################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15793 _Assigned_chem_shift_list.ID 1 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.03 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 3 '3D CBCA(CO)NH' . . . 15793 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 36 36 ALA HA H 1 4.250 0.020 . 1 . . . . 36 ALA HA . 15793 1 2 . 1 1 36 36 ALA HB1 H 1 1.301 0.020 . 1 . . . . 36 ALA HB . 15793 1 3 . 1 1 36 36 ALA HB2 H 1 1.301 0.020 . 1 . . . . 36 ALA HB . 15793 1 4 . 1 1 36 36 ALA HB3 H 1 1.301 0.020 . 1 . . . . 36 ALA HB . 15793 1 5 . 1 1 36 36 ALA CA C 13 55.550 0.3 . 1 . . . . 36 ALA CA . 15793 1 6 . 1 1 36 36 ALA CB C 13 19.203 0.3 . 1 . . . . 36 ALA CB . 15793 1 7 . 1 1 39 39 ILE HA H 1 4.250 0.020 . 1 . . . . 39 ILE HA . 15793 1 8 . 1 1 39 39 ILE HB H 1 1.692 0.020 . 1 . . . . 39 ILE HB . 15793 1 9 . 1 1 39 39 ILE HD11 H 1 0.696 0.020 . 1 . . . . 39 ILE HD1 . 15793 1 10 . 1 1 39 39 ILE HD12 H 1 0.696 0.020 . 1 . . . . 39 ILE HD1 . 15793 1 11 . 1 1 39 39 ILE HD13 H 1 0.696 0.020 . 1 . . . . 39 ILE HD1 . 15793 1 12 . 1 1 39 39 ILE HG12 H 1 1.331 0.020 . 2 . . . . 39 ILE HG12 . 15793 1 13 . 1 1 39 39 ILE HG13 H 1 0.985 0.020 . 2 . . . . 39 ILE HG13 . 15793 1 14 . 1 1 39 39 ILE HG21 H 1 0.754 0.020 . 1 . . . . 39 ILE HG2 . 15793 1 15 . 1 1 39 39 ILE HG22 H 1 0.754 0.020 . 1 . . . . 39 ILE HG2 . 15793 1 16 . 1 1 39 39 ILE HG23 H 1 0.754 0.020 . 1 . . . . 39 ILE HG2 . 15793 1 17 . 1 1 39 39 ILE CA C 13 58.724 0.3 . 1 . . . . 39 ILE CA . 15793 1 18 . 1 1 39 39 ILE CB C 13 38.496 0.3 . 1 . . . . 39 ILE CB . 15793 1 19 . 1 1 39 39 ILE CD1 C 13 12.822 0.3 . 1 . . . . 39 ILE CD1 . 15793 1 20 . 1 1 39 39 ILE CG1 C 13 26.847 0.3 . 1 . . . . 39 ILE CG1 . 15793 1 21 . 1 1 39 39 ILE CG2 C 13 16.914 0.3 . 1 . . . . 39 ILE CG2 . 15793 1 22 . 1 1 40 40 VAL HA H 1 3.198 0.020 . 1 . . . . 40 VAL HA . 15793 1 23 . 1 1 40 40 VAL HB H 1 1.939 0.020 . 1 . . . . 40 VAL HB . 15793 1 24 . 1 1 40 40 VAL HG11 H 1 1.016 0.020 . 1 . . . . 40 VAL HG1 . 15793 1 25 . 1 1 40 40 VAL HG12 H 1 1.016 0.020 . 1 . . . . 40 VAL HG1 . 15793 1 26 . 1 1 40 40 VAL HG13 H 1 1.016 0.020 . 1 . . . . 40 VAL HG1 . 15793 1 27 . 1 1 40 40 VAL HG21 H 1 0.492 0.020 . 1 . . . . 40 VAL HG2 . 15793 1 28 . 1 1 40 40 VAL HG22 H 1 0.492 0.020 . 1 . . . . 40 VAL HG2 . 15793 1 29 . 1 1 40 40 VAL HG23 H 1 0.492 0.020 . 1 . . . . 40 VAL HG2 . 15793 1 30 . 1 1 40 40 VAL CA C 13 67.086 0.3 . 1 . . . . 40 VAL CA . 15793 1 31 . 1 1 40 40 VAL CB C 13 30.969 0.3 . 1 . . . . 40 VAL CB . 15793 1 32 . 1 1 40 40 VAL CG1 C 13 24.301 0.3 . 1 . . . . 40 VAL CG1 . 15793 1 33 . 1 1 40 40 VAL CG2 C 13 22.240 0.3 . 1 . . . . 40 VAL CG2 . 15793 1 34 . 1 1 42 42 ARG HA H 1 3.770 0.020 . 1 . . . . 42 ARG HA . 15793 1 35 . 1 1 42 42 ARG CA C 13 55.107 0.3 . 1 . . . . 42 ARG CA . 15793 1 36 . 1 1 43 43 VAL H H 1 7.364 0.020 . 1 . . . . 43 VAL H . 15793 1 37 . 1 1 43 43 VAL HA H 1 3.506 0.020 . 1 . . . . 43 VAL HA . 15793 1 38 . 1 1 43 43 VAL HB H 1 2.120 0.020 . 1 . . . . 43 VAL HB . 15793 1 39 . 1 1 43 43 VAL HG11 H 1 0.904 0.020 . 1 . . . . 43 VAL HG1 . 15793 1 40 . 1 1 43 43 VAL HG12 H 1 0.904 0.020 . 1 . . . . 43 VAL HG1 . 15793 1 41 . 1 1 43 43 VAL HG13 H 1 0.904 0.020 . 1 . . . . 43 VAL HG1 . 15793 1 42 . 1 1 43 43 VAL HG21 H 1 0.846 0.020 . 1 . . . . 43 VAL HG2 . 15793 1 43 . 1 1 43 43 VAL HG22 H 1 0.846 0.020 . 1 . . . . 43 VAL HG2 . 15793 1 44 . 1 1 43 43 VAL HG23 H 1 0.846 0.020 . 1 . . . . 43 VAL HG2 . 15793 1 45 . 1 1 43 43 VAL C C 13 178.600 0.3 . 1 . . . . 43 VAL C . 15793 1 46 . 1 1 43 43 VAL CA C 13 66.598 0.3 . 1 . . . . 43 VAL CA . 15793 1 47 . 1 1 43 43 VAL CB C 13 31.203 0.3 . 1 . . . . 43 VAL CB . 15793 1 48 . 1 1 43 43 VAL CG1 C 13 22.526 0.3 . 1 . . . . 43 VAL CG1 . 15793 1 49 . 1 1 43 43 VAL CG2 C 13 20.426 0.3 . 1 . . . . 43 VAL CG2 . 15793 1 50 . 1 1 43 43 VAL N N 15 119.765 0.3 . 1 . . . . 43 VAL N . 15793 1 51 . 1 1 44 44 ILE H H 1 7.829 0.020 . 1 . . . . 44 ILE H . 15793 1 52 . 1 1 44 44 ILE HA H 1 3.242 0.020 . 1 . . . . 44 ILE HA . 15793 1 53 . 1 1 44 44 ILE HB H 1 1.529 0.020 . 1 . . . . 44 ILE HB . 15793 1 54 . 1 1 44 44 ILE HD11 H 1 0.456 0.020 . 1 . . . . 44 ILE HD1 . 15793 1 55 . 1 1 44 44 ILE HD12 H 1 0.456 0.020 . 1 . . . . 44 ILE HD1 . 15793 1 56 . 1 1 44 44 ILE HD13 H 1 0.456 0.020 . 1 . . . . 44 ILE HD1 . 15793 1 57 . 1 1 44 44 ILE HG12 H 1 0.562 0.020 . 1 . . . . 44 ILE HG12 . 15793 1 58 . 1 1 44 44 ILE HG13 H 1 0.562 0.020 . 1 . . . . 44 ILE HG13 . 15793 1 59 . 1 1 44 44 ILE HG21 H 1 0.484 0.020 . 1 . . . . 44 ILE HG2 . 15793 1 60 . 1 1 44 44 ILE HG22 H 1 0.484 0.020 . 1 . . . . 44 ILE HG2 . 15793 1 61 . 1 1 44 44 ILE HG23 H 1 0.484 0.020 . 1 . . . . 44 ILE HG2 . 15793 1 62 . 1 1 44 44 ILE C C 13 178.289 0.3 . 1 . . . . 44 ILE C . 15793 1 63 . 1 1 44 44 ILE CA C 13 66.146 0.3 . 1 . . . . 44 ILE CA . 15793 1 64 . 1 1 44 44 ILE CB C 13 36.869 0.3 . 1 . . . . 44 ILE CB . 15793 1 65 . 1 1 44 44 ILE CD1 C 13 14.927 0.3 . 1 . . . . 44 ILE CD1 . 15793 1 66 . 1 1 44 44 ILE CG1 C 13 29.521 0.3 . 1 . . . . 44 ILE CG1 . 15793 1 67 . 1 1 44 44 ILE CG2 C 13 16.747 0.3 . 1 . . . . 44 ILE CG2 . 15793 1 68 . 1 1 44 44 ILE N N 15 120.991 0.3 . 1 . . . . 44 ILE N . 15793 1 69 . 1 1 45 45 TRP H H 1 9.154 0.020 . 1 . . . . 45 TRP H . 15793 1 70 . 1 1 45 45 TRP HA H 1 4.377 0.020 . 1 . . . . 45 TRP HA . 15793 1 71 . 1 1 45 45 TRP HB2 H 1 3.231 0.020 . 2 . . . . 45 TRP HB2 . 15793 1 72 . 1 1 45 45 TRP HB3 H 1 3.067 0.020 . 2 . . . . 45 TRP HB3 . 15793 1 73 . 1 1 45 45 TRP HD1 H 1 7.140 0.020 . 1 . . . . 45 TRP HD1 . 15793 1 74 . 1 1 45 45 TRP HE1 H 1 10.299 0.020 . 1 . . . . 45 TRP HE1 . 15793 1 75 . 1 1 45 45 TRP HE3 H 1 7.640 0.020 . 1 . . . . 45 TRP HE3 . 15793 1 76 . 1 1 45 45 TRP HZ2 H 1 7.070 0.020 . 1 . . . . 45 TRP HZ2 . 15793 1 77 . 1 1 45 45 TRP C C 13 179.154 0.3 . 1 . . . . 45 TRP C . 15793 1 78 . 1 1 45 45 TRP CA C 13 60.749 0.3 . 1 . . . . 45 TRP CA . 15793 1 79 . 1 1 45 45 TRP CB C 13 28.620 0.3 . 1 . . . . 45 TRP CB . 15793 1 80 . 1 1 45 45 TRP N N 15 119.877 0.3 . 1 . . . . 45 TRP N . 15793 1 81 . 1 1 45 45 TRP NE1 N 15 129.365 0.3 . 1 . . . . 45 TRP NE1 . 15793 1 82 . 1 1 46 46 SER H H 1 7.556 0.020 . 1 . . . . 46 SER H . 15793 1 83 . 1 1 46 46 SER HA H 1 4.247 0.020 . 1 . . . . 46 SER HA . 15793 1 84 . 1 1 46 46 SER HB2 H 1 3.973 0.020 . 1 . . . . 46 SER HB2 . 15793 1 85 . 1 1 46 46 SER HB3 H 1 3.973 0.020 . 1 . . . . 46 SER HB3 . 15793 1 86 . 1 1 46 46 SER C C 13 175.737 0.3 . 1 . . . . 46 SER C . 15793 1 87 . 1 1 46 46 SER CA C 13 61.315 0.3 . 1 . . . . 46 SER CA . 15793 1 88 . 1 1 46 46 SER CB C 13 63.510 0.3 . 1 . . . . 46 SER CB . 15793 1 89 . 1 1 46 46 SER N N 15 113.170 0.3 . 1 . . . . 46 SER N . 15793 1 90 . 1 1 47 47 LEU H H 1 7.667 0.020 . 1 . . . . 47 LEU H . 15793 1 91 . 1 1 47 47 LEU HA H 1 4.274 0.020 . 1 . . . . 47 LEU HA . 15793 1 92 . 1 1 47 47 LEU HB2 H 1 1.551 0.020 . 2 . . . . 47 LEU HB2 . 15793 1 93 . 1 1 47 47 LEU HB3 H 1 1.459 0.020 . 2 . . . . 47 LEU HB3 . 15793 1 94 . 1 1 47 47 LEU HD11 H 1 0.544 0.020 . 1 . . . . 47 LEU HD1 . 15793 1 95 . 1 1 47 47 LEU HD12 H 1 0.544 0.020 . 1 . . . . 47 LEU HD1 . 15793 1 96 . 1 1 47 47 LEU HD13 H 1 0.544 0.020 . 1 . . . . 47 LEU HD1 . 15793 1 97 . 1 1 47 47 LEU HD21 H 1 0.749 0.020 . 1 . . . . 47 LEU HD2 . 15793 1 98 . 1 1 47 47 LEU HD22 H 1 0.749 0.020 . 1 . . . . 47 LEU HD2 . 15793 1 99 . 1 1 47 47 LEU HD23 H 1 0.749 0.020 . 1 . . . . 47 LEU HD2 . 15793 1 100 . 1 1 47 47 LEU HG H 1 1.680 0.020 . 1 . . . . 47 LEU HG . 15793 1 101 . 1 1 47 47 LEU C C 13 178.987 0.3 . 1 . . . . 47 LEU C . 15793 1 102 . 1 1 47 47 LEU CA C 13 55.835 0.3 . 1 . . . . 47 LEU CA . 15793 1 103 . 1 1 47 47 LEU CB C 13 43.548 0.3 . 1 . . . . 47 LEU CB . 15793 1 104 . 1 1 47 47 LEU CD1 C 13 25.689 0.3 . 1 . . . . 47 LEU CD1 . 15793 1 105 . 1 1 47 47 LEU CD2 C 13 22.309 0.3 . 1 . . . . 47 LEU CD2 . 15793 1 106 . 1 1 47 47 LEU CG C 13 26.888 0.3 . 1 . . . . 47 LEU CG . 15793 1 107 . 1 1 47 47 LEU N N 15 120.838 0.3 . 1 . . . . 47 LEU N . 15793 1 108 . 1 1 48 48 GLY H H 1 8.656 0.020 . 1 . . . . 48 GLY H . 15793 1 109 . 1 1 48 48 GLY HA2 H 1 4.373 0.020 . 2 . . . . 48 GLY HA2 . 15793 1 110 . 1 1 48 48 GLY HA3 H 1 3.296 0.020 . 2 . . . . 48 GLY HA3 . 15793 1 111 . 1 1 48 48 GLY C C 13 173.625 0.3 . 1 . . . . 48 GLY C . 15793 1 112 . 1 1 48 48 GLY CA C 13 46.944 0.3 . 1 . . . . 48 GLY CA . 15793 1 113 . 1 1 48 48 GLY N N 15 113.217 0.3 . 1 . . . . 48 GLY N . 15793 1 114 . 1 1 49 49 GLU H H 1 7.347 0.020 . 1 . . . . 49 GLU H . 15793 1 115 . 1 1 49 49 GLU HA H 1 4.830 0.020 . 1 . . . . 49 GLU HA . 15793 1 116 . 1 1 49 49 GLU HB2 H 1 1.947 0.020 . 2 . . . . 49 GLU HB2 . 15793 1 117 . 1 1 49 49 GLU HB3 H 1 1.667 0.020 . 2 . . . . 49 GLU HB3 . 15793 1 118 . 1 1 49 49 GLU HG2 H 1 1.650 0.020 . 1 . . . . 49 GLU HG2 . 15793 1 119 . 1 1 49 49 GLU HG3 H 1 1.650 0.020 . 1 . . . . 49 GLU HG3 . 15793 1 120 . 1 1 49 49 GLU C C 13 174.973 0.3 . 1 . . . . 49 GLU C . 15793 1 121 . 1 1 49 49 GLU CA C 13 55.026 0.3 . 1 . . . . 49 GLU CA . 15793 1 122 . 1 1 49 49 GLU CB C 13 31.947 0.3 . 1 . . . . 49 GLU CB . 15793 1 123 . 1 1 49 49 GLU CG C 13 31.32 0.3 . 1 . . . . 49 GLU CG . 15793 1 124 . 1 1 49 49 GLU N N 15 116.219 0.3 . 1 . . . . 49 GLU N . 15793 1 125 . 1 1 50 50 ALA H H 1 8.598 0.020 . 1 . . . . 50 ALA H . 15793 1 126 . 1 1 50 50 ALA HA H 1 4.817 0.020 . 1 . . . . 50 ALA HA . 15793 1 127 . 1 1 50 50 ALA HB1 H 1 1.256 0.020 . 1 . . . . 50 ALA HB . 15793 1 128 . 1 1 50 50 ALA HB2 H 1 1.256 0.020 . 1 . . . . 50 ALA HB . 15793 1 129 . 1 1 50 50 ALA HB3 H 1 1.256 0.020 . 1 . . . . 50 ALA HB . 15793 1 130 . 1 1 50 50 ALA C C 13 176.042 0.3 . 1 . . . . 50 ALA C . 15793 1 131 . 1 1 50 50 ALA CA C 13 52.189 0.3 . 1 . . . . 50 ALA CA . 15793 1 132 . 1 1 50 50 ALA CB C 13 24.738 0.3 . 1 . . . . 50 ALA CB . 15793 1 133 . 1 1 50 50 ALA N N 15 122.121 0.3 . 1 . . . . 50 ALA N . 15793 1 134 . 1 1 51 51 ARG H H 1 8.935 0.020 . 1 . . . . 51 ARG H . 15793 1 135 . 1 1 51 51 ARG HA H 1 5.098 0.020 . 1 . . . . 51 ARG HA . 15793 1 136 . 1 1 51 51 ARG HB2 H 1 1.650 0.020 . 2 . . . . 51 ARG HB2 . 15793 1 137 . 1 1 51 51 ARG HB3 H 1 2.293 0.020 . 2 . . . . 51 ARG HB3 . 15793 1 138 . 1 1 51 51 ARG HD2 H 1 3.177 0.020 . 2 . . . . 51 ARG HD2 . 15793 1 139 . 1 1 51 51 ARG HD3 H 1 3.083 0.020 . 2 . . . . 51 ARG HD3 . 15793 1 140 . 1 1 51 51 ARG HG2 H 1 1.593 0.020 . 1 . . . . 51 ARG HG2 . 15793 1 141 . 1 1 51 51 ARG HG3 H 1 1.593 0.020 . 1 . . . . 51 ARG HG3 . 15793 1 142 . 1 1 51 51 ARG C C 13 178.696 0.3 . 1 . . . . 51 ARG C . 15793 1 143 . 1 1 51 51 ARG CA C 13 54.995 0.3 . 1 . . . . 51 ARG CA . 15793 1 144 . 1 1 51 51 ARG CB C 13 32.605 0.3 . 1 . . . . 51 ARG CB . 15793 1 145 . 1 1 51 51 ARG CD C 13 43.264 0.3 . 1 . . . . 51 ARG CD . 15793 1 146 . 1 1 51 51 ARG CG C 13 29.108 0.3 . 1 . . . . 51 ARG CG . 15793 1 147 . 1 1 51 51 ARG N N 15 121.019 0.3 . 1 . . . . 51 ARG N . 15793 1 148 . 1 1 52 52 VAL H H 1 9.767 0.020 . 1 . . . . 52 VAL H . 15793 1 149 . 1 1 52 52 VAL HA H 1 3.494 0.020 . 1 . . . . 52 VAL HA . 15793 1 150 . 1 1 52 52 VAL HB H 1 2.139 0.020 . 1 . . . . 52 VAL HB . 15793 1 151 . 1 1 52 52 VAL HG11 H 1 0.926 0.020 . 1 . . . . 52 VAL HG1 . 15793 1 152 . 1 1 52 52 VAL HG12 H 1 0.926 0.020 . 1 . . . . 52 VAL HG1 . 15793 1 153 . 1 1 52 52 VAL HG13 H 1 0.926 0.020 . 1 . . . . 52 VAL HG1 . 15793 1 154 . 1 1 52 52 VAL HG21 H 1 0.889 0.020 . 1 . . . . 52 VAL HG2 . 15793 1 155 . 1 1 52 52 VAL HG22 H 1 0.889 0.020 . 1 . . . . 52 VAL HG2 . 15793 1 156 . 1 1 52 52 VAL HG23 H 1 0.889 0.020 . 1 . . . . 52 VAL HG2 . 15793 1 157 . 1 1 52 52 VAL C C 13 176.292 0.3 . 1 . . . . 52 VAL C . 15793 1 158 . 1 1 52 52 VAL CA C 13 67.295 0.3 . 1 . . . . 52 VAL CA . 15793 1 159 . 1 1 52 52 VAL CB C 13 31.427 0.3 . 1 . . . . 52 VAL CB . 15793 1 160 . 1 1 52 52 VAL CG1 C 13 22.879 0.3 . 1 . . . . 52 VAL CG1 . 15793 1 161 . 1 1 52 52 VAL CG2 C 13 20.447 0.3 . 1 . . . . 52 VAL CG2 . 15793 1 162 . 1 1 52 52 VAL N N 15 121.483 0.3 . 1 . . . . 52 VAL N . 15793 1 163 . 1 1 53 53 ASP H H 1 8.640 0.020 . 1 . . . . 53 ASP H . 15793 1 164 . 1 1 53 53 ASP HA H 1 4.199 0.020 . 1 . . . . 53 ASP HA . 15793 1 165 . 1 1 53 53 ASP HB2 H 1 2.496 0.020 . 2 . . . . 53 ASP HB2 . 15793 1 166 . 1 1 53 53 ASP HB3 H 1 2.644 0.020 . 2 . . . . 53 ASP HB3 . 15793 1 167 . 1 1 53 53 ASP C C 13 178.904 0.3 . 1 . . . . 53 ASP C . 15793 1 168 . 1 1 53 53 ASP CA C 13 56.797 0.3 . 1 . . . . 53 ASP CA . 15793 1 169 . 1 1 53 53 ASP CB C 13 39.068 0.3 . 1 . . . . 53 ASP CB . 15793 1 170 . 1 1 53 53 ASP N N 15 116.987 0.3 . 1 . . . . 53 ASP N . 15793 1 171 . 1 1 54 54 GLU H H 1 7.028 0.020 . 1 . . . . 54 GLU H . 15793 1 172 . 1 1 54 54 GLU HA H 1 4.017 0.020 . 1 . . . . 54 GLU HA . 15793 1 173 . 1 1 54 54 GLU HB2 H 1 1.928 0.020 . 2 . . . . 54 GLU HB2 . 15793 1 174 . 1 1 54 54 GLU HB3 H 1 2.370 0.020 . 2 . . . . 54 GLU HB3 . 15793 1 175 . 1 1 54 54 GLU HG2 H 1 2.211 0.020 . 1 . . . . 54 GLU HG2 . 15793 1 176 . 1 1 54 54 GLU C C 13 178.696 0.3 . 1 . . . . 54 GLU C . 15793 1 177 . 1 1 54 54 GLU CA C 13 58.261 0.3 . 1 . . . . 54 GLU CA . 15793 1 178 . 1 1 54 54 GLU CB C 13 30.742 0.3 . 1 . . . . 54 GLU CB . 15793 1 179 . 1 1 54 54 GLU CG C 13 36.998 0.3 . 1 . . . . 54 GLU CG . 15793 1 180 . 1 1 54 54 GLU N N 15 119.862 0.3 . 1 . . . . 54 GLU N . 15793 1 181 . 1 1 55 55 ILE H H 1 7.639 0.020 . 1 . . . . 55 ILE H . 15793 1 182 . 1 1 55 55 ILE HA H 1 3.345 0.020 . 1 . . . . 55 ILE HA . 15793 1 183 . 1 1 55 55 ILE HB H 1 1.687 0.020 . 1 . . . . 55 ILE HB . 15793 1 184 . 1 1 55 55 ILE HD11 H 1 0.406 0.020 . 1 . . . . 55 ILE HD1 . 15793 1 185 . 1 1 55 55 ILE HD12 H 1 0.406 0.020 . 1 . . . . 55 ILE HD1 . 15793 1 186 . 1 1 55 55 ILE HD13 H 1 0.406 0.020 . 1 . . . . 55 ILE HD1 . 15793 1 187 . 1 1 55 55 ILE HG12 H 1 1.258 0.020 . 1 . . . . 55 ILE HG12 . 15793 1 188 . 1 1 55 55 ILE HG13 H 1 1.258 0.020 . 1 . . . . 55 ILE HG13 . 15793 1 189 . 1 1 55 55 ILE HG21 H 1 0.639 0.020 . 1 . . . . 55 ILE HG2 . 15793 1 190 . 1 1 55 55 ILE HG22 H 1 0.639 0.020 . 1 . . . . 55 ILE HG2 . 15793 1 191 . 1 1 55 55 ILE HG23 H 1 0.639 0.020 . 1 . . . . 55 ILE HG2 . 15793 1 192 . 1 1 55 55 ILE C C 13 177.945 0.3 . 1 . . . . 55 ILE C . 15793 1 193 . 1 1 55 55 ILE CA C 13 64.533 0.3 . 1 . . . . 55 ILE CA . 15793 1 194 . 1 1 55 55 ILE CB C 13 38.824 0.3 . 1 . . . . 55 ILE CB . 15793 1 195 . 1 1 55 55 ILE CD1 C 13 14.980 0.3 . 1 . . . . 55 ILE CD1 . 15793 1 196 . 1 1 55 55 ILE CG1 C 13 24.774 0.3 . 1 . . . . 55 ILE CG1 . 15793 1 197 . 1 1 55 55 ILE CG2 C 13 16.734 0.3 . 1 . . . . 55 ILE CG2 . 15793 1 198 . 1 1 55 55 ILE N N 15 118.743 0.3 . 1 . . . . 55 ILE N . 15793 1 199 . 1 1 56 56 TYR H H 1 8.548 0.020 . 1 . . . . 56 TYR H . 15793 1 200 . 1 1 56 56 TYR HA H 1 4.028 0.020 . 1 . . . . 56 TYR HA . 15793 1 201 . 1 1 56 56 TYR HB2 H 1 2.908 0.020 . 2 . . . . 56 TYR HB2 . 15793 1 202 . 1 1 56 56 TYR HB3 H 1 2.874 0.020 . 2 . . . . 56 TYR HB3 . 15793 1 203 . 1 1 56 56 TYR HD1 H 1 6.960 0.020 . 1 . . . . 56 TYR HD1 . 15793 1 204 . 1 1 56 56 TYR HD2 H 1 6.960 0.020 . 1 . . . . 56 TYR HD2 . 15793 1 205 . 1 1 56 56 TYR HE1 H 1 6.630 0.020 . 1 . . . . 56 TYR HE1 . 15793 1 206 . 1 1 56 56 TYR HE2 H 1 6.630 0.020 . 1 . . . . 56 TYR HE2 . 15793 1 207 . 1 1 56 56 TYR C C 13 177.279 0.3 . 1 . . . . 56 TYR C . 15793 1 208 . 1 1 56 56 TYR CA C 13 61.046 0.3 . 1 . . . . 56 TYR CA . 15793 1 209 . 1 1 56 56 TYR CB C 13 38.746 0.3 . 1 . . . . 56 TYR CB . 15793 1 210 . 1 1 56 56 TYR N N 15 117.394 0.3 . 1 . . . . 56 TYR N . 15793 1 211 . 1 1 57 57 ALA H H 1 7.305 0.020 . 1 . . . . 57 ALA H . 15793 1 212 . 1 1 57 57 ALA HA H 1 3.891 0.020 . 1 . . . . 57 ALA HA . 15793 1 213 . 1 1 57 57 ALA HB1 H 1 1.387 0.020 . 1 . . . . 57 ALA HB . 15793 1 214 . 1 1 57 57 ALA HB2 H 1 1.387 0.020 . 1 . . . . 57 ALA HB . 15793 1 215 . 1 1 57 57 ALA HB3 H 1 1.387 0.020 . 1 . . . . 57 ALA HB . 15793 1 216 . 1 1 57 57 ALA C C 13 178.515 0.3 . 1 . . . . 57 ALA C . 15793 1 217 . 1 1 57 57 ALA CA C 13 53.867 0.3 . 1 . . . . 57 ALA CA . 15793 1 218 . 1 1 57 57 ALA CB C 13 18.567 0.3 . 1 . . . . 57 ALA CB . 15793 1 219 . 1 1 57 57 ALA N N 15 116.845 0.3 . 1 . . . . 57 ALA N . 15793 1 220 . 1 1 58 58 GLN H H 1 7.182 0.020 . 1 . . . . 58 GLN H . 15793 1 221 . 1 1 58 58 GLN HA H 1 4.182 0.020 . 1 . . . . 58 GLN HA . 15793 1 222 . 1 1 58 58 GLN HB2 H 1 1.770 0.020 . 2 . . . . 58 GLN HB2 . 15793 1 223 . 1 1 58 58 GLN HB3 H 1 2.261 0.020 . 2 . . . . 58 GLN HB3 . 15793 1 224 . 1 1 58 58 GLN HE21 H 1 7.519 0.020 . 1 . . . . 58 GLN HE21 . 15793 1 225 . 1 1 58 58 GLN HE22 H 1 6.671 0.020 . 1 . . . . 58 GLN HE22 . 15793 1 226 . 1 1 58 58 GLN HG2 H 1 2.373 0.020 . 1 . . . . 58 GLN HG2 . 15793 1 227 . 1 1 58 58 GLN HG3 H 1 2.373 0.020 . 1 . . . . 58 GLN HG3 . 15793 1 228 . 1 1 58 58 GLN C C 13 176.015 0.3 . 1 . . . . 58 GLN C . 15793 1 229 . 1 1 58 58 GLN CA C 13 54.679 0.3 . 1 . . . . 58 GLN CA . 15793 1 230 . 1 1 58 58 GLN CB C 13 29.584 0.3 . 1 . . . . 58 GLN CB . 15793 1 231 . 1 1 58 58 GLN CG C 13 32.830 0.3 . 1 . . . . 58 GLN CG . 15793 1 232 . 1 1 58 58 GLN N N 15 113.228 0.3 . 1 . . . . 58 GLN N . 15793 1 233 . 1 1 58 58 GLN NE2 N 15 112.312 0.3 . 1 . . . . 58 GLN NE2 . 15793 1 234 . 1 1 59 59 ILE H H 1 7.051 0.020 . 1 . . . . 59 ILE H . 15793 1 235 . 1 1 59 59 ILE HA H 1 3.829 0.020 . 1 . . . . 59 ILE HA . 15793 1 236 . 1 1 59 59 ILE HB H 1 1.762 0.020 . 1 . . . . 59 ILE HB . 15793 1 237 . 1 1 59 59 ILE HD11 H 1 0.602 0.020 . 1 . . . . 59 ILE HD1 . 15793 1 238 . 1 1 59 59 ILE HD12 H 1 0.602 0.020 . 1 . . . . 59 ILE HD1 . 15793 1 239 . 1 1 59 59 ILE HD13 H 1 0.602 0.020 . 1 . . . . 59 ILE HD1 . 15793 1 240 . 1 1 59 59 ILE HG12 H 1 1.274 0.020 . 2 . . . . 59 ILE HG12 . 15793 1 241 . 1 1 59 59 ILE HG13 H 1 1.748 0.020 . 2 . . . . 59 ILE HG13 . 15793 1 242 . 1 1 59 59 ILE HG21 H 1 0.479 0.020 . 1 . . . . 59 ILE HG2 . 15793 1 243 . 1 1 59 59 ILE HG22 H 1 0.479 0.020 . 1 . . . . 59 ILE HG2 . 15793 1 244 . 1 1 59 59 ILE HG23 H 1 0.479 0.020 . 1 . . . . 59 ILE HG2 . 15793 1 245 . 1 1 59 59 ILE CA C 13 57.557 0.3 . 1 . . . . 59 ILE CA . 15793 1 246 . 1 1 59 59 ILE CB C 13 36.090 0.3 . 1 . . . . 59 ILE CB . 15793 1 247 . 1 1 59 59 ILE CD1 C 13 10.969 0.3 . 1 . . . . 59 ILE CD1 . 15793 1 248 . 1 1 59 59 ILE CG1 C 13 26.669 0.3 . 1 . . . . 59 ILE CG1 . 15793 1 249 . 1 1 59 59 ILE CG2 C 13 17.298 0.3 . 1 . . . . 59 ILE CG2 . 15793 1 250 . 1 1 59 59 ILE N N 15 121.926 0.3 . 1 . . . . 59 ILE N . 15793 1 251 . 1 1 60 60 PRO HA H 1 4.049 0.020 . 1 . . . . 60 PRO HA . 15793 1 252 . 1 1 60 60 PRO HB2 H 1 2.139 0.020 . 2 . . . . 60 PRO HB2 . 15793 1 253 . 1 1 60 60 PRO HB3 H 1 1.758 0.020 . 2 . . . . 60 PRO HB3 . 15793 1 254 . 1 1 60 60 PRO HD2 H 1 3.697 0.020 . 2 . . . . 60 PRO HD2 . 15793 1 255 . 1 1 60 60 PRO HD3 H 1 3.487 0.020 . 2 . . . . 60 PRO HD3 . 15793 1 256 . 1 1 60 60 PRO HG2 H 1 1.875 0.020 . 2 . . . . 60 PRO HG2 . 15793 1 257 . 1 1 60 60 PRO HG3 H 1 1.811 0.020 . 2 . . . . 60 PRO HG3 . 15793 1 258 . 1 1 60 60 PRO CA C 13 63.775 0.3 . 1 . . . . 60 PRO CA . 15793 1 259 . 1 1 60 60 PRO CB C 13 32.050 0.3 . 1 . . . . 60 PRO CB . 15793 1 260 . 1 1 60 60 PRO CD C 13 51.114 0.3 . 1 . . . . 60 PRO CD . 15793 1 261 . 1 1 60 60 PRO CG C 13 27.238 0.3 . 1 . . . . 60 PRO CG . 15793 1 262 . 1 1 61 61 GLN H H 1 8.772 0.020 . 1 . . . . 61 GLN H . 15793 1 263 . 1 1 61 61 GLN HA H 1 3.772 0.020 . 1 . . . . 61 GLN HA . 15793 1 264 . 1 1 61 61 GLN HB2 H 1 1.902 0.020 . 1 . . . . 61 GLN HB2 . 15793 1 265 . 1 1 61 61 GLN HB3 H 1 1.902 0.020 . 1 . . . . 61 GLN HB3 . 15793 1 266 . 1 1 61 61 GLN HE21 H 1 7.423 0.020 . 1 . . . . 61 GLN HE21 . 15793 1 267 . 1 1 61 61 GLN HE22 H 1 6.687 0.020 . 1 . . . . 61 GLN HE22 . 15793 1 268 . 1 1 61 61 GLN HG2 H 1 2.277 0.020 . 1 . . . . 61 GLN HG2 . 15793 1 269 . 1 1 61 61 GLN HG3 H 1 2.277 0.020 . 1 . . . . 61 GLN HG3 . 15793 1 270 . 1 1 61 61 GLN C C 13 178.654 0.3 . 1 . . . . 61 GLN C . 15793 1 271 . 1 1 61 61 GLN CA C 13 58.761 0.3 . 1 . . . . 61 GLN CA . 15793 1 272 . 1 1 61 61 GLN CB C 13 28.318 0.3 . 1 . . . . 61 GLN CB . 15793 1 273 . 1 1 61 61 GLN CG C 13 33.929 0.3 . 1 . . . . 61 GLN CG . 15793 1 274 . 1 1 61 61 GLN N N 15 126.284 0.3 . 1 . . . . 61 GLN N . 15793 1 275 . 1 1 61 61 GLN NE2 N 15 112.666 0.3 . 1 . . . . 61 GLN NE2 . 15793 1 276 . 1 1 62 62 GLU H H 1 9.471 0.020 . 1 . . . . 62 GLU H . 15793 1 277 . 1 1 62 62 GLU HA H 1 3.971 0.020 . 1 . . . . 62 GLU HA . 15793 1 278 . 1 1 62 62 GLU HB2 H 1 1.821 0.020 . 1 . . . . 62 GLU HB2 . 15793 1 279 . 1 1 62 62 GLU HB3 H 1 1.821 0.020 . 1 . . . . 62 GLU HB3 . 15793 1 280 . 1 1 62 62 GLU HG2 H 1 1.895 0.020 . 2 . . . . 62 GLU HG2 . 15793 1 281 . 1 1 62 62 GLU HG3 H 1 1.737 0.020 . 2 . . . . 62 GLU HG3 . 15793 1 282 . 1 1 62 62 GLU C C 13 177.376 0.3 . 1 . . . . 62 GLU C . 15793 1 283 . 1 1 62 62 GLU CA C 13 58.072 0.3 . 1 . . . . 62 GLU CA . 15793 1 284 . 1 1 62 62 GLU CB C 13 28.164 0.3 . 1 . . . . 62 GLU CB . 15793 1 285 . 1 1 62 62 GLU CG C 13 31.139 0.3 . 1 . . . . 62 GLU CG . 15793 1 286 . 1 1 62 62 GLU N N 15 118.102 0.3 . 1 . . . . 62 GLU N . 15793 1 287 . 1 1 63 63 LEU H H 1 6.792 0.020 . 1 . . . . 63 LEU H . 15793 1 288 . 1 1 63 63 LEU HA H 1 3.717 0.020 . 1 . . . . 63 LEU HA . 15793 1 289 . 1 1 63 63 LEU HB2 H 1 0.722 0.020 . 2 . . . . 63 LEU HB2 . 15793 1 290 . 1 1 63 63 LEU HB3 H 1 0.030 0.020 . 2 . . . . 63 LEU HB3 . 15793 1 291 . 1 1 63 63 LEU HD11 H 1 -0.259 0.020 . 1 . . . . 63 LEU HD1 . 15793 1 292 . 1 1 63 63 LEU HD12 H 1 -0.259 0.020 . 1 . . . . 63 LEU HD1 . 15793 1 293 . 1 1 63 63 LEU HD13 H 1 -0.259 0.020 . 1 . . . . 63 LEU HD1 . 15793 1 294 . 1 1 63 63 LEU HD21 H 1 0.356 0.020 . 1 . . . . 63 LEU HD2 . 15793 1 295 . 1 1 63 63 LEU HD22 H 1 0.356 0.020 . 1 . . . . 63 LEU HD2 . 15793 1 296 . 1 1 63 63 LEU HD23 H 1 0.356 0.020 . 1 . . . . 63 LEU HD2 . 15793 1 297 . 1 1 63 63 LEU HG H 1 0.933 0.020 . 1 . . . . 63 LEU HG . 15793 1 298 . 1 1 63 63 LEU C C 13 176.570 0.3 . 1 . . . . 63 LEU C . 15793 1 299 . 1 1 63 63 LEU CA C 13 56.173 0.3 . 1 . . . . 63 LEU CA . 15793 1 300 . 1 1 63 63 LEU CB C 13 39.610 0.3 . 1 . . . . 63 LEU CB . 15793 1 301 . 1 1 63 63 LEU CD1 C 13 24.302 0.3 . 1 . . . . 63 LEU CD1 . 15793 1 302 . 1 1 63 63 LEU CD2 C 13 21.543 0.3 . 1 . . . . 63 LEU CD2 . 15793 1 303 . 1 1 63 63 LEU CG C 13 26.622 0.3 . 1 . . . . 63 LEU CG . 15793 1 304 . 1 1 63 63 LEU N N 15 118.573 0.3 . 1 . . . . 63 LEU N . 15793 1 305 . 1 1 64 64 GLU H H 1 7.589 0.020 . 1 . . . . 64 GLU H . 15793 1 306 . 1 1 64 64 GLU HA H 1 3.782 0.020 . 1 . . . . 64 GLU HA . 15793 1 307 . 1 1 64 64 GLU HB2 H 1 2.055 0.020 . 1 . . . . 64 GLU HB2 . 15793 1 308 . 1 1 64 64 GLU HB3 H 1 2.055 0.020 . 1 . . . . 64 GLU HB3 . 15793 1 309 . 1 1 64 64 GLU HG2 H 1 2.013 0.020 . 2 . . . . 64 GLU HG2 . 15793 1 310 . 1 1 64 64 GLU HG3 H 1 2.055 0.020 . 2 . . . . 64 GLU HG3 . 15793 1 311 . 1 1 64 64 GLU C C 13 176.723 0.3 . 1 . . . . 64 GLU C . 15793 1 312 . 1 1 64 64 GLU CA C 13 57.031 0.3 . 1 . . . . 64 GLU CA . 15793 1 313 . 1 1 64 64 GLU CB C 13 26.951 0.3 . 1 . . . . 64 GLU CB . 15793 1 314 . 1 1 64 64 GLU CG C 13 36.460 0.3 . 1 . . . . 64 GLU CG . 15793 1 315 . 1 1 64 64 GLU N N 15 112.960 0.3 . 1 . . . . 64 GLU N . 15793 1 316 . 1 1 65 65 TRP H H 1 8.340 0.020 . 1 . . . . 65 TRP H . 15793 1 317 . 1 1 65 65 TRP HA H 1 5.097 0.020 . 1 . . . . 65 TRP HA . 15793 1 318 . 1 1 65 65 TRP HB2 H 1 3.061 0.020 . 1 . . . . 65 TRP HB2 . 15793 1 319 . 1 1 65 65 TRP HB3 H 1 3.061 0.020 . 1 . . . . 65 TRP HB3 . 15793 1 320 . 1 1 65 65 TRP HD1 H 1 6.863 0.020 . 1 . . . . 65 TRP HD1 . 15793 1 321 . 1 1 65 65 TRP HE1 H 1 9.896 0.020 . 1 . . . . 65 TRP HE1 . 15793 1 322 . 1 1 65 65 TRP HZ2 H 1 7.190 0.020 . 1 . . . . 65 TRP HZ2 . 15793 1 323 . 1 1 65 65 TRP CA C 13 54.697 0.3 . 1 . . . . 65 TRP CA . 15793 1 324 . 1 1 65 65 TRP CB C 13 30.450 0.3 . 1 . . . . 65 TRP CB . 15793 1 325 . 1 1 65 65 TRP N N 15 119.866 0.3 . 1 . . . . 65 TRP N . 15793 1 326 . 1 1 65 65 TRP NE1 N 15 126.441 0.3 . 1 . . . . 65 TRP NE1 . 15793 1 327 . 1 1 66 66 SER HA H 1 4.700 0.020 . 1 . . . . 66 SER HA . 15793 1 328 . 1 1 66 66 SER HB2 H 1 4.246 0.020 . 2 . . . . 66 SER HB2 . 15793 1 329 . 1 1 66 66 SER HB3 H 1 3.959 0.020 . 2 . . . . 66 SER HB3 . 15793 1 330 . 1 1 66 66 SER CA C 13 56.340 0.3 . 1 . . . . 66 SER CA . 15793 1 331 . 1 1 66 66 SER CB C 13 66.184 0.3 . 1 . . . . 66 SER CB . 15793 1 332 . 1 1 67 67 LEU H H 1 8.622 0.020 . 1 . . . . 67 LEU H . 15793 1 333 . 1 1 67 67 LEU HA H 1 3.357 0.020 . 1 . . . . 67 LEU HA . 15793 1 334 . 1 1 67 67 LEU HB2 H 1 1.335 0.020 . 2 . . . . 67 LEU HB2 . 15793 1 335 . 1 1 67 67 LEU HB3 H 1 0.846 0.020 . 2 . . . . 67 LEU HB3 . 15793 1 336 . 1 1 67 67 LEU HD11 H 1 0.551 0.020 . 1 . . . . 67 LEU HD1 . 15793 1 337 . 1 1 67 67 LEU HD12 H 1 0.551 0.020 . 1 . . . . 67 LEU HD1 . 15793 1 338 . 1 1 67 67 LEU HD13 H 1 0.551 0.020 . 1 . . . . 67 LEU HD1 . 15793 1 339 . 1 1 67 67 LEU HD21 H 1 0.455 0.020 . 1 . . . . 67 LEU HD2 . 15793 1 340 . 1 1 67 67 LEU HD22 H 1 0.455 0.020 . 1 . . . . 67 LEU HD2 . 15793 1 341 . 1 1 67 67 LEU HD23 H 1 0.455 0.020 . 1 . . . . 67 LEU HD2 . 15793 1 342 . 1 1 67 67 LEU HG H 1 1.021 0.020 . 1 . . . . 67 LEU HG . 15793 1 343 . 1 1 67 67 LEU C C 13 178.779 0.3 . 1 . . . . 67 LEU C . 15793 1 344 . 1 1 67 67 LEU CA C 13 58.385 0.3 . 1 . . . . 67 LEU CA . 15793 1 345 . 1 1 67 67 LEU CB C 13 41.218 0.3 . 1 . . . . 67 LEU CB . 15793 1 346 . 1 1 67 67 LEU CD1 C 13 25.065 0.3 . 1 . . . . 67 LEU CD1 . 15793 1 347 . 1 1 67 67 LEU CD2 C 13 23.353 0.3 . 1 . . . . 67 LEU CD2 . 15793 1 348 . 1 1 67 67 LEU CG C 13 26.539 0.3 . 1 . . . . 67 LEU CG . 15793 1 349 . 1 1 67 67 LEU N N 15 123.216 0.3 . 1 . . . . 67 LEU N . 15793 1 350 . 1 1 68 68 ALA H H 1 7.987 0.020 . 1 . . . . 68 ALA H . 15793 1 351 . 1 1 68 68 ALA HA H 1 3.766 0.020 . 1 . . . . 68 ALA HA . 15793 1 352 . 1 1 68 68 ALA HB1 H 1 1.214 0.020 . 1 . . . . 68 ALA HB . 15793 1 353 . 1 1 68 68 ALA HB2 H 1 1.214 0.020 . 1 . . . . 68 ALA HB . 15793 1 354 . 1 1 68 68 ALA HB3 H 1 1.214 0.020 . 1 . . . . 68 ALA HB . 15793 1 355 . 1 1 68 68 ALA C C 13 180.626 0.3 . 1 . . . . 68 ALA C . 15793 1 356 . 1 1 68 68 ALA CA C 13 55.431 0.3 . 1 . . . . 68 ALA CA . 15793 1 357 . 1 1 68 68 ALA CB C 13 17.780 0.3 . 1 . . . . 68 ALA CB . 15793 1 358 . 1 1 68 68 ALA N N 15 119.912 0.3 . 1 . . . . 68 ALA N . 15793 1 359 . 1 1 69 69 THR H H 1 7.781 0.020 . 1 . . . . 69 THR H . 15793 1 360 . 1 1 69 69 THR HA H 1 3.477 0.020 . 1 . . . . 69 THR HA . 15793 1 361 . 1 1 69 69 THR HB H 1 4.098 0.020 . 1 . . . . 69 THR HB . 15793 1 362 . 1 1 69 69 THR HG21 H 1 0.146 0.020 . 1 . . . . 69 THR HG2 . 15793 1 363 . 1 1 69 69 THR HG22 H 1 0.146 0.020 . 1 . . . . 69 THR HG2 . 15793 1 364 . 1 1 69 69 THR HG23 H 1 0.146 0.020 . 1 . . . . 69 THR HG2 . 15793 1 365 . 1 1 69 69 THR C C 13 176.154 0.3 . 1 . . . . 69 THR C . 15793 1 366 . 1 1 69 69 THR CA C 13 66.975 0.3 . 1 . . . . 69 THR CA . 15793 1 367 . 1 1 69 69 THR CB C 13 68.525 0.3 . 1 . . . . 69 THR CB . 15793 1 368 . 1 1 69 69 THR CG2 C 13 20.413 0.3 . 1 . . . . 69 THR CG2 . 15793 1 369 . 1 1 69 69 THR N N 15 118.256 0.3 . 1 . . . . 69 THR N . 15793 1 370 . 1 1 70 70 VAL H H 1 7.373 0.020 . 1 . . . . 70 VAL H . 15793 1 371 . 1 1 70 70 VAL HA H 1 3.201 0.020 . 1 . . . . 70 VAL HA . 15793 1 372 . 1 1 70 70 VAL HB H 1 2.177 0.020 . 1 . . . . 70 VAL HB . 15793 1 373 . 1 1 70 70 VAL HG11 H 1 1.264 0.020 . 1 . . . . 70 VAL HG1 . 15793 1 374 . 1 1 70 70 VAL HG12 H 1 1.264 0.020 . 1 . . . . 70 VAL HG1 . 15793 1 375 . 1 1 70 70 VAL HG13 H 1 1.264 0.020 . 1 . . . . 70 VAL HG1 . 15793 1 376 . 1 1 70 70 VAL HG21 H 1 0.764 0.020 . 1 . . . . 70 VAL HG2 . 15793 1 377 . 1 1 70 70 VAL HG22 H 1 0.764 0.020 . 1 . . . . 70 VAL HG2 . 15793 1 378 . 1 1 70 70 VAL HG23 H 1 0.764 0.020 . 1 . . . . 70 VAL HG2 . 15793 1 379 . 1 1 70 70 VAL C C 13 177.265 0.3 . 1 . . . . 70 VAL C . 15793 1 380 . 1 1 70 70 VAL CA C 13 67.795 0.3 . 1 . . . . 70 VAL CA . 15793 1 381 . 1 1 70 70 VAL CB C 13 31.342 0.3 . 1 . . . . 70 VAL CB . 15793 1 382 . 1 1 70 70 VAL CG1 C 13 24.741 0.3 . 1 . . . . 70 VAL CG1 . 15793 1 383 . 1 1 70 70 VAL CG2 C 13 21.234 0.3 . 1 . . . . 70 VAL CG2 . 15793 1 384 . 1 1 70 70 VAL N N 15 120.502 0.3 . 1 . . . . 70 VAL N . 15793 1 385 . 1 1 71 71 LYS H H 1 8.521 0.020 . 1 . . . . 71 LYS H . 15793 1 386 . 1 1 71 71 LYS HA H 1 3.659 0.020 . 1 . . . . 71 LYS HA . 15793 1 387 . 1 1 71 71 LYS HB2 H 1 1.724 0.020 . 1 . . . . 71 LYS HB2 . 15793 1 388 . 1 1 71 71 LYS HB3 H 1 1.724 0.020 . 1 . . . . 71 LYS HB3 . 15793 1 389 . 1 1 71 71 LYS HD2 H 1 1.495 0.020 . 1 . . . . 71 LYS HD2 . 15793 1 390 . 1 1 71 71 LYS HD3 H 1 1.495 0.020 . 1 . . . . 71 LYS HD3 . 15793 1 391 . 1 1 71 71 LYS HE2 H 1 2.638 0.020 . 2 . . . . 71 LYS HE2 . 15793 1 392 . 1 1 71 71 LYS HE3 H 1 2.822 0.020 . 2 . . . . 71 LYS HE3 . 15793 1 393 . 1 1 71 71 LYS HG2 H 1 1.414 0.020 . 2 . . . . 71 LYS HG2 . 15793 1 394 . 1 1 71 71 LYS HG3 H 1 1.240 0.020 . 2 . . . . 71 LYS HG3 . 15793 1 395 . 1 1 71 71 LYS C C 13 180.154 0.3 . 1 . . . . 71 LYS C . 15793 1 396 . 1 1 71 71 LYS CA C 13 61.155 0.3 . 1 . . . . 71 LYS CA . 15793 1 397 . 1 1 71 71 LYS CB C 13 32.114 0.3 . 1 . . . . 71 LYS CB . 15793 1 398 . 1 1 71 71 LYS CD C 13 29.519 0.3 . 1 . . . . 71 LYS CD . 15793 1 399 . 1 1 71 71 LYS CE C 13 41.548 0.3 . 1 . . . . 71 LYS CE . 15793 1 400 . 1 1 71 71 LYS CG C 13 25.886 0.3 . 1 . . . . 71 LYS CG . 15793 1 401 . 1 1 71 71 LYS N N 15 118.966 0.3 . 1 . . . . 71 LYS N . 15793 1 402 . 1 1 72 72 THR H H 1 8.160 0.020 . 1 . . . . 72 THR H . 15793 1 403 . 1 1 72 72 THR HA H 1 3.747 0.020 . 1 . . . . 72 THR HA . 15793 1 404 . 1 1 72 72 THR HB H 1 4.104 0.020 . 1 . . . . 72 THR HB . 15793 1 405 . 1 1 72 72 THR HG21 H 1 0.962 0.020 . 1 . . . . 72 THR HG2 . 15793 1 406 . 1 1 72 72 THR HG22 H 1 0.962 0.020 . 1 . . . . 72 THR HG2 . 15793 1 407 . 1 1 72 72 THR HG23 H 1 0.962 0.020 . 1 . . . . 72 THR HG2 . 15793 1 408 . 1 1 72 72 THR C C 13 177.209 0.3 . 1 . . . . 72 THR C . 15793 1 409 . 1 1 72 72 THR CA C 13 66.978 0.3 . 1 . . . . 72 THR CA . 15793 1 410 . 1 1 72 72 THR CB C 13 68.268 0.3 . 1 . . . . 72 THR CB . 15793 1 411 . 1 1 72 72 THR CG2 C 13 21.242 0.3 . 1 . . . . 72 THR CG2 . 15793 1 412 . 1 1 72 72 THR N N 15 119.017 0.3 . 1 . . . . 72 THR N . 15793 1 413 . 1 1 73 73 LEU H H 1 7.753 0.020 . 1 . . . . 73 LEU H . 15793 1 414 . 1 1 73 73 LEU HA H 1 3.682 0.020 . 1 . . . . 73 LEU HA . 15793 1 415 . 1 1 73 73 LEU HB2 H 1 1.779 0.020 . 1 . . . . 73 LEU HB2 . 15793 1 416 . 1 1 73 73 LEU HB3 H 1 1.779 0.020 . 1 . . . . 73 LEU HB3 . 15793 1 417 . 1 1 73 73 LEU HD11 H 1 -0.056 0.020 . 1 . . . . 73 LEU HD1 . 15793 1 418 . 1 1 73 73 LEU HD12 H 1 -0.056 0.020 . 1 . . . . 73 LEU HD1 . 15793 1 419 . 1 1 73 73 LEU HD13 H 1 -0.056 0.020 . 1 . . . . 73 LEU HD1 . 15793 1 420 . 1 1 73 73 LEU HD21 H 1 0.442 0.020 . 1 . . . . 73 LEU HD2 . 15793 1 421 . 1 1 73 73 LEU HD22 H 1 0.442 0.020 . 1 . . . . 73 LEU HD2 . 15793 1 422 . 1 1 73 73 LEU HD23 H 1 0.442 0.020 . 1 . . . . 73 LEU HD2 . 15793 1 423 . 1 1 73 73 LEU HG H 1 0.025 0.020 . 1 . . . . 73 LEU HG . 15793 1 424 . 1 1 73 73 LEU C C 13 178.821 0.3 . 1 . . . . 73 LEU C . 15793 1 425 . 1 1 73 73 LEU CA C 13 58.671 0.3 . 1 . . . . 73 LEU CA . 15793 1 426 . 1 1 73 73 LEU CB C 13 42.182 0.3 . 1 . . . . 73 LEU CB . 15793 1 427 . 1 1 73 73 LEU CD1 C 13 27.044 0.3 . 1 . . . . 73 LEU CD1 . 15793 1 428 . 1 1 73 73 LEU CD2 C 13 23.157 0.3 . 1 . . . . 73 LEU CD2 . 15793 1 429 . 1 1 73 73 LEU CG C 13 27.004 0.3 . 1 . . . . 73 LEU CG . 15793 1 430 . 1 1 73 73 LEU N N 15 123.340 0.3 . 1 . . . . 73 LEU N . 15793 1 431 . 1 1 74 74 LEU H H 1 8.341 0.020 . 1 . . . . 74 LEU H . 15793 1 432 . 1 1 74 74 LEU HA H 1 3.551 0.020 . 1 . . . . 74 LEU HA . 15793 1 433 . 1 1 74 74 LEU HB2 H 1 1.560 0.020 . 2 . . . . 74 LEU HB2 . 15793 1 434 . 1 1 74 74 LEU HB3 H 1 1.500 0.020 . 2 . . . . 74 LEU HB3 . 15793 1 435 . 1 1 74 74 LEU HD11 H 1 0.158 0.020 . 1 . . . . 74 LEU HD1 . 15793 1 436 . 1 1 74 74 LEU HD12 H 1 0.158 0.020 . 1 . . . . 74 LEU HD1 . 15793 1 437 . 1 1 74 74 LEU HD13 H 1 0.158 0.020 . 1 . . . . 74 LEU HD1 . 15793 1 438 . 1 1 74 74 LEU HD21 H 1 -0.140 0.020 . 1 . . . . 74 LEU HD2 . 15793 1 439 . 1 1 74 74 LEU HD22 H 1 -0.140 0.020 . 1 . . . . 74 LEU HD2 . 15793 1 440 . 1 1 74 74 LEU HD23 H 1 -0.140 0.020 . 1 . . . . 74 LEU HD2 . 15793 1 441 . 1 1 74 74 LEU HG H 1 1.360 0.020 . 1 . . . . 74 LEU HG . 15793 1 442 . 1 1 74 74 LEU C C 13 178.832 0.3 . 1 . . . . 74 LEU C . 15793 1 443 . 1 1 74 74 LEU CA C 13 58.293 0.3 . 1 . . . . 74 LEU CA . 15793 1 444 . 1 1 74 74 LEU CB C 13 40.530 0.3 . 1 . . . . 74 LEU CB . 15793 1 445 . 1 1 74 74 LEU CD1 C 13 26.057 0.3 . 1 . . . . 74 LEU CD1 . 15793 1 446 . 1 1 74 74 LEU CD2 C 13 22.961 0.3 . 1 . . . . 74 LEU CD2 . 15793 1 447 . 1 1 74 74 LEU CG C 13 25.998 0.3 . 1 . . . . 74 LEU CG . 15793 1 448 . 1 1 74 74 LEU N N 15 118.538 0.3 . 1 . . . . 74 LEU N . 15793 1 449 . 1 1 75 75 GLY H H 1 7.780 0.020 . 1 . . . . 75 GLY H . 15793 1 450 . 1 1 75 75 GLY HA2 H 1 3.648 0.020 . 2 . . . . 75 GLY HA2 . 15793 1 451 . 1 1 75 75 GLY HA3 H 1 3.767 0.020 . 2 . . . . 75 GLY HA3 . 15793 1 452 . 1 1 75 75 GLY C C 13 177.626 0.3 . 1 . . . . 75 GLY C . 15793 1 453 . 1 1 75 75 GLY CA C 13 47.290 0.3 . 1 . . . . 75 GLY CA . 15793 1 454 . 1 1 75 75 GLY N N 15 103.878 0.3 . 1 . . . . 75 GLY N . 15793 1 455 . 1 1 76 76 ARG H H 1 7.637 0.020 . 1 . . . . 76 ARG H . 15793 1 456 . 1 1 76 76 ARG HA H 1 3.908 0.020 . 1 . . . . 76 ARG HA . 15793 1 457 . 1 1 76 76 ARG HB2 H 1 1.926 0.020 . 2 . . . . 76 ARG HB2 . 15793 1 458 . 1 1 76 76 ARG HB3 H 1 1.885 0.020 . 2 . . . . 76 ARG HB3 . 15793 1 459 . 1 1 76 76 ARG HD2 H 1 2.972 0.020 . 2 . . . . 76 ARG HD2 . 15793 1 460 . 1 1 76 76 ARG HD3 H 1 3.004 0.020 . 2 . . . . 76 ARG HD3 . 15793 1 461 . 1 1 76 76 ARG HG2 H 1 1.566 0.020 . 2 . . . . 76 ARG HG2 . 15793 1 462 . 1 1 76 76 ARG HG3 H 1 1.708 0.020 . 2 . . . . 76 ARG HG3 . 15793 1 463 . 1 1 76 76 ARG C C 13 179.001 0.3 . 1 . . . . 76 ARG C . 15793 1 464 . 1 1 76 76 ARG CA C 13 59.378 0.3 . 1 . . . . 76 ARG CA . 15793 1 465 . 1 1 76 76 ARG CB C 13 30.767 0.3 . 1 . . . . 76 ARG CB . 15793 1 466 . 1 1 76 76 ARG CD C 13 43.956 0.3 . 1 . . . . 76 ARG CD . 15793 1 467 . 1 1 76 76 ARG CG C 13 27.029 0.3 . 1 . . . . 76 ARG CG . 15793 1 468 . 1 1 76 76 ARG N N 15 122.469 0.3 . 1 . . . . 76 ARG N . 15793 1 469 . 1 1 77 77 LEU H H 1 7.922 0.020 . 1 . . . . 77 LEU H . 15793 1 470 . 1 1 77 77 LEU HA H 1 3.812 0.020 . 1 . . . . 77 LEU HA . 15793 1 471 . 1 1 77 77 LEU HB2 H 1 1.476 0.020 . 2 . . . . 77 LEU HB2 . 15793 1 472 . 1 1 77 77 LEU HB3 H 1 1.240 0.020 . 2 . . . . 77 LEU HB3 . 15793 1 473 . 1 1 77 77 LEU HD11 H 1 0.643 0.020 . 1 . . . . 77 LEU HD1 . 15793 1 474 . 1 1 77 77 LEU HD12 H 1 0.643 0.020 . 1 . . . . 77 LEU HD1 . 15793 1 475 . 1 1 77 77 LEU HD13 H 1 0.643 0.020 . 1 . . . . 77 LEU HD1 . 15793 1 476 . 1 1 77 77 LEU HD21 H 1 0.784 0.020 . 1 . . . . 77 LEU HD2 . 15793 1 477 . 1 1 77 77 LEU HD22 H 1 0.784 0.020 . 1 . . . . 77 LEU HD2 . 15793 1 478 . 1 1 77 77 LEU HD23 H 1 0.784 0.020 . 1 . . . . 77 LEU HD2 . 15793 1 479 . 1 1 77 77 LEU HG H 1 1.336 0.020 . 1 . . . . 77 LEU HG . 15793 1 480 . 1 1 77 77 LEU C C 13 179.835 0.3 . 1 . . . . 77 LEU C . 15793 1 481 . 1 1 77 77 LEU CA C 13 58.306 0.3 . 1 . . . . 77 LEU CA . 15793 1 482 . 1 1 77 77 LEU CB C 13 42.365 0.3 . 1 . . . . 77 LEU CB . 15793 1 483 . 1 1 77 77 LEU CD1 C 13 24.566 0.3 . 1 . . . . 77 LEU CD1 . 15793 1 484 . 1 1 77 77 LEU CD2 C 13 23.424 0.3 . 1 . . . . 77 LEU CD2 . 15793 1 485 . 1 1 77 77 LEU CG C 13 26.768 0.3 . 1 . . . . 77 LEU CG . 15793 1 486 . 1 1 77 77 LEU N N 15 120.640 0.3 . 1 . . . . 77 LEU N . 15793 1 487 . 1 1 78 78 VAL H H 1 8.287 0.020 . 1 . . . . 78 VAL H . 15793 1 488 . 1 1 78 78 VAL HA H 1 3.950 0.020 . 1 . . . . 78 VAL HA . 15793 1 489 . 1 1 78 78 VAL HB H 1 2.073 0.020 . 1 . . . . 78 VAL HB . 15793 1 490 . 1 1 78 78 VAL HG11 H 1 0.936 0.020 . 1 . . . . 78 VAL HG1 . 15793 1 491 . 1 1 78 78 VAL HG12 H 1 0.936 0.020 . 1 . . . . 78 VAL HG1 . 15793 1 492 . 1 1 78 78 VAL HG13 H 1 0.936 0.020 . 1 . . . . 78 VAL HG1 . 15793 1 493 . 1 1 78 78 VAL HG21 H 1 0.839 0.020 . 1 . . . . 78 VAL HG2 . 15793 1 494 . 1 1 78 78 VAL HG22 H 1 0.839 0.020 . 1 . . . . 78 VAL HG2 . 15793 1 495 . 1 1 78 78 VAL HG23 H 1 0.839 0.020 . 1 . . . . 78 VAL HG2 . 15793 1 496 . 1 1 78 78 VAL C C 13 181.099 0.3 . 1 . . . . 78 VAL C . 15793 1 497 . 1 1 78 78 VAL CA C 13 66.044 0.3 . 1 . . . . 78 VAL CA . 15793 1 498 . 1 1 78 78 VAL CB C 13 32.287 0.3 . 1 . . . . 78 VAL CB . 15793 1 499 . 1 1 78 78 VAL CG1 C 13 23.222 0.3 . 1 . . . . 78 VAL CG1 . 15793 1 500 . 1 1 78 78 VAL CG2 C 13 20.823 0.3 . 1 . . . . 78 VAL CG2 . 15793 1 501 . 1 1 78 78 VAL N N 15 121.179 0.3 . 1 . . . . 78 VAL N . 15793 1 502 . 1 1 79 79 LYS H H 1 7.836 0.020 . 1 . . . . 79 LYS H . 15793 1 503 . 1 1 79 79 LYS HA H 1 4.004 0.020 . 1 . . . . 79 LYS HA . 15793 1 504 . 1 1 79 79 LYS HB2 H 1 1.577 0.020 . 1 . . . . 79 LYS HB2 . 15793 1 505 . 1 1 79 79 LYS HB3 H 1 1.577 0.020 . 1 . . . . 79 LYS HB3 . 15793 1 506 . 1 1 79 79 LYS HD2 H 1 1.889 0.020 . 1 . . . . 79 LYS HD2 . 15793 1 507 . 1 1 79 79 LYS HD3 H 1 1.889 0.020 . 1 . . . . 79 LYS HD3 . 15793 1 508 . 1 1 79 79 LYS HE2 H 1 2.844 0.020 . 1 . . . . 79 LYS HE2 . 15793 1 509 . 1 1 79 79 LYS HE3 H 1 2.844 0.020 . 1 . . . . 79 LYS HE3 . 15793 1 510 . 1 1 79 79 LYS HG2 H 1 1.434 0.020 . 2 . . . . 79 LYS HG2 . 15793 1 511 . 1 1 79 79 LYS HG3 H 1 1.393 0.020 . 2 . . . . 79 LYS HG3 . 15793 1 512 . 1 1 79 79 LYS CA C 13 59.189 0.3 . 1 . . . . 79 LYS CA . 15793 1 513 . 1 1 79 79 LYS CB C 13 29.238 0.3 . 1 . . . . 79 LYS CB . 15793 1 514 . 1 1 79 79 LYS CD C 13 31.736 0.3 . 1 . . . . 79 LYS CD . 15793 1 515 . 1 1 79 79 LYS CE C 13 42.022 0.3 . 1 . . . . 79 LYS CE . 15793 1 516 . 1 1 79 79 LYS CG C 13 24.957 0.3 . 1 . . . . 79 LYS CG . 15793 1 517 . 1 1 79 79 LYS N N 15 123.239 0.3 . 1 . . . . 79 LYS N . 15793 1 518 . 1 1 80 80 LYS HA H 1 4.179 0.020 . 1 . . . . 80 LYS HA . 15793 1 519 . 1 1 80 80 LYS HB2 H 1 1.891 0.020 . 1 . . . . 80 LYS HB2 . 15793 1 520 . 1 1 80 80 LYS HB3 H 1 1.891 0.020 . 1 . . . . 80 LYS HB3 . 15793 1 521 . 1 1 80 80 LYS CA C 13 57.269 0.3 . 1 . . . . 80 LYS CA . 15793 1 522 . 1 1 80 80 LYS CB C 13 31.067 0.3 . 1 . . . . 80 LYS CB . 15793 1 523 . 1 1 81 81 GLU H H 1 7.801 0.020 . 1 . . . . 81 GLU H . 15793 1 524 . 1 1 81 81 GLU HA H 1 4.513 0.020 . 1 . . . . 81 GLU HA . 15793 1 525 . 1 1 81 81 GLU HB2 H 1 1.749 0.020 . 1 . . . . 81 GLU HB2 . 15793 1 526 . 1 1 81 81 GLU HB3 H 1 1.749 0.020 . 1 . . . . 81 GLU HB3 . 15793 1 527 . 1 1 81 81 GLU CA C 13 57.915 0.3 . 1 . . . . 81 GLU CA . 15793 1 528 . 1 1 81 81 GLU CB C 13 26.150 0.3 . 1 . . . . 81 GLU CB . 15793 1 529 . 1 1 81 81 GLU N N 15 126.946 0.3 . 1 . . . . 81 GLU N . 15793 1 530 . 1 1 82 82 MET H H 1 7.978 0.020 . 1 . . . . 82 MET H . 15793 1 531 . 1 1 82 82 MET HA H 1 3.781 0.020 . 1 . . . . 82 MET HA . 15793 1 532 . 1 1 82 82 MET HB2 H 1 1.644 0.020 . 1 . . . . 82 MET HB2 . 15793 1 533 . 1 1 82 82 MET HB3 H 1 1.644 0.020 . 1 . . . . 82 MET HB3 . 15793 1 534 . 1 1 82 82 MET HG2 H 1 2.067 0.020 . 1 . . . . 82 MET HG2 . 15793 1 535 . 1 1 82 82 MET HG3 H 1 2.067 0.020 . 1 . . . . 82 MET HG3 . 15793 1 536 . 1 1 82 82 MET C C 13 176.695 0.3 . 1 . . . . 82 MET C . 15793 1 537 . 1 1 82 82 MET CA C 13 57.599 0.3 . 1 . . . . 82 MET CA . 15793 1 538 . 1 1 82 82 MET CB C 13 33.067 0.3 . 1 . . . . 82 MET CB . 15793 1 539 . 1 1 82 82 MET CG C 13 36.619 0.3 . 1 . . . . 82 MET CG . 15793 1 540 . 1 1 82 82 MET N N 15 112.370 0.3 . 1 . . . . 82 MET N . 15793 1 541 . 1 1 83 83 LEU H H 1 6.928 0.020 . 1 . . . . 83 LEU H . 15793 1 542 . 1 1 83 83 LEU HA H 1 5.042 0.020 . 1 . . . . 83 LEU HA . 15793 1 543 . 1 1 83 83 LEU HB2 H 1 1.254 0.020 . 2 . . . . 83 LEU HB2 . 15793 1 544 . 1 1 83 83 LEU HB3 H 1 1.332 0.020 . 2 . . . . 83 LEU HB3 . 15793 1 545 . 1 1 83 83 LEU HD21 H 1 0.624 0.020 . 1 . . . . 83 LEU HD2 . 15793 1 546 . 1 1 83 83 LEU HD22 H 1 0.624 0.020 . 1 . . . . 83 LEU HD2 . 15793 1 547 . 1 1 83 83 LEU HD23 H 1 0.624 0.020 . 1 . . . . 83 LEU HD2 . 15793 1 548 . 1 1 83 83 LEU C C 13 175.376 0.3 . 1 . . . . 83 LEU C . 15793 1 549 . 1 1 83 83 LEU CA C 13 52.193 0.3 . 1 . . . . 83 LEU CA . 15793 1 550 . 1 1 83 83 LEU CB C 13 48.040 0.3 . 1 . . . . 83 LEU CB . 15793 1 551 . 1 1 83 83 LEU CD1 C 13 24.746 0.3 . 1 . . . . 83 LEU CD1 . 15793 1 552 . 1 1 83 83 LEU CD2 C 13 28.069 0.3 . 1 . . . . 83 LEU CD2 . 15793 1 553 . 1 1 83 83 LEU N N 15 116.646 0.3 . 1 . . . . 83 LEU N . 15793 1 554 . 1 1 84 84 SER H H 1 9.089 0.020 . 1 . . . . 84 SER H . 15793 1 555 . 1 1 84 84 SER HA H 1 4.711 0.020 . 1 . . . . 84 SER HA . 15793 1 556 . 1 1 84 84 SER HB2 H 1 3.816 0.020 . 2 . . . . 84 SER HB2 . 15793 1 557 . 1 1 84 84 SER HB3 H 1 3.560 0.020 . 2 . . . . 84 SER HB3 . 15793 1 558 . 1 1 84 84 SER C C 13 173.496 0.3 . 1 . . . . 84 SER C . 15793 1 559 . 1 1 84 84 SER CA C 13 56.311 0.3 . 1 . . . . 84 SER CA . 15793 1 560 . 1 1 84 84 SER CB C 13 65.943 0.3 . 1 . . . . 84 SER CB . 15793 1 561 . 1 1 84 84 SER N N 15 115.366 0.3 . 1 . . . . 84 SER N . 15793 1 562 . 1 1 85 85 THR H H 1 8.091 0.020 . 1 . . . . 85 THR H . 15793 1 563 . 1 1 85 85 THR HA H 1 5.036 0.020 . 1 . . . . 85 THR HA . 15793 1 564 . 1 1 85 85 THR HB H 1 3.383 0.020 . 1 . . . . 85 THR HB . 15793 1 565 . 1 1 85 85 THR HG21 H 1 0.522 0.020 . 1 . . . . 85 THR HG2 . 15793 1 566 . 1 1 85 85 THR HG22 H 1 0.522 0.020 . 1 . . . . 85 THR HG2 . 15793 1 567 . 1 1 85 85 THR HG23 H 1 0.522 0.020 . 1 . . . . 85 THR HG2 . 15793 1 568 . 1 1 85 85 THR C C 13 173.844 0.3 . 1 . . . . 85 THR C . 15793 1 569 . 1 1 85 85 THR CA C 13 58.919 0.3 . 1 . . . . 85 THR CA . 15793 1 570 . 1 1 85 85 THR CB C 13 71.518 0.3 . 1 . . . . 85 THR CB . 15793 1 571 . 1 1 85 85 THR CG2 C 13 21.386 0.3 . 1 . . . . 85 THR CG2 . 15793 1 572 . 1 1 85 85 THR N N 15 110.842 0.3 . 1 . . . . 85 THR N . 15793 1 573 . 1 1 86 86 GLU H H 1 8.128 0.020 . 1 . . . . 86 GLU H . 15793 1 574 . 1 1 86 86 GLU HA H 1 4.413 0.020 . 1 . . . . 86 GLU HA . 15793 1 575 . 1 1 86 86 GLU HB2 H 1 2.004 0.020 . 1 . . . . 86 GLU HB2 . 15793 1 576 . 1 1 86 86 GLU HG2 H 1 1.701 0.020 . 1 . . . . 86 GLU HG2 . 15793 1 577 . 1 1 86 86 GLU HG3 H 1 1.701 0.020 . 1 . . . . 86 GLU HG3 . 15793 1 578 . 1 1 86 86 GLU C C 13 174.693 0.3 . 1 . . . . 86 GLU C . 15793 1 579 . 1 1 86 86 GLU CA C 13 54.405 0.3 . 1 . . . . 86 GLU CA . 15793 1 580 . 1 1 86 86 GLU CB C 13 33.099 0.3 . 1 . . . . 86 GLU CB . 15793 1 581 . 1 1 86 86 GLU CG C 13 29.617 0.3 . 1 . . . . 86 GLU CG . 15793 1 582 . 1 1 86 86 GLU N N 15 122.318 0.3 . 1 . . . . 86 GLU N . 15793 1 583 . 1 1 87 87 LYS H H 1 8.622 0.020 . 1 . . . . 87 LYS H . 15793 1 584 . 1 1 87 87 LYS HA H 1 4.153 0.020 . 1 . . . . 87 LYS HA . 15793 1 585 . 1 1 87 87 LYS HB2 H 1 1.330 0.020 . 2 . . . . 87 LYS HB2 . 15793 1 586 . 1 1 87 87 LYS HB3 H 1 1.526 0.020 . 2 . . . . 87 LYS HB3 . 15793 1 587 . 1 1 87 87 LYS HD2 H 1 1.544 0.020 . 2 . . . . 87 LYS HD2 . 15793 1 588 . 1 1 87 87 LYS HD3 H 1 1.289 0.020 . 2 . . . . 87 LYS HD3 . 15793 1 589 . 1 1 87 87 LYS HE2 H 1 2.550 0.020 . 1 . . . . 87 LYS HE2 . 15793 1 590 . 1 1 87 87 LYS HE3 H 1 2.550 0.020 . 1 . . . . 87 LYS HE3 . 15793 1 591 . 1 1 87 87 LYS HG2 H 1 0.893 0.020 . 2 . . . . 87 LYS HG2 . 15793 1 592 . 1 1 87 87 LYS HG3 H 1 0.809 0.020 . 2 . . . . 87 LYS HG3 . 15793 1 593 . 1 1 87 87 LYS C C 13 175.909 0.3 . 1 . . . . 87 LYS C . 15793 1 594 . 1 1 87 87 LYS CA C 13 56.403 0.3 . 1 . . . . 87 LYS CA . 15793 1 595 . 1 1 87 87 LYS CB C 13 32.960 0.3 . 1 . . . . 87 LYS CB . 15793 1 596 . 1 1 87 87 LYS CD C 13 29.207 0.3 . 1 . . . . 87 LYS CD . 15793 1 597 . 1 1 87 87 LYS CE C 13 41.704 0.3 . 1 . . . . 87 LYS CE . 15793 1 598 . 1 1 87 87 LYS CG C 13 24.603 0.3 . 1 . . . . 87 LYS CG . 15793 1 599 . 1 1 87 87 LYS N N 15 124.854 0.3 . 1 . . . . 87 LYS N . 15793 1 600 . 1 1 88 88 GLU HA H 1 4.276 0.020 . 1 . . . . 88 GLU HA . 15793 1 601 . 1 1 88 88 GLU HB2 H 1 1.701 0.020 . 1 . . . . 88 GLU HB2 . 15793 1 602 . 1 1 88 88 GLU HG2 H 1 1.729 0.020 . 2 . . . . 88 GLU HG2 . 15793 1 603 . 1 1 88 88 GLU HG3 H 1 1.586 0.020 . 2 . . . . 88 GLU HG3 . 15793 1 604 . 1 1 88 88 GLU C C 13 175.998 0.3 . 1 . . . . 88 GLU C . 15793 1 605 . 1 1 88 88 GLU CA C 13 55.362 0.3 . 1 . . . . 88 GLU CA . 15793 1 606 . 1 1 88 88 GLU CB C 13 30.945 0.3 . 1 . . . . 88 GLU CB . 15793 1 607 . 1 1 88 88 GLU CG C 13 30.259 0.3 . 1 . . . . 88 GLU CG . 15793 1 608 . 1 1 91 91 LYS H H 1 7.651 0.020 . 1 . . . . 91 LYS H . 15793 1 609 . 1 1 91 91 LYS HA H 1 4.456 0.020 . 1 . . . . 91 LYS HA . 15793 1 610 . 1 1 91 91 LYS HB2 H 1 1.781 0.020 . 1 . . . . 91 LYS HB2 . 15793 1 611 . 1 1 91 91 LYS HB3 H 1 1.781 0.020 . 1 . . . . 91 LYS HB3 . 15793 1 612 . 1 1 91 91 LYS HD2 H 1 1.606 0.020 . 1 . . . . 91 LYS HD2 . 15793 1 613 . 1 1 91 91 LYS HD3 H 1 1.606 0.020 . 1 . . . . 91 LYS HD3 . 15793 1 614 . 1 1 91 91 LYS HG2 H 1 1.312 0.020 . 1 . . . . 91 LYS HG2 . 15793 1 615 . 1 1 91 91 LYS HG3 H 1 1.312 0.020 . 1 . . . . 91 LYS HG3 . 15793 1 616 . 1 1 91 91 LYS C C 13 174.960 0.3 . 1 . . . . 91 LYS C . 15793 1 617 . 1 1 91 91 LYS CA C 13 54.992 0.3 . 1 . . . . 91 LYS CA . 15793 1 618 . 1 1 91 91 LYS CB C 13 34.855 0.3 . 1 . . . . 91 LYS CB . 15793 1 619 . 1 1 91 91 LYS CD C 13 29.404 0.3 . 1 . . . . 91 LYS CD . 15793 1 620 . 1 1 91 91 LYS CE C 13 42.111 0.3 . 1 . . . . 91 LYS CE . 15793 1 621 . 1 1 91 91 LYS CG C 13 25.145 0.3 . 1 . . . . 91 LYS CG . 15793 1 622 . 1 1 91 91 LYS N N 15 119.096 0.3 . 1 . . . . 91 LYS N . 15793 1 623 . 1 1 92 92 PHE H H 1 7.904 0.020 . 1 . . . . 92 PHE H . 15793 1 624 . 1 1 92 92 PHE HA H 1 4.772 0.020 . 1 . . . . 92 PHE HA . 15793 1 625 . 1 1 92 92 PHE HB2 H 1 2.626 0.020 . 2 . . . . 92 PHE HB2 . 15793 1 626 . 1 1 92 92 PHE HB3 H 1 2.316 0.020 . 2 . . . . 92 PHE HB3 . 15793 1 627 . 1 1 92 92 PHE HD1 H 1 6.988 0.020 . 1 . . . . 92 PHE HD1 . 15793 1 628 . 1 1 92 92 PHE HD2 H 1 6.988 0.020 . 1 . . . . 92 PHE HD2 . 15793 1 629 . 1 1 92 92 PHE HE1 H 1 7.131 0.020 . 1 . . . . 92 PHE HE1 . 15793 1 630 . 1 1 92 92 PHE HE2 H 1 7.131 0.020 . 1 . . . . 92 PHE HE2 . 15793 1 631 . 1 1 92 92 PHE C C 13 175.183 0.3 . 1 . . . . 92 PHE C . 15793 1 632 . 1 1 92 92 PHE CA C 13 57.762 0.3 . 1 . . . . 92 PHE CA . 15793 1 633 . 1 1 92 92 PHE CB C 13 40.747 0.3 . 1 . . . . 92 PHE CB . 15793 1 634 . 1 1 92 92 PHE N N 15 118.936 0.3 . 1 . . . . 92 PHE N . 15793 1 635 . 1 1 93 93 VAL H H 1 8.626 0.020 . 1 . . . . 93 VAL H . 15793 1 636 . 1 1 93 93 VAL HA H 1 4.090 0.020 . 1 . . . . 93 VAL HA . 15793 1 637 . 1 1 93 93 VAL HB H 1 1.645 0.020 . 1 . . . . 93 VAL HB . 15793 1 638 . 1 1 93 93 VAL HG11 H 1 0.629 0.020 . 1 . . . . 93 VAL HG1 . 15793 1 639 . 1 1 93 93 VAL HG12 H 1 0.629 0.020 . 1 . . . . 93 VAL HG1 . 15793 1 640 . 1 1 93 93 VAL HG13 H 1 0.629 0.020 . 1 . . . . 93 VAL HG1 . 15793 1 641 . 1 1 93 93 VAL HG21 H 1 0.629 0.020 . 1 . . . . 93 VAL HG2 . 15793 1 642 . 1 1 93 93 VAL HG22 H 1 0.629 0.020 . 1 . . . . 93 VAL HG2 . 15793 1 643 . 1 1 93 93 VAL HG23 H 1 0.629 0.020 . 1 . . . . 93 VAL HG2 . 15793 1 644 . 1 1 93 93 VAL C C 13 174.856 0.3 . 1 . . . . 93 VAL C . 15793 1 645 . 1 1 93 93 VAL CA C 13 61.228 0.3 . 1 . . . . 93 VAL CA . 15793 1 646 . 1 1 93 93 VAL CB C 13 33.595 0.3 . 1 . . . . 93 VAL CB . 15793 1 647 . 1 1 93 93 VAL CG1 C 13 20.775 0.3 . 1 . . . . 93 VAL CG1 . 15793 1 648 . 1 1 93 93 VAL N N 15 120.649 0.3 . 1 . . . . 93 VAL N . 15793 1 649 . 1 1 94 94 TYR H H 1 8.950 0.020 . 1 . . . . 94 TYR H . 15793 1 650 . 1 1 94 94 TYR HA H 1 5.029 0.020 . 1 . . . . 94 TYR HA . 15793 1 651 . 1 1 94 94 TYR HB2 H 1 2.489 0.020 . 2 . . . . 94 TYR HB2 . 15793 1 652 . 1 1 94 94 TYR HB3 H 1 2.768 0.020 . 2 . . . . 94 TYR HB3 . 15793 1 653 . 1 1 94 94 TYR HD1 H 1 6.849 0.020 . 1 . . . . 94 TYR HD1 . 15793 1 654 . 1 1 94 94 TYR HD2 H 1 6.849 0.020 . 1 . . . . 94 TYR HD2 . 15793 1 655 . 1 1 94 94 TYR HE1 H 1 6.460 0.020 . 1 . . . . 94 TYR HE1 . 15793 1 656 . 1 1 94 94 TYR HE2 H 1 6.460 0.020 . 1 . . . . 94 TYR HE2 . 15793 1 657 . 1 1 94 94 TYR C C 13 175.242 0.3 . 1 . . . . 94 TYR C . 15793 1 658 . 1 1 94 94 TYR CA C 13 57.619 0.3 . 1 . . . . 94 TYR CA . 15793 1 659 . 1 1 94 94 TYR CB C 13 41.447 0.3 . 1 . . . . 94 TYR CB . 15793 1 660 . 1 1 94 94 TYR N N 15 125.589 0.3 . 1 . . . . 94 TYR N . 15793 1 661 . 1 1 95 95 ARG H H 1 8.275 0.020 . 1 . . . . 95 ARG H . 15793 1 662 . 1 1 95 95 ARG HA H 1 5.001 0.020 . 1 . . . . 95 ARG HA . 15793 1 663 . 1 1 95 95 ARG HB2 H 1 1.635 0.020 . 1 . . . . 95 ARG HB2 . 15793 1 664 . 1 1 95 95 ARG HB3 H 1 1.635 0.020 . 1 . . . . 95 ARG HB3 . 15793 1 665 . 1 1 95 95 ARG CA C 13 53.055 0.3 . 1 . . . . 95 ARG CA . 15793 1 666 . 1 1 95 95 ARG N N 15 118.094 0.3 . 1 . . . . 95 ARG N . 15793 1 667 . 1 1 96 96 PRO HB2 H 1 1.760 0.020 . 1 . . . . 96 PRO HB2 . 15793 1 668 . 1 1 96 96 PRO HD2 H 1 2.940 0.020 . 2 . . . . 96 PRO HD2 . 15793 1 669 . 1 1 96 96 PRO HD3 H 1 2.900 0.020 . 2 . . . . 96 PRO HD3 . 15793 1 670 . 1 1 96 96 PRO CA C 13 63.815 0.3 . 1 . . . . 96 PRO CA . 15793 1 671 . 1 1 96 96 PRO CB C 13 33.778 0.3 . 1 . . . . 96 PRO CB . 15793 1 672 . 1 1 96 96 PRO CD C 13 50.367 0.3 . 1 . . . . 96 PRO CD . 15793 1 673 . 1 1 97 97 LEU H H 1 7.862 0.020 . 1 . . . . 97 LEU H . 15793 1 674 . 1 1 97 97 LEU HA H 1 4.054 0.020 . 1 . . . . 97 LEU HA . 15793 1 675 . 1 1 97 97 LEU HB2 H 1 1.161 0.020 . 2 . . . . 97 LEU HB2 . 15793 1 676 . 1 1 97 97 LEU HB3 H 1 1.304 0.020 . 2 . . . . 97 LEU HB3 . 15793 1 677 . 1 1 97 97 LEU HD11 H 1 0.605 0.020 . 1 . . . . 97 LEU HD1 . 15793 1 678 . 1 1 97 97 LEU HD12 H 1 0.605 0.020 . 1 . . . . 97 LEU HD1 . 15793 1 679 . 1 1 97 97 LEU HD13 H 1 0.605 0.020 . 1 . . . . 97 LEU HD1 . 15793 1 680 . 1 1 97 97 LEU HD21 H 1 0.716 0.020 . 1 . . . . 97 LEU HD2 . 15793 1 681 . 1 1 97 97 LEU HD22 H 1 0.716 0.020 . 1 . . . . 97 LEU HD2 . 15793 1 682 . 1 1 97 97 LEU HD23 H 1 0.716 0.020 . 1 . . . . 97 LEU HD2 . 15793 1 683 . 1 1 97 97 LEU HG H 1 1.302 0.020 . 1 . . . . 97 LEU HG . 15793 1 684 . 1 1 97 97 LEU CA C 13 55.208 0.3 . 1 . . . . 97 LEU CA . 15793 1 685 . 1 1 97 97 LEU CB C 13 42.072 0.3 . 1 . . . . 97 LEU CB . 15793 1 686 . 1 1 97 97 LEU CD1 C 13 23.008 0.3 . 1 . . . . 97 LEU CD1 . 15793 1 687 . 1 1 97 97 LEU CD2 C 13 24.632 0.3 . 1 . . . . 97 LEU CD2 . 15793 1 688 . 1 1 97 97 LEU CG C 13 26.514 0.3 . 1 . . . . 97 LEU CG . 15793 1 689 . 1 1 97 97 LEU N N 15 119.401 0.3 . 1 . . . . 97 LEU N . 15793 1 stop_ save_