################################### # 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 53702 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name RsmE _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method linewidth. _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' . . . 53702 1 2 '2D 1H-13C HSQC aliphatic' . . . 53702 1 3 '3D HCCH-TOCSY' . . . 53702 1 4 '3D 15N-separated NOESY' . . . 53702 1 5 '3D 1H-13C NOESY aliphatic' . . . 53702 1 6 '3D HN(CO)CA' . . . 53702 1 7 '3D HNCACB' . . . 53702 1 8 '3D HNCO' . . . 53702 1 9 '3D HNCACO' . . . 53702 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 . . 53702 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 HA H 1 3.729 0.020 . 1 . . . . . 1 MET HA . 53702 1 2 . 1 . 1 1 1 MET HB2 H 1 1.873 0.020 . 1 . . . . . 1 MET HB2 . 53702 1 3 . 1 . 1 1 1 MET HB3 H 1 1.873 0.020 . 1 . . . . . 1 MET HB3 . 53702 1 4 . 1 . 1 1 1 MET HG2 H 1 2.257 0.020 . 2 . . . . . 1 MET HG2 . 53702 1 5 . 1 . 1 1 1 MET HG3 H 1 2.191 0.020 . 2 . . . . . 1 MET HG3 . 53702 1 6 . 1 . 1 1 1 MET HE1 H 1 1.993 0.020 . 1 . . . . . 1 MET HE . 53702 1 7 . 1 . 1 1 1 MET HE2 H 1 1.993 0.020 . 1 . . . . . 1 MET HE . 53702 1 8 . 1 . 1 1 1 MET HE3 H 1 1.993 0.020 . 1 . . . . . 1 MET HE . 53702 1 9 . 1 . 1 1 1 MET CA C 13 56.295 0.3 . 1 . . . . . 1 MET CA . 53702 1 10 . 1 . 1 1 1 MET CB C 13 36.642 0.3 . 1 . . . . . 1 MET CB . 53702 1 11 . 1 . 1 1 1 MET CG C 13 31.638 0.3 . 1 . . . . . 1 MET CG . 53702 1 12 . 1 . 1 1 1 MET CE C 13 16.784 0.3 . 1 . . . . . 1 MET CE . 53702 1 13 . 1 . 1 2 2 LEU H H 1 8.423 0.020 . 1 . . . . . 2 LEU H . 53702 1 14 . 1 . 1 2 2 LEU HA H 1 4.596 0.020 . 1 . . . . . 2 LEU HA . 53702 1 15 . 1 . 1 2 2 LEU HB2 H 1 1.672 0.020 . 2 . . . . . 2 LEU HB2 . 53702 1 16 . 1 . 1 2 2 LEU HB3 H 1 1.607 0.020 . 2 . . . . . 2 LEU HB3 . 53702 1 17 . 1 . 1 2 2 LEU HG H 1 1.548 0.020 . 1 . . . . . 2 LEU HG . 53702 1 18 . 1 . 1 2 2 LEU HD11 H 1 0.866 0.020 . 2 . . . . . 2 LEU HD1 . 53702 1 19 . 1 . 1 2 2 LEU HD12 H 1 0.866 0.020 . 2 . . . . . 2 LEU HD1 . 53702 1 20 . 1 . 1 2 2 LEU HD13 H 1 0.866 0.020 . 2 . . . . . 2 LEU HD1 . 53702 1 21 . 1 . 1 2 2 LEU HD21 H 1 0.922 0.020 . 2 . . . . . 2 LEU HD2 . 53702 1 22 . 1 . 1 2 2 LEU HD22 H 1 0.922 0.020 . 2 . . . . . 2 LEU HD2 . 53702 1 23 . 1 . 1 2 2 LEU HD23 H 1 0.922 0.020 . 2 . . . . . 2 LEU HD2 . 53702 1 24 . 1 . 1 2 2 LEU C C 13 175.536 0.3 . 1 . . . . . 2 LEU C . 53702 1 25 . 1 . 1 2 2 LEU CA C 13 54.406 0.3 . 1 . . . . . 2 LEU CA . 53702 1 26 . 1 . 1 2 2 LEU CB C 13 43.701 0.3 . 1 . . . . . 2 LEU CB . 53702 1 27 . 1 . 1 2 2 LEU CG C 13 27.253 0.3 . 1 . . . . . 2 LEU CG . 53702 1 28 . 1 . 1 2 2 LEU CD1 C 13 25.206 0.3 . 1 . . . . . 2 LEU CD1 . 53702 1 29 . 1 . 1 2 2 LEU CD2 C 13 24.327 0.3 . 1 . . . . . 2 LEU CD2 . 53702 1 30 . 1 . 1 2 2 LEU N N 15 127.628 0.3 . 1 . . . . . 2 LEU N . 53702 1 31 . 1 . 1 3 3 ILE H H 1 8.501 0.020 . 1 . . . . . 3 ILE H . 53702 1 32 . 1 . 1 3 3 ILE HA H 1 5.061 0.020 . 1 . . . . . 3 ILE HA . 53702 1 33 . 1 . 1 3 3 ILE HB H 1 1.663 0.020 . 1 . . . . . 3 ILE HB . 53702 1 34 . 1 . 1 3 3 ILE HG12 H 1 1.471 0.020 . 1 . . . . . 3 ILE HG12 . 53702 1 35 . 1 . 1 3 3 ILE HG13 H 1 1.471 0.020 . 1 . . . . . 3 ILE HG13 . 53702 1 36 . 1 . 1 3 3 ILE HG21 H 1 0.714 0.020 . 1 . . . . . 3 ILE HG2 . 53702 1 37 . 1 . 1 3 3 ILE HG22 H 1 0.714 0.020 . 1 . . . . . 3 ILE HG2 . 53702 1 38 . 1 . 1 3 3 ILE HG23 H 1 0.714 0.020 . 1 . . . . . 3 ILE HG2 . 53702 1 39 . 1 . 1 3 3 ILE HD11 H 1 0.733 0.020 . 1 . . . . . 3 ILE HD1 . 53702 1 40 . 1 . 1 3 3 ILE HD12 H 1 0.733 0.020 . 1 . . . . . 3 ILE HD1 . 53702 1 41 . 1 . 1 3 3 ILE HD13 H 1 0.733 0.020 . 1 . . . . . 3 ILE HD1 . 53702 1 42 . 1 . 1 3 3 ILE C C 13 175.512 0.3 . 1 . . . . . 3 ILE C . 53702 1 43 . 1 . 1 3 3 ILE CA C 13 60.672 0.3 . 1 . . . . . 3 ILE CA . 53702 1 44 . 1 . 1 3 3 ILE CB C 13 38.970 0.3 . 1 . . . . . 3 ILE CB . 53702 1 45 . 1 . 1 3 3 ILE CG1 C 13 27.473 0.3 . 1 . . . . . 3 ILE CG1 . 53702 1 46 . 1 . 1 3 3 ILE CG2 C 13 17.116 0.3 . 1 . . . . . 3 ILE CG2 . 53702 1 47 . 1 . 1 3 3 ILE CD1 C 13 13.324 0.3 . 1 . . . . . 3 ILE CD1 . 53702 1 48 . 1 . 1 3 3 ILE N N 15 126.081 0.3 . 1 . . . . . 3 ILE N . 53702 1 49 . 1 . 1 4 4 LEU H H 1 9.136 0.020 . 1 . . . . . 4 LEU H . 53702 1 50 . 1 . 1 4 4 LEU HA H 1 4.881 0.020 . 1 . . . . . 4 LEU HA . 53702 1 51 . 1 . 1 4 4 LEU HB2 H 1 1.484 0.020 . 1 . . . . . 4 LEU HB2 . 53702 1 52 . 1 . 1 4 4 LEU HB3 H 1 1.484 0.020 . 1 . . . . . 4 LEU HB3 . 53702 1 53 . 1 . 1 4 4 LEU HG H 1 1.541 0.020 . 1 . . . . . 4 LEU HG . 53702 1 54 . 1 . 1 4 4 LEU HD11 H 1 0.735 0.020 . 2 . . . . . 4 LEU HD1 . 53702 1 55 . 1 . 1 4 4 LEU HD12 H 1 0.735 0.020 . 2 . . . . . 4 LEU HD1 . 53702 1 56 . 1 . 1 4 4 LEU HD13 H 1 0.735 0.020 . 2 . . . . . 4 LEU HD1 . 53702 1 57 . 1 . 1 4 4 LEU HD21 H 1 0.871 0.020 . 2 . . . . . 4 LEU HD2 . 53702 1 58 . 1 . 1 4 4 LEU HD22 H 1 0.871 0.020 . 2 . . . . . 4 LEU HD2 . 53702 1 59 . 1 . 1 4 4 LEU HD23 H 1 0.871 0.020 . 2 . . . . . 4 LEU HD2 . 53702 1 60 . 1 . 1 4 4 LEU C C 13 175.267 0.3 . 1 . . . . . 4 LEU C . 53702 1 61 . 1 . 1 4 4 LEU CA C 13 53.692 0.3 . 1 . . . . . 4 LEU CA . 53702 1 62 . 1 . 1 4 4 LEU CB C 13 46.082 0.3 . 1 . . . . . 4 LEU CB . 53702 1 63 . 1 . 1 4 4 LEU CG C 13 27.127 0.3 . 1 . . . . . 4 LEU CG . 53702 1 64 . 1 . 1 4 4 LEU CD1 C 13 26.240 0.3 . 1 . . . . . 4 LEU CD1 . 53702 1 65 . 1 . 1 4 4 LEU CD2 C 13 24.898 0.3 . 1 . . . . . 4 LEU CD2 . 53702 1 66 . 1 . 1 4 4 LEU N N 15 127.296 0.3 . 1 . . . . . 4 LEU N . 53702 1 67 . 1 . 1 5 5 THR H H 1 8.466 0.020 . 1 . . . . . 5 THR H . 53702 1 68 . 1 . 1 5 5 THR HA H 1 5.435 0.020 . 1 . . . . . 5 THR HA . 53702 1 69 . 1 . 1 5 5 THR HB H 1 3.943 0.020 . 1 . . . . . 5 THR HB . 53702 1 70 . 1 . 1 5 5 THR HG21 H 1 1.067 0.020 . 1 . . . . . 5 THR HG2 . 53702 1 71 . 1 . 1 5 5 THR HG22 H 1 1.067 0.020 . 1 . . . . . 5 THR HG2 . 53702 1 72 . 1 . 1 5 5 THR HG23 H 1 1.067 0.020 . 1 . . . . . 5 THR HG2 . 53702 1 73 . 1 . 1 5 5 THR C C 13 175.654 0.3 . 1 . . . . . 5 THR C . 53702 1 74 . 1 . 1 5 5 THR CA C 13 60.853 0.3 . 1 . . . . . 5 THR CA . 53702 1 75 . 1 . 1 5 5 THR CB C 13 70.449 0.3 . 1 . . . . . 5 THR CB . 53702 1 76 . 1 . 1 5 5 THR CG2 C 13 21.594 0.3 . 1 . . . . . 5 THR CG2 . 53702 1 77 . 1 . 1 5 5 THR N N 15 114.953 0.3 . 1 . . . . . 5 THR N . 53702 1 78 . 1 . 1 6 6 ARG H H 1 9.129 0.020 . 1 . . . . . 6 ARG H . 53702 1 79 . 1 . 1 6 6 ARG HA H 1 4.940 0.020 . 1 . . . . . 6 ARG HA . 53702 1 80 . 1 . 1 6 6 ARG HB2 H 1 1.873 0.020 . 2 . . . . . 6 ARG HB2 . 53702 1 81 . 1 . 1 6 6 ARG HB3 H 1 1.580 0.020 . 2 . . . . . 6 ARG HB3 . 53702 1 82 . 1 . 1 6 6 ARG HG2 H 1 1.369 0.020 . 1 . . . . . 6 ARG HG2 . 53702 1 83 . 1 . 1 6 6 ARG HG3 H 1 1.369 0.020 . 1 . . . . . 6 ARG HG3 . 53702 1 84 . 1 . 1 6 6 ARG HD2 H 1 3.123 0.020 . 1 . . . . . 6 ARG HD2 . 53702 1 85 . 1 . 1 6 6 ARG HD3 H 1 3.123 0.020 . 1 . . . . . 6 ARG HD3 . 53702 1 86 . 1 . 1 6 6 ARG C C 13 173.799 0.3 . 1 . . . . . 6 ARG C . 53702 1 87 . 1 . 1 6 6 ARG CA C 13 53.741 0.3 . 1 . . . . . 6 ARG CA . 53702 1 88 . 1 . 1 6 6 ARG CB C 13 37.244 0.3 . 1 . . . . . 6 ARG CB . 53702 1 89 . 1 . 1 6 6 ARG CG C 13 27.071 0.3 . 1 . . . . . 6 ARG CG . 53702 1 90 . 1 . 1 6 6 ARG CD C 13 43.504 0.3 . 1 . . . . . 6 ARG CD . 53702 1 91 . 1 . 1 6 6 ARG N N 15 125.634 0.3 . 1 . . . . . 6 ARG N . 53702 1 92 . 1 . 1 7 7 LYS H H 1 9.145 0.020 . 1 . . . . . 7 LYS H . 53702 1 93 . 1 . 1 7 7 LYS HA H 1 5.157 0.020 . 1 . . . . . 7 LYS HA . 53702 1 94 . 1 . 1 7 7 LYS HB2 H 1 1.825 0.020 . 2 . . . . . 7 LYS HB2 . 53702 1 95 . 1 . 1 7 7 LYS HB3 H 1 1.518 0.020 . 2 . . . . . 7 LYS HB3 . 53702 1 96 . 1 . 1 7 7 LYS HG2 H 1 1.422 0.020 . 2 . . . . . 7 LYS HG2 . 53702 1 97 . 1 . 1 7 7 LYS HG3 H 1 1.379 0.020 . 2 . . . . . 7 LYS HG3 . 53702 1 98 . 1 . 1 7 7 LYS HD2 H 1 1.657 0.020 . 1 . . . . . 7 LYS HD2 . 53702 1 99 . 1 . 1 7 7 LYS HD3 H 1 1.657 0.020 . 1 . . . . . 7 LYS HD3 . 53702 1 100 . 1 . 1 7 7 LYS HE2 H 1 2.964 0.020 . 1 . . . . . 7 LYS HE2 . 53702 1 101 . 1 . 1 7 7 LYS HE3 H 1 2.964 0.020 . 1 . . . . . 7 LYS HE3 . 53702 1 102 . 1 . 1 7 7 LYS C C 13 176.521 0.3 . 1 . . . . . 7 LYS C . 53702 1 103 . 1 . 1 7 7 LYS CA C 13 54.291 0.3 . 1 . . . . . 7 LYS CA . 53702 1 104 . 1 . 1 7 7 LYS CB C 13 34.769 0.3 . 1 . . . . . 7 LYS CB . 53702 1 105 . 1 . 1 7 7 LYS CG C 13 25.462 0.3 . 1 . . . . . 7 LYS CG . 53702 1 106 . 1 . 1 7 7 LYS CD C 13 29.702 0.3 . 1 . . . . . 7 LYS CD . 53702 1 107 . 1 . 1 7 7 LYS CE C 13 42.035 0.3 . 1 . . . . . 7 LYS CE . 53702 1 108 . 1 . 1 7 7 LYS N N 15 122.103 0.3 . 1 . . . . . 7 LYS N . 53702 1 109 . 1 . 1 8 8 VAL H H 1 7.594 0.020 . 1 . . . . . 8 VAL H . 53702 1 110 . 1 . 1 8 8 VAL HA H 1 3.337 0.020 . 1 . . . . . 8 VAL HA . 53702 1 111 . 1 . 1 8 8 VAL HB H 1 1.942 0.020 . 1 . . . . . 8 VAL HB . 53702 1 112 . 1 . 1 8 8 VAL HG11 H 1 1.013 0.020 . 2 . . . . . 8 VAL HG1 . 53702 1 113 . 1 . 1 8 8 VAL HG12 H 1 1.013 0.020 . 2 . . . . . 8 VAL HG1 . 53702 1 114 . 1 . 1 8 8 VAL HG13 H 1 1.013 0.020 . 2 . . . . . 8 VAL HG1 . 53702 1 115 . 1 . 1 8 8 VAL HG21 H 1 0.872 0.020 . 2 . . . . . 8 VAL HG2 . 53702 1 116 . 1 . 1 8 8 VAL HG22 H 1 0.872 0.020 . 2 . . . . . 8 VAL HG2 . 53702 1 117 . 1 . 1 8 8 VAL HG23 H 1 0.872 0.020 . 2 . . . . . 8 VAL HG2 . 53702 1 118 . 1 . 1 8 8 VAL C C 13 176.523 0.3 . 1 . . . . . 8 VAL C . 53702 1 119 . 1 . 1 8 8 VAL CA C 13 65.860 0.3 . 1 . . . . . 8 VAL CA . 53702 1 120 . 1 . 1 8 8 VAL CB C 13 31.808 0.3 . 1 . . . . . 8 VAL CB . 53702 1 121 . 1 . 1 8 8 VAL CG1 C 13 23.204 0.3 . 1 . . . . . 8 VAL CG1 . 53702 1 122 . 1 . 1 8 8 VAL CG2 C 13 21.178 0.3 . 1 . . . . . 8 VAL CG2 . 53702 1 123 . 1 . 1 8 8 VAL N N 15 118.238 0.3 . 1 . . . . . 8 VAL N . 53702 1 124 . 1 . 1 9 9 GLY H H 1 9.219 0.020 . 1 . . . . . 9 GLY H . 53702 1 125 . 1 . 1 9 9 GLY HA2 H 1 4.445 0.020 . 2 . . . . . 9 GLY HA2 . 53702 1 126 . 1 . 1 9 9 GLY HA3 H 1 3.623 0.020 . 2 . . . . . 9 GLY HA3 . 53702 1 127 . 1 . 1 9 9 GLY C C 13 174.692 0.3 . 1 . . . . . 9 GLY C . 53702 1 128 . 1 . 1 9 9 GLY CA C 13 44.634 0.3 . 1 . . . . . 9 GLY CA . 53702 1 129 . 1 . 1 9 9 GLY N N 15 116.256 0.3 . 1 . . . . . 9 GLY N . 53702 1 130 . 1 . 1 10 10 GLU H H 1 8.365 0.020 . 1 . . . . . 10 GLU H . 53702 1 131 . 1 . 1 10 10 GLU HA H 1 4.726 0.020 . 1 . . . . . 10 GLU HA . 53702 1 132 . 1 . 1 10 10 GLU HB2 H 1 2.574 0.020 . 2 . . . . . 10 GLU HB2 . 53702 1 133 . 1 . 1 10 10 GLU HB3 H 1 2.150 0.020 . 2 . . . . . 10 GLU HB3 . 53702 1 134 . 1 . 1 10 10 GLU HG2 H 1 2.204 0.020 . 1 . . . . . 10 GLU HG2 . 53702 1 135 . 1 . 1 10 10 GLU HG3 H 1 2.204 0.020 . 1 . . . . . 10 GLU HG3 . 53702 1 136 . 1 . 1 10 10 GLU C C 13 176.179 0.3 . 1 . . . . . 10 GLU C . 53702 1 137 . 1 . 1 10 10 GLU CA C 13 55.940 0.3 . 1 . . . . . 10 GLU CA . 53702 1 138 . 1 . 1 10 10 GLU CB C 13 32.725 0.3 . 1 . . . . . 10 GLU CB . 53702 1 139 . 1 . 1 10 10 GLU CG C 13 37.805 0.3 . 1 . . . . . 10 GLU CG . 53702 1 140 . 1 . 1 10 10 GLU N N 15 119.696 0.3 . 1 . . . . . 10 GLU N . 53702 1 141 . 1 . 1 11 11 SER H H 1 8.550 0.020 . 1 . . . . . 11 SER H . 53702 1 142 . 1 . 1 11 11 SER HA H 1 5.853 0.020 . 1 . . . . . 11 SER HA . 53702 1 143 . 1 . 1 11 11 SER HB2 H 1 3.669 0.020 . 2 . . . . . 11 SER HB2 . 53702 1 144 . 1 . 1 11 11 SER HB3 H 1 3.488 0.020 . 2 . . . . . 11 SER HB3 . 53702 1 145 . 1 . 1 11 11 SER C C 13 174.043 0.3 . 1 . . . . . 11 SER C . 53702 1 146 . 1 . 1 11 11 SER CA C 13 57.618 0.3 . 1 . . . . . 11 SER CA . 53702 1 147 . 1 . 1 11 11 SER CB C 13 67.276 0.3 . 1 . . . . . 11 SER CB . 53702 1 148 . 1 . 1 11 11 SER N N 15 112.590 0.3 . 1 . . . . . 11 SER N . 53702 1 149 . 1 . 1 12 12 ILE H H 1 9.341 0.020 . 1 . . . . . 12 ILE H . 53702 1 150 . 1 . 1 12 12 ILE HA H 1 4.455 0.020 . 1 . . . . . 12 ILE HA . 53702 1 151 . 1 . 1 12 12 ILE HB H 1 1.515 0.020 . 1 . . . . . 12 ILE HB . 53702 1 152 . 1 . 1 12 12 ILE HG12 H 1 1.421 0.020 . 2 . . . . . 12 ILE HG12 . 53702 1 153 . 1 . 1 12 12 ILE HG13 H 1 0.840 0.020 . 2 . . . . . 12 ILE HG13 . 53702 1 154 . 1 . 1 12 12 ILE HG21 H 1 0.695 0.020 . 1 . . . . . 12 ILE HG2 . 53702 1 155 . 1 . 1 12 12 ILE HG22 H 1 0.695 0.020 . 1 . . . . . 12 ILE HG2 . 53702 1 156 . 1 . 1 12 12 ILE HG23 H 1 0.695 0.020 . 1 . . . . . 12 ILE HG2 . 53702 1 157 . 1 . 1 12 12 ILE HD11 H 1 0.688 0.020 . 1 . . . . . 12 ILE HD1 . 53702 1 158 . 1 . 1 12 12 ILE HD12 H 1 0.688 0.020 . 1 . . . . . 12 ILE HD1 . 53702 1 159 . 1 . 1 12 12 ILE HD13 H 1 0.688 0.020 . 1 . . . . . 12 ILE HD1 . 53702 1 160 . 1 . 1 12 12 ILE C C 13 173.986 0.3 . 1 . . . . . 12 ILE C . 53702 1 161 . 1 . 1 12 12 ILE CA C 13 60.539 0.3 . 1 . . . . . 12 ILE CA . 53702 1 162 . 1 . 1 12 12 ILE CB C 13 42.524 0.3 . 1 . . . . . 12 ILE CB . 53702 1 163 . 1 . 1 12 12 ILE CG1 C 13 27.943 0.3 . 1 . . . . . 12 ILE CG1 . 53702 1 164 . 1 . 1 12 12 ILE CG2 C 13 16.991 0.3 . 1 . . . . . 12 ILE CG2 . 53702 1 165 . 1 . 1 12 12 ILE CD1 C 13 15.017 0.3 . 1 . . . . . 12 ILE CD1 . 53702 1 166 . 1 . 1 12 12 ILE N N 15 121.786 0.3 . 1 . . . . . 12 ILE N . 53702 1 167 . 1 . 1 13 13 ASN H H 1 9.131 0.020 . 1 . . . . . 13 ASN H . 53702 1 168 . 1 . 1 13 13 ASN HA H 1 5.400 0.020 . 1 . . . . . 13 ASN HA . 53702 1 169 . 1 . 1 13 13 ASN HB2 H 1 2.750 0.020 . 2 . . . . . 13 ASN HB2 . 53702 1 170 . 1 . 1 13 13 ASN HB3 H 1 2.398 0.020 . 2 . . . . . 13 ASN HB3 . 53702 1 171 . 1 . 1 13 13 ASN HD21 H 1 7.163 0.020 . 1 . . . . . 13 ASN HD21 . 53702 1 172 . 1 . 1 13 13 ASN HD22 H 1 6.638 0.020 . 1 . . . . . 13 ASN HD22 . 53702 1 173 . 1 . 1 13 13 ASN C C 13 174.005 0.3 . 1 . . . . . 13 ASN C . 53702 1 174 . 1 . 1 13 13 ASN CA C 13 52.877 0.3 . 1 . . . . . 13 ASN CA . 53702 1 175 . 1 . 1 13 13 ASN CB C 13 40.705 0.3 . 1 . . . . . 13 ASN CB . 53702 1 176 . 1 . 1 13 13 ASN N N 15 126.353 0.3 . 1 . . . . . 13 ASN N . 53702 1 177 . 1 . 1 13 13 ASN ND2 N 15 111.476 0.3 . 1 . . . . . 13 ASN ND2 . 53702 1 178 . 1 . 1 13 13 ASN CG C 13 176.191 0.3 . 1 . . . . . 13 ASN CG . 53702 1 179 . 1 . 1 14 14 ILE H H 1 8.612 0.020 . 1 . . . . . 14 ILE H . 53702 1 180 . 1 . 1 14 14 ILE HA H 1 4.414 0.020 . 1 . . . . . 14 ILE HA . 53702 1 181 . 1 . 1 14 14 ILE HB H 1 1.625 0.020 . 1 . . . . . 14 ILE HB . 53702 1 182 . 1 . 1 14 14 ILE HG12 H 1 1.417 0.020 . 2 . . . . . 14 ILE HG12 . 53702 1 183 . 1 . 1 14 14 ILE HG13 H 1 0.870 0.020 . 2 . . . . . 14 ILE HG13 . 53702 1 184 . 1 . 1 14 14 ILE HG21 H 1 0.696 0.020 . 1 . . . . . 14 ILE HG2 . 53702 1 185 . 1 . 1 14 14 ILE HG22 H 1 0.696 0.020 . 1 . . . . . 14 ILE HG2 . 53702 1 186 . 1 . 1 14 14 ILE HG23 H 1 0.696 0.020 . 1 . . . . . 14 ILE HG2 . 53702 1 187 . 1 . 1 14 14 ILE HD11 H 1 0.695 0.020 . 1 . . . . . 14 ILE HD1 . 53702 1 188 . 1 . 1 14 14 ILE HD12 H 1 0.695 0.020 . 1 . . . . . 14 ILE HD1 . 53702 1 189 . 1 . 1 14 14 ILE HD13 H 1 0.695 0.020 . 1 . . . . . 14 ILE HD1 . 53702 1 190 . 1 . 1 14 14 ILE C C 13 175.415 0.3 . 1 . . . . . 14 ILE C . 53702 1 191 . 1 . 1 14 14 ILE CA C 13 60.515 0.3 . 1 . . . . . 14 ILE CA . 53702 1 192 . 1 . 1 14 14 ILE CB C 13 38.785 0.3 . 1 . . . . . 14 ILE CB . 53702 1 193 . 1 . 1 14 14 ILE CG1 C 13 27.896 0.3 . 1 . . . . . 14 ILE CG1 . 53702 1 194 . 1 . 1 14 14 ILE CG2 C 13 17.497 0.3 . 1 . . . . . 14 ILE CG2 . 53702 1 195 . 1 . 1 14 14 ILE CD1 C 13 14.293 0.3 . 1 . . . . . 14 ILE CD1 . 53702 1 196 . 1 . 1 14 14 ILE N N 15 124.034 0.3 . 1 . . . . . 14 ILE N . 53702 1 197 . 1 . 1 15 15 GLY H H 1 8.849 0.020 . 1 . . . . . 15 GLY H . 53702 1 198 . 1 . 1 15 15 GLY HA2 H 1 4.076 0.020 . 1 . . . . . 15 GLY HA2 . 53702 1 199 . 1 . 1 15 15 GLY HA3 H 1 4.076 0.020 . 1 . . . . . 15 GLY HA3 . 53702 1 200 . 1 . 1 15 15 GLY C C 13 174.018 0.3 . 1 . . . . . 15 GLY C . 53702 1 201 . 1 . 1 15 15 GLY CA C 13 45.830 0.3 . 1 . . . . . 15 GLY CA . 53702 1 202 . 1 . 1 15 15 GLY N N 15 114.133 0.3 . 1 . . . . . 15 GLY N . 53702 1 203 . 1 . 1 16 16 ASP H H 1 8.601 0.020 . 1 . . . . . 16 ASP H . 53702 1 204 . 1 . 1 16 16 ASP HA H 1 4.709 0.020 . 1 . . . . . 16 ASP HA . 53702 1 205 . 1 . 1 16 16 ASP HB2 H 1 2.729 0.020 . 2 . . . . . 16 ASP HB2 . 53702 1 206 . 1 . 1 16 16 ASP HB3 H 1 2.533 0.020 . 2 . . . . . 16 ASP HB3 . 53702 1 207 . 1 . 1 16 16 ASP C C 13 177.682 0.3 . 1 . . . . . 16 ASP C . 53702 1 208 . 1 . 1 16 16 ASP CA C 13 55.754 0.3 . 1 . . . . . 16 ASP CA . 53702 1 209 . 1 . 1 16 16 ASP CB C 13 41.956 0.3 . 1 . . . . . 16 ASP CB . 53702 1 210 . 1 . 1 16 16 ASP N N 15 120.022 0.3 . 1 . . . . . 16 ASP N . 53702 1 211 . 1 . 1 17 17 ASP H H 1 8.175 0.020 . 1 . . . . . 17 ASP H . 53702 1 212 . 1 . 1 17 17 ASP HA H 1 4.730 0.020 . 1 . . . . . 17 ASP HA . 53702 1 213 . 1 . 1 17 17 ASP HB2 H 1 2.731 0.020 . 2 . . . . . 17 ASP HB2 . 53702 1 214 . 1 . 1 17 17 ASP HB3 H 1 2.592 0.020 . 2 . . . . . 17 ASP HB3 . 53702 1 215 . 1 . 1 17 17 ASP C C 13 175.444 0.3 . 1 . . . . . 17 ASP C . 53702 1 216 . 1 . 1 17 17 ASP CA C 13 54.633 0.3 . 1 . . . . . 17 ASP CA . 53702 1 217 . 1 . 1 17 17 ASP CB C 13 42.795 0.3 . 1 . . . . . 17 ASP CB . 53702 1 218 . 1 . 1 17 17 ASP N N 15 115.107 0.3 . 1 . . . . . 17 ASP N . 53702 1 219 . 1 . 1 18 18 ILE H H 1 7.165 0.020 . 1 . . . . . 18 ILE H . 53702 1 220 . 1 . 1 18 18 ILE HA H 1 5.131 0.020 . 1 . . . . . 18 ILE HA . 53702 1 221 . 1 . 1 18 18 ILE HB H 1 2.208 0.020 . 1 . . . . . 18 ILE HB . 53702 1 222 . 1 . 1 18 18 ILE HG12 H 1 1.761 0.020 . 2 . . . . . 18 ILE HG12 . 53702 1 223 . 1 . 1 18 18 ILE HG13 H 1 0.884 0.020 . 2 . . . . . 18 ILE HG13 . 53702 1 224 . 1 . 1 18 18 ILE HG21 H 1 0.751 0.020 . 1 . . . . . 18 ILE HG2 . 53702 1 225 . 1 . 1 18 18 ILE HG22 H 1 0.751 0.020 . 1 . . . . . 18 ILE HG2 . 53702 1 226 . 1 . 1 18 18 ILE HG23 H 1 0.751 0.020 . 1 . . . . . 18 ILE HG2 . 53702 1 227 . 1 . 1 18 18 ILE HD11 H 1 0.798 0.020 . 1 . . . . . 18 ILE HD1 . 53702 1 228 . 1 . 1 18 18 ILE HD12 H 1 0.798 0.020 . 1 . . . . . 18 ILE HD1 . 53702 1 229 . 1 . 1 18 18 ILE HD13 H 1 0.798 0.020 . 1 . . . . . 18 ILE HD1 . 53702 1 230 . 1 . 1 18 18 ILE C C 13 176.123 0.3 . 1 . . . . . 18 ILE C . 53702 1 231 . 1 . 1 18 18 ILE CA C 13 60.382 0.3 . 1 . . . . . 18 ILE CA . 53702 1 232 . 1 . 1 18 18 ILE CB C 13 39.938 0.3 . 1 . . . . . 18 ILE CB . 53702 1 233 . 1 . 1 18 18 ILE CG1 C 13 27.850 0.3 . 1 . . . . . 18 ILE CG1 . 53702 1 234 . 1 . 1 18 18 ILE CG2 C 13 17.286 0.3 . 1 . . . . . 18 ILE CG2 . 53702 1 235 . 1 . 1 18 18 ILE CD1 C 13 14.013 0.3 . 1 . . . . . 18 ILE CD1 . 53702 1 236 . 1 . 1 18 18 ILE N N 15 118.524 0.3 . 1 . . . . . 18 ILE N . 53702 1 237 . 1 . 1 19 19 THR H H 1 8.924 0.020 . 1 . . . . . 19 THR H . 53702 1 238 . 1 . 1 19 19 THR HA H 1 5.228 0.020 . 1 . . . . . 19 THR HA . 53702 1 239 . 1 . 1 19 19 THR HB H 1 3.847 0.020 . 1 . . . . . 19 THR HB . 53702 1 240 . 1 . 1 19 19 THR HG21 H 1 1.137 0.020 . 1 . . . . . 19 THR HG2 . 53702 1 241 . 1 . 1 19 19 THR HG22 H 1 1.137 0.020 . 1 . . . . . 19 THR HG2 . 53702 1 242 . 1 . 1 19 19 THR HG23 H 1 1.137 0.020 . 1 . . . . . 19 THR HG2 . 53702 1 243 . 1 . 1 19 19 THR C C 13 173.432 0.3 . 1 . . . . . 19 THR C . 53702 1 244 . 1 . 1 19 19 THR CA C 13 61.832 0.3 . 1 . . . . . 19 THR CA . 53702 1 245 . 1 . 1 19 19 THR CB C 13 71.981 0.3 . 1 . . . . . 19 THR CB . 53702 1 246 . 1 . 1 19 19 THR CG2 C 13 21.897 0.3 . 1 . . . . . 19 THR CG2 . 53702 1 247 . 1 . 1 19 19 THR N N 15 123.748 0.3 . 1 . . . . . 19 THR N . 53702 1 248 . 1 . 1 20 20 ILE H H 1 9.116 0.020 . 1 . . . . . 20 ILE H . 53702 1 249 . 1 . 1 20 20 ILE HA H 1 5.066 0.020 . 1 . . . . . 20 ILE HA . 53702 1 250 . 1 . 1 20 20 ILE HB H 1 1.778 0.020 . 1 . . . . . 20 ILE HB . 53702 1 251 . 1 . 1 20 20 ILE HG12 H 1 1.376 0.020 . 2 . . . . . 20 ILE HG12 . 53702 1 252 . 1 . 1 20 20 ILE HG13 H 1 1.079 0.020 . 2 . . . . . 20 ILE HG13 . 53702 1 253 . 1 . 1 20 20 ILE HG21 H 1 0.699 0.020 . 1 . . . . . 20 ILE HG2 . 53702 1 254 . 1 . 1 20 20 ILE HG22 H 1 0.699 0.020 . 1 . . . . . 20 ILE HG2 . 53702 1 255 . 1 . 1 20 20 ILE HG23 H 1 0.699 0.020 . 1 . . . . . 20 ILE HG2 . 53702 1 256 . 1 . 1 20 20 ILE HD11 H 1 0.672 0.020 . 1 . . . . . 20 ILE HD1 . 53702 1 257 . 1 . 1 20 20 ILE HD12 H 1 0.672 0.020 . 1 . . . . . 20 ILE HD1 . 53702 1 258 . 1 . 1 20 20 ILE HD13 H 1 0.672 0.020 . 1 . . . . . 20 ILE HD1 . 53702 1 259 . 1 . 1 20 20 ILE C C 13 174.976 0.3 . 1 . . . . . 20 ILE C . 53702 1 260 . 1 . 1 20 20 ILE CA C 13 58.918 0.3 . 1 . . . . . 20 ILE CA . 53702 1 261 . 1 . 1 20 20 ILE CB C 13 40.233 0.3 . 1 . . . . . 20 ILE CB . 53702 1 262 . 1 . 1 20 20 ILE CG1 C 13 27.537 0.3 . 1 . . . . . 20 ILE CG1 . 53702 1 263 . 1 . 1 20 20 ILE CG2 C 13 17.446 0.3 . 1 . . . . . 20 ILE CG2 . 53702 1 264 . 1 . 1 20 20 ILE CD1 C 13 14.024 0.3 . 1 . . . . . 20 ILE CD1 . 53702 1 265 . 1 . 1 20 20 ILE N N 15 125.881 0.3 . 1 . . . . . 20 ILE N . 53702 1 266 . 1 . 1 21 21 THR H H 1 9.589 0.020 . 1 . . . . . 21 THR H . 53702 1 267 . 1 . 1 21 21 THR HA H 1 4.903 0.020 . 1 . . . . . 21 THR HA . 53702 1 268 . 1 . 1 21 21 THR HB H 1 3.520 0.020 . 1 . . . . . 21 THR HB . 53702 1 269 . 1 . 1 21 21 THR HG21 H 1 0.923 0.020 . 1 . . . . . 21 THR HG2 . 53702 1 270 . 1 . 1 21 21 THR HG22 H 1 0.923 0.020 . 1 . . . . . 21 THR HG2 . 53702 1 271 . 1 . 1 21 21 THR HG23 H 1 0.923 0.020 . 1 . . . . . 21 THR HG2 . 53702 1 272 . 1 . 1 21 21 THR C C 13 173.599 0.3 . 1 . . . . . 21 THR C . 53702 1 273 . 1 . 1 21 21 THR CA C 13 61.710 0.3 . 1 . . . . . 21 THR CA . 53702 1 274 . 1 . 1 21 21 THR CB C 13 71.827 0.3 . 1 . . . . . 21 THR CB . 53702 1 275 . 1 . 1 21 21 THR CG2 C 13 21.249 0.3 . 1 . . . . . 21 THR CG2 . 53702 1 276 . 1 . 1 21 21 THR N N 15 123.486 0.3 . 1 . . . . . 21 THR N . 53702 1 277 . 1 . 1 22 22 ILE H H 1 8.443 0.020 . 1 . . . . . 22 ILE H . 53702 1 278 . 1 . 1 22 22 ILE HA H 1 4.126 0.020 . 1 . . . . . 22 ILE HA . 53702 1 279 . 1 . 1 22 22 ILE HB H 1 2.440 0.020 . 1 . . . . . 22 ILE HB . 53702 1 280 . 1 . 1 22 22 ILE HG12 H 1 1.469 0.020 . 2 . . . . . 22 ILE HG12 . 53702 1 281 . 1 . 1 22 22 ILE HG13 H 1 1.079 0.020 . 2 . . . . . 22 ILE HG13 . 53702 1 282 . 1 . 1 22 22 ILE HG21 H 1 0.725 0.020 . 1 . . . . . 22 ILE HG2 . 53702 1 283 . 1 . 1 22 22 ILE HG22 H 1 0.725 0.020 . 1 . . . . . 22 ILE HG2 . 53702 1 284 . 1 . 1 22 22 ILE HG23 H 1 0.725 0.020 . 1 . . . . . 22 ILE HG2 . 53702 1 285 . 1 . 1 22 22 ILE HD11 H 1 0.518 0.020 . 1 . . . . . 22 ILE HD1 . 53702 1 286 . 1 . 1 22 22 ILE HD12 H 1 0.518 0.020 . 1 . . . . . 22 ILE HD1 . 53702 1 287 . 1 . 1 22 22 ILE HD13 H 1 0.518 0.020 . 1 . . . . . 22 ILE HD1 . 53702 1 288 . 1 . 1 22 22 ILE C C 13 174.754 0.3 . 1 . . . . . 22 ILE C . 53702 1 289 . 1 . 1 22 22 ILE CA C 13 59.797 0.3 . 1 . . . . . 22 ILE CA . 53702 1 290 . 1 . 1 22 22 ILE CB C 13 34.185 0.3 . 1 . . . . . 22 ILE CB . 53702 1 291 . 1 . 1 22 22 ILE CG1 C 13 26.812 0.3 . 1 . . . . . 22 ILE CG1 . 53702 1 292 . 1 . 1 22 22 ILE CG2 C 13 18.289 0.3 . 1 . . . . . 22 ILE CG2 . 53702 1 293 . 1 . 1 22 22 ILE CD1 C 13 9.465 0.3 . 1 . . . . . 22 ILE CD1 . 53702 1 294 . 1 . 1 22 22 ILE N N 15 126.137 0.3 . 1 . . . . . 22 ILE N . 53702 1 295 . 1 . 1 23 23 LEU H H 1 8.849 0.020 . 1 . . . . . 23 LEU H . 53702 1 296 . 1 . 1 23 23 LEU HA H 1 4.460 0.020 . 1 . . . . . 23 LEU HA . 53702 1 297 . 1 . 1 23 23 LEU HB2 H 1 1.447 0.020 . 2 . . . . . 23 LEU HB2 . 53702 1 298 . 1 . 1 23 23 LEU HB3 H 1 1.331 0.020 . 2 . . . . . 23 LEU HB3 . 53702 1 299 . 1 . 1 23 23 LEU HG H 1 1.510 0.020 . 1 . . . . . 23 LEU HG . 53702 1 300 . 1 . 1 23 23 LEU HD11 H 1 0.743 0.020 . 2 . . . . . 23 LEU HD1 . 53702 1 301 . 1 . 1 23 23 LEU HD12 H 1 0.743 0.020 . 2 . . . . . 23 LEU HD1 . 53702 1 302 . 1 . 1 23 23 LEU HD13 H 1 0.743 0.020 . 2 . . . . . 23 LEU HD1 . 53702 1 303 . 1 . 1 23 23 LEU HD21 H 1 0.732 0.020 . 2 . . . . . 23 LEU HD2 . 53702 1 304 . 1 . 1 23 23 LEU HD22 H 1 0.732 0.020 . 2 . . . . . 23 LEU HD2 . 53702 1 305 . 1 . 1 23 23 LEU HD23 H 1 0.732 0.020 . 2 . . . . . 23 LEU HD2 . 53702 1 306 . 1 . 1 23 23 LEU C C 13 178.057 0.3 . 1 . . . . . 23 LEU C . 53702 1 307 . 1 . 1 23 23 LEU CA C 13 55.692 0.3 . 1 . . . . . 23 LEU CA . 53702 1 308 . 1 . 1 23 23 LEU CB C 13 42.860 0.3 . 1 . . . . . 23 LEU CB . 53702 1 309 . 1 . 1 23 23 LEU CG C 13 27.001 0.3 . 1 . . . . . 23 LEU CG . 53702 1 310 . 1 . 1 23 23 LEU CD1 C 13 26.386 0.3 . 1 . . . . . 23 LEU CD1 . 53702 1 311 . 1 . 1 23 23 LEU CD2 C 13 22.321 0.3 . 1 . . . . . 23 LEU CD2 . 53702 1 312 . 1 . 1 23 23 LEU N N 15 129.380 0.3 . 1 . . . . . 23 LEU N . 53702 1 313 . 1 . 1 24 24 GLY H H 1 7.660 0.020 . 1 . . . . . 24 GLY H . 53702 1 314 . 1 . 1 24 24 GLY HA2 H 1 4.164 0.020 . 2 . . . . . 24 GLY HA2 . 53702 1 315 . 1 . 1 24 24 GLY HA3 H 1 4.021 0.020 . 2 . . . . . 24 GLY HA3 . 53702 1 316 . 1 . 1 24 24 GLY C C 13 170.493 0.3 . 1 . . . . . 24 GLY C . 53702 1 317 . 1 . 1 24 24 GLY CA C 13 46.200 0.3 . 1 . . . . . 24 GLY CA . 53702 1 318 . 1 . 1 24 24 GLY N N 15 104.871 0.3 . 1 . . . . . 24 GLY N . 53702 1 319 . 1 . 1 25 25 VAL H H 1 8.465 0.020 . 1 . . . . . 25 VAL H . 53702 1 320 . 1 . 1 25 25 VAL HA H 1 4.755 0.020 . 1 . . . . . 25 VAL HA . 53702 1 321 . 1 . 1 25 25 VAL HB H 1 1.821 0.020 . 1 . . . . . 25 VAL HB . 53702 1 322 . 1 . 1 25 25 VAL HG11 H 1 0.816 0.020 . 2 . . . . . 25 VAL HG1 . 53702 1 323 . 1 . 1 25 25 VAL HG12 H 1 0.816 0.020 . 2 . . . . . 25 VAL HG1 . 53702 1 324 . 1 . 1 25 25 VAL HG13 H 1 0.816 0.020 . 2 . . . . . 25 VAL HG1 . 53702 1 325 . 1 . 1 25 25 VAL HG21 H 1 0.732 0.020 . 2 . . . . . 25 VAL HG2 . 53702 1 326 . 1 . 1 25 25 VAL HG22 H 1 0.732 0.020 . 2 . . . . . 25 VAL HG2 . 53702 1 327 . 1 . 1 25 25 VAL HG23 H 1 0.732 0.020 . 2 . . . . . 25 VAL HG2 . 53702 1 328 . 1 . 1 25 25 VAL C C 13 175.123 0.3 . 1 . . . . . 25 VAL C . 53702 1 329 . 1 . 1 25 25 VAL CA C 13 61.354 0.3 . 1 . . . . . 25 VAL CA . 53702 1 330 . 1 . 1 25 25 VAL CB C 13 36.037 0.3 . 1 . . . . . 25 VAL CB . 53702 1 331 . 1 . 1 25 25 VAL CG1 C 13 22.188 0.3 . 1 . . . . . 25 VAL CG1 . 53702 1 332 . 1 . 1 25 25 VAL CG2 C 13 21.322 0.3 . 1 . . . . . 25 VAL CG2 . 53702 1 333 . 1 . 1 25 25 VAL N N 15 119.394 0.3 . 1 . . . . . 25 VAL N . 53702 1 334 . 1 . 1 26 26 SER H H 1 8.594 0.020 . 1 . . . . . 26 SER H . 53702 1 335 . 1 . 1 26 26 SER HA H 1 4.602 0.020 . 1 . . . . . 26 SER HA . 53702 1 336 . 1 . 1 26 26 SER HB2 H 1 3.729 0.020 . 2 . . . . . 26 SER HB2 . 53702 1 337 . 1 . 1 26 26 SER HB3 H 1 3.653 0.020 . 2 . . . . . 26 SER HB3 . 53702 1 338 . 1 . 1 26 26 SER C C 13 176.063 0.3 . 1 . . . . . 26 SER C . 53702 1 339 . 1 . 1 26 26 SER CA C 13 56.835 0.3 . 1 . . . . . 26 SER CA . 53702 1 340 . 1 . 1 26 26 SER CB C 13 63.760 0.3 . 1 . . . . . 26 SER CB . 53702 1 341 . 1 . 1 26 26 SER N N 15 120.757 0.3 . 1 . . . . . 26 SER N . 53702 1 342 . 1 . 1 27 27 GLY HA2 H 1 4.000 0.020 . 2 . . . . . 27 GLY HA2 . 53702 1 343 . 1 . 1 27 27 GLY HA3 H 1 3.654 0.020 . 2 . . . . . 27 GLY HA3 . 53702 1 344 . 1 . 1 27 27 GLY C C 13 175.986 0.3 . 1 . . . . . 27 GLY C . 53702 1 345 . 1 . 1 27 27 GLY CA C 13 47.606 0.3 . 1 . . . . . 27 GLY CA . 53702 1 346 . 1 . 1 28 28 GLN HA H 1 4.342 0.020 . 1 . . . . . 28 GLN HA . 53702 1 347 . 1 . 1 28 28 GLN HB2 H 1 2.391 0.020 . 2 . . . . . 28 GLN HB2 . 53702 1 348 . 1 . 1 28 28 GLN HB3 H 1 1.959 0.020 . 2 . . . . . 28 GLN HB3 . 53702 1 349 . 1 . 1 28 28 GLN HG2 H 1 2.373 0.020 . 2 . . . . . 28 GLN HG2 . 53702 1 350 . 1 . 1 28 28 GLN HG3 H 1 2.326 0.020 . 2 . . . . . 28 GLN HG3 . 53702 1 351 . 1 . 1 28 28 GLN HE21 H 1 7.431 0.020 . 1 . . . . . 28 GLN HE21 . 53702 1 352 . 1 . 1 28 28 GLN HE22 H 1 6.840 0.020 . 1 . . . . . 28 GLN HE22 . 53702 1 353 . 1 . 1 28 28 GLN C C 13 174.045 0.3 . 1 . . . . . 28 GLN C . 53702 1 354 . 1 . 1 28 28 GLN CA C 13 55.037 0.3 . 1 . . . . . 28 GLN CA . 53702 1 355 . 1 . 1 28 28 GLN CB C 13 29.360 0.3 . 1 . . . . . 28 GLN CB . 53702 1 356 . 1 . 1 28 28 GLN CG C 13 34.237 0.3 . 1 . . . . . 28 GLN CG . 53702 1 357 . 1 . 1 28 28 GLN NE2 N 15 112.541 0.3 . 1 . . . . . 28 GLN NE2 . 53702 1 358 . 1 . 1 28 28 GLN CD C 13 180.550 0.3 . 1 . . . . . 28 GLN CD . 53702 1 359 . 1 . 1 29 29 GLN H H 1 8.107 0.020 . 1 . . . . . 29 GLN H . 53702 1 360 . 1 . 1 29 29 GLN HA H 1 4.703 0.020 . 1 . . . . . 29 GLN HA . 53702 1 361 . 1 . 1 29 29 GLN HB2 H 1 2.067 0.020 . 2 . . . . . 29 GLN HB2 . 53702 1 362 . 1 . 1 29 29 GLN HB3 H 1 1.986 0.020 . 2 . . . . . 29 GLN HB3 . 53702 1 363 . 1 . 1 29 29 GLN HG2 H 1 2.286 0.020 . 2 . . . . . 29 GLN HG2 . 53702 1 364 . 1 . 1 29 29 GLN HG3 H 1 2.103 0.020 . 2 . . . . . 29 GLN HG3 . 53702 1 365 . 1 . 1 29 29 GLN HE21 H 1 7.373 0.020 . 1 . . . . . 29 GLN HE21 . 53702 1 366 . 1 . 1 29 29 GLN HE22 H 1 6.810 0.020 . 1 . . . . . 29 GLN HE22 . 53702 1 367 . 1 . 1 29 29 GLN C C 13 174.395 0.3 . 1 . . . . . 29 GLN C . 53702 1 368 . 1 . 1 29 29 GLN CA C 13 55.375 0.3 . 1 . . . . . 29 GLN CA . 53702 1 369 . 1 . 1 29 29 GLN CB C 13 31.564 0.3 . 1 . . . . . 29 GLN CB . 53702 1 370 . 1 . 1 29 29 GLN CG C 13 34.735 0.3 . 1 . . . . . 29 GLN CG . 53702 1 371 . 1 . 1 29 29 GLN N N 15 117.463 0.3 . 1 . . . . . 29 GLN N . 53702 1 372 . 1 . 1 29 29 GLN NE2 N 15 111.065 0.3 . 1 . . . . . 29 GLN NE2 . 53702 1 373 . 1 . 1 29 29 GLN CD C 13 179.895 0.3 . 1 . . . . . 29 GLN CD . 53702 1 374 . 1 . 1 30 30 VAL H H 1 9.175 0.020 . 1 . . . . . 30 VAL H . 53702 1 375 . 1 . 1 30 30 VAL HA H 1 4.634 0.020 . 1 . . . . . 30 VAL HA . 53702 1 376 . 1 . 1 30 30 VAL HB H 1 1.955 0.020 . 1 . . . . . 30 VAL HB . 53702 1 377 . 1 . 1 30 30 VAL HG11 H 1 0.842 0.020 . 2 . . . . . 30 VAL HG1 . 53702 1 378 . 1 . 1 30 30 VAL HG12 H 1 0.842 0.020 . 2 . . . . . 30 VAL HG1 . 53702 1 379 . 1 . 1 30 30 VAL HG13 H 1 0.842 0.020 . 2 . . . . . 30 VAL HG1 . 53702 1 380 . 1 . 1 30 30 VAL HG21 H 1 0.931 0.020 . 2 . . . . . 30 VAL HG2 . 53702 1 381 . 1 . 1 30 30 VAL HG22 H 1 0.931 0.020 . 2 . . . . . 30 VAL HG2 . 53702 1 382 . 1 . 1 30 30 VAL HG23 H 1 0.931 0.020 . 2 . . . . . 30 VAL HG2 . 53702 1 383 . 1 . 1 30 30 VAL C C 13 173.648 0.3 . 1 . . . . . 30 VAL C . 53702 1 384 . 1 . 1 30 30 VAL CA C 13 60.644 0.3 . 1 . . . . . 30 VAL CA . 53702 1 385 . 1 . 1 30 30 VAL CB C 13 34.724 0.3 . 1 . . . . . 30 VAL CB . 53702 1 386 . 1 . 1 30 30 VAL CG1 C 13 22.673 0.3 . 1 . . . . . 30 VAL CG1 . 53702 1 387 . 1 . 1 30 30 VAL CG2 C 13 22.263 0.3 . 1 . . . . . 30 VAL CG2 . 53702 1 388 . 1 . 1 30 30 VAL N N 15 123.757 0.3 . 1 . . . . . 30 VAL N . 53702 1 389 . 1 . 1 31 31 ARG H H 1 8.728 0.020 . 1 . . . . . 31 ARG H . 53702 1 390 . 1 . 1 31 31 ARG HA H 1 4.903 0.020 . 1 . . . . . 31 ARG HA . 53702 1 391 . 1 . 1 31 31 ARG HB2 H 1 1.473 0.020 . 1 . . . . . 31 ARG HB2 . 53702 1 392 . 1 . 1 31 31 ARG HB3 H 1 1.473 0.020 . 1 . . . . . 31 ARG HB3 . 53702 1 393 . 1 . 1 31 31 ARG HG2 H 1 1.421 0.020 . 2 . . . . . 31 ARG HG2 . 53702 1 394 . 1 . 1 31 31 ARG HG3 H 1 1.318 0.020 . 2 . . . . . 31 ARG HG3 . 53702 1 395 . 1 . 1 31 31 ARG HD2 H 1 2.992 0.020 . 1 . . . . . 31 ARG HD2 . 53702 1 396 . 1 . 1 31 31 ARG HD3 H 1 2.992 0.020 . 1 . . . . . 31 ARG HD3 . 53702 1 397 . 1 . 1 31 31 ARG HE H 1 7.696 0.020 . 1 . . . . . 31 ARG HE . 53702 1 398 . 1 . 1 31 31 ARG C C 13 175.017 0.3 . 1 . . . . . 31 ARG C . 53702 1 399 . 1 . 1 31 31 ARG CA C 13 55.357 0.3 . 1 . . . . . 31 ARG CA . 53702 1 400 . 1 . 1 31 31 ARG CB C 13 31.721 0.3 . 1 . . . . . 31 ARG CB . 53702 1 401 . 1 . 1 31 31 ARG CG C 13 27.598 0.3 . 1 . . . . . 31 ARG CG . 53702 1 402 . 1 . 1 31 31 ARG CD C 13 43.432 0.3 . 1 . . . . . 31 ARG CD . 53702 1 403 . 1 . 1 31 31 ARG N N 15 128.319 0.3 . 1 . . . . . 31 ARG N . 53702 1 404 . 1 . 1 31 31 ARG NE N 15 83.014 0.3 . 1 . . . . . 31 ARG NE . 53702 1 405 . 1 . 1 32 32 ILE H H 1 9.340 0.020 . 1 . . . . . 32 ILE H . 53702 1 406 . 1 . 1 32 32 ILE HA H 1 4.812 0.020 . 1 . . . . . 32 ILE HA . 53702 1 407 . 1 . 1 32 32 ILE HB H 1 1.602 0.020 . 1 . . . . . 32 ILE HB . 53702 1 408 . 1 . 1 32 32 ILE HG12 H 1 1.461 0.020 . 2 . . . . . 32 ILE HG12 . 53702 1 409 . 1 . 1 32 32 ILE HG13 H 1 0.929 0.020 . 2 . . . . . 32 ILE HG13 . 53702 1 410 . 1 . 1 32 32 ILE HG21 H 1 0.724 0.020 . 1 . . . . . 32 ILE HG2 . 53702 1 411 . 1 . 1 32 32 ILE HG22 H 1 0.724 0.020 . 1 . . . . . 32 ILE HG2 . 53702 1 412 . 1 . 1 32 32 ILE HG23 H 1 0.724 0.020 . 1 . . . . . 32 ILE HG2 . 53702 1 413 . 1 . 1 32 32 ILE HD11 H 1 0.607 0.020 . 1 . . . . . 32 ILE HD1 . 53702 1 414 . 1 . 1 32 32 ILE HD12 H 1 0.607 0.020 . 1 . . . . . 32 ILE HD1 . 53702 1 415 . 1 . 1 32 32 ILE HD13 H 1 0.607 0.020 . 1 . . . . . 32 ILE HD1 . 53702 1 416 . 1 . 1 32 32 ILE C C 13 173.462 0.3 . 1 . . . . . 32 ILE C . 53702 1 417 . 1 . 1 32 32 ILE CA C 13 59.516 0.3 . 1 . . . . . 32 ILE CA . 53702 1 418 . 1 . 1 32 32 ILE CB C 13 41.752 0.3 . 1 . . . . . 32 ILE CB . 53702 1 419 . 1 . 1 32 32 ILE CG1 C 13 28.007 0.3 . 1 . . . . . 32 ILE CG1 . 53702 1 420 . 1 . 1 32 32 ILE CG2 C 13 18.065 0.3 . 1 . . . . . 32 ILE CG2 . 53702 1 421 . 1 . 1 32 32 ILE CD1 C 13 13.648 0.3 . 1 . . . . . 32 ILE CD1 . 53702 1 422 . 1 . 1 32 32 ILE N N 15 127.096 0.3 . 1 . . . . . 32 ILE N . 53702 1 423 . 1 . 1 33 33 GLY H H 1 9.321 0.020 . 1 . . . . . 33 GLY H . 53702 1 424 . 1 . 1 33 33 GLY HA2 H 1 5.297 0.020 . 2 . . . . . 33 GLY HA2 . 53702 1 425 . 1 . 1 33 33 GLY HA3 H 1 3.561 0.020 . 2 . . . . . 33 GLY HA3 . 53702 1 426 . 1 . 1 33 33 GLY C C 13 173.464 0.3 . 1 . . . . . 33 GLY C . 53702 1 427 . 1 . 1 33 33 GLY CA C 13 44.392 0.3 . 1 . . . . . 33 GLY CA . 53702 1 428 . 1 . 1 33 33 GLY N N 15 112.464 0.3 . 1 . . . . . 33 GLY N . 53702 1 429 . 1 . 1 34 34 ILE H H 1 9.531 0.020 . 1 . . . . . 34 ILE H . 53702 1 430 . 1 . 1 34 34 ILE HA H 1 4.839 0.020 . 1 . . . . . 34 ILE HA . 53702 1 431 . 1 . 1 34 34 ILE HB H 1 1.773 0.020 . 1 . . . . . 34 ILE HB . 53702 1 432 . 1 . 1 34 34 ILE HG12 H 1 1.481 0.020 . 2 . . . . . 34 ILE HG12 . 53702 1 433 . 1 . 1 34 34 ILE HG13 H 1 0.978 0.020 . 2 . . . . . 34 ILE HG13 . 53702 1 434 . 1 . 1 34 34 ILE HG21 H 1 0.727 0.020 . 1 . . . . . 34 ILE HG2 . 53702 1 435 . 1 . 1 34 34 ILE HG22 H 1 0.727 0.020 . 1 . . . . . 34 ILE HG2 . 53702 1 436 . 1 . 1 34 34 ILE HG23 H 1 0.727 0.020 . 1 . . . . . 34 ILE HG2 . 53702 1 437 . 1 . 1 34 34 ILE HD11 H 1 0.755 0.020 . 1 . . . . . 34 ILE HD1 . 53702 1 438 . 1 . 1 34 34 ILE HD12 H 1 0.755 0.020 . 1 . . . . . 34 ILE HD1 . 53702 1 439 . 1 . 1 34 34 ILE HD13 H 1 0.755 0.020 . 1 . . . . . 34 ILE HD1 . 53702 1 440 . 1 . 1 34 34 ILE C C 13 174.880 0.3 . 1 . . . . . 34 ILE C . 53702 1 441 . 1 . 1 34 34 ILE CA C 13 60.616 0.3 . 1 . . . . . 34 ILE CA . 53702 1 442 . 1 . 1 34 34 ILE CB C 13 41.093 0.3 . 1 . . . . . 34 ILE CB . 53702 1 443 . 1 . 1 34 34 ILE CG1 C 13 28.356 0.3 . 1 . . . . . 34 ILE CG1 . 53702 1 444 . 1 . 1 34 34 ILE CG2 C 13 17.690 0.3 . 1 . . . . . 34 ILE CG2 . 53702 1 445 . 1 . 1 34 34 ILE CD1 C 13 14.882 0.3 . 1 . . . . . 34 ILE CD1 . 53702 1 446 . 1 . 1 34 34 ILE N N 15 124.695 0.3 . 1 . . . . . 34 ILE N . 53702 1 447 . 1 . 1 35 35 ASN H H 1 9.076 0.020 . 1 . . . . . 35 ASN H . 53702 1 448 . 1 . 1 35 35 ASN HA H 1 5.118 0.020 . 1 . . . . . 35 ASN HA . 53702 1 449 . 1 . 1 35 35 ASN HB2 H 1 2.862 0.020 . 2 . . . . . 35 ASN HB2 . 53702 1 450 . 1 . 1 35 35 ASN HB3 H 1 2.567 0.020 . 2 . . . . . 35 ASN HB3 . 53702 1 451 . 1 . 1 35 35 ASN HD21 H 1 7.198 0.020 . 1 . . . . . 35 ASN HD21 . 53702 1 452 . 1 . 1 35 35 ASN HD22 H 1 6.755 0.020 . 1 . . . . . 35 ASN HD22 . 53702 1 453 . 1 . 1 35 35 ASN C C 13 172.371 0.3 . 1 . . . . . 35 ASN C . 53702 1 454 . 1 . 1 35 35 ASN CA C 13 52.642 0.3 . 1 . . . . . 35 ASN CA . 53702 1 455 . 1 . 1 35 35 ASN CB C 13 40.810 0.3 . 1 . . . . . 35 ASN CB . 53702 1 456 . 1 . 1 35 35 ASN CG C 13 180.133 0.3 . 1 . . . . . 35 ASN CG . 53702 1 457 . 1 . 1 35 35 ASN N N 15 128.825 0.3 . 1 . . . . . 35 ASN N . 53702 1 458 . 1 . 1 35 35 ASN ND2 N 15 111.917 0.3 . 1 . . . . . 35 ASN ND2 . 53702 1 459 . 1 . 1 36 36 ALA H H 1 8.278 0.020 . 1 . . . . . 36 ALA H . 53702 1 460 . 1 . 1 36 36 ALA HA H 1 5.125 0.020 . 1 . . . . . 36 ALA HA . 53702 1 461 . 1 . 1 36 36 ALA HB1 H 1 1.190 0.020 . 1 . . . . . 36 ALA HB . 53702 1 462 . 1 . 1 36 36 ALA HB2 H 1 1.190 0.020 . 1 . . . . . 36 ALA HB . 53702 1 463 . 1 . 1 36 36 ALA HB3 H 1 1.190 0.020 . 1 . . . . . 36 ALA HB . 53702 1 464 . 1 . 1 36 36 ALA C C 13 173.990 0.3 . 1 . . . . . 36 ALA C . 53702 1 465 . 1 . 1 36 36 ALA CA C 13 49.685 0.3 . 1 . . . . . 36 ALA CA . 53702 1 466 . 1 . 1 36 36 ALA CB C 13 19.851 0.3 . 1 . . . . . 36 ALA CB . 53702 1 467 . 1 . 1 36 36 ALA N N 15 125.976 0.3 . 1 . . . . . 36 ALA N . 53702 1 468 . 1 . 1 37 37 PRO HA H 1 4.505 0.020 . 1 . . . . . 37 PRO HA . 53702 1 469 . 1 . 1 37 37 PRO HB2 H 1 2.419 0.020 . 2 . . . . . 37 PRO HB2 . 53702 1 470 . 1 . 1 37 37 PRO HB3 H 1 1.962 0.020 . 2 . . . . . 37 PRO HB3 . 53702 1 471 . 1 . 1 37 37 PRO HG2 H 1 2.028 0.020 . 1 . . . . . 37 PRO HG2 . 53702 1 472 . 1 . 1 37 37 PRO HG3 H 1 2.028 0.020 . 1 . . . . . 37 PRO HG3 . 53702 1 473 . 1 . 1 37 37 PRO HD2 H 1 3.887 0.020 . 2 . . . . . 37 PRO HD2 . 53702 1 474 . 1 . 1 37 37 PRO HD3 H 1 3.218 0.020 . 2 . . . . . 37 PRO HD3 . 53702 1 475 . 1 . 1 37 37 PRO C C 13 177.189 0.3 . 1 . . . . . 37 PRO C . 53702 1 476 . 1 . 1 37 37 PRO CA C 13 63.038 0.3 . 1 . . . . . 37 PRO CA . 53702 1 477 . 1 . 1 37 37 PRO CB C 13 32.513 0.3 . 1 . . . . . 37 PRO CB . 53702 1 478 . 1 . 1 37 37 PRO CG C 13 27.878 0.3 . 1 . . . . . 37 PRO CG . 53702 1 479 . 1 . 1 37 37 PRO CD C 13 50.425 0.3 . 1 . . . . . 37 PRO CD . 53702 1 480 . 1 . 1 38 38 LYS H H 1 8.365 0.020 . 1 . . . . . 38 LYS H . 53702 1 481 . 1 . 1 38 38 LYS HA H 1 4.102 0.020 . 1 . . . . . 38 LYS HA . 53702 1 482 . 1 . 1 38 38 LYS HB2 H 1 1.817 0.020 . 1 . . . . . 38 LYS HB2 . 53702 1 483 . 1 . 1 38 38 LYS HB3 H 1 1.817 0.020 . 1 . . . . . 38 LYS HB3 . 53702 1 484 . 1 . 1 38 38 LYS HG2 H 1 1.460 0.020 . 1 . . . . . 38 LYS HG2 . 53702 1 485 . 1 . 1 38 38 LYS HG3 H 1 1.460 0.020 . 1 . . . . . 38 LYS HG3 . 53702 1 486 . 1 . 1 38 38 LYS HD2 H 1 1.684 0.020 . 1 . . . . . 38 LYS HD2 . 53702 1 487 . 1 . 1 38 38 LYS HD3 H 1 1.684 0.020 . 1 . . . . . 38 LYS HD3 . 53702 1 488 . 1 . 1 38 38 LYS HE2 H 1 3.008 0.020 . 1 . . . . . 38 LYS HE2 . 53702 1 489 . 1 . 1 38 38 LYS HE3 H 1 3.008 0.020 . 1 . . . . . 38 LYS HE3 . 53702 1 490 . 1 . 1 38 38 LYS C C 13 176.579 0.3 . 1 . . . . . 38 LYS C . 53702 1 491 . 1 . 1 38 38 LYS CA C 13 58.279 0.3 . 1 . . . . . 38 LYS CA . 53702 1 492 . 1 . 1 38 38 LYS CB C 13 32.668 0.3 . 1 . . . . . 38 LYS CB . 53702 1 493 . 1 . 1 38 38 LYS CG C 13 24.524 0.3 . 1 . . . . . 38 LYS CG . 53702 1 494 . 1 . 1 38 38 LYS CD C 13 29.200 0.3 . 1 . . . . . 38 LYS CD . 53702 1 495 . 1 . 1 38 38 LYS CE C 13 42.229 0.3 . 1 . . . . . 38 LYS CE . 53702 1 496 . 1 . 1 38 38 LYS N N 15 120.140 0.3 . 1 . . . . . 38 LYS N . 53702 1 497 . 1 . 1 39 39 ASP H H 1 8.215 0.020 . 1 . . . . . 39 ASP H . 53702 1 498 . 1 . 1 39 39 ASP HA H 1 4.514 0.020 . 1 . . . . . 39 ASP HA . 53702 1 499 . 1 . 1 39 39 ASP HB2 H 1 2.701 0.020 . 1 . . . . . 39 ASP HB2 . 53702 1 500 . 1 . 1 39 39 ASP HB3 H 1 2.701 0.020 . 1 . . . . . 39 ASP HB3 . 53702 1 501 . 1 . 1 39 39 ASP C C 13 175.607 0.3 . 1 . . . . . 39 ASP C . 53702 1 502 . 1 . 1 39 39 ASP CA C 13 54.324 0.3 . 1 . . . . . 39 ASP CA . 53702 1 503 . 1 . 1 39 39 ASP CB C 13 40.390 0.3 . 1 . . . . . 39 ASP CB . 53702 1 504 . 1 . 1 39 39 ASP N N 15 115.834 0.3 . 1 . . . . . 39 ASP N . 53702 1 505 . 1 . 1 40 40 VAL H H 1 7.569 0.020 . 1 . . . . . 40 VAL H . 53702 1 506 . 1 . 1 40 40 VAL HA H 1 4.043 0.020 . 1 . . . . . 40 VAL HA . 53702 1 507 . 1 . 1 40 40 VAL HB H 1 1.949 0.020 . 1 . . . . . 40 VAL HB . 53702 1 508 . 1 . 1 40 40 VAL HG11 H 1 0.750 0.020 . 2 . . . . . 40 VAL HG1 . 53702 1 509 . 1 . 1 40 40 VAL HG12 H 1 0.750 0.020 . 2 . . . . . 40 VAL HG1 . 53702 1 510 . 1 . 1 40 40 VAL HG13 H 1 0.750 0.020 . 2 . . . . . 40 VAL HG1 . 53702 1 511 . 1 . 1 40 40 VAL HG21 H 1 0.863 0.020 . 2 . . . . . 40 VAL HG2 . 53702 1 512 . 1 . 1 40 40 VAL HG22 H 1 0.863 0.020 . 2 . . . . . 40 VAL HG2 . 53702 1 513 . 1 . 1 40 40 VAL HG23 H 1 0.863 0.020 . 2 . . . . . 40 VAL HG2 . 53702 1 514 . 1 . 1 40 40 VAL C C 13 174.552 0.3 . 1 . . . . . 40 VAL C . 53702 1 515 . 1 . 1 40 40 VAL CA C 13 62.141 0.3 . 1 . . . . . 40 VAL CA . 53702 1 516 . 1 . 1 40 40 VAL CB C 13 32.473 0.3 . 1 . . . . . 40 VAL CB . 53702 1 517 . 1 . 1 40 40 VAL CG1 C 13 21.322 0.3 . 1 . . . . . 40 VAL CG1 . 53702 1 518 . 1 . 1 40 40 VAL CG2 C 13 21.439 0.3 . 1 . . . . . 40 VAL CG2 . 53702 1 519 . 1 . 1 40 40 VAL N N 15 121.069 0.3 . 1 . . . . . 40 VAL N . 53702 1 520 . 1 . 1 41 41 ALA H H 1 8.399 0.020 . 1 . . . . . 41 ALA H . 53702 1 521 . 1 . 1 41 41 ALA HA H 1 4.223 0.020 . 1 . . . . . 41 ALA HA . 53702 1 522 . 1 . 1 41 41 ALA HB1 H 1 1.216 0.020 . 1 . . . . . 41 ALA HB . 53702 1 523 . 1 . 1 41 41 ALA HB2 H 1 1.216 0.020 . 1 . . . . . 41 ALA HB . 53702 1 524 . 1 . 1 41 41 ALA HB3 H 1 1.216 0.020 . 1 . . . . . 41 ALA HB . 53702 1 525 . 1 . 1 41 41 ALA C C 13 176.664 0.3 . 1 . . . . . 41 ALA C . 53702 1 526 . 1 . 1 41 41 ALA CA C 13 52.254 0.3 . 1 . . . . . 41 ALA CA . 53702 1 527 . 1 . 1 41 41 ALA CB C 13 19.533 0.3 . 1 . . . . . 41 ALA CB . 53702 1 528 . 1 . 1 41 41 ALA N N 15 129.288 0.3 . 1 . . . . . 41 ALA N . 53702 1 529 . 1 . 1 42 42 VAL H H 1 7.982 0.020 . 1 . . . . . 42 VAL H . 53702 1 530 . 1 . 1 42 42 VAL HA H 1 4.368 0.020 . 1 . . . . . 42 VAL HA . 53702 1 531 . 1 . 1 42 42 VAL HB H 1 1.898 0.020 . 1 . . . . . 42 VAL HB . 53702 1 532 . 1 . 1 42 42 VAL HG11 H 1 0.721 0.020 . 2 . . . . . 42 VAL HG1 . 53702 1 533 . 1 . 1 42 42 VAL HG12 H 1 0.721 0.020 . 2 . . . . . 42 VAL HG1 . 53702 1 534 . 1 . 1 42 42 VAL HG13 H 1 0.721 0.020 . 2 . . . . . 42 VAL HG1 . 53702 1 535 . 1 . 1 42 42 VAL HG21 H 1 0.801 0.020 . 2 . . . . . 42 VAL HG2 . 53702 1 536 . 1 . 1 42 42 VAL HG22 H 1 0.801 0.020 . 2 . . . . . 42 VAL HG2 . 53702 1 537 . 1 . 1 42 42 VAL HG23 H 1 0.801 0.020 . 2 . . . . . 42 VAL HG2 . 53702 1 538 . 1 . 1 42 42 VAL C C 13 175.563 0.3 . 1 . . . . . 42 VAL C . 53702 1 539 . 1 . 1 42 42 VAL CA C 13 61.784 0.3 . 1 . . . . . 42 VAL CA . 53702 1 540 . 1 . 1 42 42 VAL CB C 13 32.719 0.3 . 1 . . . . . 42 VAL CB . 53702 1 541 . 1 . 1 42 42 VAL CG1 C 13 21.614 0.3 . 1 . . . . . 42 VAL CG1 . 53702 1 542 . 1 . 1 42 42 VAL CG2 C 13 21.100 0.3 . 1 . . . . . 42 VAL CG2 . 53702 1 543 . 1 . 1 42 42 VAL N N 15 121.956 0.3 . 1 . . . . . 42 VAL N . 53702 1 544 . 1 . 1 43 43 HIS H H 1 8.465 0.020 . 1 . . . . . 43 HIS H . 53702 1 545 . 1 . 1 43 43 HIS HA H 1 4.876 0.020 . 1 . . . . . 43 HIS HA . 53702 1 546 . 1 . 1 43 43 HIS HB2 H 1 3.177 0.020 . 2 . . . . . 43 HIS HB2 . 53702 1 547 . 1 . 1 43 43 HIS HB3 H 1 2.931 0.020 . 2 . . . . . 43 HIS HB3 . 53702 1 548 . 1 . 1 43 43 HIS C C 13 176.111 0.3 . 1 . . . . . 43 HIS C . 53702 1 549 . 1 . 1 43 43 HIS CA C 13 55.718 0.3 . 1 . . . . . 43 HIS CA . 53702 1 550 . 1 . 1 43 43 HIS CB C 13 32.537 0.3 . 1 . . . . . 43 HIS CB . 53702 1 551 . 1 . 1 43 43 HIS N N 15 124.340 0.3 . 1 . . . . . 43 HIS N . 53702 1 552 . 1 . 1 44 44 ARG H H 1 8.726 0.020 . 1 . . . . . 44 ARG H . 53702 1 553 . 1 . 1 44 44 ARG HA H 1 4.168 0.020 . 1 . . . . . 44 ARG HA . 53702 1 554 . 1 . 1 44 44 ARG HB2 H 1 2.001 0.020 . 2 . . . . . 44 ARG HB2 . 53702 1 555 . 1 . 1 44 44 ARG HB3 H 1 1.850 0.020 . 2 . . . . . 44 ARG HB3 . 53702 1 556 . 1 . 1 44 44 ARG HG2 H 1 1.766 0.020 . 2 . . . . . 44 ARG HG2 . 53702 1 557 . 1 . 1 44 44 ARG HG3 H 1 1.552 0.020 . 2 . . . . . 44 ARG HG3 . 53702 1 558 . 1 . 1 44 44 ARG HD2 H 1 3.264 0.020 . 1 . . . . . 44 ARG HD2 . 53702 1 559 . 1 . 1 44 44 ARG HD3 H 1 3.264 0.020 . 1 . . . . . 44 ARG HD3 . 53702 1 560 . 1 . 1 44 44 ARG C C 13 176.751 0.3 . 1 . . . . . 44 ARG C . 53702 1 561 . 1 . 1 44 44 ARG CA C 13 57.501 0.3 . 1 . . . . . 44 ARG CA . 53702 1 562 . 1 . 1 44 44 ARG CB C 13 30.961 0.3 . 1 . . . . . 44 ARG CB . 53702 1 563 . 1 . 1 44 44 ARG CG C 13 27.854 0.3 . 1 . . . . . 44 ARG CG . 53702 1 564 . 1 . 1 44 44 ARG CD C 13 43.678 0.3 . 1 . . . . . 44 ARG CD . 53702 1 565 . 1 . 1 44 44 ARG N N 15 122.865 0.3 . 1 . . . . . 44 ARG N . 53702 1 566 . 1 . 1 45 45 GLU H H 1 8.366 0.020 . 1 . . . . . 45 GLU H . 53702 1 567 . 1 . 1 45 45 GLU HA H 1 4.305 0.020 . 1 . . . . . 45 GLU HA . 53702 1 568 . 1 . 1 45 45 GLU HB2 H 1 2.109 0.020 . 2 . . . . . 45 GLU HB2 . 53702 1 569 . 1 . 1 45 45 GLU HB3 H 1 1.897 0.020 . 2 . . . . . 45 GLU HB3 . 53702 1 570 . 1 . 1 45 45 GLU HG2 H 1 2.296 0.020 . 1 . . . . . 45 GLU HG2 . 53702 1 571 . 1 . 1 45 45 GLU HG3 H 1 2.296 0.020 . 1 . . . . . 45 GLU HG3 . 53702 1 572 . 1 . 1 45 45 GLU C C 13 176.702 0.3 . 1 . . . . . 45 GLU C . 53702 1 573 . 1 . 1 45 45 GLU CA C 13 58.065 0.3 . 1 . . . . . 45 GLU CA . 53702 1 574 . 1 . 1 45 45 GLU CB C 13 30.146 0.3 . 1 . . . . . 45 GLU CB . 53702 1 575 . 1 . 1 45 45 GLU CG C 13 36.223 0.3 . 1 . . . . . 45 GLU CG . 53702 1 576 . 1 . 1 45 45 GLU N N 15 122.501 0.3 . 1 . . . . . 45 GLU N . 53702 1 577 . 1 . 1 46 46 GLU H H 1 8.989 0.020 . 1 . . . . . 46 GLU H . 53702 1 578 . 1 . 1 46 46 GLU HA H 1 4.307 0.020 . 1 . . . . . 46 GLU HA . 53702 1 579 . 1 . 1 46 46 GLU HB2 H 1 2.101 0.020 . 2 . . . . . 46 GLU HB2 . 53702 1 580 . 1 . 1 46 46 GLU HB3 H 1 1.996 0.020 . 2 . . . . . 46 GLU HB3 . 53702 1 581 . 1 . 1 46 46 GLU HG2 H 1 2.402 0.020 . 2 . . . . . 46 GLU HG2 . 53702 1 582 . 1 . 1 46 46 GLU HG3 H 1 2.224 0.020 . 2 . . . . . 46 GLU HG3 . 53702 1 583 . 1 . 1 46 46 GLU C C 13 177.307 0.3 . 1 . . . . . 46 GLU C . 53702 1 584 . 1 . 1 46 46 GLU CA C 13 57.589 0.3 . 1 . . . . . 46 GLU CA . 53702 1 585 . 1 . 1 46 46 GLU CB C 13 29.058 0.3 . 1 . . . . . 46 GLU CB . 53702 1 586 . 1 . 1 46 46 GLU CG C 13 35.983 0.3 . 1 . . . . . 46 GLU CG . 53702 1 587 . 1 . 1 46 46 GLU N N 15 120.138 0.3 . 1 . . . . . 46 GLU N . 53702 1 588 . 1 . 1 47 47 ILE H H 1 7.772 0.020 . 1 . . . . . 47 ILE H . 53702 1 589 . 1 . 1 47 47 ILE HA H 1 4.144 0.020 . 1 . . . . . 47 ILE HA . 53702 1 590 . 1 . 1 47 47 ILE HB H 1 1.947 0.020 . 1 . . . . . 47 ILE HB . 53702 1 591 . 1 . 1 47 47 ILE HG12 H 1 1.294 0.020 . 2 . . . . . 47 ILE HG12 . 53702 1 592 . 1 . 1 47 47 ILE HG13 H 1 1.157 0.020 . 2 . . . . . 47 ILE HG13 . 53702 1 593 . 1 . 1 47 47 ILE HG21 H 1 0.803 0.020 . 1 . . . . . 47 ILE HG2 . 53702 1 594 . 1 . 1 47 47 ILE HG22 H 1 0.803 0.020 . 1 . . . . . 47 ILE HG2 . 53702 1 595 . 1 . 1 47 47 ILE HG23 H 1 0.803 0.020 . 1 . . . . . 47 ILE HG2 . 53702 1 596 . 1 . 1 47 47 ILE HD11 H 1 0.791 0.020 . 1 . . . . . 47 ILE HD1 . 53702 1 597 . 1 . 1 47 47 ILE HD12 H 1 0.791 0.020 . 1 . . . . . 47 ILE HD1 . 53702 1 598 . 1 . 1 47 47 ILE HD13 H 1 0.791 0.020 . 1 . . . . . 47 ILE HD1 . 53702 1 599 . 1 . 1 47 47 ILE C C 13 176.370 0.3 . 1 . . . . . 47 ILE C . 53702 1 600 . 1 . 1 47 47 ILE CA C 13 61.954 0.3 . 1 . . . . . 47 ILE CA . 53702 1 601 . 1 . 1 47 47 ILE CB C 13 38.037 0.3 . 1 . . . . . 47 ILE CB . 53702 1 602 . 1 . 1 47 47 ILE CG1 C 13 27.407 0.3 . 1 . . . . . 47 ILE CG1 . 53702 1 603 . 1 . 1 47 47 ILE CG2 C 13 17.271 0.3 . 1 . . . . . 47 ILE CG2 . 53702 1 604 . 1 . 1 47 47 ILE CD1 C 13 12.353 0.3 . 1 . . . . . 47 ILE CD1 . 53702 1 605 . 1 . 1 47 47 ILE N N 15 120.244 0.3 . 1 . . . . . 47 ILE N . 53702 1 606 . 1 . 1 48 48 TYR H H 1 7.939 0.020 . 1 . . . . . 48 TYR H . 53702 1 607 . 1 . 1 48 48 TYR HA H 1 4.387 0.020 . 1 . . . . . 48 TYR HA . 53702 1 608 . 1 . 1 48 48 TYR HB2 H 1 3.110 0.020 . 2 . . . . . 48 TYR HB2 . 53702 1 609 . 1 . 1 48 48 TYR HB3 H 1 2.875 0.020 . 2 . . . . . 48 TYR HB3 . 53702 1 610 . 1 . 1 48 48 TYR C C 13 176.403 0.3 . 1 . . . . . 48 TYR C . 53702 1 611 . 1 . 1 48 48 TYR CA C 13 59.149 0.3 . 1 . . . . . 48 TYR CA . 53702 1 612 . 1 . 1 48 48 TYR CB C 13 38.911 0.3 . 1 . . . . . 48 TYR CB . 53702 1 613 . 1 . 1 48 48 TYR N N 15 122.041 0.3 . 1 . . . . . 48 TYR N . 53702 1 614 . 1 . 1 49 49 GLN H H 1 8.236 0.020 . 1 . . . . . 49 GLN H . 53702 1 615 . 1 . 1 49 49 GLN HA H 1 4.120 0.020 . 1 . . . . . 49 GLN HA . 53702 1 616 . 1 . 1 49 49 GLN HB2 H 1 2.049 0.020 . 2 . . . . . 49 GLN HB2 . 53702 1 617 . 1 . 1 49 49 GLN HB3 H 1 1.978 0.020 . 2 . . . . . 49 GLN HB3 . 53702 1 618 . 1 . 1 49 49 GLN HG2 H 1 2.401 0.020 . 2 . . . . . 49 GLN HG2 . 53702 1 619 . 1 . 1 49 49 GLN HG3 H 1 2.347 0.020 . 2 . . . . . 49 GLN HG3 . 53702 1 620 . 1 . 1 49 49 GLN HE21 H 1 7.467 0.020 . 1 . . . . . 49 GLN HE21 . 53702 1 621 . 1 . 1 49 49 GLN HE22 H 1 6.763 0.020 . 1 . . . . . 49 GLN HE22 . 53702 1 622 . 1 . 1 49 49 GLN C C 13 176.556 0.3 . 1 . . . . . 49 GLN C . 53702 1 623 . 1 . 1 49 49 GLN CA C 13 57.086 0.3 . 1 . . . . . 49 GLN CA . 53702 1 624 . 1 . 1 49 49 GLN CB C 13 29.118 0.3 . 1 . . . . . 49 GLN CB . 53702 1 625 . 1 . 1 49 49 GLN CG C 13 33.877 0.3 . 1 . . . . . 49 GLN CG . 53702 1 626 . 1 . 1 49 49 GLN N N 15 119.394 0.3 . 1 . . . . . 49 GLN N . 53702 1 627 . 1 . 1 49 49 GLN NE2 N 15 111.520 0.3 . 1 . . . . . 49 GLN NE2 . 53702 1 628 . 1 . 1 49 49 GLN CD C 13 180.098 0.3 . 1 . . . . . 49 GLN CD . 53702 1 629 . 1 . 1 50 50 ARG H H 1 7.834 0.020 . 1 . . . . . 50 ARG H . 53702 1 630 . 1 . 1 50 50 ARG HA H 1 4.187 0.020 . 1 . . . . . 50 ARG HA . 53702 1 631 . 1 . 1 50 50 ARG HB2 H 1 1.843 0.020 . 2 . . . . . 50 ARG HB2 . 53702 1 632 . 1 . 1 50 50 ARG HB3 H 1 1.795 0.020 . 2 . . . . . 50 ARG HB3 . 53702 1 633 . 1 . 1 50 50 ARG HG2 H 1 1.683 0.020 . 2 . . . . . 50 ARG HG2 . 53702 1 634 . 1 . 1 50 50 ARG HG3 H 1 1.579 0.020 . 2 . . . . . 50 ARG HG3 . 53702 1 635 . 1 . 1 50 50 ARG HD2 H 1 3.139 0.020 . 1 . . . . . 50 ARG HD2 . 53702 1 636 . 1 . 1 50 50 ARG HD3 H 1 3.139 0.020 . 1 . . . . . 50 ARG HD3 . 53702 1 637 . 1 . 1 50 50 ARG C C 13 177.058 0.3 . 1 . . . . . 50 ARG C . 53702 1 638 . 1 . 1 50 50 ARG CA C 13 57.438 0.3 . 1 . . . . . 50 ARG CA . 53702 1 639 . 1 . 1 50 50 ARG CB C 13 30.545 0.3 . 1 . . . . . 50 ARG CB . 53702 1 640 . 1 . 1 50 50 ARG CG C 13 27.560 0.3 . 1 . . . . . 50 ARG CG . 53702 1 641 . 1 . 1 50 50 ARG CD C 13 43.524 0.3 . 1 . . . . . 50 ARG CD . 53702 1 642 . 1 . 1 50 50 ARG N N 15 121.222 0.3 . 1 . . . . . 50 ARG N . 53702 1 643 . 1 . 1 51 51 ILE H H 1 8.000 0.020 . 1 . . . . . 51 ILE H . 53702 1 644 . 1 . 1 51 51 ILE HA H 1 4.006 0.020 . 1 . . . . . 51 ILE HA . 53702 1 645 . 1 . 1 51 51 ILE HB H 1 1.792 0.020 . 1 . . . . . 51 ILE HB . 53702 1 646 . 1 . 1 51 51 ILE HG12 H 1 1.451 0.020 . 2 . . . . . 51 ILE HG12 . 53702 1 647 . 1 . 1 51 51 ILE HG13 H 1 1.081 0.020 . 2 . . . . . 51 ILE HG13 . 53702 1 648 . 1 . 1 51 51 ILE HG21 H 1 0.820 0.020 . 1 . . . . . 51 ILE HG2 . 53702 1 649 . 1 . 1 51 51 ILE HG22 H 1 0.820 0.020 . 1 . . . . . 51 ILE HG2 . 53702 1 650 . 1 . 1 51 51 ILE HG23 H 1 0.820 0.020 . 1 . . . . . 51 ILE HG2 . 53702 1 651 . 1 . 1 51 51 ILE HD11 H 1 0.724 0.020 . 1 . . . . . 51 ILE HD1 . 53702 1 652 . 1 . 1 51 51 ILE HD12 H 1 0.724 0.020 . 1 . . . . . 51 ILE HD1 . 53702 1 653 . 1 . 1 51 51 ILE HD13 H 1 0.724 0.020 . 1 . . . . . 51 ILE HD1 . 53702 1 654 . 1 . 1 51 51 ILE C C 13 177.179 0.3 . 1 . . . . . 51 ILE C . 53702 1 655 . 1 . 1 51 51 ILE CA C 13 62.527 0.3 . 1 . . . . . 51 ILE CA . 53702 1 656 . 1 . 1 51 51 ILE CB C 13 38.437 0.3 . 1 . . . . . 51 ILE CB . 53702 1 657 . 1 . 1 51 51 ILE CG1 C 13 27.607 0.3 . 1 . . . . . 51 ILE CG1 . 53702 1 658 . 1 . 1 51 51 ILE CG2 C 13 17.256 0.3 . 1 . . . . . 51 ILE CG2 . 53702 1 659 . 1 . 1 51 51 ILE CD1 C 13 13.019 0.3 . 1 . . . . . 51 ILE CD1 . 53702 1 660 . 1 . 1 51 51 ILE N N 15 121.254 0.3 . 1 . . . . . 51 ILE N . 53702 1 661 . 1 . 1 52 52 GLN H H 1 8.200 0.020 . 1 . . . . . 52 GLN H . 53702 1 662 . 1 . 1 52 52 GLN HA H 1 4.148 0.020 . 1 . . . . . 52 GLN HA . 53702 1 663 . 1 . 1 52 52 GLN HB2 H 1 2.024 0.020 . 2 . . . . . 52 GLN HB2 . 53702 1 664 . 1 . 1 52 52 GLN HB3 H 1 1.907 0.020 . 2 . . . . . 52 GLN HB3 . 53702 1 665 . 1 . 1 52 52 GLN HG2 H 1 2.212 0.020 . 1 . . . . . 52 GLN HG2 . 53702 1 666 . 1 . 1 52 52 GLN HG3 H 1 2.212 0.020 . 1 . . . . . 52 GLN HG3 . 53702 1 667 . 1 . 1 52 52 GLN HE21 H 1 7.467 0.020 . 1 . . . . . 52 GLN HE21 . 53702 1 668 . 1 . 1 52 52 GLN HE22 H 1 6.840 0.020 . 1 . . . . . 52 GLN HE22 . 53702 1 669 . 1 . 1 52 52 GLN C C 13 176.117 0.3 . 1 . . . . . 52 GLN C . 53702 1 670 . 1 . 1 52 52 GLN CA C 13 56.403 0.3 . 1 . . . . . 52 GLN CA . 53702 1 671 . 1 . 1 52 52 GLN CB C 13 29.143 0.3 . 1 . . . . . 52 GLN CB . 53702 1 672 . 1 . 1 52 52 GLN CG C 13 33.746 0.3 . 1 . . . . . 52 GLN CG . 53702 1 673 . 1 . 1 52 52 GLN N N 15 122.692 0.3 . 1 . . . . . 52 GLN N . 53702 1 674 . 1 . 1 52 52 GLN NE2 N 15 111.990 0.3 . 1 . . . . . 52 GLN NE2 . 53702 1 675 . 1 . 1 53 53 ALA H H 1 8.002 0.020 . 1 . . . . . 53 ALA H . 53702 1 676 . 1 . 1 53 53 ALA HA H 1 4.266 0.020 . 1 . . . . . 53 ALA HA . 53702 1 677 . 1 . 1 53 53 ALA HB1 H 1 1.401 0.020 . 1 . . . . . 53 ALA HB . 53702 1 678 . 1 . 1 53 53 ALA HB2 H 1 1.401 0.020 . 1 . . . . . 53 ALA HB . 53702 1 679 . 1 . 1 53 53 ALA HB3 H 1 1.401 0.020 . 1 . . . . . 53 ALA HB . 53702 1 680 . 1 . 1 53 53 ALA C C 13 178.203 0.3 . 1 . . . . . 53 ALA C . 53702 1 681 . 1 . 1 53 53 ALA CA C 13 52.912 0.3 . 1 . . . . . 53 ALA CA . 53702 1 682 . 1 . 1 53 53 ALA CB C 13 19.083 0.3 . 1 . . . . . 53 ALA CB . 53702 1 683 . 1 . 1 53 53 ALA N N 15 123.938 0.3 . 1 . . . . . 53 ALA N . 53702 1 684 . 1 . 1 54 54 GLY H H 1 8.100 0.020 . 1 . . . . . 54 GLY H . 53702 1 685 . 1 . 1 54 54 GLY HA2 H 1 3.941 0.020 . 1 . . . . . 54 GLY HA2 . 53702 1 686 . 1 . 1 54 54 GLY HA3 H 1 3.941 0.020 . 1 . . . . . 54 GLY HA3 . 53702 1 687 . 1 . 1 54 54 GLY C C 13 174.325 0.3 . 1 . . . . . 54 GLY C . 53702 1 688 . 1 . 1 54 54 GLY CA C 13 45.607 0.3 . 1 . . . . . 54 GLY CA . 53702 1 689 . 1 . 1 54 54 GLY N N 15 107.087 0.3 . 1 . . . . . 54 GLY N . 53702 1 690 . 1 . 1 55 55 LEU H H 1 7.903 0.020 . 1 . . . . . 55 LEU H . 53702 1 691 . 1 . 1 55 55 LEU HA H 1 4.401 0.020 . 1 . . . . . 55 LEU HA . 53702 1 692 . 1 . 1 55 55 LEU HB2 H 1 1.633 0.020 . 1 . . . . . 55 LEU HB2 . 53702 1 693 . 1 . 1 55 55 LEU HB3 H 1 1.633 0.020 . 1 . . . . . 55 LEU HB3 . 53702 1 694 . 1 . 1 55 55 LEU HG H 1 1.604 0.020 . 1 . . . . . 55 LEU HG . 53702 1 695 . 1 . 1 55 55 LEU HD11 H 1 0.888 0.020 . 2 . . . . . 55 LEU HD1 . 53702 1 696 . 1 . 1 55 55 LEU HD12 H 1 0.888 0.020 . 2 . . . . . 55 LEU HD1 . 53702 1 697 . 1 . 1 55 55 LEU HD13 H 1 0.888 0.020 . 2 . . . . . 55 LEU HD1 . 53702 1 698 . 1 . 1 55 55 LEU HD21 H 1 0.843 0.020 . 2 . . . . . 55 LEU HD2 . 53702 1 699 . 1 . 1 55 55 LEU HD22 H 1 0.843 0.020 . 2 . . . . . 55 LEU HD2 . 53702 1 700 . 1 . 1 55 55 LEU HD23 H 1 0.843 0.020 . 2 . . . . . 55 LEU HD2 . 53702 1 701 . 1 . 1 55 55 LEU C C 13 177.471 0.3 . 1 . . . . . 55 LEU C . 53702 1 702 . 1 . 1 55 55 LEU CA C 13 55.367 0.3 . 1 . . . . . 55 LEU CA . 53702 1 703 . 1 . 1 55 55 LEU CB C 13 42.493 0.3 . 1 . . . . . 55 LEU CB . 53702 1 704 . 1 . 1 55 55 LEU CG C 13 26.959 0.3 . 1 . . . . . 55 LEU CG . 53702 1 705 . 1 . 1 55 55 LEU CD1 C 13 25.121 0.3 . 1 . . . . . 55 LEU CD1 . 53702 1 706 . 1 . 1 55 55 LEU CD2 C 13 23.423 0.3 . 1 . . . . . 55 LEU CD2 . 53702 1 707 . 1 . 1 55 55 LEU N N 15 121.108 0.3 . 1 . . . . . 55 LEU N . 53702 1 708 . 1 . 1 56 56 THR H H 1 7.961 0.020 . 1 . . . . . 56 THR H . 53702 1 709 . 1 . 1 56 56 THR HA H 1 4.312 0.020 . 1 . . . . . 56 THR HA . 53702 1 710 . 1 . 1 56 56 THR HB H 1 4.159 0.020 . 1 . . . . . 56 THR HB . 53702 1 711 . 1 . 1 56 56 THR HG21 H 1 1.172 0.020 . 1 . . . . . 56 THR HG2 . 53702 1 712 . 1 . 1 56 56 THR HG22 H 1 1.172 0.020 . 1 . . . . . 56 THR HG2 . 53702 1 713 . 1 . 1 56 56 THR HG23 H 1 1.172 0.020 . 1 . . . . . 56 THR HG2 . 53702 1 714 . 1 . 1 56 56 THR C C 13 173.808 0.3 . 1 . . . . . 56 THR C . 53702 1 715 . 1 . 1 56 56 THR CA C 13 61.679 0.3 . 1 . . . . . 56 THR CA . 53702 1 716 . 1 . 1 56 56 THR CB C 13 70.056 0.3 . 1 . . . . . 56 THR CB . 53702 1 717 . 1 . 1 56 56 THR CG2 C 13 21.746 0.3 . 1 . . . . . 56 THR CG2 . 53702 1 718 . 1 . 1 56 56 THR N N 15 113.898 0.3 . 1 . . . . . 56 THR N . 53702 1 719 . 1 . 1 57 57 ALA H H 1 8.175 0.020 . 1 . . . . . 57 ALA H . 53702 1 720 . 1 . 1 57 57 ALA HA H 1 4.582 0.020 . 1 . . . . . 57 ALA HA . 53702 1 721 . 1 . 1 57 57 ALA HB1 H 1 1.368 0.020 . 1 . . . . . 57 ALA HB . 53702 1 722 . 1 . 1 57 57 ALA HB2 H 1 1.368 0.020 . 1 . . . . . 57 ALA HB . 53702 1 723 . 1 . 1 57 57 ALA HB3 H 1 1.368 0.020 . 1 . . . . . 57 ALA HB . 53702 1 724 . 1 . 1 57 57 ALA C C 13 175.676 0.3 . 1 . . . . . 57 ALA C . 53702 1 725 . 1 . 1 57 57 ALA CA C 13 50.700 0.3 . 1 . . . . . 57 ALA CA . 53702 1 726 . 1 . 1 57 57 ALA CB C 13 18.360 0.3 . 1 . . . . . 57 ALA CB . 53702 1 727 . 1 . 1 57 57 ALA N N 15 127.441 0.3 . 1 . . . . . 57 ALA N . 53702 1 728 . 1 . 1 58 58 PRO HA H 1 4.362 0.020 . 1 . . . . . 58 PRO HA . 53702 1 729 . 1 . 1 58 58 PRO HB2 H 1 2.246 0.020 . 2 . . . . . 58 PRO HB2 . 53702 1 730 . 1 . 1 58 58 PRO HB3 H 1 1.901 0.020 . 2 . . . . . 58 PRO HB3 . 53702 1 731 . 1 . 1 58 58 PRO HG2 H 1 1.983 0.020 . 1 . . . . . 58 PRO HG2 . 53702 1 732 . 1 . 1 58 58 PRO HG3 H 1 1.983 0.020 . 1 . . . . . 58 PRO HG3 . 53702 1 733 . 1 . 1 58 58 PRO HD2 H 1 3.742 0.020 . 2 . . . . . 58 PRO HD2 . 53702 1 734 . 1 . 1 58 58 PRO HD3 H 1 3.643 0.020 . 2 . . . . . 58 PRO HD3 . 53702 1 735 . 1 . 1 58 58 PRO C C 13 176.679 0.3 . 1 . . . . . 58 PRO C . 53702 1 736 . 1 . 1 58 58 PRO CA C 13 63.657 0.3 . 1 . . . . . 58 PRO CA . 53702 1 737 . 1 . 1 58 58 PRO CB C 13 31.975 0.3 . 1 . . . . . 58 PRO CB . 53702 1 738 . 1 . 1 58 58 PRO CG C 13 27.347 0.3 . 1 . . . . . 58 PRO CG . 53702 1 739 . 1 . 1 58 58 PRO CD C 13 50.528 0.3 . 1 . . . . . 58 PRO CD . 53702 1 740 . 1 . 1 59 59 ASP H H 1 8.268 0.020 . 1 . . . . . 59 ASP H . 53702 1 741 . 1 . 1 59 59 ASP HA H 1 4.529 0.020 . 1 . . . . . 59 ASP HA . 53702 1 742 . 1 . 1 59 59 ASP HB2 H 1 2.658 0.020 . 1 . . . . . 59 ASP HB2 . 53702 1 743 . 1 . 1 59 59 ASP HB3 H 1 2.658 0.020 . 1 . . . . . 59 ASP HB3 . 53702 1 744 . 1 . 1 59 59 ASP C C 13 176.334 0.3 . 1 . . . . . 59 ASP C . 53702 1 745 . 1 . 1 59 59 ASP CA C 13 54.352 0.3 . 1 . . . . . 59 ASP CA . 53702 1 746 . 1 . 1 59 59 ASP CB C 13 41.183 0.3 . 1 . . . . . 59 ASP CB . 53702 1 747 . 1 . 1 59 59 ASP N N 15 119.234 0.3 . 1 . . . . . 59 ASP N . 53702 1 748 . 1 . 1 60 60 LYS H H 1 8.073 0.020 . 1 . . . . . 60 LYS H . 53702 1 749 . 1 . 1 60 60 LYS HA H 1 4.299 0.020 . 1 . . . . . 60 LYS HA . 53702 1 750 . 1 . 1 60 60 LYS HB2 H 1 1.851 0.020 . 2 . . . . . 60 LYS HB2 . 53702 1 751 . 1 . 1 60 60 LYS HB3 H 1 1.743 0.020 . 2 . . . . . 60 LYS HB3 . 53702 1 752 . 1 . 1 60 60 LYS HG2 H 1 1.409 0.020 . 2 . . . . . 60 LYS HG2 . 53702 1 753 . 1 . 1 60 60 LYS HG3 H 1 1.355 0.020 . 2 . . . . . 60 LYS HG3 . 53702 1 754 . 1 . 1 60 60 LYS HD2 H 1 1.641 0.020 . 1 . . . . . 60 LYS HD2 . 53702 1 755 . 1 . 1 60 60 LYS HD3 H 1 1.641 0.020 . 1 . . . . . 60 LYS HD3 . 53702 1 756 . 1 . 1 60 60 LYS HE2 H 1 2.955 0.020 . 1 . . . . . 60 LYS HE2 . 53702 1 757 . 1 . 1 60 60 LYS HE3 H 1 2.955 0.020 . 1 . . . . . 60 LYS HE3 . 53702 1 758 . 1 . 1 60 60 LYS C C 13 176.514 0.3 . 1 . . . . . 60 LYS C . 53702 1 759 . 1 . 1 60 60 LYS CA C 13 56.374 0.3 . 1 . . . . . 60 LYS CA . 53702 1 760 . 1 . 1 60 60 LYS CB C 13 32.785 0.3 . 1 . . . . . 60 LYS CB . 53702 1 761 . 1 . 1 60 60 LYS CG C 13 24.735 0.3 . 1 . . . . . 60 LYS CG . 53702 1 762 . 1 . 1 60 60 LYS CD C 13 29.114 0.3 . 1 . . . . . 60 LYS CD . 53702 1 763 . 1 . 1 60 60 LYS CE C 13 42.275 0.3 . 1 . . . . . 60 LYS CE . 53702 1 764 . 1 . 1 60 60 LYS N N 15 121.421 0.3 . 1 . . . . . 60 LYS N . 53702 1 765 . 1 . 1 61 61 ARG H H 1 8.197 0.020 . 1 . . . . . 61 ARG H . 53702 1 766 . 1 . 1 61 61 ARG HA H 1 4.183 0.020 . 1 . . . . . 61 ARG HA . 53702 1 767 . 1 . 1 61 61 ARG HB2 H 1 1.791 0.020 . 2 . . . . . 61 ARG HB2 . 53702 1 768 . 1 . 1 61 61 ARG HB3 H 1 1.735 0.020 . 2 . . . . . 61 ARG HB3 . 53702 1 769 . 1 . 1 61 61 ARG HG2 H 1 1.564 0.020 . 2 . . . . . 61 ARG HG2 . 53702 1 770 . 1 . 1 61 61 ARG HG3 H 1 1.530 0.020 . 2 . . . . . 61 ARG HG3 . 53702 1 771 . 1 . 1 61 61 ARG HD2 H 1 3.107 0.020 . 1 . . . . . 61 ARG HD2 . 53702 1 772 . 1 . 1 61 61 ARG HD3 H 1 3.107 0.020 . 1 . . . . . 61 ARG HD3 . 53702 1 773 . 1 . 1 61 61 ARG C C 13 176.456 0.3 . 1 . . . . . 61 ARG C . 53702 1 774 . 1 . 1 61 61 ARG CA C 13 56.692 0.3 . 1 . . . . . 61 ARG CA . 53702 1 775 . 1 . 1 61 61 ARG CB C 13 30.488 0.3 . 1 . . . . . 61 ARG CB . 53702 1 776 . 1 . 1 61 61 ARG CG C 13 27.095 0.3 . 1 . . . . . 61 ARG CG . 53702 1 777 . 1 . 1 61 61 ARG CD C 13 43.514 0.3 . 1 . . . . . 61 ARG CD . 53702 1 778 . 1 . 1 61 61 ARG N N 15 121.525 0.3 . 1 . . . . . 61 ARG N . 53702 1 779 . 1 . 1 62 62 GLU H H 1 8.406 0.020 . 1 . . . . . 62 GLU H . 53702 1 780 . 1 . 1 62 62 GLU HA H 1 4.247 0.020 . 1 . . . . . 62 GLU HA . 53702 1 781 . 1 . 1 62 62 GLU HB2 H 1 1.849 0.020 . 2 . . . . . 62 GLU HB2 . 53702 1 782 . 1 . 1 62 62 GLU HB3 H 1 1.792 0.020 . 2 . . . . . 62 GLU HB3 . 53702 1 783 . 1 . 1 62 62 GLU HG2 H 1 2.196 0.020 . 1 . . . . . 62 GLU HG2 . 53702 1 784 . 1 . 1 62 62 GLU HG3 H 1 2.196 0.020 . 1 . . . . . 62 GLU HG3 . 53702 1 785 . 1 . 1 62 62 GLU C C 13 176.732 0.3 . 1 . . . . . 62 GLU C . 53702 1 786 . 1 . 1 62 62 GLU CA C 13 56.810 0.3 . 1 . . . . . 62 GLU CA . 53702 1 787 . 1 . 1 62 62 GLU CB C 13 30.098 0.3 . 1 . . . . . 62 GLU CB . 53702 1 788 . 1 . 1 62 62 GLU CG C 13 36.354 0.3 . 1 . . . . . 62 GLU CG . 53702 1 789 . 1 . 1 62 62 GLU N N 15 121.181 0.3 . 1 . . . . . 62 GLU N . 53702 1 790 . 1 . 1 63 63 THR H H 1 7.984 0.020 . 1 . . . . . 63 THR H . 53702 1 791 . 1 . 1 63 63 THR HA H 1 4.209 0.020 . 1 . . . . . 63 THR HA . 53702 1 792 . 1 . 1 63 63 THR HG21 H 1 1.080 0.020 . 1 . . . . . 63 THR HG2 . 53702 1 793 . 1 . 1 63 63 THR HG22 H 1 1.080 0.020 . 1 . . . . . 63 THR HG2 . 53702 1 794 . 1 . 1 63 63 THR HG23 H 1 1.080 0.020 . 1 . . . . . 63 THR HG2 . 53702 1 795 . 1 . 1 63 63 THR C C 13 175.857 0.3 . 1 . . . . . 63 THR C . 53702 1 796 . 1 . 1 63 63 THR CA C 13 62.146 0.3 . 1 . . . . . 63 THR CA . 53702 1 797 . 1 . 1 63 63 THR CG2 C 13 21.563 0.3 . 1 . . . . . 63 THR CG2 . 53702 1 798 . 1 . 1 63 63 THR N N 15 113.851 0.3 . 1 . . . . . 63 THR N . 53702 1 799 . 1 . 1 64 64 TRP H H 1 7.896 0.020 . 1 . . . . . 64 TRP H . 53702 1 800 . 1 . 1 64 64 TRP HE1 H 1 10.063 0.020 . 1 . . . . . 64 TRP HE1 . 53702 1 801 . 1 . 1 64 64 TRP C C 13 175.857 0.3 . 1 . . . . . 64 TRP C . 53702 1 802 . 1 . 1 64 64 TRP N N 15 122.304 0.3 . 1 . . . . . 64 TRP N . 53702 1 803 . 1 . 1 64 64 TRP NE1 N 15 129.518 0.3 . 1 . . . . . 64 TRP NE1 . 53702 1 804 . 1 . 1 65 65 HIS H H 1 7.784 0.020 . 1 . . . . . 65 HIS H . 53702 1 805 . 1 . 1 65 65 HIS HA H 1 4.376 0.020 . 1 . . . . . 65 HIS HA . 53702 1 806 . 1 . 1 65 65 HIS HB2 H 1 3.122 0.020 . 2 . . . . . 65 HIS HB2 . 53702 1 807 . 1 . 1 65 65 HIS HB3 H 1 2.985 0.020 . 2 . . . . . 65 HIS HB3 . 53702 1 808 . 1 . 1 65 65 HIS CA C 13 57.605 0.3 . 1 . . . . . 65 HIS CA . 53702 1 809 . 1 . 1 65 65 HIS CB C 13 31.119 0.3 . 1 . . . . . 65 HIS CB . 53702 1 810 . 1 . 1 65 65 HIS N N 15 125.753 0.3 . 1 . . . . . 65 HIS N . 53702 1 811 . 1 . 1 70 70 HIS H H 1 7.666 0.020 . 1 . . . . . 70 HIS H . 53702 1 812 . 1 . 1 70 70 HIS C C 13 179.538 0.3 . 1 . . . . . 70 HIS C . 53702 1 813 . 1 . 1 70 70 HIS CA C 13 57.719 0.3 . 1 . . . . . 70 HIS CA . 53702 1 814 . 1 . 1 70 70 HIS N N 15 126.434 0.3 . 1 . . . . . 70 HIS N . 53702 1 stop_ save_