################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7072 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 2 CBCACONH 2 $sample_2 isotropic 7072 1 3 CBCANH 2 $sample_2 isotropic 7072 1 4 HNCO 2 $sample_2 isotropic 7072 1 5 HBHACBCACONH 2 $sample_2 isotropic 7072 1 6 HCCONH-tocsy 2 $sample_2 isotropic 7072 1 7 CCONH-tocsy 2 $sample_2 isotropic 7072 1 8 15N_NOESY 2 $sample_2 isotropic 7072 1 9 HNCACO 2 $sample_2 isotropic 7072 1 10 13C_NOESY . . isotropic 7072 1 11 HCCH-tocsy . . isotropic 7072 1 12 HCCH-cosy . . isotropic 7072 1 . . 1 $sample_1 isotropic 7072 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 $sparky . . 7072 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 PRO HA H 1 4.641 0.01 . 1 . . . . 9 PRO HA . 7072 1 2 . 1 1 1 1 PRO HB2 H 1 2.338 0.01 . 1 . . . . 9 PRO HB2 . 7072 1 3 . 1 1 1 1 PRO HB3 H 1 2.037 0.01 . 1 . . . . 9 PRO HB3 . 7072 1 4 . 1 1 1 1 PRO HG2 H 1 2.111 0.01 . 1 . . . . 9 PRO HG2 . 7072 1 5 . 1 1 1 1 PRO HG3 H 1 2.063 0.01 . 1 . . . . 9 PRO HG3 . 7072 1 6 . 1 1 1 1 PRO HD2 H 1 3.762 0.01 . 1 . . . . 9 PRO HD2 . 7072 1 7 . 1 1 1 1 PRO HD3 H 1 3.716 0.01 . 1 . . . . 9 PRO HD3 . 7072 1 8 . 1 1 1 1 PRO C C 13 176.814 0.1 . 1 . . . . 9 PRO C . 7072 1 9 . 1 1 1 1 PRO CA C 13 62.42 0.1 . 1 . . . . 9 PRO CA . 7072 1 10 . 1 1 1 1 PRO CB C 13 32.064 0.1 . 1 . . . . 9 PRO CB . 7072 1 11 . 1 1 1 1 PRO CG C 13 27.31 0.1 . 1 . . . . 9 PRO CG . 7072 1 12 . 1 1 1 1 PRO CD C 13 49.423 0.1 . 1 . . . . 9 PRO CD . 7072 1 13 . 1 1 2 2 ILE H H 1 8.277 0.01 . 1 . . . . 10 ILE H . 7072 1 14 . 1 1 2 2 ILE HA H 1 4.417 0.01 . 1 . . . . 10 ILE HA . 7072 1 15 . 1 1 2 2 ILE HB H 1 1.767 0.01 . 1 . . . . 10 ILE HB . 7072 1 16 . 1 1 2 2 ILE HG12 H 1 1.015 0.01 . 1 . . . . 10 ILE HG12 . 7072 1 17 . 1 1 2 2 ILE HG13 H 1 1.015 0.01 . 1 . . . . 10 ILE HG13 . 7072 1 18 . 1 1 2 2 ILE HG21 H 1 0.961 0.01 . 1 . . . . 10 ILE HG2 . 7072 1 19 . 1 1 2 2 ILE HG22 H 1 0.961 0.01 . 1 . . . . 10 ILE HG2 . 7072 1 20 . 1 1 2 2 ILE HG23 H 1 0.961 0.01 . 1 . . . . 10 ILE HG2 . 7072 1 21 . 1 1 2 2 ILE HD11 H 1 0.921 0.01 . 1 . . . . 10 ILE HD1 . 7072 1 22 . 1 1 2 2 ILE HD12 H 1 0.921 0.01 . 1 . . . . 10 ILE HD1 . 7072 1 23 . 1 1 2 2 ILE HD13 H 1 0.921 0.01 . 1 . . . . 10 ILE HD1 . 7072 1 24 . 1 1 2 2 ILE C C 13 177.311 0.1 . 1 . . . . 10 ILE C . 7072 1 25 . 1 1 2 2 ILE CA C 13 62.248 0.1 . 1 . . . . 10 ILE CA . 7072 1 26 . 1 1 2 2 ILE CB C 13 38.326 0.1 . 1 . . . . 10 ILE CB . 7072 1 27 . 1 1 2 2 ILE CG1 C 13 28.78 0.1 . 1 . . . . 10 ILE CG1 . 7072 1 28 . 1 1 2 2 ILE CG2 C 13 18.112 0.1 . 1 . . . . 10 ILE CG2 . 7072 1 29 . 1 1 2 2 ILE CD1 C 13 13.569 0.1 . 1 . . . . 10 ILE CD1 . 7072 1 30 . 1 1 2 2 ILE N N 15 121.966 0.1 . 1 . . . . 10 ILE N . 7072 1 31 . 1 1 3 3 ARG H H 1 9.559 0.01 . 1 . . . . 11 ARG H . 7072 1 32 . 1 1 3 3 ARG HA H 1 4.869 0.01 . 1 . . . . 11 ARG HA . 7072 1 33 . 1 1 3 3 ARG HB2 H 1 1.663 0.01 . 1 . . . . 11 ARG HB2 . 7072 1 34 . 1 1 3 3 ARG HB3 H 1 1.898 0.01 . 1 . . . . 11 ARG HB3 . 7072 1 35 . 1 1 3 3 ARG HG2 H 1 1.687 0.01 . 1 . . . . 11 ARG HG2 . 7072 1 36 . 1 1 3 3 ARG HG3 H 1 1.687 0.01 . 1 . . . . 11 ARG HG3 . 7072 1 37 . 1 1 3 3 ARG HD2 H 1 3.359 0.01 . 1 . . . . 11 ARG HD2 . 7072 1 38 . 1 1 3 3 ARG HD3 H 1 3.294 0.01 . 1 . . . . 11 ARG HD3 . 7072 1 39 . 1 1 3 3 ARG C C 13 174.688 0.1 . 1 . . . . 11 ARG C . 7072 1 40 . 1 1 3 3 ARG CA C 13 54.9 0.1 . 1 . . . . 11 ARG CA . 7072 1 41 . 1 1 3 3 ARG CB C 13 31.329 0.1 . 1 . . . . 11 ARG CB . 7072 1 42 . 1 1 3 3 ARG CG C 13 26.682 0.1 . 1 . . . . 11 ARG CG . 7072 1 43 . 1 1 3 3 ARG CD C 13 44.141 0.1 . 1 . . . . 11 ARG CD . 7072 1 44 . 1 1 3 3 ARG N N 15 127.621 0.1 . 1 . . . . 11 ARG N . 7072 1 45 . 1 1 4 4 LYS H H 1 8.401 0.01 . 1 . . . . 12 LYS H . 7072 1 46 . 1 1 4 4 LYS HA H 1 5.559 0.01 . 1 . . . . 12 LYS HA . 7072 1 47 . 1 1 4 4 LYS HB2 H 1 1.719 0.01 . 1 . . . . 12 LYS HB2 . 7072 1 48 . 1 1 4 4 LYS HB3 H 1 1.852 0.01 . 1 . . . . 12 LYS HB3 . 7072 1 49 . 1 1 4 4 LYS HG2 H 1 1.56 0.01 . 1 . . . . 12 LYS HG2 . 7072 1 50 . 1 1 4 4 LYS HG3 H 1 1.342 0.01 . 1 . . . . 12 LYS HG3 . 7072 1 51 . 1 1 4 4 LYS HD2 H 1 1.732 0.01 . 1 . . . . 12 LYS HD2 . 7072 1 52 . 1 1 4 4 LYS HD3 H 1 1.732 0.01 . 1 . . . . 12 LYS HD3 . 7072 1 53 . 1 1 4 4 LYS C C 13 176.684 0.1 . 1 . . . . 12 LYS C . 7072 1 54 . 1 1 4 4 LYS CA C 13 54.96 0.1 . 1 . . . . 12 LYS CA . 7072 1 55 . 1 1 4 4 LYS CB C 13 33.734 0.1 . 1 . . . . 12 LYS CB . 7072 1 56 . 1 1 4 4 LYS CG C 13 25.519 0.1 . 1 . . . . 12 LYS CG . 7072 1 57 . 1 1 4 4 LYS CD C 13 29.224 0.1 . 1 . . . . 12 LYS CD . 7072 1 58 . 1 1 4 4 LYS CE C 13 41.817 0.1 . 1 . . . . 12 LYS CE . 7072 1 59 . 1 1 4 4 LYS N N 15 120.904 0.1 . 1 . . . . 12 LYS N . 7072 1 60 . 1 1 5 5 VAL H H 1 9.258 0.01 . 1 . . . . 13 VAL H . 7072 1 61 . 1 1 5 5 VAL HA H 1 4.379 0.01 . 1 . . . . 13 VAL HA . 7072 1 62 . 1 1 5 5 VAL HB H 1 1.905 0.01 . 1 . . . . 13 VAL HB . 7072 1 63 . 1 1 5 5 VAL HG11 H 1 0.919 0.01 . 1 . . . . 13 VAL HG1 . 7072 1 64 . 1 1 5 5 VAL HG12 H 1 0.919 0.01 . 1 . . . . 13 VAL HG1 . 7072 1 65 . 1 1 5 5 VAL HG13 H 1 0.919 0.01 . 1 . . . . 13 VAL HG1 . 7072 1 66 . 1 1 5 5 VAL HG21 H 1 0.919 0.01 . 1 . . . . 13 VAL HG2 . 7072 1 67 . 1 1 5 5 VAL HG22 H 1 0.919 0.01 . 1 . . . . 13 VAL HG2 . 7072 1 68 . 1 1 5 5 VAL HG23 H 1 0.919 0.01 . 1 . . . . 13 VAL HG2 . 7072 1 69 . 1 1 5 5 VAL C C 13 173.627 0.1 . 1 . . . . 13 VAL C . 7072 1 70 . 1 1 5 5 VAL CA C 13 61.391 0.1 . 1 . . . . 13 VAL CA . 7072 1 71 . 1 1 5 5 VAL CB C 13 36.239 0.1 . 1 . . . . 13 VAL CB . 7072 1 72 . 1 1 5 5 VAL CG1 C 13 21.377 0.1 . 1 . . . . 13 VAL CG1 . 7072 1 73 . 1 1 5 5 VAL CG2 C 13 21.377 0.1 . 1 . . . . 13 VAL CG2 . 7072 1 74 . 1 1 5 5 VAL N N 15 125.94 0.1 . 1 . . . . 13 VAL N . 7072 1 75 . 1 1 6 6 LEU H H 1 8.61 0.01 . 1 . . . . 14 LEU H . 7072 1 76 . 1 1 6 6 LEU HA H 1 5.228 0.01 . 1 . . . . 14 LEU HA . 7072 1 77 . 1 1 6 6 LEU HB2 H 1 1.659 0.01 . 1 . . . . 14 LEU HB2 . 7072 1 78 . 1 1 6 6 LEU HB3 H 1 1.659 0.01 . 1 . . . . 14 LEU HB3 . 7072 1 79 . 1 1 6 6 LEU HG H 1 1.571 0.01 . 1 . . . . 14 LEU HG . 7072 1 80 . 1 1 6 6 LEU HD11 H 1 0.943 0.01 . 1 . . . . 14 LEU HD1 . 7072 1 81 . 1 1 6 6 LEU HD12 H 1 0.943 0.01 . 1 . . . . 14 LEU HD1 . 7072 1 82 . 1 1 6 6 LEU HD13 H 1 0.943 0.01 . 1 . . . . 14 LEU HD1 . 7072 1 83 . 1 1 6 6 LEU HD21 H 1 0.943 0.01 . 1 . . . . 14 LEU HD2 . 7072 1 84 . 1 1 6 6 LEU HD22 H 1 0.943 0.01 . 1 . . . . 14 LEU HD2 . 7072 1 85 . 1 1 6 6 LEU HD23 H 1 0.943 0.01 . 1 . . . . 14 LEU HD2 . 7072 1 86 . 1 1 6 6 LEU C C 13 175.226 0.1 . 1 . . . . 14 LEU C . 7072 1 87 . 1 1 6 6 LEU CA C 13 53.932 0.1 . 1 . . . . 14 LEU CA . 7072 1 88 . 1 1 6 6 LEU CB C 13 43.782 0.1 . 1 . . . . 14 LEU CB . 7072 1 89 . 1 1 6 6 LEU CG C 13 27.63 0.1 . 1 . . . . 14 LEU CG . 7072 1 90 . 1 1 6 6 LEU CD1 C 13 24.449 0.1 . 1 . . . . 14 LEU CD1 . 7072 1 91 . 1 1 6 6 LEU CD2 C 13 24.449 0.1 . 1 . . . . 14 LEU CD2 . 7072 1 92 . 1 1 6 6 LEU N N 15 128.883 0.1 . 1 . . . . 14 LEU N . 7072 1 93 . 1 1 7 7 LEU H H 1 9.341 0.01 . 1 . . . . 15 LEU H . 7072 1 94 . 1 1 7 7 LEU HA H 1 4.645 0.01 . 1 . . . . 15 LEU HA . 7072 1 95 . 1 1 7 7 LEU HB2 H 1 1.667 0.01 . 1 . . . . 15 LEU HB2 . 7072 1 96 . 1 1 7 7 LEU HB3 H 1 1.874 0.01 . 1 . . . . 15 LEU HB3 . 7072 1 97 . 1 1 7 7 LEU HG H 1 1.672 0.01 . 1 . . . . 15 LEU HG . 7072 1 98 . 1 1 7 7 LEU HD11 H 1 0.82 0.01 . 1 . . . . 15 LEU HD1 . 7072 1 99 . 1 1 7 7 LEU HD12 H 1 0.82 0.01 . 1 . . . . 15 LEU HD1 . 7072 1 100 . 1 1 7 7 LEU HD13 H 1 0.82 0.01 . 1 . . . . 15 LEU HD1 . 7072 1 101 . 1 1 7 7 LEU HD21 H 1 0.82 0.01 . 1 . . . . 15 LEU HD2 . 7072 1 102 . 1 1 7 7 LEU HD22 H 1 0.82 0.01 . 1 . . . . 15 LEU HD2 . 7072 1 103 . 1 1 7 7 LEU HD23 H 1 0.82 0.01 . 1 . . . . 15 LEU HD2 . 7072 1 104 . 1 1 7 7 LEU C C 13 173.904 0.1 . 1 . . . . 15 LEU C . 7072 1 105 . 1 1 7 7 LEU CA C 13 54.593 0.1 . 1 . . . . 15 LEU CA . 7072 1 106 . 1 1 7 7 LEU CB C 13 45.517 0.1 . 1 . . . . 15 LEU CB . 7072 1 107 . 1 1 7 7 LEU CG C 13 26.516 0.1 . 1 . . . . 15 LEU CG . 7072 1 108 . 1 1 7 7 LEU CD1 C 13 28.404 0.1 . 1 . . . . 15 LEU CD1 . 7072 1 109 . 1 1 7 7 LEU CD2 C 13 26.654 0.1 . 1 . . . . 15 LEU CD2 . 7072 1 110 . 1 1 7 7 LEU N N 15 127.53 0.1 . 1 . . . . 15 LEU N . 7072 1 111 . 1 1 8 8 LEU H H 1 8.139 0.01 . 1 . . . . 16 LEU H . 7072 1 112 . 1 1 8 8 LEU HA H 1 5.049 0.01 . 1 . . . . 16 LEU HA . 7072 1 113 . 1 1 8 8 LEU HB2 H 1 1.623 0.01 . 1 . . . . 16 LEU HB2 . 7072 1 114 . 1 1 8 8 LEU HB3 H 1 1.671 0.01 . 1 . . . . 16 LEU HB3 . 7072 1 115 . 1 1 8 8 LEU HG H 1 1.573 0.01 . 1 . . . . 16 LEU HG . 7072 1 116 . 1 1 8 8 LEU HD11 H 1 0.803 0.01 . 1 . . . . 16 LEU HD1 . 7072 1 117 . 1 1 8 8 LEU HD12 H 1 0.803 0.01 . 1 . . . . 16 LEU HD1 . 7072 1 118 . 1 1 8 8 LEU HD13 H 1 0.803 0.01 . 1 . . . . 16 LEU HD1 . 7072 1 119 . 1 1 8 8 LEU HD21 H 1 0.948 0.01 . 1 . . . . 16 LEU HD2 . 7072 1 120 . 1 1 8 8 LEU HD22 H 1 0.948 0.01 . 1 . . . . 16 LEU HD2 . 7072 1 121 . 1 1 8 8 LEU HD23 H 1 0.948 0.01 . 1 . . . . 16 LEU HD2 . 7072 1 122 . 1 1 8 8 LEU C C 13 175.332 0.1 . 1 . . . . 16 LEU C . 7072 1 123 . 1 1 8 8 LEU CA C 13 53.997 0.1 . 1 . . . . 16 LEU CA . 7072 1 124 . 1 1 8 8 LEU CB C 13 43.565 0.1 . 1 . . . . 16 LEU CB . 7072 1 125 . 1 1 8 8 LEU CG C 13 27.751 0.1 . 1 . . . . 16 LEU CG . 7072 1 126 . 1 1 8 8 LEU CD1 C 13 24.468 0.1 . 1 . . . . 16 LEU CD1 . 7072 1 127 . 1 1 8 8 LEU CD2 C 13 24.468 0.1 . 1 . . . . 16 LEU CD2 . 7072 1 128 . 1 1 8 8 LEU N N 15 125.634 0.1 . 1 . . . . 16 LEU N . 7072 1 129 . 1 1 9 9 LYS H H 1 8.517 0.01 . 1 . . . . 17 LYS H . 7072 1 130 . 1 1 9 9 LYS HA H 1 4.72 0.01 . 1 . . . . 17 LYS HA . 7072 1 131 . 1 1 9 9 LYS HB2 H 1 1.731 0.01 . 1 . . . . 17 LYS HB2 . 7072 1 132 . 1 1 9 9 LYS HB3 H 1 1.731 0.01 . 1 . . . . 17 LYS HB3 . 7072 1 133 . 1 1 9 9 LYS HG2 H 1 1.473 0.01 . 1 . . . . 17 LYS HG2 . 7072 1 134 . 1 1 9 9 LYS HG3 H 1 1.331 0.01 . 1 . . . . 17 LYS HG3 . 7072 1 135 . 1 1 9 9 LYS HD2 H 1 1.587 0.01 . 1 . . . . 17 LYS HD2 . 7072 1 136 . 1 1 9 9 LYS HD3 H 1 1.496 0.01 . 1 . . . . 17 LYS HD3 . 7072 1 137 . 1 1 9 9 LYS HE2 H 1 3.193 0.01 . 1 . . . . 17 LYS HE2 . 7072 1 138 . 1 1 9 9 LYS HE3 H 1 3.074 0.01 . 1 . . . . 17 LYS HE3 . 7072 1 139 . 1 1 9 9 LYS C C 13 176.44 0.1 . 1 . . . . 17 LYS C . 7072 1 140 . 1 1 9 9 LYS CA C 13 54.488 0.1 . 1 . . . . 17 LYS CA . 7072 1 141 . 1 1 9 9 LYS CB C 13 35.955 0.1 . 1 . . . . 17 LYS CB . 7072 1 142 . 1 1 9 9 LYS CG C 13 22.029 0.1 . 1 . . . . 17 LYS CG . 7072 1 143 . 1 1 9 9 LYS CD C 13 29.593 0.1 . 1 . . . . 17 LYS CD . 7072 1 144 . 1 1 9 9 LYS CE C 13 41.776 0.1 . 1 . . . . 17 LYS CE . 7072 1 145 . 1 1 9 9 LYS N N 15 123.914 0.1 . 1 . . . . 17 LYS N . 7072 1 146 . 1 1 10 10 GLU H H 1 9.703 0.01 . 1 . . . . 18 GLU H . 7072 1 147 . 1 1 10 10 GLU HA H 1 4.653 0.01 . 1 . . . . 18 GLU HA . 7072 1 148 . 1 1 10 10 GLU HB2 H 1 2.312 0.01 . 1 . . . . 18 GLU HB2 . 7072 1 149 . 1 1 10 10 GLU HB3 H 1 1.614 0.01 . 1 . . . . 18 GLU HB3 . 7072 1 150 . 1 1 10 10 GLU HG2 H 1 2.465 0.01 . 1 . . . . 18 GLU HG2 . 7072 1 151 . 1 1 10 10 GLU HG3 H 1 2.322 0.01 . 1 . . . . 18 GLU HG3 . 7072 1 152 . 1 1 10 10 GLU C C 13 179.401 0.1 . 1 . . . . 18 GLU C . 7072 1 153 . 1 1 10 10 GLU CA C 13 55.918 0.1 . 1 . . . . 18 GLU CA . 7072 1 154 . 1 1 10 10 GLU CB C 13 30.892 0.1 . 1 . . . . 18 GLU CB . 7072 1 155 . 1 1 10 10 GLU CG C 13 36.6 0.1 . 1 . . . . 18 GLU CG . 7072 1 156 . 1 1 10 10 GLU N N 15 126.102 0.1 . 1 . . . . 18 GLU N . 7072 1 157 . 1 1 11 11 ASP H H 1 9.396 0.01 . 1 . . . . 19 ASP H . 7072 1 158 . 1 1 11 11 ASP HA H 1 4.412 0.01 . 1 . . . . 19 ASP HA . 7072 1 159 . 1 1 11 11 ASP HB2 H 1 2.845 0.01 . 1 . . . . 19 ASP HB2 . 7072 1 160 . 1 1 11 11 ASP HB3 H 1 2.845 0.01 . 1 . . . . 19 ASP HB3 . 7072 1 161 . 1 1 11 11 ASP C C 13 176.747 0.1 . 1 . . . . 19 ASP C . 7072 1 162 . 1 1 11 11 ASP CA C 13 58.007 0.1 . 1 . . . . 19 ASP CA . 7072 1 163 . 1 1 11 11 ASP CB C 13 40.378 0.1 . 1 . . . . 19 ASP CB . 7072 1 164 . 1 1 11 11 ASP N N 15 122.065 0.1 . 1 . . . . 19 ASP N . 7072 1 165 . 1 1 12 12 HIS H H 1 7.827 0.01 . 1 . . . . 20 HIS H . 7072 1 166 . 1 1 12 12 HIS HA H 1 4.729 0.01 . 1 . . . . 20 HIS HA . 7072 1 167 . 1 1 12 12 HIS HB2 H 1 3.465 0.01 . 1 . . . . 20 HIS HB2 . 7072 1 168 . 1 1 12 12 HIS HB3 H 1 3.062 0.01 . 1 . . . . 20 HIS HB3 . 7072 1 169 . 1 1 12 12 HIS HD2 H 1 7.914 0.01 . 1 . . . . 20 HIS HD2 . 7072 1 170 . 1 1 12 12 HIS HE1 H 1 7.101 0.01 . 1 . . . . 20 HIS HE1 . 7072 1 171 . 1 1 12 12 HIS C C 13 175.028 0.1 . 1 . . . . 20 HIS C . 7072 1 172 . 1 1 12 12 HIS CA C 13 56.365 0.1 . 1 . . . . 20 HIS CA . 7072 1 173 . 1 1 12 12 HIS CB C 13 30.379 0.1 . 1 . . . . 20 HIS CB . 7072 1 174 . 1 1 12 12 HIS N N 15 112.418 0.1 . 1 . . . . 20 HIS N . 7072 1 175 . 1 1 13 13 GLU H H 1 7.317 0.01 . 1 . . . . 21 GLU H . 7072 1 176 . 1 1 13 13 GLU HA H 1 4.591 0.01 . 1 . . . . 21 GLU HA . 7072 1 177 . 1 1 13 13 GLU HB2 H 1 2.155 0.01 . 1 . . . . 21 GLU HB2 . 7072 1 178 . 1 1 13 13 GLU HG2 H 1 1.797 0.01 . 1 . . . . 21 GLU HG2 . 7072 1 179 . 1 1 13 13 GLU HG3 H 1 2.056 0.01 . 1 . . . . 21 GLU HG3 . 7072 1 180 . 1 1 13 13 GLU C C 13 176.608 0.1 . 1 . . . . 21 GLU C . 7072 1 181 . 1 1 13 13 GLU CA C 13 55.121 0.1 . 1 . . . . 21 GLU CA . 7072 1 182 . 1 1 13 13 GLU CB C 13 32.818 0.1 . 1 . . . . 21 GLU CB . 7072 1 183 . 1 1 13 13 GLU CG C 13 36.842 0.1 . 1 . . . . 21 GLU CG . 7072 1 184 . 1 1 13 13 GLU N N 15 120.493 0.1 . 1 . . . . 21 GLU N . 7072 1 185 . 1 1 14 14 GLY H H 1 8.471 0.01 . 1 . . . . 22 GLY H . 7072 1 186 . 1 1 14 14 GLY HA2 H 1 4.592 0.01 . 1 . . . . 22 GLY HA2 . 7072 1 187 . 1 1 14 14 GLY HA3 H 1 3.884 0.01 . 1 . . . . 22 GLY HA3 . 7072 1 188 . 1 1 14 14 GLY C C 13 173.269 0.1 . 1 . . . . 22 GLY C . 7072 1 189 . 1 1 14 14 GLY CA C 13 43.863 0.1 . 1 . . . . 22 GLY CA . 7072 1 190 . 1 1 14 14 GLY N N 15 108.843 0.1 . 1 . . . . 22 GLY N . 7072 1 191 . 1 1 15 15 LEU H H 1 8.322 0.01 . 1 . . . . 23 LEU H . 7072 1 192 . 1 1 15 15 LEU HA H 1 4.052 0.01 . 1 . . . . 23 LEU HA . 7072 1 193 . 1 1 15 15 LEU HB2 H 1 1.922 0.01 . 1 . . . . 23 LEU HB2 . 7072 1 194 . 1 1 15 15 LEU HB3 H 1 1.486 0.01 . 1 . . . . 23 LEU HB3 . 7072 1 195 . 1 1 15 15 LEU HG H 1 1.92 0.01 . 1 . . . . 23 LEU HG . 7072 1 196 . 1 1 15 15 LEU HD11 H 1 1.032 0.01 . 1 . . . . 23 LEU HD1 . 7072 1 197 . 1 1 15 15 LEU HD12 H 1 1.032 0.01 . 1 . . . . 23 LEU HD1 . 7072 1 198 . 1 1 15 15 LEU HD13 H 1 1.032 0.01 . 1 . . . . 23 LEU HD1 . 7072 1 199 . 1 1 15 15 LEU HD21 H 1 1.131 0.01 . 1 . . . . 23 LEU HD2 . 7072 1 200 . 1 1 15 15 LEU HD22 H 1 1.131 0.01 . 1 . . . . 23 LEU HD2 . 7072 1 201 . 1 1 15 15 LEU HD23 H 1 1.131 0.01 . 1 . . . . 23 LEU HD2 . 7072 1 202 . 1 1 15 15 LEU C C 13 177.986 0.1 . 1 . . . . 23 LEU C . 7072 1 203 . 1 1 15 15 LEU CA C 13 57.239 0.1 . 1 . . . . 23 LEU CA . 7072 1 204 . 1 1 15 15 LEU CB C 13 43.875 0.1 . 1 . . . . 23 LEU CB . 7072 1 205 . 1 1 15 15 LEU CG C 13 27.307 0.1 . 1 . . . . 23 LEU CG . 7072 1 206 . 1 1 15 15 LEU CD1 C 13 25.161 0.1 . 1 . . . . 23 LEU CD1 . 7072 1 207 . 1 1 15 15 LEU CD2 C 13 26.641 0.1 . 1 . . . . 23 LEU CD2 . 7072 1 208 . 1 1 15 15 LEU N N 15 115.011 0.1 . 1 . . . . 23 LEU N . 7072 1 209 . 1 1 16 16 GLY H H 1 8.61 0.01 . 1 . . . . 24 GLY H . 7072 1 210 . 1 1 16 16 GLY HA2 H 1 4.397 0.01 . 1 . . . . 24 GLY HA2 . 7072 1 211 . 1 1 16 16 GLY HA3 H 1 4.009 0.01 . 1 . . . . 24 GLY HA3 . 7072 1 212 . 1 1 16 16 GLY C C 13 175.826 0.1 . 1 . . . . 24 GLY C . 7072 1 213 . 1 1 16 16 GLY CA C 13 46.243 0.1 . 1 . . . . 24 GLY CA . 7072 1 214 . 1 1 16 16 GLY N N 15 101.513 0.1 . 1 . . . . 24 GLY N . 7072 1 215 . 1 1 17 17 ILE H H 1 7.274 0.01 . 1 . . . . 25 ILE H . 7072 1 216 . 1 1 17 17 ILE HA H 1 5.158 0.01 . 1 . . . . 25 ILE HA . 7072 1 217 . 1 1 17 17 ILE HB H 1 1.884 0.01 . 1 . . . . 25 ILE HB . 7072 1 218 . 1 1 17 17 ILE HG12 H 1 1.368 0.01 . 1 . . . . 25 ILE HG12 . 7072 1 219 . 1 1 17 17 ILE HG13 H 1 0.815 0.01 . 1 . . . . 25 ILE HG13 . 7072 1 220 . 1 1 17 17 ILE HG21 H 1 0.738 0.01 . 1 . . . . 25 ILE HG2 . 7072 1 221 . 1 1 17 17 ILE HG22 H 1 0.738 0.01 . 1 . . . . 25 ILE HG2 . 7072 1 222 . 1 1 17 17 ILE HG23 H 1 0.738 0.01 . 1 . . . . 25 ILE HG2 . 7072 1 223 . 1 1 17 17 ILE HD11 H 1 0.689 0.01 . 1 . . . . 25 ILE HD1 . 7072 1 224 . 1 1 17 17 ILE HD12 H 1 0.689 0.01 . 1 . . . . 25 ILE HD1 . 7072 1 225 . 1 1 17 17 ILE HD13 H 1 0.689 0.01 . 1 . . . . 25 ILE HD1 . 7072 1 226 . 1 1 17 17 ILE C C 13 175.464 0.1 . 1 . . . . 25 ILE C . 7072 1 227 . 1 1 17 17 ILE CA C 13 58.983 0.1 . 1 . . . . 25 ILE CA . 7072 1 228 . 1 1 17 17 ILE CB C 13 42.284 0.1 . 1 . . . . 25 ILE CB . 7072 1 229 . 1 1 17 17 ILE CG1 C 13 25.487 0.1 . 1 . . . . 25 ILE CG1 . 7072 1 230 . 1 1 17 17 ILE CG2 C 13 18.537 0.1 . 1 . . . . 25 ILE CG2 . 7072 1 231 . 1 1 17 17 ILE CD1 C 13 13.702 0.1 . 1 . . . . 25 ILE CD1 . 7072 1 232 . 1 1 17 17 ILE N N 15 112.588 0.1 . 1 . . . . 25 ILE N . 7072 1 233 . 1 1 18 18 SER H H 1 8.331 0.01 . 1 . . . . 26 SER H . 7072 1 234 . 1 1 18 18 SER HA H 1 5.097 0.01 . 1 . . . . 26 SER HA . 7072 1 235 . 1 1 18 18 SER HB2 H 1 4.033 0.01 . 1 . . . . 26 SER HB2 . 7072 1 236 . 1 1 18 18 SER HB3 H 1 3.775 0.01 . 1 . . . . 26 SER HB3 . 7072 1 237 . 1 1 18 18 SER C C 13 173.459 0.1 . 1 . . . . 26 SER C . 7072 1 238 . 1 1 18 18 SER CA C 13 57.486 0.1 . 1 . . . . 26 SER CA . 7072 1 239 . 1 1 18 18 SER CB C 13 64.59 0.1 . 1 . . . . 26 SER CB . 7072 1 240 . 1 1 18 18 SER N N 15 118.137 0.1 . 1 . . . . 26 SER N . 7072 1 241 . 1 1 19 19 ILE H H 1 8.791 0.01 . 1 . . . . 27 ILE H . 7072 1 242 . 1 1 19 19 ILE HA H 1 5.806 0.01 . 1 . . . . 27 ILE HA . 7072 1 243 . 1 1 19 19 ILE HB H 1 1.977 0.01 . 1 . . . . 27 ILE HB . 7072 1 244 . 1 1 19 19 ILE HG12 H 1 1.515 0.01 . 1 . . . . 27 ILE HG12 . 7072 1 245 . 1 1 19 19 ILE HG13 H 1 1.034 0.01 . 1 . . . . 27 ILE HG13 . 7072 1 246 . 1 1 19 19 ILE HG21 H 1 0.746 0.01 . 1 . . . . 27 ILE HG2 . 7072 1 247 . 1 1 19 19 ILE HG22 H 1 0.746 0.01 . 1 . . . . 27 ILE HG2 . 7072 1 248 . 1 1 19 19 ILE HG23 H 1 0.746 0.01 . 1 . . . . 27 ILE HG2 . 7072 1 249 . 1 1 19 19 ILE HD11 H 1 0.632 0.01 . 1 . . . . 27 ILE HD1 . 7072 1 250 . 1 1 19 19 ILE HD12 H 1 0.632 0.01 . 1 . . . . 27 ILE HD1 . 7072 1 251 . 1 1 19 19 ILE HD13 H 1 0.632 0.01 . 1 . . . . 27 ILE HD1 . 7072 1 252 . 1 1 19 19 ILE C C 13 175.993 0.1 . 1 . . . . 27 ILE C . 7072 1 253 . 1 1 19 19 ILE CA C 13 58.837 0.1 . 1 . . . . 27 ILE CA . 7072 1 254 . 1 1 19 19 ILE CB C 13 42.947 0.1 . 1 . . . . 27 ILE CB . 7072 1 255 . 1 1 19 19 ILE CG1 C 13 25.386 0.1 . 1 . . . . 27 ILE CG1 . 7072 1 256 . 1 1 19 19 ILE CG2 C 13 18.971 0.1 . 1 . . . . 27 ILE CG2 . 7072 1 257 . 1 1 19 19 ILE CD1 C 13 14.865 0.1 . 1 . . . . 27 ILE CD1 . 7072 1 258 . 1 1 19 19 ILE N N 15 116.517 0.1 . 1 . . . . 27 ILE N . 7072 1 259 . 1 1 20 20 THR H H 1 9.412 0.01 . 1 . . . . 28 THR H . 7072 1 260 . 1 1 20 20 THR HA H 1 4.772 0.01 . 1 . . . . 28 THR HA . 7072 1 261 . 1 1 20 20 THR HB H 1 4.146 0.01 . 1 . . . . 28 THR HB . 7072 1 262 . 1 1 20 20 THR HG21 H 1 1.167 0.01 . 1 . . . . 28 THR HG2 . 7072 1 263 . 1 1 20 20 THR HG22 H 1 1.167 0.01 . 1 . . . . 28 THR HG2 . 7072 1 264 . 1 1 20 20 THR HG23 H 1 1.167 0.01 . 1 . . . . 28 THR HG2 . 7072 1 265 . 1 1 20 20 THR C C 13 172.814 0.1 . 1 . . . . 28 THR C . 7072 1 266 . 1 1 20 20 THR CA C 13 59.42 0.1 . 1 . . . . 28 THR CA . 7072 1 267 . 1 1 20 20 THR CB C 13 70.923 0.1 . 1 . . . . 28 THR CB . 7072 1 268 . 1 1 20 20 THR CG2 C 13 20.176 0.1 . 1 . . . . 28 THR CG2 . 7072 1 269 . 1 1 20 20 THR N N 15 116.798 0.1 . 1 . . . . 28 THR N . 7072 1 270 . 1 1 21 21 GLY H H 1 8.253 0.01 . 1 . . . . 29 GLY H . 7072 1 271 . 1 1 21 21 GLY HA2 H 1 4.914 0.01 . 1 . . . . 29 GLY HA2 . 7072 1 272 . 1 1 21 21 GLY HA3 H 1 3.553 0.01 . 1 . . . . 29 GLY HA3 . 7072 1 273 . 1 1 21 21 GLY C C 13 173.889 0.1 . 1 . . . . 29 GLY C . 7072 1 274 . 1 1 21 21 GLY CA C 13 45.072 0.1 . 1 . . . . 29 GLY CA . 7072 1 275 . 1 1 21 21 GLY N N 15 108.277 0.1 . 1 . . . . 29 GLY N . 7072 1 276 . 1 1 22 22 GLY H H 1 7.28 0.01 . 1 . . . . 30 GLY H . 7072 1 277 . 1 1 22 22 GLY HA2 H 1 4.935 0.01 . 1 . . . . 30 GLY HA2 . 7072 1 278 . 1 1 22 22 GLY HA3 H 1 3.938 0.01 . 1 . . . . 30 GLY HA3 . 7072 1 279 . 1 1 22 22 GLY C C 13 175.991 0.1 . 1 . . . . 30 GLY C . 7072 1 280 . 1 1 22 22 GLY CA C 13 44.108 0.1 . 1 . . . . 30 GLY CA . 7072 1 281 . 1 1 22 22 GLY N N 15 107.259 0.1 . 1 . . . . 30 GLY N . 7072 1 282 . 1 1 23 23 LYS H H 1 8.195 0.01 . 1 . . . . 31 LYS H . 7072 1 283 . 1 1 23 23 LYS HA H 1 4.154 0.01 . 1 . . . . 31 LYS HA . 7072 1 284 . 1 1 23 23 LYS HB2 H 1 1.691 0.01 . 1 . . . . 31 LYS HB2 . 7072 1 285 . 1 1 23 23 LYS HB3 H 1 1.503 0.01 . 1 . . . . 31 LYS HB3 . 7072 1 286 . 1 1 23 23 LYS HG2 H 1 1.519 0.01 . 1 . . . . 31 LYS HG2 . 7072 1 287 . 1 1 23 23 LYS HG3 H 1 1.43 0.01 . 1 . . . . 31 LYS HG3 . 7072 1 288 . 1 1 23 23 LYS HD2 H 1 1.776 0.01 . 1 . . . . 31 LYS HD2 . 7072 1 289 . 1 1 23 23 LYS HD3 H 1 1.776 0.01 . 1 . . . . 31 LYS HD3 . 7072 1 290 . 1 1 23 23 LYS HE2 H 1 3.071 0.01 . 1 . . . . 31 LYS HE2 . 7072 1 291 . 1 1 23 23 LYS HE3 H 1 3.034 0.01 . 1 . . . . 31 LYS HE3 . 7072 1 292 . 1 1 23 23 LYS C C 13 179.036 0.1 . 1 . . . . 31 LYS C . 7072 1 293 . 1 1 23 23 LYS CA C 13 59.502 0.1 . 1 . . . . 31 LYS CA . 7072 1 294 . 1 1 23 23 LYS CB C 13 33.386 0.1 . 1 . . . . 31 LYS CB . 7072 1 295 . 1 1 23 23 LYS CG C 13 24.839 0.1 . 1 . . . . 31 LYS CG . 7072 1 296 . 1 1 23 23 LYS CD C 13 29.17 0.1 . 1 . . . . 31 LYS CD . 7072 1 297 . 1 1 23 23 LYS CE C 13 41.934 0.1 . 1 . . . . 31 LYS CE . 7072 1 298 . 1 1 23 23 LYS N N 15 120.844 0.1 . 1 . . . . 31 LYS N . 7072 1 299 . 1 1 24 24 GLU H H 1 10.945 0.01 . 1 . . . . 32 GLU H . 7072 1 300 . 1 1 24 24 GLU HA H 1 4.27 0.01 . 1 . . . . 32 GLU HA . 7072 1 301 . 1 1 24 24 GLU HB2 H 1 1.925 0.01 . 1 . . . . 32 GLU HB2 . 7072 1 302 . 1 1 24 24 GLU HB3 H 1 1.656 0.01 . 1 . . . . 32 GLU HB3 . 7072 1 303 . 1 1 24 24 GLU HG2 H 1 2.208 0.01 . 1 . . . . 32 GLU HG2 . 7072 1 304 . 1 1 24 24 GLU HG3 H 1 2.166 0.01 . 1 . . . . 32 GLU HG3 . 7072 1 305 . 1 1 24 24 GLU C C 13 176.78 0.1 . 1 . . . . 32 GLU C . 7072 1 306 . 1 1 24 24 GLU CA C 13 59.165 0.1 . 1 . . . . 32 GLU CA . 7072 1 307 . 1 1 24 24 GLU CB C 13 28.153 0.1 . 1 . . . . 32 GLU CB . 7072 1 308 . 1 1 24 24 GLU CG C 13 36.172 0.1 . 1 . . . . 32 GLU CG . 7072 1 309 . 1 1 24 24 GLU N N 15 121.228 0.1 . 1 . . . . 32 GLU N . 7072 1 310 . 1 1 25 25 HIS H H 1 8.18 0.01 . 1 . . . . 33 HIS H . 7072 1 311 . 1 1 25 25 HIS HA H 1 4.94 0.01 . 1 . . . . 33 HIS HA . 7072 1 312 . 1 1 25 25 HIS HB2 H 1 3.504 0.01 . 1 . . . . 33 HIS HB2 . 7072 1 313 . 1 1 25 25 HIS HB3 H 1 2.972 0.01 . 1 . . . . 33 HIS HB3 . 7072 1 314 . 1 1 25 25 HIS HD2 H 1 6.848 0.01 . 1 . . . . 33 HIS HD2 . 7072 1 315 . 1 1 25 25 HIS C C 13 175.981 0.1 . 1 . . . . 33 HIS C . 7072 1 316 . 1 1 25 25 HIS CA C 13 55.527 0.1 . 1 . . . . 33 HIS CA . 7072 1 317 . 1 1 25 25 HIS CB C 13 32.621 0.1 . 1 . . . . 33 HIS CB . 7072 1 318 . 1 1 25 25 HIS N N 15 118.397 0.1 . 1 . . . . 33 HIS N . 7072 1 319 . 1 1 26 26 GLY H H 1 8.06 0.01 . 1 . . . . 34 GLY H . 7072 1 320 . 1 1 26 26 GLY HA2 H 1 4.177 0.01 . 1 . . . . 34 GLY HA2 . 7072 1 321 . 1 1 26 26 GLY HA3 H 1 4.006 0.01 . 1 . . . . 34 GLY HA3 . 7072 1 322 . 1 1 26 26 GLY C C 13 173.69 0.1 . 1 . . . . 34 GLY C . 7072 1 323 . 1 1 26 26 GLY CA C 13 46.09 0.1 . 1 . . . . 34 GLY CA . 7072 1 324 . 1 1 26 26 GLY N N 15 107.695 0.1 . 1 . . . . 34 GLY N . 7072 1 325 . 1 1 27 27 VAL H H 1 7.29 0.01 . 1 . . . . 35 VAL H . 7072 1 326 . 1 1 27 27 VAL HA H 1 4.992 0.01 . 1 . . . . 35 VAL HA . 7072 1 327 . 1 1 27 27 VAL HB H 1 2.284 0.01 . 1 . . . . 35 VAL HB . 7072 1 328 . 1 1 27 27 VAL HG11 H 1 1.074 0.01 . 1 . . . . 35 VAL HG1 . 7072 1 329 . 1 1 27 27 VAL HG12 H 1 1.074 0.01 . 1 . . . . 35 VAL HG1 . 7072 1 330 . 1 1 27 27 VAL HG13 H 1 1.074 0.01 . 1 . . . . 35 VAL HG1 . 7072 1 331 . 1 1 27 27 VAL HG21 H 1 1.03 0.01 . 1 . . . . 35 VAL HG2 . 7072 1 332 . 1 1 27 27 VAL HG22 H 1 1.03 0.01 . 1 . . . . 35 VAL HG2 . 7072 1 333 . 1 1 27 27 VAL HG23 H 1 1.03 0.01 . 1 . . . . 35 VAL HG2 . 7072 1 334 . 1 1 27 27 VAL C C 13 175.827 0.1 . 1 . . . . 35 VAL C . 7072 1 335 . 1 1 27 27 VAL CA C 13 58.957 0.1 . 1 . . . . 35 VAL CA . 7072 1 336 . 1 1 27 27 VAL CB C 13 34.416 0.1 . 1 . . . . 35 VAL CB . 7072 1 337 . 1 1 27 27 VAL CG1 C 13 22.081 0.1 . 1 . . . . 35 VAL CG1 . 7072 1 338 . 1 1 27 27 VAL CG2 C 13 20.259 0.1 . 1 . . . . 35 VAL CG2 . 7072 1 339 . 1 1 27 27 VAL N N 15 112.381 0.1 . 1 . . . . 35 VAL N . 7072 1 340 . 1 1 28 28 PRO HA H 1 4.662 0.01 . 1 . . . . 36 PRO HA . 7072 1 341 . 1 1 28 28 PRO HB2 H 1 2.494 0.01 . 1 . . . . 36 PRO HB2 . 7072 1 342 . 1 1 28 28 PRO HB3 H 1 1.78 0.01 . 1 . . . . 36 PRO HB3 . 7072 1 343 . 1 1 28 28 PRO HG2 H 1 2.012 0.01 . 1 . . . . 36 PRO HG2 . 7072 1 344 . 1 1 28 28 PRO HG3 H 1 1.814 0.01 . 1 . . . . 36 PRO HG3 . 7072 1 345 . 1 1 28 28 PRO HD2 H 1 3.864 0.01 . 1 . . . . 36 PRO HD2 . 7072 1 346 . 1 1 28 28 PRO HD3 H 1 3.514 0.01 . 1 . . . . 36 PRO HD3 . 7072 1 347 . 1 1 28 28 PRO C C 13 174.477 0.1 . 1 . . . . 36 PRO C . 7072 1 348 . 1 1 28 28 PRO CA C 13 62.396 0.1 . 1 . . . . 36 PRO CA . 7072 1 349 . 1 1 28 28 PRO CB C 13 32.806 0.1 . 1 . . . . 36 PRO CB . 7072 1 350 . 1 1 28 28 PRO CG C 13 27.263 0.1 . 1 . . . . 36 PRO CG . 7072 1 351 . 1 1 28 28 PRO CD C 13 50.957 0.1 . 1 . . . . 36 PRO CD . 7072 1 352 . 1 1 29 29 ILE H H 1 8.298 0.01 . 1 . . . . 37 ILE H . 7072 1 353 . 1 1 29 29 ILE HA H 1 4.416 0.01 . 1 . . . . 37 ILE HA . 7072 1 354 . 1 1 29 29 ILE HB H 1 2.407 0.01 . 1 . . . . 37 ILE HB . 7072 1 355 . 1 1 29 29 ILE HG12 H 1 2.012 0.01 . 1 . . . . 37 ILE HG12 . 7072 1 356 . 1 1 29 29 ILE HG13 H 1 1.325 0.01 . 1 . . . . 37 ILE HG13 . 7072 1 357 . 1 1 29 29 ILE HG21 H 1 0.878 0.01 . 1 . . . . 37 ILE HG2 . 7072 1 358 . 1 1 29 29 ILE HG22 H 1 0.878 0.01 . 1 . . . . 37 ILE HG2 . 7072 1 359 . 1 1 29 29 ILE HG23 H 1 0.878 0.01 . 1 . . . . 37 ILE HG2 . 7072 1 360 . 1 1 29 29 ILE HD11 H 1 0.69 0.01 . 1 . . . . 37 ILE HD1 . 7072 1 361 . 1 1 29 29 ILE HD12 H 1 0.69 0.01 . 1 . . . . 37 ILE HD1 . 7072 1 362 . 1 1 29 29 ILE HD13 H 1 0.69 0.01 . 1 . . . . 37 ILE HD1 . 7072 1 363 . 1 1 29 29 ILE C C 13 175.268 0.1 . 1 . . . . 37 ILE C . 7072 1 364 . 1 1 29 29 ILE CA C 13 59.215 0.1 . 1 . . . . 37 ILE CA . 7072 1 365 . 1 1 29 29 ILE CB C 13 34.514 0.1 . 1 . . . . 37 ILE CB . 7072 1 366 . 1 1 29 29 ILE CG1 C 13 26.311 0.1 . 1 . . . . 37 ILE CG1 . 7072 1 367 . 1 1 29 29 ILE CG2 C 13 18.533 0.1 . 1 . . . . 37 ILE CG2 . 7072 1 368 . 1 1 29 29 ILE CD1 C 13 9.554 0.1 . 1 . . . . 37 ILE CD1 . 7072 1 369 . 1 1 29 29 ILE N N 15 118.21 0.1 . 1 . . . . 37 ILE N . 7072 1 370 . 1 1 30 30 LEU H H 1 8.587 0.01 . 1 . . . . 38 LEU H . 7072 1 371 . 1 1 30 30 LEU HA H 1 5.292 0.01 . 1 . . . . 38 LEU HA . 7072 1 372 . 1 1 30 30 LEU HB2 H 1 1.504 0.01 . 1 . . . . 38 LEU HB2 . 7072 1 373 . 1 1 30 30 LEU HB3 H 1 1.125 0.01 . 1 . . . . 38 LEU HB3 . 7072 1 374 . 1 1 30 30 LEU HG H 1 1.695 0.01 . 1 . . . . 38 LEU HG . 7072 1 375 . 1 1 30 30 LEU HD11 H 1 0.782 0.01 . 1 . . . . 38 LEU HD1 . 7072 1 376 . 1 1 30 30 LEU HD12 H 1 0.782 0.01 . 1 . . . . 38 LEU HD1 . 7072 1 377 . 1 1 30 30 LEU HD13 H 1 0.782 0.01 . 1 . . . . 38 LEU HD1 . 7072 1 378 . 1 1 30 30 LEU HD21 H 1 0.709 0.01 . 1 . . . . 38 LEU HD2 . 7072 1 379 . 1 1 30 30 LEU HD22 H 1 0.709 0.01 . 1 . . . . 38 LEU HD2 . 7072 1 380 . 1 1 30 30 LEU HD23 H 1 0.709 0.01 . 1 . . . . 38 LEU HD2 . 7072 1 381 . 1 1 30 30 LEU C C 13 177.32 0.1 . 1 . . . . 38 LEU C . 7072 1 382 . 1 1 30 30 LEU CA C 13 52.936 0.1 . 1 . . . . 38 LEU CA . 7072 1 383 . 1 1 30 30 LEU CB C 13 45.871 0.1 . 1 . . . . 38 LEU CB . 7072 1 384 . 1 1 30 30 LEU CG C 13 27.767 0.1 . 1 . . . . 38 LEU CG . 7072 1 385 . 1 1 30 30 LEU CD1 C 13 26.178 0.1 . 1 . . . . 38 LEU CD1 . 7072 1 386 . 1 1 30 30 LEU CD2 C 13 24.549 0.1 . 1 . . . . 38 LEU CD2 . 7072 1 387 . 1 1 30 30 LEU N N 15 128.863 0.1 . 1 . . . . 38 LEU N . 7072 1 388 . 1 1 31 31 ILE H H 1 9.025 0.01 . 1 . . . . 39 ILE H . 7072 1 389 . 1 1 31 31 ILE HA H 1 4.311 0.01 . 1 . . . . 39 ILE HA . 7072 1 390 . 1 1 31 31 ILE HB H 1 2.291 0.01 . 1 . . . . 39 ILE HB . 7072 1 391 . 1 1 31 31 ILE HG12 H 1 1.963 0.01 . 1 . . . . 39 ILE HG12 . 7072 1 392 . 1 1 31 31 ILE HG13 H 1 1.963 0.01 . 1 . . . . 39 ILE HG13 . 7072 1 393 . 1 1 31 31 ILE HG21 H 1 0.849 0.01 . 1 . . . . 39 ILE HG2 . 7072 1 394 . 1 1 31 31 ILE HG22 H 1 0.849 0.01 . 1 . . . . 39 ILE HG2 . 7072 1 395 . 1 1 31 31 ILE HG23 H 1 0.849 0.01 . 1 . . . . 39 ILE HG2 . 7072 1 396 . 1 1 31 31 ILE HD11 H 1 0.87 0.01 . 1 . . . . 39 ILE HD1 . 7072 1 397 . 1 1 31 31 ILE HD12 H 1 0.87 0.01 . 1 . . . . 39 ILE HD1 . 7072 1 398 . 1 1 31 31 ILE HD13 H 1 0.87 0.01 . 1 . . . . 39 ILE HD1 . 7072 1 399 . 1 1 31 31 ILE C C 13 176.199 0.1 . 1 . . . . 39 ILE C . 7072 1 400 . 1 1 31 31 ILE CA C 13 63.353 0.1 . 1 . . . . 39 ILE CA . 7072 1 401 . 1 1 31 31 ILE CB C 13 37.23 0.1 . 1 . . . . 39 ILE CB . 7072 1 402 . 1 1 31 31 ILE CG1 C 13 28.681 0.1 . 1 . . . . 39 ILE CG1 . 7072 1 403 . 1 1 31 31 ILE CG2 C 13 18.079 0.1 . 1 . . . . 39 ILE CG2 . 7072 1 404 . 1 1 31 31 ILE CD1 C 13 14.042 0.1 . 1 . . . . 39 ILE CD1 . 7072 1 405 . 1 1 31 31 ILE N N 15 120.333 0.1 . 1 . . . . 39 ILE N . 7072 1 406 . 1 1 32 32 SER H H 1 9.293 0.01 . 1 . . . . 40 SER H . 7072 1 407 . 1 1 32 32 SER HA H 1 4.687 0.01 . 1 . . . . 40 SER HA . 7072 1 408 . 1 1 32 32 SER HB2 H 1 3.997 0.01 . 1 . . . . 40 SER HB2 . 7072 1 409 . 1 1 32 32 SER HB3 H 1 3.556 0.01 . 1 . . . . 40 SER HB3 . 7072 1 410 . 1 1 32 32 SER C C 13 174.897 0.1 . 1 . . . . 40 SER C . 7072 1 411 . 1 1 32 32 SER CA C 13 58.505 0.1 . 1 . . . . 40 SER CA . 7072 1 412 . 1 1 32 32 SER CB C 13 64.932 0.1 . 1 . . . . 40 SER CB . 7072 1 413 . 1 1 32 32 SER N N 15 124.994 0.1 . 1 . . . . 40 SER N . 7072 1 414 . 1 1 33 33 GLU H H 1 7.448 0.01 . 1 . . . . 41 GLU H . 7072 1 415 . 1 1 33 33 GLU HA H 1 4.467 0.01 . 1 . . . . 41 GLU HA . 7072 1 416 . 1 1 33 33 GLU HB2 H 1 1.919 0.01 . 1 . . . . 41 GLU HB2 . 7072 1 417 . 1 1 33 33 GLU HB3 H 1 1.86 0.01 . 1 . . . . 41 GLU HB3 . 7072 1 418 . 1 1 33 33 GLU HG2 H 1 2.229 0.01 . 1 . . . . 41 GLU HG2 . 7072 1 419 . 1 1 33 33 GLU HG3 H 1 2.121 0.01 . 1 . . . . 41 GLU HG3 . 7072 1 420 . 1 1 33 33 GLU C C 13 173.993 0.1 . 1 . . . . 41 GLU C . 7072 1 421 . 1 1 33 33 GLU CA C 13 56.648 0.1 . 1 . . . . 41 GLU CA . 7072 1 422 . 1 1 33 33 GLU CB C 13 34.938 0.1 . 1 . . . . 41 GLU CB . 7072 1 423 . 1 1 33 33 GLU CG C 13 36.651 0.1 . 1 . . . . 41 GLU CG . 7072 1 424 . 1 1 33 33 GLU N N 15 119.905 0.1 . 1 . . . . 41 GLU N . 7072 1 425 . 1 1 34 34 ILE H H 1 8.592 0.01 . 1 . . . . 42 ILE H . 7072 1 426 . 1 1 34 34 ILE HA H 1 4.378 0.01 . 1 . . . . 42 ILE HA . 7072 1 427 . 1 1 34 34 ILE HB H 1 1.831 0.01 . 1 . . . . 42 ILE HB . 7072 1 428 . 1 1 34 34 ILE HG12 H 1 1.471 0.01 . 1 . . . . 42 ILE HG12 . 7072 1 429 . 1 1 34 34 ILE HG13 H 1 1.01 0.01 . 1 . . . . 42 ILE HG13 . 7072 1 430 . 1 1 34 34 ILE HG21 H 1 0.796 0.01 . 1 . . . . 42 ILE HG2 . 7072 1 431 . 1 1 34 34 ILE HG22 H 1 0.796 0.01 . 1 . . . . 42 ILE HG2 . 7072 1 432 . 1 1 34 34 ILE HG23 H 1 0.796 0.01 . 1 . . . . 42 ILE HG2 . 7072 1 433 . 1 1 34 34 ILE HD11 H 1 0.6 0.01 . 1 . . . . 42 ILE HD1 . 7072 1 434 . 1 1 34 34 ILE HD12 H 1 0.6 0.01 . 1 . . . . 42 ILE HD1 . 7072 1 435 . 1 1 34 34 ILE HD13 H 1 0.6 0.01 . 1 . . . . 42 ILE HD1 . 7072 1 436 . 1 1 34 34 ILE C C 13 175.281 0.1 . 1 . . . . 42 ILE C . 7072 1 437 . 1 1 34 34 ILE CA C 13 59.253 0.1 . 1 . . . . 42 ILE CA . 7072 1 438 . 1 1 34 34 ILE CB C 13 38.599 0.1 . 1 . . . . 42 ILE CB . 7072 1 439 . 1 1 34 34 ILE CG1 C 13 27.224 0.1 . 1 . . . . 42 ILE CG1 . 7072 1 440 . 1 1 34 34 ILE CG2 C 13 17.074 0.1 . 1 . . . . 42 ILE CG2 . 7072 1 441 . 1 1 34 34 ILE CD1 C 13 12.683 0.1 . 1 . . . . 42 ILE CD1 . 7072 1 442 . 1 1 34 34 ILE N N 15 123.638 0.1 . 1 . . . . 42 ILE N . 7072 1 443 . 1 1 35 35 HIS H H 1 7.938 0.01 . 1 . . . . 43 HIS H . 7072 1 444 . 1 1 35 35 HIS HA H 1 4.986 0.01 . 1 . . . . 43 HIS HA . 7072 1 445 . 1 1 35 35 HIS HB2 H 1 3.208 0.01 . 1 . . . . 43 HIS HB2 . 7072 1 446 . 1 1 35 35 HIS HB3 H 1 2.685 0.01 . 1 . . . . 43 HIS HB3 . 7072 1 447 . 1 1 35 35 HIS HD2 H 1 6.612 0.01 . 1 . . . . 43 HIS HD2 . 7072 1 448 . 1 1 35 35 HIS HE1 H 1 7.639 0.01 . 1 . . . . 43 HIS HE1 . 7072 1 449 . 1 1 35 35 HIS C C 13 174.487 0.1 . 1 . . . . 43 HIS C . 7072 1 450 . 1 1 35 35 HIS CA C 13 53.965 0.1 . 1 . . . . 43 HIS CA . 7072 1 451 . 1 1 35 35 HIS CB C 13 30.649 0.1 . 1 . . . . 43 HIS CB . 7072 1 452 . 1 1 35 35 HIS N N 15 128.409 0.1 . 1 . . . . 43 HIS N . 7072 1 453 . 1 1 36 36 PRO HA H 1 4.402 0.01 . 1 . . . . 44 PRO HA . 7072 1 454 . 1 1 36 36 PRO HB2 H 1 2.448 0.01 . 1 . . . . 44 PRO HB2 . 7072 1 455 . 1 1 36 36 PRO HB3 H 1 2.095 0.01 . 1 . . . . 44 PRO HB3 . 7072 1 456 . 1 1 36 36 PRO HG2 H 1 2.191 0.01 . 1 . . . . 44 PRO HG2 . 7072 1 457 . 1 1 36 36 PRO HG3 H 1 2.278 0.01 . 1 . . . . 44 PRO HG3 . 7072 1 458 . 1 1 36 36 PRO HD2 H 1 4.332 0.01 . 1 . . . . 44 PRO HD2 . 7072 1 459 . 1 1 36 36 PRO HD3 H 1 3.882 0.01 . 1 . . . . 44 PRO HD3 . 7072 1 460 . 1 1 36 36 PRO C C 13 178.698 0.1 . 1 . . . . 44 PRO C . 7072 1 461 . 1 1 36 36 PRO CA C 13 64.087 0.1 . 1 . . . . 44 PRO CA . 7072 1 462 . 1 1 36 36 PRO CB C 13 32.099 0.1 . 1 . . . . 44 PRO CB . 7072 1 463 . 1 1 36 36 PRO CG C 13 27.859 0.1 . 1 . . . . 44 PRO CG . 7072 1 464 . 1 1 36 36 PRO CD C 13 51.395 0.1 . 1 . . . . 44 PRO CD . 7072 1 465 . 1 1 37 37 GLY H H 1 10.606 0.01 . 1 . . . . 45 GLY H . 7072 1 466 . 1 1 37 37 GLY HA2 H 1 4.343 0.01 . 1 . . . . 45 GLY HA2 . 7072 1 467 . 1 1 37 37 GLY HA3 H 1 3.915 0.01 . 1 . . . . 45 GLY HA3 . 7072 1 468 . 1 1 37 37 GLY C C 13 174.177 0.1 . 1 . . . . 45 GLY C . 7072 1 469 . 1 1 37 37 GLY CA C 13 45.736 0.1 . 1 . . . . 45 GLY CA . 7072 1 470 . 1 1 37 37 GLY N N 15 113.373 0.1 . 1 . . . . 45 GLY N . 7072 1 471 . 1 1 38 38 GLN H H 1 7.247 0.01 . 1 . . . . 46 GLN H . 7072 1 472 . 1 1 38 38 GLN HA H 1 4.734 0.01 . 1 . . . . 46 GLN HA . 7072 1 473 . 1 1 38 38 GLN HB2 H 1 2.476 0.01 . 1 . . . . 46 GLN HB2 . 7072 1 474 . 1 1 38 38 GLN HB3 H 1 2.637 0.01 . 1 . . . . 46 GLN HB3 . 7072 1 475 . 1 1 38 38 GLN HG2 H 1 3.21 0.01 . 1 . . . . 46 GLN HG2 . 7072 1 476 . 1 1 38 38 GLN HE21 H 1 6.949 0.01 . 1 . . . . 46 GLN HE21 . 7072 1 477 . 1 1 38 38 GLN HE22 H 1 7.682 0.01 . 1 . . . . 46 GLN HE22 . 7072 1 478 . 1 1 38 38 GLN C C 13 174.067 0.1 . 1 . . . . 46 GLN C . 7072 1 479 . 1 1 38 38 GLN CA C 13 55.681 0.1 . 1 . . . . 46 GLN CA . 7072 1 480 . 1 1 38 38 GLN CB C 13 27.259 0.1 . 1 . . . . 46 GLN CB . 7072 1 481 . 1 1 38 38 GLN N N 15 120.531 0.1 . 1 . . . . 46 GLN N . 7072 1 482 . 1 1 38 38 GLN NE2 N 15 112.393 0.1 . 1 . . . . 46 GLN NE2 . 7072 1 483 . 1 1 39 39 PRO HA H 1 4.056 0.01 . 1 . . . . 47 PRO HA . 7072 1 484 . 1 1 39 39 PRO HB2 H 1 2.541 0.01 . 1 . . . . 47 PRO HB2 . 7072 1 485 . 1 1 39 39 PRO HB3 H 1 2.023 0.01 . 1 . . . . 47 PRO HB3 . 7072 1 486 . 1 1 39 39 PRO HG2 H 1 2.624 0.01 . 1 . . . . 47 PRO HG2 . 7072 1 487 . 1 1 39 39 PRO HG3 H 1 2.073 0.01 . 1 . . . . 47 PRO HG3 . 7072 1 488 . 1 1 39 39 PRO HD2 H 1 3.852 0.01 . 1 . . . . 47 PRO HD2 . 7072 1 489 . 1 1 39 39 PRO HD3 H 1 3.852 0.01 . 1 . . . . 47 PRO HD3 . 7072 1 490 . 1 1 39 39 PRO C C 13 178.067 0.1 . 1 . . . . 47 PRO C . 7072 1 491 . 1 1 39 39 PRO CA C 13 68.535 0.1 . 1 . . . . 47 PRO CA . 7072 1 492 . 1 1 39 39 PRO CB C 13 32.129 0.1 . 1 . . . . 47 PRO CB . 7072 1 493 . 1 1 39 39 PRO CG C 13 31.604 0.1 . 1 . . . . 47 PRO CG . 7072 1 494 . 1 1 40 40 ALA H H 1 7.721 0.01 . 1 . . . . 48 ALA H . 7072 1 495 . 1 1 40 40 ALA HA H 1 4.119 0.01 . 1 . . . . 48 ALA HA . 7072 1 496 . 1 1 40 40 ALA HB1 H 1 1.241 0.01 . 1 . . . . 48 ALA HB . 7072 1 497 . 1 1 40 40 ALA HB2 H 1 1.241 0.01 . 1 . . . . 48 ALA HB . 7072 1 498 . 1 1 40 40 ALA HB3 H 1 1.241 0.01 . 1 . . . . 48 ALA HB . 7072 1 499 . 1 1 40 40 ALA C C 13 179.178 0.1 . 1 . . . . 48 ALA C . 7072 1 500 . 1 1 40 40 ALA CA C 13 55.256 0.1 . 1 . . . . 48 ALA CA . 7072 1 501 . 1 1 40 40 ALA CB C 13 19.212 0.1 . 1 . . . . 48 ALA CB . 7072 1 502 . 1 1 40 40 ALA N N 15 118.439 0.1 . 1 . . . . 48 ALA N . 7072 1 503 . 1 1 41 41 ASP H H 1 8.977 0.01 . 1 . . . . 49 ASP H . 7072 1 504 . 1 1 41 41 ASP HA H 1 4.346 0.01 . 1 . . . . 49 ASP HA . 7072 1 505 . 1 1 41 41 ASP HB2 H 1 2.912 0.01 . 1 . . . . 49 ASP HB2 . 7072 1 506 . 1 1 41 41 ASP HB3 H 1 2.912 0.01 . 1 . . . . 49 ASP HB3 . 7072 1 507 . 1 1 41 41 ASP C C 13 178.398 0.1 . 1 . . . . 49 ASP C . 7072 1 508 . 1 1 41 41 ASP CA C 13 56.856 0.1 . 1 . . . . 49 ASP CA . 7072 1 509 . 1 1 41 41 ASP CB C 13 43.115 0.1 . 1 . . . . 49 ASP CB . 7072 1 510 . 1 1 41 41 ASP N N 15 122.611 0.1 . 1 . . . . 49 ASP N . 7072 1 511 . 1 1 42 42 ARG H H 1 8.216 0.01 . 1 . . . . 50 ARG H . 7072 1 512 . 1 1 42 42 ARG HA H 1 4.068 0.01 . 1 . . . . 50 ARG HA . 7072 1 513 . 1 1 42 42 ARG HB2 H 1 1.91 0.01 . 1 . . . . 50 ARG HB2 . 7072 1 514 . 1 1 42 42 ARG HB3 H 1 1.968 0.01 . 1 . . . . 50 ARG HB3 . 7072 1 515 . 1 1 42 42 ARG HG2 H 1 1.852 0.01 . 1 . . . . 50 ARG HG2 . 7072 1 516 . 1 1 42 42 ARG HG3 H 1 1.565 0.01 . 1 . . . . 50 ARG HG3 . 7072 1 517 . 1 1 42 42 ARG HD2 H 1 3.406 0.01 . 1 . . . . 50 ARG HD2 . 7072 1 518 . 1 1 42 42 ARG HD3 H 1 3.269 0.01 . 1 . . . . 50 ARG HD3 . 7072 1 519 . 1 1 42 42 ARG C C 13 178.762 0.1 . 1 . . . . 50 ARG C . 7072 1 520 . 1 1 42 42 ARG CA C 13 59.544 0.1 . 1 . . . . 50 ARG CA . 7072 1 521 . 1 1 42 42 ARG CB C 13 30.803 0.1 . 1 . . . . 50 ARG CB . 7072 1 522 . 1 1 42 42 ARG CG C 13 27.72 0.1 . 1 . . . . 50 ARG CG . 7072 1 523 . 1 1 42 42 ARG CD C 13 43.828 0.1 . 1 . . . . 50 ARG CD . 7072 1 524 . 1 1 42 42 ARG N N 15 115.305 0.1 . 1 . . . . 50 ARG N . 7072 1 525 . 1 1 43 43 CYS H H 1 7.872 0.01 . 1 . . . . 51 CYS H . 7072 1 526 . 1 1 43 43 CYS HA H 1 4.729 0.01 . 1 . . . . 51 CYS HA . 7072 1 527 . 1 1 43 43 CYS HB2 H 1 3.334 0.01 . 1 . . . . 51 CYS HB2 . 7072 1 528 . 1 1 43 43 CYS HB3 H 1 3.334 0.01 . 1 . . . . 51 CYS HB3 . 7072 1 529 . 1 1 43 43 CYS C C 13 176.438 0.1 . 1 . . . . 51 CYS C . 7072 1 530 . 1 1 43 43 CYS CA C 13 59.801 0.1 . 1 . . . . 51 CYS CA . 7072 1 531 . 1 1 43 43 CYS CB C 13 27.725 0.1 . 1 . . . . 51 CYS CB . 7072 1 532 . 1 1 43 43 CYS N N 15 113.715 0.1 . 1 . . . . 51 CYS N . 7072 1 533 . 1 1 44 44 GLY H H 1 7.496 0.01 . 1 . . . . 52 GLY H . 7072 1 534 . 1 1 44 44 GLY HA2 H 1 4.225 0.01 . 1 . . . . 52 GLY HA2 . 7072 1 535 . 1 1 44 44 GLY HA3 H 1 4.098 0.01 . 1 . . . . 52 GLY HA3 . 7072 1 536 . 1 1 44 44 GLY C C 13 174.387 0.1 . 1 . . . . 52 GLY C . 7072 1 537 . 1 1 44 44 GLY CA C 13 46.494 0.1 . 1 . . . . 52 GLY CA . 7072 1 538 . 1 1 44 44 GLY N N 15 109.103 0.1 . 1 . . . . 52 GLY N . 7072 1 539 . 1 1 45 45 GLY H H 1 7.79 0.01 . 1 . . . . 53 GLY H . 7072 1 540 . 1 1 45 45 GLY HA2 H 1 4.448 0.01 . 1 . . . . 53 GLY HA2 . 7072 1 541 . 1 1 45 45 GLY HA3 H 1 3.771 0.01 . 1 . . . . 53 GLY HA3 . 7072 1 542 . 1 1 45 45 GLY C C 13 172.721 0.1 . 1 . . . . 53 GLY C . 7072 1 543 . 1 1 45 45 GLY CA C 13 44.841 0.1 . 1 . . . . 53 GLY CA . 7072 1 544 . 1 1 45 45 GLY N N 15 106.013 0.1 . 1 . . . . 53 GLY N . 7072 1 545 . 1 1 46 46 LEU H H 1 7.62 0.01 . 1 . . . . 54 LEU H . 7072 1 546 . 1 1 46 46 LEU HA H 1 4.572 0.01 . 1 . . . . 54 LEU HA . 7072 1 547 . 1 1 46 46 LEU HB2 H 1 1.371 0.01 . 1 . . . . 54 LEU HB2 . 7072 1 548 . 1 1 46 46 LEU HB3 H 1 1.036 0.01 . 1 . . . . 54 LEU HB3 . 7072 1 549 . 1 1 46 46 LEU HG H 1 1.33 0.01 . 1 . . . . 54 LEU HG . 7072 1 550 . 1 1 46 46 LEU HD11 H 1 0.322 0.01 . 1 . . . . 54 LEU HD1 . 7072 1 551 . 1 1 46 46 LEU HD12 H 1 0.322 0.01 . 1 . . . . 54 LEU HD1 . 7072 1 552 . 1 1 46 46 LEU HD13 H 1 0.322 0.01 . 1 . . . . 54 LEU HD1 . 7072 1 553 . 1 1 46 46 LEU HD21 H 1 0.636 0.01 . 1 . . . . 54 LEU HD2 . 7072 1 554 . 1 1 46 46 LEU HD22 H 1 0.636 0.01 . 1 . . . . 54 LEU HD2 . 7072 1 555 . 1 1 46 46 LEU HD23 H 1 0.636 0.01 . 1 . . . . 54 LEU HD2 . 7072 1 556 . 1 1 46 46 LEU C C 13 174.585 0.1 . 1 . . . . 54 LEU C . 7072 1 557 . 1 1 46 46 LEU CA C 13 52.839 0.1 . 1 . . . . 54 LEU CA . 7072 1 558 . 1 1 46 46 LEU CB C 13 45.339 0.1 . 1 . . . . 54 LEU CB . 7072 1 559 . 1 1 46 46 LEU CG C 13 26.624 0.1 . 1 . . . . 54 LEU CG . 7072 1 560 . 1 1 46 46 LEU CD1 C 13 25.45 0.1 . 1 . . . . 54 LEU CD1 . 7072 1 561 . 1 1 46 46 LEU CD2 C 13 24.148 0.1 . 1 . . . . 54 LEU CD2 . 7072 1 562 . 1 1 46 46 LEU N N 15 119.257 0.1 . 1 . . . . 54 LEU N . 7072 1 563 . 1 1 47 47 HIS H H 1 9.278 0.01 . 1 . . . . 55 HIS H . 7072 1 564 . 1 1 47 47 HIS HA H 1 4.836 0.01 . 1 . . . . 55 HIS HA . 7072 1 565 . 1 1 47 47 HIS HB2 H 1 3.165 0.01 . 1 . . . . 55 HIS HB2 . 7072 1 566 . 1 1 47 47 HIS HB3 H 1 2.773 0.01 . 1 . . . . 55 HIS HB3 . 7072 1 567 . 1 1 47 47 HIS HD2 H 1 7.099 0.01 . 1 . . . . 55 HIS HD2 . 7072 1 568 . 1 1 47 47 HIS HE1 H 1 6.988 0.01 . 1 . . . . 55 HIS HE1 . 7072 1 569 . 1 1 47 47 HIS C C 13 174.669 0.1 . 1 . . . . 55 HIS C . 7072 1 570 . 1 1 47 47 HIS CA C 13 53.971 0.1 . 1 . . . . 55 HIS CA . 7072 1 571 . 1 1 47 47 HIS CB C 13 32.643 0.1 . 1 . . . . 55 HIS CB . 7072 1 572 . 1 1 47 47 HIS N N 15 119.619 0.1 . 1 . . . . 55 HIS N . 7072 1 573 . 1 1 48 48 VAL H H 1 8.697 0.01 . 1 . . . . 56 VAL H . 7072 1 574 . 1 1 48 48 VAL HA H 1 3.566 0.01 . 1 . . . . 56 VAL HA . 7072 1 575 . 1 1 48 48 VAL HB H 1 2.015 0.01 . 1 . . . . 56 VAL HB . 7072 1 576 . 1 1 48 48 VAL HG11 H 1 1.005 0.01 . 1 . . . . 56 VAL HG1 . 7072 1 577 . 1 1 48 48 VAL HG12 H 1 1.005 0.01 . 1 . . . . 56 VAL HG1 . 7072 1 578 . 1 1 48 48 VAL HG13 H 1 1.005 0.01 . 1 . . . . 56 VAL HG1 . 7072 1 579 . 1 1 48 48 VAL HG21 H 1 1.005 0.01 . 1 . . . . 56 VAL HG2 . 7072 1 580 . 1 1 48 48 VAL HG22 H 1 1.005 0.01 . 1 . . . . 56 VAL HG2 . 7072 1 581 . 1 1 48 48 VAL HG23 H 1 1.005 0.01 . 1 . . . . 56 VAL HG2 . 7072 1 582 . 1 1 48 48 VAL C C 13 177.603 0.1 . 1 . . . . 56 VAL C . 7072 1 583 . 1 1 48 48 VAL CA C 13 65.393 0.1 . 1 . . . . 56 VAL CA . 7072 1 584 . 1 1 48 48 VAL CB C 13 31.324 0.1 . 1 . . . . 56 VAL CB . 7072 1 585 . 1 1 48 48 VAL CG1 C 13 22.451 0.1 . 1 . . . . 56 VAL CG1 . 7072 1 586 . 1 1 48 48 VAL CG2 C 13 21.597 0.1 . 1 . . . . 56 VAL CG2 . 7072 1 587 . 1 1 48 48 VAL N N 15 122.067 0.1 . 1 . . . . 56 VAL N . 7072 1 588 . 1 1 49 49 GLY H H 1 9.068 0.01 . 1 . . . . 57 GLY H . 7072 1 589 . 1 1 49 49 GLY HA2 H 1 4.609 0.01 . 1 . . . . 57 GLY HA2 . 7072 1 590 . 1 1 49 49 GLY HA3 H 1 3.472 0.01 . 1 . . . . 57 GLY HA3 . 7072 1 591 . 1 1 49 49 GLY C C 13 173.72 0.1 . 1 . . . . 57 GLY C . 7072 1 592 . 1 1 49 49 GLY CA C 13 44.982 0.1 . 1 . . . . 57 GLY CA . 7072 1 593 . 1 1 49 49 GLY N N 15 115.969 0.1 . 1 . . . . 57 GLY N . 7072 1 594 . 1 1 50 50 ASP H H 1 8.163 0.01 . 1 . . . . 58 ASP H . 7072 1 595 . 1 1 50 50 ASP HA H 1 5.256 0.01 . 1 . . . . 58 ASP HA . 7072 1 596 . 1 1 50 50 ASP HB2 H 1 3.129 0.01 . 1 . . . . 58 ASP HB2 . 7072 1 597 . 1 1 50 50 ASP HB3 H 1 2.292 0.01 . 1 . . . . 58 ASP HB3 . 7072 1 598 . 1 1 50 50 ASP C C 13 175.594 0.1 . 1 . . . . 58 ASP C . 7072 1 599 . 1 1 50 50 ASP CA C 13 55.568 0.1 . 1 . . . . 58 ASP CA . 7072 1 600 . 1 1 50 50 ASP CB C 13 41.972 0.1 . 1 . . . . 58 ASP CB . 7072 1 601 . 1 1 50 50 ASP N N 15 120.245 0.1 . 1 . . . . 58 ASP N . 7072 1 602 . 1 1 51 51 ALA H H 1 9.521 0.01 . 1 . . . . 59 ALA H . 7072 1 603 . 1 1 51 51 ALA HA H 1 5.491 0.01 . 1 . . . . 59 ALA HA . 7072 1 604 . 1 1 51 51 ALA HB1 H 1 1.355 0.01 . 1 . . . . 59 ALA HB . 7072 1 605 . 1 1 51 51 ALA HB2 H 1 1.355 0.01 . 1 . . . . 59 ALA HB . 7072 1 606 . 1 1 51 51 ALA HB3 H 1 1.355 0.01 . 1 . . . . 59 ALA HB . 7072 1 607 . 1 1 51 51 ALA C C 13 177.611 0.1 . 1 . . . . 59 ALA C . 7072 1 608 . 1 1 51 51 ALA CA C 13 49.788 0.1 . 1 . . . . 59 ALA CA . 7072 1 609 . 1 1 51 51 ALA CB C 13 20.363 0.1 . 1 . . . . 59 ALA CB . 7072 1 610 . 1 1 51 51 ALA N N 15 123.64 0.1 . 1 . . . . 59 ALA N . 7072 1 611 . 1 1 52 52 ILE H H 1 8.757 0.01 . 1 . . . . 60 ILE H . 7072 1 612 . 1 1 52 52 ILE HA H 1 4.413 0.01 . 1 . . . . 60 ILE HA . 7072 1 613 . 1 1 52 52 ILE HB H 1 1.737 0.01 . 1 . . . . 60 ILE HB . 7072 1 614 . 1 1 52 52 ILE HG12 H 1 1.601 0.01 . 1 . . . . 60 ILE HG12 . 7072 1 615 . 1 1 52 52 ILE HG13 H 1 1.739 0.01 . 1 . . . . 60 ILE HG13 . 7072 1 616 . 1 1 52 52 ILE HG21 H 1 0.862 0.01 . 1 . . . . 60 ILE HG2 . 7072 1 617 . 1 1 52 52 ILE HG22 H 1 0.862 0.01 . 1 . . . . 60 ILE HG2 . 7072 1 618 . 1 1 52 52 ILE HG23 H 1 0.862 0.01 . 1 . . . . 60 ILE HG2 . 7072 1 619 . 1 1 52 52 ILE HD11 H 1 13.891 0.1 . 1 . . . . 60 ILE HD1 . 7072 1 620 . 1 1 52 52 ILE HD12 H 1 13.891 0.1 . 1 . . . . 60 ILE HD1 . 7072 1 621 . 1 1 52 52 ILE HD13 H 1 13.891 0.1 . 1 . . . . 60 ILE HD1 . 7072 1 622 . 1 1 52 52 ILE C C 13 174.839 0.1 . 1 . . . . 60 ILE C . 7072 1 623 . 1 1 52 52 ILE CA C 13 61.268 0.1 . 1 . . . . 60 ILE CA . 7072 1 624 . 1 1 52 52 ILE CB C 13 38.204 0.1 . 1 . . . . 60 ILE CB . 7072 1 625 . 1 1 52 52 ILE CG1 C 13 26.93 0.1 . 1 . . . . 60 ILE CG1 . 7072 1 626 . 1 1 52 52 ILE CG2 C 13 20.259 0.1 . 1 . . . . 60 ILE CG2 . 7072 1 627 . 1 1 52 52 ILE CD1 C 13 13.891 0.1 . 1 . . . . 60 ILE CD1 . 7072 1 628 . 1 1 52 52 ILE N N 15 119.968 0.1 . 1 . . . . 60 ILE N . 7072 1 629 . 1 1 53 53 LEU H H 1 9.201 0.01 . 1 . . . . 61 LEU H . 7072 1 630 . 1 1 53 53 LEU HA H 1 4.331 0.01 . 1 . . . . 61 LEU HA . 7072 1 631 . 1 1 53 53 LEU HB2 H 1 1.684 0.01 . 1 . . . . 61 LEU HB2 . 7072 1 632 . 1 1 53 53 LEU HB3 H 1 1.456 0.01 . 1 . . . . 61 LEU HB3 . 7072 1 633 . 1 1 53 53 LEU HG H 1 1.748 0.01 . 1 . . . . 61 LEU HG . 7072 1 634 . 1 1 53 53 LEU HD11 H 1 0.848 0.01 . 1 . . . . 61 LEU HD1 . 7072 1 635 . 1 1 53 53 LEU HD12 H 1 0.848 0.01 . 1 . . . . 61 LEU HD1 . 7072 1 636 . 1 1 53 53 LEU HD13 H 1 0.848 0.01 . 1 . . . . 61 LEU HD1 . 7072 1 637 . 1 1 53 53 LEU HD21 H 1 0.938 0.01 . 1 . . . . 61 LEU HD2 . 7072 1 638 . 1 1 53 53 LEU HD22 H 1 0.938 0.01 . 1 . . . . 61 LEU HD2 . 7072 1 639 . 1 1 53 53 LEU HD23 H 1 0.938 0.01 . 1 . . . . 61 LEU HD2 . 7072 1 640 . 1 1 53 53 LEU C C 13 177.457 0.1 . 1 . . . . 61 LEU C . 7072 1 641 . 1 1 53 53 LEU CA C 13 55.87 0.1 . 1 . . . . 61 LEU CA . 7072 1 642 . 1 1 53 53 LEU CB C 13 41.774 0.1 . 1 . . . . 61 LEU CB . 7072 1 643 . 1 1 53 53 LEU CG C 13 26.949 0.1 . 1 . . . . 61 LEU CG . 7072 1 644 . 1 1 53 53 LEU CD1 C 13 21.971 0.1 . 1 . . . . 61 LEU CD1 . 7072 1 645 . 1 1 53 53 LEU CD2 C 13 25.831 0.1 . 1 . . . . 61 LEU CD2 . 7072 1 646 . 1 1 53 53 LEU N N 15 126.785 0.1 . 1 . . . . 61 LEU N . 7072 1 647 . 1 1 54 54 ALA H H 1 7.965 0.01 . 1 . . . . 62 ALA H . 7072 1 648 . 1 1 54 54 ALA HA H 1 5.161 0.01 . 1 . . . . 62 ALA HA . 7072 1 649 . 1 1 54 54 ALA HB1 H 1 1.311 0.01 . 1 . . . . 62 ALA HB . 7072 1 650 . 1 1 54 54 ALA HB2 H 1 1.311 0.01 . 1 . . . . 62 ALA HB . 7072 1 651 . 1 1 54 54 ALA HB3 H 1 1.311 0.01 . 1 . . . . 62 ALA HB . 7072 1 652 . 1 1 54 54 ALA C C 13 175.598 0.1 . 1 . . . . 62 ALA C . 7072 1 653 . 1 1 54 54 ALA CA C 13 51.966 0.1 . 1 . . . . 62 ALA CA . 7072 1 654 . 1 1 54 54 ALA CB C 13 22.788 0.1 . 1 . . . . 62 ALA CB . 7072 1 655 . 1 1 54 54 ALA N N 15 117.277 0.1 . 1 . . . . 62 ALA N . 7072 1 656 . 1 1 55 55 VAL H H 1 8.349 0.01 . 1 . . . . 63 VAL H . 7072 1 657 . 1 1 55 55 VAL HA H 1 4.964 0.01 . 1 . . . . 63 VAL HA . 7072 1 658 . 1 1 55 55 VAL HB H 1 1.597 0.01 . 1 . . . . 63 VAL HB . 7072 1 659 . 1 1 55 55 VAL HG11 H 1 0.721 0.01 . 1 . . . . 63 VAL HG1 . 7072 1 660 . 1 1 55 55 VAL HG12 H 1 0.721 0.01 . 1 . . . . 63 VAL HG1 . 7072 1 661 . 1 1 55 55 VAL HG13 H 1 0.721 0.01 . 1 . . . . 63 VAL HG1 . 7072 1 662 . 1 1 55 55 VAL HG21 H 1 0.458 0.01 . 1 . . . . 63 VAL HG2 . 7072 1 663 . 1 1 55 55 VAL HG22 H 1 0.458 0.01 . 1 . . . . 63 VAL HG2 . 7072 1 664 . 1 1 55 55 VAL HG23 H 1 0.458 0.01 . 1 . . . . 63 VAL HG2 . 7072 1 665 . 1 1 55 55 VAL C C 13 174.002 0.1 . 1 . . . . 63 VAL C . 7072 1 666 . 1 1 55 55 VAL CA C 13 58.581 0.1 . 1 . . . . 63 VAL CA . 7072 1 667 . 1 1 55 55 VAL CB C 13 34.461 0.1 . 1 . . . . 63 VAL CB . 7072 1 668 . 1 1 55 55 VAL CG1 C 13 20.259 0.1 . 1 . . . . 63 VAL CG1 . 7072 1 669 . 1 1 55 55 VAL CG2 C 13 22.462 0.1 . 1 . . . . 63 VAL CG2 . 7072 1 670 . 1 1 55 55 VAL N N 15 116.159 0.1 . 1 . . . . 63 VAL N . 7072 1 671 . 1 1 56 56 ASN H H 1 9.896 0.01 . 1 . . . . 64 ASN H . 7072 1 672 . 1 1 56 56 ASN HA H 1 4.665 0.01 . 1 . . . . 64 ASN HA . 7072 1 673 . 1 1 56 56 ASN HB2 H 1 3.378 0.01 . 1 . . . . 64 ASN HB2 . 7072 1 674 . 1 1 56 56 ASN HB3 H 1 2.787 0.01 . 1 . . . . 64 ASN HB3 . 7072 1 675 . 1 1 56 56 ASN HD21 H 1 7.236 0.01 . 1 . . . . 64 ASN HD21 . 7072 1 676 . 1 1 56 56 ASN HD22 H 1 8.096 0.01 . 1 . . . . 64 ASN HD22 . 7072 1 677 . 1 1 56 56 ASN C C 13 174.002 0.1 . 1 . . . . 64 ASN C . 7072 1 678 . 1 1 56 56 ASN CA C 13 53.662 0.1 . 1 . . . . 64 ASN CA . 7072 1 679 . 1 1 56 56 ASN CB C 13 37.367 0.1 . 1 . . . . 64 ASN CB . 7072 1 680 . 1 1 56 56 ASN N N 15 127.214 0.1 . 1 . . . . 64 ASN N . 7072 1 681 . 1 1 56 56 ASN ND2 N 15 112.204 0.1 . 1 . . . . 64 ASN ND2 . 7072 1 682 . 1 1 57 57 GLY H H 1 8.98 0.01 . 1 . . . . 65 GLY H . 7072 1 683 . 1 1 57 57 GLY HA2 H 1 4.173 0.01 . 1 . . . . 65 GLY HA2 . 7072 1 684 . 1 1 57 57 GLY HA3 H 1 3.681 0.01 . 1 . . . . 65 GLY HA3 . 7072 1 685 . 1 1 57 57 GLY C C 13 174.252 0.1 . 1 . . . . 65 GLY C . 7072 1 686 . 1 1 57 57 GLY CA C 13 45.451 0.1 . 1 . . . . 65 GLY CA . 7072 1 687 . 1 1 57 57 GLY N N 15 102.99 0.1 . 1 . . . . 65 GLY N . 7072 1 688 . 1 1 58 58 VAL H H 1 8.611 0.01 . 1 . . . . 66 VAL H . 7072 1 689 . 1 1 58 58 VAL HA H 1 3.986 0.01 . 1 . . . . 66 VAL HA . 7072 1 690 . 1 1 58 58 VAL HB H 1 2.392 0.01 . 1 . . . . 66 VAL HB . 7072 1 691 . 1 1 58 58 VAL HG11 H 1 1.013 0.01 . 1 . . . . 66 VAL HG1 . 7072 1 692 . 1 1 58 58 VAL HG12 H 1 1.013 0.01 . 1 . . . . 66 VAL HG1 . 7072 1 693 . 1 1 58 58 VAL HG13 H 1 1.013 0.01 . 1 . . . . 66 VAL HG1 . 7072 1 694 . 1 1 58 58 VAL HG21 H 1 1.013 0.01 . 1 . . . . 66 VAL HG2 . 7072 1 695 . 1 1 58 58 VAL HG22 H 1 1.013 0.01 . 1 . . . . 66 VAL HG2 . 7072 1 696 . 1 1 58 58 VAL HG23 H 1 1.013 0.01 . 1 . . . . 66 VAL HG2 . 7072 1 697 . 1 1 58 58 VAL C C 13 175.549 0.1 . 1 . . . . 66 VAL C . 7072 1 698 . 1 1 58 58 VAL CA C 13 62.841 0.1 . 1 . . . . 66 VAL CA . 7072 1 699 . 1 1 58 58 VAL CB C 13 31.198 0.1 . 1 . . . . 66 VAL CB . 7072 1 700 . 1 1 58 58 VAL CG1 C 13 21.421 0.1 . 1 . . . . 66 VAL CG1 . 7072 1 701 . 1 1 58 58 VAL CG2 C 13 21.421 0.1 . 1 . . . . 66 VAL CG2 . 7072 1 702 . 1 1 58 58 VAL N N 15 125.364 0.1 . 1 . . . . 66 VAL N . 7072 1 703 . 1 1 59 59 ASN H H 1 8.619 0.01 . 1 . . . . 67 ASN H . 7072 1 704 . 1 1 59 59 ASN HA H 1 4.601 0.01 . 1 . . . . 67 ASN HA . 7072 1 705 . 1 1 59 59 ASN HB2 H 1 3.045 0.01 . 1 . . . . 67 ASN HB2 . 7072 1 706 . 1 1 59 59 ASN HB3 H 1 3.045 0.01 . 1 . . . . 67 ASN HB3 . 7072 1 707 . 1 1 59 59 ASN HD21 H 1 7.076 0.01 . 1 . . . . 67 ASN HD21 . 7072 1 708 . 1 1 59 59 ASN HD22 H 1 7.678 0.01 . 1 . . . . 67 ASN HD22 . 7072 1 709 . 1 1 59 59 ASN C C 13 176.144 0.1 . 1 . . . . 67 ASN C . 7072 1 710 . 1 1 59 59 ASN CA C 13 54.364 0.1 . 1 . . . . 67 ASN CA . 7072 1 711 . 1 1 59 59 ASN CB C 13 39.141 0.1 . 1 . . . . 67 ASN CB . 7072 1 712 . 1 1 59 59 ASN N N 15 126.042 0.1 . 1 . . . . 67 ASN N . 7072 1 713 . 1 1 59 59 ASN ND2 N 15 112.091 0.1 . 1 . . . . 67 ASN ND2 . 7072 1 714 . 1 1 60 60 LEU H H 1 9.129 0.01 . 1 . . . . 68 LEU H . 7072 1 715 . 1 1 60 60 LEU HA H 1 4.97 0.01 . 1 . . . . 68 LEU HA . 7072 1 716 . 1 1 60 60 LEU HB2 H 1 1.838 0.01 . 1 . . . . 68 LEU HB2 . 7072 1 717 . 1 1 60 60 LEU HB3 H 1 1.426 0.01 . 1 . . . . 68 LEU HB3 . 7072 1 718 . 1 1 60 60 LEU HG H 1 1.837 0.01 . 1 . . . . 68 LEU HG . 7072 1 719 . 1 1 60 60 LEU HD11 H 1 0.826 0.01 . 1 . . . . 68 LEU HD1 . 7072 1 720 . 1 1 60 60 LEU HD12 H 1 0.826 0.01 . 1 . . . . 68 LEU HD1 . 7072 1 721 . 1 1 60 60 LEU HD13 H 1 0.826 0.01 . 1 . . . . 68 LEU HD1 . 7072 1 722 . 1 1 60 60 LEU HD21 H 1 0.908 0.01 . 1 . . . . 68 LEU HD2 . 7072 1 723 . 1 1 60 60 LEU HD22 H 1 0.908 0.01 . 1 . . . . 68 LEU HD2 . 7072 1 724 . 1 1 60 60 LEU HD23 H 1 0.908 0.01 . 1 . . . . 68 LEU HD2 . 7072 1 725 . 1 1 60 60 LEU C C 13 179.671 0.1 . 1 . . . . 68 LEU C . 7072 1 726 . 1 1 60 60 LEU CA C 13 54.111 0.1 . 1 . . . . 68 LEU CA . 7072 1 727 . 1 1 60 60 LEU CB C 13 43.374 0.1 . 1 . . . . 68 LEU CB . 7072 1 728 . 1 1 60 60 LEU CD1 C 13 26.052 0.1 . 1 . . . . 68 LEU CD1 . 7072 1 729 . 1 1 60 60 LEU CD2 C 13 24.516 0.1 . 1 . . . . 68 LEU CD2 . 7072 1 730 . 1 1 60 60 LEU N N 15 127.251 0.1 . 1 . . . . 68 LEU N . 7072 1 731 . 1 1 61 61 ARG H H 1 8.485 0.01 . 1 . . . . 69 ARG H . 7072 1 732 . 1 1 61 61 ARG HA H 1 4.284 0.01 . 1 . . . . 69 ARG HA . 7072 1 733 . 1 1 61 61 ARG HB2 H 1 1.941 0.01 . 1 . . . . 69 ARG HB2 . 7072 1 734 . 1 1 61 61 ARG HB3 H 1 1.878 0.01 . 1 . . . . 69 ARG HB3 . 7072 1 735 . 1 1 61 61 ARG HG2 H 1 2.185 0.01 . 1 . . . . 69 ARG HG2 . 7072 1 736 . 1 1 61 61 ARG HG3 H 1 1.664 0.01 . 1 . . . . 69 ARG HG3 . 7072 1 737 . 1 1 61 61 ARG HD2 H 1 3.405 0.01 . 1 . . . . 69 ARG HD2 . 7072 1 738 . 1 1 61 61 ARG HD3 H 1 3.382 0.01 . 1 . . . . 69 ARG HD3 . 7072 1 739 . 1 1 61 61 ARG C C 13 176.875 0.1 . 1 . . . . 69 ARG C . 7072 1 740 . 1 1 61 61 ARG CA C 13 59.193 0.1 . 1 . . . . 69 ARG CA . 7072 1 741 . 1 1 61 61 ARG CB C 13 30.421 0.1 . 1 . . . . 69 ARG CB . 7072 1 742 . 1 1 61 61 ARG CG C 13 26.95 0.1 . 1 . . . . 69 ARG CG . 7072 1 743 . 1 1 61 61 ARG CD C 13 43.859 0.1 . 1 . . . . 69 ARG CD . 7072 1 744 . 1 1 61 61 ARG N N 15 123.483 0.1 . 1 . . . . 69 ARG N . 7072 1 745 . 1 1 62 62 ASP H H 1 8.813 0.01 . 1 . . . . 70 ASP H . 7072 1 746 . 1 1 62 62 ASP HA H 1 4.855 0.01 . 1 . . . . 70 ASP HA . 7072 1 747 . 1 1 62 62 ASP HB2 H 1 2.912 0.01 . 1 . . . . 70 ASP HB2 . 7072 1 748 . 1 1 62 62 ASP HB3 H 1 2.485 0.01 . 1 . . . . 70 ASP HB3 . 7072 1 749 . 1 1 62 62 ASP C C 13 175.257 0.1 . 1 . . . . 70 ASP C . 7072 1 750 . 1 1 62 62 ASP CA C 13 53.927 0.1 . 1 . . . . 70 ASP CA . 7072 1 751 . 1 1 62 62 ASP CB C 13 41.524 0.1 . 1 . . . . 70 ASP CB . 7072 1 752 . 1 1 62 62 ASP N N 15 118.089 0.1 . 1 . . . . 70 ASP N . 7072 1 753 . 1 1 63 63 THR H H 1 7.434 0.01 . 1 . . . . 71 THR H . 7072 1 754 . 1 1 63 63 THR HA H 1 4.506 0.01 . 1 . . . . 71 THR HA . 7072 1 755 . 1 1 63 63 THR HB H 1 4.121 0.01 . 1 . . . . 71 THR HB . 7072 1 756 . 1 1 63 63 THR HG21 H 1 1.391 0.01 . 1 . . . . 71 THR HG2 . 7072 1 757 . 1 1 63 63 THR HG22 H 1 1.391 0.01 . 1 . . . . 71 THR HG2 . 7072 1 758 . 1 1 63 63 THR HG23 H 1 1.391 0.01 . 1 . . . . 71 THR HG2 . 7072 1 759 . 1 1 63 63 THR C C 13 176.251 0.1 . 1 . . . . 71 THR C . 7072 1 760 . 1 1 63 63 THR CA C 13 62.152 0.1 . 1 . . . . 71 THR CA . 7072 1 761 . 1 1 63 63 THR CB C 13 70.971 0.1 . 1 . . . . 71 THR CB . 7072 1 762 . 1 1 63 63 THR CG2 C 13 22.699 0.1 . 1 . . . . 71 THR CG2 . 7072 1 763 . 1 1 63 63 THR N N 15 111.46 0.1 . 1 . . . . 71 THR N . 7072 1 764 . 1 1 64 64 LYS H H 1 9.161 0.01 . 1 . . . . 72 LYS H . 7072 1 765 . 1 1 64 64 LYS HA H 1 4.816 0.01 . 1 . . . . 72 LYS HA . 7072 1 766 . 1 1 64 64 LYS HB2 H 1 2.403 0.01 . 1 . . . . 72 LYS HB2 . 7072 1 767 . 1 1 64 64 LYS HB3 H 1 1.842 0.01 . 1 . . . . 72 LYS HB3 . 7072 1 768 . 1 1 64 64 LYS HG2 H 1 1.491 0.01 . 1 . . . . 72 LYS HG2 . 7072 1 769 . 1 1 64 64 LYS HG3 H 1 1.491 0.01 . 1 . . . . 72 LYS HG3 . 7072 1 770 . 1 1 64 64 LYS HD2 H 1 1.638 0.01 . 1 . . . . 72 LYS HD2 . 7072 1 771 . 1 1 64 64 LYS HD3 H 1 1.823 0.01 . 1 . . . . 72 LYS HD3 . 7072 1 772 . 1 1 64 64 LYS HE2 H 1 3.032 0.01 . 1 . . . . 72 LYS HE2 . 7072 1 773 . 1 1 64 64 LYS HE3 H 1 3.07 0.01 . 1 . . . . 72 LYS HE3 . 7072 1 774 . 1 1 64 64 LYS C C 13 177.47 0.1 . 1 . . . . 72 LYS C . 7072 1 775 . 1 1 64 64 LYS CA C 13 56.93 0.1 . 1 . . . . 72 LYS CA . 7072 1 776 . 1 1 64 64 LYS CB C 13 33.828 0.1 . 1 . . . . 72 LYS CB . 7072 1 777 . 1 1 64 64 LYS CG C 13 27.027 0.1 . 1 . . . . 72 LYS CG . 7072 1 778 . 1 1 64 64 LYS CD C 13 29.264 0.1 . 1 . . . . 72 LYS CD . 7072 1 779 . 1 1 64 64 LYS CE C 13 41.916 0.1 . 1 . . . . 72 LYS CE . 7072 1 780 . 1 1 64 64 LYS N N 15 125.196 0.1 . 1 . . . . 72 LYS N . 7072 1 781 . 1 1 65 65 HIS H H 1 10.368 0.01 . 1 . . . . 73 HIS H . 7072 1 782 . 1 1 65 65 HIS HA H 1 4.022 0.01 . 1 . . . . 73 HIS HA . 7072 1 783 . 1 1 65 65 HIS HB2 H 1 3.812 0.01 . 1 . . . . 73 HIS HB2 . 7072 1 784 . 1 1 65 65 HIS HB3 H 1 3.373 0.01 . 1 . . . . 73 HIS HB3 . 7072 1 785 . 1 1 65 65 HIS HD2 H 1 6.741 0.01 . 1 . . . . 73 HIS HD2 . 7072 1 786 . 1 1 65 65 HIS HE1 H 1 7.715 0.01 . 1 . . . . 73 HIS HE1 . 7072 1 787 . 1 1 65 65 HIS C C 13 177.224 0.1 . 1 . . . . 73 HIS C . 7072 1 788 . 1 1 65 65 HIS CA C 13 63.129 0.1 . 1 . . . . 73 HIS CA . 7072 1 789 . 1 1 65 65 HIS CB C 13 30.661 0.1 . 1 . . . . 73 HIS CB . 7072 1 790 . 1 1 65 65 HIS N N 15 125.013 0.1 . 1 . . . . 73 HIS N . 7072 1 791 . 1 1 66 66 LYS H H 1 9.542 0.01 . 1 . . . . 74 LYS H . 7072 1 792 . 1 1 66 66 LYS HA H 1 4.045 0.01 . 1 . . . . 74 LYS HA . 7072 1 793 . 1 1 66 66 LYS HB2 H 1 2.083 0.01 . 1 . . . . 74 LYS HB2 . 7072 1 794 . 1 1 66 66 LYS HB3 H 1 1.932 0.01 . 1 . . . . 74 LYS HB3 . 7072 1 795 . 1 1 66 66 LYS HG2 H 1 1.619 0.01 . 1 . . . . 74 LYS HG2 . 7072 1 796 . 1 1 66 66 LYS HG3 H 1 1.672 0.01 . 1 . . . . 74 LYS HG3 . 7072 1 797 . 1 1 66 66 LYS HD2 H 1 1.841 0.01 . 1 . . . . 74 LYS HD2 . 7072 1 798 . 1 1 66 66 LYS HD3 H 1 1.841 0.01 . 1 . . . . 74 LYS HD3 . 7072 1 799 . 1 1 66 66 LYS HE2 H 1 3.133 0.01 . 1 . . . . 74 LYS HE2 . 7072 1 800 . 1 1 66 66 LYS HE3 H 1 3.133 0.01 . 1 . . . . 74 LYS HE3 . 7072 1 801 . 1 1 66 66 LYS C C 13 179.577 0.1 . 1 . . . . 74 LYS C . 7072 1 802 . 1 1 66 66 LYS CA C 13 59.656 0.1 . 1 . . . . 74 LYS CA . 7072 1 803 . 1 1 66 66 LYS CB C 13 32.136 0.1 . 1 . . . . 74 LYS CB . 7072 1 804 . 1 1 66 66 LYS CG C 13 25.188 0.1 . 1 . . . . 74 LYS CG . 7072 1 805 . 1 1 66 66 LYS CD C 13 29.268 0.1 . 1 . . . . 74 LYS CD . 7072 1 806 . 1 1 66 66 LYS CE C 13 41.939 0.1 . 1 . . . . 74 LYS CE . 7072 1 807 . 1 1 66 66 LYS N N 15 115.475 0.1 . 1 . . . . 74 LYS N . 7072 1 808 . 1 1 67 67 GLU H H 1 7.121 0.01 . 1 . . . . 75 GLU H . 7072 1 809 . 1 1 67 67 GLU HA H 1 4.193 0.01 . 1 . . . . 75 GLU HA . 7072 1 810 . 1 1 67 67 GLU HB2 H 1 2.419 0.01 . 1 . . . . 75 GLU HB2 . 7072 1 811 . 1 1 67 67 GLU HB3 H 1 2.139 0.01 . 1 . . . . 75 GLU HB3 . 7072 1 812 . 1 1 67 67 GLU HG2 H 1 2.822 0.01 . 1 . . . . 75 GLU HG2 . 7072 1 813 . 1 1 67 67 GLU HG3 H 1 2.431 0.01 . 1 . . . . 75 GLU HG3 . 7072 1 814 . 1 1 67 67 GLU C C 13 178.539 0.1 . 1 . . . . 75 GLU C . 7072 1 815 . 1 1 67 67 GLU CA C 13 58.929 0.1 . 1 . . . . 75 GLU CA . 7072 1 816 . 1 1 67 67 GLU CB C 13 29.858 0.1 . 1 . . . . 75 GLU CB . 7072 1 817 . 1 1 67 67 GLU CG C 13 36.861 0.1 . 1 . . . . 75 GLU CG . 7072 1 818 . 1 1 67 67 GLU N N 15 118.67 0.1 . 1 . . . . 75 GLU N . 7072 1 819 . 1 1 68 68 ALA H H 1 8.288 0.01 . 1 . . . . 76 ALA H . 7072 1 820 . 1 1 68 68 ALA HA H 1 4.034 0.01 . 1 . . . . 76 ALA HA . 7072 1 821 . 1 1 68 68 ALA HB1 H 1 1.521 0.01 . 1 . . . . 76 ALA HB . 7072 1 822 . 1 1 68 68 ALA HB2 H 1 1.521 0.01 . 1 . . . . 76 ALA HB . 7072 1 823 . 1 1 68 68 ALA HB3 H 1 1.521 0.01 . 1 . . . . 76 ALA HB . 7072 1 824 . 1 1 68 68 ALA C C 13 179.135 0.1 . 1 . . . . 76 ALA C . 7072 1 825 . 1 1 68 68 ALA CA C 13 55.625 0.1 . 1 . . . . 76 ALA CA . 7072 1 826 . 1 1 68 68 ALA CB C 13 18.66 0.1 . 1 . . . . 76 ALA CB . 7072 1 827 . 1 1 68 68 ALA N N 15 122.395 0.1 . 1 . . . . 76 ALA N . 7072 1 828 . 1 1 69 69 VAL H H 1 8.334 0.01 . 1 . . . . 77 VAL H . 7072 1 829 . 1 1 69 69 VAL HA H 1 3.534 0.01 . 1 . . . . 77 VAL HA . 7072 1 830 . 1 1 69 69 VAL HB H 1 2.226 0.01 . 1 . . . . 77 VAL HB . 7072 1 831 . 1 1 69 69 VAL HG11 H 1 0.948 0.01 . 1 . . . . 77 VAL HG1 . 7072 1 832 . 1 1 69 69 VAL HG12 H 1 0.948 0.01 . 1 . . . . 77 VAL HG1 . 7072 1 833 . 1 1 69 69 VAL HG13 H 1 0.948 0.01 . 1 . . . . 77 VAL HG1 . 7072 1 834 . 1 1 69 69 VAL HG21 H 1 1.06 0.01 . 1 . . . . 77 VAL HG2 . 7072 1 835 . 1 1 69 69 VAL HG22 H 1 1.06 0.01 . 1 . . . . 77 VAL HG2 . 7072 1 836 . 1 1 69 69 VAL HG23 H 1 1.06 0.01 . 1 . . . . 77 VAL HG2 . 7072 1 837 . 1 1 69 69 VAL C C 13 179.337 0.1 . 1 . . . . 77 VAL C . 7072 1 838 . 1 1 69 69 VAL CA C 13 67.387 0.1 . 1 . . . . 77 VAL CA . 7072 1 839 . 1 1 69 69 VAL CB C 13 31.814 0.1 . 1 . . . . 77 VAL CB . 7072 1 840 . 1 1 69 69 VAL CG1 C 13 23.045 0.1 . 1 . . . . 77 VAL CG1 . 7072 1 841 . 1 1 69 69 VAL CG2 C 13 21.415 0.1 . 1 . . . . 77 VAL CG2 . 7072 1 842 . 1 1 69 69 VAL N N 15 117.544 0.1 . 1 . . . . 77 VAL N . 7072 1 843 . 1 1 70 70 THR H H 1 7.908 0.01 . 1 . . . . 78 THR H . 7072 1 844 . 1 1 70 70 THR HA H 1 3.94 0.01 . 1 . . . . 78 THR HA . 7072 1 845 . 1 1 70 70 THR HB H 1 4.444 0.01 . 1 . . . . 78 THR HB . 7072 1 846 . 1 1 70 70 THR HG21 H 1 1.301 0.01 . 1 . . . . 78 THR HG2 . 7072 1 847 . 1 1 70 70 THR HG22 H 1 1.301 0.01 . 1 . . . . 78 THR HG2 . 7072 1 848 . 1 1 70 70 THR HG23 H 1 1.301 0.01 . 1 . . . . 78 THR HG2 . 7072 1 849 . 1 1 70 70 THR C C 13 176.824 0.1 . 1 . . . . 78 THR C . 7072 1 850 . 1 1 70 70 THR CA C 13 67.025 0.1 . 1 . . . . 78 THR CA . 7072 1 851 . 1 1 70 70 THR CB C 13 68.745 0.1 . 1 . . . . 78 THR CB . 7072 1 852 . 1 1 70 70 THR CG2 C 13 21.589 0.1 . 1 . . . . 78 THR CG2 . 7072 1 853 . 1 1 70 70 THR N N 15 117.75 0.1 . 1 . . . . 78 THR N . 7072 1 854 . 1 1 71 71 ILE H H 1 8.291 0.01 . 1 . . . . 79 ILE H . 7072 1 855 . 1 1 71 71 ILE HA H 1 3.788 0.01 . 1 . . . . 79 ILE HA . 7072 1 856 . 1 1 71 71 ILE HB H 1 1.853 0.01 . 1 . . . . 79 ILE HB . 7072 1 857 . 1 1 71 71 ILE HG12 H 1 1.831 0.01 . 1 . . . . 79 ILE HG12 . 7072 1 858 . 1 1 71 71 ILE HG13 H 1 1.182 0.01 . 1 . . . . 79 ILE HG13 . 7072 1 859 . 1 1 71 71 ILE HG21 H 1 0.869 0.01 . 1 . . . . 79 ILE HG2 . 7072 1 860 . 1 1 71 71 ILE HG22 H 1 0.869 0.01 . 1 . . . . 79 ILE HG2 . 7072 1 861 . 1 1 71 71 ILE HG23 H 1 0.869 0.01 . 1 . . . . 79 ILE HG2 . 7072 1 862 . 1 1 71 71 ILE HD11 H 1 0.876 0.01 . 1 . . . . 79 ILE HD1 . 7072 1 863 . 1 1 71 71 ILE HD12 H 1 0.876 0.01 . 1 . . . . 79 ILE HD1 . 7072 1 864 . 1 1 71 71 ILE HD13 H 1 0.876 0.01 . 1 . . . . 79 ILE HD1 . 7072 1 865 . 1 1 71 71 ILE C C 13 180.264 0.1 . 1 . . . . 79 ILE C . 7072 1 866 . 1 1 71 71 ILE CA C 13 65.753 0.1 . 1 . . . . 79 ILE CA . 7072 1 867 . 1 1 71 71 ILE CB C 13 38.861 0.1 . 1 . . . . 79 ILE CB . 7072 1 868 . 1 1 71 71 ILE CG1 C 13 29.424 0.1 . 1 . . . . 79 ILE CG1 . 7072 1 869 . 1 1 71 71 ILE CG2 C 13 17.25 0.1 . 1 . . . . 79 ILE CG2 . 7072 1 870 . 1 1 71 71 ILE CD1 C 13 13.798 0.1 . 1 . . . . 79 ILE CD1 . 7072 1 871 . 1 1 71 71 ILE N N 15 122.886 0.1 . 1 . . . . 79 ILE N . 7072 1 872 . 1 1 72 72 LEU H H 1 8.966 0.01 . 1 . . . . 80 LEU H . 7072 1 873 . 1 1 72 72 LEU HA H 1 3.955 0.01 . 1 . . . . 80 LEU HA . 7072 1 874 . 1 1 72 72 LEU HB2 H 1 2.12 0.01 . 1 . . . . 80 LEU HB2 . 7072 1 875 . 1 1 72 72 LEU HB3 H 1 1.512 0.01 . 1 . . . . 80 LEU HB3 . 7072 1 876 . 1 1 72 72 LEU HG H 1 1.836 0.01 . 1 . . . . 80 LEU HG . 7072 1 877 . 1 1 72 72 LEU HD11 H 1 0.924 0.01 . 1 . . . . 80 LEU HD1 . 7072 1 878 . 1 1 72 72 LEU HD12 H 1 0.924 0.01 . 1 . . . . 80 LEU HD1 . 7072 1 879 . 1 1 72 72 LEU HD13 H 1 0.924 0.01 . 1 . . . . 80 LEU HD1 . 7072 1 880 . 1 1 72 72 LEU HD21 H 1 0.867 0.01 . 1 . . . . 80 LEU HD2 . 7072 1 881 . 1 1 72 72 LEU HD22 H 1 0.867 0.01 . 1 . . . . 80 LEU HD2 . 7072 1 882 . 1 1 72 72 LEU HD23 H 1 0.867 0.01 . 1 . . . . 80 LEU HD2 . 7072 1 883 . 1 1 72 72 LEU C C 13 179.314 0.1 . 1 . . . . 80 LEU C . 7072 1 884 . 1 1 72 72 LEU CA C 13 59.221 0.1 . 1 . . . . 80 LEU CA . 7072 1 885 . 1 1 72 72 LEU CB C 13 41.378 0.1 . 1 . . . . 80 LEU CB . 7072 1 886 . 1 1 72 72 LEU CG C 13 28.117 0.1 . 1 . . . . 80 LEU CG . 7072 1 887 . 1 1 72 72 LEU CD1 C 13 24.454 0.1 . 1 . . . . 80 LEU CD1 . 7072 1 888 . 1 1 72 72 LEU CD2 C 13 25.903 0.1 . 1 . . . . 80 LEU CD2 . 7072 1 889 . 1 1 72 72 LEU N N 15 120.513 0.1 . 1 . . . . 80 LEU N . 7072 1 890 . 1 1 73 73 SER H H 1 8.247 0.01 . 1 . . . . 81 SER H . 7072 1 891 . 1 1 73 73 SER HA H 1 4.457 0.01 . 1 . . . . 81 SER HA . 7072 1 892 . 1 1 73 73 SER HB2 H 1 4.222 0.01 . 1 . . . . 81 SER HB2 . 7072 1 893 . 1 1 73 73 SER HB3 H 1 4.222 0.01 . 1 . . . . 81 SER HB3 . 7072 1 894 . 1 1 73 73 SER C C 13 174.53 0.1 . 1 . . . . 81 SER C . 7072 1 895 . 1 1 73 73 SER CA C 13 61.149 0.1 . 1 . . . . 81 SER CA . 7072 1 896 . 1 1 73 73 SER CB C 13 63.512 0.1 . 1 . . . . 81 SER CB . 7072 1 897 . 1 1 73 73 SER N N 15 113.227 0.1 . 1 . . . . 81 SER N . 7072 1 898 . 1 1 74 74 GLN H H 1 7.493 0.01 . 1 . . . . 82 GLN H . 7072 1 899 . 1 1 74 74 GLN HA H 1 4.488 0.01 . 1 . . . . 82 GLN HA . 7072 1 900 . 1 1 74 74 GLN HB2 H 1 2.313 0.01 . 1 . . . . 82 GLN HB2 . 7072 1 901 . 1 1 74 74 GLN HB3 H 1 2.222 0.01 . 1 . . . . 82 GLN HB3 . 7072 1 902 . 1 1 74 74 GLN HG2 H 1 2.696 0.01 . 1 . . . . 82 GLN HG2 . 7072 1 903 . 1 1 74 74 GLN HG3 H 1 2.587 0.01 . 1 . . . . 82 GLN HG3 . 7072 1 904 . 1 1 74 74 GLN HE21 H 1 6.848 0.01 . 1 . . . . 82 GLN HE21 . 7072 1 905 . 1 1 74 74 GLN HE22 H 1 7.363 0.01 . 1 . . . . 82 GLN HE22 . 7072 1 906 . 1 1 74 74 GLN C C 13 176.371 0.1 . 1 . . . . 82 GLN C . 7072 1 907 . 1 1 74 74 GLN CA C 13 55.887 0.1 . 1 . . . . 82 GLN CA . 7072 1 908 . 1 1 74 74 GLN CB C 13 29.279 0.1 . 1 . . . . 82 GLN CB . 7072 1 909 . 1 1 74 74 GLN CG C 13 33.971 0.1 . 1 . . . . 82 GLN CG . 7072 1 910 . 1 1 74 74 GLN N N 15 118.439 0.1 . 1 . . . . 82 GLN N . 7072 1 911 . 1 1 74 74 GLN NE2 N 15 110.713 0.1 . 1 . . . . 82 GLN NE2 . 7072 1 912 . 1 1 75 75 GLN H H 1 7.258 0.01 . 1 . . . . 83 GLN H . 7072 1 913 . 1 1 75 75 GLN HA H 1 4.436 0.01 . 1 . . . . 83 GLN HA . 7072 1 914 . 1 1 75 75 GLN HB2 H 1 2.16 0.01 . 1 . . . . 83 GLN HB2 . 7072 1 915 . 1 1 75 75 GLN HB3 H 1 1.961 0.01 . 1 . . . . 83 GLN HB3 . 7072 1 916 . 1 1 75 75 GLN HG2 H 1 3.087 0.01 . 1 . . . . 83 GLN HG2 . 7072 1 917 . 1 1 75 75 GLN HG3 H 1 2.107 0.01 . 1 . . . . 83 GLN HG3 . 7072 1 918 . 1 1 75 75 GLN HE21 H 1 7.172 0.01 . 1 . . . . 83 GLN HE21 . 7072 1 919 . 1 1 75 75 GLN HE22 H 1 7.59 0.01 . 1 . . . . 83 GLN HE22 . 7072 1 920 . 1 1 75 75 GLN C C 13 175.528 0.1 . 1 . . . . 83 GLN C . 7072 1 921 . 1 1 75 75 GLN CA C 13 54.56 0.1 . 1 . . . . 83 GLN CA . 7072 1 922 . 1 1 75 75 GLN CB C 13 28.297 0.1 . 1 . . . . 83 GLN CB . 7072 1 923 . 1 1 75 75 GLN CG C 13 32.161 0.1 . 1 . . . . 83 GLN CG . 7072 1 924 . 1 1 75 75 GLN N N 15 116.273 0.1 . 1 . . . . 83 GLN N . 7072 1 925 . 1 1 75 75 GLN NE2 N 15 114.507 0.1 . 1 . . . . 83 GLN NE2 . 7072 1 926 . 1 1 76 76 ARG H H 1 8.857 0.01 . 1 . . . . 84 ARG H . 7072 1 927 . 1 1 76 76 ARG HA H 1 4.632 0.01 . 1 . . . . 84 ARG HA . 7072 1 928 . 1 1 76 76 ARG HB2 H 1 1.976 0.01 . 1 . . . . 84 ARG HB2 . 7072 1 929 . 1 1 76 76 ARG HB3 H 1 1.81 0.01 . 1 . . . . 84 ARG HB3 . 7072 1 930 . 1 1 76 76 ARG HG2 H 1 1.669 0.01 . 1 . . . . 84 ARG HG2 . 7072 1 931 . 1 1 76 76 ARG HG3 H 1 1.669 0.01 . 1 . . . . 84 ARG HG3 . 7072 1 932 . 1 1 76 76 ARG HD2 H 1 3.079 0.01 . 1 . . . . 84 ARG HD2 . 7072 1 933 . 1 1 76 76 ARG HD3 H 1 3.28 0.01 . 1 . . . . 84 ARG HD3 . 7072 1 934 . 1 1 76 76 ARG C C 13 174.951 0.1 . 1 . . . . 84 ARG C . 7072 1 935 . 1 1 76 76 ARG CA C 13 55.35 0.1 . 1 . . . . 84 ARG CA . 7072 1 936 . 1 1 76 76 ARG CB C 13 33.928 0.1 . 1 . . . . 84 ARG CB . 7072 1 937 . 1 1 76 76 ARG CG C 13 26.65 0.1 . 1 . . . . 84 ARG CG . 7072 1 938 . 1 1 76 76 ARG CD C 13 43.415 0.1 . 1 . . . . 84 ARG CD . 7072 1 939 . 1 1 76 76 ARG N N 15 121.786 0.1 . 1 . . . . 84 ARG N . 7072 1 940 . 1 1 77 77 GLY H H 1 8.556 0.01 . 1 . . . . 85 GLY H . 7072 1 941 . 1 1 77 77 GLY HA2 H 1 4.042 0.01 . 1 . . . . 85 GLY HA2 . 7072 1 942 . 1 1 77 77 GLY HA3 H 1 3.776 0.01 . 1 . . . . 85 GLY HA3 . 7072 1 943 . 1 1 77 77 GLY C C 13 173.108 0.1 . 1 . . . . 85 GLY C . 7072 1 944 . 1 1 77 77 GLY CA C 13 46.482 0.1 . 1 . . . . 85 GLY CA . 7072 1 945 . 1 1 77 77 GLY N N 15 110.047 0.1 . 1 . . . . 85 GLY N . 7072 1 946 . 1 1 78 78 GLU H H 1 8.341 0.01 . 1 . . . . 86 GLU H . 7072 1 947 . 1 1 78 78 GLU HA H 1 4.808 0.01 . 1 . . . . 86 GLU HA . 7072 1 948 . 1 1 78 78 GLU HB2 H 1 2.053 0.01 . 1 . . . . 86 GLU HB2 . 7072 1 949 . 1 1 78 78 GLU HB3 H 1 2.053 0.01 . 1 . . . . 86 GLU HB3 . 7072 1 950 . 1 1 78 78 GLU HG2 H 1 2.247 0.01 . 1 . . . . 86 GLU HG2 . 7072 1 951 . 1 1 78 78 GLU HG3 H 1 2.157 0.01 . 1 . . . . 86 GLU HG3 . 7072 1 952 . 1 1 78 78 GLU C C 13 176.081 0.1 . 1 . . . . 86 GLU C . 7072 1 953 . 1 1 78 78 GLU CA C 13 56.274 0.1 . 1 . . . . 86 GLU CA . 7072 1 954 . 1 1 78 78 GLU CB C 13 30.156 0.076 . 1 . . . . 86 GLU CB . 7072 1 955 . 1 1 78 78 GLU CG C 13 37.209 0.1 . 1 . . . . 86 GLU CG . 7072 1 956 . 1 1 78 78 GLU N N 15 126.005 0.1 . 1 . . . . 86 GLU N . 7072 1 957 . 1 1 79 79 ILE H H 1 9.285 0.01 . 1 . . . . 87 ILE H . 7072 1 958 . 1 1 79 79 ILE HA H 1 4.447 0.01 . 1 . . . . 87 ILE HA . 7072 1 959 . 1 1 79 79 ILE HB H 1 1.734 0.01 . 1 . . . . 87 ILE HB . 7072 1 960 . 1 1 79 79 ILE HG12 H 1 0.698 0.01 . 1 . . . . 87 ILE HG12 . 7072 1 961 . 1 1 79 79 ILE HG13 H 1 1.591 0.01 . 1 . . . . 87 ILE HG13 . 7072 1 962 . 1 1 79 79 ILE HG21 H 1 0.42 0.01 . 1 . . . . 87 ILE HG2 . 7072 1 963 . 1 1 79 79 ILE HG22 H 1 0.42 0.01 . 1 . . . . 87 ILE HG2 . 7072 1 964 . 1 1 79 79 ILE HG23 H 1 0.42 0.01 . 1 . . . . 87 ILE HG2 . 7072 1 965 . 1 1 79 79 ILE HD11 H 1 0.668 0.01 . 1 . . . . 87 ILE HD1 . 7072 1 966 . 1 1 79 79 ILE HD12 H 1 0.668 0.01 . 1 . . . . 87 ILE HD1 . 7072 1 967 . 1 1 79 79 ILE HD13 H 1 0.668 0.01 . 1 . . . . 87 ILE HD1 . 7072 1 968 . 1 1 79 79 ILE C C 13 173.764 0.1 . 1 . . . . 87 ILE C . 7072 1 969 . 1 1 79 79 ILE CA C 13 60.907 0.1 . 1 . . . . 87 ILE CA . 7072 1 970 . 1 1 79 79 ILE CB C 13 40.875 0.1 . 1 . . . . 87 ILE CB . 7072 1 971 . 1 1 79 79 ILE CG1 C 13 27.596 0.1 . 1 . . . . 87 ILE CG1 . 7072 1 972 . 1 1 79 79 ILE CG2 C 13 19.359 0.1 . 1 . . . . 87 ILE CG2 . 7072 1 973 . 1 1 79 79 ILE CD1 C 13 15.711 0.1 . 1 . . . . 87 ILE CD1 . 7072 1 974 . 1 1 79 79 ILE N N 15 128.855 0.1 . 1 . . . . 87 ILE N . 7072 1 975 . 1 1 80 80 GLU H H 1 8.573 0.01 . 1 . . . . 88 GLU H . 7072 1 976 . 1 1 80 80 GLU HA H 1 5.169 0.01 . 1 . . . . 88 GLU HA . 7072 1 977 . 1 1 80 80 GLU HB2 H 1 2.2 0.01 . 1 . . . . 88 GLU HB2 . 7072 1 978 . 1 1 80 80 GLU HB3 H 1 1.982 0.01 . 1 . . . . 88 GLU HB3 . 7072 1 979 . 1 1 80 80 GLU HG2 H 1 1.956 0.01 . 1 . . . . 88 GLU HG2 . 7072 1 980 . 1 1 80 80 GLU HG3 H 1 2.113 0.01 . 1 . . . . 88 GLU HG3 . 7072 1 981 . 1 1 80 80 GLU C C 13 175.86 0.1 . 1 . . . . 88 GLU C . 7072 1 982 . 1 1 80 80 GLU CA C 13 55.038 0.1 . 1 . . . . 88 GLU CA . 7072 1 983 . 1 1 80 80 GLU CB C 13 32.372 0.1 . 1 . . . . 88 GLU CB . 7072 1 984 . 1 1 80 80 GLU CG C 13 37.901 0.1 . 1 . . . . 88 GLU CG . 7072 1 985 . 1 1 80 80 GLU N N 15 127.435 0.1 . 1 . . . . 88 GLU N . 7072 1 986 . 1 1 81 81 PHE H H 1 9.919 0.01 . 1 . . . . 89 PHE H . 7072 1 987 . 1 1 81 81 PHE HA H 1 5.149 0.01 . 1 . . . . 89 PHE HA . 7072 1 988 . 1 1 81 81 PHE HB2 H 1 3.167 0.01 . 1 . . . . 89 PHE HB2 . 7072 1 989 . 1 1 81 81 PHE HB3 H 1 2.967 0.01 . 1 . . . . 89 PHE HB3 . 7072 1 990 . 1 1 81 81 PHE HD1 H 1 7.245 0.01 . 1 . . . . 89 PHE HD1 . 7072 1 991 . 1 1 81 81 PHE HD2 H 1 7.245 0.01 . 1 . . . . 89 PHE HD2 . 7072 1 992 . 1 1 81 81 PHE HE1 H 1 7.095 0.01 . 1 . . . . 89 PHE HE1 . 7072 1 993 . 1 1 81 81 PHE HE2 H 1 7.095 0.01 . 1 . . . . 89 PHE HE2 . 7072 1 994 . 1 1 81 81 PHE C C 13 174.999 0.1 . 1 . . . . 89 PHE C . 7072 1 995 . 1 1 81 81 PHE CA C 13 57.115 0.1 . 1 . . . . 89 PHE CA . 7072 1 996 . 1 1 81 81 PHE CB C 13 42.4 0.1 . 1 . . . . 89 PHE CB . 7072 1 997 . 1 1 81 81 PHE N N 15 128.075 0.1 . 1 . . . . 89 PHE N . 7072 1 998 . 1 1 82 82 GLU H H 1 8.612 0.01 . 1 . . . . 90 GLU H . 7072 1 999 . 1 1 82 82 GLU HA H 1 5.427 0.01 . 1 . . . . 90 GLU HA . 7072 1 1000 . 1 1 82 82 GLU HB2 H 1 2.157 0.01 . 1 . . . . 90 GLU HB2 . 7072 1 1001 . 1 1 82 82 GLU HB3 H 1 1.901 0.01 . 1 . . . . 90 GLU HB3 . 7072 1 1002 . 1 1 82 82 GLU HG2 H 1 2.189 0.01 . 1 . . . . 90 GLU HG2 . 7072 1 1003 . 1 1 82 82 GLU HG3 H 1 2.061 0.01 . 1 . . . . 90 GLU HG3 . 7072 1 1004 . 1 1 82 82 GLU C C 13 176.07 0.1 . 1 . . . . 90 GLU C . 7072 1 1005 . 1 1 82 82 GLU CA C 13 55.902 0.1 . 1 . . . . 90 GLU CA . 7072 1 1006 . 1 1 82 82 GLU CB C 13 31.87 0.1 . 1 . . . . 90 GLU CB . 7072 1 1007 . 1 1 82 82 GLU CG C 13 37.371 0.1 . 1 . . . . 90 GLU CG . 7072 1 1008 . 1 1 82 82 GLU N N 15 123.564 0.1 . 1 . . . . 90 GLU N . 7072 1 1009 . 1 1 83 83 VAL H H 1 9.163 0.01 . 1 . . . . 91 VAL H . 7072 1 1010 . 1 1 83 83 VAL HA H 1 5.943 0.01 . 1 . . . . 91 VAL HA . 7072 1 1011 . 1 1 83 83 VAL HB H 1 2.151 0.01 . 1 . . . . 91 VAL HB . 7072 1 1012 . 1 1 83 83 VAL HG11 H 1 1.025 0.01 . 1 . . . . 91 VAL HG1 . 7072 1 1013 . 1 1 83 83 VAL HG12 H 1 1.025 0.01 . 1 . . . . 91 VAL HG1 . 7072 1 1014 . 1 1 83 83 VAL HG13 H 1 1.025 0.01 . 1 . . . . 91 VAL HG1 . 7072 1 1015 . 1 1 83 83 VAL HG21 H 1 0.878 0.01 . 1 . . . . 91 VAL HG2 . 7072 1 1016 . 1 1 83 83 VAL HG22 H 1 0.878 0.01 . 1 . . . . 91 VAL HG2 . 7072 1 1017 . 1 1 83 83 VAL HG23 H 1 0.878 0.01 . 1 . . . . 91 VAL HG2 . 7072 1 1018 . 1 1 83 83 VAL C C 13 173.954 0.1 . 1 . . . . 91 VAL C . 7072 1 1019 . 1 1 83 83 VAL CA C 13 58.359 0.1 . 1 . . . . 91 VAL CA . 7072 1 1020 . 1 1 83 83 VAL CB C 13 37.528 0.1 . 1 . . . . 91 VAL CB . 7072 1 1021 . 1 1 83 83 VAL CG1 C 13 22.813 0.1 . 1 . . . . 91 VAL CG1 . 7072 1 1022 . 1 1 83 83 VAL CG2 C 13 18.279 0.1 . 1 . . . . 91 VAL CG2 . 7072 1 1023 . 1 1 83 83 VAL N N 15 117.843 0.1 . 1 . . . . 91 VAL N . 7072 1 1024 . 1 1 84 84 VAL H H 1 8.523 0.01 . 1 . . . . 92 VAL H . 7072 1 1025 . 1 1 84 84 VAL HA H 1 4.655 0.01 . 1 . . . . 92 VAL HA . 7072 1 1026 . 1 1 84 84 VAL HB H 1 2.084 0.01 . 1 . . . . 92 VAL HB . 7072 1 1027 . 1 1 84 84 VAL HG11 H 1 0.981 0.01 . 1 . . . . 92 VAL HG1 . 7072 1 1028 . 1 1 84 84 VAL HG12 H 1 0.981 0.01 . 1 . . . . 92 VAL HG1 . 7072 1 1029 . 1 1 84 84 VAL HG13 H 1 0.981 0.01 . 1 . . . . 92 VAL HG1 . 7072 1 1030 . 1 1 84 84 VAL HG21 H 1 0.981 0.01 . 1 . . . . 92 VAL HG2 . 7072 1 1031 . 1 1 84 84 VAL HG22 H 1 0.981 0.01 . 1 . . . . 92 VAL HG2 . 7072 1 1032 . 1 1 84 84 VAL HG23 H 1 0.981 0.01 . 1 . . . . 92 VAL HG2 . 7072 1 1033 . 1 1 84 84 VAL C C 13 172.839 0.1 . 1 . . . . 92 VAL C . 7072 1 1034 . 1 1 84 84 VAL CA C 13 59.921 0.1 . 1 . . . . 92 VAL CA . 7072 1 1035 . 1 1 84 84 VAL CB C 13 35.672 0.1 . 1 . . . . 92 VAL CB . 7072 1 1036 . 1 1 84 84 VAL CG1 C 13 21.3 0.1 . 1 . . . . 92 VAL CG1 . 7072 1 1037 . 1 1 84 84 VAL CG2 C 13 20.851 0.1 . 1 . . . . 92 VAL CG2 . 7072 1 1038 . 1 1 84 84 VAL N N 15 116.486 0.1 . 1 . . . . 92 VAL N . 7072 1 1039 . 1 1 85 85 TYR H H 1 9.068 0.01 . 1 . . . . 93 TYR H . 7072 1 1040 . 1 1 85 85 TYR HA H 1 5.07 0.01 . 1 . . . . 93 TYR HA . 7072 1 1041 . 1 1 85 85 TYR HB2 H 1 3.216 0.01 . 1 . . . . 93 TYR HB2 . 7072 1 1042 . 1 1 85 85 TYR HB3 H 1 2.94 0.01 . 1 . . . . 93 TYR HB3 . 7072 1 1043 . 1 1 85 85 TYR HD1 H 1 7.159 0.01 . 1 . . . . 93 TYR HD1 . 7072 1 1044 . 1 1 85 85 TYR HD2 H 1 7.159 0.01 . 1 . . . . 93 TYR HD2 . 7072 1 1045 . 1 1 85 85 TYR HE1 H 1 6.989 0.01 . 1 . . . . 93 TYR HE1 . 7072 1 1046 . 1 1 85 85 TYR HE2 H 1 6.989 0.01 . 1 . . . . 93 TYR HE2 . 7072 1 1047 . 1 1 85 85 TYR C C 13 175.712 0.1 . 1 . . . . 93 TYR C . 7072 1 1048 . 1 1 85 85 TYR CA C 13 59.472 0.1 . 1 . . . . 93 TYR CA . 7072 1 1049 . 1 1 85 85 TYR CB C 13 38.228 0.1 . 1 . . . . 93 TYR CB . 7072 1 1050 . 1 1 85 85 TYR N N 15 128.798 0.1 . 1 . . . . 93 TYR N . 7072 1 1051 . 1 1 86 86 VAL H H 1 7.512 0.01 . 1 . . . . 94 VAL H . 7072 1 1052 . 1 1 86 86 VAL HA H 1 4.34 0.01 . 1 . . . . 94 VAL HA . 7072 1 1053 . 1 1 86 86 VAL HB H 1 2.133 0.01 . 1 . . . . 94 VAL HB . 7072 1 1054 . 1 1 86 86 VAL HG11 H 1 0.94 0.01 . 1 . . . . 94 VAL HG1 . 7072 1 1055 . 1 1 86 86 VAL HG12 H 1 0.94 0.01 . 1 . . . . 94 VAL HG1 . 7072 1 1056 . 1 1 86 86 VAL HG13 H 1 0.94 0.01 . 1 . . . . 94 VAL HG1 . 7072 1 1057 . 1 1 86 86 VAL HG21 H 1 0.94 0.01 . 1 . . . . 94 VAL HG2 . 7072 1 1058 . 1 1 86 86 VAL HG22 H 1 0.94 0.01 . 1 . . . . 94 VAL HG2 . 7072 1 1059 . 1 1 86 86 VAL HG23 H 1 0.94 0.01 . 1 . . . . 94 VAL HG2 . 7072 1 1060 . 1 1 86 86 VAL CA C 13 61.607 0.1 . 1 . . . . 94 VAL CA . 7072 1 1061 . 1 1 86 86 VAL CB C 13 33.317 0.1 . 1 . . . . 94 VAL CB . 7072 1 1062 . 1 1 86 86 VAL CG1 C 13 21.756 0.1 . 1 . . . . 94 VAL CG1 . 7072 1 1063 . 1 1 86 86 VAL CG2 C 13 21.756 0.1 . 1 . . . . 94 VAL CG2 . 7072 1 1064 . 1 1 86 86 VAL N N 15 124.587 0.1 . 1 . . . . 94 VAL N . 7072 1 1065 . 1 1 87 87 ALA HA H 1 4.139 0.01 . 1 . . . . 95 ALA HA . 7072 1 1066 . 1 1 87 87 ALA HB1 H 1 1.426 0.01 . 1 . . . . 95 ALA HB . 7072 1 1067 . 1 1 87 87 ALA HB2 H 1 1.426 0.01 . 1 . . . . 95 ALA HB . 7072 1 1068 . 1 1 87 87 ALA HB3 H 1 1.426 0.01 . 1 . . . . 95 ALA HB . 7072 1 1069 . 1 1 87 87 ALA C C 13 176.664 0.1 . 1 . . . . 95 ALA C . 7072 1 1070 . 1 1 87 87 ALA CA C 13 52.626 0.1 . 1 . . . . 95 ALA CA . 7072 1 1071 . 1 1 87 87 ALA CB C 13 19.022 0.1 . 1 . . . . 95 ALA CB . 7072 1 stop_ save_