################################### # 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 27517 _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 '3D HNCACB' . . . 27517 1 2 '3D CBCA(CO)NH' . . . 27517 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 $NMRView . . 27517 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 ALA H H 1 8.371 . . . . . . . . 3 ALA HN . 27517 1 2 . 1 . 1 5 5 ALA CA C 13 52.675 . . . . . . . . 3 ALA CA . 27517 1 3 . 1 . 1 5 5 ALA CB C 13 19.233 . . . . . . . . 3 ALA CB . 27517 1 4 . 1 . 1 5 5 ALA N N 15 125.566 . . . . . . . . 3 ALA N . 27517 1 5 . 1 . 1 6 6 SER H H 1 8.258 . . . . . . . . 4 SER HN . 27517 1 6 . 1 . 1 6 6 SER CA C 13 58.572 . . . . . . . . 4 SER CA . 27517 1 7 . 1 . 1 6 6 SER CB C 13 64.021 . . . . . . . . 4 SER CB . 27517 1 8 . 1 . 1 6 6 SER N N 15 114.868 . . . . . . . . 4 SER N . 27517 1 9 . 1 . 1 7 7 GLY H H 1 8.381 . . . . . . . . 5 GLY HN . 27517 1 10 . 1 . 1 7 7 GLY CA C 13 45.509 . . . . . . . . 5 GLY CA . 27517 1 11 . 1 . 1 7 7 GLY N N 15 110.508 . . . . . . . . 5 GLY N . 27517 1 12 . 1 . 1 8 8 LEU H H 1 7.942 . . . . . . . . 6 LEU HN . 27517 1 13 . 1 . 1 8 8 LEU CA C 13 55.288 . . . . . . . . 6 LEU CA . 27517 1 14 . 1 . 1 8 8 LEU CB C 13 42.382 . . . . . . . . 6 LEU CB . 27517 1 15 . 1 . 1 8 8 LEU N N 15 121.266 . . . . . . . . 6 LEU N . 27517 1 16 . 1 . 1 9 9 PHE H H 1 8.165 . . . . . . . . 7 PHE HN . 27517 1 17 . 1 . 1 9 9 PHE CA C 13 57.825 . . . . . . . . 7 PHE CA . 27517 1 18 . 1 . 1 9 9 PHE CB C 13 39.462 . . . . . . . . 7 PHE CB . 27517 1 19 . 1 . 1 9 9 PHE N N 15 120.552 . . . . . . . . 7 PHE N . 27517 1 20 . 1 . 1 10 10 ARG H H 1 8.025 . . . . . . . . 8 ARG HN . 27517 1 21 . 1 . 1 10 10 ARG CA C 13 55.661 . . . . . . . . 8 ARG CA . 27517 1 22 . 1 . 1 10 10 ARG CB C 13 31.027 . . . . . . . . 8 ARG CB . 27517 1 23 . 1 . 1 10 10 ARG N N 15 123.044 . . . . . . . . 8 ARG N . 27517 1 24 . 1 . 1 11 11 ALA H H 1 8.191 . . . . . . . . 9 ALA HN . 27517 1 25 . 1 . 1 11 11 ALA CA C 13 52.227 . . . . . . . . 9 ALA CA . 27517 1 26 . 1 . 1 11 11 ALA CB C 13 19.233 . . . . . . . . 9 ALA CB . 27517 1 27 . 1 . 1 11 11 ALA N N 15 125.480 . . . . . . . . 9 ALA N . 27517 1 28 . 1 . 1 12 12 LEU H H 1 8.117 . . . . . . . . 10 LEU HN . 27517 1 29 . 1 . 1 12 12 LEU CA C 13 52.973 . . . . . . . . 10 LEU CA . 27517 1 30 . 1 . 1 12 12 LEU CB C 13 41.776 . . . . . . . . 10 LEU CB . 27517 1 31 . 1 . 1 12 12 LEU N N 15 122.733 . . . . . . . . 10 LEU N . 27517 1 32 . 1 . 1 13 13 PRO CA C 13 63.051 . . . . . . . . 11 PRO CA . 27517 1 33 . 1 . 1 13 13 PRO CB C 13 31.920 . . . . . . . . 11 PRO CB . 27517 1 34 . 1 . 1 14 14 VAL H H 1 8.137 . . . . . . . . 12 VAL HN . 27517 1 35 . 1 . 1 14 14 VAL CA C 13 62.230 . . . . . . . . 12 VAL CA . 27517 1 36 . 1 . 1 14 14 VAL CB C 13 32.893 . . . . . . . . 12 VAL CB . 27517 1 37 . 1 . 1 14 14 VAL N N 15 119.679 . . . . . . . . 12 VAL N . 27517 1 38 . 1 . 1 15 15 SER H H 1 8.304 . . . . . . . . 13 SER HN . 27517 1 39 . 1 . 1 15 15 SER CA C 13 58.273 . . . . . . . . 13 SER CA . 27517 1 40 . 1 . 1 15 15 SER CB C 13 64.021 . . . . . . . . 13 SER CB . 27517 1 41 . 1 . 1 15 15 SER N N 15 119.217 . . . . . . . . 13 SER N . 27517 1 42 . 1 . 1 16 16 ALA H H 1 8.325 . . . . . . . . 14 ALA HN . 27517 1 43 . 1 . 1 16 16 ALA CA C 13 50.510 . . . . . . . . 14 ALA CA . 27517 1 44 . 1 . 1 16 16 ALA CB C 13 18.411 . . . . . . . . 14 ALA CB . 27517 1 45 . 1 . 1 16 16 ALA N N 15 127.067 . . . . . . . . 14 ALA N . 27517 1 46 . 1 . 1 17 17 PRO CA C 13 63.797 . . . . . . . . 15 PRO CA . 27517 1 47 . 1 . 1 17 17 PRO CB C 13 31.923 . . . . . . . . 15 PRO CB . 27517 1 48 . 1 . 1 18 18 GLU H H 1 8.689 . . . . . . . . 16 GLU HN . 27517 1 49 . 1 . 1 18 18 GLU CA C 13 57.303 . . . . . . . . 16 GLU CA . 27517 1 50 . 1 . 1 18 18 GLU CB C 13 29.758 . . . . . . . . 16 GLU CB . 27517 1 51 . 1 . 1 18 18 GLU N N 15 119.403 . . . . . . . . 16 GLU N . 27517 1 52 . 1 . 1 19 19 ASP H H 1 8.151 . . . . . . . . 17 ASP HN . 27517 1 53 . 1 . 1 19 19 ASP CA C 13 54.541 . . . . . . . . 17 ASP CA . 27517 1 54 . 1 . 1 19 19 ASP CB C 13 40.955 . . . . . . . . 17 ASP CB . 27517 1 55 . 1 . 1 19 19 ASP N N 15 120.346 . . . . . . . . 17 ASP N . 27517 1 56 . 1 . 1 20 20 LEU H H 1 7.884 . . . . . . . . 18 LEU HN . 27517 1 57 . 1 . 1 20 20 LEU CA C 13 55.288 . . . . . . . . 18 LEU CA . 27517 1 58 . 1 . 1 20 20 LEU CB C 13 42.421 . . . . . . . . 18 LEU CB . 27517 1 59 . 1 . 1 20 20 LEU N N 15 121.596 . . . . . . . . 18 LEU N . 27517 1 60 . 1 . 1 21 21 LEU H H 1 8.133 . . . . . . . . 19 LEU HN . 27517 1 61 . 1 . 1 21 21 LEU CA C 13 55.287 . . . . . . . . 19 LEU CA . 27517 1 62 . 1 . 1 21 21 LEU CB C 13 42.149 . . . . . . . . 19 LEU CB . 27517 1 63 . 1 . 1 21 21 LEU N N 15 123.194 . . . . . . . . 19 LEU N . 27517 1 64 . 1 . 1 22 22 VAL H H 1 8.011 . . . . . . . . 20 VAL HN . 27517 1 65 . 1 . 1 22 22 VAL CA C 13 62.437 . . . . . . . . 20 VAL CA . 27517 1 66 . 1 . 1 22 22 VAL CB C 13 32.799 . . . . . . . . 20 VAL CB . 27517 1 67 . 1 . 1 22 22 VAL N N 15 121.417 . . . . . . . . 20 VAL N . 27517 1 68 . 1 . 1 23 23 GLU H H 1 8.439 . . . . . . . . 21 GLU HN . 27517 1 69 . 1 . 1 23 23 GLU CA C 13 56.855 . . . . . . . . 21 GLU CA . 27517 1 70 . 1 . 1 23 23 GLU CB C 13 30.579 . . . . . . . . 21 GLU CB . 27517 1 71 . 1 . 1 23 23 GLU N N 15 124.513 . . . . . . . . 21 GLU N . 27517 1 72 . 1 . 1 24 24 GLU H H 1 8.364 . . . . . . . . 22 GLU HN . 27517 1 73 . 1 . 1 24 24 GLU CA C 13 56.640 . . . . . . . . 22 GLU CA . 27517 1 74 . 1 . 1 24 24 GLU CB C 13 30.403 . . . . . . . . 22 GLU CB . 27517 1 75 . 1 . 1 24 24 GLU N N 15 122.019 . . . . . . . . 22 GLU N . 27517 1 76 . 1 . 1 25 25 LEU H H 1 8.252 . . . . . . . . 23 LEU HN . 27517 1 77 . 1 . 1 25 25 LEU CA C 13 55.138 . . . . . . . . 23 LEU CA . 27517 1 78 . 1 . 1 25 25 LEU CB C 13 42.224 . . . . . . . . 23 LEU CB . 27517 1 79 . 1 . 1 25 25 LEU N N 15 123.828 . . . . . . . . 23 LEU N . 27517 1 80 . 1 . 1 26 26 VAL H H 1 8.122 . . . . . . . . 24 VAL HN . 27517 1 81 . 1 . 1 26 26 VAL CA C 13 62.398 . . . . . . . . 24 VAL CA . 27517 1 82 . 1 . 1 26 26 VAL CB C 13 32.760 . . . . . . . . 24 VAL CB . 27517 1 83 . 1 . 1 26 26 VAL N N 15 121.354 . . . . . . . . 24 VAL N . 27517 1 84 . 1 . 1 27 27 ASP H H 1 8.376 . . . . . . . . 25 ASP HN . 27517 1 85 . 1 . 1 27 27 ASP CA C 13 54.690 . . . . . . . . 25 ASP CA . 27517 1 86 . 1 . 1 27 27 ASP CB C 13 41.254 . . . . . . . . 25 ASP CB . 27517 1 87 . 1 . 1 27 27 ASP N N 15 123.832 . . . . . . . . 25 ASP N . 27517 1 88 . 1 . 1 28 28 GLY H H 1 8.285 . . . . . . . . 26 GLY HN . 27517 1 89 . 1 . 1 28 28 GLY CA C 13 45.658 . . . . . . . . 26 GLY CA . 27517 1 90 . 1 . 1 28 28 GLY N N 15 109.312 . . . . . . . . 26 GLY N . 27517 1 91 . 1 . 1 29 29 LEU H H 1 8.054 . . . . . . . . 27 LEU HN . 27517 1 92 . 1 . 1 29 29 LEU CA C 13 55.481 . . . . . . . . 27 LEU CA . 27517 1 93 . 1 . 1 29 29 LEU CB C 13 42.266 . . . . . . . . 27 LEU CB . 27517 1 94 . 1 . 1 29 29 LEU N N 15 121.400 . . . . . . . . 27 LEU N . 27517 1 95 . 1 . 1 30 30 LEU H H 1 8.147 . . . . . . . . 28 LEU HN . 27517 1 96 . 1 . 1 30 30 LEU CA C 13 55.362 . . . . . . . . 28 LEU CA . 27517 1 97 . 1 . 1 30 30 LEU CB C 13 42.373 . . . . . . . . 28 LEU CB . 27517 1 98 . 1 . 1 30 30 LEU N N 15 122.486 . . . . . . . . 28 LEU N . 27517 1 99 . 1 . 1 31 31 SER H H 1 8.252 . . . . . . . . 29 SER HN . 27517 1 100 . 1 . 1 31 31 SER CA C 13 58.272 . . . . . . . . 29 SER CA . 27517 1 101 . 1 . 1 31 31 SER CB C 13 63.750 . . . . . . . . 29 SER CB . 27517 1 102 . 1 . 1 31 31 SER N N 15 116.761 . . . . . . . . 29 SER N . 27517 1 103 . 1 . 1 32 32 LEU H H 1 8.271 . . . . . . . . 30 LEU HN . 27517 1 104 . 1 . 1 32 32 LEU CA C 13 55.586 . . . . . . . . 30 LEU CA . 27517 1 105 . 1 . 1 32 32 LEU CB C 13 42.373 . . . . . . . . 30 LEU CB . 27517 1 106 . 1 . 1 32 32 LEU N N 15 124.454 . . . . . . . . 30 LEU N . 27517 1 107 . 1 . 1 33 33 GLU H H 1 8.335 . . . . . . . . 31 GLU HN . 27517 1 108 . 1 . 1 33 33 GLU CA C 13 57.218 . . . . . . . . 31 GLU CA . 27517 1 109 . 1 . 1 33 33 GLU CB C 13 30.126 . . . . . . . . 31 GLU CB . 27517 1 110 . 1 . 1 33 33 GLU N N 15 120.848 . . . . . . . . 31 GLU N . 27517 1 111 . 1 . 1 34 34 GLU H H 1 8.438 . . . . . . . . 32 GLU HN . 27517 1 112 . 1 . 1 34 34 GLU CA C 13 56.988 . . . . . . . . 32 GLU CA . 27517 1 113 . 1 . 1 34 34 GLU CB C 13 30.210 . . . . . . . . 32 GLU CB . 27517 1 114 . 1 . 1 34 34 GLU N N 15 121.973 . . . . . . . . 32 GLU N . 27517 1 115 . 1 . 1 35 35 GLU H H 1 8.345 . . . . . . . . 33 GLU HN . 27517 1 116 . 1 . 1 35 35 GLU CA C 13 57.066 . . . . . . . . 33 GLU CA . 27517 1 117 . 1 . 1 35 35 GLU CB C 13 30.326 . . . . . . . . 33 GLU CB . 27517 1 118 . 1 . 1 35 35 GLU N N 15 121.708 . . . . . . . . 33 GLU N . 27517 1 119 . 1 . 1 36 36 LEU H H 1 8.211 . . . . . . . . 34 LEU HN . 27517 1 120 . 1 . 1 36 36 LEU CA C 13 55.437 . . . . . . . . 34 LEU CA . 27517 1 121 . 1 . 1 36 36 LEU CB C 13 42.075 . . . . . . . . 34 LEU CB . 27517 1 122 . 1 . 1 36 36 LEU N N 15 122.883 . . . . . . . . 34 LEU N . 27517 1 123 . 1 . 1 37 37 LYS H H 1 8.118 . . . . . . . . 35 LYS HN . 27517 1 124 . 1 . 1 37 37 LYS CA C 13 56.602 . . . . . . . . 35 LYS CA . 27517 1 125 . 1 . 1 37 37 LYS CB C 13 33.108 . . . . . . . . 35 LYS CB . 27517 1 126 . 1 . 1 37 37 LYS N N 15 122.090 . . . . . . . . 35 LYS N . 27517 1 127 . 1 . 1 38 38 ASP H H 1 8.307 . . . . . . . . 36 ASP HN . 27517 1 128 . 1 . 1 38 38 ASP CA C 13 54.631 . . . . . . . . 36 ASP CA . 27517 1 129 . 1 . 1 38 38 ASP CB C 13 41.068 . . . . . . . . 36 ASP CB . 27517 1 130 . 1 . 1 38 38 ASP N N 15 121.114 . . . . . . . . 36 ASP N . 27517 1 131 . 1 . 1 39 39 LYS H H 1 8.184 . . . . . . . . 37 LYS HN . 27517 1 132 . 1 . 1 39 39 LYS CA C 13 56.563 . . . . . . . . 37 LYS CA . 27517 1 133 . 1 . 1 39 39 LYS CB C 13 32.953 . . . . . . . . 37 LYS CB . 27517 1 134 . 1 . 1 39 39 LYS N N 15 121.308 . . . . . . . . 37 LYS N . 27517 1 135 . 1 . 1 40 40 GLU H H 1 8.427 . . . . . . . . 38 GLU HN . 27517 1 136 . 1 . 1 40 40 GLU CA C 13 56.988 . . . . . . . . 38 GLU CA . 27517 1 137 . 1 . 1 40 40 GLU CB C 13 30.094 . . . . . . . . 38 GLU CB . 27517 1 138 . 1 . 1 40 40 GLU N N 15 122.218 . . . . . . . . 38 GLU N . 27517 1 139 . 1 . 1 41 41 GLU H H 1 8.379 . . . . . . . . 39 GLU HN . 27517 1 140 . 1 . 1 41 41 GLU CA C 13 57.027 . . . . . . . . 39 GLU CA . 27517 1 141 . 1 . 1 41 41 GLU CB C 13 30.171 . . . . . . . . 39 GLU CB . 27517 1 142 . 1 . 1 41 41 GLU N N 15 122.218 . . . . . . . . 39 GLU N . 27517 1 143 . 1 . 1 42 42 GLU H H 1 8.401 . . . . . . . . 40 GLU HN . 27517 1 144 . 1 . 1 42 42 GLU CA C 13 56.988 . . . . . . . . 40 GLU CA . 27517 1 145 . 1 . 1 42 42 GLU CB C 13 30.364 . . . . . . . . 40 GLU CB . 27517 1 146 . 1 . 1 42 42 GLU N N 15 121.753 . . . . . . . . 40 GLU N . 27517 1 147 . 1 . 1 43 43 LYS H H 1 8.235 . . . . . . . . 41 LYS HN . 27517 1 148 . 1 . 1 43 43 LYS CA C 13 56.706 . . . . . . . . 41 LYS CA . 27517 1 149 . 1 . 1 43 43 LYS CB C 13 32.968 . . . . . . . . 41 LYS CB . 27517 1 150 . 1 . 1 43 43 LYS N N 15 122.598 . . . . . . . . 41 LYS N . 27517 1 151 . 1 . 1 44 44 ALA H H 1 8.239 . . . . . . . . 42 ALA HN . 27517 1 152 . 1 . 1 44 44 ALA CA C 13 52.899 . . . . . . . . 42 ALA CA . 27517 1 153 . 1 . 1 44 44 ALA CB C 13 19.009 . . . . . . . . 42 ALA CB . 27517 1 154 . 1 . 1 44 44 ALA N N 15 124.807 . . . . . . . . 42 ALA N . 27517 1 155 . 1 . 1 45 45 VAL H H 1 8.060 . . . . . . . . 43 VAL HN . 27517 1 156 . 1 . 1 45 45 VAL CA C 13 62.827 . . . . . . . . 43 VAL CA . 27517 1 157 . 1 . 1 45 45 VAL CB C 13 32.595 . . . . . . . . 43 VAL CB . 27517 1 158 . 1 . 1 45 45 VAL N N 15 119.756 . . . . . . . . 43 VAL N . 27517 1 159 . 1 . 1 46 46 LEU H H 1 8.239 . . . . . . . . 44 LEU HN . 27517 1 160 . 1 . 1 46 46 LEU CA C 13 55.437 . . . . . . . . 44 LEU CA . 27517 1 161 . 1 . 1 46 46 LEU CB C 13 42.149 . . . . . . . . 44 LEU CB . 27517 1 162 . 1 . 1 46 46 LEU N N 15 125.460 . . . . . . . . 44 LEU N . 27517 1 163 . 1 . 1 47 47 ASP H H 1 8.252 . . . . . . . . 45 ASP HN . 27517 1 164 . 1 . 1 47 47 ASP CA C 13 54.914 . . . . . . . . 45 ASP CA . 27517 1 165 . 1 . 1 47 47 ASP CB C 13 41.179 . . . . . . . . 45 ASP CB . 27517 1 166 . 1 . 1 47 47 ASP N N 15 120.927 . . . . . . . . 45 ASP N . 27517 1 167 . 1 . 1 48 48 GLY H H 1 8.249 . . . . . . . . 46 GLY HN . 27517 1 168 . 1 . 1 48 48 GLY CA C 13 45.733 . . . . . . . . 46 GLY CA . 27517 1 169 . 1 . 1 48 48 GLY N N 15 108.942 . . . . . . . . 46 GLY N . 27517 1 170 . 1 . 1 49 49 LEU H H 1 8.018 . . . . . . . . 47 LEU HN . 27517 1 171 . 1 . 1 49 49 LEU CA C 13 55.558 . . . . . . . . 47 LEU CA . 27517 1 172 . 1 . 1 49 49 LEU CB C 13 42.189 . . . . . . . . 47 LEU CB . 27517 1 173 . 1 . 1 49 49 LEU N N 15 121.420 . . . . . . . . 47 LEU N . 27517 1 174 . 1 . 1 50 50 LEU H H 1 8.123 . . . . . . . . 48 LEU HN . 27517 1 175 . 1 . 1 50 50 LEU CA C 13 55.398 . . . . . . . . 48 LEU CA . 27517 1 176 . 1 . 1 50 50 LEU CB C 13 42.368 . . . . . . . . 48 LEU CB . 27517 1 177 . 1 . 1 50 50 LEU N N 15 122.233 . . . . . . . . 48 LEU N . 27517 1 178 . 1 . 1 51 51 SER H H 1 8.219 . . . . . . . . 49 SER HN . 27517 1 179 . 1 . 1 51 51 SER CA C 13 58.273 . . . . . . . . 49 SER CA . 27517 1 180 . 1 . 1 51 51 SER CB C 13 63.797 . . . . . . . . 49 SER CB . 27517 1 181 . 1 . 1 51 51 SER N N 15 116.548 . . . . . . . . 49 SER N . 27517 1 182 . 1 . 1 52 52 LEU H H 1 8.250 . . . . . . . . 50 LEU HN . 27517 1 183 . 1 . 1 52 52 LEU CA C 13 55.536 . . . . . . . . 50 LEU CA . 27517 1 184 . 1 . 1 52 52 LEU CB C 13 42.277 . . . . . . . . 50 LEU CB . 27517 1 185 . 1 . 1 52 52 LEU N N 15 123.704 . . . . . . . . 50 LEU N . 27517 1 186 . 1 . 1 53 53 GLU H H 1 8.329 . . . . . . . . 51 GLU HN . 27517 1 187 . 1 . 1 53 53 GLU CA C 13 57.025 . . . . . . . . 51 GLU CA . 27517 1 188 . 1 . 1 53 53 GLU CB C 13 30.118 . . . . . . . . 51 GLU CB . 27517 1 189 . 1 . 1 53 53 GLU N N 15 121.149 . . . . . . . . 51 GLU N . 27517 1 190 . 1 . 1 54 54 GLU H H 1 8.280 . . . . . . . . 52 GLU HN . 27517 1 191 . 1 . 1 54 54 GLU CA C 13 57.104 . . . . . . . . 52 GLU CA . 27517 1 192 . 1 . 1 54 54 GLU CB C 13 30.326 . . . . . . . . 52 GLU CB . 27517 1 193 . 1 . 1 54 54 GLU N N 15 121.342 . . . . . . . . 52 GLU N . 27517 1 194 . 1 . 1 55 55 GLU H H 1 8.333 . . . . . . . . 53 GLU HN . 27517 1 195 . 1 . 1 55 55 GLU CA C 13 56.950 . . . . . . . . 53 GLU CA . 27517 1 196 . 1 . 1 55 55 GLU CB C 13 30.364 . . . . . . . . 53 GLU CB . 27517 1 197 . 1 . 1 55 55 GLU N N 15 121.588 . . . . . . . . 53 GLU N . 27517 1 198 . 1 . 1 56 56 SER H H 1 8.317 . . . . . . . . 54 SER HN . 27517 1 199 . 1 . 1 56 56 SER CA C 13 58.497 . . . . . . . . 54 SER CA . 27517 1 200 . 1 . 1 56 56 SER CB C 13 63.648 . . . . . . . . 54 SER CB . 27517 1 201 . 1 . 1 56 56 SER N N 15 116.735 . . . . . . . . 54 SER N . 27517 1 202 . 1 . 1 57 57 ARG H H 1 8.322 . . . . . . . . 55 ARG HN . 27517 1 203 . 1 . 1 57 57 ARG CA C 13 56.109 . . . . . . . . 55 ARG CA . 27517 1 204 . 1 . 1 57 57 ARG CB C 13 30.952 . . . . . . . . 55 ARG CB . 27517 1 205 . 1 . 1 57 57 ARG N N 15 123.704 . . . . . . . . 55 ARG N . 27517 1 206 . 1 . 1 58 58 GLY H H 1 8.010 . . . . . . . . 56 GLY HN . 27517 1 207 . 1 . 1 58 58 GLY CA C 13 46.180 . . . . . . . . 56 GLY CA . 27517 1 208 . 1 . 1 58 58 GLY N N 15 115.920 . . . . . . . . 56 GLY N . 27517 1 stop_ save_