################################### # 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 27548 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' . . . 27548 1 2 '3D HN(CO)CACB' . . . 27548 1 3 '2D 1H-15N TROSY' . . . 27548 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 1 1 GLY H H 1 7.920 0.000 . 1 . . . . . 7 GLY HN . 27548 1 2 . 1 1 1 1 GLY CA C 13 41.687 0.000 . 1 . . . . . 7 GLY CA . 27548 1 3 . 1 1 1 1 GLY N N 15 108.965 0.000 . 1 . . . . . 7 GLY N . 27548 1 4 . 1 1 2 2 PRO CA C 13 60.030 0.000 . 1 . . . . . 8 PRO CA . 27548 1 5 . 1 1 2 2 PRO CB C 13 28.691 0.000 . 1 . . . . . 8 PRO CB . 27548 1 6 . 1 1 3 3 SER H H 1 8.279 0.000 . 1 . . . . . 9 SER HN . 27548 1 7 . 1 1 3 3 SER CA C 13 55.166 0.037 . 1 . . . . . 9 SER CA . 27548 1 8 . 1 1 3 3 SER CB C 13 60.699 0.149 . 1 . . . . . 9 SER CB . 27548 1 9 . 1 1 3 3 SER N N 15 116.720 0.000 . 1 . . . . . 9 SER N . 27548 1 10 . 1 1 4 4 PHE H H 1 8.133 0.000 . 1 . . . . . 10 PHE HN . 27548 1 11 . 1 1 4 4 PHE CA C 13 54.497 0.185 . 1 . . . . . 10 PHE CA . 27548 1 12 . 1 1 4 4 PHE CB C 13 36.637 0.000 . 1 . . . . . 10 PHE CB . 27548 1 13 . 1 1 4 4 PHE N N 15 122.636 0.000 . 1 . . . . . 10 PHE N . 27548 1 14 . 1 1 5 5 THR H H 1 7.940 0.000 . 1 . . . . . 11 THR HN . 27548 1 15 . 1 1 5 5 THR CA C 13 58.730 0.111 . 1 . . . . . 11 THR CA . 27548 1 16 . 1 1 5 5 THR CB C 13 66.602 0.111 . 1 . . . . . 11 THR CB . 27548 1 17 . 1 1 5 5 THR N N 15 117.364 0.000 . 1 . . . . . 11 THR N . 27548 1 18 . 1 1 6 6 SER H H 1 8.335 0.000 . 1 . . . . . 12 SER HN . 27548 1 19 . 1 1 6 6 SER CA C 13 53.866 0.000 . 1 . . . . . 12 SER CA . 27548 1 20 . 1 1 6 6 SER CB C 13 60.179 0.000 . 1 . . . . . 12 SER CB . 27548 1 21 . 1 1 6 6 SER N N 15 120.950 0.000 . 1 . . . . . 12 SER N . 27548 1 22 . 1 1 7 7 PRO CA C 13 60.104 0.000 . 1 . . . . . 13 PRO CA . 27548 1 23 . 1 1 7 7 PRO CB C 13 28.691 0.000 . 1 . . . . . 13 PRO CB . 27548 1 24 . 1 1 8 8 ALA H H 1 8.128 0.000 . 1 . . . . . 14 ALA HN . 27548 1 25 . 1 1 8 8 ALA CA C 13 49.262 0.000 . 1 . . . . . 14 ALA CA . 27548 1 26 . 1 1 8 8 ALA CB C 13 15.769 0.074 . 1 . . . . . 14 ALA CB . 27548 1 27 . 1 1 8 8 ALA N N 15 124.646 0.000 . 1 . . . . . 14 ALA N . 27548 1 28 . 1 1 9 9 VAL H H 1 7.885 0.000 . 1 . . . . . 15 VAL HN . 27548 1 29 . 1 1 9 9 VAL CA C 13 58.991 0.074 . 1 . . . . . 15 VAL CA . 27548 1 30 . 1 1 9 9 VAL CB C 13 29.471 0.037 . 1 . . . . . 15 VAL CB . 27548 1 31 . 1 1 9 9 VAL N N 15 120.527 0.000 . 1 . . . . . 15 VAL N . 27548 1 32 . 1 1 10 10 LYS H H 1 8.202 0.000 . 1 . . . . . 16 LYS HN . 27548 1 33 . 1 1 10 10 LYS CA C 13 53.049 0.000 . 1 . . . . . 16 LYS CA . 27548 1 34 . 1 1 10 10 LYS CB C 13 29.285 0.000 . 1 . . . . . 16 LYS CB . 27548 1 35 . 1 1 10 10 LYS N N 15 126.966 0.000 . 1 . . . . . 16 LYS N . 27548 1 36 . 1 1 14 14 GLY CA C 13 42.727 0.000 . 1 . . . . . 20 GLY CA . 27548 1 37 . 1 1 15 15 TRP H H 1 7.990 0.000 . 1 . . . . . 21 TRP HN . 27548 1 38 . 1 1 15 15 TRP CA C 13 53.495 0.000 . 1 . . . . . 21 TRP CA . 27548 1 39 . 1 1 15 15 TRP CB C 13 27.132 0.075 . 1 . . . . . 21 TRP CB . 27548 1 40 . 1 1 15 15 TRP N N 15 119.824 0.000 . 1 . . . . . 21 TRP N . 27548 1 41 . 1 1 16 16 LYS H H 1 7.804 0.000 . 1 . . . . . 22 LYS HN . 27548 1 42 . 1 1 16 16 LYS CA C 13 54.126 0.037 . 1 . . . . . 22 LYS CA . 27548 1 43 . 1 1 16 16 LYS CB C 13 29.434 0.000 . 1 . . . . . 22 LYS CB . 27548 1 44 . 1 1 16 16 LYS N N 15 123.339 0.000 . 1 . . . . . 22 LYS N . 27548 1 45 . 1 1 17 17 GLN H H 1 8.374 0.000 . 1 . . . . . 23 GLN HN . 27548 1 46 . 1 1 17 17 GLN CA C 13 51.527 0.111 . 1 . . . . . 23 GLN CA . 27548 1 47 . 1 1 17 17 GLN CB C 13 26.203 0.112 . 1 . . . . . 23 GLN CB . 27548 1 48 . 1 1 17 17 GLN N N 15 123.574 0.000 . 1 . . . . . 23 GLN N . 27548 1 49 . 1 1 18 18 GLY H H 1 8.527 0.000 . 1 . . . . . 24 GLY HN . 27548 1 50 . 1 1 18 18 GLY CA C 13 41.761 0.000 . 1 . . . . . 24 GLY CA . 27548 1 51 . 1 1 18 18 GLY N N 15 112.654 0.000 . 1 . . . . . 24 GLY N . 27548 1 52 . 1 1 19 19 ASP H H 1 8.265 0.000 . 1 . . . . . 25 ASP HN . 27548 1 53 . 1 1 19 19 ASP CA C 13 51.305 0.111 . 1 . . . . . 25 ASP CA . 27548 1 54 . 1 1 19 19 ASP CB C 13 38.420 0.074 . 1 . . . . . 25 ASP CB . 27548 1 55 . 1 1 19 19 ASP N N 15 120.059 0.000 . 1 . . . . . 25 ASP N . 27548 1 56 . 1 1 20 20 GLU H H 1 8.363 0.000 . 1 . . . . . 26 GLU HN . 27548 1 57 . 1 1 20 20 GLU CA C 13 53.829 0.037 . 1 . . . . . 26 GLU CA . 27548 1 58 . 1 1 20 20 GLU CB C 13 27.317 0.037 . 1 . . . . . 26 GLU CB . 27548 1 59 . 1 1 20 20 GLU N N 15 120.982 0.000 . 1 . . . . . 26 GLU N . 27548 1 60 . 1 1 21 21 GLU H H 1 7.655 0.000 . 1 . . . . . 27 GLU HN . 27548 1 61 . 1 1 21 21 GLU CA C 13 52.493 0.037 . 1 . . . . . 27 GLU CA . 27548 1 62 . 1 1 21 21 GLU CB C 13 26.537 0.000 . 1 . . . . . 27 GLU CB . 27548 1 63 . 1 1 21 21 GLU N N 15 118.277 0.000 . 1 . . . . . 27 GLU N . 27548 1 64 . 1 1 22 22 GLU H H 1 8.153 0.000 . 1 . . . . . 28 GLU HN . 27548 1 65 . 1 1 22 22 GLU CA C 13 54.015 0.000 . 1 . . . . . 28 GLU CA . 27548 1 66 . 1 1 22 22 GLU N N 15 121.348 0.000 . 1 . . . . . 28 GLU N . 27548 1 67 . 1 1 25 25 ALA CA C 13 52.975 0.000 . 1 . . . . . 31 ALA CA . 27548 1 68 . 1 1 25 25 ALA CB C 13 15.769 0.000 . 1 . . . . . 31 ALA CB . 27548 1 69 . 1 1 26 26 GLU H H 1 8.213 0.000 . 1 . . . . . 32 GLU HN . 27548 1 70 . 1 1 26 26 GLU CA C 13 52.381 0.000 . 1 . . . . . 32 GLU CA . 27548 1 71 . 1 1 26 26 GLU CB C 13 27.206 0.297 . 1 . . . . . 32 GLU CB . 27548 1 72 . 1 1 26 26 GLU N N 15 119.004 0.000 . 1 . . . . . 32 GLU N . 27548 1 73 . 1 1 27 27 LYS H H 1 8.607 0.000 . 1 . . . . . 33 LYS HN . 27548 1 74 . 1 1 27 27 LYS CA C 13 55.500 0.297 . 1 . . . . . 33 LYS CA . 27548 1 75 . 1 1 27 27 LYS CB C 13 28.691 0.297 . 1 . . . . . 33 LYS CB . 27548 1 76 . 1 1 27 27 LYS N N 15 119.004 0.000 . 1 . . . . . 33 LYS N . 27548 1 77 . 1 1 28 28 ALA H H 1 7.819 0.000 . 1 . . . . . 34 ALA HN . 27548 1 78 . 1 1 28 28 ALA CA C 13 51.713 0.000 . 1 . . . . . 34 ALA CA . 27548 1 79 . 1 1 28 28 ALA CB C 13 13.541 0.000 . 1 . . . . . 34 ALA CB . 27548 1 80 . 1 1 28 28 ALA N N 15 122.055 0.000 . 1 . . . . . 34 ALA N . 27548 1 81 . 1 1 29 29 VAL H H 1 8.734 0.000 . 1 . . . . . 35 VAL HN . 27548 1 82 . 1 1 29 29 VAL CA C 13 64.374 0.111 . 1 . . . . . 35 VAL CA . 27548 1 83 . 1 1 29 29 VAL CB C 13 27.837 0.037 . 1 . . . . . 35 VAL CB . 27548 1 84 . 1 1 29 29 VAL N N 15 124.732 0.000 . 1 . . . . . 35 VAL N . 27548 1 85 . 1 1 30 30 ASP H H 1 8.493 0.000 . 1 . . . . . 36 ASP HN . 27548 1 86 . 1 1 30 30 ASP CA C 13 55.278 0.075 . 1 . . . . . 36 ASP CA . 27548 1 87 . 1 1 30 30 ASP CB C 13 39.311 0.000 . 1 . . . . . 36 ASP CB . 27548 1 88 . 1 1 30 30 ASP N N 15 122.402 0.000 . 1 . . . . . 36 ASP N . 27548 1 89 . 1 1 31 31 ALA H H 1 7.649 0.000 . 1 . . . . . 37 ALA HN . 27548 1 90 . 1 1 31 31 ALA CA C 13 51.898 0.111 . 1 . . . . . 37 ALA CA . 27548 1 91 . 1 1 31 31 ALA CB C 13 14.915 0.037 . 1 . . . . . 37 ALA CB . 27548 1 92 . 1 1 31 31 ALA N N 15 118.672 0.000 . 1 . . . . . 37 ALA N . 27548 1 93 . 1 1 32 32 LEU H H 1 7.334 0.000 . 1 . . . . . 38 LEU HN . 27548 1 94 . 1 1 32 32 LEU CA C 13 54.683 0.000 . 1 . . . . . 38 LEU CA . 27548 1 95 . 1 1 32 32 LEU CB C 13 37.788 0.037 . 1 . . . . . 38 LEU CB . 27548 1 96 . 1 1 32 32 LEU N N 15 119.060 0.000 . 1 . . . . . 38 LEU N . 27548 1 97 . 1 1 33 33 VAL H H 1 8.504 0.000 . 1 . . . . . 39 VAL HN . 27548 1 98 . 1 1 33 33 VAL CA C 13 63.855 0.037 . 1 . . . . . 39 VAL CA . 27548 1 99 . 1 1 33 33 VAL CB C 13 27.986 0.038 . 1 . . . . . 39 VAL CB . 27548 1 100 . 1 1 33 33 VAL N N 15 120.293 0.000 . 1 . . . . . 39 VAL N . 27548 1 101 . 1 1 34 34 LYS H H 1 7.433 0.000 . 1 . . . . . 40 LYS HN . 27548 1 102 . 1 1 34 34 LYS CA C 13 56.986 0.075 . 1 . . . . . 40 LYS CA . 27548 1 103 . 1 1 34 34 LYS CB C 13 29.211 0.000 . 1 . . . . . 40 LYS CB . 27548 1 104 . 1 1 34 34 LYS N N 15 117.009 0.000 . 1 . . . . . 40 LYS N . 27548 1 105 . 1 1 35 35 LYS H H 1 7.130 0.000 . 1 . . . . . 41 LYS HN . 27548 1 106 . 1 1 35 35 LYS CA C 13 55.649 0.000 . 1 . . . . . 41 LYS CA . 27548 1 107 . 1 1 35 35 LYS CB C 13 30.064 0.112 . 1 . . . . . 41 LYS CB . 27548 1 108 . 1 1 35 35 LYS N N 15 116.636 0.000 . 1 . . . . . 41 LYS N . 27548 1 109 . 1 1 36 36 LEU H H 1 8.430 0.000 . 1 . . . . . 42 LEU HN . 27548 1 110 . 1 1 36 36 LEU CA C 13 53.681 0.037 . 1 . . . . . 42 LEU CA . 27548 1 111 . 1 1 36 36 LEU CB C 13 37.751 0.074 . 1 . . . . . 42 LEU CB . 27548 1 112 . 1 1 36 36 LEU N N 15 118.579 0.000 . 1 . . . . . 42 LEU N . 27548 1 113 . 1 1 37 37 LYS H H 1 7.976 0.000 . 1 . . . . . 43 LYS HN . 27548 1 114 . 1 1 37 37 LYS CA C 13 55.723 0.074 . 1 . . . . . 43 LYS CA . 27548 1 115 . 1 1 37 37 LYS CB C 13 28.914 0.000 . 1 . . . . . 43 LYS CB . 27548 1 116 . 1 1 37 37 LYS N N 15 117.901 0.000 . 1 . . . . . 43 LYS N . 27548 1 117 . 1 1 38 38 LYS H H 1 7.099 0.000 . 1 . . . . . 44 LYS HN . 27548 1 118 . 1 1 38 38 LYS CA C 13 53.421 0.000 . 1 . . . . . 44 LYS CA . 27548 1 119 . 1 1 38 38 LYS CB C 13 29.360 0.075 . 1 . . . . . 44 LYS CB . 27548 1 120 . 1 1 38 38 LYS N N 15 115.470 0.000 . 1 . . . . . 44 LYS N . 27548 1 121 . 1 1 39 39 LYS H H 1 7.637 0.000 . 1 . . . . . 45 LYS HN . 27548 1 122 . 1 1 39 39 LYS CA C 13 51.601 0.037 . 1 . . . . . 45 LYS CA . 27548 1 123 . 1 1 39 39 LYS CB C 13 29.767 0.111 . 1 . . . . . 45 LYS CB . 27548 1 124 . 1 1 39 39 LYS N N 15 122.015 0.000 . 1 . . . . . 45 LYS N . 27548 1 125 . 1 1 40 40 LYS H H 1 8.368 0.000 . 1 . . . . . 46 LYS HN . 27548 1 126 . 1 1 40 40 LYS CA C 13 55.092 0.037 . 1 . . . . . 46 LYS CA . 27548 1 127 . 1 1 40 40 LYS CB C 13 28.394 0.000 . 1 . . . . . 46 LYS CB . 27548 1 128 . 1 1 40 40 LYS N N 15 126.911 0.000 . 1 . . . . . 46 LYS N . 27548 1 129 . 1 1 41 41 GLY H H 1 9.035 0.000 . 1 . . . . . 47 GLY HN . 27548 1 130 . 1 1 41 41 GLY CA C 13 42.801 0.000 . 1 . . . . . 47 GLY CA . 27548 1 131 . 1 1 41 41 GLY N N 15 115.958 0.000 . 1 . . . . . 47 GLY N . 27548 1 132 . 1 1 42 42 ALA H H 1 7.566 0.000 . 1 . . . . . 48 ALA HN . 27548 1 133 . 1 1 42 42 ALA CA C 13 52.418 0.037 . 1 . . . . . 48 ALA CA . 27548 1 134 . 1 1 42 42 ALA CB C 13 17.032 0.000 . 1 . . . . . 48 ALA CB . 27548 1 135 . 1 1 42 42 ALA N N 15 125.469 0.000 . 1 . . . . . 48 ALA N . 27548 1 136 . 1 1 43 43 MET H H 1 8.679 0.000 . 1 . . . . . 49 MET HN . 27548 1 137 . 1 1 43 43 MET CA C 13 54.535 0.000 . 1 . . . . . 49 MET CA . 27548 1 138 . 1 1 43 43 MET CB C 13 27.614 0.037 . 1 . . . . . 49 MET CB . 27548 1 139 . 1 1 43 43 MET N N 15 117.521 0.000 . 1 . . . . . 49 MET N . 27548 1 140 . 1 1 44 44 GLU H H 1 8.875 0.000 . 1 . . . . . 50 GLU HN . 27548 1 141 . 1 1 44 44 GLU CA C 13 57.431 0.000 . 1 . . . . . 50 GLU CA . 27548 1 142 . 1 1 44 44 GLU CB C 13 24.755 0.000 . 1 . . . . . 50 GLU CB . 27548 1 143 . 1 1 44 44 GLU N N 15 119.989 0.000 . 1 . . . . . 50 GLU N . 27548 1 144 . 1 1 47 47 GLU CA C 13 57.208 0.000 . 1 . . . . . 53 GLU CA . 27548 1 145 . 1 1 47 47 GLU CB C 13 25.869 0.000 . 1 . . . . . 53 GLU CB . 27548 1 146 . 1 1 48 48 LYS H H 1 7.567 0.000 . 1 . . . . . 54 LYS HN . 27548 1 147 . 1 1 48 48 LYS CA C 13 56.503 0.037 . 1 . . . . . 54 LYS CA . 27548 1 148 . 1 1 48 48 LYS CB C 13 28.282 0.186 . 1 . . . . . 54 LYS CB . 27548 1 149 . 1 1 48 48 LYS N N 15 121.699 0.000 . 1 . . . . . 54 LYS N . 27548 1 150 . 1 1 49 49 ALA H H 1 7.689 0.000 . 1 . . . . . 55 ALA HN . 27548 1 151 . 1 1 49 49 ALA CA C 13 51.193 0.000 . 1 . . . . . 55 ALA CA . 27548 1 152 . 1 1 49 49 ALA CB C 13 14.197 0.062 . 1 . . . . . 55 ALA CB . 27548 1 153 . 1 1 49 49 ALA N N 15 122.589 0.000 . 1 . . . . . 55 ALA N . 27548 1 154 . 1 1 50 50 LEU H H 1 7.334 0.000 . 1 . . . . . 56 LEU HN . 27548 1 155 . 1 1 50 50 LEU CA C 13 52.641 0.037 . 1 . . . . . 56 LEU CA . 27548 1 156 . 1 1 50 50 LEU CB C 13 37.306 0.148 . 1 . . . . . 56 LEU CB . 27548 1 157 . 1 1 50 50 LEU N N 15 120.102 0.000 . 1 . . . . . 56 LEU N . 27548 1 158 . 1 1 51 51 SER H H 1 7.118 0.000 . 1 . . . . . 57 SER HN . 27548 1 159 . 1 1 51 51 SER CA C 13 55.871 0.074 . 1 . . . . . 57 SER CA . 27548 1 160 . 1 1 51 51 SER CB C 13 61.181 0.111 . 1 . . . . . 57 SER CB . 27548 1 161 . 1 1 51 51 SER N N 15 109.865 0.000 . 1 . . . . . 57 SER N . 27548 1 162 . 1 1 52 52 SER H H 1 6.905 0.000 . 1 . . . . . 58 SER HN . 27548 1 163 . 1 1 52 52 SER CA C 13 51.787 0.000 . 1 . . . . . 58 SER CA . 27548 1 164 . 1 1 52 52 SER CB C 13 59.882 0.000 . 1 . . . . . 58 SER CB . 27548 1 165 . 1 1 52 52 SER N N 15 116.464 0.000 . 1 . . . . . 58 SER N . 27548 1 166 . 1 1 53 53 PRO CA C 13 60.847 0.000 . 1 . . . . . 59 PRO CA . 27548 1 167 . 1 1 53 53 PRO CB C 13 28.171 0.000 . 1 . . . . . 59 PRO CB . 27548 1 168 . 1 1 54 54 GLY H H 1 8.165 0.000 . 1 . . . . . 60 GLY HN . 27548 1 169 . 1 1 54 54 GLY CA C 13 41.984 0.000 . 1 . . . . . 60 GLY CA . 27548 1 170 . 1 1 54 54 GLY N N 15 108.619 0.000 . 1 . . . . . 60 GLY N . 27548 1 171 . 1 1 55 55 GLN H H 1 7.244 0.000 . 1 . . . . . 61 GLN HN . 27548 1 172 . 1 1 55 55 GLN CA C 13 49.485 0.000 . 1 . . . . . 61 GLN CA . 27548 1 173 . 1 1 55 55 GLN CB C 13 25.720 0.000 . 1 . . . . . 61 GLN CB . 27548 1 174 . 1 1 55 55 GLN N N 15 120.245 0.000 . 1 . . . . . 61 GLN N . 27548 1 175 . 1 1 56 56 PRO CA C 13 60.402 0.000 . 1 . . . . . 62 PRO CA . 27548 1 176 . 1 1 56 56 PRO CB C 13 28.691 0.000 . 1 . . . . . 62 PRO CB . 27548 1 177 . 1 1 57 57 SER H H 1 8.243 0.000 . 1 . . . . . 63 SER HN . 27548 1 178 . 1 1 57 57 SER CA C 13 53.495 0.000 . 1 . . . . . 63 SER CA . 27548 1 179 . 1 1 57 57 SER CB C 13 61.961 0.074 . 1 . . . . . 63 SER CB . 27548 1 180 . 1 1 57 57 SER N N 15 115.723 0.000 . 1 . . . . . 63 SER N . 27548 1 181 . 1 1 58 58 LYS H H 1 9.045 0.000 . 1 . . . . . 64 LYS HN . 27548 1 182 . 1 1 58 58 LYS CA C 13 52.195 0.111 . 1 . . . . . 64 LYS CA . 27548 1 183 . 1 1 58 58 LYS CB C 13 30.437 0.186 . 1 . . . . . 64 LYS CB . 27548 1 184 . 1 1 58 58 LYS N N 15 123.258 0.000 . 1 . . . . . 64 LYS N . 27548 1 185 . 1 1 59 59 CYS H H 1 7.986 0.000 . 1 . . . . . 65 CYS HN . 27548 1 186 . 1 1 59 59 CYS CA C 13 59.770 0.037 . 1 . . . . . 65 CYS CA . 27548 1 187 . 1 1 59 59 CYS CB C 13 28.245 0.000 . 1 . . . . . 65 CYS CB . 27548 1 188 . 1 1 59 59 CYS N N 15 117.246 0.000 . 1 . . . . . 65 CYS N . 27548 1 189 . 1 1 60 60 VAL H H 1 7.939 0.000 . 1 . . . . . 66 VAL HN . 27548 1 190 . 1 1 60 60 VAL CA C 13 58.842 0.223 . 1 . . . . . 66 VAL CA . 27548 1 191 . 1 1 60 60 VAL CB C 13 30.622 0.074 . 1 . . . . . 66 VAL CB . 27548 1 192 . 1 1 60 60 VAL N N 15 124.394 0.000 . 1 . . . . . 66 VAL N . 27548 1 193 . 1 1 61 61 THR H H 1 8.362 0.001 . 1 . . . . . 67 THR HN . 27548 1 194 . 1 1 61 61 THR CA C 13 55.945 0.075 . 1 . . . . . 67 THR CA . 27548 1 195 . 1 1 61 61 THR CB C 13 68.050 0.075 . 1 . . . . . 67 THR CB . 27548 1 196 . 1 1 61 61 THR N N 15 116.175 0.000 . 1 . . . . . 67 THR N . 27548 1 197 . 1 1 62 62 ILE H H 1 8.074 0.000 . 1 . . . . . 68 ILE HN . 27548 1 198 . 1 1 62 62 ILE CA C 13 55.129 0.000 . 1 . . . . . 68 ILE CA . 27548 1 199 . 1 1 62 62 ILE CB C 13 36.266 0.000 . 1 . . . . . 68 ILE CB . 27548 1 200 . 1 1 62 62 ILE N N 15 111.593 0.000 . 1 . . . . . 68 ILE N . 27548 1 201 . 1 1 63 63 PRO CA C 13 59.139 0.000 . 1 . . . . . 69 PRO CA . 27548 1 202 . 1 1 63 63 PRO CB C 13 29.582 0.000 . 1 . . . . . 69 PRO CB . 27548 1 203 . 1 1 64 64 ARG H H 1 8.370 0.000 . 1 . . . . . 70 ARG HN . 27548 1 204 . 1 1 64 64 ARG CA C 13 53.198 0.149 . 1 . . . . . 70 ARG CA . 27548 1 205 . 1 1 64 64 ARG CB C 13 27.057 0.074 . 1 . . . . . 70 ARG CB . 27548 1 206 . 1 1 64 64 ARG N N 15 125.566 0.000 . 1 . . . . . 70 ARG N . 27548 1 207 . 1 1 65 65 SER H H 1 7.877 0.000 . 1 . . . . . 71 SER HN . 27548 1 208 . 1 1 65 65 SER CA C 13 52.678 0.000 . 1 . . . . . 71 SER CA . 27548 1 209 . 1 1 65 65 SER CB C 13 60.921 0.000 . 1 . . . . . 71 SER CB . 27548 1 210 . 1 1 65 65 SER N N 15 116.426 0.000 . 1 . . . . . 71 SER N . 27548 1 211 . 1 1 70 70 LEU CA C 13 50.153 0.000 . 1 . . . . . 76 LEU CA . 27548 1 212 . 1 1 70 70 LEU CB C 13 42.801 0.000 . 1 . . . . . 76 LEU CB . 27548 1 213 . 1 1 71 71 GLN H H 1 8.922 0.000 . 1 . . . . . 77 GLN HN . 27548 1 214 . 1 1 71 71 GLN CA C 13 49.708 0.000 . 1 . . . . . 77 GLN CA . 27548 1 215 . 1 1 71 71 GLN CB C 13 32.478 0.000 . 1 . . . . . 77 GLN CB . 27548 1 216 . 1 1 71 71 GLN N N 15 121.230 0.000 . 1 . . . . . 77 GLN N . 27548 1 217 . 1 1 74 74 HIS CA C 13 52.530 0.000 . 1 . . . . . 80 HIS CA . 27548 1 218 . 1 1 74 74 HIS CB C 13 30.102 0.000 . 1 . . . . . 80 HIS CB . 27548 1 219 . 1 1 75 75 ARG H H 1 8.025 0.000 . 1 . . . . . 81 ARG HN . 27548 1 220 . 1 1 75 75 ARG CA C 13 53.644 0.000 . 1 . . . . . 81 ARG CA . 27548 1 221 . 1 1 75 75 ARG CB C 13 25.646 0.074 . 1 . . . . . 81 ARG CB . 27548 1 222 . 1 1 75 75 ARG N N 15 122.051 0.000 . 1 . . . . . 81 ARG N . 27548 1 223 . 1 1 76 76 LYS H H 1 8.101 0.000 . 1 . . . . . 82 LYS HN . 27548 1 224 . 1 1 76 76 LYS CA C 13 53.495 0.000 . 1 . . . . . 82 LYS CA . 27548 1 225 . 1 1 76 76 LYS CB C 13 25.832 0.112 . 1 . . . . . 82 LYS CB . 27548 1 226 . 1 1 76 76 LYS N N 15 121.079 0.000 . 1 . . . . . 82 LYS N . 27548 1 227 . 1 1 77 77 GLY H H 1 8.356 0.000 . 1 . . . . . 83 GLY HN . 27548 1 228 . 1 1 77 77 GLY CA C 13 41.895 0.000 . 1 . . . . . 83 GLY CA . 27548 1 229 . 1 1 77 77 GLY N N 15 112.091 0.000 . 1 . . . . . 83 GLY N . 27548 1 230 . 1 1 78 78 LEU H H 1 7.885 0.000 . 1 . . . . . 84 LEU HN . 27548 1 231 . 1 1 78 78 LEU CA C 13 49.856 0.000 . 1 . . . . . 84 LEU CA . 27548 1 232 . 1 1 78 78 LEU CB C 13 38.197 0.000 . 1 . . . . . 84 LEU CB . 27548 1 233 . 1 1 78 78 LEU N N 15 123.105 0.000 . 1 . . . . . 84 LEU N . 27548 1 234 . 1 1 79 79 PRO CA C 13 60.253 0.000 . 1 . . . . . 85 PRO CA . 27548 1 235 . 1 1 79 79 PRO CB C 13 28.468 0.000 . 1 . . . . . 85 PRO CB . 27548 1 236 . 1 1 80 80 HIS H H 1 8.021 0.000 . 1 . . . . . 86 HIS HN . 27548 1 237 . 1 1 80 80 HIS CA C 13 53.346 0.000 . 1 . . . . . 86 HIS CA . 27548 1 238 . 1 1 80 80 HIS CB C 13 27.800 0.000 . 1 . . . . . 86 HIS CB . 27548 1 239 . 1 1 80 80 HIS N N 15 122.687 0.000 . 1 . . . . . 86 HIS N . 27548 1 240 . 1 1 90 90 PRO CA C 13 61.813 0.000 . 1 . . . . . 96 PRO CA . 27548 1 241 . 1 1 90 90 PRO CB C 13 28.840 0.000 . 1 . . . . . 96 PRO CB . 27548 1 242 . 1 1 91 91 ASP H H 1 8.357 0.000 . 1 . . . . . 97 ASP HN . 27548 1 243 . 1 1 91 91 ASP CA C 13 49.708 0.075 . 1 . . . . . 97 ASP CA . 27548 1 244 . 1 1 91 91 ASP CB C 13 36.785 0.075 . 1 . . . . . 97 ASP CB . 27548 1 245 . 1 1 91 91 ASP N N 15 112.677 0.000 . 1 . . . . . 97 ASP N . 27548 1 246 . 1 1 92 92 LEU H H 1 7.431 0.000 . 1 . . . . . 98 LEU HN . 27548 1 247 . 1 1 92 92 LEU CA C 13 53.569 0.000 . 1 . . . . . 98 LEU CA . 27548 1 248 . 1 1 92 92 LEU CB C 13 40.000 0.000 . 1 . . . . . 98 LEU CB . 27548 1 249 . 1 1 92 92 LEU N N 15 123.803 0.000 . 1 . . . . . 98 LEU N . 27548 1 250 . 1 1 93 93 GLN CA C 13 53.866 0.000 . 1 . . . . . 99 GLN CA . 27548 1 251 . 1 1 93 93 GLN CB C 13 28.023 0.000 . 1 . . . . . 99 GLN CB . 27548 1 252 . 1 1 94 94 SER H H 1 7.893 0.000 . 1 . . . . . 100 SER HN . 27548 1 253 . 1 1 94 94 SER CA C 13 54.015 0.000 . 1 . . . . . 100 SER CA . 27548 1 254 . 1 1 94 94 SER CB C 13 62.629 0.000 . 1 . . . . . 100 SER CB . 27548 1 255 . 1 1 94 94 SER N N 15 112.137 0.000 . 1 . . . . . 100 SER N . 27548 1 256 . 1 1 96 96 HIS CA C 13 57.505 0.000 . 1 . . . . . 102 HIS CA . 27548 1 257 . 1 1 96 96 HIS CB C 13 24.829 0.000 . 1 . . . . . 102 HIS CB . 27548 1 258 . 1 1 97 97 GLU H H 1 7.721 0.000 . 1 . . . . . 103 GLU HN . 27548 1 259 . 1 1 97 97 GLU CA C 13 55.389 0.037 . 1 . . . . . 103 GLU CA . 27548 1 260 . 1 1 97 97 GLU CB C 13 25.201 0.000 . 1 . . . . . 103 GLU CB . 27548 1 261 . 1 1 97 97 GLU N N 15 121.778 0.000 . 1 . . . . . 103 GLU N . 27548 1 262 . 1 1 98 98 LEU H H 1 7.845 0.000 . 1 . . . . . 104 LEU HN . 27548 1 263 . 1 1 98 98 LEU CA C 13 54.015 0.000 . 1 . . . . . 104 LEU CA . 27548 1 264 . 1 1 98 98 LEU CB C 13 42.900 7.860 . 1 . . . . . 104 LEU CB . 27548 1 265 . 1 1 98 98 LEU N N 15 120.274 0.000 . 1 . . . . . 104 LEU N . 27548 1 266 . 1 1 99 99 LYS H H 1 7.999 0.000 . 1 . . . . . 105 LYS HN . 27548 1 267 . 1 1 99 99 LYS CA C 13 57.357 0.000 . 1 . . . . . 105 LYS CA . 27548 1 268 . 1 1 99 99 LYS CB C 13 25.869 0.000 . 1 . . . . . 105 LYS CB . 27548 1 269 . 1 1 99 99 LYS N N 15 117.246 0.000 . 1 . . . . . 105 LYS N . 27548 1 270 . 1 1 101 101 LEU CA C 13 51.341 0.000 . 1 . . . . . 107 LEU CA . 27548 1 271 . 1 1 101 101 LEU CB C 13 39.459 0.000 . 1 . . . . . 107 LEU CB . 27548 1 272 . 1 1 102 102 ASP H H 1 8.403 0.000 . 1 . . . . . 108 ASP HN . 27548 1 273 . 1 1 102 102 ASP CA C 13 53.718 0.074 . 1 . . . . . 108 ASP CA . 27548 1 274 . 1 1 102 102 ASP CB C 13 36.674 0.037 . 1 . . . . . 108 ASP CB . 27548 1 275 . 1 1 102 102 ASP N N 15 122.153 0.000 . 1 . . . . . 108 ASP N . 27548 1 276 . 1 1 103 103 ILE H H 1 6.579 0.000 . 1 . . . . . 109 ILE HN . 27548 1 277 . 1 1 103 103 ILE CA C 13 57.802 0.000 . 1 . . . . . 109 ILE CA . 27548 1 278 . 1 1 103 103 ILE CB C 13 34.781 0.000 . 1 . . . . . 109 ILE CB . 27548 1 279 . 1 1 103 103 ILE N N 15 109.734 0.000 . 1 . . . . . 109 ILE N . 27548 1 280 . 1 1 104 104 CYS H H 1 6.923 0.000 . 1 . . . . . 110 CYS HN . 27548 1 281 . 1 1 104 104 CYS CA C 13 59.213 0.000 . 1 . . . . . 110 CYS CA . 27548 1 282 . 1 1 104 104 CYS CB C 13 26.945 0.186 . 1 . . . . . 110 CYS CB . 27548 1 283 . 1 1 104 104 CYS N N 15 125.181 0.000 . 1 . . . . . 110 CYS N . 27548 1 284 . 1 1 105 105 GLU H H 1 7.416 0.000 . 1 . . . . . 111 GLU HN . 27548 1 285 . 1 1 105 105 GLU CA C 13 54.015 0.074 . 1 . . . . . 111 GLU CA . 27548 1 286 . 1 1 105 105 GLU CB C 13 27.986 0.038 . 1 . . . . . 111 GLU CB . 27548 1 287 . 1 1 105 105 GLU N N 15 131.879 0.000 . 1 . . . . . 111 GLU N . 27548 1 288 . 1 1 106 106 PHE H H 1 8.241 0.000 . 1 . . . . . 112 PHE HN . 27548 1 289 . 1 1 106 106 PHE CA C 13 51.787 0.000 . 1 . . . . . 112 PHE CA . 27548 1 290 . 1 1 106 106 PHE CB C 13 37.380 0.000 . 1 . . . . . 112 PHE CB . 27548 1 291 . 1 1 106 106 PHE N N 15 119.004 0.000 . 1 . . . . . 112 PHE N . 27548 1 292 . 1 1 107 107 PRO CA C 13 64.483 0.000 . 1 . . . . . 113 PRO CA . 27548 1 293 . 1 1 107 107 PRO CB C 13 26.686 0.000 . 1 . . . . . 113 PRO CB . 27548 1 294 . 1 1 108 108 PHE H H 1 8.336 0.000 . 1 . . . . . 114 PHE HN . 27548 1 295 . 1 1 108 108 PHE CA C 13 51.639 0.148 . 1 . . . . . 114 PHE CA . 27548 1 296 . 1 1 108 108 PHE CB C 13 38.011 0.037 . 1 . . . . . 114 PHE CB . 27548 1 297 . 1 1 108 108 PHE N N 15 120.996 0.000 . 1 . . . . . 114 PHE N . 27548 1 298 . 1 1 109 109 GLY H H 1 7.982 0.000 . 1 . . . . . 115 GLY HN . 27548 1 299 . 1 1 109 109 GLY CA C 13 42.207 0.000 . 1 . . . . . 115 GLY CA . 27548 1 300 . 1 1 109 109 GLY N N 15 121.230 0.000 . 1 . . . . . 115 GLY N . 27548 1 301 . 1 1 110 110 SER H H 1 7.705 0.000 . 1 . . . . . 116 SER HN . 27548 1 302 . 1 1 110 110 SER CA C 13 56.094 0.000 . 1 . . . . . 116 SER CA . 27548 1 303 . 1 1 110 110 SER CB C 13 61.293 0.000 . 1 . . . . . 116 SER CB . 27548 1 304 . 1 1 110 110 SER N N 15 115.958 0.000 . 1 . . . . . 116 SER N . 27548 1 305 . 1 1 113 113 LYS CA C 13 55.277 0.000 . 1 . . . . . 119 LYS CA . 27548 1 306 . 1 1 113 113 LYS CB C 13 29.211 0.000 . 1 . . . . . 119 LYS CB . 27548 1 307 . 1 1 114 114 GLU H H 1 7.230 0.000 . 1 . . . . . 120 GLU HN . 27548 1 308 . 1 1 114 114 GLU CA C 13 54.113 0.590 . 1 . . . . . 120 GLU CA . 27548 1 309 . 1 1 114 114 GLU CB C 13 28.988 0.000 . 1 . . . . . 120 GLU CB . 27548 1 310 . 1 1 114 114 GLU N N 15 117.598 0.000 . 1 . . . . . 120 GLU N . 27548 1 311 . 1 1 115 115 VAL H H 1 9.023 0.000 . 1 . . . . . 121 VAL HN . 27548 1 312 . 1 1 115 115 VAL CA C 13 56.614 0.223 . 1 . . . . . 121 VAL CA . 27548 1 313 . 1 1 115 115 VAL CB C 13 32.441 0.037 . 1 . . . . . 121 VAL CB . 27548 1 314 . 1 1 115 115 VAL N N 15 119.444 0.000 . 1 . . . . . 121 VAL N . 27548 1 315 . 1 1 116 116 CYS H H 1 8.949 0.000 . 1 . . . . . 122 CYS HN . 27548 1 316 . 1 1 116 116 CYS CA C 13 57.097 0.037 . 1 . . . . . 122 CYS CA . 27548 1 317 . 1 1 116 116 CYS CB C 13 27.577 0.074 . 1 . . . . . 122 CYS CB . 27548 1 318 . 1 1 116 116 CYS N N 15 128.738 0.000 . 1 . . . . . 122 CYS N . 27548 1 319 . 1 1 117 117 ILE H H 1 8.938 0.000 . 1 . . . . . 123 ILE HN . 27548 1 320 . 1 1 117 117 ILE CA C 13 55.166 0.111 . 1 . . . . . 123 ILE CA . 27548 1 321 . 1 1 117 117 ILE CB C 13 34.298 0.037 . 1 . . . . . 123 ILE CB . 27548 1 322 . 1 1 117 117 ILE N N 15 120.644 0.000 . 1 . . . . . 123 ILE N . 27548 1 323 . 1 1 118 118 ASN H H 1 8.622 0.000 . 1 . . . . . 124 ASN HN . 27548 1 324 . 1 1 118 118 ASN CA C 13 48.222 0.000 . 1 . . . . . 124 ASN CA . 27548 1 325 . 1 1 118 118 ASN CB C 13 35.300 0.000 . 1 . . . . . 124 ASN CB . 27548 1 326 . 1 1 118 118 ASN N N 15 121.335 0.000 . 1 . . . . . 124 ASN N . 27548 1 327 . 1 1 120 120 TYR CB C 13 41.093 0.000 . 1 . . . . . 126 TYR CB . 27548 1 328 . 1 1 121 121 HIS H H 1 9.387 0.000 . 1 . . . . . 127 HIS HN . 27548 1 329 . 1 1 121 121 HIS CA C 13 53.606 0.111 . 1 . . . . . 127 HIS CA . 27548 1 330 . 1 1 121 121 HIS CB C 13 28.320 0.149 . 1 . . . . . 127 HIS CB . 27548 1 331 . 1 1 121 121 HIS N N 15 125.566 0.000 . 1 . . . . . 127 HIS N . 27548 1 332 . 1 1 122 122 TYR H H 1 6.977 0.000 . 1 . . . . . 128 TYR HN . 27548 1 333 . 1 1 122 122 TYR CA C 13 53.941 0.074 . 1 . . . . . 128 TYR CA . 27548 1 334 . 1 1 122 122 TYR CB C 13 39.756 0.000 . 1 . . . . . 128 TYR CB . 27548 1 335 . 1 1 122 122 TYR N N 15 114.903 0.000 . 1 . . . . . 128 TYR N . 27548 1 336 . 1 1 123 123 LYS H H 1 9.334 0.000 . 1 . . . . . 129 LYS HN . 27548 1 337 . 1 1 123 123 LYS CA C 13 50.970 0.000 . 1 . . . . . 129 LYS CA . 27548 1 338 . 1 1 123 123 LYS CB C 13 32.367 0.111 . 1 . . . . . 129 LYS CB . 27548 1 339 . 1 1 123 123 LYS N N 15 119.004 0.000 . 1 . . . . . 129 LYS N . 27548 1 340 . 1 1 124 124 ARG H H 1 7.855 0.000 . 1 . . . . . 130 ARG HN . 27548 1 341 . 1 1 124 124 ARG CA C 13 51.490 0.000 . 1 . . . . . 130 ARG CA . 27548 1 342 . 1 1 124 124 ARG CB C 13 26.352 0.037 . 1 . . . . . 130 ARG CB . 27548 1 343 . 1 1 124 124 ARG N N 15 123.691 0.000 . 1 . . . . . 130 ARG N . 27548 1 344 . 1 1 125 125 VAL H H 1 8.443 0.000 . 1 . . . . . 131 VAL HN . 27548 1 345 . 1 1 125 125 VAL CA C 13 57.617 0.038 . 1 . . . . . 131 VAL CA . 27548 1 346 . 1 1 125 125 VAL CB C 13 30.548 0.075 . 1 . . . . . 131 VAL CB . 27548 1 347 . 1 1 125 125 VAL N N 15 124.507 0.000 . 1 . . . . . 131 VAL N . 27548 1 348 . 1 1 126 126 GLU H H 1 8.234 0.000 . 1 . . . . . 132 GLU HN . 27548 1 349 . 1 1 126 126 GLU CA C 13 53.272 0.000 . 1 . . . . . 132 GLU CA . 27548 1 350 . 1 1 126 126 GLU CB C 13 26.983 0.074 . 1 . . . . . 132 GLU CB . 27548 1 351 . 1 1 126 126 GLU N N 15 123.578 0.000 . 1 . . . . . 132 GLU N . 27548 1 352 . 1 1 127 127 SER H H 1 8.288 0.000 . 1 . . . . . 133 SER HN . 27548 1 353 . 1 1 127 127 SER CA C 13 52.752 0.000 . 1 . . . . . 133 SER CA . 27548 1 354 . 1 1 127 127 SER CB C 13 60.179 0.000 . 1 . . . . . 133 SER CB . 27548 1 355 . 1 1 127 127 SER N N 15 118.613 0.000 . 1 . . . . . 133 SER N . 27548 1 356 . 1 1 128 128 PRO CA C 13 60.030 0.000 . 1 . . . . . 134 PRO CA . 27548 1 357 . 1 1 129 129 VAL H H 1 7.996 0.000 . 1 . . . . . 135 VAL HN . 27548 1 358 . 1 1 129 129 VAL CA C 13 59.325 0.037 . 1 . . . . . 135 VAL CA . 27548 1 359 . 1 1 129 129 VAL CB C 13 28.840 0.000 . 1 . . . . . 135 VAL CB . 27548 1 360 . 1 1 129 129 VAL N N 15 121.481 0.000 . 1 . . . . . 135 VAL N . 27548 1 361 . 1 1 130 130 LEU H H 1 8.117 0.000 . 1 . . . . . 136 LEU HN . 27548 1 362 . 1 1 130 130 LEU CA C 13 49.633 0.000 . 1 . . . . . 136 LEU CA . 27548 1 363 . 1 1 130 130 LEU CB C 13 37.900 0.000 . 1 . . . . . 136 LEU CB . 27548 1 364 . 1 1 130 130 LEU N N 15 128.962 0.000 . 1 . . . . . 136 LEU N . 27548 1 stop_ save_