################################### # 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 51949 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name MepS _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 '2D 1H-15N HSQC' . . . 51949 1 2 '3D CBCA(CO)NH' . . . 51949 1 3 '3D HNCA' . . . 51949 1 4 '3D HN(CO)CA' . . . 51949 1 5 '3D CBCANH' . . . 51949 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 . . 51949 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 6 6 THR H H 1 8.109 0.020 . 1 . . . . . 6 THR H . 51949 1 2 . 1 . 1 6 6 THR C C 13 174.428 0.3 . 1 . . . . . 6 THR C . 51949 1 3 . 1 . 1 6 6 THR CA C 13 62.165 0.3 . 1 . . . . . 6 THR CA . 51949 1 4 . 1 . 1 6 6 THR CB C 13 69.410 0.3 . 1 . . . . . 6 THR CB . 51949 1 5 . 1 . 1 6 6 THR N N 15 114.427 0.3 . 1 . . . . . 6 THR N . 51949 1 6 . 1 . 1 7 7 ALA H H 1 8.234 0.020 . 1 . . . . . 7 ALA H . 51949 1 7 . 1 . 1 7 7 ALA C C 13 177.711 0.3 . 1 . . . . . 7 ALA C . 51949 1 8 . 1 . 1 7 7 ALA CA C 13 52.620 0.3 . 1 . . . . . 7 ALA CA . 51949 1 9 . 1 . 1 7 7 ALA CB C 13 18.781 0.3 . 1 . . . . . 7 ALA CB . 51949 1 10 . 1 . 1 7 7 ALA N N 15 126.148 0.3 . 1 . . . . . 7 ALA N . 51949 1 11 . 1 . 1 8 8 LYS H H 1 8.122 0.020 . 1 . . . . . 8 LYS H . 51949 1 12 . 1 . 1 8 8 LYS C C 13 176.324 0.3 . 1 . . . . . 8 LYS C . 51949 1 13 . 1 . 1 8 8 LYS CA C 13 56.456 0.3 . 1 . . . . . 8 LYS CA . 51949 1 14 . 1 . 1 8 8 LYS CB C 13 32.655 0.3 . 1 . . . . . 8 LYS CB . 51949 1 15 . 1 . 1 8 8 LYS N N 15 120.023 0.3 . 1 . . . . . 8 LYS N . 51949 1 16 . 1 . 1 9 9 ASN H H 1 8.328 0.020 . 1 . . . . . 9 ASN H . 51949 1 17 . 1 . 1 9 9 ASN C C 13 174.977 0.3 . 1 . . . . . 9 ASN C . 51949 1 18 . 1 . 1 9 9 ASN CA C 13 53.144 0.3 . 1 . . . . . 9 ASN CA . 51949 1 19 . 1 . 1 9 9 ASN CB C 13 38.210 0.3 . 1 . . . . . 9 ASN CB . 51949 1 20 . 1 . 1 9 9 ASN N N 15 119.019 0.3 . 1 . . . . . 9 ASN N . 51949 1 21 . 1 . 1 10 10 MET H H 1 8.217 0.020 . 1 . . . . . 10 MET H . 51949 1 22 . 1 . 1 10 10 MET C C 13 175.743 0.3 . 1 . . . . . 10 MET C . 51949 1 23 . 1 . 1 10 10 MET CA C 13 55.263 0.3 . 1 . . . . . 10 MET CA . 51949 1 24 . 1 . 1 10 10 MET CB C 13 32.377 0.3 . 1 . . . . . 10 MET CB . 51949 1 25 . 1 . 1 10 10 MET N N 15 120.286 0.3 . 1 . . . . . 10 MET N . 51949 1 26 . 1 . 1 13 13 GLU H H 1 8.847 0.020 . 1 . . . . . 13 GLU H . 51949 1 27 . 1 . 1 13 13 GLU C C 13 176.743 0.3 . 1 . . . . . 13 GLU C . 51949 1 28 . 1 . 1 13 13 GLU CA C 13 56.724 0.3 . 1 . . . . . 13 GLU CA . 51949 1 29 . 1 . 1 13 13 GLU CB C 13 29.786 0.3 . 1 . . . . . 13 GLU CB . 51949 1 30 . 1 . 1 13 13 GLU N N 15 121.126 0.3 . 1 . . . . . 13 GLU N . 51949 1 31 . 1 . 1 14 14 THR H H 1 8.161 0.020 . 1 . . . . . 14 THR H . 51949 1 32 . 1 . 1 14 14 THR C C 13 174.301 0.3 . 1 . . . . . 14 THR C . 51949 1 33 . 1 . 1 14 14 THR CA C 13 61.911 0.3 . 1 . . . . . 14 THR CA . 51949 1 34 . 1 . 1 14 14 THR CB C 13 69.448 0.3 . 1 . . . . . 14 THR CB . 51949 1 35 . 1 . 1 14 14 THR N N 15 115.720 0.3 . 1 . . . . . 14 THR N . 51949 1 36 . 1 . 1 15 15 ARG H H 1 8.295 0.020 . 1 . . . . . 15 ARG H . 51949 1 37 . 1 . 1 15 15 ARG C C 13 175.625 0.3 . 1 . . . . . 15 ARG C . 51949 1 38 . 1 . 1 15 15 ARG CA C 13 55.798 0.3 . 1 . . . . . 15 ARG CA . 51949 1 39 . 1 . 1 15 15 ARG CB C 13 30.523 0.3 . 1 . . . . . 15 ARG CB . 51949 1 40 . 1 . 1 15 15 ARG N N 15 123.856 0.3 . 1 . . . . . 15 ARG N . 51949 1 41 . 1 . 1 16 16 ALA H H 1 8.344 0.020 . 1 . . . . . 16 ALA H . 51949 1 42 . 1 . 1 16 16 ALA C C 13 177.582 0.3 . 1 . . . . . 16 ALA C . 51949 1 43 . 1 . 1 16 16 ALA CA C 13 52.213 0.3 . 1 . . . . . 16 ALA CA . 51949 1 44 . 1 . 1 16 16 ALA CB C 13 18.771 0.3 . 1 . . . . . 16 ALA CB . 51949 1 45 . 1 . 1 16 16 ALA N N 15 125.896 0.3 . 1 . . . . . 16 ALA N . 51949 1 46 . 1 . 1 17 17 VAL H H 1 8.173 0.020 . 1 . . . . . 17 VAL H . 51949 1 47 . 1 . 1 17 17 VAL C C 13 176.743 0.3 . 1 . . . . . 17 VAL C . 51949 1 48 . 1 . 1 17 17 VAL CA C 13 62.567 0.3 . 1 . . . . . 17 VAL CA . 51949 1 49 . 1 . 1 17 17 VAL CB C 13 32.546 0.3 . 1 . . . . . 17 VAL CB . 51949 1 50 . 1 . 1 17 17 VAL N N 15 120.064 0.3 . 1 . . . . . 17 VAL N . 51949 1 51 . 1 . 1 18 18 GLY H H 1 8.547 0.020 . 1 . . . . . 18 GLY H . 51949 1 52 . 1 . 1 18 18 GLY C C 13 174.214 0.3 . 1 . . . . . 18 GLY C . 51949 1 53 . 1 . 1 18 18 GLY CA C 13 45.170 0.3 . 1 . . . . . 18 GLY CA . 51949 1 54 . 1 . 1 18 18 GLY N N 15 112.909 0.3 . 1 . . . . . 18 GLY N . 51949 1 55 . 1 . 1 19 19 SER H H 1 8.220 0.020 . 1 . . . . . 19 SER H . 51949 1 56 . 1 . 1 19 19 SER C C 13 174.715 0.3 . 1 . . . . . 19 SER C . 51949 1 57 . 1 . 1 19 19 SER CA C 13 58.447 0.3 . 1 . . . . . 19 SER CA . 51949 1 58 . 1 . 1 19 19 SER CB C 13 63.686 0.3 . 1 . . . . . 19 SER CB . 51949 1 59 . 1 . 1 19 19 SER N N 15 115.678 0.3 . 1 . . . . . 19 SER N . 51949 1 60 . 1 . 1 20 20 GLU H H 1 8.680 0.020 . 1 . . . . . 20 GLU H . 51949 1 61 . 1 . 1 20 20 GLU C C 13 176.808 0.3 . 1 . . . . . 20 GLU C . 51949 1 62 . 1 . 1 20 20 GLU CA C 13 56.996 0.3 . 1 . . . . . 20 GLU CA . 51949 1 63 . 1 . 1 20 20 GLU CB C 13 29.644 0.3 . 1 . . . . . 20 GLU CB . 51949 1 64 . 1 . 1 20 20 GLU N N 15 122.853 0.3 . 1 . . . . . 20 GLU N . 51949 1 65 . 1 . 1 21 21 THR H H 1 8.170 0.020 . 1 . . . . . 21 THR H . 51949 1 66 . 1 . 1 21 21 THR C C 13 174.761 0.3 . 1 . . . . . 21 THR C . 51949 1 67 . 1 . 1 21 21 THR CA C 13 62.053 0.3 . 1 . . . . . 21 THR CA . 51949 1 68 . 1 . 1 21 21 THR CB C 13 69.405 0.3 . 1 . . . . . 21 THR CB . 51949 1 69 . 1 . 1 21 21 THR N N 15 114.605 0.3 . 1 . . . . . 21 THR N . 51949 1 70 . 1 . 1 22 22 SER H H 1 8.313 0.020 . 1 . . . . . 22 SER H . 51949 1 71 . 1 . 1 22 22 SER C C 13 174.842 0.3 . 1 . . . . . 22 SER C . 51949 1 72 . 1 . 1 22 22 SER CA C 13 58.571 0.3 . 1 . . . . . 22 SER CA . 51949 1 73 . 1 . 1 22 22 SER CB C 13 63.517 0.3 . 1 . . . . . 22 SER CB . 51949 1 74 . 1 . 1 22 22 SER N N 15 118.263 0.3 . 1 . . . . . 22 SER N . 51949 1 75 . 1 . 1 23 23 SER H H 1 8.374 0.020 . 1 . . . . . 23 SER H . 51949 1 76 . 1 . 1 23 23 SER C C 13 174.670 0.3 . 1 . . . . . 23 SER C . 51949 1 77 . 1 . 1 23 23 SER CA C 13 58.587 0.3 . 1 . . . . . 23 SER CA . 51949 1 78 . 1 . 1 23 23 SER CB C 13 63.560 0.3 . 1 . . . . . 23 SER CB . 51949 1 79 . 1 . 1 23 23 SER N N 15 118.070 0.3 . 1 . . . . . 23 SER N . 51949 1 80 . 1 . 1 24 24 LEU H H 1 8.158 0.020 . 1 . . . . . 24 LEU H . 51949 1 81 . 1 . 1 24 24 LEU C C 13 177.462 0.3 . 1 . . . . . 24 LEU C . 51949 1 82 . 1 . 1 24 24 LEU CA C 13 55.537 0.3 . 1 . . . . . 24 LEU CA . 51949 1 83 . 1 . 1 24 24 LEU CB C 13 41.798 0.3 . 1 . . . . . 24 LEU CB . 51949 1 84 . 1 . 1 24 24 LEU N N 15 123.763 0.3 . 1 . . . . . 24 LEU N . 51949 1 85 . 1 . 1 25 25 GLN H H 1 8.222 0.020 . 1 . . . . . 25 GLN H . 51949 1 86 . 1 . 1 25 25 GLN C C 13 175.762 0.3 . 1 . . . . . 25 GLN C . 51949 1 87 . 1 . 1 25 25 GLN CA C 13 55.920 0.3 . 1 . . . . . 25 GLN CA . 51949 1 88 . 1 . 1 25 25 GLN CB C 13 29.001 0.3 . 1 . . . . . 25 GLN CB . 51949 1 89 . 1 . 1 25 25 GLN N N 15 120.766 0.3 . 1 . . . . . 25 GLN N . 51949 1 90 . 1 . 1 26 26 ALA H H 1 8.248 0.020 . 1 . . . . . 26 ALA H . 51949 1 91 . 1 . 1 26 26 ALA C C 13 177.881 0.3 . 1 . . . . . 26 ALA C . 51949 1 92 . 1 . 1 26 26 ALA CA C 13 52.736 0.3 . 1 . . . . . 26 ALA CA . 51949 1 93 . 1 . 1 26 26 ALA CB C 13 18.885 0.3 . 1 . . . . . 26 ALA CB . 51949 1 94 . 1 . 1 26 26 ALA N N 15 124.914 0.3 . 1 . . . . . 26 ALA N . 51949 1 95 . 1 . 1 27 27 SER H H 1 8.274 0.020 . 1 . . . . . 27 SER H . 51949 1 96 . 1 . 1 27 27 SER C C 13 174.912 0.3 . 1 . . . . . 27 SER C . 51949 1 97 . 1 . 1 27 27 SER CA C 13 58.583 0.3 . 1 . . . . . 27 SER CA . 51949 1 98 . 1 . 1 27 27 SER CB C 13 63.432 0.3 . 1 . . . . . 27 SER CB . 51949 1 99 . 1 . 1 27 27 SER N N 15 115.081 0.3 . 1 . . . . . 27 SER N . 51949 1 100 . 1 . 1 28 28 GLN H H 1 8.423 0.020 . 1 . . . . . 28 GLN H . 51949 1 101 . 1 . 1 28 28 GLN C C 13 175.975 0.3 . 1 . . . . . 28 GLN C . 51949 1 102 . 1 . 1 28 28 GLN CA C 13 56.326 0.3 . 1 . . . . . 28 GLN CA . 51949 1 103 . 1 . 1 28 28 GLN CB C 13 28.952 0.3 . 1 . . . . . 28 GLN CB . 51949 1 104 . 1 . 1 28 28 GLN N N 15 122.299 0.3 . 1 . . . . . 28 GLN N . 51949 1 105 . 1 . 1 29 29 ASP H H 1 8.301 0.020 . 1 . . . . . 29 ASP H . 51949 1 106 . 1 . 1 29 29 ASP C C 13 176.603 0.3 . 1 . . . . . 29 ASP C . 51949 1 107 . 1 . 1 29 29 ASP CA C 13 54.998 0.3 . 1 . . . . . 29 ASP CA . 51949 1 108 . 1 . 1 29 29 ASP CB C 13 40.935 0.3 . 1 . . . . . 29 ASP CB . 51949 1 109 . 1 . 1 29 29 ASP N N 15 120.928 0.3 . 1 . . . . . 29 ASP N . 51949 1 110 . 1 . 1 30 30 GLU H H 1 8.269 0.020 . 1 . . . . . 30 GLU H . 51949 1 111 . 1 . 1 30 30 GLU C C 13 176.874 0.3 . 1 . . . . . 30 GLU C . 51949 1 112 . 1 . 1 30 30 GLU CA C 13 57.389 0.3 . 1 . . . . . 30 GLU CA . 51949 1 113 . 1 . 1 30 30 GLU CB C 13 29.649 0.3 . 1 . . . . . 30 GLU CB . 51949 1 114 . 1 . 1 30 30 GLU N N 15 120.878 0.3 . 1 . . . . . 30 GLU N . 51949 1 115 . 1 . 1 31 31 PHE H H 1 8.173 0.020 . 1 . . . . . 31 PHE H . 51949 1 116 . 1 . 1 31 31 PHE C C 13 176.324 0.3 . 1 . . . . . 31 PHE C . 51949 1 117 . 1 . 1 31 31 PHE CA C 13 58.714 0.3 . 1 . . . . . 31 PHE CA . 51949 1 118 . 1 . 1 31 31 PHE CB C 13 38.928 0.3 . 1 . . . . . 31 PHE CB . 51949 1 119 . 1 . 1 31 31 PHE N N 15 119.920 0.3 . 1 . . . . . 31 PHE N . 51949 1 120 . 1 . 1 32 32 GLU H H 1 8.245 0.020 . 1 . . . . . 32 GLU H . 51949 1 121 . 1 . 1 32 32 GLU C C 13 176.691 0.3 . 1 . . . . . 32 GLU C . 51949 1 122 . 1 . 1 32 32 GLU CA C 13 57.521 0.3 . 1 . . . . . 32 GLU CA . 51949 1 123 . 1 . 1 32 32 GLU CB C 13 29.689 0.3 . 1 . . . . . 32 GLU CB . 51949 1 124 . 1 . 1 32 32 GLU N N 15 120.464 0.3 . 1 . . . . . 32 GLU N . 51949 1 125 . 1 . 1 33 33 ASN H H 1 8.224 0.020 . 1 . . . . . 33 ASN H . 51949 1 126 . 1 . 1 33 33 ASN C C 13 175.409 0.3 . 1 . . . . . 33 ASN C . 51949 1 127 . 1 . 1 33 33 ASN CA C 13 53.808 0.3 . 1 . . . . . 33 ASN CA . 51949 1 128 . 1 . 1 33 33 ASN CB C 13 38.383 0.3 . 1 . . . . . 33 ASN CB . 51949 1 129 . 1 . 1 33 33 ASN N N 15 118.205 0.3 . 1 . . . . . 33 ASN N . 51949 1 130 . 1 . 1 34 34 LEU H H 1 7.989 0.020 . 1 . . . . . 34 LEU H . 51949 1 131 . 1 . 1 34 34 LEU C C 13 177.645 0.3 . 1 . . . . . 34 LEU C . 51949 1 132 . 1 . 1 34 34 LEU CA C 13 56.068 0.3 . 1 . . . . . 34 LEU CA . 51949 1 133 . 1 . 1 34 34 LEU CB C 13 41.936 0.3 . 1 . . . . . 34 LEU CB . 51949 1 134 . 1 . 1 34 34 LEU N N 15 121.876 0.3 . 1 . . . . . 34 LEU N . 51949 1 135 . 1 . 1 35 35 VAL H H 1 7.962 0.020 . 1 . . . . . 35 VAL H . 51949 1 136 . 1 . 1 35 35 VAL C C 13 176.459 0.3 . 1 . . . . . 35 VAL C . 51949 1 137 . 1 . 1 35 35 VAL CA C 13 63.098 0.3 . 1 . . . . . 35 VAL CA . 51949 1 138 . 1 . 1 35 35 VAL CB C 13 31.866 0.3 . 1 . . . . . 35 VAL CB . 51949 1 139 . 1 . 1 35 35 VAL N N 15 119.416 0.3 . 1 . . . . . 35 VAL N . 51949 1 140 . 1 . 1 36 36 ARG H H 1 8.156 0.020 . 1 . . . . . 36 ARG H . 51949 1 141 . 1 . 1 36 36 ARG C C 13 176.377 0.3 . 1 . . . . . 36 ARG C . 51949 1 142 . 1 . 1 36 36 ARG CA C 13 56.695 0.3 . 1 . . . . . 36 ARG CA . 51949 1 143 . 1 . 1 36 36 ARG CB C 13 30.374 0.3 . 1 . . . . . 36 ARG CB . 51949 1 144 . 1 . 1 36 36 ARG N N 15 123.079 0.3 . 1 . . . . . 36 ARG N . 51949 1 145 . 1 . 1 37 37 ASN H H 1 8.433 0.020 . 1 . . . . . 37 ASN H . 51949 1 146 . 1 . 1 37 37 ASN CA C 13 54.215 0.3 . 1 . . . . . 37 ASN CA . 51949 1 147 . 1 . 1 37 37 ASN N N 15 119.126 0.3 . 1 . . . . . 37 ASN N . 51949 1 148 . 1 . 1 38 38 VAL H H 1 8.082 0.020 . 1 . . . . . 38 VAL H . 51949 1 149 . 1 . 1 38 38 VAL CA C 13 63.091 0.3 . 1 . . . . . 38 VAL CA . 51949 1 150 . 1 . 1 38 38 VAL CB C 13 32.425 0.3 . 1 . . . . . 38 VAL CB . 51949 1 151 . 1 . 1 38 38 VAL N N 15 119.442 0.3 . 1 . . . . . 38 VAL N . 51949 1 152 . 1 . 1 39 39 ASP H H 1 8.322 0.020 . 1 . . . . . 39 ASP H . 51949 1 153 . 1 . 1 39 39 ASP CA C 13 54.338 0.3 . 1 . . . . . 39 ASP CA . 51949 1 154 . 1 . 1 39 39 ASP N N 15 124.346 0.3 . 1 . . . . . 39 ASP N . 51949 1 155 . 1 . 1 40 40 VAL H H 1 8.086 0.020 . 1 . . . . . 40 VAL H . 51949 1 156 . 1 . 1 40 40 VAL C C 13 177.531 0.3 . 1 . . . . . 40 VAL C . 51949 1 157 . 1 . 1 40 40 VAL CA C 13 66.948 0.3 . 1 . . . . . 40 VAL CA . 51949 1 158 . 1 . 1 40 40 VAL N N 15 122.598 0.3 . 1 . . . . . 40 VAL N . 51949 1 159 . 1 . 1 41 41 LYS H H 1 8.381 0.020 . 1 . . . . . 41 LYS H . 51949 1 160 . 1 . 1 41 41 LYS C C 13 178.002 0.3 . 1 . . . . . 41 LYS C . 51949 1 161 . 1 . 1 41 41 LYS CA C 13 60.568 0.3 . 1 . . . . . 41 LYS CA . 51949 1 162 . 1 . 1 41 41 LYS N N 15 118.465 0.3 . 1 . . . . . 41 LYS N . 51949 1 163 . 1 . 1 42 42 SER H H 1 8.164 0.020 . 1 . . . . . 42 SER H . 51949 1 164 . 1 . 1 42 42 SER CA C 13 61.780 0.3 . 1 . . . . . 42 SER CA . 51949 1 165 . 1 . 1 42 42 SER N N 15 113.688 0.3 . 1 . . . . . 42 SER N . 51949 1 166 . 1 . 1 44 44 ILE H H 1 7.747 0.020 . 1 . . . . . 44 ILE H . 51949 1 167 . 1 . 1 44 44 ILE CA C 13 65.878 0.3 . 1 . . . . . 44 ILE CA . 51949 1 168 . 1 . 1 44 44 ILE N N 15 118.344 0.3 . 1 . . . . . 44 ILE N . 51949 1 169 . 1 . 1 45 45 MET H H 1 8.616 0.020 . 1 . . . . . 45 MET H . 51949 1 170 . 1 . 1 45 45 MET C C 13 180.107 0.3 . 1 . . . . . 45 MET C . 51949 1 171 . 1 . 1 45 45 MET CA C 13 56.176 0.3 . 1 . . . . . 45 MET CA . 51949 1 172 . 1 . 1 45 45 MET CB C 13 28.910 0.3 . 1 . . . . . 45 MET CB . 51949 1 173 . 1 . 1 45 45 MET N N 15 117.240 0.3 . 1 . . . . . 45 MET N . 51949 1 174 . 1 . 1 46 46 ASP H H 1 8.389 0.020 . 1 . . . . . 46 ASP H . 51949 1 175 . 1 . 1 46 46 ASP C C 13 178.667 0.3 . 1 . . . . . 46 ASP C . 51949 1 176 . 1 . 1 46 46 ASP CA C 13 57.380 0.3 . 1 . . . . . 46 ASP CA . 51949 1 177 . 1 . 1 46 46 ASP CB C 13 40.027 0.3 . 1 . . . . . 46 ASP CB . 51949 1 178 . 1 . 1 46 46 ASP N N 15 125.019 0.3 . 1 . . . . . 46 ASP N . 51949 1 179 . 1 . 1 47 47 GLN H H 1 7.609 0.020 . 1 . . . . . 47 GLN H . 51949 1 180 . 1 . 1 47 47 GLN CA C 13 59.384 0.3 . 1 . . . . . 47 GLN CA . 51949 1 181 . 1 . 1 47 47 GLN CB C 13 26.515 0.3 . 1 . . . . . 47 GLN CB . 51949 1 182 . 1 . 1 47 47 GLN N N 15 121.900 0.3 . 1 . . . . . 47 GLN N . 51949 1 183 . 1 . 1 48 48 TYR H H 1 8.904 0.020 . 1 . . . . . 48 TYR H . 51949 1 184 . 1 . 1 48 48 TYR CA C 13 61.889 0.3 . 1 . . . . . 48 TYR CA . 51949 1 185 . 1 . 1 48 48 TYR N N 15 118.277 0.3 . 1 . . . . . 48 TYR N . 51949 1 186 . 1 . 1 49 49 ALA H H 1 8.442 0.020 . 1 . . . . . 49 ALA H . 51949 1 187 . 1 . 1 49 49 ALA C C 13 179.494 0.3 . 1 . . . . . 49 ALA C . 51949 1 188 . 1 . 1 49 49 ALA CA C 13 55.120 0.3 . 1 . . . . . 49 ALA CA . 51949 1 189 . 1 . 1 49 49 ALA CB C 13 17.518 0.3 . 1 . . . . . 49 ALA CB . 51949 1 190 . 1 . 1 49 49 ALA N N 15 119.869 0.3 . 1 . . . . . 49 ALA N . 51949 1 191 . 1 . 1 50 50 ASP H H 1 7.205 0.020 . 1 . . . . . 50 ASP H . 51949 1 192 . 1 . 1 50 50 ASP CA C 13 55.528 0.3 . 1 . . . . . 50 ASP CA . 51949 1 193 . 1 . 1 50 50 ASP CB C 13 42.344 0.3 . 1 . . . . . 50 ASP CB . 51949 1 194 . 1 . 1 50 50 ASP N N 15 114.338 0.3 . 1 . . . . . 50 ASP N . 51949 1 195 . 1 . 1 51 51 TRP H H 1 7.954 0.020 . 1 . . . . . 51 TRP H . 51949 1 196 . 1 . 1 51 51 TRP CA C 13 58.727 0.3 . 1 . . . . . 51 TRP CA . 51949 1 197 . 1 . 1 51 51 TRP CB C 13 30.287 0.3 . 1 . . . . . 51 TRP CB . 51949 1 198 . 1 . 1 51 51 TRP N N 15 118.145 0.3 . 1 . . . . . 51 TRP N . 51949 1 199 . 1 . 1 52 52 LYS H H 1 7.874 0.020 . 1 . . . . . 52 LYS H . 51949 1 200 . 1 . 1 52 52 LYS C C 13 177.728 0.3 . 1 . . . . . 52 LYS C . 51949 1 201 . 1 . 1 52 52 LYS CA C 13 58.181 0.3 . 1 . . . . . 52 LYS CA . 51949 1 202 . 1 . 1 52 52 LYS CB C 13 30.958 0.3 . 1 . . . . . 52 LYS CB . 51949 1 203 . 1 . 1 52 52 LYS N N 15 122.487 0.3 . 1 . . . . . 52 LYS N . 51949 1 204 . 1 . 1 53 53 GLY H H 1 9.046 0.020 . 1 . . . . . 53 GLY H . 51949 1 205 . 1 . 1 53 53 GLY CA C 13 44.893 0.3 . 1 . . . . . 53 GLY CA . 51949 1 206 . 1 . 1 53 53 GLY N N 15 113.604 0.3 . 1 . . . . . 53 GLY N . 51949 1 207 . 1 . 1 54 54 VAL H H 1 8.121 0.020 . 1 . . . . . 54 VAL H . 51949 1 208 . 1 . 1 54 54 VAL CA C 13 64.824 0.3 . 1 . . . . . 54 VAL CA . 51949 1 209 . 1 . 1 54 54 VAL N N 15 124.434 0.3 . 1 . . . . . 54 VAL N . 51949 1 210 . 1 . 1 55 55 ARG H H 1 8.200 0.020 . 1 . . . . . 55 ARG H . 51949 1 211 . 1 . 1 55 55 ARG C C 13 174.157 0.3 . 1 . . . . . 55 ARG C . 51949 1 212 . 1 . 1 55 55 ARG CA C 13 56.063 0.3 . 1 . . . . . 55 ARG CA . 51949 1 213 . 1 . 1 55 55 ARG CB C 13 31.033 0.3 . 1 . . . . . 55 ARG CB . 51949 1 214 . 1 . 1 55 55 ARG N N 15 125.718 0.3 . 1 . . . . . 55 ARG N . 51949 1 215 . 1 . 1 56 56 TYR H H 1 8.619 0.020 . 1 . . . . . 56 TYR H . 51949 1 216 . 1 . 1 56 56 TYR C C 13 177.244 0.3 . 1 . . . . . 56 TYR C . 51949 1 217 . 1 . 1 56 56 TYR CA C 13 57.772 0.3 . 1 . . . . . 56 TYR CA . 51949 1 218 . 1 . 1 56 56 TYR N N 15 121.332 0.3 . 1 . . . . . 56 TYR N . 51949 1 219 . 1 . 1 57 57 ARG H H 1 6.782 0.020 . 1 . . . . . 57 ARG H . 51949 1 220 . 1 . 1 57 57 ARG CA C 13 55.362 0.3 . 1 . . . . . 57 ARG CA . 51949 1 221 . 1 . 1 57 57 ARG N N 15 128.290 0.3 . 1 . . . . . 57 ARG N . 51949 1 222 . 1 . 1 58 58 LEU H H 1 9.072 0.020 . 1 . . . . . 58 LEU H . 51949 1 223 . 1 . 1 58 58 LEU CA C 13 57.502 0.3 . 1 . . . . . 58 LEU CA . 51949 1 224 . 1 . 1 58 58 LEU N N 15 131.151 0.3 . 1 . . . . . 58 LEU N . 51949 1 225 . 1 . 1 59 59 GLY H H 1 9.583 0.020 . 1 . . . . . 59 GLY H . 51949 1 226 . 1 . 1 59 59 GLY CA C 13 45.310 0.3 . 1 . . . . . 59 GLY CA . 51949 1 227 . 1 . 1 59 59 GLY N N 15 117.864 0.3 . 1 . . . . . 59 GLY N . 51949 1 228 . 1 . 1 60 60 GLY H H 1 8.164 0.020 . 1 . . . . . 60 GLY H . 51949 1 229 . 1 . 1 60 60 GLY CA C 13 45.549 0.3 . 1 . . . . . 60 GLY CA . 51949 1 230 . 1 . 1 60 60 GLY N N 15 109.273 0.3 . 1 . . . . . 60 GLY N . 51949 1 231 . 1 . 1 61 61 SER H H 1 8.586 0.020 . 1 . . . . . 61 SER H . 51949 1 232 . 1 . 1 61 61 SER CA C 13 57.756 0.3 . 1 . . . . . 61 SER CA . 51949 1 233 . 1 . 1 61 61 SER CB C 13 64.296 0.3 . 1 . . . . . 61 SER CB . 51949 1 234 . 1 . 1 61 61 SER N N 15 113.952 0.3 . 1 . . . . . 61 SER N . 51949 1 235 . 1 . 1 62 62 THR H H 1 7.820 0.020 . 1 . . . . . 62 THR H . 51949 1 236 . 1 . 1 62 62 THR CA C 13 60.646 0.3 . 1 . . . . . 62 THR CA . 51949 1 237 . 1 . 1 62 62 THR N N 15 110.303 0.3 . 1 . . . . . 62 THR N . 51949 1 238 . 1 . 1 64 64 LYS H H 1 8.040 0.020 . 1 . . . . . 64 LYS H . 51949 1 239 . 1 . 1 64 64 LYS C C 13 176.891 0.3 . 1 . . . . . 64 LYS C . 51949 1 240 . 1 . 1 64 64 LYS CA C 13 56.321 0.3 . 1 . . . . . 64 LYS CA . 51949 1 241 . 1 . 1 64 64 LYS CB C 13 31.851 0.3 . 1 . . . . . 64 LYS CB . 51949 1 242 . 1 . 1 64 64 LYS N N 15 117.821 0.3 . 1 . . . . . 64 LYS N . 51949 1 243 . 1 . 1 65 65 GLY H H 1 7.648 0.020 . 1 . . . . . 65 GLY H . 51949 1 244 . 1 . 1 65 65 GLY C C 13 171.880 0.3 . 1 . . . . . 65 GLY C . 51949 1 245 . 1 . 1 65 65 GLY CA C 13 46.364 0.3 . 1 . . . . . 65 GLY CA . 51949 1 246 . 1 . 1 65 65 GLY N N 15 109.629 0.3 . 1 . . . . . 65 GLY N . 51949 1 247 . 1 . 1 66 66 ILE H H 1 8.990 0.020 . 1 . . . . . 66 ILE H . 51949 1 248 . 1 . 1 66 66 ILE CA C 13 58.681 0.3 . 1 . . . . . 66 ILE CA . 51949 1 249 . 1 . 1 66 66 ILE N N 15 129.216 0.3 . 1 . . . . . 66 ILE N . 51949 1 250 . 1 . 1 67 67 ASP H H 1 6.989 0.020 . 1 . . . . . 67 ASP H . 51949 1 251 . 1 . 1 67 67 ASP CA C 13 51.064 0.3 . 1 . . . . . 67 ASP CA . 51949 1 252 . 1 . 1 67 67 ASP CB C 13 41.526 0.3 . 1 . . . . . 67 ASP CB . 51949 1 253 . 1 . 1 67 67 ASP N N 15 121.981 0.3 . 1 . . . . . 67 ASP N . 51949 1 254 . 1 . 1 68 68 CYS H H 1 8.167 0.020 . 1 . . . . . 68 CYS H . 51949 1 255 . 1 . 1 68 68 CYS CA C 13 61.758 0.3 . 1 . . . . . 68 CYS CA . 51949 1 256 . 1 . 1 68 68 CYS N N 15 113.841 0.3 . 1 . . . . . 68 CYS N . 51949 1 257 . 1 . 1 69 69 SER H H 1 7.640 0.020 . 1 . . . . . 69 SER H . 51949 1 258 . 1 . 1 69 69 SER CA C 13 59.670 0.3 . 1 . . . . . 69 SER CA . 51949 1 259 . 1 . 1 69 69 SER N N 15 120.066 0.3 . 1 . . . . . 69 SER N . 51949 1 260 . 1 . 1 70 70 GLY H H 1 8.915 0.020 . 1 . . . . . 70 GLY H . 51949 1 261 . 1 . 1 70 70 GLY CA C 13 46.882 0.3 . 1 . . . . . 70 GLY CA . 51949 1 262 . 1 . 1 70 70 GLY N N 15 117.228 0.3 . 1 . . . . . 70 GLY N . 51949 1 263 . 1 . 1 71 71 PHE H H 1 8.737 0.020 . 1 . . . . . 71 PHE H . 51949 1 264 . 1 . 1 71 71 PHE CA C 13 62.002 0.3 . 1 . . . . . 71 PHE CA . 51949 1 265 . 1 . 1 71 71 PHE CB C 13 38.641 0.3 . 1 . . . . . 71 PHE CB . 51949 1 266 . 1 . 1 71 71 PHE N N 15 123.368 0.3 . 1 . . . . . 71 PHE N . 51949 1 267 . 1 . 1 72 72 VAL H H 1 7.654 0.020 . 1 . . . . . 72 VAL H . 51949 1 268 . 1 . 1 72 72 VAL C C 13 176.603 0.3 . 1 . . . . . 72 VAL C . 51949 1 269 . 1 . 1 72 72 VAL CA C 13 67.726 0.3 . 1 . . . . . 72 VAL CA . 51949 1 270 . 1 . 1 72 72 VAL CB C 13 31.702 0.3 . 1 . . . . . 72 VAL CB . 51949 1 271 . 1 . 1 72 72 VAL N N 15 122.858 0.3 . 1 . . . . . 72 VAL N . 51949 1 272 . 1 . 1 73 73 GLN H H 1 8.534 0.020 . 1 . . . . . 73 GLN H . 51949 1 273 . 1 . 1 73 73 GLN CA C 13 59.421 0.3 . 1 . . . . . 73 GLN CA . 51949 1 274 . 1 . 1 73 73 GLN CB C 13 29.010 0.3 . 1 . . . . . 73 GLN CB . 51949 1 275 . 1 . 1 73 73 GLN N N 15 119.082 0.3 . 1 . . . . . 73 GLN N . 51949 1 276 . 1 . 1 74 74 ARG H H 1 8.376 0.020 . 1 . . . . . 74 ARG H . 51949 1 277 . 1 . 1 74 74 ARG CA C 13 60.322 0.3 . 1 . . . . . 74 ARG CA . 51949 1 278 . 1 . 1 74 74 ARG N N 15 118.799 0.3 . 1 . . . . . 74 ARG N . 51949 1 279 . 1 . 1 75 75 THR H H 1 7.534 0.020 . 1 . . . . . 75 THR H . 51949 1 280 . 1 . 1 75 75 THR CA C 13 67.512 0.3 . 1 . . . . . 75 THR CA . 51949 1 281 . 1 . 1 75 75 THR N N 15 115.010 0.3 . 1 . . . . . 75 THR N . 51949 1 282 . 1 . 1 76 76 PHE H H 1 8.119 0.020 . 1 . . . . . 76 PHE H . 51949 1 283 . 1 . 1 76 76 PHE C C 13 178.554 0.3 . 1 . . . . . 76 PHE C . 51949 1 284 . 1 . 1 76 76 PHE CA C 13 63.487 0.3 . 1 . . . . . 76 PHE CA . 51949 1 285 . 1 . 1 76 76 PHE CB C 13 37.801 0.3 . 1 . . . . . 76 PHE CB . 51949 1 286 . 1 . 1 76 76 PHE N N 15 117.643 0.3 . 1 . . . . . 76 PHE N . 51949 1 287 . 1 . 1 77 77 ARG H H 1 7.796 0.020 . 1 . . . . . 77 ARG H . 51949 1 288 . 1 . 1 77 77 ARG C C 13 178.787 0.3 . 1 . . . . . 77 ARG C . 51949 1 289 . 1 . 1 77 77 ARG CA C 13 60.017 0.3 . 1 . . . . . 77 ARG CA . 51949 1 290 . 1 . 1 77 77 ARG CB C 13 30.762 0.3 . 1 . . . . . 77 ARG CB . 51949 1 291 . 1 . 1 77 77 ARG N N 15 121.717 0.3 . 1 . . . . . 77 ARG N . 51949 1 292 . 1 . 1 78 78 GLU H H 1 8.479 0.020 . 1 . . . . . 78 GLU H . 51949 1 293 . 1 . 1 78 78 GLU CA C 13 59.256 0.3 . 1 . . . . . 78 GLU CA . 51949 1 294 . 1 . 1 78 78 GLU CB C 13 29.037 0.3 . 1 . . . . . 78 GLU CB . 51949 1 295 . 1 . 1 78 78 GLU N N 15 117.162 0.3 . 1 . . . . . 78 GLU N . 51949 1 296 . 1 . 1 79 79 GLN H H 1 8.015 0.020 . 1 . . . . . 79 GLN H . 51949 1 297 . 1 . 1 79 79 GLN C C 13 177.013 0.3 . 1 . . . . . 79 GLN C . 51949 1 298 . 1 . 1 79 79 GLN CA C 13 55.386 0.3 . 1 . . . . . 79 GLN CA . 51949 1 299 . 1 . 1 79 79 GLN CB C 13 27.534 0.3 . 1 . . . . . 79 GLN CB . 51949 1 300 . 1 . 1 79 79 GLN N N 15 110.659 0.3 . 1 . . . . . 79 GLN N . 51949 1 301 . 1 . 1 80 80 PHE H H 1 6.638 0.020 . 1 . . . . . 80 PHE H . 51949 1 302 . 1 . 1 80 80 PHE C C 13 175.242 0.3 . 1 . . . . . 80 PHE C . 51949 1 303 . 1 . 1 80 80 PHE CA C 13 56.741 0.3 . 1 . . . . . 80 PHE CA . 51949 1 304 . 1 . 1 80 80 PHE CB C 13 41.005 0.3 . 1 . . . . . 80 PHE CB . 51949 1 305 . 1 . 1 80 80 PHE N N 15 111.224 0.3 . 1 . . . . . 80 PHE N . 51949 1 306 . 1 . 1 81 81 GLY H H 1 7.505 0.020 . 1 . . . . . 81 GLY H . 51949 1 307 . 1 . 1 81 81 GLY C C 13 173.411 0.3 . 1 . . . . . 81 GLY C . 51949 1 308 . 1 . 1 81 81 GLY CA C 13 46.817 0.3 . 1 . . . . . 81 GLY CA . 51949 1 309 . 1 . 1 81 81 GLY N N 15 109.835 0.3 . 1 . . . . . 81 GLY N . 51949 1 310 . 1 . 1 82 82 LEU H H 1 7.602 0.020 . 1 . . . . . 82 LEU H . 51949 1 311 . 1 . 1 82 82 LEU C C 13 175.050 0.3 . 1 . . . . . 82 LEU C . 51949 1 312 . 1 . 1 82 82 LEU CA C 13 53.532 0.3 . 1 . . . . . 82 LEU CA . 51949 1 313 . 1 . 1 82 82 LEU CB C 13 44.668 0.3 . 1 . . . . . 82 LEU CB . 51949 1 314 . 1 . 1 82 82 LEU N N 15 122.057 0.3 . 1 . . . . . 82 LEU N . 51949 1 315 . 1 . 1 83 83 GLU H H 1 8.724 0.020 . 1 . . . . . 83 GLU H . 51949 1 316 . 1 . 1 83 83 GLU C C 13 174.641 0.3 . 1 . . . . . 83 GLU C . 51949 1 317 . 1 . 1 83 83 GLU CA C 13 55.287 0.3 . 1 . . . . . 83 GLU CA . 51949 1 318 . 1 . 1 83 83 GLU CB C 13 29.084 0.3 . 1 . . . . . 83 GLU CB . 51949 1 319 . 1 . 1 83 83 GLU N N 15 126.611 0.3 . 1 . . . . . 83 GLU N . 51949 1 320 . 1 . 1 84 84 LEU H H 1 8.837 0.020 . 1 . . . . . 84 LEU H . 51949 1 321 . 1 . 1 84 84 LEU C C 13 174.065 0.3 . 1 . . . . . 84 LEU C . 51949 1 322 . 1 . 1 84 84 LEU CA C 13 51.694 0.3 . 1 . . . . . 84 LEU CA . 51949 1 323 . 1 . 1 84 84 LEU CB C 13 42.370 0.3 . 1 . . . . . 84 LEU CB . 51949 1 324 . 1 . 1 84 84 LEU N N 15 128.054 0.3 . 1 . . . . . 84 LEU N . 51949 1 325 . 1 . 1 86 86 ARG H H 1 8.348 0.020 . 1 . . . . . 86 ARG H . 51949 1 326 . 1 . 1 86 86 ARG C C 13 176.504 0.3 . 1 . . . . . 86 ARG C . 51949 1 327 . 1 . 1 86 86 ARG CA C 13 56.609 0.3 . 1 . . . . . 86 ARG CA . 51949 1 328 . 1 . 1 86 86 ARG N N 15 117.285 0.3 . 1 . . . . . 86 ARG N . 51949 1 329 . 1 . 1 87 87 SER H H 1 7.731 0.020 . 1 . . . . . 87 SER H . 51949 1 330 . 1 . 1 87 87 SER CA C 13 56.843 0.3 . 1 . . . . . 87 SER CA . 51949 1 331 . 1 . 1 87 87 SER CB C 13 65.438 0.3 . 1 . . . . . 87 SER CB . 51949 1 332 . 1 . 1 87 87 SER N N 15 111.139 0.3 . 1 . . . . . 87 SER N . 51949 1 333 . 1 . 1 89 89 TYR H H 1 7.838 0.020 . 1 . . . . . 89 TYR H . 51949 1 334 . 1 . 1 89 89 TYR C C 13 177.348 0.3 . 1 . . . . . 89 TYR C . 51949 1 335 . 1 . 1 89 89 TYR CA C 13 60.712 0.3 . 1 . . . . . 89 TYR CA . 51949 1 336 . 1 . 1 89 89 TYR CB C 13 37.522 0.3 . 1 . . . . . 89 TYR CB . 51949 1 337 . 1 . 1 89 89 TYR N N 15 117.474 0.3 . 1 . . . . . 89 TYR N . 51949 1 338 . 1 . 1 90 90 GLU H H 1 7.275 0.020 . 1 . . . . . 90 GLU H . 51949 1 339 . 1 . 1 90 90 GLU C C 13 180.121 0.3 . 1 . . . . . 90 GLU C . 51949 1 340 . 1 . 1 90 90 GLU CA C 13 58.325 0.3 . 1 . . . . . 90 GLU CA . 51949 1 341 . 1 . 1 90 90 GLU CB C 13 30.954 0.3 . 1 . . . . . 90 GLU CB . 51949 1 342 . 1 . 1 90 90 GLU N N 15 116.246 0.3 . 1 . . . . . 90 GLU N . 51949 1 343 . 1 . 1 91 91 GLN H H 1 8.134 0.020 . 1 . . . . . 91 GLN H . 51949 1 344 . 1 . 1 91 91 GLN CA C 13 60.182 0.3 . 1 . . . . . 91 GLN CA . 51949 1 345 . 1 . 1 91 91 GLN CB C 13 26.565 0.3 . 1 . . . . . 91 GLN CB . 51949 1 346 . 1 . 1 91 91 GLN N N 15 121.292 0.3 . 1 . . . . . 91 GLN N . 51949 1 347 . 1 . 1 92 92 GLN H H 1 7.643 0.020 . 1 . . . . . 92 GLN H . 51949 1 348 . 1 . 1 92 92 GLN C C 13 174.405 0.3 . 1 . . . . . 92 GLN C . 51949 1 349 . 1 . 1 92 92 GLN CA C 13 57.510 0.3 . 1 . . . . . 92 GLN CA . 51949 1 350 . 1 . 1 92 92 GLN CB C 13 27.534 0.3 . 1 . . . . . 92 GLN CB . 51949 1 351 . 1 . 1 92 92 GLN N N 15 113.262 0.3 . 1 . . . . . 92 GLN N . 51949 1 352 . 1 . 1 93 93 GLU H H 1 6.738 0.020 . 1 . . . . . 93 GLU H . 51949 1 353 . 1 . 1 93 93 GLU C C 13 176.877 0.3 . 1 . . . . . 93 GLU C . 51949 1 354 . 1 . 1 93 93 GLU CA C 13 54.818 0.3 . 1 . . . . . 93 GLU CA . 51949 1 355 . 1 . 1 93 93 GLU CB C 13 29.916 0.3 . 1 . . . . . 93 GLU CB . 51949 1 356 . 1 . 1 93 93 GLU N N 15 113.332 0.3 . 1 . . . . . 93 GLU N . 51949 1 357 . 1 . 1 94 94 MET H H 1 7.179 0.020 . 1 . . . . . 94 MET H . 51949 1 358 . 1 . 1 94 94 MET C C 13 177.056 0.3 . 1 . . . . . 94 MET C . 51949 1 359 . 1 . 1 94 94 MET CA C 13 53.698 0.3 . 1 . . . . . 94 MET CA . 51949 1 360 . 1 . 1 94 94 MET N N 15 117.770 0.3 . 1 . . . . . 94 MET N . 51949 1 361 . 1 . 1 95 95 GLY H H 1 8.598 0.020 . 1 . . . . . 95 GLY H . 51949 1 362 . 1 . 1 95 95 GLY C C 13 173.467 0.3 . 1 . . . . . 95 GLY C . 51949 1 363 . 1 . 1 95 95 GLY CA C 13 45.823 0.3 . 1 . . . . . 95 GLY CA . 51949 1 364 . 1 . 1 95 95 GLY N N 15 107.542 0.3 . 1 . . . . . 95 GLY N . 51949 1 365 . 1 . 1 96 96 LYS H H 1 7.881 0.020 . 1 . . . . . 96 LYS H . 51949 1 366 . 1 . 1 96 96 LYS C C 13 175.491 0.3 . 1 . . . . . 96 LYS C . 51949 1 367 . 1 . 1 96 96 LYS CA C 13 53.534 0.3 . 1 . . . . . 96 LYS CA . 51949 1 368 . 1 . 1 96 96 LYS CB C 13 35.331 0.3 . 1 . . . . . 96 LYS CB . 51949 1 369 . 1 . 1 96 96 LYS N N 15 120.003 0.3 . 1 . . . . . 96 LYS N . 51949 1 370 . 1 . 1 97 97 SER H H 1 8.709 0.020 . 1 . . . . . 97 SER H . 51949 1 371 . 1 . 1 97 97 SER CA C 13 59.115 0.3 . 1 . . . . . 97 SER CA . 51949 1 372 . 1 . 1 97 97 SER CB C 13 63.289 0.3 . 1 . . . . . 97 SER CB . 51949 1 373 . 1 . 1 97 97 SER N N 15 117.908 0.3 . 1 . . . . . 97 SER N . 51949 1 374 . 1 . 1 98 98 VAL H H 1 7.810 0.020 . 1 . . . . . 98 VAL H . 51949 1 375 . 1 . 1 98 98 VAL C C 13 174.994 0.3 . 1 . . . . . 98 VAL C . 51949 1 376 . 1 . 1 98 98 VAL CA C 13 60.054 0.3 . 1 . . . . . 98 VAL CA . 51949 1 377 . 1 . 1 98 98 VAL CB C 13 35.470 0.3 . 1 . . . . . 98 VAL CB . 51949 1 378 . 1 . 1 98 98 VAL N N 15 122.861 0.3 . 1 . . . . . 98 VAL N . 51949 1 379 . 1 . 1 99 99 SER H H 1 8.600 0.020 . 1 . . . . . 99 SER H . 51949 1 380 . 1 . 1 99 99 SER C C 13 175.112 0.3 . 1 . . . . . 99 SER C . 51949 1 381 . 1 . 1 99 99 SER CA C 13 57.806 0.3 . 1 . . . . . 99 SER CA . 51949 1 382 . 1 . 1 99 99 SER CB C 13 63.956 0.3 . 1 . . . . . 99 SER CB . 51949 1 383 . 1 . 1 99 99 SER N N 15 120.977 0.3 . 1 . . . . . 99 SER N . 51949 1 384 . 1 . 1 100 100 ARG H H 1 8.729 0.020 . 1 . . . . . 100 ARG H . 51949 1 385 . 1 . 1 100 100 ARG C C 13 178.146 0.3 . 1 . . . . . 100 ARG C . 51949 1 386 . 1 . 1 100 100 ARG CA C 13 58.561 0.3 . 1 . . . . . 100 ARG CA . 51949 1 387 . 1 . 1 100 100 ARG CB C 13 29.223 0.3 . 1 . . . . . 100 ARG CB . 51949 1 388 . 1 . 1 100 100 ARG N N 15 123.975 0.3 . 1 . . . . . 100 ARG N . 51949 1 389 . 1 . 1 101 101 SER H H 1 8.130 0.020 . 1 . . . . . 101 SER H . 51949 1 390 . 1 . 1 101 101 SER CA C 13 59.752 0.3 . 1 . . . . . 101 SER CA . 51949 1 391 . 1 . 1 101 101 SER CB C 13 62.919 0.3 . 1 . . . . . 101 SER CB . 51949 1 392 . 1 . 1 101 101 SER N N 15 111.346 0.3 . 1 . . . . . 101 SER N . 51949 1 393 . 1 . 1 102 102 ASN H H 1 7.747 0.020 . 1 . . . . . 102 ASN H . 51949 1 394 . 1 . 1 102 102 ASN C C 13 173.796 0.3 . 1 . . . . . 102 ASN C . 51949 1 395 . 1 . 1 102 102 ASN CA C 13 52.200 0.3 . 1 . . . . . 102 ASN CA . 51949 1 396 . 1 . 1 102 102 ASN CB C 13 39.952 0.3 . 1 . . . . . 102 ASN CB . 51949 1 397 . 1 . 1 102 102 ASN N N 15 119.715 0.3 . 1 . . . . . 102 ASN N . 51949 1 398 . 1 . 1 103 103 LEU H H 1 6.767 0.020 . 1 . . . . . 103 LEU H . 51949 1 399 . 1 . 1 103 103 LEU C C 13 176.537 0.3 . 1 . . . . . 103 LEU C . 51949 1 400 . 1 . 1 103 103 LEU CA C 13 56.051 0.3 . 1 . . . . . 103 LEU CA . 51949 1 401 . 1 . 1 103 103 LEU CB C 13 42.777 0.3 . 1 . . . . . 103 LEU CB . 51949 1 402 . 1 . 1 103 103 LEU N N 15 120.046 0.3 . 1 . . . . . 103 LEU N . 51949 1 403 . 1 . 1 104 104 ARG H H 1 9.058 0.020 . 1 . . . . . 104 ARG H . 51949 1 404 . 1 . 1 104 104 ARG C C 13 175.253 0.3 . 1 . . . . . 104 ARG C . 51949 1 405 . 1 . 1 104 104 ARG CA C 13 53.815 0.3 . 1 . . . . . 104 ARG CA . 51949 1 406 . 1 . 1 104 104 ARG CB C 13 34.398 0.3 . 1 . . . . . 104 ARG CB . 51949 1 407 . 1 . 1 104 104 ARG N N 15 123.343 0.3 . 1 . . . . . 104 ARG N . 51949 1 408 . 1 . 1 105 105 THR H H 1 8.693 0.020 . 1 . . . . . 105 THR H . 51949 1 409 . 1 . 1 105 105 THR C C 13 175.491 0.3 . 1 . . . . . 105 THR C . 51949 1 410 . 1 . 1 105 105 THR CA C 13 65.092 0.3 . 1 . . . . . 105 THR CA . 51949 1 411 . 1 . 1 105 105 THR CB C 13 67.932 0.3 . 1 . . . . . 105 THR CB . 51949 1 412 . 1 . 1 105 105 THR N N 15 118.381 0.3 . 1 . . . . . 105 THR N . 51949 1 413 . 1 . 1 106 106 GLY H H 1 9.406 0.020 . 1 . . . . . 106 GLY H . 51949 1 414 . 1 . 1 106 106 GLY CA C 13 44.764 0.3 . 1 . . . . . 106 GLY CA . 51949 1 415 . 1 . 1 106 106 GLY N N 15 114.705 0.3 . 1 . . . . . 106 GLY N . 51949 1 416 . 1 . 1 107 107 ASP H H 1 8.292 0.020 . 1 . . . . . 107 ASP H . 51949 1 417 . 1 . 1 107 107 ASP C C 13 175.824 0.3 . 1 . . . . . 107 ASP C . 51949 1 418 . 1 . 1 107 107 ASP CA C 13 55.263 0.3 . 1 . . . . . 107 ASP CA . 51949 1 419 . 1 . 1 107 107 ASP CB C 13 40.319 0.3 . 1 . . . . . 107 ASP CB . 51949 1 420 . 1 . 1 107 107 ASP N N 15 122.774 0.3 . 1 . . . . . 107 ASP N . 51949 1 421 . 1 . 1 108 108 LEU H H 1 9.247 0.020 . 1 . . . . . 108 LEU H . 51949 1 422 . 1 . 1 108 108 LEU C C 13 177.273 0.3 . 1 . . . . . 108 LEU C . 51949 1 423 . 1 . 1 108 108 LEU CA C 13 53.929 0.3 . 1 . . . . . 108 LEU CA . 51949 1 424 . 1 . 1 108 108 LEU CB C 13 42.044 0.3 . 1 . . . . . 108 LEU CB . 51949 1 425 . 1 . 1 108 108 LEU N N 15 119.798 0.3 . 1 . . . . . 108 LEU N . 51949 1 426 . 1 . 1 109 109 VAL H H 1 8.274 0.020 . 1 . . . . . 109 VAL H . 51949 1 427 . 1 . 1 109 109 VAL C C 13 173.071 0.3 . 1 . . . . . 109 VAL C . 51949 1 428 . 1 . 1 109 109 VAL CA C 13 59.239 0.3 . 1 . . . . . 109 VAL CA . 51949 1 429 . 1 . 1 109 109 VAL CB C 13 32.860 0.3 . 1 . . . . . 109 VAL CB . 51949 1 430 . 1 . 1 109 109 VAL N N 15 113.705 0.3 . 1 . . . . . 109 VAL N . 51949 1 431 . 1 . 1 110 110 LEU H H 1 8.409 0.020 . 1 . . . . . 110 LEU H . 51949 1 432 . 1 . 1 110 110 LEU CA C 13 52.875 0.3 . 1 . . . . . 110 LEU CA . 51949 1 433 . 1 . 1 110 110 LEU CB C 13 43.310 0.3 . 1 . . . . . 110 LEU CB . 51949 1 434 . 1 . 1 110 110 LEU N N 15 123.142 0.3 . 1 . . . . . 110 LEU N . 51949 1 435 . 1 . 1 111 111 PHE H H 1 9.003 0.020 . 1 . . . . . 111 PHE H . 51949 1 436 . 1 . 1 111 111 PHE CA C 13 55.246 0.3 . 1 . . . . . 111 PHE CA . 51949 1 437 . 1 . 1 111 111 PHE CB C 13 43.536 0.3 . 1 . . . . . 111 PHE CB . 51949 1 438 . 1 . 1 111 111 PHE N N 15 117.086 0.3 . 1 . . . . . 111 PHE N . 51949 1 439 . 1 . 1 112 112 ARG H H 1 9.224 0.020 . 1 . . . . . 112 ARG H . 51949 1 440 . 1 . 1 112 112 ARG C C 13 173.934 0.3 . 1 . . . . . 112 ARG C . 51949 1 441 . 1 . 1 112 112 ARG CA C 13 55.930 0.3 . 1 . . . . . 112 ARG CA . 51949 1 442 . 1 . 1 112 112 ARG CB C 13 28.897 0.3 . 1 . . . . . 112 ARG CB . 51949 1 443 . 1 . 1 112 112 ARG N N 15 123.929 0.3 . 1 . . . . . 112 ARG N . 51949 1 444 . 1 . 1 113 113 ALA H H 1 7.186 0.020 . 1 . . . . . 113 ALA H . 51949 1 445 . 1 . 1 113 113 ALA C C 13 176.328 0.3 . 1 . . . . . 113 ALA C . 51949 1 446 . 1 . 1 113 113 ALA CA C 13 50.984 0.3 . 1 . . . . . 113 ALA CA . 51949 1 447 . 1 . 1 113 113 ALA CB C 13 21.904 0.3 . 1 . . . . . 113 ALA CB . 51949 1 448 . 1 . 1 113 113 ALA N N 15 125.089 0.3 . 1 . . . . . 113 ALA N . 51949 1 449 . 1 . 1 114 114 GLY H H 1 8.642 0.020 . 1 . . . . . 114 GLY H . 51949 1 450 . 1 . 1 114 114 GLY CA C 13 45.137 0.3 . 1 . . . . . 114 GLY CA . 51949 1 451 . 1 . 1 114 114 GLY N N 15 108.419 0.3 . 1 . . . . . 114 GLY N . 51949 1 452 . 1 . 1 117 117 GLY H H 1 7.709 0.020 . 1 . . . . . 117 GLY H . 51949 1 453 . 1 . 1 117 117 GLY C C 13 174.145 0.3 . 1 . . . . . 117 GLY C . 51949 1 454 . 1 . 1 117 117 GLY CA C 13 45.459 0.3 . 1 . . . . . 117 GLY CA . 51949 1 455 . 1 . 1 117 117 GLY N N 15 110.351 0.3 . 1 . . . . . 117 GLY N . 51949 1 456 . 1 . 1 118 118 ARG H H 1 8.061 0.020 . 1 . . . . . 118 ARG H . 51949 1 457 . 1 . 1 118 118 ARG C C 13 173.752 0.3 . 1 . . . . . 118 ARG C . 51949 1 458 . 1 . 1 118 118 ARG CA C 13 54.226 0.3 . 1 . . . . . 118 ARG CA . 51949 1 459 . 1 . 1 118 118 ARG CB C 13 33.792 0.3 . 1 . . . . . 118 ARG CB . 51949 1 460 . 1 . 1 118 118 ARG N N 15 119.598 0.3 . 1 . . . . . 118 ARG N . 51949 1 461 . 1 . 1 119 119 HIS H H 1 9.042 0.020 . 1 . . . . . 119 HIS H . 51949 1 462 . 1 . 1 119 119 HIS C C 13 172.966 0.3 . 1 . . . . . 119 HIS C . 51949 1 463 . 1 . 1 119 119 HIS CA C 13 55.930 0.3 . 1 . . . . . 119 HIS CA . 51949 1 464 . 1 . 1 119 119 HIS CB C 13 35.517 0.3 . 1 . . . . . 119 HIS CB . 51949 1 465 . 1 . 1 119 119 HIS N N 15 124.053 0.3 . 1 . . . . . 119 HIS N . 51949 1 466 . 1 . 1 120 120 VAL H H 1 7.040 0.020 . 1 . . . . . 120 VAL H . 51949 1 467 . 1 . 1 120 120 VAL C C 13 172.088 0.3 . 1 . . . . . 120 VAL C . 51949 1 468 . 1 . 1 120 120 VAL CA C 13 58.561 0.3 . 1 . . . . . 120 VAL CA . 51949 1 469 . 1 . 1 120 120 VAL CB C 13 35.657 0.3 . 1 . . . . . 120 VAL CB . 51949 1 470 . 1 . 1 120 120 VAL N N 15 125.661 0.3 . 1 . . . . . 120 VAL N . 51949 1 471 . 1 . 1 121 121 GLY H H 1 9.005 0.020 . 1 . . . . . 121 GLY H . 51949 1 472 . 1 . 1 121 121 GLY CA C 13 44.767 0.3 . 1 . . . . . 121 GLY CA . 51949 1 473 . 1 . 1 121 121 GLY N N 15 111.859 0.3 . 1 . . . . . 121 GLY N . 51949 1 474 . 1 . 1 122 122 ILE H H 1 9.473 0.020 . 1 . . . . . 122 ILE H . 51949 1 475 . 1 . 1 122 122 ILE C C 13 175.622 0.3 . 1 . . . . . 122 ILE C . 51949 1 476 . 1 . 1 122 122 ILE CA C 13 60.597 0.3 . 1 . . . . . 122 ILE CA . 51949 1 477 . 1 . 1 122 122 ILE CB C 13 40.930 0.3 . 1 . . . . . 122 ILE CB . 51949 1 478 . 1 . 1 122 122 ILE N N 15 117.595 0.3 . 1 . . . . . 122 ILE N . 51949 1 479 . 1 . 1 123 123 TYR H H 1 9.926 0.020 . 1 . . . . . 123 TYR H . 51949 1 480 . 1 . 1 123 123 TYR C C 13 176.315 0.3 . 1 . . . . . 123 TYR C . 51949 1 481 . 1 . 1 123 123 TYR CA C 13 60.182 0.3 . 1 . . . . . 123 TYR CA . 51949 1 482 . 1 . 1 123 123 TYR CB C 13 39.014 0.3 . 1 . . . . . 123 TYR CB . 51949 1 483 . 1 . 1 123 123 TYR N N 15 129.285 0.3 . 1 . . . . . 123 TYR N . 51949 1 484 . 1 . 1 127 127 ASN H H 1 8.304 0.020 . 1 . . . . . 127 ASN H . 51949 1 485 . 1 . 1 127 127 ASN C C 13 173.437 0.3 . 1 . . . . . 127 ASN C . 51949 1 486 . 1 . 1 127 127 ASN CA C 13 55.090 0.3 . 1 . . . . . 127 ASN CA . 51949 1 487 . 1 . 1 127 127 ASN CB C 13 38.081 0.3 . 1 . . . . . 127 ASN CB . 51949 1 488 . 1 . 1 127 127 ASN N N 15 106.299 0.3 . 1 . . . . . 127 ASN N . 51949 1 489 . 1 . 1 128 128 GLN H H 1 7.769 0.020 . 1 . . . . . 128 GLN H . 51949 1 490 . 1 . 1 128 128 GLN C C 13 173.987 0.3 . 1 . . . . . 128 GLN C . 51949 1 491 . 1 . 1 128 128 GLN CA C 13 54.991 0.3 . 1 . . . . . 128 GLN CA . 51949 1 492 . 1 . 1 128 128 GLN CB C 13 32.300 0.3 . 1 . . . . . 128 GLN CB . 51949 1 493 . 1 . 1 128 128 GLN N N 15 118.707 0.3 . 1 . . . . . 128 GLN N . 51949 1 494 . 1 . 1 129 129 PHE H H 1 8.941 0.020 . 1 . . . . . 129 PHE H . 51949 1 495 . 1 . 1 129 129 PHE CA C 13 55.386 0.3 . 1 . . . . . 129 PHE CA . 51949 1 496 . 1 . 1 129 129 PHE CB C 13 42.510 0.3 . 1 . . . . . 129 PHE CB . 51949 1 497 . 1 . 1 129 129 PHE N N 15 115.867 0.3 . 1 . . . . . 129 PHE N . 51949 1 498 . 1 . 1 130 130 VAL H H 1 9.112 0.020 . 1 . . . . . 130 VAL H . 51949 1 499 . 1 . 1 130 130 VAL C C 13 174.052 0.3 . 1 . . . . . 130 VAL C . 51949 1 500 . 1 . 1 130 130 VAL CA C 13 58.300 0.3 . 1 . . . . . 130 VAL CA . 51949 1 501 . 1 . 1 130 130 VAL CB C 13 33.979 0.3 . 1 . . . . . 130 VAL CB . 51949 1 502 . 1 . 1 130 130 VAL N N 15 119.708 0.3 . 1 . . . . . 130 VAL N . 51949 1 503 . 1 . 1 131 131 HIS H H 1 8.902 0.020 . 1 . . . . . 131 HIS H . 51949 1 504 . 1 . 1 131 131 HIS C C 13 171.802 0.3 . 1 . . . . . 131 HIS C . 51949 1 505 . 1 . 1 131 131 HIS CA C 13 53.871 0.3 . 1 . . . . . 131 HIS CA . 51949 1 506 . 1 . 1 131 131 HIS CB C 13 33.839 0.3 . 1 . . . . . 131 HIS CB . 51949 1 507 . 1 . 1 131 131 HIS N N 15 121.709 0.3 . 1 . . . . . 131 HIS N . 51949 1 508 . 1 . 1 132 132 ALA H H 1 8.069 0.020 . 1 . . . . . 132 ALA H . 51949 1 509 . 1 . 1 132 132 ALA CA C 13 50.447 0.3 . 1 . . . . . 132 ALA CA . 51949 1 510 . 1 . 1 132 132 ALA CB C 13 18.306 0.3 . 1 . . . . . 132 ALA CB . 51949 1 511 . 1 . 1 132 132 ALA N N 15 121.443 0.3 . 1 . . . . . 132 ALA N . 51949 1 512 . 1 . 1 133 133 SER H H 1 7.370 0.020 . 1 . . . . . 133 SER H . 51949 1 513 . 1 . 1 133 133 SER CA C 13 56.720 0.3 . 1 . . . . . 133 SER CA . 51949 1 514 . 1 . 1 133 133 SER N N 15 119.098 0.3 . 1 . . . . . 133 SER N . 51949 1 515 . 1 . 1 134 134 THR H H 1 8.674 0.020 . 1 . . . . . 134 THR H . 51949 1 516 . 1 . 1 134 134 THR CA C 13 64.327 0.3 . 1 . . . . . 134 THR CA . 51949 1 517 . 1 . 1 134 134 THR N N 15 117.039 0.3 . 1 . . . . . 134 THR N . 51949 1 518 . 1 . 1 135 135 SER H H 1 7.795 0.020 . 1 . . . . . 135 SER H . 51949 1 519 . 1 . 1 135 135 SER C C 13 176.407 0.3 . 1 . . . . . 135 SER C . 51949 1 520 . 1 . 1 135 135 SER CA C 13 59.387 0.3 . 1 . . . . . 135 SER CA . 51949 1 521 . 1 . 1 135 135 SER N N 15 113.630 0.3 . 1 . . . . . 135 SER N . 51949 1 522 . 1 . 1 137 137 GLY H H 1 8.111 0.020 . 1 . . . . . 137 GLY H . 51949 1 523 . 1 . 1 137 137 GLY C C 13 175.962 0.3 . 1 . . . . . 137 GLY C . 51949 1 524 . 1 . 1 137 137 GLY CA C 13 45.162 0.3 . 1 . . . . . 137 GLY CA . 51949 1 525 . 1 . 1 137 137 GLY N N 15 112.236 0.3 . 1 . . . . . 137 GLY N . 51949 1 526 . 1 . 1 138 138 VAL H H 1 8.052 0.020 . 1 . . . . . 138 VAL H . 51949 1 527 . 1 . 1 138 138 VAL CA C 13 64.548 0.3 . 1 . . . . . 138 VAL CA . 51949 1 528 . 1 . 1 138 138 VAL N N 15 123.503 0.3 . 1 . . . . . 138 VAL N . 51949 1 529 . 1 . 1 139 139 ILE H H 1 8.785 0.020 . 1 . . . . . 139 ILE H . 51949 1 530 . 1 . 1 139 139 ILE CA C 13 60.679 0.3 . 1 . . . . . 139 ILE CA . 51949 1 531 . 1 . 1 139 139 ILE N N 15 126.502 0.3 . 1 . . . . . 139 ILE N . 51949 1 532 . 1 . 1 140 140 ILE H H 1 7.244 0.020 . 1 . . . . . 140 ILE H . 51949 1 533 . 1 . 1 140 140 ILE CA C 13 60.449 0.3 . 1 . . . . . 140 ILE CA . 51949 1 534 . 1 . 1 140 140 ILE CB C 13 39.386 0.3 . 1 . . . . . 140 ILE CB . 51949 1 535 . 1 . 1 140 140 ILE N N 15 118.654 0.3 . 1 . . . . . 140 ILE N . 51949 1 536 . 1 . 1 141 141 SER H H 1 8.401 0.020 . 1 . . . . . 141 SER H . 51949 1 537 . 1 . 1 141 141 SER CA C 13 57.115 0.3 . 1 . . . . . 141 SER CA . 51949 1 538 . 1 . 1 141 141 SER CB C 13 65.447 0.3 . 1 . . . . . 141 SER CB . 51949 1 539 . 1 . 1 141 141 SER N N 15 123.295 0.3 . 1 . . . . . 141 SER N . 51949 1 540 . 1 . 1 142 142 SER H H 1 8.711 0.020 . 1 . . . . . 142 SER H . 51949 1 541 . 1 . 1 142 142 SER C C 13 177.034 0.3 . 1 . . . . . 142 SER C . 51949 1 542 . 1 . 1 142 142 SER CA C 13 55.781 0.3 . 1 . . . . . 142 SER CA . 51949 1 543 . 1 . 1 142 142 SER CB C 13 64.079 0.3 . 1 . . . . . 142 SER CB . 51949 1 544 . 1 . 1 142 142 SER N N 15 114.008 0.3 . 1 . . . . . 142 SER N . 51949 1 545 . 1 . 1 143 143 MET H H 1 9.458 0.020 . 1 . . . . . 143 MET H . 51949 1 546 . 1 . 1 143 143 MET C C 13 175.739 0.3 . 1 . . . . . 143 MET C . 51949 1 547 . 1 . 1 143 143 MET CA C 13 57.238 0.3 . 1 . . . . . 143 MET CA . 51949 1 548 . 1 . 1 143 143 MET N N 15 124.863 0.3 . 1 . . . . . 143 MET N . 51949 1 549 . 1 . 1 144 144 ASN H H 1 8.496 0.020 . 1 . . . . . 144 ASN H . 51949 1 550 . 1 . 1 144 144 ASN C C 13 176.602 0.3 . 1 . . . . . 144 ASN C . 51949 1 551 . 1 . 1 144 144 ASN CA C 13 52.771 0.3 . 1 . . . . . 144 ASN CA . 51949 1 552 . 1 . 1 144 144 ASN CB C 13 38.641 0.3 . 1 . . . . . 144 ASN CB . 51949 1 553 . 1 . 1 144 144 ASN N N 15 113.443 0.3 . 1 . . . . . 144 ASN N . 51949 1 554 . 1 . 1 145 145 GLU H H 1 7.601 0.020 . 1 . . . . . 145 GLU H . 51949 1 555 . 1 . 1 145 145 GLU C C 13 175.832 0.3 . 1 . . . . . 145 GLU C . 51949 1 556 . 1 . 1 145 145 GLU CA C 13 55.120 0.3 . 1 . . . . . 145 GLU CA . 51949 1 557 . 1 . 1 145 145 GLU CB C 13 29.469 0.3 . 1 . . . . . 145 GLU CB . 51949 1 558 . 1 . 1 145 145 GLU N N 15 124.031 0.3 . 1 . . . . . 145 GLU N . 51949 1 559 . 1 . 1 147 147 TYR H H 1 8.559 0.020 . 1 . . . . . 147 TYR H . 51949 1 560 . 1 . 1 147 147 TYR C C 13 176.877 0.3 . 1 . . . . . 147 TYR C . 51949 1 561 . 1 . 1 147 147 TYR CA C 13 61.363 0.3 . 1 . . . . . 147 TYR CA . 51949 1 562 . 1 . 1 147 147 TYR CB C 13 39.070 0.3 . 1 . . . . . 147 TYR CB . 51949 1 563 . 1 . 1 147 147 TYR N N 15 115.608 0.3 . 1 . . . . . 147 TYR N . 51949 1 564 . 1 . 1 148 148 TRP H H 1 6.603 0.020 . 1 . . . . . 148 TRP H . 51949 1 565 . 1 . 1 148 148 TRP C C 13 178.769 0.3 . 1 . . . . . 148 TRP C . 51949 1 566 . 1 . 1 148 148 TRP CA C 13 57.668 0.3 . 1 . . . . . 148 TRP CA . 51949 1 567 . 1 . 1 148 148 TRP CB C 13 29.923 0.3 . 1 . . . . . 148 TRP CB . 51949 1 568 . 1 . 1 148 148 TRP N N 15 116.713 0.3 . 1 . . . . . 148 TRP N . 51949 1 569 . 1 . 1 149 149 LYS H H 1 8.895 0.020 . 1 . . . . . 149 LYS H . 51949 1 570 . 1 . 1 149 149 LYS C C 13 179.834 0.3 . 1 . . . . . 149 LYS C . 51949 1 571 . 1 . 1 149 149 LYS CA C 13 60.282 0.3 . 1 . . . . . 149 LYS CA . 51949 1 572 . 1 . 1 149 149 LYS CB C 13 32.627 0.3 . 1 . . . . . 149 LYS CB . 51949 1 573 . 1 . 1 149 149 LYS N N 15 122.599 0.3 . 1 . . . . . 149 LYS N . 51949 1 574 . 1 . 1 150 150 LYS H H 1 7.747 0.020 . 1 . . . . . 150 LYS H . 51949 1 575 . 1 . 1 150 150 LYS C C 13 177.298 0.3 . 1 . . . . . 150 LYS C . 51949 1 576 . 1 . 1 150 150 LYS CA C 13 57.930 0.3 . 1 . . . . . 150 LYS CA . 51949 1 577 . 1 . 1 150 150 LYS CB C 13 32.394 0.3 . 1 . . . . . 150 LYS CB . 51949 1 578 . 1 . 1 150 150 LYS N N 15 114.464 0.3 . 1 . . . . . 150 LYS N . 51949 1 579 . 1 . 1 151 151 ARG H H 1 7.046 0.020 . 1 . . . . . 151 ARG H . 51949 1 580 . 1 . 1 151 151 ARG C C 13 175.530 0.3 . 1 . . . . . 151 ARG C . 51949 1 581 . 1 . 1 151 151 ARG CA C 13 55.930 0.3 . 1 . . . . . 151 ARG CA . 51949 1 582 . 1 . 1 151 151 ARG CB C 13 30.669 0.3 . 1 . . . . . 151 ARG CB . 51949 1 583 . 1 . 1 151 151 ARG N N 15 115.361 0.3 . 1 . . . . . 151 ARG N . 51949 1 584 . 1 . 1 152 152 TYR H H 1 7.575 0.020 . 1 . . . . . 152 TYR H . 51949 1 585 . 1 . 1 152 152 TYR C C 13 174.000 0.3 . 1 . . . . . 152 TYR C . 51949 1 586 . 1 . 1 152 152 TYR CA C 13 61.506 0.3 . 1 . . . . . 152 TYR CA . 51949 1 587 . 1 . 1 152 152 TYR CB C 13 37.801 0.3 . 1 . . . . . 152 TYR CB . 51949 1 588 . 1 . 1 152 152 TYR N N 15 123.769 0.3 . 1 . . . . . 152 TYR N . 51949 1 589 . 1 . 1 153 153 ASN H H 1 8.394 0.020 . 1 . . . . . 153 ASN H . 51949 1 590 . 1 . 1 153 153 ASN C C 13 173.010 0.3 . 1 . . . . . 153 ASN C . 51949 1 591 . 1 . 1 153 153 ASN CA C 13 54.102 0.3 . 1 . . . . . 153 ASN CA . 51949 1 592 . 1 . 1 153 153 ASN CB C 13 41.811 0.3 . 1 . . . . . 153 ASN CB . 51949 1 593 . 1 . 1 153 153 ASN N N 15 127.171 0.3 . 1 . . . . . 153 ASN N . 51949 1 594 . 1 . 1 154 154 GLU H H 1 6.879 0.020 . 1 . . . . . 154 GLU H . 51949 1 595 . 1 . 1 154 154 GLU C C 13 170.507 0.3 . 1 . . . . . 154 GLU C . 51949 1 596 . 1 . 1 154 154 GLU CA C 13 55.263 0.3 . 1 . . . . . 154 GLU CA . 51949 1 597 . 1 . 1 154 154 GLU CB C 13 31.461 0.3 . 1 . . . . . 154 GLU CB . 51949 1 598 . 1 . 1 154 154 GLU N N 15 114.610 0.3 . 1 . . . . . 154 GLU N . 51949 1 599 . 1 . 1 155 155 ALA H H 1 7.470 0.020 . 1 . . . . . 155 ALA H . 51949 1 600 . 1 . 1 155 155 ALA C C 13 176.877 0.3 . 1 . . . . . 155 ALA C . 51949 1 601 . 1 . 1 155 155 ALA CA C 13 50.472 0.3 . 1 . . . . . 155 ALA CA . 51949 1 602 . 1 . 1 155 155 ALA CB C 13 23.582 0.3 . 1 . . . . . 155 ALA CB . 51949 1 603 . 1 . 1 155 155 ALA N N 15 120.367 0.3 . 1 . . . . . 155 ALA N . 51949 1 604 . 1 . 1 156 156 ARG H H 1 8.845 0.020 . 1 . . . . . 156 ARG H . 51949 1 605 . 1 . 1 156 156 ARG C C 13 174.536 0.3 . 1 . . . . . 156 ARG C . 51949 1 606 . 1 . 1 156 156 ARG CA C 13 51.385 0.3 . 1 . . . . . 156 ARG CA . 51949 1 607 . 1 . 1 156 156 ARG CB C 13 31.927 0.3 . 1 . . . . . 156 ARG CB . 51949 1 608 . 1 . 1 156 156 ARG N N 15 115.490 0.3 . 1 . . . . . 156 ARG N . 51949 1 609 . 1 . 1 157 157 ARG H H 1 9.333 0.020 . 1 . . . . . 157 ARG H . 51949 1 610 . 1 . 1 157 157 ARG C C 13 176.315 0.3 . 1 . . . . . 157 ARG C . 51949 1 611 . 1 . 1 157 157 ARG CA C 13 55.386 0.3 . 1 . . . . . 157 ARG CA . 51949 1 612 . 1 . 1 157 157 ARG CB C 13 30.296 0.3 . 1 . . . . . 157 ARG CB . 51949 1 613 . 1 . 1 157 157 ARG N N 15 124.127 0.3 . 1 . . . . . 157 ARG N . 51949 1 614 . 1 . 1 158 158 VAL H H 1 8.697 0.020 . 1 . . . . . 158 VAL H . 51949 1 615 . 1 . 1 158 158 VAL CA C 13 60.943 0.3 . 1 . . . . . 158 VAL CA . 51949 1 616 . 1 . 1 158 158 VAL N N 15 120.381 0.3 . 1 . . . . . 158 VAL N . 51949 1 617 . 1 . 1 159 159 LEU H H 1 7.719 0.020 . 1 . . . . . 159 LEU H . 51949 1 618 . 1 . 1 159 159 LEU C C 13 176.184 0.3 . 1 . . . . . 159 LEU C . 51949 1 619 . 1 . 1 159 159 LEU CA C 13 54.300 0.3 . 1 . . . . . 159 LEU CA . 51949 1 620 . 1 . 1 159 159 LEU CB C 13 42.277 0.3 . 1 . . . . . 159 LEU CB . 51949 1 621 . 1 . 1 159 159 LEU N N 15 122.472 0.3 . 1 . . . . . 159 LEU N . 51949 1 622 . 1 . 1 160 160 SER H H 1 8.667 0.020 . 1 . . . . . 160 SER H . 51949 1 623 . 1 . 1 160 160 SER C C 13 174.641 0.3 . 1 . . . . . 160 SER C . 51949 1 624 . 1 . 1 160 160 SER CA C 13 57.387 0.3 . 1 . . . . . 160 SER CA . 51949 1 625 . 1 . 1 160 160 SER CB C 13 64.048 0.3 . 1 . . . . . 160 SER CB . 51949 1 626 . 1 . 1 160 160 SER N N 15 118.717 0.3 . 1 . . . . . 160 SER N . 51949 1 stop_ save_