################################### # 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 51829 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name SERF1a _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 4 '3D CBCA(CO)NH' . . . 51829 1 5 '3D HNCACB' . . . 51829 1 6 '3D HNCA' . . . 51829 1 7 '3D HNCO' . . . 51829 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 . . 51829 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 1 1 MET C C 13 175.53 0.2 . 1 . . . . . 1 MET C . 51829 1 2 . 1 . 1 1 1 MET CA C 13 55.24 0.2 . 1 . . . . . 1 MET CA . 51829 1 3 . 1 . 1 1 1 MET CB C 13 32.79 0.2 . 1 . . . . . 1 MET CB . 51829 1 4 . 1 . 1 2 2 ALA H H 1 8.33 0.04 . 1 . . . . . 2 ALA H . 51829 1 5 . 1 . 1 2 2 ALA C C 13 177.51 0.2 . 1 . . . . . 2 ALA C . 51829 1 6 . 1 . 1 2 2 ALA CA C 13 52.42 0.2 . 1 . . . . . 2 ALA CA . 51829 1 7 . 1 . 1 2 2 ALA CB C 13 18.88 0.2 . 1 . . . . . 2 ALA CB . 51829 1 8 . 1 . 1 2 2 ALA N N 15 125.835 0.2 . 1 . . . . . 2 ALA N . 51829 1 9 . 1 . 1 3 3 ARG H H 1 8.35 0.04 . 1 . . . . . 3 ARG H . 51829 1 10 . 1 . 1 3 3 ARG C C 13 176.87 0.2 . 1 . . . . . 3 ARG C . 51829 1 11 . 1 . 1 3 3 ARG CA C 13 56.13 0.2 . 1 . . . . . 3 ARG CA . 51829 1 12 . 1 . 1 3 3 ARG CB C 13 30.73 0.2 . 1 . . . . . 3 ARG CB . 51829 1 13 . 1 . 1 3 3 ARG N N 15 120.470 0.2 . 1 . . . . . 3 ARG N . 51829 1 14 . 1 . 1 4 4 GLY H H 1 8.41 0.04 . 1 . . . . . 4 GLY H . 51829 1 15 . 1 . 1 4 4 GLY C C 13 173.90 0.2 . 1 . . . . . 4 GLY C . 51829 1 16 . 1 . 1 4 4 GLY CA C 13 45.22 0.2 . 1 . . . . . 4 GLY CA . 51829 1 17 . 1 . 1 4 4 GLY N N 15 109.642 0.2 . 1 . . . . . 4 GLY N . 51829 1 18 . 1 . 1 5 5 ASN H H 1 8.37 0.04 . 1 . . . . . 5 ASN H . 51829 1 19 . 1 . 1 5 5 ASN C C 13 175.53 0.2 . 1 . . . . . 5 ASN C . 51829 1 20 . 1 . 1 5 5 ASN CA C 13 53.39 0.2 . 1 . . . . . 5 ASN CA . 51829 1 21 . 1 . 1 5 5 ASN CB C 13 38.69 0.2 . 1 . . . . . 5 ASN CB . 51829 1 22 . 1 . 1 5 5 ASN N N 15 118.834 0.2 . 1 . . . . . 5 ASN N . 51829 1 23 . 1 . 1 6 6 GLN H H 1 8.49 0.04 . 1 . . . . . 6 GLN H . 51829 1 24 . 1 . 1 6 6 GLN C C 13 177.01 0.2 . 1 . . . . . 6 GLN C . 51829 1 25 . 1 . 1 6 6 GLN CA C 13 56.98 0.2 . 1 . . . . . 6 GLN CA . 51829 1 26 . 1 . 1 6 6 GLN CB C 13 28.80 0.2 . 1 . . . . . 6 GLN CB . 51829 1 27 . 1 . 1 6 6 GLN N N 15 120.871 0.2 . 1 . . . . . 6 GLN N . 51829 1 28 . 1 . 1 7 7 ARG H H 1 8.34 0.04 . 1 . . . . . 7 ARG H . 51829 1 29 . 1 . 1 7 7 ARG C C 13 177.40 0.2 . 1 . . . . . 7 ARG C . 51829 1 30 . 1 . 1 7 7 ARG CA C 13 56.98 0.2 . 1 . . . . . 7 ARG CA . 51829 1 31 . 1 . 1 7 7 ARG CB C 13 32.72 0.2 . 1 . . . . . 7 ARG CB . 51829 1 32 . 1 . 1 7 7 ARG N N 15 121.157 0.2 . 1 . . . . . 7 ARG N . 51829 1 33 . 1 . 1 8 8 GLU H H 1 8.34 0.04 . 1 . . . . . 8 GLU H . 51829 1 34 . 1 . 1 8 8 GLU C C 13 177.59 0.2 . 1 . . . . . 8 GLU C . 51829 1 35 . 1 . 1 8 8 GLU CA C 13 57.00 0.2 . 1 . . . . . 8 GLU CA . 51829 1 36 . 1 . 1 8 8 GLU CB C 13 29.85 0.2 . 1 . . . . . 8 GLU CB . 51829 1 37 . 1 . 1 8 8 GLU N N 15 121.196 0.2 . 1 . . . . . 8 GLU N . 51829 1 38 . 1 . 1 9 9 LEU H H 1 8.18 0.04 . 1 . . . . . 9 LEU H . 51829 1 39 . 1 . 1 9 9 LEU C C 13 178.30 0.2 . 1 . . . . . 9 LEU C . 51829 1 40 . 1 . 1 9 9 LEU CA C 13 55.94 0.2 . 1 . . . . . 9 LEU CA . 51829 1 41 . 1 . 1 9 9 LEU CB C 13 41.91 0.2 . 1 . . . . . 9 LEU CB . 51829 1 42 . 1 . 1 9 9 LEU N N 15 122.730 0.2 . 1 . . . . . 9 LEU N . 51829 1 43 . 1 . 1 10 10 ALA H H 1 8.13 0.04 . 1 . . . . . 10 ALA H . 51829 1 44 . 1 . 1 10 10 ALA C C 13 178.67 0.2 . 1 . . . . . 10 ALA C . 51829 1 45 . 1 . 1 10 10 ALA CA C 13 53.40 0.2 . 1 . . . . . 10 ALA CA . 51829 1 46 . 1 . 1 10 10 ALA CB C 13 18.78 0.2 . 1 . . . . . 10 ALA CB . 51829 1 47 . 1 . 1 10 10 ALA N N 15 123.374 0.2 . 1 . . . . . 10 ALA N . 51829 1 48 . 1 . 1 11 11 ARG H H 1 8.07 0.04 . 1 . . . . . 11 ARG H . 51829 1 49 . 1 . 1 11 11 ARG C C 13 177.42 0.2 . 1 . . . . . 11 ARG C . 51829 1 50 . 1 . 1 11 11 ARG CA C 13 56.96 0.2 . 1 . . . . . 11 ARG CA . 51829 1 51 . 1 . 1 11 11 ARG CB C 13 30.49 0.2 . 1 . . . . . 11 ARG CB . 51829 1 52 . 1 . 1 11 11 ARG N N 15 119.465 0.2 . 1 . . . . . 11 ARG N . 51829 1 53 . 1 . 1 12 12 GLN H H 1 8.21 0.04 . 1 . . . . . 12 GLN H . 51829 1 54 . 1 . 1 12 12 GLN C C 13 177.10 0.2 . 1 . . . . . 12 GLN C . 51829 1 55 . 1 . 1 12 12 GLN CA C 13 57.15 0.2 . 1 . . . . . 12 GLN CA . 51829 1 56 . 1 . 1 12 12 GLN CB C 13 28.97 0.2 . 1 . . . . . 12 GLN CB . 51829 1 57 . 1 . 1 12 12 GLN N N 15 120.321 0.2 . 1 . . . . . 12 GLN N . 51829 1 58 . 1 . 1 13 13 LYS C C 13 177.02 0.2 . 1 . . . . . 13 LYS C . 51829 1 59 . 1 . 1 13 13 LYS CA C 13 56.96 0.2 . 1 . . . . . 13 LYS CA . 51829 1 60 . 1 . 1 13 13 LYS CB C 13 32.87 0.2 . 1 . . . . . 13 LYS CB . 51829 1 61 . 1 . 1 14 14 ASN H H 1 8.34 0.04 . 1 . . . . . 14 ASN H . 51829 1 62 . 1 . 1 14 14 ASN C C 13 175.63 0.2 . 1 . . . . . 14 ASN C . 51829 1 63 . 1 . 1 14 14 ASN CA C 13 53.42 0.2 . 1 . . . . . 14 ASN CA . 51829 1 64 . 1 . 1 14 14 ASN CB C 13 38.72 0.2 . 1 . . . . . 14 ASN CB . 51829 1 65 . 1 . 1 14 14 ASN N N 15 118.855 0.2 . 1 . . . . . 14 ASN N . 51829 1 66 . 1 . 1 15 15 MET H H 1 8.22 0.04 . 1 . . . . . 15 MET H . 51829 1 67 . 1 . 1 15 15 MET C C 13 176.47 0.2 . 1 . . . . . 15 MET C . 51829 1 68 . 1 . 1 15 15 MET CA C 13 55.76 0.2 . 1 . . . . . 15 MET CA . 51829 1 69 . 1 . 1 15 15 MET CB C 13 32.91 0.2 . 1 . . . . . 15 MET CB . 51829 1 70 . 1 . 1 15 15 MET N N 15 121.021 0.2 . 1 . . . . . 15 MET N . 51829 1 71 . 1 . 1 16 16 LYS H H 1 8.25 0.04 . 1 . . . . . 16 LYS H . 51829 1 72 . 1 . 1 16 16 LYS C C 13 176.79 0.2 . 1 . . . . . 16 LYS C . 51829 1 73 . 1 . 1 16 16 LYS CA C 13 57.10 0.2 . 1 . . . . . 16 LYS CA . 51829 1 74 . 1 . 1 16 16 LYS CB C 13 32.78 0.2 . 1 . . . . . 16 LYS CB . 51829 1 75 . 1 . 1 16 16 LYS N N 15 121.798 0.2 . 1 . . . . . 16 LYS N . 51829 1 76 . 1 . 1 17 17 LYS H H 1 8.25 0.04 . 1 . . . . . 17 LYS H . 51829 1 77 . 1 . 1 17 17 LYS C C 13 176.98 0.2 . 1 . . . . . 17 LYS C . 51829 1 78 . 1 . 1 17 17 LYS CA C 13 56.82 0.2 . 1 . . . . . 17 LYS CA . 51829 1 79 . 1 . 1 17 17 LYS CB C 13 32.71 0.2 . 1 . . . . . 17 LYS CB . 51829 1 80 . 1 . 1 17 17 LYS N N 15 122.366 0.2 . 1 . . . . . 17 LYS N . 51829 1 81 . 1 . 1 18 18 THR H H 1 8.19 0.04 . 1 . . . . . 18 THR H . 51829 1 82 . 1 . 1 18 18 THR C C 13 174.77 0.2 . 1 . . . . . 18 THR C . 51829 1 83 . 1 . 1 18 18 THR CA C 13 62.24 0.2 . 1 . . . . . 18 THR CA . 51829 1 84 . 1 . 1 18 18 THR CB C 13 69.71 0.2 . 1 . . . . . 18 THR CB . 51829 1 85 . 1 . 1 18 18 THR N N 15 115.855 0.2 . 1 . . . . . 18 THR N . 51829 1 86 . 1 . 1 19 19 GLN H H 1 8.42 0.04 . 1 . . . . . 19 GLN H . 51829 1 87 . 1 . 1 19 19 GLN C C 13 176.02 0.2 . 1 . . . . . 19 GLN C . 51829 1 88 . 1 . 1 19 19 GLN CA C 13 56.16 0.2 . 1 . . . . . 19 GLN CA . 51829 1 89 . 1 . 1 19 19 GLN CB C 13 29.38 0.2 . 1 . . . . . 19 GLN CB . 51829 1 90 . 1 . 1 19 19 GLN N N 15 122.619 0.2 . 1 . . . . . 19 GLN N . 51829 1 91 . 1 . 1 20 20 GLU H H 1 8.44 0.04 . 1 . . . . . 20 GLU H . 51829 1 92 . 1 . 1 20 20 GLU C C 13 176.77 0.2 . 1 . . . . . 20 GLU C . 51829 1 93 . 1 . 1 20 20 GLU CA C 13 56.69 0.2 . 1 . . . . . 20 GLU CA . 51829 1 94 . 1 . 1 20 20 GLU CB C 13 30.28 0.2 . 1 . . . . . 20 GLU CB . 51829 1 95 . 1 . 1 20 20 GLU N N 15 123.011 0.2 . 1 . . . . . 20 GLU N . 51829 1 96 . 1 . 1 21 21 ILE H H 1 8.29 0.04 . 1 . . . . . 21 ILE H . 51829 1 97 . 1 . 1 21 21 ILE C C 13 176.50 0.2 . 1 . . . . . 21 ILE C . 51829 1 98 . 1 . 1 21 21 ILE CA C 13 61.34 0.2 . 1 . . . . . 21 ILE CA . 51829 1 99 . 1 . 1 21 21 ILE CB C 13 38.55 0.2 . 1 . . . . . 21 ILE CB . 51829 1 100 . 1 . 1 21 21 ILE N N 15 122.554 0.2 . 1 . . . . . 21 ILE N . 51829 1 101 . 1 . 1 22 22 SER H H 1 8.39 0.04 . 1 . . . . . 22 SER H . 51829 1 102 . 1 . 1 22 22 SER C C 13 174.71 0.2 . 1 . . . . . 22 SER C . 51829 1 103 . 1 . 1 22 22 SER CA C 13 58.64 0.2 . 1 . . . . . 22 SER CA . 51829 1 104 . 1 . 1 22 22 SER CB C 13 63.64 0.2 . 1 . . . . . 22 SER CB . 51829 1 105 . 1 . 1 22 22 SER N N 15 119.856 0.2 . 1 . . . . . 22 SER N . 51829 1 106 . 1 . 1 23 23 LYS H H 1 8.39 0.04 . 1 . . . . . 23 LYS H . 51829 1 107 . 1 . 1 23 23 LYS C C 13 177.10 0.2 . 1 . . . . . 23 LYS C . 51829 1 108 . 1 . 1 23 23 LYS CA C 13 56.64 0.2 . 1 . . . . . 23 LYS CA . 51829 1 109 . 1 . 1 23 23 LYS CB C 13 32.84 0.2 . 1 . . . . . 23 LYS CB . 51829 1 110 . 1 . 1 23 23 LYS N N 15 123.754 0.2 . 1 . . . . . 23 LYS N . 51829 1 111 . 1 . 1 24 24 GLY H H 1 8.37 0.04 . 1 . . . . . 24 GLY H . 51829 1 112 . 1 . 1 24 24 GLY C C 13 173.84 0.2 . 1 . . . . . 24 GLY C . 51829 1 113 . 1 . 1 24 24 GLY CA C 13 45.15 0.2 . 1 . . . . . 24 GLY CA . 51829 1 114 . 1 . 1 24 24 GLY N N 15 109.623 0.2 . 1 . . . . . 24 GLY N . 51829 1 115 . 1 . 1 25 25 LYS H H 1 8.15 0.04 . 1 . . . . . 25 LYS H . 51829 1 116 . 1 . 1 25 25 LYS C C 13 176.46 0.2 . 1 . . . . . 25 LYS C . 51829 1 117 . 1 . 1 25 25 LYS CA C 13 56.23 0.2 . 1 . . . . . 25 LYS CA . 51829 1 118 . 1 . 1 25 25 LYS CB C 13 32.91 0.2 . 1 . . . . . 25 LYS CB . 51829 1 119 . 1 . 1 25 25 LYS N N 15 121.047 0.2 . 1 . . . . . 25 LYS N . 51829 1 120 . 1 . 1 26 26 ARG H H 1 8.44 0.04 . 1 . . . . . 26 ARG H . 51829 1 121 . 1 . 1 26 26 ARG C C 13 176.50 0.2 . 1 . . . . . 26 ARG C . 51829 1 122 . 1 . 1 26 26 ARG CA C 13 55.99 0.2 . 1 . . . . . 26 ARG CA . 51829 1 123 . 1 . 1 26 26 ARG CB C 13 30.44 0.2 . 1 . . . . . 26 ARG CB . 51829 1 124 . 1 . 1 26 26 ARG N N 15 123.004 0.2 . 1 . . . . . 26 ARG N . 51829 1 125 . 1 . 1 27 27 LYS H H 1 8.55 0.04 . 1 . . . . . 27 LYS H . 51829 1 126 . 1 . 1 27 27 LYS C C 13 176.93 0.2 . 1 . . . . . 27 LYS C . 51829 1 127 . 1 . 1 27 27 LYS CA C 13 56.90 0.2 . 1 . . . . . 27 LYS CA . 51829 1 128 . 1 . 1 27 27 LYS CB C 13 32.79 0.2 . 1 . . . . . 27 LYS CB . 51829 1 129 . 1 . 1 27 27 LYS N N 15 124.285 0.2 . 1 . . . . . 27 LYS N . 51829 1 130 . 1 . 1 28 28 GLU H H 1 8.71 0.04 . 1 . . . . . 28 GLU H . 51829 1 131 . 1 . 1 28 28 GLU C C 13 176.37 0.2 . 1 . . . . . 28 GLU C . 51829 1 132 . 1 . 1 28 28 GLU CA C 13 56.97 0.2 . 1 . . . . . 28 GLU CA . 51829 1 133 . 1 . 1 28 28 GLU CB C 13 29.94 0.2 . 1 . . . . . 28 GLU CB . 51829 1 134 . 1 . 1 28 28 GLU N N 15 122.313 0.2 . 1 . . . . . 28 GLU N . 51829 1 135 . 1 . 1 29 29 ASP H H 1 8.30 0.04 . 1 . . . . . 29 ASP H . 51829 1 136 . 1 . 1 29 29 ASP C C 13 176.41 0.2 . 1 . . . . . 29 ASP C . 51829 1 137 . 1 . 1 29 29 ASP CA C 13 54.61 0.2 . 1 . . . . . 29 ASP CA . 51829 1 138 . 1 . 1 29 29 ASP CB C 13 41.11 0.2 . 1 . . . . . 29 ASP CB . 51829 1 139 . 1 . 1 29 29 ASP N N 15 121.484 0.2 . 1 . . . . . 29 ASP N . 51829 1 140 . 1 . 1 30 30 SER H H 1 8.26 0.04 . 1 . . . . . 30 SER H . 51829 1 141 . 1 . 1 30 30 SER C C 13 174.76 0.2 . 1 . . . . . 30 SER C . 51829 1 142 . 1 . 1 30 30 SER CA C 13 58.69 0.2 . 1 . . . . . 30 SER CA . 51829 1 143 . 1 . 1 30 30 SER CB C 13 63.54 0.2 . 1 . . . . . 30 SER CB . 51829 1 144 . 1 . 1 30 30 SER N N 15 116.001 0.2 . 1 . . . . . 30 SER N . 51829 1 145 . 1 . 1 31 31 LEU H H 1 8.17 0.04 . 1 . . . . . 31 LEU H . 51829 1 146 . 1 . 1 31 31 LEU C C 13 178.28 0.2 . 1 . . . . . 31 LEU C . 51829 1 147 . 1 . 1 31 31 LEU CA C 13 55.76 0.2 . 1 . . . . . 31 LEU CA . 51829 1 148 . 1 . 1 31 31 LEU CB C 13 42.31 0.2 . 1 . . . . . 31 LEU CB . 51829 1 149 . 1 . 1 31 31 LEU N N 15 123.593 0.2 . 1 . . . . . 31 LEU N . 51829 1 150 . 1 . 1 32 32 THR H H 1 8.29 0.04 . 1 . . . . . 32 THR H . 51829 1 151 . 1 . 1 32 32 THR C C 13 175.41 0.2 . 1 . . . . . 32 THR C . 51829 1 152 . 1 . 1 32 32 THR CA C 13 62.24 0.2 . 1 . . . . . 32 THR CA . 51829 1 153 . 1 . 1 32 32 THR CB C 13 69.85 0.2 . 1 . . . . . 32 THR CB . 51829 1 154 . 1 . 1 32 32 THR N N 15 114.050 0.2 . 1 . . . . . 32 THR N . 51829 1 155 . 1 . 1 33 33 ALA H H 1 8.52 0.04 . 1 . . . . . 33 ALA H . 51829 1 156 . 1 . 1 33 33 ALA C C 13 179.89 0.2 . 1 . . . . . 33 ALA C . 51829 1 157 . 1 . 1 33 33 ALA CA C 13 54.59 0.2 . 1 . . . . . 33 ALA CA . 51829 1 158 . 1 . 1 33 33 ALA CB C 13 18.34 0.2 . 1 . . . . . 33 ALA CB . 51829 1 159 . 1 . 1 33 33 ALA N N 15 124.685 0.2 . 1 . . . . . 33 ALA N . 51829 1 160 . 1 . 1 34 34 SER H H 1 8.33 0.04 . 1 . . . . . 34 SER H . 51829 1 161 . 1 . 1 34 34 SER C C 13 176.48 0.2 . 1 . . . . . 34 SER C . 51829 1 162 . 1 . 1 34 34 SER CA C 13 60.14 0.2 . 1 . . . . . 34 SER CA . 51829 1 163 . 1 . 1 34 34 SER CB C 13 62.88 0.2 . 1 . . . . . 34 SER CB . 51829 1 164 . 1 . 1 34 34 SER N N 15 113.743 0.2 . 1 . . . . . 34 SER N . 51829 1 165 . 1 . 1 35 35 GLN H H 1 8.01 0.04 . 1 . . . . . 35 GLN H . 51829 1 166 . 1 . 1 35 35 GLN C C 13 177.96 0.2 . 1 . . . . . 35 GLN C . 51829 1 167 . 1 . 1 35 35 GLN CA C 13 57.35 0.2 . 1 . . . . . 35 GLN CA . 51829 1 168 . 1 . 1 35 35 GLN CB C 13 28.99 0.2 . 1 . . . . . 35 GLN CB . 51829 1 169 . 1 . 1 35 35 GLN N N 15 122.178 0.2 . 1 . . . . . 35 GLN N . 51829 1 170 . 1 . 1 36 36 ARG H H 1 8.35 0.04 . 1 . . . . . 36 ARG H . 51829 1 171 . 1 . 1 36 36 ARG C C 13 177.21 0.2 . 1 . . . . . 36 ARG C . 51829 1 172 . 1 . 1 36 36 ARG CA C 13 57.87 0.2 . 1 . . . . . 36 ARG CA . 51829 1 173 . 1 . 1 36 36 ARG CB C 13 30.09 0.2 . 1 . . . . . 36 ARG CB . 51829 1 174 . 1 . 1 36 36 ARG N N 15 121.417 0.2 . 1 . . . . . 36 ARG N . 51829 1 175 . 1 . 1 37 37 LYS H H 1 8.09 0.04 . 1 . . . . . 37 LYS H . 51829 1 176 . 1 . 1 37 37 LYS C C 13 178.38 0.2 . 1 . . . . . 37 LYS C . 51829 1 177 . 1 . 1 37 37 LYS CA C 13 57.85 0.2 . 1 . . . . . 37 LYS CA . 51829 1 178 . 1 . 1 37 37 LYS CB C 13 32.62 0.2 . 1 . . . . . 37 LYS CB . 51829 1 179 . 1 . 1 37 37 LYS N N 15 120.852 0.2 . 1 . . . . . 37 LYS N . 51829 1 180 . 1 . 1 38 38 GLN H H 1 8.13 0.04 . 1 . . . . . 38 GLN H . 51829 1 181 . 1 . 1 38 38 GLN C C 13 177.42 0.2 . 1 . . . . . 38 GLN C . 51829 1 182 . 1 . 1 38 38 GLN CA C 13 57.48 0.2 . 1 . . . . . 38 GLN CA . 51829 1 183 . 1 . 1 38 38 GLN CB C 13 29.03 0.2 . 1 . . . . . 38 GLN CB . 51829 1 184 . 1 . 1 38 38 GLN N N 15 120.756 0.2 . 1 . . . . . 38 GLN N . 51829 1 185 . 1 . 1 39 39 ARG H H 1 8.31 0.04 . 1 . . . . . 39 ARG H . 51829 1 186 . 1 . 1 39 39 ARG C C 13 177.67 0.2 . 1 . . . . . 39 ARG C . 51829 1 187 . 1 . 1 39 39 ARG CA C 13 57.68 0.2 . 1 . . . . . 39 ARG CA . 51829 1 188 . 1 . 1 39 39 ARG CB C 13 29.71 0.2 . 1 . . . . . 39 ARG CB . 51829 1 189 . 1 . 1 39 39 ARG N N 15 121.549 0.2 . 1 . . . . . 39 ARG N . 51829 1 190 . 1 . 1 40 40 ASP H H 1 8.45 0.04 . 1 . . . . . 40 ASP H . 51829 1 191 . 1 . 1 40 40 ASP C C 13 178.35 0.2 . 1 . . . . . 40 ASP C . 51829 1 192 . 1 . 1 40 40 ASP CA C 13 56.20 0.2 . 1 . . . . . 40 ASP CA . 51829 1 193 . 1 . 1 40 40 ASP CB C 13 40.41 0.2 . 1 . . . . . 40 ASP CB . 51829 1 194 . 1 . 1 40 40 ASP N N 15 120.550 0.2 . 1 . . . . . 40 ASP N . 51829 1 195 . 1 . 1 41 41 SER H H 1 8.12 0.04 . 1 . . . . . 41 SER H . 51829 1 196 . 1 . 1 41 41 SER C C 13 178.30 0.2 . 1 . . . . . 41 SER C . 51829 1 197 . 1 . 1 41 41 SER CA C 13 59.94 0.2 . 1 . . . . . 41 SER CA . 51829 1 198 . 1 . 1 41 41 SER CB C 13 63.34 0.2 . 1 . . . . . 41 SER CB . 51829 1 199 . 1 . 1 41 41 SER N N 15 115.473 0.2 . 1 . . . . . 41 SER N . 51829 1 200 . 1 . 1 42 42 GLU H H 1 8.18 0.04 . 1 . . . . . 42 GLU H . 51829 1 201 . 1 . 1 42 42 GLU C C 13 178.63 0.2 . 1 . . . . . 42 GLU C . 51829 1 202 . 1 . 1 42 42 GLU CA C 13 58.08 0.2 . 1 . . . . . 42 GLU CA . 51829 1 203 . 1 . 1 42 42 GLU CB C 13 29.90 0.2 . 1 . . . . . 42 GLU CB . 51829 1 204 . 1 . 1 42 42 GLU N N 15 122.753 0.2 . 1 . . . . . 42 GLU N . 51829 1 205 . 1 . 1 43 43 ILE H H 1 8.08 0.04 . 1 . . . . . 43 ILE H . 51829 1 206 . 1 . 1 43 43 ILE C C 13 177.95 0.2 . 1 . . . . . 43 ILE C . 51829 1 207 . 1 . 1 43 43 ILE CA C 13 62.86 0.2 . 1 . . . . . 43 ILE CA . 51829 1 208 . 1 . 1 43 43 ILE CB C 13 38.15 0.2 . 1 . . . . . 43 ILE CB . 51829 1 209 . 1 . 1 43 43 ILE N N 15 120.861 0.2 . 1 . . . . . 43 ILE N . 51829 1 210 . 1 . 1 44 44 MET H H 1 8.16 0.04 . 1 . . . . . 44 MET H . 51829 1 211 . 1 . 1 44 44 MET C C 13 178.10 0.2 . 1 . . . . . 44 MET C . 51829 1 212 . 1 . 1 44 44 MET CA C 13 57.61 0.2 . 1 . . . . . 44 MET CA . 51829 1 213 . 1 . 1 44 44 MET CB C 13 32.26 0.2 . 1 . . . . . 44 MET CB . 51829 1 214 . 1 . 1 44 44 MET N N 15 121.844 0.2 . 1 . . . . . 44 MET N . 51829 1 215 . 1 . 1 45 45 GLN H H 1 8.25 0.04 . 1 . . . . . 45 GLN H . 51829 1 216 . 1 . 1 45 45 GLN C C 13 178.05 0.2 . 1 . . . . . 45 GLN C . 51829 1 217 . 1 . 1 45 45 GLN CA C 13 57.84 0.2 . 1 . . . . . 45 GLN CA . 51829 1 218 . 1 . 1 45 45 GLN CB C 13 28.85 0.2 . 1 . . . . . 45 GLN CB . 51829 1 219 . 1 . 1 45 45 GLN N N 15 120.549 0.2 . 1 . . . . . 45 GLN N . 51829 1 220 . 1 . 1 46 46 GLU H H 1 8.32 0.04 . 1 . . . . . 46 GLU H . 51829 1 221 . 1 . 1 46 46 GLU C C 13 178.68 0.2 . 1 . . . . . 46 GLU C . 51829 1 222 . 1 . 1 46 46 GLU N N 15 121.208 0.2 . 1 . . . . . 46 GLU N . 51829 1 223 . 1 . 1 49 49 LYS CA C 13 57.49 0.2 . 1 . . . . . 49 LYS CA . 51829 1 224 . 1 . 1 49 49 LYS CB C 13 32.76 0.2 . 1 . . . . . 49 LYS CB . 51829 1 225 . 1 . 1 50 50 ALA H H 1 8.17 0.04 . 1 . . . . . 50 ALA H . 51829 1 226 . 1 . 1 50 50 ALA C C 13 179.15 0.2 . 1 . . . . . 50 ALA C . 51829 1 227 . 1 . 1 50 50 ALA CA C 13 53.18 0.2 . 1 . . . . . 50 ALA CA . 51829 1 228 . 1 . 1 50 50 ALA CB C 13 18.64 0.2 . 1 . . . . . 50 ALA CB . 51829 1 229 . 1 . 1 50 50 ALA N N 15 123.592 0.2 . 1 . . . . . 50 ALA N . 51829 1 230 . 1 . 1 51 51 ALA H H 1 8.12 0.04 . 1 . . . . . 51 ALA H . 51829 1 231 . 1 . 1 51 51 ALA C C 13 178.99 0.2 . 1 . . . . . 51 ALA C . 51829 1 232 . 1 . 1 51 51 ALA CA C 13 53.41 0.2 . 1 . . . . . 51 ALA CA . 51829 1 233 . 1 . 1 51 51 ALA CB C 13 18.80 0.2 . 1 . . . . . 51 ALA CB . 51829 1 234 . 1 . 1 51 51 ALA N N 15 122.245 0.2 . 1 . . . . . 51 ALA N . 51829 1 235 . 1 . 1 52 52 ASN H H 1 8.25 0.04 . 1 . . . . . 52 ASN H . 51829 1 236 . 1 . 1 52 52 ASN C C 13 176.34 0.2 . 1 . . . . . 52 ASN C . 51829 1 237 . 1 . 1 52 52 ASN CA C 13 54.01 0.2 . 1 . . . . . 52 ASN CA . 51829 1 238 . 1 . 1 52 52 ASN CB C 13 38.68 0.2 . 1 . . . . . 52 ASN CB . 51829 1 239 . 1 . 1 52 52 ASN N N 15 117.158 0.2 . 1 . . . . . 52 ASN N . 51829 1 240 . 1 . 1 53 53 GLU H H 1 8.19 0.04 . 1 . . . . . 53 GLU H . 51829 1 241 . 1 . 1 53 53 GLU C C 13 177.23 0.2 . 1 . . . . . 53 GLU C . 51829 1 242 . 1 . 1 53 53 GLU CA C 13 57.57 0.2 . 1 . . . . . 53 GLU CA . 51829 1 243 . 1 . 1 53 53 GLU CB C 13 29.96 0.2 . 1 . . . . . 53 GLU CB . 51829 1 244 . 1 . 1 53 53 GLU N N 15 121.156 0.2 . 1 . . . . . 53 GLU N . 51829 1 245 . 1 . 1 56 56 SER H H 1 8.28 0.04 . 1 . . . . . 56 SER H . 51829 1 246 . 1 . 1 56 56 SER C C 13 174.81 0.2 . 1 . . . . . 56 SER C . 51829 1 247 . 1 . 1 56 56 SER CA C 13 58.67 0.2 . 1 . . . . . 56 SER CA . 51829 1 248 . 1 . 1 56 56 SER CB C 13 63.60 0.2 . 1 . . . . . 56 SER CB . 51829 1 249 . 1 . 1 56 56 SER N N 15 116.501 0.2 . 1 . . . . . 56 SER N . 51829 1 250 . 1 . 1 57 57 MET H H 1 8.34 0.04 . 1 . . . . . 57 MET H . 51829 1 251 . 1 . 1 57 57 MET C C 13 175.51 0.2 . 1 . . . . . 57 MET C . 51829 1 252 . 1 . 1 57 57 MET CA C 13 56.69 0.2 . 1 . . . . . 57 MET CA . 51829 1 253 . 1 . 1 57 57 MET CB C 13 32.54 0.2 . 1 . . . . . 57 MET CB . 51829 1 254 . 1 . 1 57 57 MET N N 15 121.931 0.2 . 1 . . . . . 57 MET N . 51829 1 255 . 1 . 1 58 58 GLN C C 13 176.13 0.2 . 1 . . . . . 58 GLN C . 51829 1 256 . 1 . 1 58 58 GLN CA C 13 56.31 0.2 . 1 . . . . . 58 GLN CA . 51829 1 257 . 1 . 1 58 58 GLN CB C 13 29.34 0.2 . 1 . . . . . 58 GLN CB . 51829 1 258 . 1 . 1 59 59 THR H H 1 8.19 0.04 . 1 . . . . . 59 THR H . 51829 1 259 . 1 . 1 59 59 THR C C 13 174.12 0.2 . 1 . . . . . 59 THR C . 51829 1 260 . 1 . 1 59 59 THR CA C 13 61.89 0.2 . 1 . . . . . 59 THR CA . 51829 1 261 . 1 . 1 59 59 THR CB C 13 69.77 0.2 . 1 . . . . . 59 THR CB . 51829 1 262 . 1 . 1 59 59 THR N N 15 115.850 0.2 . 1 . . . . . 59 THR N . 51829 1 263 . 1 . 1 60 60 ARG H H 1 8.35 0.04 . 1 . . . . . 60 ARG H . 51829 1 264 . 1 . 1 60 60 ARG C C 13 175.92 0.2 . 1 . . . . . 60 ARG C . 51829 1 265 . 1 . 1 60 60 ARG CA C 13 55.82 0.2 . 1 . . . . . 60 ARG CA . 51829 1 266 . 1 . 1 60 60 ARG CB C 13 30.88 0.2 . 1 . . . . . 60 ARG CB . 51829 1 267 . 1 . 1 60 60 ARG N N 15 123.413 0.2 . 1 . . . . . 60 ARG N . 51829 1 268 . 1 . 1 61 61 GLU H H 1 8.53 0.04 . 1 . . . . . 61 GLU H . 51829 1 269 . 1 . 1 61 61 GLU C C 13 175.28 0.2 . 1 . . . . . 61 GLU C . 51829 1 270 . 1 . 1 61 61 GLU CA C 13 56.89 0.2 . 1 . . . . . 61 GLU CA . 51829 1 271 . 1 . 1 61 61 GLU CB C 13 30.26 0.2 . 1 . . . . . 61 GLU CB . 51829 1 272 . 1 . 1 61 61 GLU N N 15 122.938 0.2 . 1 . . . . . 61 GLU N . 51829 1 273 . 1 . 1 62 62 LYS H H 1 7.94 0.04 . 1 . . . . . 62 LYS H . 51829 1 274 . 1 . 1 62 62 LYS C C 13 180.91 0.2 . 1 . . . . . 62 LYS C . 51829 1 275 . 1 . 1 62 62 LYS CA C 13 57.74 0.2 . 1 . . . . . 62 LYS CA . 51829 1 276 . 1 . 1 62 62 LYS CB C 13 33.48 0.2 . 1 . . . . . 62 LYS CB . 51829 1 277 . 1 . 1 62 62 LYS N N 15 126.625 0.2 . 1 . . . . . 62 LYS N . 51829 1 stop_ save_