################################### # 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 30726 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D HNCA' . . . 30726 1 2 '3D 1H-15N NOESY' . . . 30726 1 3 '3D 1H-13C NOESY aliphatic' . . . 30726 1 4 '3D HNCACB' . . . 30726 1 5 '3D HN(CO)CA' . . . 30726 1 6 '3D 1H-15N TOCSY' . . . 30726 1 7 '3D 1H-13C NOESY aromatic' . . . 30726 1 8 '3D CBCA(CO)NH' . . . 30726 1 9 '3D HCCCONH' . . . 30726 1 10 '3D HCCH-TOCSY' . . . 30726 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 H H 1 8.275 0.020 . 1 . . . . A 1 MET H1 . 30726 1 2 . 1 . 1 1 1 MET HA H 1 4.180 0.020 . 1 . . . . A 1 MET HA . 30726 1 3 . 1 . 1 1 1 MET HB2 H 1 1.898 0.020 . 2 . . . . A 1 MET HB2 . 30726 1 4 . 1 . 1 1 1 MET HB3 H 1 1.727 0.020 . 2 . . . . A 1 MET HB3 . 30726 1 5 . 1 . 1 1 1 MET HG2 H 1 2.127 0.020 . 1 . . . . A 1 MET HG2 . 30726 1 6 . 1 . 1 1 1 MET HG3 H 1 2.127 0.020 . 1 . . . . A 1 MET HG3 . 30726 1 7 . 1 . 1 1 1 MET CA C 13 51.370 0.3 . 1 . . . . A 1 MET CA . 30726 1 8 . 1 . 1 1 1 MET CB C 13 26.464 0.3 . 1 . . . . A 1 MET CB . 30726 1 9 . 1 . 1 1 1 MET N N 15 123.124 0.3 . 1 . . . . A 1 MET N . 30726 1 10 . 1 . 1 2 2 TRP H H 1 8.683 0.020 . 1 . . . . A 2 TRP H . 30726 1 11 . 1 . 1 2 2 TRP CA C 13 54.532 0.3 . 1 . . . . A 2 TRP CA . 30726 1 12 . 1 . 1 2 2 TRP CB C 13 26.615 0.3 . 1 . . . . A 2 TRP CB . 30726 1 13 . 1 . 1 2 2 TRP N N 15 124.724 0.3 . 1 . . . . A 2 TRP N . 30726 1 14 . 1 . 1 3 3 GLN H H 1 8.150 0.020 . 1 . . . . A 3 GLN H . 30726 1 15 . 1 . 1 3 3 GLN HA H 1 4.065 0.020 . 1 . . . . A 3 GLN HA . 30726 1 16 . 1 . 1 3 3 GLN HB2 H 1 1.794 0.020 . 2 . . . . A 3 GLN HB2 . 30726 1 17 . 1 . 1 3 3 GLN HB3 H 1 1.680 0.020 . 2 . . . . A 3 GLN HB3 . 30726 1 18 . 1 . 1 3 3 GLN HG2 H 1 2.062 0.020 . 1 . . . . A 3 GLN HG2 . 30726 1 19 . 1 . 1 3 3 GLN HG3 H 1 2.062 0.020 . 1 . . . . A 3 GLN HG3 . 30726 1 20 . 1 . 1 3 3 GLN CA C 13 52.473 0.3 . 1 . . . . A 3 GLN CA . 30726 1 21 . 1 . 1 3 3 GLN CB C 13 26.993 0.3 . 1 . . . . A 3 GLN CB . 30726 1 22 . 1 . 1 3 3 GLN CG C 13 30.783 0.3 . 1 . . . . A 3 GLN CG . 30726 1 23 . 1 . 1 3 3 GLN N N 15 123.238 0.3 . 1 . . . . A 3 GLN N . 30726 1 24 . 1 . 1 4 4 ARG H H 1 8.116 0.020 . 1 . . . . A 4 ARG H . 30726 1 25 . 1 . 1 4 4 ARG HA H 1 3.944 0.020 . 1 . . . . A 4 ARG HA . 30726 1 26 . 1 . 1 4 4 ARG HB2 H 1 1.611 0.020 . 2 . . . . A 4 ARG HB2 . 30726 1 27 . 1 . 1 4 4 ARG HB3 H 1 1.509 0.020 . 2 . . . . A 4 ARG HB3 . 30726 1 28 . 1 . 1 4 4 ARG HG2 H 1 1.416 0.020 . 1 . . . . A 4 ARG HG2 . 30726 1 29 . 1 . 1 4 4 ARG HG3 H 1 1.416 0.020 . 1 . . . . A 4 ARG HG3 . 30726 1 30 . 1 . 1 4 4 ARG HD2 H 1 3.037 0.020 . 1 . . . . A 4 ARG HD2 . 30726 1 31 . 1 . 1 4 4 ARG HD3 H 1 3.037 0.020 . 1 . . . . A 4 ARG HD3 . 30726 1 32 . 1 . 1 4 4 ARG CA C 13 53.543 0.3 . 1 . . . . A 4 ARG CA . 30726 1 33 . 1 . 1 4 4 ARG CB C 13 27.599 0.3 . 1 . . . . A 4 ARG CB . 30726 1 34 . 1 . 1 4 4 ARG CG C 13 27.190 0.3 . 1 . . . . A 4 ARG CG . 30726 1 35 . 1 . 1 4 4 ARG CD C 13 40.156 0.3 . 1 . . . . A 4 ARG CD . 30726 1 36 . 1 . 1 4 4 ARG N N 15 122.426 0.3 . 1 . . . . A 4 ARG N . 30726 1 37 . 1 . 1 5 5 ARG H H 1 8.386 0.020 . 1 . . . . A 5 ARG H . 30726 1 38 . 1 . 1 5 5 ARG HA H 1 4.111 0.020 . 1 . . . . A 5 ARG HA . 30726 1 39 . 1 . 1 5 5 ARG HB2 H 1 1.644 0.020 . 1 . . . . A 5 ARG HB2 . 30726 1 40 . 1 . 1 5 5 ARG HB3 H 1 1.644 0.020 . 1 . . . . A 5 ARG HB3 . 30726 1 41 . 1 . 1 5 5 ARG HG2 H 1 1.462 0.020 . 1 . . . . A 5 ARG HG2 . 30726 1 42 . 1 . 1 5 5 ARG HG3 H 1 1.462 0.020 . 1 . . . . A 5 ARG HG3 . 30726 1 43 . 1 . 1 5 5 ARG HD2 H 1 3.021 0.020 . 1 . . . . A 5 ARG HD2 . 30726 1 44 . 1 . 1 5 5 ARG HD3 H 1 3.021 0.020 . 1 . . . . A 5 ARG HD3 . 30726 1 45 . 1 . 1 5 5 ARG CA C 13 53.446 0.3 . 1 . . . . A 5 ARG CA . 30726 1 46 . 1 . 1 5 5 ARG CB C 13 27.901 0.3 . 1 . . . . A 5 ARG CB . 30726 1 47 . 1 . 1 5 5 ARG CG C 13 27.503 0.3 . 1 . . . . A 5 ARG CG . 30726 1 48 . 1 . 1 5 5 ARG CD C 13 40.078 0.3 . 1 . . . . A 5 ARG CD . 30726 1 49 . 1 . 1 5 5 ARG N N 15 122.454 0.3 . 1 . . . . A 5 ARG N . 30726 1 50 . 1 . 1 6 6 GLN H H 1 8.380 0.020 . 1 . . . . A 6 GLN H . 30726 1 51 . 1 . 1 6 6 GLN HA H 1 4.186 0.020 . 1 . . . . A 6 GLN HA . 30726 1 52 . 1 . 1 6 6 GLN HB2 H 1 1.818 0.020 . 1 . . . . A 6 GLN HB2 . 30726 1 53 . 1 . 1 6 6 GLN HB3 H 1 1.818 0.020 . 1 . . . . A 6 GLN HB3 . 30726 1 54 . 1 . 1 6 6 GLN HG2 H 1 2.204 0.020 . 1 . . . . A 6 GLN HG2 . 30726 1 55 . 1 . 1 6 6 GLN HG3 H 1 2.204 0.020 . 1 . . . . A 6 GLN HG3 . 30726 1 56 . 1 . 1 6 6 GLN CA C 13 53.121 0.3 . 1 . . . . A 6 GLN CA . 30726 1 57 . 1 . 1 6 6 GLN CB C 13 26.691 0.3 . 1 . . . . A 6 GLN CB . 30726 1 58 . 1 . 1 6 6 GLN CG C 13 33.517 0.3 . 1 . . . . A 6 GLN CG . 30726 1 59 . 1 . 1 6 6 GLN N N 15 121.882 0.3 . 1 . . . . A 6 GLN N . 30726 1 60 . 1 . 1 7 7 ARG H H 1 8.436 0.020 . 1 . . . . A 7 ARG H . 30726 1 61 . 1 . 1 7 7 ARG HA H 1 4.186 0.020 . 1 . . . . A 7 ARG HA . 30726 1 62 . 1 . 1 7 7 ARG HB2 H 1 1.658 0.020 . 2 . . . . A 7 ARG HB2 . 30726 1 63 . 1 . 1 7 7 ARG HB3 H 1 1.593 0.020 . 2 . . . . A 7 ARG HB3 . 30726 1 64 . 1 . 1 7 7 ARG HG2 H 1 1.481 0.020 . 1 . . . . A 7 ARG HG2 . 30726 1 65 . 1 . 1 7 7 ARG HG3 H 1 1.481 0.020 . 1 . . . . A 7 ARG HG3 . 30726 1 66 . 1 . 1 7 7 ARG HD2 H 1 3.037 0.020 . 1 . . . . A 7 ARG HD2 . 30726 1 67 . 1 . 1 7 7 ARG HD3 H 1 3.037 0.020 . 1 . . . . A 7 ARG HD3 . 30726 1 68 . 1 . 1 7 7 ARG CA C 13 53.121 0.3 . 1 . . . . A 7 ARG CA . 30726 1 69 . 1 . 1 7 7 ARG CB C 13 27.826 0.3 . 1 . . . . A 7 ARG CB . 30726 1 70 . 1 . 1 7 7 ARG CG C 13 27.112 0.3 . 1 . . . . A 7 ARG CG . 30726 1 71 . 1 . 1 7 7 ARG CD C 13 40.078 0.3 . 1 . . . . A 7 ARG CD . 30726 1 72 . 1 . 1 7 7 ARG N N 15 123.140 0.3 . 1 . . . . A 7 ARG N . 30726 1 73 . 1 . 1 8 8 ARG H H 1 8.505 0.020 . 1 . . . . A 8 ARG H . 30726 1 74 . 1 . 1 8 8 ARG HA H 1 4.171 0.020 . 1 . . . . A 8 ARG HA . 30726 1 75 . 1 . 1 8 8 ARG HB2 H 1 1.723 0.020 . 2 . . . . A 8 ARG HB2 . 30726 1 76 . 1 . 1 8 8 ARG HB3 H 1 1.621 0.020 . 2 . . . . A 8 ARG HB3 . 30726 1 77 . 1 . 1 8 8 ARG HG2 H 1 1.509 0.020 . 1 . . . . A 8 ARG HG2 . 30726 1 78 . 1 . 1 8 8 ARG HG3 H 1 1.509 0.020 . 1 . . . . A 8 ARG HG3 . 30726 1 79 . 1 . 1 8 8 ARG HD2 H 1 3.037 0.020 . 1 . . . . A 8 ARG HD2 . 30726 1 80 . 1 . 1 8 8 ARG HD3 H 1 3.037 0.020 . 1 . . . . A 8 ARG HD3 . 30726 1 81 . 1 . 1 8 8 ARG CA C 13 53.478 0.3 . 1 . . . . A 8 ARG CA . 30726 1 82 . 1 . 1 8 8 ARG CB C 13 27.826 0.3 . 1 . . . . A 8 ARG CB . 30726 1 83 . 1 . 1 8 8 ARG CG C 13 27.268 0.3 . 1 . . . . A 8 ARG CG . 30726 1 84 . 1 . 1 8 8 ARG CD C 13 40.234 0.3 . 1 . . . . A 8 ARG CD . 30726 1 85 . 1 . 1 8 8 ARG N N 15 122.856 0.3 . 1 . . . . A 8 ARG N . 30726 1 86 . 1 . 1 9 9 GLY H H 1 8.532 0.020 . 1 . . . . A 9 GLY H . 30726 1 87 . 1 . 1 9 9 GLY HA2 H 1 3.808 0.020 . 1 . . . . A 9 GLY HA2 . 30726 1 88 . 1 . 1 9 9 GLY HA3 H 1 3.808 0.020 . 1 . . . . A 9 GLY HA3 . 30726 1 89 . 1 . 1 9 9 GLY CA C 13 42.712 0.3 . 1 . . . . A 9 GLY CA . 30726 1 90 . 1 . 1 9 9 GLY N N 15 110.825 0.3 . 1 . . . . A 9 GLY N . 30726 1 91 . 1 . 1 10 10 GLU H H 1 8.195 0.020 . 1 . . . . A 10 GLU H . 30726 1 92 . 1 . 1 10 10 GLU HA H 1 4.156 0.020 . 1 . . . . A 10 GLU HA . 30726 1 93 . 1 . 1 10 10 GLU HB2 H 1 1.962 0.020 . 2 . . . . A 10 GLU HB2 . 30726 1 94 . 1 . 1 10 10 GLU HB3 H 1 1.780 0.020 . 2 . . . . A 10 GLU HB3 . 30726 1 95 . 1 . 1 10 10 GLU HG2 H 1 2.109 0.020 . 1 . . . . A 10 GLU HG2 . 30726 1 96 . 1 . 1 10 10 GLU HG3 H 1 2.109 0.020 . 1 . . . . A 10 GLU HG3 . 30726 1 97 . 1 . 1 10 10 GLU CA C 13 53.640 0.3 . 1 . . . . A 10 GLU CA . 30726 1 98 . 1 . 1 10 10 GLU CB C 13 27.296 0.3 . 1 . . . . A 10 GLU CB . 30726 1 99 . 1 . 1 10 10 GLU CG C 13 33.439 0.3 . 1 . . . . A 10 GLU CG . 30726 1 100 . 1 . 1 10 10 GLU N N 15 120.272 0.3 . 1 . . . . A 10 GLU N . 30726 1 101 . 1 . 1 11 11 GLU H H 1 8.261 0.020 . 1 . . . . A 11 GLU H . 30726 1 102 . 1 . 1 11 11 GLU HA H 1 4.126 0.020 . 1 . . . . A 11 GLU HA . 30726 1 103 . 1 . 1 11 11 GLU HB2 H 1 1.901 0.020 . 2 . . . . A 11 GLU HB2 . 30726 1 104 . 1 . 1 11 11 GLU HB3 H 1 1.780 0.020 . 2 . . . . A 11 GLU HB3 . 30726 1 105 . 1 . 1 11 11 GLU HG2 H 1 2.143 0.020 . 1 . . . . A 11 GLU HG2 . 30726 1 106 . 1 . 1 11 11 GLU HG3 H 1 2.143 0.020 . 1 . . . . A 11 GLU HG3 . 30726 1 107 . 1 . 1 11 11 GLU CA C 13 53.932 0.3 . 1 . . . . A 11 GLU CA . 30726 1 108 . 1 . 1 11 11 GLU CB C 13 26.842 0.3 . 1 . . . . A 11 GLU CB . 30726 1 109 . 1 . 1 11 11 GLU CG C 13 33.517 0.3 . 1 . . . . A 11 GLU CG . 30726 1 110 . 1 . 1 11 11 GLU N N 15 121.049 0.3 . 1 . . . . A 11 GLU N . 30726 1 111 . 1 . 1 12 12 ARG H H 1 8.250 0.020 . 1 . . . . A 12 ARG H . 30726 1 112 . 1 . 1 12 12 ARG HA H 1 4.186 0.020 . 1 . . . . A 12 ARG HA . 30726 1 113 . 1 . 1 12 12 ARG HB2 H 1 1.723 0.020 . 2 . . . . A 12 ARG HB2 . 30726 1 114 . 1 . 1 12 12 ARG HB3 H 1 1.630 0.020 . 2 . . . . A 12 ARG HB3 . 30726 1 115 . 1 . 1 12 12 ARG HG2 H 1 1.462 0.020 . 1 . . . . A 12 ARG HG2 . 30726 1 116 . 1 . 1 12 12 ARG HG3 H 1 1.462 0.020 . 1 . . . . A 12 ARG HG3 . 30726 1 117 . 1 . 1 12 12 ARG HD2 H 1 3.027 0.020 . 1 . . . . A 12 ARG HD2 . 30726 1 118 . 1 . 1 12 12 ARG HD3 H 1 3.027 0.020 . 1 . . . . A 12 ARG HD3 . 30726 1 119 . 1 . 1 12 12 ARG CA C 13 53.089 0.3 . 1 . . . . A 12 ARG CA . 30726 1 120 . 1 . 1 12 12 ARG CB C 13 27.372 0.3 . 1 . . . . A 12 ARG CB . 30726 1 121 . 1 . 1 12 12 ARG CG C 13 27.372 0.3 . 1 . . . . A 12 ARG CG . 30726 1 122 . 1 . 1 12 12 ARG CD C 13 40.000 0.3 . 1 . . . . A 12 ARG CD . 30726 1 123 . 1 . 1 12 12 ARG N N 15 122.019 0.3 . 1 . . . . A 12 ARG N . 30726 1 124 . 1 . 1 13 13 LYS H H 1 8.261 0.020 . 1 . . . . A 13 LYS H . 30726 1 125 . 1 . 1 13 13 LYS HA H 1 4.398 0.020 . 1 . . . . A 13 LYS HA . 30726 1 126 . 1 . 1 13 13 LYS HB2 H 1 1.704 0.020 . 1 . . . . A 13 LYS HB2 . 30726 1 127 . 1 . 1 13 13 LYS HB3 H 1 1.704 0.020 . 1 . . . . A 13 LYS HB3 . 30726 1 128 . 1 . 1 13 13 LYS HG2 H 1 1.281 0.020 . 1 . . . . A 13 LYS HG2 . 30726 1 129 . 1 . 1 13 13 LYS HG3 H 1 1.281 0.020 . 1 . . . . A 13 LYS HG3 . 30726 1 130 . 1 . 1 13 13 LYS HD2 H 1 1.565 0.020 . 1 . . . . A 13 LYS HD2 . 30726 1 131 . 1 . 1 13 13 LYS HD3 H 1 1.565 0.020 . 1 . . . . A 13 LYS HD3 . 30726 1 132 . 1 . 1 13 13 LYS HE2 H 1 2.855 0.020 . 1 . . . . A 13 LYS HE2 . 30726 1 133 . 1 . 1 13 13 LYS HE3 H 1 2.855 0.020 . 1 . . . . A 13 LYS HE3 . 30726 1 134 . 1 . 1 13 13 LYS CA C 13 53.121 0.3 . 1 . . . . A 13 LYS CA . 30726 1 135 . 1 . 1 13 13 LYS CB C 13 30.095 0.3 . 1 . . . . A 13 LYS CB . 30726 1 136 . 1 . 1 13 13 LYS CG C 13 21.801 0.3 . 1 . . . . A 13 LYS CG . 30726 1 137 . 1 . 1 13 13 LYS CD C 13 25.706 0.3 . 1 . . . . A 13 LYS CD . 30726 1 138 . 1 . 1 13 13 LYS CE C 13 39.219 0.3 . 1 . . . . A 13 LYS CE . 30726 1 139 . 1 . 1 13 13 LYS N N 15 122.974 0.3 . 1 . . . . A 13 LYS N . 30726 1 140 . 1 . 1 14 14 ALA H H 1 8.268 0.020 . 1 . . . . A 14 ALA H . 30726 1 141 . 1 . 1 14 14 ALA HA H 1 4.461 0.020 . 1 . . . . A 14 ALA HA . 30726 1 142 . 1 . 1 14 14 ALA HB1 H 1 1.265 0.020 . 1 . . . . A 14 ALA HB1 . 30726 1 143 . 1 . 1 14 14 ALA HB2 H 1 1.265 0.020 . 1 . . . . A 14 ALA HB2 . 30726 1 144 . 1 . 1 14 14 ALA HB3 H 1 1.265 0.020 . 1 . . . . A 14 ALA HB3 . 30726 1 145 . 1 . 1 14 14 ALA CA C 13 47.771 0.3 . 1 . . . . A 14 ALA CA . 30726 1 146 . 1 . 1 14 14 ALA CB C 13 15.315 0.3 . 1 . . . . A 14 ALA CB . 30726 1 147 . 1 . 1 14 14 ALA N N 15 126.590 0.3 . 1 . . . . A 14 ALA N . 30726 1 148 . 1 . 1 16 16 GLU H H 1 8.604 0.020 . 1 . . . . A 16 GLU H . 30726 1 149 . 1 . 1 16 16 GLU HA H 1 4.065 0.020 . 1 . . . . A 16 GLU HA . 30726 1 150 . 1 . 1 16 16 GLU HB2 H 1 1.916 0.020 . 2 . . . . A 16 GLU HB2 . 30726 1 151 . 1 . 1 16 16 GLU HB3 H 1 1.795 0.020 . 2 . . . . A 16 GLU HB3 . 30726 1 152 . 1 . 1 16 16 GLU HG2 H 1 2.143 0.020 . 1 . . . . A 16 GLU HG2 . 30726 1 153 . 1 . 1 16 16 GLU HG3 H 1 2.143 0.020 . 1 . . . . A 16 GLU HG3 . 30726 1 154 . 1 . 1 16 16 GLU CA C 13 54.224 0.3 . 1 . . . . A 16 GLU CA . 30726 1 155 . 1 . 1 16 16 GLU CB C 13 26.993 0.3 . 1 . . . . A 16 GLU CB . 30726 1 156 . 1 . 1 16 16 GLU CG C 13 33.439 0.3 . 1 . . . . A 16 GLU CG . 30726 1 157 . 1 . 1 16 16 GLU N N 15 119.705 0.3 . 1 . . . . A 16 GLU N . 30726 1 158 . 1 . 1 17 17 ASN H H 1 8.188 0.020 . 1 . . . . A 17 ASN H . 30726 1 159 . 1 . 1 17 17 ASN HA H 1 4.588 0.020 . 1 . . . . A 17 ASN HA . 30726 1 160 . 1 . 1 17 17 ASN HB2 H 1 2.710 0.020 . 1 . . . . A 17 ASN HB2 . 30726 1 161 . 1 . 1 17 17 ASN HB3 H 1 2.710 0.020 . 1 . . . . A 17 ASN HB3 . 30726 1 162 . 1 . 1 17 17 ASN CA C 13 50.430 0.3 . 1 . . . . A 17 ASN CA . 30726 1 163 . 1 . 1 17 17 ASN CB C 13 35.845 0.3 . 1 . . . . A 17 ASN CB . 30726 1 164 . 1 . 1 17 17 ASN N N 15 117.772 0.3 . 1 . . . . A 17 ASN N . 30726 1 165 . 1 . 1 18 18 GLN H H 1 8.250 0.020 . 1 . . . . A 18 GLN H . 30726 1 166 . 1 . 1 18 18 GLN HA H 1 4.141 0.020 . 1 . . . . A 18 GLN HA . 30726 1 167 . 1 . 1 18 18 GLN HB2 H 1 1.992 0.020 . 2 . . . . A 18 GLN HB2 . 30726 1 168 . 1 . 1 18 18 GLN HB3 H 1 1.810 0.020 . 2 . . . . A 18 GLN HB3 . 30726 1 169 . 1 . 1 18 18 GLN HG2 H 1 2.173 0.020 . 1 . . . . A 18 GLN HG2 . 30726 1 170 . 1 . 1 18 18 GLN HG3 H 1 2.173 0.020 . 1 . . . . A 18 GLN HG3 . 30726 1 171 . 1 . 1 18 18 GLN CA C 13 53.056 0.3 . 1 . . . . A 18 GLN CA . 30726 1 172 . 1 . 1 18 18 GLN CB C 13 26.615 0.3 . 1 . . . . A 18 GLN CB . 30726 1 173 . 1 . 1 18 18 GLN CG C 13 33.517 0.3 . 1 . . . . A 18 GLN CG . 30726 1 174 . 1 . 1 18 18 GLN N N 15 120.795 0.3 . 1 . . . . A 18 GLN N . 30726 1 175 . 1 . 1 19 19 GLU H H 1 8.369 0.020 . 1 . . . . A 19 GLU H . 30726 1 176 . 1 . 1 19 19 GLU HA H 1 4.126 0.020 . 1 . . . . A 19 GLU HA . 30726 1 177 . 1 . 1 19 19 GLU HB2 H 1 1.946 0.020 . 2 . . . . A 19 GLU HB2 . 30726 1 178 . 1 . 1 19 19 GLU HB3 H 1 1.810 0.020 . 2 . . . . A 19 GLU HB3 . 30726 1 179 . 1 . 1 19 19 GLU HG2 H 1 2.123 0.020 . 1 . . . . A 19 GLU HG2 . 30726 1 180 . 1 . 1 19 19 GLU HG3 H 1 2.123 0.020 . 1 . . . . A 19 GLU HG3 . 30726 1 181 . 1 . 1 19 19 GLU CA C 13 54.029 0.3 . 1 . . . . A 19 GLU CA . 30726 1 182 . 1 . 1 19 19 GLU CB C 13 26.691 0.3 . 1 . . . . A 19 GLU CB . 30726 1 183 . 1 . 1 19 19 GLU CG C 13 33.439 0.3 . 1 . . . . A 19 GLU CG . 30726 1 184 . 1 . 1 19 19 GLU N N 15 121.353 0.3 . 1 . . . . A 19 GLU N . 30726 1 185 . 1 . 1 20 20 GLU H H 1 8.285 0.020 . 1 . . . . A 20 GLU H . 30726 1 186 . 1 . 1 20 20 GLU HA H 1 4.065 0.020 . 1 . . . . A 20 GLU HA . 30726 1 187 . 1 . 1 20 20 GLU HB2 H 1 1.826 0.020 . 1 . . . . A 20 GLU HB2 . 30726 1 188 . 1 . 1 20 20 GLU HB3 H 1 1.826 0.020 . 1 . . . . A 20 GLU HB3 . 30726 1 189 . 1 . 1 20 20 GLU HG2 H 1 2.118 0.020 . 1 . . . . A 20 GLU HG2 . 30726 1 190 . 1 . 1 20 20 GLU HG3 H 1 2.118 0.020 . 1 . . . . A 20 GLU HG3 . 30726 1 191 . 1 . 1 20 20 GLU CA C 13 53.964 0.3 . 1 . . . . A 20 GLU CA . 30726 1 192 . 1 . 1 20 20 GLU CB C 13 26.918 0.3 . 1 . . . . A 20 GLU CB . 30726 1 193 . 1 . 1 20 20 GLU CG C 13 33.283 0.3 . 1 . . . . A 20 GLU CG . 30726 1 194 . 1 . 1 20 20 GLU N N 15 121.721 0.3 . 1 . . . . A 20 GLU N . 30726 1 195 . 1 . 1 21 21 GLU H H 1 8.228 0.020 . 1 . . . . A 21 GLU H . 30726 1 196 . 1 . 1 21 21 GLU HA H 1 4.126 0.020 . 1 . . . . A 21 GLU HA . 30726 1 197 . 1 . 1 21 21 GLU HB2 H 1 1.952 0.020 . 2 . . . . A 21 GLU HB2 . 30726 1 198 . 1 . 1 21 21 GLU HB3 H 1 1.785 0.020 . 2 . . . . A 21 GLU HB3 . 30726 1 199 . 1 . 1 21 21 GLU HG2 H 1 2.117 0.020 . 1 . . . . A 21 GLU HG2 . 30726 1 200 . 1 . 1 21 21 GLU HG3 H 1 2.117 0.020 . 1 . . . . A 21 GLU HG3 . 30726 1 201 . 1 . 1 21 21 GLU CA C 13 53.705 0.3 . 1 . . . . A 21 GLU CA . 30726 1 202 . 1 . 1 21 21 GLU CB C 13 27.145 0.3 . 1 . . . . A 21 GLU CB . 30726 1 203 . 1 . 1 21 21 GLU CG C 13 33.283 0.3 . 1 . . . . A 21 GLU CG . 30726 1 204 . 1 . 1 21 21 GLU N N 15 120.616 0.3 . 1 . . . . A 21 GLU N . 30726 1 205 . 1 . 1 22 22 GLU H H 1 8.298 0.020 . 1 . . . . A 22 GLU H . 30726 1 206 . 1 . 1 22 22 GLU HA H 1 4.186 0.020 . 1 . . . . A 22 GLU HA . 30726 1 207 . 1 . 1 22 22 GLU HB2 H 1 1.918 0.020 . 2 . . . . A 22 GLU HB2 . 30726 1 208 . 1 . 1 22 22 GLU HB3 H 1 1.757 0.020 . 2 . . . . A 22 GLU HB3 . 30726 1 209 . 1 . 1 22 22 GLU HG2 H 1 2.109 0.020 . 1 . . . . A 22 GLU HG2 . 30726 1 210 . 1 . 1 22 22 GLU HG3 H 1 2.109 0.020 . 1 . . . . A 22 GLU HG3 . 30726 1 211 . 1 . 1 22 22 GLU CA C 13 53.478 0.3 . 1 . . . . A 22 GLU CA . 30726 1 212 . 1 . 1 22 22 GLU CB C 13 27.893 0.3 . 1 . . . . A 22 GLU CB . 30726 1 213 . 1 . 1 22 22 GLU CG C 13 33.361 0.3 . 1 . . . . A 22 GLU CG . 30726 1 214 . 1 . 1 22 22 GLU N N 15 121.774 0.3 . 1 . . . . A 22 GLU N . 30726 1 215 . 1 . 1 23 23 GLU H H 1 8.314 0.020 . 1 . . . . A 23 GLU H . 30726 1 216 . 1 . 1 23 23 GLU HA H 1 4.178 0.020 . 1 . . . . A 23 GLU HA . 30726 1 217 . 1 . 1 23 23 GLU HB2 H 1 1.751 0.020 . 2 . . . . A 23 GLU HB2 . 30726 1 218 . 1 . 1 23 23 GLU HB3 H 1 1.940 0.020 . 2 . . . . A 23 GLU HB3 . 30726 1 219 . 1 . 1 23 23 GLU HG2 H 1 2.114 0.020 . 1 . . . . A 23 GLU HG2 . 30726 1 220 . 1 . 1 23 23 GLU HG3 H 1 2.114 0.020 . 1 . . . . A 23 GLU HG3 . 30726 1 221 . 1 . 1 23 23 GLU CA C 13 54.153 0.3 . 1 . . . . A 23 GLU CA . 30726 1 222 . 1 . 1 23 23 GLU CB C 13 27.069 0.3 . 1 . . . . A 23 GLU CB . 30726 1 223 . 1 . 1 23 23 GLU CG C 13 33.361 0.3 . 1 . . . . A 23 GLU CG . 30726 1 224 . 1 . 1 23 23 GLU N N 15 122.149 0.3 . 1 . . . . A 23 GLU N . 30726 1 225 . 1 . 1 24 24 ARG H H 1 8.186 0.020 . 1 . . . . A 24 ARG H . 30726 1 226 . 1 . 1 24 24 ARG HA H 1 4.156 0.020 . 1 . . . . A 24 ARG HA . 30726 1 227 . 1 . 1 24 24 ARG HB2 H 1 1.704 0.020 . 2 . . . . A 24 ARG HB2 . 30726 1 228 . 1 . 1 24 24 ARG HB3 H 1 1.621 0.020 . 2 . . . . A 24 ARG HB3 . 30726 1 229 . 1 . 1 24 24 ARG HG2 H 1 1.462 0.020 . 1 . . . . A 24 ARG HG2 . 30726 1 230 . 1 . 1 24 24 ARG HG3 H 1 1.462 0.020 . 1 . . . . A 24 ARG HG3 . 30726 1 231 . 1 . 1 24 24 ARG HD2 H 1 3.027 0.020 . 1 . . . . A 24 ARG HD2 . 30726 1 232 . 1 . 1 24 24 ARG HD3 H 1 3.027 0.020 . 1 . . . . A 24 ARG HD3 . 30726 1 233 . 1 . 1 24 24 ARG CA C 13 53.219 0.3 . 1 . . . . A 24 ARG CA . 30726 1 234 . 1 . 1 24 24 ARG CB C 13 27.523 0.3 . 1 . . . . A 24 ARG CB . 30726 1 235 . 1 . 1 24 24 ARG CG C 13 27.112 0.3 . 1 . . . . A 24 ARG CG . 30726 1 236 . 1 . 1 24 24 ARG CD C 13 40.078 0.3 . 1 . . . . A 24 ARG CD . 30726 1 237 . 1 . 1 24 24 ARG N N 15 122.295 0.3 . 1 . . . . A 24 ARG N . 30726 1 238 . 1 . 1 25 25 ALA H H 1 8.205 0.020 . 1 . . . . A 25 ALA H . 30726 1 239 . 1 . 1 25 25 ALA HA H 1 4.130 0.020 . 1 . . . . A 25 ALA HA . 30726 1 240 . 1 . 1 25 25 ALA HB1 H 1 1.236 0.020 . 1 . . . . A 25 ALA HB1 . 30726 1 241 . 1 . 1 25 25 ALA HB2 H 1 1.236 0.020 . 1 . . . . A 25 ALA HB2 . 30726 1 242 . 1 . 1 25 25 ALA HB3 H 1 1.236 0.020 . 1 . . . . A 25 ALA HB3 . 30726 1 243 . 1 . 1 25 25 ALA CA C 13 49.976 0.3 . 1 . . . . A 25 ALA CA . 30726 1 244 . 1 . 1 25 25 ALA CB C 13 16.175 0.3 . 1 . . . . A 25 ALA CB . 30726 1 245 . 1 . 1 25 25 ALA N N 15 125.174 0.3 . 1 . . . . A 25 ALA N . 30726 1 246 . 1 . 1 26 26 GLU H H 1 8.303 0.020 . 1 . . . . A 26 GLU H . 30726 1 247 . 1 . 1 26 26 GLU HA H 1 4.080 0.020 . 1 . . . . A 26 GLU HA . 30726 1 248 . 1 . 1 26 26 GLU HB2 H 1 1.886 0.020 . 2 . . . . A 26 GLU HB2 . 30726 1 249 . 1 . 1 26 26 GLU HB3 H 1 1.780 0.020 . 2 . . . . A 26 GLU HB3 . 30726 1 250 . 1 . 1 26 26 GLU HG2 H 1 2.113 0.020 . 1 . . . . A 26 GLU HG2 . 30726 1 251 . 1 . 1 26 26 GLU HG3 H 1 2.113 0.020 . 1 . . . . A 26 GLU HG3 . 30726 1 252 . 1 . 1 26 26 GLU CA C 13 53.705 0.3 . 1 . . . . A 26 GLU CA . 30726 1 253 . 1 . 1 26 26 GLU CB C 13 26.767 0.3 . 1 . . . . A 26 GLU CB . 30726 1 254 . 1 . 1 26 26 GLU CG C 13 33.205 0.3 . 1 . . . . A 26 GLU CG . 30726 1 255 . 1 . 1 26 26 GLU N N 15 119.571 0.3 . 1 . . . . A 26 GLU N . 30726 1 256 . 1 . 1 27 27 LEU H H 1 8.064 0.020 . 1 . . . . A 27 LEU H . 30726 1 257 . 1 . 1 27 27 LEU HA H 1 4.171 0.020 . 1 . . . . A 27 LEU HA . 30726 1 258 . 1 . 1 27 27 LEU HB2 H 1 1.462 0.020 . 1 . . . . A 27 LEU HB2 . 30726 1 259 . 1 . 1 27 27 LEU HB3 H 1 1.462 0.020 . 1 . . . . A 27 LEU HB3 . 30726 1 260 . 1 . 1 27 27 LEU HG H 1 1.462 0.020 . 1 . . . . A 27 LEU HG . 30726 1 261 . 1 . 1 27 27 LEU HD11 H 1 0.804 0.020 . 1 . . . . A 27 LEU HD11 . 30726 1 262 . 1 . 1 27 27 LEU HD12 H 1 0.804 0.020 . 1 . . . . A 27 LEU HD12 . 30726 1 263 . 1 . 1 27 27 LEU HD13 H 1 0.804 0.020 . 1 . . . . A 27 LEU HD13 . 30726 1 264 . 1 . 1 27 27 LEU HD21 H 1 0.804 0.020 . 1 . . . . A 27 LEU HD21 . 30726 1 265 . 1 . 1 27 27 LEU HD22 H 1 0.804 0.020 . 1 . . . . A 27 LEU HD22 . 30726 1 266 . 1 . 1 27 27 LEU HD23 H 1 0.804 0.020 . 1 . . . . A 27 LEU HD23 . 30726 1 267 . 1 . 1 27 27 LEU CA C 13 52.343 0.3 . 1 . . . . A 27 LEU CA . 30726 1 268 . 1 . 1 27 27 LEU CB C 13 39.249 0.3 . 1 . . . . A 27 LEU CB . 30726 1 269 . 1 . 1 27 27 LEU CG C 13 24.847 0.3 . 1 . . . . A 27 LEU CG . 30726 1 270 . 1 . 1 27 27 LEU CD1 C 13 20.494 0.3 . 1 . . . . A 27 LEU CD1 . 30726 1 271 . 1 . 1 27 27 LEU CD2 C 13 21.817 0.3 . 1 . . . . A 27 LEU CD2 . 30726 1 272 . 1 . 1 27 27 LEU N N 15 122.438 0.3 . 1 . . . . A 27 LEU N . 30726 1 273 . 1 . 1 28 28 ASN H H 1 8.328 0.020 . 1 . . . . A 28 ASN H . 30726 1 274 . 1 . 1 28 28 ASN HA H 1 4.535 0.020 . 1 . . . . A 28 ASN HA . 30726 1 275 . 1 . 1 28 28 ASN HB2 H 1 2.703 0.020 . 2 . . . . A 28 ASN HB2 . 30726 1 276 . 1 . 1 28 28 ASN HB3 H 1 2.612 0.020 . 2 . . . . A 28 ASN HB3 . 30726 1 277 . 1 . 1 28 28 ASN CA C 13 50.365 0.3 . 1 . . . . A 28 ASN CA . 30726 1 278 . 1 . 1 28 28 ASN CB C 13 35.921 0.3 . 1 . . . . A 28 ASN CB . 30726 1 279 . 1 . 1 28 28 ASN N N 15 119.264 0.3 . 1 . . . . A 28 ASN N . 30726 1 280 . 1 . 1 29 29 GLN H H 1 8.221 0.020 . 1 . . . . A 29 GLN H . 30726 1 281 . 1 . 1 29 29 GLN HA H 1 4.141 0.020 . 1 . . . . A 29 GLN HA . 30726 1 282 . 1 . 1 29 29 GLN HB2 H 1 1.977 0.020 . 2 . . . . A 29 GLN HB2 . 30726 1 283 . 1 . 1 29 29 GLN HB3 H 1 1.841 0.020 . 2 . . . . A 29 GLN HB3 . 30726 1 284 . 1 . 1 29 29 GLN HG2 H 1 2.219 0.020 . 1 . . . . A 29 GLN HG2 . 30726 1 285 . 1 . 1 29 29 GLN HG3 H 1 2.219 0.020 . 1 . . . . A 29 GLN HG3 . 30726 1 286 . 1 . 1 29 29 GLN CA C 13 53.057 0.3 . 1 . . . . A 29 GLN CA . 30726 1 287 . 1 . 1 29 29 GLN CB C 13 26.161 0.3 . 1 . . . . A 29 GLN CB . 30726 1 288 . 1 . 1 29 29 GLN CG C 13 29.924 0.3 . 1 . . . . A 29 GLN CG . 30726 1 289 . 1 . 1 29 29 GLN N N 15 120.123 0.3 . 1 . . . . A 29 GLN N . 30726 1 290 . 1 . 1 30 30 SER H H 1 8.258 0.020 . 1 . . . . A 30 SER H . 30726 1 291 . 1 . 1 30 30 SER HA H 1 4.292 0.020 . 1 . . . . A 30 SER HA . 30726 1 292 . 1 . 1 30 30 SER HB2 H 1 3.748 0.020 . 1 . . . . A 30 SER HB2 . 30726 1 293 . 1 . 1 30 30 SER HB3 H 1 3.748 0.020 . 1 . . . . A 30 SER HB3 . 30726 1 294 . 1 . 1 30 30 SER CA C 13 55.618 0.3 . 1 . . . . A 30 SER CA . 30726 1 295 . 1 . 1 30 30 SER CB C 13 60.886 0.3 . 1 . . . . A 30 SER CB . 30726 1 296 . 1 . 1 30 30 SER N N 15 116.817 0.3 . 1 . . . . A 30 SER N . 30726 1 297 . 1 . 1 31 31 GLU H H 1 8.322 0.020 . 1 . . . . A 31 GLU H . 30726 1 298 . 1 . 1 31 31 GLU HA H 1 4.065 0.020 . 1 . . . . A 31 GLU HA . 30726 1 299 . 1 . 1 31 31 GLU HB2 H 1 1.884 0.020 . 2 . . . . A 31 GLU HB2 . 30726 1 300 . 1 . 1 31 31 GLU HB3 H 1 1.774 0.020 . 2 . . . . A 31 GLU HB3 . 30726 1 301 . 1 . 1 31 31 GLU HG2 H 1 2.102 0.020 . 1 . . . . A 31 GLU HG2 . 30726 1 302 . 1 . 1 31 31 GLU HG3 H 1 2.102 0.020 . 1 . . . . A 31 GLU HG3 . 30726 1 303 . 1 . 1 31 31 GLU CA C 13 53.094 0.3 . 1 . . . . A 31 GLU CA . 30726 1 304 . 1 . 1 31 31 GLU CB C 13 27.220 0.3 . 1 . . . . A 31 GLU CB . 30726 1 305 . 1 . 1 31 31 GLU CG C 13 33.361 0.3 . 1 . . . . A 31 GLU CG . 30726 1 306 . 1 . 1 31 31 GLU N N 15 122.441 0.3 . 1 . . . . A 31 GLU N . 30726 1 307 . 1 . 1 32 32 GLU H H 1 8.432 0.020 . 1 . . . . A 32 GLU H . 30726 1 308 . 1 . 1 32 32 GLU HA H 1 4.080 0.020 . 1 . . . . A 32 GLU HA . 30726 1 309 . 1 . 1 32 32 GLU HB2 H 1 1.838 0.020 . 1 . . . . A 32 GLU HB2 . 30726 1 310 . 1 . 1 32 32 GLU HB3 H 1 1.838 0.020 . 1 . . . . A 32 GLU HB3 . 30726 1 311 . 1 . 1 32 32 GLU HG2 H 1 2.113 0.020 . 1 . . . . A 32 GLU HG2 . 30726 1 312 . 1 . 1 32 32 GLU HG3 H 1 2.113 0.020 . 1 . . . . A 32 GLU HG3 . 30726 1 313 . 1 . 1 32 32 GLU CA C 13 53.932 0.3 . 1 . . . . A 32 GLU CA . 30726 1 314 . 1 . 1 32 32 GLU CB C 13 27.220 0.3 . 1 . . . . A 32 GLU CB . 30726 1 315 . 1 . 1 32 32 GLU CG C 13 33.283 0.3 . 1 . . . . A 32 GLU CG . 30726 1 316 . 1 . 1 32 32 GLU N N 15 121.649 0.3 . 1 . . . . A 32 GLU N . 30726 1 317 . 1 . 1 34 34 GLU H H 1 8.436 0.020 . 1 . . . . A 34 GLU H . 30726 1 318 . 1 . 1 34 34 GLU HA H 1 4.080 0.020 . 1 . . . . A 34 GLU HA . 30726 1 319 . 1 . 1 34 34 GLU HB2 H 1 1.893 0.020 . 2 . . . . A 34 GLU HB2 . 30726 1 320 . 1 . 1 34 34 GLU HB3 H 1 1.785 0.020 . 2 . . . . A 34 GLU HB3 . 30726 1 321 . 1 . 1 34 34 GLU HG2 H 1 2.166 0.020 . 1 . . . . A 34 GLU HG2 . 30726 1 322 . 1 . 1 34 34 GLU HG3 H 1 2.166 0.020 . 1 . . . . A 34 GLU HG3 . 30726 1 323 . 1 . 1 34 34 GLU CA C 13 53.435 0.3 . 1 . . . . A 34 GLU CA . 30726 1 324 . 1 . 1 34 34 GLU CB C 13 26.993 0.3 . 1 . . . . A 34 GLU CB . 30726 1 325 . 1 . 1 34 34 GLU CG C 13 33.439 0.3 . 1 . . . . A 34 GLU CG . 30726 1 326 . 1 . 1 34 34 GLU N N 15 121.256 0.3 . 1 . . . . A 34 GLU N . 30726 1 327 . 1 . 1 35 35 ALA H H 1 8.305 0.020 . 1 . . . . A 35 ALA H . 30726 1 328 . 1 . 1 35 35 ALA HA H 1 4.171 0.020 . 1 . . . . A 35 ALA HA . 30726 1 329 . 1 . 1 35 35 ALA HB1 H 1 1.245 0.020 . 1 . . . . A 35 ALA HB1 . 30726 1 330 . 1 . 1 35 35 ALA HB2 H 1 1.245 0.020 . 1 . . . . A 35 ALA HB2 . 30726 1 331 . 1 . 1 35 35 ALA HB3 H 1 1.245 0.020 . 1 . . . . A 35 ALA HB3 . 30726 1 332 . 1 . 1 35 35 ALA CA C 13 49.781 0.3 . 1 . . . . A 35 ALA CA . 30726 1 333 . 1 . 1 35 35 ALA CB C 13 16.251 0.3 . 1 . . . . A 35 ALA CB . 30726 1 334 . 1 . 1 35 35 ALA N N 15 125.432 0.3 . 1 . . . . A 35 ALA N . 30726 1 335 . 1 . 1 36 36 GLY H H 1 8.247 0.020 . 1 . . . . A 36 GLY H . 30726 1 336 . 1 . 1 36 36 GLY HA2 H 1 3.808 0.020 . 1 . . . . A 36 GLY HA2 . 30726 1 337 . 1 . 1 36 36 GLY HA3 H 1 3.808 0.020 . 1 . . . . A 36 GLY HA3 . 30726 1 338 . 1 . 1 36 36 GLY CA C 13 42.226 0.3 . 1 . . . . A 36 GLY CA . 30726 1 339 . 1 . 1 36 36 GLY N N 15 108.066 0.3 . 1 . . . . A 36 GLY N . 30726 1 340 . 1 . 1 37 37 GLU H H 1 8.219 0.020 . 1 . . . . A 37 GLU H . 30726 1 341 . 1 . 1 37 37 GLU HA H 1 4.171 0.020 . 1 . . . . A 37 GLU HA . 30726 1 342 . 1 . 1 37 37 GLU HB2 H 1 1.946 0.020 . 2 . . . . A 37 GLU HB2 . 30726 1 343 . 1 . 1 37 37 GLU HB3 H 1 1.795 0.020 . 2 . . . . A 37 GLU HB3 . 30726 1 344 . 1 . 1 37 37 GLU HG2 H 1 2.112 0.020 . 1 . . . . A 37 GLU HG2 . 30726 1 345 . 1 . 1 37 37 GLU HG3 H 1 2.112 0.020 . 1 . . . . A 37 GLU HG3 . 30726 1 346 . 1 . 1 37 37 GLU CA C 13 53.463 0.3 . 1 . . . . A 37 GLU CA . 30726 1 347 . 1 . 1 37 37 GLU CB C 13 27.296 0.3 . 1 . . . . A 37 GLU CB . 30726 1 348 . 1 . 1 37 37 GLU CG C 13 33.361 0.3 . 1 . . . . A 37 GLU CG . 30726 1 349 . 1 . 1 37 37 GLU N N 15 120.528 0.3 . 1 . . . . A 37 GLU N . 30726 1 350 . 1 . 1 38 38 SER H H 1 8.368 0.020 . 1 . . . . A 38 SER H . 30726 1 351 . 1 . 1 38 38 SER HA H 1 4.353 0.020 . 1 . . . . A 38 SER HA . 30726 1 352 . 1 . 1 38 38 SER HB2 H 1 3.763 0.020 . 1 . . . . A 38 SER HB2 . 30726 1 353 . 1 . 1 38 38 SER HB3 H 1 3.763 0.020 . 1 . . . . A 38 SER HB3 . 30726 1 354 . 1 . 1 38 38 SER CA C 13 55.456 0.3 . 1 . . . . A 38 SER CA . 30726 1 355 . 1 . 1 38 38 SER CB C 13 60.735 0.3 . 1 . . . . A 38 SER CB . 30726 1 356 . 1 . 1 38 38 SER N N 15 116.855 0.3 . 1 . . . . A 38 SER N . 30726 1 357 . 1 . 1 39 39 SER H H 1 8.378 0.020 . 1 . . . . A 39 SER H . 30726 1 358 . 1 . 1 39 39 SER HA H 1 4.429 0.020 . 1 . . . . A 39 SER HA . 30726 1 359 . 1 . 1 39 39 SER HB2 H 1 3.763 0.020 . 1 . . . . A 39 SER HB2 . 30726 1 360 . 1 . 1 39 39 SER HB3 H 1 3.763 0.020 . 1 . . . . A 39 SER HB3 . 30726 1 361 . 1 . 1 39 39 SER CA C 13 55.521 0.3 . 1 . . . . A 39 SER CA . 30726 1 362 . 1 . 1 39 39 SER CB C 13 60.660 0.3 . 1 . . . . A 39 SER CB . 30726 1 363 . 1 . 1 39 39 SER N N 15 118.032 0.3 . 1 . . . . A 39 SER N . 30726 1 364 . 1 . 1 40 40 THR H H 1 8.151 0.020 . 1 . . . . A 40 THR H . 30726 1 365 . 1 . 1 40 40 THR HA H 1 4.310 0.020 . 1 . . . . A 40 THR HA . 30726 1 366 . 1 . 1 40 40 THR HB H 1 4.220 0.020 . 1 . . . . A 40 THR HB . 30726 1 367 . 1 . 1 40 40 THR HG21 H 1 1.082 0.020 . 1 . . . . A 40 THR HG21 . 30726 1 368 . 1 . 1 40 40 THR HG22 H 1 1.082 0.020 . 1 . . . . A 40 THR HG22 . 30726 1 369 . 1 . 1 40 40 THR HG23 H 1 1.082 0.020 . 1 . . . . A 40 THR HG23 . 30726 1 370 . 1 . 1 40 40 THR CA C 13 58.904 0.3 . 1 . . . . A 40 THR CA . 30726 1 371 . 1 . 1 40 40 THR CB C 13 66.779 0.3 . 1 . . . . A 40 THR CB . 30726 1 372 . 1 . 1 40 40 THR CG2 C 13 18.644 0.3 . 1 . . . . A 40 THR CG2 . 30726 1 373 . 1 . 1 40 40 THR N N 15 114.918 0.3 . 1 . . . . A 40 THR N . 30726 1 374 . 1 . 1 41 41 GLY H H 1 8.266 0.020 . 1 . . . . A 41 GLY H . 30726 1 375 . 1 . 1 41 41 GLY HA2 H 1 3.869 0.020 . 1 . . . . A 41 GLY HA2 . 30726 1 376 . 1 . 1 41 41 GLY HA3 H 1 3.869 0.020 . 1 . . . . A 41 GLY HA3 . 30726 1 377 . 1 . 1 41 41 GLY CA C 13 42.420 0.3 . 1 . . . . A 41 GLY CA . 30726 1 378 . 1 . 1 41 41 GLY N N 15 110.981 0.3 . 1 . . . . A 41 GLY N . 30726 1 379 . 1 . 1 42 42 GLY H H 1 8.018 0.020 . 1 . . . . A 42 GLY H . 30726 1 380 . 1 . 1 42 42 GLY HA2 H 1 4.020 0.020 . 2 . . . . A 42 GLY HA2 . 30726 1 381 . 1 . 1 42 42 GLY HA3 H 1 3.899 0.020 . 2 . . . . A 42 GLY HA3 . 30726 1 382 . 1 . 1 42 42 GLY CA C 13 41.350 0.3 . 1 . . . . A 42 GLY CA . 30726 1 383 . 1 . 1 42 42 GLY N N 15 109.428 0.3 . 1 . . . . A 42 GLY N . 30726 1 stop_ save_