################################### # 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 19343 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19343 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY offset' 'amide protons' . . . 19343 1 'TROSY offset' 'amide nitrogens' . . . 19343 1 '2H isotope effect' 'all 13C' . . . 19343 1 '2H isotope effect' 'all 15N' . . . 19343 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.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 ALA H H 1 8.45 0.02 . 1 . . . A 1 ALA H1 . 19343 1 2 . 1 1 1 1 ALA C C 13 178.366 0.3 . 1 . . . A 1 ALA C . 19343 1 3 . 1 1 1 1 ALA CA C 13 52.732 0.3 . 1 . . . A 1 ALA CA . 19343 1 4 . 1 1 1 1 ALA CB C 13 18.62 0.3 . 1 . . . A 1 ALA CB . 19343 1 5 . 1 1 1 1 ALA N N 15 125.12 0.3 . 1 . . . A 1 ALA N . 19343 1 6 . 1 1 2 2 SER H H 1 8.331 0.02 . 1 . . . A 2 SER H . 19343 1 7 . 1 1 2 2 SER C C 13 175.434 0.3 . 1 . . . A 2 SER C . 19343 1 8 . 1 1 2 2 SER CA C 13 58.61 0.3 . 1 . . . A 2 SER CA . 19343 1 9 . 1 1 2 2 SER CB C 13 63.837 0.3 . 1 . . . A 2 SER CB . 19343 1 10 . 1 1 2 2 SER N N 15 114.852 0.3 . 1 . . . A 2 SER N . 19343 1 11 . 1 1 3 3 GLU H H 1 8.593 0.02 . 1 . . . A 3 GLU H . 19343 1 12 . 1 1 3 3 GLU C C 13 177.0 0.3 . 1 . . . A 3 GLU C . 19343 1 13 . 1 1 3 3 GLU CA C 13 56.833 0.3 . 1 . . . A 3 GLU CA . 19343 1 14 . 1 1 3 3 GLU CB C 13 29.05 0.3 . 1 . . . A 3 GLU CB . 19343 1 15 . 1 1 3 3 GLU N N 15 122.794 0.3 . 1 . . . A 3 GLU N . 19343 1 16 . 1 1 4 4 ASP H H 1 8.366 0.02 . 1 . . . A 4 ASP H . 19343 1 17 . 1 1 4 4 ASP C C 13 177.663 0.3 . 1 . . . A 4 ASP C . 19343 1 18 . 1 1 4 4 ASP CA C 13 56.351 0.3 . 1 . . . A 4 ASP CA . 19343 1 19 . 1 1 4 4 ASP CB C 13 40.904 0.3 . 1 . . . A 4 ASP CB . 19343 1 20 . 1 1 4 4 ASP N N 15 120.891 0.3 . 1 . . . A 4 ASP N . 19343 1 21 . 1 1 5 5 GLY H H 1 8.55 0.02 . 1 . . . A 5 GLY H . 19343 1 22 . 1 1 5 5 GLY C C 13 175.521 0.3 . 1 . . . A 5 GLY C . 19343 1 23 . 1 1 5 5 GLY CA C 13 45.33 0.3 . 1 . . . A 5 GLY CA . 19343 1 24 . 1 1 5 5 GLY N N 15 110.851 0.3 . 1 . . . A 5 GLY N . 19343 1 25 . 1 1 6 6 GLY H H 1 8.449 0.02 . 1 . . . A 6 GLY H . 19343 1 26 . 1 1 6 6 GLY C C 13 173.807 0.3 . 1 . . . A 6 GLY C . 19343 1 27 . 1 1 6 6 GLY CA C 13 45.575 0.3 . 1 . . . A 6 GLY CA . 19343 1 28 . 1 1 6 6 GLY N N 15 109.418 0.3 . 1 . . . A 6 GLY N . 19343 1 29 . 1 1 7 7 ARG H H 1 7.581 0.02 . 1 . . . A 7 ARG H . 19343 1 30 . 1 1 7 7 ARG C C 13 177.151 0.3 . 1 . . . A 7 ARG C . 19343 1 31 . 1 1 7 7 ARG CA C 13 55.066 0.3 . 1 . . . A 7 ARG CA . 19343 1 32 . 1 1 7 7 ARG CB C 13 31.412 0.3 . 1 . . . A 7 ARG CB . 19343 1 33 . 1 1 7 7 ARG N N 15 117.808 0.3 . 1 . . . A 7 ARG N . 19343 1 34 . 1 1 8 8 GLY H H 1 8.297 0.02 . 1 . . . A 8 GLY H . 19343 1 35 . 1 1 8 8 GLY CA C 13 44.677 0.3 . 1 . . . A 8 GLY CA . 19343 1 36 . 1 1 8 8 GLY N N 15 109.915 0.3 . 1 . . . A 8 GLY N . 19343 1 37 . 1 1 9 9 PRO C C 13 175.944 0.3 . 1 . . . A 9 PRO C . 19343 1 38 . 1 1 9 9 PRO CA C 13 62.38 0.3 . 1 . . . A 9 PRO CA . 19343 1 39 . 1 1 9 9 PRO CB C 13 32.521 0.3 . 1 . . . A 9 PRO CB . 19343 1 40 . 1 1 10 10 TYR H H 1 8.847 0.02 . 1 . . . A 10 TYR H . 19343 1 41 . 1 1 10 10 TYR C C 13 173.151 0.3 . 1 . . . A 10 TYR C . 19343 1 42 . 1 1 10 10 TYR CA C 13 56.647 0.3 . 1 . . . A 10 TYR CA . 19343 1 43 . 1 1 10 10 TYR CB C 13 41.002 0.3 . 1 . . . A 10 TYR CB . 19343 1 44 . 1 1 10 10 TYR N N 15 115.969 0.3 . 1 . . . A 10 TYR N . 19343 1 45 . 1 1 11 11 VAL H H 1 8.882 0.02 . 1 . . . A 11 VAL H . 19343 1 46 . 1 1 11 11 VAL C C 13 174.053 0.3 . 1 . . . A 11 VAL C . 19343 1 47 . 1 1 11 11 VAL CA C 13 59.14 0.3 . 1 . . . A 11 VAL CA . 19343 1 48 . 1 1 11 11 VAL CB C 13 34.77 0.3 . 1 . . . A 11 VAL CB . 19343 1 49 . 1 1 11 11 VAL N N 15 114.755 0.3 . 1 . . . A 11 VAL N . 19343 1 50 . 1 1 12 12 GLN H H 1 9.252 0.02 . 1 . . . A 12 GLN H . 19343 1 51 . 1 1 12 12 GLN C C 13 174.087 0.3 . 1 . . . A 12 GLN C . 19343 1 52 . 1 1 12 12 GLN CA C 13 54.194 0.3 . 1 . . . A 12 GLN CA . 19343 1 53 . 1 1 12 12 GLN CB C 13 31.644 0.3 . 1 . . . A 12 GLN CB . 19343 1 54 . 1 1 12 12 GLN N N 15 126.391 0.3 . 1 . . . A 12 GLN N . 19343 1 55 . 1 1 13 13 ALA H H 1 8.692 0.02 . 1 . . . A 13 ALA H . 19343 1 56 . 1 1 13 13 ALA C C 13 174.387 0.3 . 1 . . . A 13 ALA C . 19343 1 57 . 1 1 13 13 ALA CA C 13 50.805 0.3 . 1 . . . A 13 ALA CA . 19343 1 58 . 1 1 13 13 ALA CB C 13 20.76 0.3 . 1 . . . A 13 ALA CB . 19343 1 59 . 1 1 13 13 ALA N N 15 127.788 0.3 . 1 . . . A 13 ALA N . 19343 1 60 . 1 1 14 14 ASP H H 1 9.041 0.02 . 1 . . . A 14 ASP H . 19343 1 61 . 1 1 14 14 ASP C C 13 176.1 0.3 . 1 . . . A 14 ASP C . 19343 1 62 . 1 1 14 14 ASP CA C 13 52.875 0.3 . 1 . . . A 14 ASP CA . 19343 1 63 . 1 1 14 14 ASP CB C 13 45.821 0.3 . 1 . . . A 14 ASP CB . 19343 1 64 . 1 1 14 14 ASP N N 15 118.37 0.3 . 1 . . . A 14 ASP N . 19343 1 65 . 1 1 29 29 PRO C C 13 177.686 0.3 . 1 . . . A 29 PRO C . 19343 1 66 . 1 1 29 29 PRO CA C 13 63.798 0.3 . 1 . . . A 29 PRO CA . 19343 1 67 . 1 1 29 29 PRO CB C 13 28.501 0.02 . 1 . . . A 29 PRO CB . 19343 1 68 . 1 1 30 30 THR H H 1 8.25 0.02 . 1 . . . A 30 THR H . 19343 1 69 . 1 1 30 30 THR C C 13 174.747 0.3 . 1 . . . A 30 THR C . 19343 1 70 . 1 1 30 30 THR CA C 13 61.999 0.3 . 1 . . . A 30 THR CA . 19343 1 71 . 1 1 30 30 THR CB C 13 69.429 0.3 . 1 . . . A 30 THR CB . 19343 1 72 . 1 1 30 30 THR N N 15 114.503 0.3 . 1 . . . A 30 THR N . 19343 1 73 . 1 1 31 31 ALA H H 1 8.313 0.02 . 1 . . . A 31 ALA H . 19343 1 74 . 1 1 31 31 ALA C C 13 176.44 0.3 . 1 . . . A 31 ALA C . 19343 1 75 . 1 1 31 31 ALA CA C 13 50.66 0.3 . 1 . . . A 31 ALA CA . 19343 1 76 . 1 1 31 31 ALA CB C 13 17.524 0.3 . 1 . . . A 31 ALA CB . 19343 1 77 . 1 1 31 31 ALA N N 15 127.406 0.3 . 1 . . . A 31 ALA N . 19343 1 78 . 1 1 51 51 SER H H 1 8.2 0.02 . 1 . . . A 51 SER H . 19343 1 79 . 1 1 51 51 SER C C 13 174.792 0.3 . 1 . . . A 51 SER C . 19343 1 80 . 1 1 51 51 SER CA C 13 61.751 0.3 . 1 . . . A 51 SER CA . 19343 1 81 . 1 1 51 51 SER CB C 13 69.538 0.3 . 1 . . . A 51 SER CB . 19343 1 82 . 1 1 51 51 SER N N 15 113.737 0.3 . 1 . . . A 51 SER N . 19343 1 83 . 1 1 52 52 VAL H H 1 8.226 0.02 . 1 . . . A 52 VAL H . 19343 1 84 . 1 1 52 52 VAL C C 13 175.153 0.3 . 1 . . . A 52 VAL C . 19343 1 85 . 1 1 52 52 VAL CA C 13 59.798 0.3 . 1 . . . A 52 VAL CA . 19343 1 86 . 1 1 52 52 VAL CB C 13 31.878 0.3 . 1 . . . A 52 VAL CB . 19343 1 87 . 1 1 52 52 VAL N N 15 123.687 0.3 . 1 . . . A 52 VAL N . 19343 1 88 . 1 1 57 57 SER H H 1 9.29 0.02 . 1 . . . A 57 SER H . 19343 1 89 . 1 1 57 57 SER C C 13 173.257 0.3 . 1 . . . A 57 SER C . 19343 1 90 . 1 1 57 57 SER CA C 13 57.391 0.3 . 1 . . . A 57 SER CA . 19343 1 91 . 1 1 57 57 SER CB C 13 66.123 0.3 . 1 . . . A 57 SER CB . 19343 1 92 . 1 1 57 57 SER N N 15 117.736 0.3 . 1 . . . A 57 SER N . 19343 1 93 . 1 1 58 58 VAL H H 1 8.892 0.02 . 1 . . . A 58 VAL H . 19343 1 94 . 1 1 58 58 VAL C C 13 174.287 0.3 . 1 . . . A 58 VAL C . 19343 1 95 . 1 1 58 58 VAL CA C 13 60.05 0.3 . 1 . . . A 58 VAL CA . 19343 1 96 . 1 1 58 58 VAL CB C 13 33.997 0.3 . 1 . . . A 58 VAL CB . 19343 1 97 . 1 1 58 58 VAL N N 15 120.059 0.3 . 1 . . . A 58 VAL N . 19343 1 98 . 1 1 59 59 GLY H H 1 8.165 0.02 . 1 . . . A 59 GLY H . 19343 1 99 . 1 1 59 59 GLY C C 13 171.019 0.3 . 1 . . . A 59 GLY C . 19343 1 100 . 1 1 59 59 GLY CA C 13 45.571 0.3 . 1 . . . A 59 GLY CA . 19343 1 101 . 1 1 59 59 GLY N N 15 111.967 0.3 . 1 . . . A 59 GLY N . 19343 1 102 . 1 1 60 60 TYR H H 1 9.124 0.02 . 1 . . . A 60 TYR H . 19343 1 103 . 1 1 60 60 TYR C C 13 173.063 0.3 . 1 . . . A 60 TYR C . 19343 1 104 . 1 1 60 60 TYR CA C 13 58.122 0.3 . 1 . . . A 60 TYR CA . 19343 1 105 . 1 1 60 60 TYR CB C 13 42.79 0.3 . 1 . . . A 60 TYR CB . 19343 1 106 . 1 1 60 60 TYR N N 15 119.581 0.3 . 1 . . . A 60 TYR N . 19343 1 107 . 1 1 61 61 ASP H H 1 8.173 0.02 . 1 . . . A 61 ASP H . 19343 1 108 . 1 1 61 61 ASP C C 13 175.411 0.3 . 1 . . . A 61 ASP C . 19343 1 109 . 1 1 61 61 ASP CA C 13 52.492 0.3 . 1 . . . A 61 ASP CA . 19343 1 110 . 1 1 61 61 ASP CB C 13 41.851 0.3 . 1 . . . A 61 ASP CB . 19343 1 111 . 1 1 61 61 ASP N N 15 127.261 0.3 . 1 . . . A 61 ASP N . 19343 1 112 . 1 1 62 62 PHE H H 1 9.084 0.02 . 1 . . . A 62 PHE H . 19343 1 113 . 1 1 62 62 PHE C C 13 176.679 0.3 . 1 . . . A 62 PHE C . 19343 1 114 . 1 1 62 62 PHE CA C 13 59.644 0.3 . 1 . . . A 62 PHE CA . 19343 1 115 . 1 1 62 62 PHE CB C 13 38.241 0.3 . 1 . . . A 62 PHE CB . 19343 1 116 . 1 1 62 62 PHE N N 15 122.821 0.3 . 1 . . . A 62 PHE N . 19343 1 117 . 1 1 63 63 GLY H H 1 9.6 0.02 . 1 . . . A 63 GLY H . 19343 1 118 . 1 1 63 63 GLY C C 13 174.776 0.3 . 1 . . . A 63 GLY C . 19343 1 119 . 1 1 63 63 GLY CA C 13 46.663 0.3 . 1 . . . A 63 GLY CA . 19343 1 120 . 1 1 63 63 GLY N N 15 113.407 0.3 . 1 . . . A 63 GLY N . 19343 1 121 . 1 1 64 64 GLY H H 1 8.986 0.02 . 1 . . . A 64 GLY H . 19343 1 122 . 1 1 64 64 GLY C C 13 172.481 0.3 . 1 . . . A 64 GLY C . 19343 1 123 . 1 1 64 64 GLY CA C 13 45.674 0.3 . 1 . . . A 64 GLY CA . 19343 1 124 . 1 1 64 64 GLY N N 15 114.349 0.3 . 1 . . . A 64 GLY N . 19343 1 125 . 1 1 65 65 TRP H H 1 7.569 0.02 . 1 . . . A 65 TRP H . 19343 1 126 . 1 1 65 65 TRP C C 13 175.076 0.3 . 1 . . . A 65 TRP C . 19343 1 127 . 1 1 65 65 TRP CA C 13 55.987 0.3 . 1 . . . A 65 TRP CA . 19343 1 128 . 1 1 65 65 TRP CB C 13 30.499 0.3 . 1 . . . A 65 TRP CB . 19343 1 129 . 1 1 65 65 TRP N N 15 116.89 0.3 . 1 . . . A 65 TRP N . 19343 1 130 . 1 1 66 66 ARG H H 1 9.936 0.02 . 1 . . . A 66 ARG H . 19343 1 131 . 1 1 66 66 ARG C C 13 175.595 0.3 . 1 . . . A 66 ARG C . 19343 1 132 . 1 1 66 66 ARG CA C 13 55.166 0.3 . 1 . . . A 66 ARG CA . 19343 1 133 . 1 1 66 66 ARG CB C 13 34.96 0.3 . 1 . . . A 66 ARG CB . 19343 1 134 . 1 1 66 66 ARG N N 15 119.274 0.3 . 1 . . . A 66 ARG N . 19343 1 135 . 1 1 67 67 ILE H H 1 8.47 0.02 . 1 . . . A 67 ILE H . 19343 1 136 . 1 1 67 67 ILE C C 13 175.118 0.3 . 1 . . . A 67 ILE C . 19343 1 137 . 1 1 67 67 ILE CA C 13 58.77 0.3 . 1 . . . A 67 ILE CA . 19343 1 138 . 1 1 67 67 ILE CB C 13 40.542 0.3 . 1 . . . A 67 ILE CB . 19343 1 139 . 1 1 67 67 ILE N N 15 118.386 0.3 . 1 . . . A 67 ILE N . 19343 1 140 . 1 1 68 68 ALA H H 1 8.66 0.02 . 1 . . . A 68 ALA H . 19343 1 141 . 1 1 68 68 ALA C C 13 177.247 0.3 . 1 . . . A 68 ALA C . 19343 1 142 . 1 1 68 68 ALA CA C 13 51.727 0.3 . 1 . . . A 68 ALA CA . 19343 1 143 . 1 1 68 68 ALA CB C 13 22.036 0.3 . 1 . . . A 68 ALA CB . 19343 1 144 . 1 1 68 68 ALA N N 15 124.102 0.3 . 1 . . . A 68 ALA N . 19343 1 145 . 1 1 69 69 ALA H H 1 9.572 0.02 . 1 . . . A 69 ALA H . 19343 1 146 . 1 1 69 69 ALA C C 13 176.223 0.3 . 1 . . . A 69 ALA C . 19343 1 147 . 1 1 69 69 ALA CA C 13 49.95 0.3 . 1 . . . A 69 ALA CA . 19343 1 148 . 1 1 69 69 ALA CB C 13 20.171 0.3 . 1 . . . A 69 ALA CB . 19343 1 149 . 1 1 69 69 ALA N N 15 128.725 0.3 . 1 . . . A 69 ALA N . 19343 1 150 . 1 1 70 70 ASP H H 1 9.475 0.02 . 1 . . . A 70 ASP H . 19343 1 151 . 1 1 70 70 ASP C C 13 174.034 0.3 . 1 . . . A 70 ASP C . 19343 1 152 . 1 1 70 70 ASP CA C 13 52.369 0.3 . 1 . . . A 70 ASP CA . 19343 1 153 . 1 1 70 70 ASP CB C 13 45.779 0.3 . 1 . . . A 70 ASP CB . 19343 1 154 . 1 1 70 70 ASP N N 15 118.233 0.3 . 1 . . . A 70 ASP N . 19343 1 155 . 1 1 71 71 TYR H H 1 9.243 0.02 . 1 . . . A 71 TYR H . 19343 1 156 . 1 1 71 71 TYR C C 13 173.769 0.3 . 1 . . . A 71 TYR C . 19343 1 157 . 1 1 71 71 TYR CA C 13 57.126 0.3 . 1 . . . A 71 TYR CA . 19343 1 158 . 1 1 71 71 TYR N N 15 118.228 0.3 . 1 . . . A 71 TYR N . 19343 1 159 . 1 1 95 95 ASN H H 1 8.393 0.02 . 1 . . . A 95 ASN H . 19343 1 160 . 1 1 95 95 ASN C C 13 177.514 0.3 . 1 . . . A 95 ASN C . 19343 1 161 . 1 1 95 95 ASN CA C 13 54.591 0.3 . 1 . . . A 95 ASN CA . 19343 1 162 . 1 1 95 95 ASN CB C 13 40.573 0.3 . 1 . . . A 95 ASN CB . 19343 1 163 . 1 1 95 95 ASN N N 15 119.591 0.3 . 1 . . . A 95 ASN N . 19343 1 164 . 1 1 96 96 GLY H H 1 8.34 0.02 . 1 . . . A 96 GLY H . 19343 1 165 . 1 1 96 96 GLY C C 13 174.697 0.3 . 1 . . . A 96 GLY C . 19343 1 166 . 1 1 96 96 GLY CA C 13 45.615 0.3 . 1 . . . A 96 GLY CA . 19343 1 167 . 1 1 96 96 GLY N N 15 109.334 0.3 . 1 . . . A 96 GLY N . 19343 1 168 . 1 1 97 97 ILE H H 1 8.003 0.02 . 1 . . . A 97 ILE H . 19343 1 169 . 1 1 97 97 ILE CA C 13 61.288 0.3 . 1 . . . A 97 ILE CA . 19343 1 170 . 1 1 97 97 ILE N N 15 119.953 0.3 . 1 . . . A 97 ILE N . 19343 1 171 . 1 1 109 109 GLY H H 1 8.315 0.02 . 1 . . . A 109 GLY H . 19343 1 172 . 1 1 109 109 GLY C C 13 174.875 0.3 . 1 . . . A 109 GLY C . 19343 1 173 . 1 1 109 109 GLY CA C 13 45.433 0.3 . 1 . . . A 109 GLY CA . 19343 1 174 . 1 1 109 109 GLY N N 15 114.84 0.3 . 1 . . . A 109 GLY N . 19343 1 175 . 1 1 110 110 THR H H 1 8.282 0.02 . 1 . . . A 110 THR H . 19343 1 176 . 1 1 110 110 THR C C 13 175.334 0.3 . 1 . . . A 110 THR C . 19343 1 177 . 1 1 110 110 THR CA C 13 58.642 0.3 . 1 . . . A 110 THR CA . 19343 1 178 . 1 1 110 110 THR CB C 13 63.947 0.3 . 1 . . . A 110 THR CB . 19343 1 179 . 1 1 110 110 THR N N 15 115.92 0.3 . 1 . . . A 110 THR N . 19343 1 180 . 1 1 118 118 GLY H H 1 9.424 0.02 . 1 . . . A 118 GLY H . 19343 1 181 . 1 1 118 118 GLY C C 13 171.826 0.3 . 1 . . . A 118 GLY C . 19343 1 182 . 1 1 118 118 GLY CA C 13 44.29 0.3 . 1 . . . A 118 GLY CA . 19343 1 183 . 1 1 118 118 GLY N N 15 115.009 0.3 . 1 . . . A 118 GLY N . 19343 1 184 . 1 1 119 119 LEU H H 1 9.181 0.02 . 1 . . . A 119 LEU H . 19343 1 185 . 1 1 119 119 LEU C C 13 175.499 0.3 . 1 . . . A 119 LEU C . 19343 1 186 . 1 1 119 119 LEU CA C 13 54.018 0.3 . 1 . . . A 119 LEU CA . 19343 1 187 . 1 1 119 119 LEU CB C 13 45.572 0.3 . 1 . . . A 119 LEU CB . 19343 1 188 . 1 1 119 119 LEU N N 15 119.633 0.3 . 1 . . . A 119 LEU N . 19343 1 189 . 1 1 120 120 SER H H 1 9.152 0.02 . 1 . . . A 120 SER H . 19343 1 190 . 1 1 120 120 SER C C 13 173.046 0.3 . 1 . . . A 120 SER C . 19343 1 191 . 1 1 120 120 SER CA C 13 57.454 0.3 . 1 . . . A 120 SER CA . 19343 1 192 . 1 1 120 120 SER CB C 13 65.655 0.3 . 1 . . . A 120 SER CB . 19343 1 193 . 1 1 120 120 SER N N 15 118.198 0.3 . 1 . . . A 120 SER N . 19343 1 194 . 1 1 121 121 ALA H H 1 8.726 0.02 . 1 . . . A 121 ALA H . 19343 1 195 . 1 1 121 121 ALA C C 13 176.277 0.3 . 1 . . . A 121 ALA C . 19343 1 196 . 1 1 121 121 ALA CA C 13 50.935 0.3 . 1 . . . A 121 ALA CA . 19343 1 197 . 1 1 121 121 ALA CB C 13 20.3 0.3 . 1 . . . A 121 ALA CB . 19343 1 198 . 1 1 121 121 ALA N N 15 125.527 0.3 . 1 . . . A 121 ALA N . 19343 1 199 . 1 1 122 122 ILE H H 1 9.499 0.02 . 1 . . . A 122 ILE H . 19343 1 200 . 1 1 122 122 ILE C C 13 173.875 0.3 . 1 . . . A 122 ILE C . 19343 1 201 . 1 1 122 122 ILE CA C 13 61.257 0.3 . 1 . . . A 122 ILE CA . 19343 1 202 . 1 1 122 122 ILE CB C 13 41.973 0.3 . 1 . . . A 122 ILE CB . 19343 1 203 . 1 1 122 122 ILE N N 15 121.964 0.3 . 1 . . . A 122 ILE N . 19343 1 204 . 1 1 123 123 TYR H H 1 9.576 0.02 . 1 . . . A 123 TYR H . 19343 1 205 . 1 1 123 123 TYR C C 13 174.052 0.3 . 1 . . . A 123 TYR C . 19343 1 206 . 1 1 123 123 TYR CA C 13 57.492 0.3 . 1 . . . A 123 TYR CA . 19343 1 207 . 1 1 123 123 TYR CB C 13 41.416 0.3 . 1 . . . A 123 TYR CB . 19343 1 208 . 1 1 123 123 TYR N N 15 128.727 0.3 . 1 . . . A 123 TYR N . 19343 1 209 . 1 1 124 124 ASP H H 1 7.767 0.02 . 1 . . . A 124 ASP H . 19343 1 210 . 1 1 124 124 ASP C C 13 175.217 0.3 . 1 . . . A 124 ASP C . 19343 1 211 . 1 1 124 124 ASP CA C 13 53.534 0.3 . 1 . . . A 124 ASP CA . 19343 1 212 . 1 1 124 124 ASP CB C 13 43.131 0.3 . 1 . . . A 124 ASP CB . 19343 1 213 . 1 1 124 124 ASP N N 15 125.662 0.3 . 1 . . . A 124 ASP N . 19343 1 214 . 1 1 125 125 PHE H H 1 9.213 0.02 . 1 . . . A 125 PHE H . 19343 1 215 . 1 1 125 125 PHE C C 13 176.347 0.3 . 1 . . . A 125 PHE C . 19343 1 216 . 1 1 125 125 PHE CA C 13 57.665 0.3 . 1 . . . A 125 PHE CA . 19343 1 217 . 1 1 125 125 PHE CB C 13 39.719 0.3 . 1 . . . A 125 PHE CB . 19343 1 218 . 1 1 125 125 PHE N N 15 121.435 0.3 . 1 . . . A 125 PHE N . 19343 1 219 . 1 1 126 126 GLN H H 1 8.929 0.02 . 1 . . . A 126 GLN H . 19343 1 220 . 1 1 126 126 GLN C C 13 176.717 0.3 . 1 . . . A 126 GLN C . 19343 1 221 . 1 1 126 126 GLN CA C 13 55.054 0.3 . 1 . . . A 126 GLN CA . 19343 1 222 . 1 1 126 126 GLN CB C 13 27.334 0.3 . 1 . . . A 126 GLN CB . 19343 1 223 . 1 1 126 126 GLN N N 15 122.72 0.3 . 1 . . . A 126 GLN N . 19343 1 224 . 1 1 127 127 ILE H H 1 8.267 0.02 . 1 . . . A 127 ILE H . 19343 1 225 . 1 1 127 127 ILE C C 13 175.87 0.3 . 1 . . . A 127 ILE C . 19343 1 226 . 1 1 127 127 ILE CA C 13 61.837 0.3 . 1 . . . A 127 ILE CA . 19343 1 227 . 1 1 127 127 ILE CB C 13 37.631 0.3 . 1 . . . A 127 ILE CB . 19343 1 228 . 1 1 127 127 ILE N N 15 120.01 0.3 . 1 . . . A 127 ILE N . 19343 1 229 . 1 1 128 128 ASN H H 1 8.342 0.02 . 1 . . . A 128 ASN H . 19343 1 230 . 1 1 128 128 ASN C C 13 174.334 0.3 . 1 . . . A 128 ASN C . 19343 1 231 . 1 1 128 128 ASN CA C 13 53.316 0.3 . 1 . . . A 128 ASN CA . 19343 1 232 . 1 1 128 128 ASN CB C 13 39.409 0.3 . 1 . . . A 128 ASN CB . 19343 1 233 . 1 1 128 128 ASN N N 15 118.359 0.3 . 1 . . . A 128 ASN N . 19343 1 234 . 1 1 129 129 ASP H H 1 8.632 0.02 . 1 . . . A 129 ASP H . 19343 1 235 . 1 1 129 129 ASP C C 13 176.841 0.3 . 1 . . . A 129 ASP C . 19343 1 236 . 1 1 129 129 ASP CA C 13 56.154 0.3 . 1 . . . A 129 ASP CA . 19343 1 237 . 1 1 129 129 ASP CB C 13 40.406 0.3 . 1 . . . A 129 ASP CB . 19343 1 238 . 1 1 129 129 ASP N N 15 117.685 0.3 . 1 . . . A 129 ASP N . 19343 1 239 . 1 1 130 130 LYS H H 1 8.571 0.02 . 1 . . . A 130 LYS H . 19343 1 240 . 1 1 130 130 LYS C C 13 176.011 0.3 . 1 . . . A 130 LYS C . 19343 1 241 . 1 1 130 130 LYS CA C 13 56.924 0.3 . 1 . . . A 130 LYS CA . 19343 1 242 . 1 1 130 130 LYS CB C 13 33.895 0.3 . 1 . . . A 130 LYS CB . 19343 1 243 . 1 1 130 130 LYS N N 15 116.361 0.3 . 1 . . . A 130 LYS N . 19343 1 244 . 1 1 131 131 PHE H H 1 8.112 0.02 . 1 . . . A 131 PHE H . 19343 1 245 . 1 1 131 131 PHE C C 13 174.776 0.3 . 1 . . . A 131 PHE C . 19343 1 246 . 1 1 131 131 PHE CA C 13 56.891 0.3 . 1 . . . A 131 PHE CA . 19343 1 247 . 1 1 131 131 PHE CB C 13 40.466 0.3 . 1 . . . A 131 PHE CB . 19343 1 248 . 1 1 131 131 PHE N N 15 118.309 0.3 . 1 . . . A 131 PHE N . 19343 1 249 . 1 1 132 132 LYS H H 1 8.974 0.02 . 1 . . . A 132 LYS H . 19343 1 250 . 1 1 132 132 LYS C C 13 176.029 0.3 . 1 . . . A 132 LYS C . 19343 1 251 . 1 1 132 132 LYS CA C 13 53.437 0.3 . 1 . . . A 132 LYS CA . 19343 1 252 . 1 1 132 132 LYS CB C 13 33.453 0.3 . 1 . . . A 132 LYS CB . 19343 1 253 . 1 1 132 132 LYS N N 15 121.819 0.3 . 1 . . . A 132 LYS N . 19343 1 254 . 1 1 133 133 PRO C C 13 173.716 0.3 . 1 . . . A 133 PRO C . 19343 1 255 . 1 1 133 133 PRO CA C 13 62.78 0.3 . 1 . . . A 133 PRO CA . 19343 1 256 . 1 1 133 133 PRO CB C 13 32.095 0.3 . 1 . . . A 133 PRO CB . 19343 1 257 . 1 1 134 134 TYR H H 1 8.905 0.02 . 1 . . . A 134 TYR H . 19343 1 258 . 1 1 134 134 TYR C C 13 174.016 0.3 . 1 . . . A 134 TYR C . 19343 1 259 . 1 1 134 134 TYR CA C 13 56.37 0.3 . 1 . . . A 134 TYR CA . 19343 1 260 . 1 1 134 134 TYR CB C 13 41.993 0.3 . 1 . . . A 134 TYR CB . 19343 1 261 . 1 1 134 134 TYR N N 15 117.842 0.3 . 1 . . . A 134 TYR N . 19343 1 262 . 1 1 135 135 ILE H H 1 8.79 0.02 . 1 . . . A 135 ILE H . 19343 1 263 . 1 1 135 135 ILE C C 13 174.246 0.3 . 1 . . . A 135 ILE C . 19343 1 264 . 1 1 135 135 ILE CA C 13 58.982 0.3 . 1 . . . A 135 ILE CA . 19343 1 265 . 1 1 135 135 ILE CB C 13 42.685 0.3 . 1 . . . A 135 ILE CB . 19343 1 266 . 1 1 135 135 ILE N N 15 114.98 0.3 . 1 . . . A 135 ILE N . 19343 1 267 . 1 1 136 136 GLY H H 1 9.48 0.02 . 1 . . . A 136 GLY H . 19343 1 268 . 1 1 136 136 GLY C C 13 171.642 0.3 . 1 . . . A 136 GLY C . 19343 1 269 . 1 1 136 136 GLY CA C 13 46.934 0.3 . 1 . . . A 136 GLY CA . 19343 1 270 . 1 1 136 136 GLY N N 15 111.712 0.3 . 1 . . . A 136 GLY N . 19343 1 271 . 1 1 137 137 ALA H H 1 8.796 0.02 . 1 . . . A 137 ALA H . 19343 1 272 . 1 1 137 137 ALA C C 13 175.323 0.3 . 1 . . . A 137 ALA C . 19343 1 273 . 1 1 137 137 ALA CA C 13 50.366 0.3 . 1 . . . A 137 ALA CA . 19343 1 274 . 1 1 137 137 ALA CB C 13 22.064 0.3 . 1 . . . A 137 ALA CB . 19343 1 275 . 1 1 137 137 ALA N N 15 120.962 0.3 . 1 . . . A 137 ALA N . 19343 1 276 . 1 1 138 138 ARG H H 1 8.433 0.02 . 1 . . . A 138 ARG H . 19343 1 277 . 1 1 138 138 ARG C C 13 174.44 0.3 . 1 . . . A 138 ARG C . 19343 1 278 . 1 1 138 138 ARG CA C 13 55.088 0.3 . 1 . . . A 138 ARG CA . 19343 1 279 . 1 1 138 138 ARG CB C 13 32.787 0.3 . 1 . . . A 138 ARG CB . 19343 1 280 . 1 1 138 138 ARG N N 15 121.465 0.3 . 1 . . . A 138 ARG N . 19343 1 281 . 1 1 139 139 VAL H H 1 9.163 0.02 . 1 . . . A 139 VAL H . 19343 1 282 . 1 1 139 139 VAL C C 13 173.787 0.3 . 1 . . . A 139 VAL C . 19343 1 283 . 1 1 139 139 VAL CA C 13 58.665 0.3 . 1 . . . A 139 VAL CA . 19343 1 284 . 1 1 139 139 VAL CB C 13 34.261 0.3 . 1 . . . A 139 VAL CB . 19343 1 285 . 1 1 139 139 VAL N N 15 125.073 0.3 . 1 . . . A 139 VAL N . 19343 1 286 . 1 1 140 140 ALA H H 1 8.821 0.02 . 1 . . . A 140 ALA H . 19343 1 287 . 1 1 140 140 ALA C C 13 176.929 0.3 . 1 . . . A 140 ALA C . 19343 1 288 . 1 1 140 140 ALA CA C 13 50.949 0.3 . 1 . . . A 140 ALA CA . 19343 1 289 . 1 1 140 140 ALA CB C 13 22.578 0.3 . 1 . . . A 140 ALA CB . 19343 1 290 . 1 1 140 140 ALA N N 15 123.524 0.3 . 1 . . . A 140 ALA N . 19343 1 291 . 1 1 157 157 VAL H H 1 8.27 0.02 . 1 . . . A 157 VAL H . 19343 1 292 . 1 1 157 157 VAL C C 13 175.063 0.3 . 1 . . . A 157 VAL C . 19343 1 293 . 1 1 157 157 VAL CA C 13 62.019 0.3 . 1 . . . A 157 VAL CA . 19343 1 294 . 1 1 157 157 VAL N N 15 116.065 0.3 . 1 . . . A 157 VAL N . 19343 1 295 . 1 1 159 159 THR H H 1 8.243 0.02 . 1 . . . A 159 THR H . 19343 1 296 . 1 1 159 159 THR C C 13 176.622 0.3 . 1 . . . A 159 THR C . 19343 1 297 . 1 1 159 159 THR CA C 13 61.897 0.3 . 1 . . . A 159 THR CA . 19343 1 298 . 1 1 159 159 THR CB C 13 69.477 0.3 . 1 . . . A 159 THR CB . 19343 1 299 . 1 1 159 159 THR N N 15 117.027 0.3 . 1 . . . A 159 THR N . 19343 1 300 . 1 1 160 160 VAL H H 1 8.527 0.02 . 1 . . . A 160 VAL H . 19343 1 301 . 1 1 160 160 VAL C C 13 177.14 0.3 . 1 . . . A 160 VAL C . 19343 1 302 . 1 1 160 160 VAL CA C 13 56.845 0.3 . 1 . . . A 160 VAL CA . 19343 1 303 . 1 1 160 160 VAL CB C 13 29.394 0.3 . 1 . . . A 160 VAL CB . 19343 1 304 . 1 1 160 160 VAL N N 15 123.139 0.3 . 1 . . . A 160 VAL N . 19343 1 305 . 1 1 161 161 PRO C C 13 177.568 0.3 . 1 . . . A 161 PRO C . 19343 1 306 . 1 1 161 161 PRO CA C 13 63.531 0.3 . 1 . . . A 161 PRO CA . 19343 1 307 . 1 1 161 161 PRO CB C 13 31.329 0.3 . 1 . . . A 161 PRO CB . 19343 1 308 . 1 1 162 162 SER H H 1 8.436 0.02 . 1 . . . A 162 SER H . 19343 1 309 . 1 1 162 162 SER C C 13 175.042 0.3 . 1 . . . A 162 SER C . 19343 1 310 . 1 1 162 162 SER CA C 13 58.554 0.3 . 1 . . . A 162 SER CA . 19343 1 311 . 1 1 162 162 SER CB C 13 63.934 0.3 . 1 . . . A 162 SER CB . 19343 1 312 . 1 1 162 162 SER N N 15 115.87 0.3 . 1 . . . A 162 SER N . 19343 1 313 . 1 1 163 163 ASN H H 1 8.466 0.02 . 1 . . . A 163 ASN H . 19343 1 314 . 1 1 163 163 ASN C C 13 175.683 0.3 . 1 . . . A 163 ASN C . 19343 1 315 . 1 1 163 163 ASN CA C 13 53.351 0.3 . 1 . . . A 163 ASN CA . 19343 1 316 . 1 1 163 163 ASN CB C 13 38.656 0.3 . 1 . . . A 163 ASN CB . 19343 1 317 . 1 1 163 163 ASN N N 15 120.667 0.3 . 1 . . . A 163 ASN N . 19343 1 318 . 1 1 164 164 ALA H H 1 8.227 0.02 . 1 . . . A 164 ALA H . 19343 1 319 . 1 1 164 164 ALA C C 13 176.372 0.3 . 1 . . . A 164 ALA C . 19343 1 320 . 1 1 164 164 ALA CA C 13 50.619 0.3 . 1 . . . A 164 ALA CA . 19343 1 321 . 1 1 164 164 ALA CB C 13 17.815 0.3 . 1 . . . A 164 ALA CB . 19343 1 322 . 1 1 164 164 ALA N N 15 124.946 0.3 . 1 . . . A 164 ALA N . 19343 1 323 . 1 1 165 165 PRO C C 13 176.557 0.3 . 1 . . . A 165 PRO C . 19343 1 324 . 1 1 165 165 PRO CA C 13 63.666 0.3 . 1 . . . A 165 PRO CA . 19343 1 325 . 1 1 165 165 PRO CB C 13 31.072 0.3 . 1 . . . A 165 PRO CB . 19343 1 326 . 1 1 166 166 ASN H H 1 8.051 0.02 . 1 . . . A 166 ASN H . 19343 1 327 . 1 1 166 166 ASN C C 13 177.248 0.3 . 1 . . . A 166 ASN C . 19343 1 328 . 1 1 166 166 ASN CA C 13 55.152 0.3 . 1 . . . A 166 ASN CA . 19343 1 329 . 1 1 166 166 ASN CB C 13 40.764 0.3 . 1 . . . A 166 ASN CB . 19343 1 330 . 1 1 166 166 ASN N N 15 124.475 0.3 . 1 . . . A 166 ASN N . 19343 1 331 . 1 1 167 167 GLY H H 1 8.402 0.02 . 1 . . . A 167 GLY H . 19343 1 332 . 1 1 167 167 GLY C C 13 174.773 0.3 . 1 . . . A 167 GLY C . 19343 1 333 . 1 1 167 167 GLY CA C 13 45.662 0.3 . 1 . . . A 167 GLY CA . 19343 1 334 . 1 1 167 167 GLY N N 15 110.212 0.3 . 1 . . . A 167 GLY N . 19343 1 335 . 1 1 168 168 ALA H H 1 8.365 0.02 . 1 . . . A 168 ALA H . 19343 1 336 . 1 1 168 168 ALA C C 13 178.532 0.3 . 1 . . . A 168 ALA C . 19343 1 337 . 1 1 168 168 ALA CA C 13 52.44 0.3 . 1 . . . A 168 ALA CA . 19343 1 338 . 1 1 168 168 ALA CB C 13 18.569 0.3 . 1 . . . A 168 ALA CB . 19343 1 339 . 1 1 168 168 ALA N N 15 123.653 0.3 . 1 . . . A 168 ALA N . 19343 1 340 . 1 1 169 169 VAL H H 1 8.213 0.02 . 1 . . . A 169 VAL H . 19343 1 341 . 1 1 169 169 VAL C C 13 177.117 0.3 . 1 . . . A 169 VAL C . 19343 1 342 . 1 1 169 169 VAL CA C 13 62.438 0.3 . 1 . . . A 169 VAL CA . 19343 1 343 . 1 1 169 169 VAL CB C 13 31.959 0.3 . 1 . . . A 169 VAL CB . 19343 1 344 . 1 1 169 169 VAL N N 15 119.182 0.3 . 1 . . . A 169 VAL N . 19343 1 345 . 1 1 170 170 THR H H 1 8.314 0.02 . 1 . . . A 170 THR H . 19343 1 346 . 1 1 170 170 THR C C 13 175.078 0.3 . 1 . . . A 170 THR C . 19343 1 347 . 1 1 170 170 THR CA C 13 61.635 0.3 . 1 . . . A 170 THR CA . 19343 1 348 . 1 1 170 170 THR CB C 13 69.477 0.3 . 1 . . . A 170 THR CB . 19343 1 349 . 1 1 170 170 THR N N 15 118.011 0.3 . 1 . . . A 170 THR N . 19343 1 350 . 1 1 171 171 THR H H 1 8.146 0.02 . 1 . . . A 171 THR H . 19343 1 351 . 1 1 171 171 THR C C 13 176.816 0.3 . 1 . . . A 171 THR C . 19343 1 352 . 1 1 171 171 THR CA C 13 62.259 0.3 . 1 . . . A 171 THR CA . 19343 1 353 . 1 1 171 171 THR CB C 13 69.477 0.3 . 1 . . . A 171 THR CB . 19343 1 354 . 1 1 171 171 THR N N 15 116.394 0.3 . 1 . . . A 171 THR N . 19343 1 355 . 1 1 172 172 TYR H H 1 8.312 0.02 . 1 . . . A 172 TYR H . 19343 1 356 . 1 1 172 172 TYR C C 13 176.286 0.3 . 1 . . . A 172 TYR C . 19343 1 357 . 1 1 172 172 TYR CA C 13 56.261 0.3 . 1 . . . A 172 TYR CA . 19343 1 358 . 1 1 172 172 TYR N N 15 121.464 0.3 . 1 . . . A 172 TYR N . 19343 1 359 . 1 1 173 173 ASN H H 1 8.471 0.02 . 1 . . . A 173 ASN H . 19343 1 360 . 1 1 173 173 ASN C C 13 175.672 0.3 . 1 . . . A 173 ASN C . 19343 1 361 . 1 1 173 173 ASN CA C 13 53.617 0.3 . 1 . . . A 173 ASN CA . 19343 1 362 . 1 1 173 173 ASN CB C 13 38.681 0.3 . 1 . . . A 173 ASN CB . 19343 1 363 . 1 1 173 173 ASN N N 15 119.854 0.3 . 1 . . . A 173 ASN N . 19343 1 364 . 1 1 174 174 THR H H 1 8.156 0.02 . 1 . . . A 174 THR H . 19343 1 365 . 1 1 174 174 THR C C 13 174.634 0.3 . 1 . . . A 174 THR C . 19343 1 366 . 1 1 174 174 THR CA C 13 61.908 0.3 . 1 . . . A 174 THR CA . 19343 1 367 . 1 1 174 174 THR CB C 13 69.397 0.3 . 1 . . . A 174 THR CB . 19343 1 368 . 1 1 174 174 THR N N 15 114.27 0.3 . 1 . . . A 174 THR N . 19343 1 369 . 1 1 175 175 ASP H H 1 8.382 0.02 . 1 . . . A 175 ASP H . 19343 1 370 . 1 1 175 175 ASP C C 13 175.537 0.3 . 1 . . . A 175 ASP C . 19343 1 371 . 1 1 175 175 ASP CA C 13 52.364 0.3 . 1 . . . A 175 ASP CA . 19343 1 372 . 1 1 175 175 ASP CB C 13 40.674 0.3 . 1 . . . A 175 ASP CB . 19343 1 373 . 1 1 175 175 ASP N N 15 124.265 0.3 . 1 . . . A 175 ASP N . 19343 1 374 . 1 1 176 176 PRO C C 13 178.033 0.3 . 1 . . . A 176 PRO C . 19343 1 375 . 1 1 176 176 PRO CA C 13 64.103 0.3 . 1 . . . A 176 PRO CA . 19343 1 376 . 1 1 176 176 PRO CB C 13 31.347 0.3 . 1 . . . A 176 PRO CB . 19343 1 377 . 1 1 177 177 LYS H H 1 8.524 0.02 . 1 . . . A 177 LYS H . 19343 1 378 . 1 1 177 177 LYS C C 13 177.982 0.3 . 1 . . . A 177 LYS C . 19343 1 379 . 1 1 177 177 LYS CA C 13 57.038 0.3 . 1 . . . A 177 LYS CA . 19343 1 380 . 1 1 177 177 LYS CB C 13 31.397 0.3 . 1 . . . A 177 LYS CB . 19343 1 381 . 1 1 177 177 LYS N N 15 119.424 0.3 . 1 . . . A 177 LYS N . 19343 1 382 . 1 1 178 178 THR H H 1 8.06 0.02 . 1 . . . A 178 THR H . 19343 1 383 . 1 1 178 178 THR C C 13 175.486 0.3 . 1 . . . A 178 THR C . 19343 1 384 . 1 1 178 178 THR CA C 13 62.259 0.3 . 1 . . . A 178 THR CA . 19343 1 385 . 1 1 178 178 THR CB C 13 69.557 0.3 . 1 . . . A 178 THR CB . 19343 1 386 . 1 1 178 178 THR N N 15 113.513 0.3 . 1 . . . A 178 THR N . 19343 1 387 . 1 1 190 190 VAL H H 1 9.585 0.02 . 1 . . . A 190 VAL H . 19343 1 388 . 1 1 190 190 VAL C C 13 174.758 0.3 . 1 . . . A 190 VAL C . 19343 1 389 . 1 1 190 190 VAL CA C 13 62.426 0.3 . 1 . . . A 190 VAL CA . 19343 1 390 . 1 1 190 190 VAL CB C 13 31.878 0.3 . 1 . . . A 190 VAL CB . 19343 1 391 . 1 1 190 190 VAL N N 15 127.004 0.3 . 1 . . . A 190 VAL N . 19343 1 392 . 1 1 191 191 GLY H H 1 8.71 0.02 . 1 . . . A 191 GLY H . 19343 1 393 . 1 1 191 191 GLY C C 13 172.392 0.3 . 1 . . . A 191 GLY C . 19343 1 394 . 1 1 191 191 GLY CA C 13 44.631 0.3 . 1 . . . A 191 GLY CA . 19343 1 395 . 1 1 191 191 GLY N N 15 114.195 0.3 . 1 . . . A 191 GLY N . 19343 1 396 . 1 1 192 192 LEU H H 1 7.814 0.02 . 1 . . . A 192 LEU H . 19343 1 397 . 1 1 192 192 LEU C C 13 175.446 0.3 . 1 . . . A 192 LEU C . 19343 1 398 . 1 1 192 192 LEU CA C 13 53.632 0.3 . 1 . . . A 192 LEU CA . 19343 1 399 . 1 1 192 192 LEU CB C 13 46.647 0.3 . 1 . . . A 192 LEU CB . 19343 1 400 . 1 1 192 192 LEU N N 15 120.017 0.3 . 1 . . . A 192 LEU N . 19343 1 401 . 1 1 193 193 GLY H H 1 9.258 0.02 . 1 . . . A 193 GLY H . 19343 1 402 . 1 1 193 193 GLY C C 13 172.428 0.3 . 1 . . . A 193 GLY C . 19343 1 403 . 1 1 193 193 GLY CA C 13 46.071 0.3 . 1 . . . A 193 GLY CA . 19343 1 404 . 1 1 193 193 GLY N N 15 109.61 0.3 . 1 . . . A 193 GLY N . 19343 1 405 . 1 1 194 194 VAL H H 1 8.769 0.02 . 1 . . . A 194 VAL H . 19343 1 406 . 1 1 194 194 VAL C C 13 174.37 0.3 . 1 . . . A 194 VAL C . 19343 1 407 . 1 1 194 194 VAL CA C 13 59.907 0.3 . 1 . . . A 194 VAL CA . 19343 1 408 . 1 1 194 194 VAL CB C 13 35.673 0.3 . 1 . . . A 194 VAL CB . 19343 1 409 . 1 1 194 194 VAL N N 15 114.126 0.3 . 1 . . . A 194 VAL N . 19343 1 410 . 1 1 195 195 ILE H H 1 8.698 0.02 . 1 . . . A 195 ILE H . 19343 1 411 . 1 1 195 195 ILE C C 13 174.087 0.3 . 1 . . . A 195 ILE C . 19343 1 412 . 1 1 195 195 ILE CA C 13 58.698 0.3 . 1 . . . A 195 ILE CA . 19343 1 413 . 1 1 195 195 ILE CB C 13 40.126 0.3 . 1 . . . A 195 ILE CB . 19343 1 414 . 1 1 195 195 ILE N N 15 118.306 0.3 . 1 . . . A 195 ILE N . 19343 1 415 . 1 1 196 196 ALA H H 1 9.311 0.02 . 1 . . . A 196 ALA H . 19343 1 416 . 1 1 196 196 ALA C C 13 175.775 0.3 . 1 . . . A 196 ALA C . 19343 1 417 . 1 1 196 196 ALA CA C 13 51.657 0.3 . 1 . . . A 196 ALA CA . 19343 1 418 . 1 1 196 196 ALA CB C 13 22.347 0.3 . 1 . . . A 196 ALA CB . 19343 1 419 . 1 1 196 196 ALA N N 15 123.076 0.3 . 1 . . . A 196 ALA N . 19343 1 420 . 1 1 197 197 GLY H H 1 7.573 0.02 . 1 . . . A 197 GLY H . 19343 1 421 . 1 1 197 197 GLY C C 13 171.97 0.3 . 1 . . . A 197 GLY C . 19343 1 422 . 1 1 197 197 GLY CA C 13 46.636 0.3 . 1 . . . A 197 GLY CA . 19343 1 423 . 1 1 197 197 GLY N N 15 106.713 0.3 . 1 . . . A 197 GLY N . 19343 1 424 . 1 1 198 198 VAL H H 1 9.444 0.02 . 1 . . . A 198 VAL H . 19343 1 425 . 1 1 198 198 VAL C C 13 173.452 0.3 . 1 . . . A 198 VAL C . 19343 1 426 . 1 1 198 198 VAL CA C 13 60.905 0.3 . 1 . . . A 198 VAL CA . 19343 1 427 . 1 1 198 198 VAL CB C 13 35.299 0.3 . 1 . . . A 198 VAL CB . 19343 1 428 . 1 1 198 198 VAL N N 15 115.826 0.3 . 1 . . . A 198 VAL N . 19343 1 429 . 1 1 199 199 GLY H H 1 8.007 0.02 . 1 . . . A 199 GLY H . 19343 1 430 . 1 1 199 199 GLY C C 13 173.36 0.3 . 1 . . . A 199 GLY C . 19343 1 431 . 1 1 199 199 GLY CA C 13 43.667 0.3 . 1 . . . A 199 GLY CA . 19343 1 432 . 1 1 199 199 GLY N N 15 111.96 0.3 . 1 . . . A 199 GLY N . 19343 1 433 . 1 1 200 200 PHE H H 1 9.479 0.02 . 1 . . . A 200 PHE H . 19343 1 434 . 1 1 200 200 PHE C C 13 175.233 0.3 . 1 . . . A 200 PHE C . 19343 1 435 . 1 1 200 200 PHE CA C 13 55.778 0.3 . 1 . . . A 200 PHE CA . 19343 1 436 . 1 1 200 200 PHE CB C 13 41.971 0.3 . 1 . . . A 200 PHE CB . 19343 1 437 . 1 1 200 200 PHE N N 15 123.684 0.3 . 1 . . . A 200 PHE N . 19343 1 438 . 1 1 201 201 ASP H H 1 8.849 0.02 . 1 . . . A 201 ASP H . 19343 1 439 . 1 1 201 201 ASP C C 13 174.97 0.3 . 1 . . . A 201 ASP C . 19343 1 440 . 1 1 201 201 ASP CA C 13 55.157 0.3 . 1 . . . A 201 ASP CA . 19343 1 441 . 1 1 201 201 ASP CB C 13 38.632 0.3 . 1 . . . A 201 ASP CB . 19343 1 442 . 1 1 201 201 ASP N N 15 130.386 0.3 . 1 . . . A 201 ASP N . 19343 1 443 . 1 1 202 202 ILE H H 1 8.646 0.02 . 1 . . . A 202 ILE H . 19343 1 444 . 1 1 202 202 ILE C C 13 176.841 0.3 . 1 . . . A 202 ILE C . 19343 1 445 . 1 1 202 202 ILE CA C 13 63.05 0.3 . 1 . . . A 202 ILE CA . 19343 1 446 . 1 1 202 202 ILE CB C 13 38.361 0.3 . 1 . . . A 202 ILE CB . 19343 1 447 . 1 1 202 202 ILE N N 15 124.928 0.3 . 1 . . . A 202 ILE N . 19343 1 448 . 1 1 203 203 THR H H 1 8.472 0.02 . 1 . . . A 203 THR H . 19343 1 449 . 1 1 203 203 THR C C 13 173.505 0.3 . 1 . . . A 203 THR C . 19343 1 450 . 1 1 203 203 THR CA C 13 59.322 0.3 . 1 . . . A 203 THR CA . 19343 1 451 . 1 1 203 203 THR CB C 13 68.634 0.3 . 1 . . . A 203 THR CB . 19343 1 452 . 1 1 203 203 THR N N 15 112.006 0.3 . 1 . . . A 203 THR N . 19343 1 453 . 1 1 204 204 PRO C C 13 177.459 0.3 . 1 . . . A 204 PRO C . 19343 1 454 . 1 1 204 204 PRO CA C 13 65.387 0.3 . 1 . . . A 204 PRO CA . 19343 1 455 . 1 1 204 204 PRO CB C 13 31.55 0.3 . 1 . . . A 204 PRO CB . 19343 1 456 . 1 1 205 205 LYS H H 1 7.801 0.02 . 1 . . . A 205 LYS H . 19343 1 457 . 1 1 205 205 LYS C C 13 175.235 0.3 . 1 . . . A 205 LYS C . 19343 1 458 . 1 1 205 205 LYS CA C 13 56.124 0.3 . 1 . . . A 205 LYS CA . 19343 1 459 . 1 1 205 205 LYS CB C 13 33.189 0.3 . 1 . . . A 205 LYS CB . 19343 1 460 . 1 1 205 205 LYS N N 15 111.965 0.3 . 1 . . . A 205 LYS N . 19343 1 461 . 1 1 206 206 LEU H H 1 7.584 0.02 . 1 . . . A 206 LEU H . 19343 1 462 . 1 1 206 206 LEU C C 13 175.976 0.3 . 1 . . . A 206 LEU C . 19343 1 463 . 1 1 206 206 LEU CA C 13 54.109 0.3 . 1 . . . A 206 LEU CA . 19343 1 464 . 1 1 206 206 LEU CB C 13 45.105 0.3 . 1 . . . A 206 LEU CB . 19343 1 465 . 1 1 206 206 LEU N N 15 121.328 0.3 . 1 . . . A 206 LEU N . 19343 1 466 . 1 1 207 207 THR H H 1 9.192 0.02 . 1 . . . A 207 THR H . 19343 1 467 . 1 1 207 207 THR C C 13 174.158 0.3 . 1 . . . A 207 THR C . 19343 1 468 . 1 1 207 207 THR CA C 13 62.017 0.3 . 1 . . . A 207 THR CA . 19343 1 469 . 1 1 207 207 THR CB C 13 72.182 0.3 . 1 . . . A 207 THR CB . 19343 1 470 . 1 1 207 207 THR N N 15 123.091 0.3 . 1 . . . A 207 THR N . 19343 1 471 . 1 1 208 208 LEU H H 1 9.418 0.02 . 1 . . . A 208 LEU H . 19343 1 472 . 1 1 208 208 LEU C C 13 174.828 0.3 . 1 . . . A 208 LEU C . 19343 1 473 . 1 1 208 208 LEU CA C 13 54.127 0.3 . 1 . . . A 208 LEU CA . 19343 1 474 . 1 1 208 208 LEU CB C 13 43.177 0.3 . 1 . . . A 208 LEU CB . 19343 1 475 . 1 1 208 208 LEU N N 15 128.382 0.3 . 1 . . . A 208 LEU N . 19343 1 476 . 1 1 209 209 ASP H H 1 9.155 0.02 . 1 . . . A 209 ASP H . 19343 1 477 . 1 1 209 209 ASP C C 13 175.876 0.3 . 1 . . . A 209 ASP C . 19343 1 478 . 1 1 209 209 ASP CA C 13 53.112 0.3 . 1 . . . A 209 ASP CA . 19343 1 479 . 1 1 209 209 ASP CB C 13 45.149 0.3 . 1 . . . A 209 ASP CB . 19343 1 480 . 1 1 209 209 ASP N N 15 127.139 0.3 . 1 . . . A 209 ASP N . 19343 1 481 . 1 1 210 210 ALA H H 1 9.03 0.02 . 1 . . . A 210 ALA H . 19343 1 482 . 1 1 210 210 ALA C C 13 175.876 0.3 . 1 . . . A 210 ALA C . 19343 1 483 . 1 1 210 210 ALA CA C 13 50.451 0.3 . 1 . . . A 210 ALA CA . 19343 1 484 . 1 1 210 210 ALA CB C 13 19.968 0.3 . 1 . . . A 210 ALA CB . 19343 1 485 . 1 1 210 210 ALA N N 15 131.933 0.3 . 1 . . . A 210 ALA N . 19343 1 486 . 1 1 211 211 GLY H H 1 8.963 0.02 . 1 . . . A 211 GLY H . 19343 1 487 . 1 1 211 211 GLY C C 13 171.654 0.3 . 1 . . . A 211 GLY C . 19343 1 488 . 1 1 211 211 GLY CA C 13 45.896 0.3 . 1 . . . A 211 GLY CA . 19343 1 489 . 1 1 211 211 GLY N N 15 107.876 0.3 . 1 . . . A 211 GLY N . 19343 1 490 . 1 1 212 212 TYR H H 1 9.675 0.02 . 1 . . . A 212 TYR H . 19343 1 491 . 1 1 212 212 TYR C C 13 175.287 0.3 . 1 . . . A 212 TYR C . 19343 1 492 . 1 1 212 212 TYR CA C 13 55.861 0.3 . 1 . . . A 212 TYR CA . 19343 1 493 . 1 1 212 212 TYR CB C 13 42.69 0.3 . 1 . . . A 212 TYR CB . 19343 1 494 . 1 1 212 212 TYR N N 15 120.649 0.3 . 1 . . . A 212 TYR N . 19343 1 495 . 1 1 231 231 SER H H 1 9.663 0.02 . 1 . . . A 231 SER H . 19343 1 496 . 1 1 231 231 SER C C 13 172.475 0.3 . 1 . . . A 231 SER C . 19343 1 497 . 1 1 231 231 SER CA C 13 57.333 0.3 . 1 . . . A 231 SER CA . 19343 1 498 . 1 1 231 231 SER CB C 13 63.387 0.3 . 1 . . . A 231 SER CB . 19343 1 499 . 1 1 231 231 SER N N 15 113.24 0.3 . 1 . . . A 231 SER N . 19343 1 500 . 1 1 233 233 GLY H H 1 9.209 0.02 . 1 . . . A 233 GLY H . 19343 1 501 . 1 1 233 233 GLY C C 13 173.063 0.3 . 1 . . . A 233 GLY C . 19343 1 502 . 1 1 233 233 GLY CA C 13 46.307 0.3 . 1 . . . A 233 GLY CA . 19343 1 503 . 1 1 233 233 GLY N N 15 112.364 0.3 . 1 . . . A 233 GLY N . 19343 1 504 . 1 1 234 234 VAL H H 1 8.647 0.02 . 1 . . . A 234 VAL H . 19343 1 505 . 1 1 234 234 VAL C C 13 174.052 0.3 . 1 . . . A 234 VAL C . 19343 1 506 . 1 1 234 234 VAL CA C 13 59.15 0.3 . 1 . . . A 234 VAL CA . 19343 1 507 . 1 1 234 234 VAL CB C 13 34.744 0.3 . 1 . . . A 234 VAL CB . 19343 1 508 . 1 1 234 234 VAL N N 15 114.067 0.3 . 1 . . . A 234 VAL N . 19343 1 509 . 1 1 235 235 ARG H H 1 9.454 0.02 . 1 . . . A 235 ARG H . 19343 1 510 . 1 1 235 235 ARG C C 13 174.723 0.3 . 1 . . . A 235 ARG C . 19343 1 511 . 1 1 235 235 ARG CA C 13 53.493 0.3 . 1 . . . A 235 ARG CA . 19343 1 512 . 1 1 235 235 ARG CB C 13 32.045 0.3 . 1 . . . A 235 ARG CB . 19343 1 513 . 1 1 235 235 ARG N N 15 124.171 0.3 . 1 . . . A 235 ARG N . 19343 1 514 . 1 1 236 236 TYR H H 1 9.462 0.02 . 1 . . . A 236 TYR H . 19343 1 515 . 1 1 236 236 TYR C C 13 174.26 0.3 . 1 . . . A 236 TYR C . 19343 1 516 . 1 1 236 236 TYR CA C 13 56.355 0.3 . 1 . . . A 236 TYR CA . 19343 1 517 . 1 1 236 236 TYR CB C 13 41.543 0.3 . 1 . . . A 236 TYR CB . 19343 1 518 . 1 1 236 236 TYR N N 15 125.851 0.3 . 1 . . . A 236 TYR N . 19343 1 519 . 1 1 237 237 ARG H H 1 8.227 0.02 . 1 . . . A 237 ARG H . 19343 1 520 . 1 1 237 237 ARG C C 13 174.405 0.3 . 1 . . . A 237 ARG C . 19343 1 521 . 1 1 237 237 ARG CA C 13 54.973 0.3 . 1 . . . A 237 ARG CA . 19343 1 522 . 1 1 237 237 ARG CB C 13 30.2 0.3 . 1 . . . A 237 ARG CB . 19343 1 523 . 1 1 237 237 ARG N N 15 128.757 0.3 . 1 . . . A 237 ARG N . 19343 1 524 . 1 1 238 238 PHE H H 1 7.537 0.02 . 1 . . . A 238 PHE H . 19343 1 525 . 1 1 238 238 PHE C C 13 181.184 0.3 . 1 . . . A 238 PHE C . 19343 1 526 . 1 1 238 238 PHE CA C 13 59.949 0.3 . 1 . . . A 238 PHE CA . 19343 1 527 . 1 1 238 238 PHE CB C 13 39.934 0.3 . 1 . . . A 238 PHE CB . 19343 1 528 . 1 1 238 238 PHE N N 15 125.181 0.3 . 1 . . . A 238 PHE N . 19343 1 stop_ save_