . . 81 ASP N . 52649 1 353 . 1 . 1 83 83 ALA H H 1 8.193342 0 . . . . . . . 82 ALA H . 52649 1 354 . 1 . 1 83 83 ALA C C 13 177.948 0 . . . . . . . 82 ALA CO . 52649 1 355 . 1 . 1 83 83 ALA CA C 13 53.022 0 . . . . . . . 82 ALA CA . 52649 1 356 . 1 . 1 83 83 ALA CB C 13 19.047 0 . . . . . . . 82 ALA CB . 52649 1 357 . 1 . 1 83 83 ALA N N 15 124.557 0 . . . . . . . 82 ALA N . 52649 1 358 . 1 . 1 84 84 ALA H H 1 8.234 0 . . . . . . . 83 ALA H . 52649 1 359 . 1 . 1 84 84 ALA C C 13 178.605 0 . . . . . . . 83 ALA CO . 52649 1 360 . 1 . 1 84 84 ALA CA C 13 52.987 0 . . . . . . . 83 ALA CA . 52649 1 361 . 1 . 1 84 84 ALA CB C 13 18.995 0 . . . . . . . 83 ALA CB . 52649 1 362 . 1 . 1 84 84 ALA N N 15 122.213 0 . . . . . . . 83 ALA N . 52649 1 363 . 1 . 1 85 85 GLY H H 1 8.235 0 . . . . . . . 84 GLY H . 52649 1 364 . 1 . 1 85 85 GLY C C 13 174.285 0 . . . . . . . 84 GLY CO . 52649 1 365 . 1 . 1 85 85 GLY CA C 13 45.409 0 . . . . . . . 84 GLY CA . 52649 1 366 . 1 . 1 85 85 GLY N N 15 107.797 0 . . . . . . . 84 GLY N . 52649 1 367 . 1 . 1 86 86 ALA H H 1 8.122 0 . . . . . . . 85 ALA H . 52649 1 368 . 1 . 1 86 86 ALA C C 13 178.166 0 . . . . . . . 85 ALA CO . 52649 1 369 . 1 . 1 86 86 ALA CA C 13 52.81 0 . . . . . . . 85 ALA CA . 52649 1 370 . 1 . 1 86 86 ALA CB C 13 19.296 0 . . . . . . . 85 ALA CB . 52649 1 371 . 1 . 1 86 86 ALA N N 15 123.698 0 . . . . . . . 85 ALA N . 52649 1 372 . 1 . 1 87 87 THR H H 1 8.062 0 . . . . . . . 86 THR H . 52649 1 373 . 1 . 1 87 87 THR C C 13 174.278 0 . . . . . . . 86 THR CO . 52649 1 374 . 1 . 1 87 87 THR CA C 13 61.937 0 . . . . . . . 86 THR CA . 52649 1 375 . 1 . 1 87 87 THR CB C 13 69.727 0 . . . . . . . 86 THR CB . 52649 1 376 . 1 . 1 87 87 THR N N 15 112.6619536 0 . . . . . . . 86 THR N . 52649 1 377 . 1 . 1 88 88 ALA H H 1 8.186 0 . . . . . . . 87 ALA H . 52649 1 378 . 1 . 1 88 88 ALA C C 13 177.29 0 . . . . . . . 87 ALA CO . 52649 1 379 . 1 . 1 88 88 ALA CA C 13 52.436 0 . . . . . . . 87 ALA CA . 52649 1 380 . 1 . 1 88 88 ALA CB C 13 19.2745597 0 . . . . . . . 87 ALA CB . 52649 1 381 . 1 . 1 88 88 ALA N N 15 126.394 0 . . . . . . . 87 ALA N . 52649 1 382 . 1 . 1 89 89 ARG H H 1 8.276032 0 . . . . . . . 88 ARG H . 52649 1 383 . 1 . 1 89 89 ARG C C 13 174.119 0 . . . . . . . 88 ARG CO . 52649 1 384 . 1 . 1 89 89 ARG CA C 13 53.856 0 . . . . . . . 88 ARG CA . 52649 1 385 . 1 . 1 89 89 ARG CB C 13 30.305 0 . . . . . . . 88 ARG CB . 52649 1 386 . 1 . 1 89 89 ARG N N 15 121.745 0 . . . . . . . 88 ARG N . 52649 1 387 . 1 . 1 90 90 PRO C C 13 176.637068 0 . . . . . . . 89 PRO CO . 52649 1 388 . 1 . 1 90 90 PRO CB C 13 32.269 0 . . . . . . . 89 PRO CB . 52649 1 389 . 1 . 1 90 90 PRO CA C 13 63.222 0 . . . . . . . 89 PRO CA . 52649 1 390 . 1 . 1 91 91 ALA H H 1 8.597032891 0 . . . . . . . 90 ALA H . 52649 1 391 . 1 . 1 91 91 ALA C C 13 177.8437813 0 . . . . . . . 90 ALA CO . 52649 1 392 . 1 . 1 91 91 ALA CA C 13 52.609 0 . . . . . . . 90 ALA CA . 52649 1 393 . 1 . 1 91 91 ALA CB C 13 19.209 0 . . . . . . . 90 ALA CB . 52649 1 394 . 1 . 1 91 91 ALA N N 15 124.831 0 . . . . . . . 90 ALA N . 52649 1 395 . 1 . 1 92 92 VAL H H 1 8.298 0 . . . . . . . 91 VAL H . 52649 1 396 . 1 . 1 92 92 VAL C C 13 176.171 0 . . . . . . . 91 VAL CO . 52649 1 397 . 1 . 1 92 92 VAL CA C 13 55.956 0 . . . . . . . 91 VAL CA . 52649 1 398 . 1 . 1 92 92 VAL CB C 13 31.049 0 . . . . . . . 91 VAL CB . 52649 1 399 . 1 . 1 92 92 VAL N N 15 120.377 0 . . . . . . . 91 VAL N . 52649 1 400 . 1 . 1 93 93 ARG H H 1 8.42 0 . . . . . . . 92 ARG H . 52649 1 401 . 1 . 1 93 93 ARG C C 13 176.175 0 . . . . . . . 92 ARG CO . 52649 1 402 . 1 . 1 93 93 ARG CA C 13 55.843 0 . . . . . . . 92 ARG CA . 52649 1 403 . 1 . 1 93 93 ARG CB C 13 31.047 0 . . . . . . . 92 ARG CB . 52649 1 404 . 1 . 1 93 93 ARG N N 15 125.604 0 . . . . . . . 92 ARG N . 52649 1 405 . 1 . 1 94 94 VAL H H 1 8.249 0 . . . . . . . 93 VAL H . 52649 1 406 . 1 . 1 94 94 VAL C C 13 174.5 0 . . . . . . . 93 VAL CO . 52649 1 407 . 1 . 1 94 94 VAL CA C 13 59.913 0 . . . . . . . 93 VAL CA . 52649 1 408 . 1 . 1 94 94 VAL CB C 13 32.768 0 . . . . . . . 93 VAL CB . 52649 1 409 . 1 . 1 94 94 VAL N N 15 123.364 0 . . . . . . . 93 VAL N . 52649 1 410 . 1 . 1 95 95 PRO C C 13 176.87 0 . . . . . . . 94 PRO CO . 52649 1 411 . 1 . 1 95 95 PRO CB C 13 32.29 0 . . . . . . . 94 PRO CA . 52649 1 412 . 1 . 1 95 95 PRO CA C 13 63.367 0 . . . . . . . 94 PRO CA . 52649 1 413 . 1 . 1 96 96 GLN H H 1 8.468 0 . . . . . . . 95 GLN H . 52649 1 414 . 1 . 1 96 96 GLN C C 13 176.085 0 . . . . . . . 95 GLN CO . 52649 1 415 . 1 . 1 96 96 GLN CA C 13 56.015 0 . . . . . . . 95 GLN CA . 52649 1 416 . 1 . 1 96 96 GLN CB C 13 29.481 0 . . . . . . . 95 GLN CB . 52649 1 417 . 1 . 1 96 96 GLN N N 15 120.729 0 . . . . . . . 95 GLN N . 52649 1 418 . 1 . 1 97 97 GLN H H 1 8.438502761 0 . . . . . . . 96 GLN H . 52649 1 419 . 1 . 1 97 97 GLN C C 13 175.85 0 . . . . . . . 96 GLN CO . 52649 1 420 . 1 . 1 97 97 GLN CB C 13 29.108 0 . . . . . . . 96 GLN CB . 52649 1 421 . 1 . 1 97 97 GLN CA C 13 56.015 0 . . . . . . . 96 GLN CA . 52649 1 422 . 1 . 1 97 97 GLN N N 15 121.706 0 . . . . . . . 96 GLN N . 52649 1 423 . 1 . 1 98 98 GLN H H 1 8.417 0 . . . . . . . 97 GLN H . 52649 1 424 . 1 . 1 98 98 GLN C C 13 175.488 0 . . . . . . . 97 GLN CO . 52649 1 425 . 1 . 1 98 98 GLN CA C 13 55.858 0 . . . . . . . 97 GLN CA . 52649 1 426 . 1 . 1 98 98 GLN CB C 13 29.62104154 0 . . . . . . . 97 GLN CB . 52649 1 427 . 1 . 1 98 98 GLN N N 15 121.901 0 . . . . . . . 97 GLN N . 52649 1 428 . 1 . 1 99 99 ALA H H 1 8.335968894 0 . . . . . . . 98 ALA H . 52649 1 429 . 1 . 1 99 99 ALA C C 13 177.402 0 . . . . . . . 98 ALA CO . 52649 1 430 . 1 . 1 99 99 ALA CA C 13 52.557 0 . . . . . . . 98 ALA CA . 52649 1 431 . 1 . 1 99 99 ALA CB C 13 19.341 0 . . . . . . . 98 ALA CB . 52649 1 432 . 1 . 1 99 99 ALA N N 15 125.534 0 . . . . . . . 98 ALA N . 52649 1 433 . 1 . 1 100 100 ILE H H 1 8.116 0 . . . . . . . 99 ILE H . 52649 1 434 . 1 . 1 100 100 ILE C C 13 176.031 0 . . . . . . . 99 ILE CO . 52649 1 435 . 1 . 1 100 100 ILE CA C 13 60.997 0 . . . . . . . 99 ILE CA . 52649 1 436 . 1 . 1 100 100 ILE CB C 13 38.647 0 . . . . . . . 99 ILE CB . 52649 1 437 . 1 . 1 100 100 ILE N N 15 120.377 0 . . . . . . . 99 ILE N . 52649 1 438 . 1 . 1 101 101 LEU H H 1 8.271129445 0 . . . . . . . 100 LEU H . 52649 1 439 . 1 . 1 101 101 LEU C C 13 176.525 0 . . . . . . . 100 LEU CO . 52649 1 440 . 1 . 1 101 101 LEU CA C 13 54.776 0 . . . . . . . 100 LEU CA . 52649 1 441 . 1 . 1 101 101 LEU CB C 13 42.61 0 . . . . . . . 100 LEU CB . 52649 1 442 . 1 . 1 101 101 LEU N N 15 126.902 0 . . . . . . . 100 LEU N . 52649 1 443 . 1 . 1 102 102 ASP H H 1 8.263573103 0 . . . . . . . 101 ASP H . 52649 1 444 . 1 . 1 102 102 ASP C C 13 174.615657 0 . . . . . . . 101 ASP CO . 52649 1 445 . 1 . 1 102 102 ASP CA C 13 52.309 0 . . . . . . . 101 ASP CA . 52649 1 446 . 1 . 1 102 102 ASP CB C 13 40.874 0 . . . . . . . 101 ASP CB . 52649 1 447 . 1 . 1 102 102 ASP N N 15 123.13 0 . . . . . . . 101 ASP N . 52649 1 448 . 1 . 1 103 103 PRO C C 13 176.9337917 0 . . . . . . . 102 PRO CO . 52649 1 449 . 1 . 1 103 103 PRO CB C 13 32.417 0 . . . . . . . 102 PRO CB . 52649 1 450 . 1 . 1 103 103 PRO CA C 13 63.387 0 . . . . . . . 102 PRO CA . 52649 1 451 . 1 . 1 104 104 GLU H H 1 8.429063838 0 . . . . . . . 103 GLU H . 52649 1 452 . 1 . 1 104 104 GLU C C 13 176.388 0 . . . . . . . 103 GLU CO . 52649 1 453 . 1 . 1 104 104 GLU CA C 13 56.41769414 0 . . . . . . . 103 GLU CA . 52649 1 454 . 1 . 1 104 104 GLU CB C 13 30.04 0 . . . . . . . 103 GLU CB . 52649 1 455 . 1 . 1 104 104 GLU N N 15 119.8392018 0 . . . . . . . 103 GLU N . 52649 1 456 . 1 . 1 105 105 LEU H H 1 8.054656287 0 . . . . . . . 104 LEU H . 52649 1 457 . 1 . 1 105 105 LEU C C 13 175.156 0 . . . . . . . 104 LEU CO . 52649 1 458 . 1 . 1 105 105 LEU CA C 13 52.977 0 . . . . . . . 104 LEU CA . 52649 1 459 . 1 . 1 105 105 LEU CB C 13 41.7945513 0 . . . . . . . 104 LEU CB . 52649 1 460 . 1 . 1 105 105 LEU N N 15 124.362 0 . . . . . . . 104 LEU N . 52649 1 461 . 1 . 1 106 106 PRO C C 13 176.633 0 . . . . . . . 105 PRO CO . 52649 1 462 . 1 . 1 106 106 PRO CB C 13 32.182 0 . . . . . . . 105 PRO CB . 52649 1 463 . 1 . 1 106 106 PRO CA C 13 63.098 0 . . . . . . . 105 PRO CA . 52649 1 464 . 1 . 1 107 107 ALA H H 1 8.318 0 . . . . . . . 106 ALA H . 52649 1 465 . 1 . 1 107 107 ALA C C 13 177.836 0 . . . . . . . 106 ALA CO . 52649 1 466 . 1 . 1 107 107 ALA CA C 13 52.446 0 . . . . . . . 106 ALA CA . 52649 1 467 . 1 . 1 107 107 ALA CB C 13 19.237 0 . . . . . . . 106 ALA CB . 52649 1 468 . 1 . 1 107 107 ALA N N 15 124.089 0 . . . . . . . 106 ALA N . 52649 1 469 . 1 . 1 108 108 VAL H H 1 8.09001479 0 . . . . . . . 107 VAL H . 52649 1 470 . 1 . 1 108 108 VAL C C 13 177.895 0 . . . . . . . 107 VAL CO . 52649 1 471 . 1 . 1 108 108 VAL CA C 13 62.281 0 . . . . . . . 107 VAL CA . 52649 1 472 . 1 . 1 108 108 VAL CB C 13 32.961 0 . . . . . . . 107 VAL CB . 52649 1 473 . 1 . 1 108 108 VAL N N 15 119.654 0 . . . . . . . 107 VAL N . 52649 1 474 . 1 . 1 109 109 ARG H H 1 8.374140458 0 . . . . . . . 108 ARG H . 52649 1 475 . 1 . 1 109 109 ARG C C 13 175.817 0 . . . . . . . 108 ARG CO . 52649 1 476 . 1 . 1 109 109 ARG CA C 13 55.7191595 0 . . . . . . . 108 ARG CA . 52649 1 477 . 1 . 1 109 109 ARG CB C 13 31.0343963 0 . . . . . . . 108 ARG CB . 52649 1 478 . 1 . 1 109 109 ARG N N 15 125.026 0 . . . . . . . 108 ARG N . 52649 1 479 . 1 . 1 110 110 GLU H H 1 8.430075215 0 . . . . . . . 109 GLU H . 52649 1 480 . 1 . 1 110 110 GLU C C 13 175.5374158 0 . . . . . . . 109 GLU CO . 52649 1 481 . 1 . 1 110 110 GLU CA C 13 54.411 0 . . . . . . . 109 GLU CA . 52649 1 482 . 1 . 1 110 110 GLU CB C 13 33.024 0 . . . . . . . 109 GLU CB . 52649 1 483 . 1 . 1 110 110 GLU N N 15 123.698 0 . . . . . . . 109 GLU N . 52649 1 484 . 1 . 1 114 114 PRO C C 13 176.5210227 0 . . . . . . . 113 PRO CO . 52649 1 485 . 1 . 1 114 114 PRO CB C 13 32.136 0 . . . . . . . 113 PRO CB . 52649 1 486 . 1 . 1 114 114 PRO CA C 13 62.816 0 . . . . . . . 113 PRO CA . 52649 1 487 . 1 . 1 115 115 ALA H H 1 8.359 0 . . . . . . . 114 ALA H . 52649 1 488 . 1 . 1 115 115 ALA C C 13 177.289 0 . . . . . . . 114 ALA CO . 52649 1 489 . 1 . 1 115 115 ALA CA C 13 52.24 0 . . . . . . . 114 ALA CA . 52649 1 490 . 1 . 1 115 115 ALA CB C 13 19.377 0 . . . . . . . 114 ALA CB . 52649 1 491 . 1 . 1 115 115 ALA N N 15 124.44 0 . . . . . . . 114 ALA N . 52649 1 492 . 1 . 1 116 116 ASP H H 1 8.277094753 0 . . . . . . . 115 ASP H . 52649 1 493 . 1 . 1 116 116 ASP C C 13 175.208 0 . . . . . . . 115 ASP CO . 52649 1 494 . 1 . 1 116 116 ASP CA C 13 52.169636 0 . . . . . . . 115 ASP CA . 52649 1 495 . 1 . 1 116 116 ASP CB C 13 41.367 0 . . . . . . . 115 ASP CB . 52649 1 496 . 1 . 1 116 116 ASP N N 15 120.807 0 . . . . . . . 115 ASP N . 52649 1 497 . 1 . 1 117 117 PRO C C 13 177.837 0 . . . . . . . 116 PRO CO . 52649 1 498 . 1 . 1 117 117 PRO CB C 13 32.424 0 . . . . . . . 116 PRO CB . 52649 1 499 . 1 . 1 117 117 PRO CA C 13 64.178 0 . . . . . . . 116 PRO CA . 52649 1 500 . 1 . 1 118 118 GLU H H 1 8.408263418 0 . . . . . . . 117 GLU H . 52649 1 501 . 1 . 1 118 118 GLU C C 13 176.9404937 0 . . . . . . . 117 GLU CO . 52649 1 502 . 1 . 1 118 118 GLU CA C 13 56.8384782 0 . . . . . . . 117 GLU CA . 52649 1 503 . 1 . 1 118 118 GLU CB C 13 29.652 0 . . . . . . . 117 GLU CB . 52649 1 504 . 1 . 1 118 118 GLU N N 15 118.697 0 . . . . . . . 117 GLU N . 52649 1 505 . 1 . 1 119 119 ALA H H 1 7.915986824 0 . . . . . . . 118 ALA H . 52649 1 506 . 1 . 1 119 119 ALA C C 13 178.11 0 . . . . . . . 118 ALA CO . 52649 1 507 . 1 . 1 119 119 ALA CA C 13 53.027 0 . . . . . . . 118 ALA CA . 52649 1 508 . 1 . 1 119 119 ALA CB C 13 18.887 0 . . . . . . . 118 ALA CB . 52649 1 509 . 1 . 1 119 119 ALA N N 15 123.664 0 . . . . . . . 118 ALA N . 52649 1 510 . 1 . 1 120 120 ARG H H 1 8.041 0 . . . . . . . 119 ARG H . 52649 1 511 . 1 . 1 120 120 ARG C C 13 176.357 0 . . . . . . . 119 ARG CO . 52649 1 512 . 1 . 1 120 120 ARG CA C 13 56.309 0 . . . . . . . 119 ARG CA . 52649 1 513 . 1 . 1 120 120 ARG CB C 13 30.545 0 . . . . . . . 119 ARG CB . 52649 1 514 . 1 . 1 120 120 ARG N N 15 118.697 0 . . . . . . . 119 ARG N . 52649 1 515 . 1 . 1 121 121 LYS H H 1 8.096257126 0 . . . . . . . 120 LYS H . 52649 1 516 . 1 . 1 121 121 LYS C C 13 176.417 0 . . . . . . . 120 LYS CO . 52649 1 517 . 1 . 1 121 121 LYS CA C 13 56.539 0 . . . . . . . 120 LYS CA . 52649 1 518 . 1 . 1 121 121 LYS CB C 13 32.981 0 . . . . . . . 120 LYS CB . 52649 1 519 . 1 . 1 121 121 LYS N N 15 121.706 0 . . . . . . . 120 LYS N . 52649 1 520 . 1 . 1 122 122 VAL H H 1 8.064 0 . . . . . . . 121 VAL H . 52649 1 521 . 1 . 1 122 122 VAL C C 13 175.978 0 . . . . . . . 121 VAL CO . 52649 1 522 . 1 . 1 122 122 VAL CA C 13 62.4210512 0 . . . . . . . 121 VAL CA . 52649 1 523 . 1 . 1 122 122 VAL CB C 13 32.843 0 . . . . . . . 121 VAL CB . 52649 1 524 . 1 . 1 122 122 VAL N N 15 121.823 0 . . . . . . . 121 VAL N . 52649 1 525 . 1 . 1 123 123 VAL H H 1 8.264 0 . . . . . . . 122 VAL H . 52649 1 526 . 1 . 1 123 123 VAL C C 13 175.9278444 0 . . . . . . . 122 VAL CO . 52649 1 527 . 1 . 1 123 123 VAL CB C 13 32.859 0 . . . . . . . 122 VAL CB . 52649 1 528 . 1 . 1 123 123 VAL N N 15 125.261 0 . . . . . . . 122 VAL N . 52649 1 529 . 1 . 1 124 124 ARG H H 1 8.457 0 . . . . . . . 123 ARG H . 52649 1 530 . 1 . 1 124 124 ARG C C 13 176.3032043 0 . . . . . . . 123 ARG CO . 52649 1 531 . 1 . 1 124 124 ARG CA C 13 55.838 0 . . . . . . . 123 ARG CA . 52649 1 532 . 1 . 1 124 124 ARG CB C 13 31.0610053 0 . . . . . . . 123 ARG CB . 52649 1 533 . 1 . 1 124 124 ARG N N 15 125.69 0 . . . . . . . 123 ARG N . 52649 1 534 . 1 . 1 125 125 GLY H H 1 8.318 0 . . . . . . . 124 GLY H . 52649 1 535 . 1 . 1 125 125 GLY C C 13 171.819 0 . . . . . . . 124 GLY CO . 52649 1 536 . 1 . 1 125 125 GLY CA C 13 44.586 0 . . . . . . . 124 GLY CA . 52649 1 537 . 1 . 1 125 125 GLY N N 15 110.572 0 . . . . . . . 124 GLY N . 52649 1 538 . 1 . 1 126 126 PRO CB C 13 32.141 0 . . . . . . . 125 PRO CB . 52649 1 539 . 1 . 1 126 126 PRO C C 13 176.946 0 . . . . . . . 125 PRO C . 52649 1 540 . 1 . 1 127 127 SER H H 1 8.457 0 . . . . . . . 126 SER H . 52649 1 541 . 1 . 1 127 127 SER C C 13 174.886 0 . . . . . . . 126 SER CO . 52649 1 542 . 1 . 1 127 127 SER CA C 13 58.555 0 . . . . . . . 126 SER CA . 52649 1 543 . 1 . 1 127 127 SER CB C 13 63.788 0 . . . . . . . 126 SER CB . 52649 1 544 . 1 . 1 127 127 SER N N 15 116.4 0 . . . . . . . 126 SER N . 52649 1 545 . 1 . 1 129 129 ARG C C 13 176.202 0 . . . . . . . 128 ARG CO . 52649 1 546 . 1 . 1 130 130 ARG CB C 13 30.755 0 . . . . . . . 129 ARG CB . 52649 1 547 . 1 . 1 130 130 ARG CA C 13 56.546 0 . . . . . . . 129 ARG CA . 52649 1 548 . 1 . 1 130 130 ARG H H 1 8.505 0 . . . . . . . 129 ARG H . 52649 1 549 . 1 . 1 130 130 ARG N N 15 122.839 0 . . . . . . . 129 ARG N . 52649 1 550 . 1 . 1 130 130 ARG C C 13 176.852 0 . . . . . . . 129 ARG CO . 52649 1 551 . 1 . 1 131 131 GLY H H 1 8.475 0 . . . . . . . 130 GLY H . 52649 1 552 . 1 . 1 131 131 GLY C C 13 173.843 0 . . . . . . . 130 GLY CO . 52649 1 553 . 1 . 1 131 131 GLY N N 15 110.572 0 . . . . . . . 130 GLY N . 52649 1 554 . 1 . 1 133 133 ARG C C 13 176.522 0 . . . . . . . 132 ARG CO . 52649 1 555 . 1 . 1 133 133 ARG CA C 13 56.107 0 . . . . . . . 132 ARG CA . 52649 1 556 . 1 . 1 134 134 SER H H 1 8.402 0 . . . . . . . 133 SER H . 52649 1 557 . 1 . 1 134 134 SER C C 13 174.936 0 . . . . . . . 133 SER CO . 52649 1 558 . 1 . 1 134 134 SER CA C 13 58.307 0 . . . . . . . 133 SER CA . 52649 1 559 . 1 . 1 134 134 SER CB C 13 63.742 0 . . . . . . . 133 SER CB . 52649 1 560 . 1 . 1 134 134 SER N N 15 117.369 0 . . . . . . . 133 SER N . 52649 1 561 . 1 . 1 135 135 THR H H 1 8.244 0 . . . . . . . 134 THR H . 52649 1 562 . 1 . 1 135 135 THR C C 13 175.15 0 . . . . . . . 134 THR CO . 52649 1 563 . 1 . 1 135 135 THR CA C 13 61.935 0 . . . . . . . 134 THR CA . 52649 1 564 . 1 . 1 135 135 THR CB C 13 69.799 0 . . . . . . . 134 THR CB . 52649 1 565 . 1 . 1 135 135 THR N N 15 115.492 0 . . . . . . . 134 THR N . 52649 1 566 . 1 . 1 136 136 GLY H H 1 8.401329945 0 . . . . . . . 135 GLY H . 52649 1 567 . 1 . 1 136 136 GLY C C 13 173.7870421 0 . . . . . . . 135 GLY CO . 52649 1 568 . 1 . 1 136 136 GLY CA C 13 45.177 0 . . . . . . . 135 GLY CA . 52649 1 569 . 1 . 1 136 136 GLY N N 15 110.767 0 . . . . . . . 135 GLY N . 52649 1 570 . 1 . 1 137 137 GLN H H 1 8.221059643 0 . . . . . . . 136 GLN H . 52649 1 571 . 1 . 1 137 137 GLN C C 13 174.116 0 . . . . . . . 136 GLN CO . 52649 1 572 . 1 . 1 137 137 GLN CA C 13 53.743 0 . . . . . . . 136 GLN CA . 52649 1 573 . 1 . 1 137 137 GLN CB C 13 28.983 0 . . . . . . . 136 GLN CB . 52649 1 574 . 1 . 1 137 137 GLN N N 15 120.963 0 . . . . . . . 136 GLN N . 52649 1 575 . 1 . 1 140 140 ALA H H 1 8.337 0 . . . . . . . 139 ALA H . 52649 1 576 . 1 . 1 140 140 ALA C C 13 175.502 0 . . . . . . . 139 ALA C . 52649 1 577 . 1 . 1 140 140 ALA CA C 13 50.484 0 . . . . . . . 139 ALA CA . 52649 1 578 . 1 . 1 140 140 ALA CB C 13 18.206 0 . . . . . . . 139 ALA CB . 52649 1 579 . 1 . 1 140 140 ALA N N 15 126.667 0 . . . . . . . 139 ALA N . 52649 1 580 . 1 . 1 141 141 PRO C C 13 177.071 0 . . . . . . . 140 PRO CO . 52649 1 581 . 1 . 1 141 141 PRO CB C 13 32.332 0 . . . . . . . 140 PRO CB . 52649 1 582 . 1 . 1 141 141 PRO CA C 13 63.074 0 . . . . . . . 140 PRO CA . 52649 1 583 . 1 . 1 142 142 ARG H H 1 8.517 0 . . . . . . . 141 ARG H . 52649 1 584 . 1 . 1 142 142 ARG C C 13 177.069 0 . . . . . . . 141 ARG CO . 52649 1 585 . 1 . 1 142 142 ARG CA C 13 56.53489015 0 . . . . . . . 141 ARG CA . 52649 1 586 . 1 . 1 142 142 ARG CB C 13 30.632 0 . . . . . . . 141 ARG CB . 52649 1 587 . 1 . 1 142 142 ARG N N 15 121.823 0 . . . . . . . 141 ARG N . 52649 1 588 . 1 . 1 143 143 GLY H H 1 8.48759815 0 . . . . . . . 142 GLY H . 52649 1 589 . 1 . 1 143 143 GLY C C 13 174.173 0 . . . . . . . 142 GLY CO . 52649 1 590 . 1 . 1 143 143 GLY CA C 13 45.23 0 . . . . . . . 142 GLY CA . 52649 1 591 . 1 . 1 143 143 GLY N N 15 110.493 0 . . . . . . . 142 GLY N . 52649 1 592 . 1 . 1 144 144 SER H H 1 8.234926589 0 . . . . . . . 143 SER H . 52649 1 593 . 1 . 1 144 144 SER C C 13 174.394 0 . . . . . . . 143 SER CO . 52649 1 594 . 1 . 1 144 144 SER CA C 13 58.416 0 . . . . . . . 143 SER CA . 52649 1 595 . 1 . 1 144 144 SER CB C 13 63.997 0 . . . . . . . 143 SER CB . 52649 1 596 . 1 . 1 144 144 SER N N 15 115.689 0 . . . . . . . 143 SER N . 52649 1 597 . 1 . 1 145 145 ARG H H 1 8.334 0 . . . . . . . 144 ARG H . 52649 1 598 . 1 . 1 145 145 ARG C C 13 175.9750092 0 . . . . . . . 144 ARG CO . 52649 1 599 . 1 . 1 145 145 ARG CA C 13 55.69 0 . . . . . . . 144 ARG CA . 52649 1 600 . 1 . 1 145 145 ARG CB C 13 31.032 0 . . . . . . . 144 ARG CB . 52649 1 601 . 1 . 1 145 145 ARG N N 15 122.839 0 . . . . . . . 144 ARG N . 52649 1 602 . 1 . 1 146 146 LYS H H 1 8.439043657 0 . . . . . . . 145 LYS H . 52649 1 603 . 1 . 1 146 146 LYS C C 13 175.539 0 . . . . . . . 145 LYS CO . 52649 1 604 . 1 . 1 146 146 LYS CA C 13 56.408 0 . . . . . . . 145 LYS CA . 52649 1 605 . 1 . 1 146 146 LYS CB C 13 33.159 0 . . . . . . . 145 LYS CB . 52649 1 606 . 1 . 1 146 146 LYS N N 15 124.048 0 . . . . . . . 145 LYS N . 52649 1 607 . 1 . 1 147 147 GLU H H 1 8.026922395 0 . . . . . . . 146 GLU H . 52649 1 608 . 1 . 1 147 147 GLU C C 13 176.305 0 . . . . . . . 146 GLU CO . 52649 1 609 . 1 . 1 147 147 GLU CA C 13 57.955 0 . . . . . . . 146 GLU CA . 52649 1 610 . 1 . 1 147 147 GLU CB C 13 31.129 0 . . . . . . . 146 GLU CB . 52649 1 611 . 1 . 1 147 147 GLU N N 15 127.761 0 . . . . . . . 146 GLU N . 52649 1 stop_ save_