################################### # 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10276 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10276 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10276 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 7 7 GLY HA2 H 1 3.892 0.030 . 1 . . . . 7 GLY HA2 . 10276 1 2 . 1 1 7 7 GLY HA3 H 1 3.892 0.030 . 1 . . . . 7 GLY HA3 . 10276 1 3 . 1 1 7 7 GLY C C 13 173.405 0.300 . 1 . . . . 7 GLY C . 10276 1 4 . 1 1 7 7 GLY CA C 13 45.070 0.300 . 1 . . . . 7 GLY CA . 10276 1 5 . 1 1 8 8 LYS H H 1 7.913 0.030 . 1 . . . . 8 LYS H . 10276 1 6 . 1 1 8 8 LYS HA H 1 4.031 0.030 . 1 . . . . 8 LYS HA . 10276 1 7 . 1 1 8 8 LYS HB2 H 1 1.409 0.030 . 2 . . . . 8 LYS HB2 . 10276 1 8 . 1 1 8 8 LYS HB3 H 1 1.306 0.030 . 2 . . . . 8 LYS HB3 . 10276 1 9 . 1 1 8 8 LYS HD2 H 1 1.181 0.030 . 2 . . . . 8 LYS HD2 . 10276 1 10 . 1 1 8 8 LYS HD3 H 1 0.966 0.030 . 2 . . . . 8 LYS HD3 . 10276 1 11 . 1 1 8 8 LYS HE2 H 1 2.131 0.030 . 2 . . . . 8 LYS HE2 . 10276 1 12 . 1 1 8 8 LYS HE3 H 1 2.323 0.030 . 2 . . . . 8 LYS HE3 . 10276 1 13 . 1 1 8 8 LYS HG2 H 1 0.556 0.030 . 1 . . . . 8 LYS HG2 . 10276 1 14 . 1 1 8 8 LYS HG3 H 1 0.556 0.030 . 1 . . . . 8 LYS HG3 . 10276 1 15 . 1 1 8 8 LYS C C 13 175.501 0.300 . 1 . . . . 8 LYS C . 10276 1 16 . 1 1 8 8 LYS CA C 13 55.765 0.300 . 1 . . . . 8 LYS CA . 10276 1 17 . 1 1 8 8 LYS CB C 13 33.046 0.300 . 1 . . . . 8 LYS CB . 10276 1 18 . 1 1 8 8 LYS CD C 13 28.234 0.300 . 1 . . . . 8 LYS CD . 10276 1 19 . 1 1 8 8 LYS CE C 13 41.988 0.300 . 1 . . . . 8 LYS CE . 10276 1 20 . 1 1 8 8 LYS CG C 13 23.957 0.300 . 1 . . . . 8 LYS CG . 10276 1 21 . 1 1 8 8 LYS N N 15 121.849 0.300 . 1 . . . . 8 LYS N . 10276 1 22 . 1 1 9 9 VAL H H 1 8.175 0.030 . 1 . . . . 9 VAL H . 10276 1 23 . 1 1 9 9 VAL HA H 1 4.082 0.030 . 1 . . . . 9 VAL HA . 10276 1 24 . 1 1 9 9 VAL HB H 1 1.895 0.030 . 1 . . . . 9 VAL HB . 10276 1 25 . 1 1 9 9 VAL HG11 H 1 0.845 0.030 . 1 . . . . 9 VAL HG1 . 10276 1 26 . 1 1 9 9 VAL HG12 H 1 0.845 0.030 . 1 . . . . 9 VAL HG1 . 10276 1 27 . 1 1 9 9 VAL HG13 H 1 0.845 0.030 . 1 . . . . 9 VAL HG1 . 10276 1 28 . 1 1 9 9 VAL HG21 H 1 0.839 0.030 . 1 . . . . 9 VAL HG2 . 10276 1 29 . 1 1 9 9 VAL HG22 H 1 0.839 0.030 . 1 . . . . 9 VAL HG2 . 10276 1 30 . 1 1 9 9 VAL HG23 H 1 0.839 0.030 . 1 . . . . 9 VAL HG2 . 10276 1 31 . 1 1 9 9 VAL C C 13 175.680 0.300 . 1 . . . . 9 VAL C . 10276 1 32 . 1 1 9 9 VAL CA C 13 61.571 0.300 . 1 . . . . 9 VAL CA . 10276 1 33 . 1 1 9 9 VAL CB C 13 32.224 0.300 . 1 . . . . 9 VAL CB . 10276 1 34 . 1 1 9 9 VAL CG1 C 13 20.515 0.300 . 2 . . . . 9 VAL CG1 . 10276 1 35 . 1 1 9 9 VAL CG2 C 13 21.123 0.300 . 2 . . . . 9 VAL CG2 . 10276 1 36 . 1 1 9 9 VAL N N 15 125.536 0.300 . 1 . . . . 9 VAL N . 10276 1 37 . 1 1 10 10 TRP H H 1 8.125 0.030 . 1 . . . . 10 TRP H . 10276 1 38 . 1 1 10 10 TRP HA H 1 4.667 0.030 . 1 . . . . 10 TRP HA . 10276 1 39 . 1 1 10 10 TRP HB2 H 1 2.965 0.030 . 2 . . . . 10 TRP HB2 . 10276 1 40 . 1 1 10 10 TRP HB3 H 1 3.055 0.030 . 2 . . . . 10 TRP HB3 . 10276 1 41 . 1 1 10 10 TRP HD1 H 1 7.255 0.030 . 1 . . . . 10 TRP HD1 . 10276 1 42 . 1 1 10 10 TRP HE1 H 1 10.270 0.030 . 1 . . . . 10 TRP HE1 . 10276 1 43 . 1 1 10 10 TRP HE3 H 1 7.975 0.030 . 1 . . . . 10 TRP HE3 . 10276 1 44 . 1 1 10 10 TRP HH2 H 1 6.789 0.030 . 1 . . . . 10 TRP HH2 . 10276 1 45 . 1 1 10 10 TRP HZ2 H 1 7.075 0.030 . 1 . . . . 10 TRP HZ2 . 10276 1 46 . 1 1 10 10 TRP HZ3 H 1 7.148 0.030 . 1 . . . . 10 TRP HZ3 . 10276 1 47 . 1 1 10 10 TRP C C 13 174.859 0.300 . 1 . . . . 10 TRP C . 10276 1 48 . 1 1 10 10 TRP CA C 13 57.088 0.300 . 1 . . . . 10 TRP CA . 10276 1 49 . 1 1 10 10 TRP CB C 13 31.730 0.300 . 1 . . . . 10 TRP CB . 10276 1 50 . 1 1 10 10 TRP CD1 C 13 127.495 0.300 . 1 . . . . 10 TRP CD1 . 10276 1 51 . 1 1 10 10 TRP CE3 C 13 121.287 0.300 . 1 . . . . 10 TRP CE3 . 10276 1 52 . 1 1 10 10 TRP CH2 C 13 123.520 0.300 . 1 . . . . 10 TRP CH2 . 10276 1 53 . 1 1 10 10 TRP CZ2 C 13 113.803 0.300 . 1 . . . . 10 TRP CZ2 . 10276 1 54 . 1 1 10 10 TRP CZ3 C 13 121.117 0.300 . 1 . . . . 10 TRP CZ3 . 10276 1 55 . 1 1 10 10 TRP N N 15 127.817 0.300 . 1 . . . . 10 TRP N . 10276 1 56 . 1 1 10 10 TRP NE1 N 15 128.999 0.300 . 1 . . . . 10 TRP NE1 . 10276 1 57 . 1 1 11 11 LYS H H 1 9.090 0.030 . 1 . . . . 11 LYS H . 10276 1 58 . 1 1 11 11 LYS HA H 1 4.856 0.030 . 1 . . . . 11 LYS HA . 10276 1 59 . 1 1 11 11 LYS HB2 H 1 1.687 0.030 . 2 . . . . 11 LYS HB2 . 10276 1 60 . 1 1 11 11 LYS HB3 H 1 1.793 0.030 . 2 . . . . 11 LYS HB3 . 10276 1 61 . 1 1 11 11 LYS HD2 H 1 1.683 0.030 . 1 . . . . 11 LYS HD2 . 10276 1 62 . 1 1 11 11 LYS HD3 H 1 1.683 0.030 . 1 . . . . 11 LYS HD3 . 10276 1 63 . 1 1 11 11 LYS HE2 H 1 3.013 0.030 . 1 . . . . 11 LYS HE2 . 10276 1 64 . 1 1 11 11 LYS HE3 H 1 3.013 0.030 . 1 . . . . 11 LYS HE3 . 10276 1 65 . 1 1 11 11 LYS HG2 H 1 1.325 0.030 . 2 . . . . 11 LYS HG2 . 10276 1 66 . 1 1 11 11 LYS HG3 H 1 1.566 0.030 . 2 . . . . 11 LYS HG3 . 10276 1 67 . 1 1 11 11 LYS C C 13 172.968 0.300 . 1 . . . . 11 LYS C . 10276 1 68 . 1 1 11 11 LYS CA C 13 53.330 0.300 . 1 . . . . 11 LYS CA . 10276 1 69 . 1 1 11 11 LYS CB C 13 33.827 0.300 . 1 . . . . 11 LYS CB . 10276 1 70 . 1 1 11 11 LYS CD C 13 29.011 0.300 . 1 . . . . 11 LYS CD . 10276 1 71 . 1 1 11 11 LYS CE C 13 42.282 0.300 . 1 . . . . 11 LYS CE . 10276 1 72 . 1 1 11 11 LYS CG C 13 23.518 0.300 . 1 . . . . 11 LYS CG . 10276 1 73 . 1 1 11 11 LYS N N 15 120.688 0.300 . 1 . . . . 11 LYS N . 10276 1 74 . 1 1 12 12 PRO HA H 1 3.894 0.030 . 1 . . . . 12 PRO HA . 10276 1 75 . 1 1 12 12 PRO HB2 H 1 2.265 0.030 . 2 . . . . 12 PRO HB2 . 10276 1 76 . 1 1 12 12 PRO HB3 H 1 1.854 0.030 . 2 . . . . 12 PRO HB3 . 10276 1 77 . 1 1 12 12 PRO HD2 H 1 3.715 0.030 . 2 . . . . 12 PRO HD2 . 10276 1 78 . 1 1 12 12 PRO HD3 H 1 3.595 0.030 . 2 . . . . 12 PRO HD3 . 10276 1 79 . 1 1 12 12 PRO HG2 H 1 1.663 0.030 . 2 . . . . 12 PRO HG2 . 10276 1 80 . 1 1 12 12 PRO HG3 H 1 2.265 0.030 . 2 . . . . 12 PRO HG3 . 10276 1 81 . 1 1 12 12 PRO C C 13 177.287 0.300 . 1 . . . . 12 PRO C . 10276 1 82 . 1 1 12 12 PRO CA C 13 63.812 0.300 . 1 . . . . 12 PRO CA . 10276 1 83 . 1 1 12 12 PRO CB C 13 31.278 0.300 . 1 . . . . 12 PRO CB . 10276 1 84 . 1 1 12 12 PRO CD C 13 50.853 0.300 . 1 . . . . 12 PRO CD . 10276 1 85 . 1 1 12 12 PRO CG C 13 28.810 0.300 . 1 . . . . 12 PRO CG . 10276 1 86 . 1 1 13 13 GLY H H 1 9.494 0.030 . 1 . . . . 13 GLY H . 10276 1 87 . 1 1 13 13 GLY HA2 H 1 4.431 0.030 . 2 . . . . 13 GLY HA2 . 10276 1 88 . 1 1 13 13 GLY HA3 H 1 3.746 0.030 . 2 . . . . 13 GLY HA3 . 10276 1 89 . 1 1 13 13 GLY C C 13 174.798 0.300 . 1 . . . . 13 GLY C . 10276 1 90 . 1 1 13 13 GLY CA C 13 44.559 0.300 . 1 . . . . 13 GLY CA . 10276 1 91 . 1 1 13 13 GLY N N 15 114.764 0.300 . 1 . . . . 13 GLY N . 10276 1 92 . 1 1 14 14 ASP H H 1 8.005 0.030 . 1 . . . . 14 ASP H . 10276 1 93 . 1 1 14 14 ASP HA H 1 4.665 0.030 . 1 . . . . 14 ASP HA . 10276 1 94 . 1 1 14 14 ASP HB2 H 1 3.105 0.030 . 2 . . . . 14 ASP HB2 . 10276 1 95 . 1 1 14 14 ASP HB3 H 1 2.985 0.030 . 2 . . . . 14 ASP HB3 . 10276 1 96 . 1 1 14 14 ASP C C 13 176.143 0.300 . 1 . . . . 14 ASP C . 10276 1 97 . 1 1 14 14 ASP CA C 13 55.553 0.300 . 1 . . . . 14 ASP CA . 10276 1 98 . 1 1 14 14 ASP CB C 13 41.600 0.300 . 1 . . . . 14 ASP CB . 10276 1 99 . 1 1 14 14 ASP N N 15 121.257 0.300 . 1 . . . . 14 ASP N . 10276 1 100 . 1 1 15 15 GLU H H 1 8.645 0.030 . 1 . . . . 15 GLU H . 10276 1 101 . 1 1 15 15 GLU HA H 1 4.852 0.030 . 1 . . . . 15 GLU HA . 10276 1 102 . 1 1 15 15 GLU HB2 H 1 2.115 0.030 . 2 . . . . 15 GLU HB2 . 10276 1 103 . 1 1 15 15 GLU HB3 H 1 2.026 0.030 . 2 . . . . 15 GLU HB3 . 10276 1 104 . 1 1 15 15 GLU HG2 H 1 2.445 0.030 . 2 . . . . 15 GLU HG2 . 10276 1 105 . 1 1 15 15 GLU HG3 H 1 2.315 0.030 . 2 . . . . 15 GLU HG3 . 10276 1 106 . 1 1 15 15 GLU C C 13 175.679 0.300 . 1 . . . . 15 GLU C . 10276 1 107 . 1 1 15 15 GLU CA C 13 55.783 0.300 . 1 . . . . 15 GLU CA . 10276 1 108 . 1 1 15 15 GLU CB C 13 31.295 0.300 . 1 . . . . 15 GLU CB . 10276 1 109 . 1 1 15 15 GLU CG C 13 36.953 0.300 . 1 . . . . 15 GLU CG . 10276 1 110 . 1 1 15 15 GLU N N 15 121.409 0.300 . 1 . . . . 15 GLU N . 10276 1 111 . 1 1 16 16 CYS H H 1 8.735 0.030 . 1 . . . . 16 CYS H . 10276 1 112 . 1 1 16 16 CYS HA H 1 5.086 0.030 . 1 . . . . 16 CYS HA . 10276 1 113 . 1 1 16 16 CYS HB2 H 1 2.776 0.030 . 2 . . . . 16 CYS HB2 . 10276 1 114 . 1 1 16 16 CYS HB3 H 1 2.543 0.030 . 2 . . . . 16 CYS HB3 . 10276 1 115 . 1 1 16 16 CYS C C 13 172.636 0.300 . 1 . . . . 16 CYS C . 10276 1 116 . 1 1 16 16 CYS CA C 13 56.418 0.300 . 1 . . . . 16 CYS CA . 10276 1 117 . 1 1 16 16 CYS CB C 13 32.553 0.300 . 1 . . . . 16 CYS CB . 10276 1 118 . 1 1 16 16 CYS N N 15 116.207 0.300 . 1 . . . . 16 CYS N . 10276 1 119 . 1 1 17 17 PHE H H 1 9.125 0.030 . 1 . . . . 17 PHE H . 10276 1 120 . 1 1 17 17 PHE HA H 1 5.235 0.030 . 1 . . . . 17 PHE HA . 10276 1 121 . 1 1 17 17 PHE HB2 H 1 2.805 0.030 . 2 . . . . 17 PHE HB2 . 10276 1 122 . 1 1 17 17 PHE HB3 H 1 2.698 0.030 . 2 . . . . 17 PHE HB3 . 10276 1 123 . 1 1 17 17 PHE HD1 H 1 6.996 0.030 . 1 . . . . 17 PHE HD1 . 10276 1 124 . 1 1 17 17 PHE HD2 H 1 6.996 0.030 . 1 . . . . 17 PHE HD2 . 10276 1 125 . 1 1 17 17 PHE HE1 H 1 7.435 0.030 . 1 . . . . 17 PHE HE1 . 10276 1 126 . 1 1 17 17 PHE HE2 H 1 7.435 0.030 . 1 . . . . 17 PHE HE2 . 10276 1 127 . 1 1 17 17 PHE HZ H 1 7.387 0.030 . 1 . . . . 17 PHE HZ . 10276 1 128 . 1 1 17 17 PHE C C 13 174.823 0.300 . 1 . . . . 17 PHE C . 10276 1 129 . 1 1 17 17 PHE CA C 13 57.547 0.300 . 1 . . . . 17 PHE CA . 10276 1 130 . 1 1 17 17 PHE CB C 13 42.053 0.300 . 1 . . . . 17 PHE CB . 10276 1 131 . 1 1 17 17 PHE CD1 C 13 130.964 0.300 . 1 . . . . 17 PHE CD1 . 10276 1 132 . 1 1 17 17 PHE CD2 C 13 130.964 0.300 . 1 . . . . 17 PHE CD2 . 10276 1 133 . 1 1 17 17 PHE CE1 C 13 131.879 0.300 . 1 . . . . 17 PHE CE1 . 10276 1 134 . 1 1 17 17 PHE CE2 C 13 131.879 0.300 . 1 . . . . 17 PHE CE2 . 10276 1 135 . 1 1 17 17 PHE CZ C 13 130.157 0.300 . 1 . . . . 17 PHE CZ . 10276 1 136 . 1 1 17 17 PHE N N 15 116.836 0.300 . 1 . . . . 17 PHE N . 10276 1 137 . 1 1 18 18 ALA H H 1 9.373 0.030 . 1 . . . . 18 ALA H . 10276 1 138 . 1 1 18 18 ALA HA H 1 5.552 0.030 . 1 . . . . 18 ALA HA . 10276 1 139 . 1 1 18 18 ALA HB1 H 1 1.169 0.030 . 1 . . . . 18 ALA HB . 10276 1 140 . 1 1 18 18 ALA HB2 H 1 1.169 0.030 . 1 . . . . 18 ALA HB . 10276 1 141 . 1 1 18 18 ALA HB3 H 1 1.169 0.030 . 1 . . . . 18 ALA HB . 10276 1 142 . 1 1 18 18 ALA C C 13 175.841 0.300 . 1 . . . . 18 ALA C . 10276 1 143 . 1 1 18 18 ALA CA C 13 50.147 0.300 . 1 . . . . 18 ALA CA . 10276 1 144 . 1 1 18 18 ALA CB C 13 23.798 0.300 . 1 . . . . 18 ALA CB . 10276 1 145 . 1 1 18 18 ALA N N 15 122.751 0.300 . 1 . . . . 18 ALA N . 10276 1 146 . 1 1 19 19 LEU H H 1 7.487 0.030 . 1 . . . . 19 LEU H . 10276 1 147 . 1 1 19 19 LEU HA H 1 3.514 0.030 . 1 . . . . 19 LEU HA . 10276 1 148 . 1 1 19 19 LEU HB2 H 1 1.630 0.030 . 2 . . . . 19 LEU HB2 . 10276 1 149 . 1 1 19 19 LEU HB3 H 1 0.745 0.030 . 2 . . . . 19 LEU HB3 . 10276 1 150 . 1 1 19 19 LEU HD11 H 1 0.020 0.030 . 1 . . . . 19 LEU HD1 . 10276 1 151 . 1 1 19 19 LEU HD12 H 1 0.020 0.030 . 1 . . . . 19 LEU HD1 . 10276 1 152 . 1 1 19 19 LEU HD13 H 1 0.020 0.030 . 1 . . . . 19 LEU HD1 . 10276 1 153 . 1 1 19 19 LEU HD21 H 1 0.625 0.030 . 1 . . . . 19 LEU HD2 . 10276 1 154 . 1 1 19 19 LEU HD22 H 1 0.625 0.030 . 1 . . . . 19 LEU HD2 . 10276 1 155 . 1 1 19 19 LEU HD23 H 1 0.625 0.030 . 1 . . . . 19 LEU HD2 . 10276 1 156 . 1 1 19 19 LEU HG H 1 0.880 0.030 . 1 . . . . 19 LEU HG . 10276 1 157 . 1 1 19 19 LEU C C 13 175.598 0.300 . 1 . . . . 19 LEU C . 10276 1 158 . 1 1 19 19 LEU CA C 13 55.165 0.300 . 1 . . . . 19 LEU CA . 10276 1 159 . 1 1 19 19 LEU CB C 13 43.656 0.300 . 1 . . . . 19 LEU CB . 10276 1 160 . 1 1 19 19 LEU CD1 C 13 22.148 0.300 . 2 . . . . 19 LEU CD1 . 10276 1 161 . 1 1 19 19 LEU CD2 C 13 25.393 0.300 . 2 . . . . 19 LEU CD2 . 10276 1 162 . 1 1 19 19 LEU CG C 13 26.360 0.300 . 1 . . . . 19 LEU CG . 10276 1 163 . 1 1 19 19 LEU N N 15 123.529 0.300 . 1 . . . . 19 LEU N . 10276 1 164 . 1 1 20 20 TYR H H 1 9.405 0.030 . 1 . . . . 20 TYR H . 10276 1 165 . 1 1 20 20 TYR HA H 1 4.939 0.030 . 1 . . . . 20 TYR HA . 10276 1 166 . 1 1 20 20 TYR HB2 H 1 3.475 0.030 . 2 . . . . 20 TYR HB2 . 10276 1 167 . 1 1 20 20 TYR HB3 H 1 2.575 0.030 . 2 . . . . 20 TYR HB3 . 10276 1 168 . 1 1 20 20 TYR HD1 H 1 6.782 0.030 . 1 . . . . 20 TYR HD1 . 10276 1 169 . 1 1 20 20 TYR HD2 H 1 6.782 0.030 . 1 . . . . 20 TYR HD2 . 10276 1 170 . 1 1 20 20 TYR HE1 H 1 6.375 0.030 . 1 . . . . 20 TYR HE1 . 10276 1 171 . 1 1 20 20 TYR HE2 H 1 6.375 0.030 . 1 . . . . 20 TYR HE2 . 10276 1 172 . 1 1 20 20 TYR C C 13 176.593 0.300 . 1 . . . . 20 TYR C . 10276 1 173 . 1 1 20 20 TYR CA C 13 55.201 0.300 . 1 . . . . 20 TYR CA . 10276 1 174 . 1 1 20 20 TYR CB C 13 37.899 0.300 . 1 . . . . 20 TYR CB . 10276 1 175 . 1 1 20 20 TYR CD1 C 13 131.500 0.300 . 1 . . . . 20 TYR CD1 . 10276 1 176 . 1 1 20 20 TYR CD2 C 13 131.500 0.300 . 1 . . . . 20 TYR CD2 . 10276 1 177 . 1 1 20 20 TYR CE1 C 13 118.935 0.300 . 1 . . . . 20 TYR CE1 . 10276 1 178 . 1 1 20 20 TYR CE2 C 13 118.935 0.300 . 1 . . . . 20 TYR CE2 . 10276 1 179 . 1 1 20 20 TYR N N 15 132.207 0.300 . 1 . . . . 20 TYR N . 10276 1 180 . 1 1 21 21 TRP H H 1 8.475 0.030 . 1 . . . . 21 TRP H . 10276 1 181 . 1 1 21 21 TRP HA H 1 4.087 0.030 . 1 . . . . 21 TRP HA . 10276 1 182 . 1 1 21 21 TRP HB2 H 1 3.119 0.030 . 2 . . . . 21 TRP HB2 . 10276 1 183 . 1 1 21 21 TRP HB3 H 1 3.313 0.030 . 2 . . . . 21 TRP HB3 . 10276 1 184 . 1 1 21 21 TRP HD1 H 1 7.225 0.030 . 1 . . . . 21 TRP HD1 . 10276 1 185 . 1 1 21 21 TRP HE1 H 1 10.085 0.030 . 1 . . . . 21 TRP HE1 . 10276 1 186 . 1 1 21 21 TRP HE3 H 1 7.200 0.030 . 1 . . . . 21 TRP HE3 . 10276 1 187 . 1 1 21 21 TRP HH2 H 1 7.148 0.030 . 1 . . . . 21 TRP HH2 . 10276 1 188 . 1 1 21 21 TRP HZ2 H 1 7.479 0.030 . 1 . . . . 21 TRP HZ2 . 10276 1 189 . 1 1 21 21 TRP HZ3 H 1 7.036 0.030 . 1 . . . . 21 TRP HZ3 . 10276 1 190 . 1 1 21 21 TRP C C 13 177.283 0.300 . 1 . . . . 21 TRP C . 10276 1 191 . 1 1 21 21 TRP CA C 13 58.695 0.300 . 1 . . . . 21 TRP CA . 10276 1 192 . 1 1 21 21 TRP CB C 13 28.111 0.300 . 1 . . . . 21 TRP CB . 10276 1 193 . 1 1 21 21 TRP CD1 C 13 127.464 0.300 . 1 . . . . 21 TRP CD1 . 10276 1 194 . 1 1 21 21 TRP CE3 C 13 120.191 0.300 . 1 . . . . 21 TRP CE3 . 10276 1 195 . 1 1 21 21 TRP CH2 C 13 124.828 0.300 . 1 . . . . 21 TRP CH2 . 10276 1 196 . 1 1 21 21 TRP CZ2 C 13 114.888 0.300 . 1 . . . . 21 TRP CZ2 . 10276 1 197 . 1 1 21 21 TRP CZ3 C 13 122.145 0.300 . 1 . . . . 21 TRP CZ3 . 10276 1 198 . 1 1 21 21 TRP N N 15 128.228 0.300 . 1 . . . . 21 TRP N . 10276 1 199 . 1 1 21 21 TRP NE1 N 15 130.527 0.300 . 1 . . . . 21 TRP NE1 . 10276 1 200 . 1 1 22 22 GLU H H 1 4.195 0.030 . 1 . . . . 22 GLU H . 10276 1 201 . 1 1 22 22 GLU HA H 1 2.895 0.030 . 1 . . . . 22 GLU HA . 10276 1 202 . 1 1 22 22 GLU HB2 H 1 0.985 0.030 . 2 . . . . 22 GLU HB2 . 10276 1 203 . 1 1 22 22 GLU HB3 H 1 -0.085 0.030 . 2 . . . . 22 GLU HB3 . 10276 1 204 . 1 1 22 22 GLU HG2 H 1 1.074 0.030 . 2 . . . . 22 GLU HG2 . 10276 1 205 . 1 1 22 22 GLU HG3 H 1 1.015 0.030 . 2 . . . . 22 GLU HG3 . 10276 1 206 . 1 1 22 22 GLU C C 13 176.342 0.300 . 1 . . . . 22 GLU C . 10276 1 207 . 1 1 22 22 GLU CA C 13 59.753 0.300 . 1 . . . . 22 GLU CA . 10276 1 208 . 1 1 22 22 GLU CB C 13 29.468 0.300 . 1 . . . . 22 GLU CB . 10276 1 209 . 1 1 22 22 GLU CG C 13 35.637 0.300 . 1 . . . . 22 GLU CG . 10276 1 210 . 1 1 22 22 GLU N N 15 117.591 0.300 . 1 . . . . 22 GLU N . 10276 1 211 . 1 1 23 23 ASP H H 1 6.695 0.030 . 1 . . . . 23 ASP H . 10276 1 212 . 1 1 23 23 ASP HA H 1 4.554 0.030 . 1 . . . . 23 ASP HA . 10276 1 213 . 1 1 23 23 ASP HB2 H 1 2.834 0.030 . 2 . . . . 23 ASP HB2 . 10276 1 214 . 1 1 23 23 ASP HB3 H 1 2.370 0.030 . 2 . . . . 23 ASP HB3 . 10276 1 215 . 1 1 23 23 ASP C C 13 176.047 0.300 . 1 . . . . 23 ASP C . 10276 1 216 . 1 1 23 23 ASP CA C 13 51.970 0.300 . 1 . . . . 23 ASP CA . 10276 1 217 . 1 1 23 23 ASP CB C 13 41.353 0.300 . 1 . . . . 23 ASP CB . 10276 1 218 . 1 1 23 23 ASP N N 15 112.180 0.300 . 1 . . . . 23 ASP N . 10276 1 219 . 1 1 24 24 ASN H H 1 8.248 0.030 . 1 . . . . 24 ASN H . 10276 1 220 . 1 1 24 24 ASN HA H 1 4.055 0.030 . 1 . . . . 24 ASN HA . 10276 1 221 . 1 1 24 24 ASN HB2 H 1 3.060 0.030 . 2 . . . . 24 ASN HB2 . 10276 1 222 . 1 1 24 24 ASN HB3 H 1 2.533 0.030 . 2 . . . . 24 ASN HB3 . 10276 1 223 . 1 1 24 24 ASN HD21 H 1 7.392 0.030 . 2 . . . . 24 ASN HD21 . 10276 1 224 . 1 1 24 24 ASN HD22 H 1 6.624 0.030 . 2 . . . . 24 ASN HD22 . 10276 1 225 . 1 1 24 24 ASN C C 13 173.702 0.300 . 1 . . . . 24 ASN C . 10276 1 226 . 1 1 24 24 ASN CA C 13 54.794 0.300 . 1 . . . . 24 ASN CA . 10276 1 227 . 1 1 24 24 ASN CB C 13 37.940 0.300 . 1 . . . . 24 ASN CB . 10276 1 228 . 1 1 24 24 ASN N N 15 116.693 0.300 . 1 . . . . 24 ASN N . 10276 1 229 . 1 1 24 24 ASN ND2 N 15 111.938 0.300 . 1 . . . . 24 ASN ND2 . 10276 1 230 . 1 1 25 25 LYS H H 1 7.604 0.030 . 1 . . . . 25 LYS H . 10276 1 231 . 1 1 25 25 LYS HA H 1 4.502 0.030 . 1 . . . . 25 LYS HA . 10276 1 232 . 1 1 25 25 LYS HB2 H 1 1.675 0.030 . 2 . . . . 25 LYS HB2 . 10276 1 233 . 1 1 25 25 LYS HB3 H 1 1.404 0.030 . 2 . . . . 25 LYS HB3 . 10276 1 234 . 1 1 25 25 LYS HD2 H 1 1.593 0.030 . 1 . . . . 25 LYS HD2 . 10276 1 235 . 1 1 25 25 LYS HD3 H 1 1.593 0.030 . 1 . . . . 25 LYS HD3 . 10276 1 236 . 1 1 25 25 LYS HE2 H 1 2.925 0.030 . 1 . . . . 25 LYS HE2 . 10276 1 237 . 1 1 25 25 LYS HE3 H 1 2.925 0.030 . 1 . . . . 25 LYS HE3 . 10276 1 238 . 1 1 25 25 LYS HG2 H 1 1.155 0.030 . 2 . . . . 25 LYS HG2 . 10276 1 239 . 1 1 25 25 LYS HG3 H 1 1.331 0.030 . 2 . . . . 25 LYS HG3 . 10276 1 240 . 1 1 25 25 LYS C C 13 174.726 0.300 . 1 . . . . 25 LYS C . 10276 1 241 . 1 1 25 25 LYS CA C 13 54.565 0.300 . 1 . . . . 25 LYS CA . 10276 1 242 . 1 1 25 25 LYS CB C 13 35.143 0.300 . 1 . . . . 25 LYS CB . 10276 1 243 . 1 1 25 25 LYS CD C 13 29.157 0.300 . 1 . . . . 25 LYS CD . 10276 1 244 . 1 1 25 25 LYS CE C 13 42.464 0.300 . 1 . . . . 25 LYS CE . 10276 1 245 . 1 1 25 25 LYS CG C 13 25.109 0.300 . 1 . . . . 25 LYS CG . 10276 1 246 . 1 1 25 25 LYS N N 15 116.646 0.300 . 1 . . . . 25 LYS N . 10276 1 247 . 1 1 26 26 PHE H H 1 8.361 0.030 . 1 . . . . 26 PHE H . 10276 1 248 . 1 1 26 26 PHE HA H 1 5.005 0.030 . 1 . . . . 26 PHE HA . 10276 1 249 . 1 1 26 26 PHE HB2 H 1 2.805 0.030 . 2 . . . . 26 PHE HB2 . 10276 1 250 . 1 1 26 26 PHE HB3 H 1 2.515 0.030 . 2 . . . . 26 PHE HB3 . 10276 1 251 . 1 1 26 26 PHE HD1 H 1 6.984 0.030 . 1 . . . . 26 PHE HD1 . 10276 1 252 . 1 1 26 26 PHE HD2 H 1 6.984 0.030 . 1 . . . . 26 PHE HD2 . 10276 1 253 . 1 1 26 26 PHE HE1 H 1 7.274 0.030 . 1 . . . . 26 PHE HE1 . 10276 1 254 . 1 1 26 26 PHE HE2 H 1 7.274 0.030 . 1 . . . . 26 PHE HE2 . 10276 1 255 . 1 1 26 26 PHE HZ H 1 7.335 0.030 . 1 . . . . 26 PHE HZ . 10276 1 256 . 1 1 26 26 PHE C C 13 176.228 0.300 . 1 . . . . 26 PHE C . 10276 1 257 . 1 1 26 26 PHE CA C 13 58.236 0.300 . 1 . . . . 26 PHE CA . 10276 1 258 . 1 1 26 26 PHE CB C 13 41.148 0.300 . 1 . . . . 26 PHE CB . 10276 1 259 . 1 1 26 26 PHE CD1 C 13 131.336 0.300 . 1 . . . . 26 PHE CD1 . 10276 1 260 . 1 1 26 26 PHE CD2 C 13 131.336 0.300 . 1 . . . . 26 PHE CD2 . 10276 1 261 . 1 1 26 26 PHE CE1 C 13 132.220 0.300 . 1 . . . . 26 PHE CE1 . 10276 1 262 . 1 1 26 26 PHE CE2 C 13 132.220 0.300 . 1 . . . . 26 PHE CE2 . 10276 1 263 . 1 1 26 26 PHE CZ C 13 130.033 0.300 . 1 . . . . 26 PHE CZ . 10276 1 264 . 1 1 26 26 PHE N N 15 118.446 0.300 . 1 . . . . 26 PHE N . 10276 1 265 . 1 1 27 27 TYR H H 1 8.851 0.030 . 1 . . . . 27 TYR H . 10276 1 266 . 1 1 27 27 TYR HA H 1 5.045 0.030 . 1 . . . . 27 TYR HA . 10276 1 267 . 1 1 27 27 TYR HB2 H 1 3.512 0.030 . 2 . . . . 27 TYR HB2 . 10276 1 268 . 1 1 27 27 TYR HB3 H 1 2.875 0.030 . 2 . . . . 27 TYR HB3 . 10276 1 269 . 1 1 27 27 TYR HD1 H 1 7.094 0.030 . 1 . . . . 27 TYR HD1 . 10276 1 270 . 1 1 27 27 TYR HD2 H 1 7.094 0.030 . 1 . . . . 27 TYR HD2 . 10276 1 271 . 1 1 27 27 TYR HE1 H 1 7.212 0.030 . 1 . . . . 27 TYR HE1 . 10276 1 272 . 1 1 27 27 TYR HE2 H 1 7.212 0.030 . 1 . . . . 27 TYR HE2 . 10276 1 273 . 1 1 27 27 TYR C C 13 175.380 0.300 . 1 . . . . 27 TYR C . 10276 1 274 . 1 1 27 27 TYR CA C 13 56.594 0.300 . 1 . . . . 27 TYR CA . 10276 1 275 . 1 1 27 27 TYR CB C 13 43.856 0.300 . 1 . . . . 27 TYR CB . 10276 1 276 . 1 1 27 27 TYR CD1 C 13 133.367 0.300 . 1 . . . . 27 TYR CD1 . 10276 1 277 . 1 1 27 27 TYR CD2 C 13 133.367 0.300 . 1 . . . . 27 TYR CD2 . 10276 1 278 . 1 1 27 27 TYR CE1 C 13 118.423 0.300 . 1 . . . . 27 TYR CE1 . 10276 1 279 . 1 1 27 27 TYR CE2 C 13 118.423 0.300 . 1 . . . . 27 TYR CE2 . 10276 1 280 . 1 1 27 27 TYR N N 15 118.823 0.300 . 1 . . . . 27 TYR N . 10276 1 281 . 1 1 28 28 ARG H H 1 9.026 0.030 . 1 . . . . 28 ARG H . 10276 1 282 . 1 1 28 28 ARG HA H 1 4.202 0.030 . 1 . . . . 28 ARG HA . 10276 1 283 . 1 1 28 28 ARG HB2 H 1 1.784 0.030 . 1 . . . . 28 ARG HB2 . 10276 1 284 . 1 1 28 28 ARG HB3 H 1 1.784 0.030 . 1 . . . . 28 ARG HB3 . 10276 1 285 . 1 1 28 28 ARG HD2 H 1 2.938 0.030 . 2 . . . . 28 ARG HD2 . 10276 1 286 . 1 1 28 28 ARG HD3 H 1 3.045 0.030 . 2 . . . . 28 ARG HD3 . 10276 1 287 . 1 1 28 28 ARG HE H 1 7.506 0.030 . 1 . . . . 28 ARG HE . 10276 1 288 . 1 1 28 28 ARG HG2 H 1 1.578 0.030 . 1 . . . . 28 ARG HG2 . 10276 1 289 . 1 1 28 28 ARG HG3 H 1 1.578 0.030 . 1 . . . . 28 ARG HG3 . 10276 1 290 . 1 1 28 28 ARG C C 13 175.789 0.300 . 1 . . . . 28 ARG C . 10276 1 291 . 1 1 28 28 ARG CA C 13 57.142 0.300 . 1 . . . . 28 ARG CA . 10276 1 292 . 1 1 28 28 ARG CB C 13 30.291 0.300 . 1 . . . . 28 ARG CB . 10276 1 293 . 1 1 28 28 ARG CD C 13 42.875 0.300 . 1 . . . . 28 ARG CD . 10276 1 294 . 1 1 28 28 ARG CG C 13 27.905 0.300 . 1 . . . . 28 ARG CG . 10276 1 295 . 1 1 28 28 ARG N N 15 122.262 0.300 . 1 . . . . 28 ARG N . 10276 1 296 . 1 1 28 28 ARG NE N 15 84.466 0.300 . 1 . . . . 28 ARG NE . 10276 1 297 . 1 1 29 29 ALA H H 1 9.157 0.030 . 1 . . . . 29 ALA H . 10276 1 298 . 1 1 29 29 ALA HA H 1 5.098 0.030 . 1 . . . . 29 ALA HA . 10276 1 299 . 1 1 29 29 ALA HB1 H 1 0.684 0.030 . 1 . . . . 29 ALA HB . 10276 1 300 . 1 1 29 29 ALA HB2 H 1 0.684 0.030 . 1 . . . . 29 ALA HB . 10276 1 301 . 1 1 29 29 ALA HB3 H 1 0.684 0.030 . 1 . . . . 29 ALA HB . 10276 1 302 . 1 1 29 29 ALA C C 13 175.247 0.300 . 1 . . . . 29 ALA C . 10276 1 303 . 1 1 29 29 ALA CA C 13 51.188 0.300 . 1 . . . . 29 ALA CA . 10276 1 304 . 1 1 29 29 ALA CB C 13 23.153 0.300 . 1 . . . . 29 ALA CB . 10276 1 305 . 1 1 29 29 ALA N N 15 126.768 0.300 . 1 . . . . 29 ALA N . 10276 1 306 . 1 1 30 30 GLU H H 1 8.167 0.030 . 1 . . . . 30 GLU H . 10276 1 307 . 1 1 30 30 GLU HA H 1 5.085 0.030 . 1 . . . . 30 GLU HA . 10276 1 308 . 1 1 30 30 GLU HB2 H 1 1.736 0.030 . 1 . . . . 30 GLU HB2 . 10276 1 309 . 1 1 30 30 GLU HB3 H 1 1.736 0.030 . 1 . . . . 30 GLU HB3 . 10276 1 310 . 1 1 30 30 GLU HG2 H 1 2.016 0.030 . 1 . . . . 30 GLU HG2 . 10276 1 311 . 1 1 30 30 GLU HG3 H 1 2.016 0.030 . 1 . . . . 30 GLU HG3 . 10276 1 312 . 1 1 30 30 GLU C C 13 176.265 0.300 . 1 . . . . 30 GLU C . 10276 1 313 . 1 1 30 30 GLU CA C 13 53.948 0.300 . 1 . . . . 30 GLU CA . 10276 1 314 . 1 1 30 30 GLU CB C 13 33.622 0.300 . 1 . . . . 30 GLU CB . 10276 1 315 . 1 1 30 30 GLU CG C 13 36.642 0.300 . 1 . . . . 30 GLU CG . 10276 1 316 . 1 1 30 30 GLU N N 15 118.036 0.300 . 1 . . . . 30 GLU N . 10276 1 317 . 1 1 31 31 VAL H H 1 8.961 0.030 . 1 . . . . 31 VAL H . 10276 1 318 . 1 1 31 31 VAL HA H 1 3.545 0.030 . 1 . . . . 31 VAL HA . 10276 1 319 . 1 1 31 31 VAL HB H 1 2.256 0.030 . 1 . . . . 31 VAL HB . 10276 1 320 . 1 1 31 31 VAL HG11 H 1 0.529 0.030 . 1 . . . . 31 VAL HG1 . 10276 1 321 . 1 1 31 31 VAL HG12 H 1 0.529 0.030 . 1 . . . . 31 VAL HG1 . 10276 1 322 . 1 1 31 31 VAL HG13 H 1 0.529 0.030 . 1 . . . . 31 VAL HG1 . 10276 1 323 . 1 1 31 31 VAL HG21 H 1 0.648 0.030 . 1 . . . . 31 VAL HG2 . 10276 1 324 . 1 1 31 31 VAL HG22 H 1 0.648 0.030 . 1 . . . . 31 VAL HG2 . 10276 1 325 . 1 1 31 31 VAL HG23 H 1 0.648 0.030 . 1 . . . . 31 VAL HG2 . 10276 1 326 . 1 1 31 31 VAL C C 13 175.369 0.300 . 1 . . . . 31 VAL C . 10276 1 327 . 1 1 31 31 VAL CA C 13 64.571 0.300 . 1 . . . . 31 VAL CA . 10276 1 328 . 1 1 31 31 VAL CB C 13 31.678 0.300 . 1 . . . . 31 VAL CB . 10276 1 329 . 1 1 31 31 VAL CG1 C 13 21.691 0.300 . 2 . . . . 31 VAL CG1 . 10276 1 330 . 1 1 31 31 VAL CG2 C 13 22.331 0.300 . 2 . . . . 31 VAL CG2 . 10276 1 331 . 1 1 31 31 VAL N N 15 124.010 0.300 . 1 . . . . 31 VAL N . 10276 1 332 . 1 1 32 32 GLU H H 1 9.483 0.030 . 1 . . . . 32 GLU H . 10276 1 333 . 1 1 32 32 GLU HA H 1 4.627 0.030 . 1 . . . . 32 GLU HA . 10276 1 334 . 1 1 32 32 GLU HB2 H 1 1.935 0.030 . 2 . . . . 32 GLU HB2 . 10276 1 335 . 1 1 32 32 GLU HB3 H 1 1.804 0.030 . 2 . . . . 32 GLU HB3 . 10276 1 336 . 1 1 32 32 GLU HG2 H 1 2.220 0.030 . 2 . . . . 32 GLU HG2 . 10276 1 337 . 1 1 32 32 GLU HG3 H 1 2.115 0.030 . 2 . . . . 32 GLU HG3 . 10276 1 338 . 1 1 32 32 GLU C C 13 175.695 0.300 . 1 . . . . 32 GLU C . 10276 1 339 . 1 1 32 32 GLU CA C 13 56.841 0.300 . 1 . . . . 32 GLU CA . 10276 1 340 . 1 1 32 32 GLU CB C 13 30.661 0.300 . 1 . . . . 32 GLU CB . 10276 1 341 . 1 1 32 32 GLU CG C 13 34.979 0.300 . 1 . . . . 32 GLU CG . 10276 1 342 . 1 1 32 32 GLU N N 15 130.912 0.300 . 1 . . . . 32 GLU N . 10276 1 343 . 1 1 33 33 ALA H H 1 7.838 0.030 . 1 . . . . 33 ALA H . 10276 1 344 . 1 1 33 33 ALA HA H 1 4.456 0.030 . 1 . . . . 33 ALA HA . 10276 1 345 . 1 1 33 33 ALA HB1 H 1 1.292 0.030 . 1 . . . . 33 ALA HB . 10276 1 346 . 1 1 33 33 ALA HB2 H 1 1.292 0.030 . 1 . . . . 33 ALA HB . 10276 1 347 . 1 1 33 33 ALA HB3 H 1 1.292 0.030 . 1 . . . . 33 ALA HB . 10276 1 348 . 1 1 33 33 ALA C C 13 174.956 0.300 . 1 . . . . 33 ALA C . 10276 1 349 . 1 1 33 33 ALA CA C 13 51.777 0.300 . 1 . . . . 33 ALA CA . 10276 1 350 . 1 1 33 33 ALA CB C 13 22.189 0.300 . 1 . . . . 33 ALA CB . 10276 1 351 . 1 1 33 33 ALA N N 15 117.714 0.300 . 1 . . . . 33 ALA N . 10276 1 352 . 1 1 34 34 LEU H H 1 8.954 0.030 . 1 . . . . 34 LEU H . 10276 1 353 . 1 1 34 34 LEU HA H 1 4.702 0.030 . 1 . . . . 34 LEU HA . 10276 1 354 . 1 1 34 34 LEU HB2 H 1 1.706 0.030 . 1 . . . . 34 LEU HB2 . 10276 1 355 . 1 1 34 34 LEU HB3 H 1 1.706 0.030 . 1 . . . . 34 LEU HB3 . 10276 1 356 . 1 1 34 34 LEU HD11 H 1 0.975 0.030 . 1 . . . . 34 LEU HD1 . 10276 1 357 . 1 1 34 34 LEU HD12 H 1 0.975 0.030 . 1 . . . . 34 LEU HD1 . 10276 1 358 . 1 1 34 34 LEU HD13 H 1 0.975 0.030 . 1 . . . . 34 LEU HD1 . 10276 1 359 . 1 1 34 34 LEU HD21 H 1 0.842 0.030 . 1 . . . . 34 LEU HD2 . 10276 1 360 . 1 1 34 34 LEU HD22 H 1 0.842 0.030 . 1 . . . . 34 LEU HD2 . 10276 1 361 . 1 1 34 34 LEU HD23 H 1 0.842 0.030 . 1 . . . . 34 LEU HD2 . 10276 1 362 . 1 1 34 34 LEU HG H 1 1.613 0.030 . 1 . . . . 34 LEU HG . 10276 1 363 . 1 1 34 34 LEU C C 13 176.325 0.300 . 1 . . . . 34 LEU C . 10276 1 364 . 1 1 34 34 LEU CA C 13 53.559 0.300 . 1 . . . . 34 LEU CA . 10276 1 365 . 1 1 34 34 LEU CB C 13 42.381 0.300 . 1 . . . . 34 LEU CB . 10276 1 366 . 1 1 34 34 LEU CD1 C 13 25.075 0.300 . 2 . . . . 34 LEU CD1 . 10276 1 367 . 1 1 34 34 LEU CD2 C 13 23.956 0.300 . 2 . . . . 34 LEU CD2 . 10276 1 368 . 1 1 34 34 LEU CG C 13 27.931 0.300 . 1 . . . . 34 LEU CG . 10276 1 369 . 1 1 34 34 LEU N N 15 122.418 0.300 . 1 . . . . 34 LEU N . 10276 1 370 . 1 1 35 35 HIS H H 1 8.022 0.030 . 1 . . . . 35 HIS H . 10276 1 371 . 1 1 35 35 HIS HA H 1 4.544 0.030 . 1 . . . . 35 HIS HA . 10276 1 372 . 1 1 35 35 HIS HB2 H 1 3.083 0.030 . 1 . . . . 35 HIS HB2 . 10276 1 373 . 1 1 35 35 HIS HB3 H 1 3.083 0.030 . 1 . . . . 35 HIS HB3 . 10276 1 374 . 1 1 35 35 HIS HD2 H 1 6.990 0.030 . 1 . . . . 35 HIS HD2 . 10276 1 375 . 1 1 35 35 HIS HE1 H 1 7.705 0.030 . 1 . . . . 35 HIS HE1 . 10276 1 376 . 1 1 35 35 HIS C C 13 178.300 0.300 . 1 . . . . 35 HIS C . 10276 1 377 . 1 1 35 35 HIS CA C 13 57.706 0.300 . 1 . . . . 35 HIS CA . 10276 1 378 . 1 1 35 35 HIS CB C 13 32.594 0.300 . 1 . . . . 35 HIS CB . 10276 1 379 . 1 1 35 35 HIS CD2 C 13 117.912 0.300 . 1 . . . . 35 HIS CD2 . 10276 1 380 . 1 1 35 35 HIS CE1 C 13 138.123 0.300 . 1 . . . . 35 HIS CE1 . 10276 1 381 . 1 1 35 35 HIS N N 15 123.729 0.300 . 1 . . . . 35 HIS N . 10276 1 382 . 1 1 37 37 SER H H 1 10.111 0.030 . 1 . . . . 37 SER H . 10276 1 383 . 1 1 37 37 SER HA H 1 4.339 0.030 . 1 . . . . 37 SER HA . 10276 1 384 . 1 1 37 37 SER HB2 H 1 4.047 0.030 . 2 . . . . 37 SER HB2 . 10276 1 385 . 1 1 37 37 SER HB3 H 1 4.184 0.030 . 2 . . . . 37 SER HB3 . 10276 1 386 . 1 1 37 37 SER C C 13 176.434 0.300 . 1 . . . . 37 SER C . 10276 1 387 . 1 1 37 37 SER CA C 13 59.895 0.300 . 1 . . . . 37 SER CA . 10276 1 388 . 1 1 37 37 SER CB C 13 63.665 0.300 . 1 . . . . 37 SER CB . 10276 1 389 . 1 1 37 37 SER N N 15 119.788 0.300 . 1 . . . . 37 SER N . 10276 1 390 . 1 1 38 38 GLY H H 1 8.136 0.030 . 1 . . . . 38 GLY H . 10276 1 391 . 1 1 38 38 GLY HA2 H 1 4.257 0.030 . 2 . . . . 38 GLY HA2 . 10276 1 392 . 1 1 38 38 GLY HA3 H 1 3.981 0.030 . 2 . . . . 38 GLY HA3 . 10276 1 393 . 1 1 38 38 GLY C C 13 174.441 0.300 . 1 . . . . 38 GLY C . 10276 1 394 . 1 1 38 38 GLY CA C 13 46.006 0.300 . 1 . . . . 38 GLY CA . 10276 1 395 . 1 1 38 38 GLY N N 15 108.557 0.300 . 1 . . . . 38 GLY N . 10276 1 396 . 1 1 39 39 MET H H 1 8.180 0.030 . 1 . . . . 39 MET H . 10276 1 397 . 1 1 39 39 MET HA H 1 4.789 0.030 . 1 . . . . 39 MET HA . 10276 1 398 . 1 1 39 39 MET HB2 H 1 2.154 0.030 . 2 . . . . 39 MET HB2 . 10276 1 399 . 1 1 39 39 MET HB3 H 1 2.075 0.030 . 2 . . . . 39 MET HB3 . 10276 1 400 . 1 1 39 39 MET HE1 H 1 2.105 0.030 . 1 . . . . 39 MET HE . 10276 1 401 . 1 1 39 39 MET HE2 H 1 2.105 0.030 . 1 . . . . 39 MET HE . 10276 1 402 . 1 1 39 39 MET HE3 H 1 2.105 0.030 . 1 . . . . 39 MET HE . 10276 1 403 . 1 1 39 39 MET HG2 H 1 2.453 0.030 . 2 . . . . 39 MET HG2 . 10276 1 404 . 1 1 39 39 MET HG3 H 1 2.670 0.030 . 2 . . . . 39 MET HG3 . 10276 1 405 . 1 1 39 39 MET C C 13 177.404 0.300 . 1 . . . . 39 MET C . 10276 1 406 . 1 1 39 39 MET CA C 13 55.889 0.300 . 1 . . . . 39 MET CA . 10276 1 407 . 1 1 39 39 MET CB C 13 34.033 0.300 . 1 . . . . 39 MET CB . 10276 1 408 . 1 1 39 39 MET CE C 13 16.749 0.300 . 1 . . . . 39 MET CE . 10276 1 409 . 1 1 39 39 MET CG C 13 32.018 0.300 . 1 . . . . 39 MET CG . 10276 1 410 . 1 1 39 39 MET N N 15 113.829 0.300 . 1 . . . . 39 MET N . 10276 1 411 . 1 1 40 40 THR H H 1 7.174 0.030 . 1 . . . . 40 THR H . 10276 1 412 . 1 1 40 40 THR HA H 1 5.182 0.030 . 1 . . . . 40 THR HA . 10276 1 413 . 1 1 40 40 THR HB H 1 4.049 0.030 . 1 . . . . 40 THR HB . 10276 1 414 . 1 1 40 40 THR HG21 H 1 0.974 0.030 . 1 . . . . 40 THR HG2 . 10276 1 415 . 1 1 40 40 THR HG22 H 1 0.974 0.030 . 1 . . . . 40 THR HG2 . 10276 1 416 . 1 1 40 40 THR HG23 H 1 0.974 0.030 . 1 . . . . 40 THR HG2 . 10276 1 417 . 1 1 40 40 THR C C 13 172.981 0.300 . 1 . . . . 40 THR C . 10276 1 418 . 1 1 40 40 THR CA C 13 59.559 0.300 . 1 . . . . 40 THR CA . 10276 1 419 . 1 1 40 40 THR CB C 13 73.120 0.300 . 1 . . . . 40 THR CB . 10276 1 420 . 1 1 40 40 THR CG2 C 13 22.312 0.300 . 1 . . . . 40 THR CG2 . 10276 1 421 . 1 1 40 40 THR N N 15 108.160 0.300 . 1 . . . . 40 THR N . 10276 1 422 . 1 1 41 41 ALA H H 1 9.245 0.030 . 1 . . . . 41 ALA H . 10276 1 423 . 1 1 41 41 ALA HA H 1 4.932 0.030 . 1 . . . . 41 ALA HA . 10276 1 424 . 1 1 41 41 ALA HB1 H 1 1.103 0.030 . 1 . . . . 41 ALA HB . 10276 1 425 . 1 1 41 41 ALA HB2 H 1 1.103 0.030 . 1 . . . . 41 ALA HB . 10276 1 426 . 1 1 41 41 ALA HB3 H 1 1.103 0.030 . 1 . . . . 41 ALA HB . 10276 1 427 . 1 1 41 41 ALA C C 13 175.635 0.300 . 1 . . . . 41 ALA C . 10276 1 428 . 1 1 41 41 ALA CA C 13 50.417 0.300 . 1 . . . . 41 ALA CA . 10276 1 429 . 1 1 41 41 ALA CB C 13 22.600 0.300 . 1 . . . . 41 ALA CB . 10276 1 430 . 1 1 41 41 ALA N N 15 122.138 0.300 . 1 . . . . 41 ALA N . 10276 1 431 . 1 1 42 42 VAL H H 1 8.773 0.030 . 1 . . . . 42 VAL H . 10276 1 432 . 1 1 42 42 VAL HA H 1 4.789 0.030 . 1 . . . . 42 VAL HA . 10276 1 433 . 1 1 42 42 VAL HB H 1 1.835 0.030 . 1 . . . . 42 VAL HB . 10276 1 434 . 1 1 42 42 VAL HG11 H 1 0.929 0.030 . 1 . . . . 42 VAL HG1 . 10276 1 435 . 1 1 42 42 VAL HG12 H 1 0.929 0.030 . 1 . . . . 42 VAL HG1 . 10276 1 436 . 1 1 42 42 VAL HG13 H 1 0.929 0.030 . 1 . . . . 42 VAL HG1 . 10276 1 437 . 1 1 42 42 VAL HG21 H 1 0.932 0.030 . 1 . . . . 42 VAL HG2 . 10276 1 438 . 1 1 42 42 VAL HG22 H 1 0.932 0.030 . 1 . . . . 42 VAL HG2 . 10276 1 439 . 1 1 42 42 VAL HG23 H 1 0.932 0.030 . 1 . . . . 42 VAL HG2 . 10276 1 440 . 1 1 42 42 VAL C C 13 176.410 0.300 . 1 . . . . 42 VAL C . 10276 1 441 . 1 1 42 42 VAL CA C 13 62.083 0.300 . 1 . . . . 42 VAL CA . 10276 1 442 . 1 1 42 42 VAL CB C 13 32.776 0.300 . 1 . . . . 42 VAL CB . 10276 1 443 . 1 1 42 42 VAL CG1 C 13 21.164 0.300 . 2 . . . . 42 VAL CG1 . 10276 1 444 . 1 1 42 42 VAL CG2 C 13 21.491 0.300 . 2 . . . . 42 VAL CG2 . 10276 1 445 . 1 1 42 42 VAL N N 15 120.320 0.300 . 1 . . . . 42 VAL N . 10276 1 446 . 1 1 43 43 VAL H H 1 9.224 0.030 . 1 . . . . 43 VAL H . 10276 1 447 . 1 1 43 43 VAL HA H 1 5.013 0.030 . 1 . . . . 43 VAL HA . 10276 1 448 . 1 1 43 43 VAL HB H 1 1.387 0.030 . 1 . . . . 43 VAL HB . 10276 1 449 . 1 1 43 43 VAL HG11 H 1 0.406 0.030 . 1 . . . . 43 VAL HG1 . 10276 1 450 . 1 1 43 43 VAL HG12 H 1 0.406 0.030 . 1 . . . . 43 VAL HG1 . 10276 1 451 . 1 1 43 43 VAL HG13 H 1 0.406 0.030 . 1 . . . . 43 VAL HG1 . 10276 1 452 . 1 1 43 43 VAL HG21 H 1 0.160 0.030 . 1 . . . . 43 VAL HG2 . 10276 1 453 . 1 1 43 43 VAL HG22 H 1 0.160 0.030 . 1 . . . . 43 VAL HG2 . 10276 1 454 . 1 1 43 43 VAL HG23 H 1 0.160 0.030 . 1 . . . . 43 VAL HG2 . 10276 1 455 . 1 1 43 43 VAL C C 13 172.532 0.300 . 1 . . . . 43 VAL C . 10276 1 456 . 1 1 43 43 VAL CA C 13 57.812 0.300 . 1 . . . . 43 VAL CA . 10276 1 457 . 1 1 43 43 VAL CB C 13 34.280 0.300 . 1 . . . . 43 VAL CB . 10276 1 458 . 1 1 43 43 VAL CG1 C 13 21.061 0.300 . 2 . . . . 43 VAL CG1 . 10276 1 459 . 1 1 43 43 VAL CG2 C 13 18.283 0.300 . 2 . . . . 43 VAL CG2 . 10276 1 460 . 1 1 43 43 VAL N N 15 121.151 0.300 . 1 . . . . 43 VAL N . 10276 1 461 . 1 1 44 44 LYS H H 1 8.645 0.030 . 1 . . . . 44 LYS H . 10276 1 462 . 1 1 44 44 LYS HA H 1 4.627 0.030 . 1 . . . . 44 LYS HA . 10276 1 463 . 1 1 44 44 LYS HB2 H 1 1.500 0.030 . 2 . . . . 44 LYS HB2 . 10276 1 464 . 1 1 44 44 LYS HB3 H 1 1.122 0.030 . 2 . . . . 44 LYS HB3 . 10276 1 465 . 1 1 44 44 LYS HD2 H 1 1.407 0.030 . 2 . . . . 44 LYS HD2 . 10276 1 466 . 1 1 44 44 LYS HD3 H 1 1.324 0.030 . 2 . . . . 44 LYS HD3 . 10276 1 467 . 1 1 44 44 LYS HE2 H 1 2.725 0.030 . 2 . . . . 44 LYS HE2 . 10276 1 468 . 1 1 44 44 LYS HE3 H 1 2.650 0.030 . 2 . . . . 44 LYS HE3 . 10276 1 469 . 1 1 44 44 LYS HG2 H 1 0.308 0.030 . 2 . . . . 44 LYS HG2 . 10276 1 470 . 1 1 44 44 LYS HG3 H 1 0.502 0.030 . 2 . . . . 44 LYS HG3 . 10276 1 471 . 1 1 44 44 LYS C C 13 177.419 0.300 . 1 . . . . 44 LYS C . 10276 1 472 . 1 1 44 44 LYS CA C 13 53.612 0.300 . 1 . . . . 44 LYS CA . 10276 1 473 . 1 1 44 44 LYS CB C 13 35.143 0.300 . 1 . . . . 44 LYS CB . 10276 1 474 . 1 1 44 44 LYS CD C 13 29.221 0.300 . 1 . . . . 44 LYS CD . 10276 1 475 . 1 1 44 44 LYS CE C 13 41.888 0.300 . 1 . . . . 44 LYS CE . 10276 1 476 . 1 1 44 44 LYS CG C 13 24.122 0.300 . 1 . . . . 44 LYS CG . 10276 1 477 . 1 1 44 44 LYS N N 15 121.425 0.300 . 1 . . . . 44 LYS N . 10276 1 478 . 1 1 45 45 PHE H H 1 8.823 0.030 . 1 . . . . 45 PHE H . 10276 1 479 . 1 1 45 45 PHE HA H 1 4.505 0.030 . 1 . . . . 45 PHE HA . 10276 1 480 . 1 1 45 45 PHE HB2 H 1 3.115 0.030 . 2 . . . . 45 PHE HB2 . 10276 1 481 . 1 1 45 45 PHE HB3 H 1 3.215 0.030 . 2 . . . . 45 PHE HB3 . 10276 1 482 . 1 1 45 45 PHE HD1 H 1 7.216 0.030 . 1 . . . . 45 PHE HD1 . 10276 1 483 . 1 1 45 45 PHE HD2 H 1 7.216 0.030 . 1 . . . . 45 PHE HD2 . 10276 1 484 . 1 1 45 45 PHE HE1 H 1 7.389 0.030 . 1 . . . . 45 PHE HE1 . 10276 1 485 . 1 1 45 45 PHE HE2 H 1 7.389 0.030 . 1 . . . . 45 PHE HE2 . 10276 1 486 . 1 1 45 45 PHE HZ H 1 6.955 0.030 . 1 . . . . 45 PHE HZ . 10276 1 487 . 1 1 45 45 PHE C C 13 177.585 0.300 . 1 . . . . 45 PHE C . 10276 1 488 . 1 1 45 45 PHE CA C 13 59.841 0.300 . 1 . . . . 45 PHE CA . 10276 1 489 . 1 1 45 45 PHE CB C 13 38.598 0.300 . 1 . . . . 45 PHE CB . 10276 1 490 . 1 1 45 45 PHE CD1 C 13 131.941 0.300 . 1 . . . . 45 PHE CD1 . 10276 1 491 . 1 1 45 45 PHE CD2 C 13 131.941 0.300 . 1 . . . . 45 PHE CD2 . 10276 1 492 . 1 1 45 45 PHE CE1 C 13 131.398 0.300 . 1 . . . . 45 PHE CE1 . 10276 1 493 . 1 1 45 45 PHE CE2 C 13 131.398 0.300 . 1 . . . . 45 PHE CE2 . 10276 1 494 . 1 1 45 45 PHE CZ C 13 128.839 0.300 . 1 . . . . 45 PHE CZ . 10276 1 495 . 1 1 45 45 PHE N N 15 128.232 0.300 . 1 . . . . 45 PHE N . 10276 1 496 . 1 1 46 46 THR H H 1 8.281 0.030 . 1 . . . . 46 THR H . 10276 1 497 . 1 1 46 46 THR HA H 1 3.738 0.030 . 1 . . . . 46 THR HA . 10276 1 498 . 1 1 46 46 THR HB H 1 3.876 0.030 . 1 . . . . 46 THR HB . 10276 1 499 . 1 1 46 46 THR HG21 H 1 1.106 0.030 . 1 . . . . 46 THR HG2 . 10276 1 500 . 1 1 46 46 THR HG22 H 1 1.106 0.030 . 1 . . . . 46 THR HG2 . 10276 1 501 . 1 1 46 46 THR HG23 H 1 1.106 0.030 . 1 . . . . 46 THR HG2 . 10276 1 502 . 1 1 46 46 THR C C 13 176.410 0.300 . 1 . . . . 46 THR C . 10276 1 503 . 1 1 46 46 THR CA C 13 65.930 0.300 . 1 . . . . 46 THR CA . 10276 1 504 . 1 1 46 46 THR CB C 13 68.743 0.300 . 1 . . . . 46 THR CB . 10276 1 505 . 1 1 46 46 THR CG2 C 13 22.312 0.300 . 1 . . . . 46 THR CG2 . 10276 1 506 . 1 1 46 46 THR N N 15 120.729 0.300 . 1 . . . . 46 THR N . 10276 1 507 . 1 1 47 47 ASP H H 1 9.166 0.030 . 1 . . . . 47 ASP H . 10276 1 508 . 1 1 47 47 ASP HA H 1 4.300 0.030 . 1 . . . . 47 ASP HA . 10276 1 509 . 1 1 47 47 ASP HB2 H 1 2.095 0.030 . 2 . . . . 47 ASP HB2 . 10276 1 510 . 1 1 47 47 ASP HB3 H 1 2.134 0.030 . 2 . . . . 47 ASP HB3 . 10276 1 511 . 1 1 47 47 ASP C C 13 176.844 0.300 . 1 . . . . 47 ASP C . 10276 1 512 . 1 1 47 47 ASP CA C 13 57.283 0.300 . 1 . . . . 47 ASP CA . 10276 1 513 . 1 1 47 47 ASP CB C 13 40.037 0.300 . 1 . . . . 47 ASP CB . 10276 1 514 . 1 1 47 47 ASP N N 15 120.635 0.300 . 1 . . . . 47 ASP N . 10276 1 515 . 1 1 48 48 TYR H H 1 7.676 0.030 . 1 . . . . 48 TYR H . 10276 1 516 . 1 1 48 48 TYR HA H 1 4.605 0.030 . 1 . . . . 48 TYR HA . 10276 1 517 . 1 1 48 48 TYR HB2 H 1 3.125 0.030 . 2 . . . . 48 TYR HB2 . 10276 1 518 . 1 1 48 48 TYR HB3 H 1 2.706 0.030 . 2 . . . . 48 TYR HB3 . 10276 1 519 . 1 1 48 48 TYR HD1 H 1 6.814 0.030 . 1 . . . . 48 TYR HD1 . 10276 1 520 . 1 1 48 48 TYR HD2 H 1 6.814 0.030 . 1 . . . . 48 TYR HD2 . 10276 1 521 . 1 1 48 48 TYR HE1 H 1 6.420 0.030 . 1 . . . . 48 TYR HE1 . 10276 1 522 . 1 1 48 48 TYR HE2 H 1 6.420 0.030 . 1 . . . . 48 TYR HE2 . 10276 1 523 . 1 1 48 48 TYR C C 13 177.343 0.300 . 1 . . . . 48 TYR C . 10276 1 524 . 1 1 48 48 TYR CA C 13 57.777 0.300 . 1 . . . . 48 TYR CA . 10276 1 525 . 1 1 48 48 TYR CB C 13 39.914 0.300 . 1 . . . . 48 TYR CB . 10276 1 526 . 1 1 48 48 TYR CD1 C 13 132.638 0.300 . 1 . . . . 48 TYR CD1 . 10276 1 527 . 1 1 48 48 TYR CD2 C 13 132.638 0.300 . 1 . . . . 48 TYR CD2 . 10276 1 528 . 1 1 48 48 TYR CE1 C 13 118.113 0.300 . 1 . . . . 48 TYR CE1 . 10276 1 529 . 1 1 48 48 TYR CE2 C 13 118.113 0.300 . 1 . . . . 48 TYR CE2 . 10276 1 530 . 1 1 48 48 TYR N N 15 114.763 0.300 . 1 . . . . 48 TYR N . 10276 1 531 . 1 1 49 49 GLY H H 1 8.065 0.030 . 1 . . . . 49 GLY H . 10276 1 532 . 1 1 49 49 GLY HA2 H 1 4.023 0.030 . 2 . . . . 49 GLY HA2 . 10276 1 533 . 1 1 49 49 GLY HA3 H 1 3.571 0.030 . 2 . . . . 49 GLY HA3 . 10276 1 534 . 1 1 49 49 GLY C C 13 172.707 0.300 . 1 . . . . 49 GLY C . 10276 1 535 . 1 1 49 49 GLY CA C 13 46.165 0.300 . 1 . . . . 49 GLY CA . 10276 1 536 . 1 1 49 49 GLY N N 15 107.679 0.300 . 1 . . . . 49 GLY N . 10276 1 537 . 1 1 50 50 ASN H H 1 8.836 0.030 . 1 . . . . 50 ASN H . 10276 1 538 . 1 1 50 50 ASN HA H 1 4.777 0.030 . 1 . . . . 50 ASN HA . 10276 1 539 . 1 1 50 50 ASN HB2 H 1 2.794 0.030 . 2 . . . . 50 ASN HB2 . 10276 1 540 . 1 1 50 50 ASN HB3 H 1 2.834 0.030 . 2 . . . . 50 ASN HB3 . 10276 1 541 . 1 1 50 50 ASN HD21 H 1 8.639 0.030 . 2 . . . . 50 ASN HD21 . 10276 1 542 . 1 1 50 50 ASN HD22 H 1 5.734 0.030 . 2 . . . . 50 ASN HD22 . 10276 1 543 . 1 1 50 50 ASN C C 13 173.696 0.300 . 1 . . . . 50 ASN C . 10276 1 544 . 1 1 50 50 ASN CA C 13 52.747 0.300 . 1 . . . . 50 ASN CA . 10276 1 545 . 1 1 50 50 ASN CB C 13 37.710 0.300 . 1 . . . . 50 ASN CB . 10276 1 546 . 1 1 50 50 ASN N N 15 114.795 0.300 . 1 . . . . 50 ASN N . 10276 1 547 . 1 1 50 50 ASN ND2 N 15 114.892 0.300 . 1 . . . . 50 ASN ND2 . 10276 1 548 . 1 1 51 51 TYR H H 1 8.726 0.030 . 1 . . . . 51 TYR H . 10276 1 549 . 1 1 51 51 TYR HA H 1 5.696 0.030 . 1 . . . . 51 TYR HA . 10276 1 550 . 1 1 51 51 TYR HB2 H 1 2.864 0.030 . 2 . . . . 51 TYR HB2 . 10276 1 551 . 1 1 51 51 TYR HB3 H 1 2.665 0.030 . 2 . . . . 51 TYR HB3 . 10276 1 552 . 1 1 51 51 TYR HD1 H 1 7.012 0.030 . 1 . . . . 51 TYR HD1 . 10276 1 553 . 1 1 51 51 TYR HD2 H 1 7.012 0.030 . 1 . . . . 51 TYR HD2 . 10276 1 554 . 1 1 51 51 TYR HE1 H 1 6.755 0.030 . 1 . . . . 51 TYR HE1 . 10276 1 555 . 1 1 51 51 TYR HE2 H 1 6.755 0.030 . 1 . . . . 51 TYR HE2 . 10276 1 556 . 1 1 51 51 TYR C C 13 176.871 0.300 . 1 . . . . 51 TYR C . 10276 1 557 . 1 1 51 51 TYR CA C 13 56.789 0.300 . 1 . . . . 51 TYR CA . 10276 1 558 . 1 1 51 51 TYR CB C 13 40.037 0.300 . 1 . . . . 51 TYR CB . 10276 1 559 . 1 1 51 51 TYR CD1 C 13 133.119 0.300 . 1 . . . . 51 TYR CD1 . 10276 1 560 . 1 1 51 51 TYR CD2 C 13 133.119 0.300 . 1 . . . . 51 TYR CD2 . 10276 1 561 . 1 1 51 51 TYR CE1 C 13 117.958 0.300 . 1 . . . . 51 TYR CE1 . 10276 1 562 . 1 1 51 51 TYR CE2 C 13 117.958 0.300 . 1 . . . . 51 TYR CE2 . 10276 1 563 . 1 1 51 51 TYR N N 15 120.703 0.300 . 1 . . . . 51 TYR N . 10276 1 564 . 1 1 52 52 GLU H H 1 8.995 0.030 . 1 . . . . 52 GLU H . 10276 1 565 . 1 1 52 52 GLU HA H 1 4.981 0.030 . 1 . . . . 52 GLU HA . 10276 1 566 . 1 1 52 52 GLU HB2 H 1 2.485 0.030 . 2 . . . . 52 GLU HB2 . 10276 1 567 . 1 1 52 52 GLU HB3 H 1 1.754 0.030 . 2 . . . . 52 GLU HB3 . 10276 1 568 . 1 1 52 52 GLU HG2 H 1 2.545 0.030 . 2 . . . . 52 GLU HG2 . 10276 1 569 . 1 1 52 52 GLU HG3 H 1 2.814 0.030 . 2 . . . . 52 GLU HG3 . 10276 1 570 . 1 1 52 52 GLU C C 13 174.629 0.300 . 1 . . . . 52 GLU C . 10276 1 571 . 1 1 52 52 GLU CA C 13 54.070 0.300 . 1 . . . . 52 GLU CA . 10276 1 572 . 1 1 52 52 GLU CB C 13 34.814 0.300 . 1 . . . . 52 GLU CB . 10276 1 573 . 1 1 52 52 GLU CG C 13 35.516 0.300 . 1 . . . . 52 GLU CG . 10276 1 574 . 1 1 52 52 GLU N N 15 118.929 0.300 . 1 . . . . 52 GLU N . 10276 1 575 . 1 1 53 53 GLU H H 1 8.995 0.030 . 1 . . . . 53 GLU H . 10276 1 576 . 1 1 53 53 GLU HA H 1 5.175 0.030 . 1 . . . . 53 GLU HA . 10276 1 577 . 1 1 53 53 GLU HB2 H 1 1.975 0.030 . 2 . . . . 53 GLU HB2 . 10276 1 578 . 1 1 53 53 GLU HB3 H 1 1.919 0.030 . 2 . . . . 53 GLU HB3 . 10276 1 579 . 1 1 53 53 GLU HG2 H 1 2.145 0.030 . 2 . . . . 53 GLU HG2 . 10276 1 580 . 1 1 53 53 GLU HG3 H 1 1.975 0.030 . 2 . . . . 53 GLU HG3 . 10276 1 581 . 1 1 53 53 GLU C C 13 176.301 0.300 . 1 . . . . 53 GLU C . 10276 1 582 . 1 1 53 53 GLU CA C 13 55.500 0.300 . 1 . . . . 53 GLU CA . 10276 1 583 . 1 1 53 53 GLU CB C 13 30.537 0.300 . 1 . . . . 53 GLU CB . 10276 1 584 . 1 1 53 53 GLU CG C 13 37.117 0.300 . 1 . . . . 53 GLU CG . 10276 1 585 . 1 1 53 53 GLU N N 15 122.819 0.300 . 1 . . . . 53 GLU N . 10276 1 586 . 1 1 54 54 VAL H H 1 9.375 0.030 . 1 . . . . 54 VAL H . 10276 1 587 . 1 1 54 54 VAL HA H 1 4.739 0.030 . 1 . . . . 54 VAL HA . 10276 1 588 . 1 1 54 54 VAL HB H 1 1.993 0.030 . 1 . . . . 54 VAL HB . 10276 1 589 . 1 1 54 54 VAL HG11 H 1 1.123 0.030 . 1 . . . . 54 VAL HG1 . 10276 1 590 . 1 1 54 54 VAL HG12 H 1 1.123 0.030 . 1 . . . . 54 VAL HG1 . 10276 1 591 . 1 1 54 54 VAL HG13 H 1 1.123 0.030 . 1 . . . . 54 VAL HG1 . 10276 1 592 . 1 1 54 54 VAL HG21 H 1 0.839 0.030 . 1 . . . . 54 VAL HG2 . 10276 1 593 . 1 1 54 54 VAL HG22 H 1 0.839 0.030 . 1 . . . . 54 VAL HG2 . 10276 1 594 . 1 1 54 54 VAL HG23 H 1 0.839 0.030 . 1 . . . . 54 VAL HG2 . 10276 1 595 . 1 1 54 54 VAL C C 13 175.017 0.300 . 1 . . . . 54 VAL C . 10276 1 596 . 1 1 54 54 VAL CA C 13 59.647 0.300 . 1 . . . . 54 VAL CA . 10276 1 597 . 1 1 54 54 VAL CB C 13 36.171 0.300 . 1 . . . . 54 VAL CB . 10276 1 598 . 1 1 54 54 VAL CG1 C 13 22.395 0.300 . 2 . . . . 54 VAL CG1 . 10276 1 599 . 1 1 54 54 VAL CG2 C 13 21.290 0.300 . 2 . . . . 54 VAL CG2 . 10276 1 600 . 1 1 54 54 VAL N N 15 125.177 0.300 . 1 . . . . 54 VAL N . 10276 1 601 . 1 1 55 55 LEU H H 1 8.744 0.030 . 1 . . . . 55 LEU H . 10276 1 602 . 1 1 55 55 LEU HA H 1 4.500 0.030 . 1 . . . . 55 LEU HA . 10276 1 603 . 1 1 55 55 LEU HB2 H 1 1.706 0.030 . 1 . . . . 55 LEU HB2 . 10276 1 604 . 1 1 55 55 LEU HB3 H 1 1.706 0.030 . 1 . . . . 55 LEU HB3 . 10276 1 605 . 1 1 55 55 LEU HD11 H 1 0.905 0.030 . 1 . . . . 55 LEU HD1 . 10276 1 606 . 1 1 55 55 LEU HD12 H 1 0.905 0.030 . 1 . . . . 55 LEU HD1 . 10276 1 607 . 1 1 55 55 LEU HD13 H 1 0.905 0.030 . 1 . . . . 55 LEU HD1 . 10276 1 608 . 1 1 55 55 LEU HD21 H 1 0.898 0.030 . 1 . . . . 55 LEU HD2 . 10276 1 609 . 1 1 55 55 LEU HD22 H 1 0.898 0.030 . 1 . . . . 55 LEU HD2 . 10276 1 610 . 1 1 55 55 LEU HD23 H 1 0.898 0.030 . 1 . . . . 55 LEU HD2 . 10276 1 611 . 1 1 55 55 LEU HG H 1 1.765 0.030 . 1 . . . . 55 LEU HG . 10276 1 612 . 1 1 55 55 LEU C C 13 179.440 0.300 . 1 . . . . 55 LEU C . 10276 1 613 . 1 1 55 55 LEU CA C 13 55.495 0.300 . 1 . . . . 55 LEU CA . 10276 1 614 . 1 1 55 55 LEU CB C 13 42.628 0.300 . 1 . . . . 55 LEU CB . 10276 1 615 . 1 1 55 55 LEU CD1 C 13 25.433 0.300 . 2 . . . . 55 LEU CD1 . 10276 1 616 . 1 1 55 55 LEU CD2 C 13 23.161 0.300 . 2 . . . . 55 LEU CD2 . 10276 1 617 . 1 1 55 55 LEU CG C 13 27.083 0.300 . 1 . . . . 55 LEU CG . 10276 1 618 . 1 1 55 55 LEU N N 15 123.920 0.300 . 1 . . . . 55 LEU N . 10276 1 619 . 1 1 56 56 LEU H H 1 8.324 0.030 . 1 . . . . 56 LEU H . 10276 1 620 . 1 1 56 56 LEU HA H 1 3.855 0.030 . 1 . . . . 56 LEU HA . 10276 1 621 . 1 1 56 56 LEU HB2 H 1 1.643 0.030 . 1 . . . . 56 LEU HB2 . 10276 1 622 . 1 1 56 56 LEU HB3 H 1 1.643 0.030 . 1 . . . . 56 LEU HB3 . 10276 1 623 . 1 1 56 56 LEU HD11 H 1 0.863 0.030 . 1 . . . . 56 LEU HD1 . 10276 1 624 . 1 1 56 56 LEU HD12 H 1 0.863 0.030 . 1 . . . . 56 LEU HD1 . 10276 1 625 . 1 1 56 56 LEU HD13 H 1 0.863 0.030 . 1 . . . . 56 LEU HD1 . 10276 1 626 . 1 1 56 56 LEU HD21 H 1 0.780 0.030 . 1 . . . . 56 LEU HD2 . 10276 1 627 . 1 1 56 56 LEU HD22 H 1 0.780 0.030 . 1 . . . . 56 LEU HD2 . 10276 1 628 . 1 1 56 56 LEU HD23 H 1 0.780 0.030 . 1 . . . . 56 LEU HD2 . 10276 1 629 . 1 1 56 56 LEU HG H 1 1.393 0.030 . 1 . . . . 56 LEU HG . 10276 1 630 . 1 1 56 56 LEU C C 13 178.810 0.300 . 1 . . . . 56 LEU C . 10276 1 631 . 1 1 56 56 LEU CA C 13 57.883 0.300 . 1 . . . . 56 LEU CA . 10276 1 632 . 1 1 56 56 LEU CB C 13 41.330 0.300 . 1 . . . . 56 LEU CB . 10276 1 633 . 1 1 56 56 LEU CD1 C 13 25.420 0.300 . 2 . . . . 56 LEU CD1 . 10276 1 634 . 1 1 56 56 LEU CD2 C 13 23.975 0.300 . 2 . . . . 56 LEU CD2 . 10276 1 635 . 1 1 56 56 LEU CG C 13 28.134 0.300 . 1 . . . . 56 LEU CG . 10276 1 636 . 1 1 56 56 LEU N N 15 123.383 0.300 . 1 . . . . 56 LEU N . 10276 1 637 . 1 1 57 57 SER H H 1 7.886 0.030 . 1 . . . . 57 SER H . 10276 1 638 . 1 1 57 57 SER HA H 1 4.364 0.030 . 1 . . . . 57 SER HA . 10276 1 639 . 1 1 57 57 SER HB2 H 1 4.110 0.030 . 2 . . . . 57 SER HB2 . 10276 1 640 . 1 1 57 57 SER HB3 H 1 3.845 0.030 . 2 . . . . 57 SER HB3 . 10276 1 641 . 1 1 57 57 SER C C 13 174.944 0.300 . 1 . . . . 57 SER C . 10276 1 642 . 1 1 57 57 SER CA C 13 59.859 0.300 . 1 . . . . 57 SER CA . 10276 1 643 . 1 1 57 57 SER CB C 13 62.509 0.300 . 1 . . . . 57 SER CB . 10276 1 644 . 1 1 57 57 SER N N 15 109.927 0.300 . 1 . . . . 57 SER N . 10276 1 645 . 1 1 58 58 ASN H H 1 8.085 0.030 . 1 . . . . 58 ASN H . 10276 1 646 . 1 1 58 58 ASN HA H 1 5.275 0.030 . 1 . . . . 58 ASN HA . 10276 1 647 . 1 1 58 58 ASN HB2 H 1 3.365 0.030 . 2 . . . . 58 ASN HB2 . 10276 1 648 . 1 1 58 58 ASN HB3 H 1 2.885 0.030 . 2 . . . . 58 ASN HB3 . 10276 1 649 . 1 1 58 58 ASN HD21 H 1 8.122 0.030 . 2 . . . . 58 ASN HD21 . 10276 1 650 . 1 1 58 58 ASN HD22 H 1 7.257 0.030 . 2 . . . . 58 ASN HD22 . 10276 1 651 . 1 1 58 58 ASN C C 13 172.402 0.300 . 1 . . . . 58 ASN C . 10276 1 652 . 1 1 58 58 ASN CA C 13 52.535 0.300 . 1 . . . . 58 ASN CA . 10276 1 653 . 1 1 58 58 ASN CB C 13 39.585 0.300 . 1 . . . . 58 ASN CB . 10276 1 654 . 1 1 58 58 ASN N N 15 120.812 0.300 . 1 . . . . 58 ASN N . 10276 1 655 . 1 1 58 58 ASN ND2 N 15 115.088 0.300 . 1 . . . . 58 ASN ND2 . 10276 1 656 . 1 1 59 59 ILE H H 1 7.291 0.030 . 1 . . . . 59 ILE H . 10276 1 657 . 1 1 59 59 ILE HA H 1 5.125 0.030 . 1 . . . . 59 ILE HA . 10276 1 658 . 1 1 59 59 ILE HB H 1 1.425 0.030 . 1 . . . . 59 ILE HB . 10276 1 659 . 1 1 59 59 ILE HD11 H 1 -0.296 0.030 . 1 . . . . 59 ILE HD1 . 10276 1 660 . 1 1 59 59 ILE HD12 H 1 -0.296 0.030 . 1 . . . . 59 ILE HD1 . 10276 1 661 . 1 1 59 59 ILE HD13 H 1 -0.296 0.030 . 1 . . . . 59 ILE HD1 . 10276 1 662 . 1 1 59 59 ILE HG12 H 1 0.706 0.030 . 2 . . . . 59 ILE HG12 . 10276 1 663 . 1 1 59 59 ILE HG13 H 1 1.282 0.030 . 2 . . . . 59 ILE HG13 . 10276 1 664 . 1 1 59 59 ILE HG21 H 1 0.144 0.030 . 1 . . . . 59 ILE HG2 . 10276 1 665 . 1 1 59 59 ILE HG22 H 1 0.144 0.030 . 1 . . . . 59 ILE HG2 . 10276 1 666 . 1 1 59 59 ILE HG23 H 1 0.144 0.030 . 1 . . . . 59 ILE HG2 . 10276 1 667 . 1 1 59 59 ILE C C 13 174.980 0.300 . 1 . . . . 59 ILE C . 10276 1 668 . 1 1 59 59 ILE CA C 13 60.659 0.300 . 1 . . . . 59 ILE CA . 10276 1 669 . 1 1 59 59 ILE CB C 13 39.996 0.300 . 1 . . . . 59 ILE CB . 10276 1 670 . 1 1 59 59 ILE CD1 C 13 12.771 0.300 . 1 . . . . 59 ILE CD1 . 10276 1 671 . 1 1 59 59 ILE CG1 C 13 26.654 0.300 . 1 . . . . 59 ILE CG1 . 10276 1 672 . 1 1 59 59 ILE CG2 C 13 17.919 0.300 . 1 . . . . 59 ILE CG2 . 10276 1 673 . 1 1 59 59 ILE N N 15 115.444 0.300 . 1 . . . . 59 ILE N . 10276 1 674 . 1 1 60 60 LYS H H 1 9.366 0.030 . 1 . . . . 60 LYS H . 10276 1 675 . 1 1 60 60 LYS HA H 1 5.300 0.030 . 1 . . . . 60 LYS HA . 10276 1 676 . 1 1 60 60 LYS HB2 H 1 1.788 0.030 . 2 . . . . 60 LYS HB2 . 10276 1 677 . 1 1 60 60 LYS HB3 H 1 1.648 0.030 . 2 . . . . 60 LYS HB3 . 10276 1 678 . 1 1 60 60 LYS HD2 H 1 1.195 0.030 . 2 . . . . 60 LYS HD2 . 10276 1 679 . 1 1 60 60 LYS HD3 H 1 1.093 0.030 . 2 . . . . 60 LYS HD3 . 10276 1 680 . 1 1 60 60 LYS HE2 H 1 2.285 0.030 . 2 . . . . 60 LYS HE2 . 10276 1 681 . 1 1 60 60 LYS HE3 H 1 1.933 0.030 . 2 . . . . 60 LYS HE3 . 10276 1 682 . 1 1 60 60 LYS HG2 H 1 1.104 0.030 . 2 . . . . 60 LYS HG2 . 10276 1 683 . 1 1 60 60 LYS HG3 H 1 1.192 0.030 . 2 . . . . 60 LYS HG3 . 10276 1 684 . 1 1 60 60 LYS C C 13 173.381 0.300 . 1 . . . . 60 LYS C . 10276 1 685 . 1 1 60 60 LYS CA C 13 52.977 0.300 . 1 . . . . 60 LYS CA . 10276 1 686 . 1 1 60 60 LYS CB C 13 34.814 0.300 . 1 . . . . 60 LYS CB . 10276 1 687 . 1 1 60 60 LYS CD C 13 29.201 0.300 . 1 . . . . 60 LYS CD . 10276 1 688 . 1 1 60 60 LYS CE C 13 41.650 0.300 . 1 . . . . 60 LYS CE . 10276 1 689 . 1 1 60 60 LYS CG C 13 24.330 0.300 . 1 . . . . 60 LYS CG . 10276 1 690 . 1 1 60 60 LYS N N 15 122.819 0.300 . 1 . . . . 60 LYS N . 10276 1 691 . 1 1 61 61 PRO HA H 1 5.027 0.030 . 1 . . . . 61 PRO HA . 10276 1 692 . 1 1 61 61 PRO HB2 H 1 2.405 0.030 . 2 . . . . 61 PRO HB2 . 10276 1 693 . 1 1 61 61 PRO HB3 H 1 1.964 0.030 . 2 . . . . 61 PRO HB3 . 10276 1 694 . 1 1 61 61 PRO HD2 H 1 3.759 0.030 . 2 . . . . 61 PRO HD2 . 10276 1 695 . 1 1 61 61 PRO HD3 H 1 4.083 0.030 . 2 . . . . 61 PRO HD3 . 10276 1 696 . 1 1 61 61 PRO HG2 H 1 2.084 0.030 . 2 . . . . 61 PRO HG2 . 10276 1 697 . 1 1 61 61 PRO HG3 H 1 1.954 0.030 . 2 . . . . 61 PRO HG3 . 10276 1 698 . 1 1 61 61 PRO C C 13 176.256 0.300 . 1 . . . . 61 PRO C . 10276 1 699 . 1 1 61 61 PRO CA C 13 62.754 0.300 . 1 . . . . 61 PRO CA . 10276 1 700 . 1 1 61 61 PRO CB C 13 32.594 0.300 . 1 . . . . 61 PRO CB . 10276 1 701 . 1 1 61 61 PRO CD C 13 50.935 0.300 . 1 . . . . 61 PRO CD . 10276 1 702 . 1 1 61 61 PRO CG C 13 27.788 0.300 . 1 . . . . 61 PRO CG . 10276 1 703 . 1 1 62 62 VAL H H 1 8.525 0.030 . 1 . . . . 62 VAL H . 10276 1 704 . 1 1 62 62 VAL HA H 1 3.969 0.030 . 1 . . . . 62 VAL HA . 10276 1 705 . 1 1 62 62 VAL HB H 1 1.970 0.030 . 1 . . . . 62 VAL HB . 10276 1 706 . 1 1 62 62 VAL HG11 H 1 0.765 0.030 . 1 . . . . 62 VAL HG1 . 10276 1 707 . 1 1 62 62 VAL HG12 H 1 0.765 0.030 . 1 . . . . 62 VAL HG1 . 10276 1 708 . 1 1 62 62 VAL HG13 H 1 0.765 0.030 . 1 . . . . 62 VAL HG1 . 10276 1 709 . 1 1 62 62 VAL HG21 H 1 0.725 0.030 . 1 . . . . 62 VAL HG2 . 10276 1 710 . 1 1 62 62 VAL HG22 H 1 0.725 0.030 . 1 . . . . 62 VAL HG2 . 10276 1 711 . 1 1 62 62 VAL HG23 H 1 0.725 0.030 . 1 . . . . 62 VAL HG2 . 10276 1 712 . 1 1 62 62 VAL C C 13 176.192 0.300 . 1 . . . . 62 VAL C . 10276 1 713 . 1 1 62 62 VAL CA C 13 62.895 0.300 . 1 . . . . 62 VAL CA . 10276 1 714 . 1 1 62 62 VAL CB C 13 32.059 0.300 . 1 . . . . 62 VAL CB . 10276 1 715 . 1 1 62 62 VAL CG1 C 13 21.196 0.300 . 2 . . . . 62 VAL CG1 . 10276 1 716 . 1 1 62 62 VAL CG2 C 13 20.401 0.300 . 2 . . . . 62 VAL CG2 . 10276 1 717 . 1 1 62 62 VAL N N 15 117.807 0.300 . 1 . . . . 62 VAL N . 10276 1 718 . 1 1 63 63 GLN H H 1 7.815 0.030 . 1 . . . . 63 GLN H . 10276 1 719 . 1 1 63 63 GLN HA H 1 4.415 0.030 . 1 . . . . 63 GLN HA . 10276 1 720 . 1 1 63 63 GLN HB2 H 1 1.885 0.030 . 2 . . . . 63 GLN HB2 . 10276 1 721 . 1 1 63 63 GLN HB3 H 1 2.025 0.030 . 2 . . . . 63 GLN HB3 . 10276 1 722 . 1 1 63 63 GLN HE21 H 1 7.499 0.030 . 2 . . . . 63 GLN HE21 . 10276 1 723 . 1 1 63 63 GLN HE22 H 1 6.814 0.030 . 2 . . . . 63 GLN HE22 . 10276 1 724 . 1 1 63 63 GLN HG2 H 1 2.245 0.030 . 1 . . . . 63 GLN HG2 . 10276 1 725 . 1 1 63 63 GLN HG3 H 1 2.245 0.030 . 1 . . . . 63 GLN HG3 . 10276 1 726 . 1 1 63 63 GLN C C 13 175.716 0.300 . 1 . . . . 63 GLN C . 10276 1 727 . 1 1 63 63 GLN CA C 13 55.535 0.300 . 1 . . . . 63 GLN CA . 10276 1 728 . 1 1 63 63 GLN CB C 13 29.468 0.300 . 1 . . . . 63 GLN CB . 10276 1 729 . 1 1 63 63 GLN CG C 13 33.678 0.300 . 1 . . . . 63 GLN CG . 10276 1 730 . 1 1 63 63 GLN N N 15 122.188 0.300 . 1 . . . . 63 GLN N . 10276 1 731 . 1 1 63 63 GLN NE2 N 15 112.312 0.300 . 1 . . . . 63 GLN NE2 . 10276 1 732 . 1 1 64 64 THR H H 1 8.185 0.030 . 1 . . . . 64 THR H . 10276 1 733 . 1 1 64 64 THR HA H 1 4.154 0.030 . 1 . . . . 64 THR HA . 10276 1 734 . 1 1 64 64 THR HB H 1 4.106 0.030 . 1 . . . . 64 THR HB . 10276 1 735 . 1 1 64 64 THR HG21 H 1 1.126 0.030 . 1 . . . . 64 THR HG2 . 10276 1 736 . 1 1 64 64 THR HG22 H 1 1.126 0.030 . 1 . . . . 64 THR HG2 . 10276 1 737 . 1 1 64 64 THR HG23 H 1 1.126 0.030 . 1 . . . . 64 THR HG2 . 10276 1 738 . 1 1 64 64 THR C C 13 174.616 0.300 . 1 . . . . 64 THR C . 10276 1 739 . 1 1 64 64 THR CA C 13 62.277 0.300 . 1 . . . . 64 THR CA . 10276 1 740 . 1 1 64 64 THR CB C 13 69.565 0.300 . 1 . . . . 64 THR CB . 10276 1 741 . 1 1 64 64 THR CG2 C 13 21.737 0.300 . 1 . . . . 64 THR CG2 . 10276 1 742 . 1 1 64 64 THR N N 15 116.169 0.300 . 1 . . . . 64 THR N . 10276 1 743 . 1 1 65 65 GLU H H 1 8.460 0.030 . 1 . . . . 65 GLU H . 10276 1 744 . 1 1 65 65 GLU HA H 1 4.174 0.030 . 1 . . . . 65 GLU HA . 10276 1 745 . 1 1 65 65 GLU HB2 H 1 1.835 0.030 . 2 . . . . 65 GLU HB2 . 10276 1 746 . 1 1 65 65 GLU HB3 H 1 1.766 0.030 . 2 . . . . 65 GLU HB3 . 10276 1 747 . 1 1 65 65 GLU HG2 H 1 2.185 0.030 . 1 . . . . 65 GLU HG2 . 10276 1 748 . 1 1 65 65 GLU HG3 H 1 2.185 0.030 . 1 . . . . 65 GLU HG3 . 10276 1 749 . 1 1 65 65 GLU C C 13 176.216 0.300 . 1 . . . . 65 GLU C . 10276 1 750 . 1 1 65 65 GLU CA C 13 56.647 0.300 . 1 . . . . 65 GLU CA . 10276 1 751 . 1 1 65 65 GLU CB C 13 30.044 0.300 . 1 . . . . 65 GLU CB . 10276 1 752 . 1 1 65 65 GLU CG C 13 36.230 0.300 . 1 . . . . 65 GLU CG . 10276 1 753 . 1 1 65 65 GLU N N 15 123.014 0.300 . 1 . . . . 65 GLU N . 10276 1 754 . 1 1 66 66 ALA H H 1 8.245 0.030 . 1 . . . . 66 ALA H . 10276 1 755 . 1 1 66 66 ALA HA H 1 4.205 0.030 . 1 . . . . 66 ALA HA . 10276 1 756 . 1 1 66 66 ALA HB1 H 1 1.308 0.030 . 1 . . . . 66 ALA HB . 10276 1 757 . 1 1 66 66 ALA HB2 H 1 1.308 0.030 . 1 . . . . 66 ALA HB . 10276 1 758 . 1 1 66 66 ALA HB3 H 1 1.308 0.030 . 1 . . . . 66 ALA HB . 10276 1 759 . 1 1 66 66 ALA C C 13 177.258 0.300 . 1 . . . . 66 ALA C . 10276 1 760 . 1 1 66 66 ALA CA C 13 52.730 0.300 . 1 . . . . 66 ALA CA . 10276 1 761 . 1 1 66 66 ALA CB C 13 19.064 0.300 . 1 . . . . 66 ALA CB . 10276 1 762 . 1 1 66 66 ALA N N 15 124.251 0.300 . 1 . . . . 66 ALA N . 10276 1 763 . 1 1 67 67 TRP H H 1 7.875 0.030 . 1 . . . . 67 TRP H . 10276 1 764 . 1 1 67 67 TRP HA H 1 4.609 0.030 . 1 . . . . 67 TRP HA . 10276 1 765 . 1 1 67 67 TRP HB2 H 1 3.215 0.030 . 1 . . . . 67 TRP HB2 . 10276 1 766 . 1 1 67 67 TRP HB3 H 1 3.215 0.030 . 1 . . . . 67 TRP HB3 . 10276 1 767 . 1 1 67 67 TRP HD1 H 1 7.173 0.030 . 1 . . . . 67 TRP HD1 . 10276 1 768 . 1 1 67 67 TRP HE1 H 1 10.106 0.030 . 1 . . . . 67 TRP HE1 . 10276 1 769 . 1 1 67 67 TRP HE3 H 1 7.511 0.030 . 1 . . . . 67 TRP HE3 . 10276 1 770 . 1 1 67 67 TRP HH2 H 1 7.095 0.030 . 1 . . . . 67 TRP HH2 . 10276 1 771 . 1 1 67 67 TRP HZ2 H 1 7.372 0.030 . 1 . . . . 67 TRP HZ2 . 10276 1 772 . 1 1 67 67 TRP C C 13 175.889 0.300 . 1 . . . . 67 TRP C . 10276 1 773 . 1 1 67 67 TRP CA C 13 57.106 0.300 . 1 . . . . 67 TRP CA . 10276 1 774 . 1 1 67 67 TRP CB C 13 29.427 0.300 . 1 . . . . 67 TRP CB . 10276 1 775 . 1 1 67 67 TRP CD1 C 13 126.999 0.300 . 1 . . . . 67 TRP CD1 . 10276 1 776 . 1 1 67 67 TRP CE3 C 13 120.864 0.300 . 1 . . . . 67 TRP CE3 . 10276 1 777 . 1 1 67 67 TRP CH2 C 13 124.513 0.300 . 1 . . . . 67 TRP CH2 . 10276 1 778 . 1 1 67 67 TRP CZ2 C 13 114.400 0.300 . 1 . . . . 67 TRP CZ2 . 10276 1 779 . 1 1 67 67 TRP N N 15 119.568 0.300 . 1 . . . . 67 TRP N . 10276 1 780 . 1 1 67 67 TRP NE1 N 15 129.486 0.300 . 1 . . . . 67 TRP NE1 . 10276 1 781 . 1 1 68 68 VAL H H 1 7.815 0.030 . 1 . . . . 68 VAL H . 10276 1 782 . 1 1 68 68 VAL HA H 1 3.917 0.030 . 1 . . . . 68 VAL HA . 10276 1 783 . 1 1 68 68 VAL HB H 1 1.885 0.030 . 1 . . . . 68 VAL HB . 10276 1 784 . 1 1 68 68 VAL HG11 H 1 0.761 0.030 . 1 . . . . 68 VAL HG1 . 10276 1 785 . 1 1 68 68 VAL HG12 H 1 0.761 0.030 . 1 . . . . 68 VAL HG1 . 10276 1 786 . 1 1 68 68 VAL HG13 H 1 0.761 0.030 . 1 . . . . 68 VAL HG1 . 10276 1 787 . 1 1 68 68 VAL HG21 H 1 0.797 0.030 . 1 . . . . 68 VAL HG2 . 10276 1 788 . 1 1 68 68 VAL HG22 H 1 0.797 0.030 . 1 . . . . 68 VAL HG2 . 10276 1 789 . 1 1 68 68 VAL HG23 H 1 0.797 0.030 . 1 . . . . 68 VAL HG2 . 10276 1 790 . 1 1 68 68 VAL C C 13 175.368 0.300 . 1 . . . . 68 VAL C . 10276 1 791 . 1 1 68 68 VAL CA C 13 62.189 0.300 . 1 . . . . 68 VAL CA . 10276 1 792 . 1 1 68 68 VAL CB C 13 32.981 0.300 . 1 . . . . 68 VAL CB . 10276 1 793 . 1 1 68 68 VAL CG1 C 13 20.610 0.300 . 2 . . . . 68 VAL CG1 . 10276 1 794 . 1 1 68 68 VAL CG2 C 13 21.009 0.300 . 2 . . . . 68 VAL CG2 . 10276 1 795 . 1 1 68 68 VAL N N 15 122.485 0.300 . 1 . . . . 68 VAL N . 10276 1 796 . 1 1 69 69 ARG H H 1 8.084 0.030 . 1 . . . . 69 ARG H . 10276 1 797 . 1 1 69 69 ARG HA H 1 4.107 0.030 . 1 . . . . 69 ARG HA . 10276 1 798 . 1 1 69 69 ARG HB2 H 1 1.695 0.030 . 2 . . . . 69 ARG HB2 . 10276 1 799 . 1 1 69 69 ARG HB3 H 1 1.640 0.030 . 2 . . . . 69 ARG HB3 . 10276 1 800 . 1 1 69 69 ARG HD2 H 1 3.106 0.030 . 1 . . . . 69 ARG HD2 . 10276 1 801 . 1 1 69 69 ARG HD3 H 1 3.106 0.030 . 1 . . . . 69 ARG HD3 . 10276 1 802 . 1 1 69 69 ARG HG2 H 1 1.518 0.030 . 2 . . . . 69 ARG HG2 . 10276 1 803 . 1 1 69 69 ARG HG3 H 1 1.475 0.030 . 2 . . . . 69 ARG HG3 . 10276 1 804 . 1 1 69 69 ARG C C 13 175.465 0.300 . 1 . . . . 69 ARG C . 10276 1 805 . 1 1 69 69 ARG CA C 13 55.841 0.300 . 1 . . . . 69 ARG CA . 10276 1 806 . 1 1 69 69 ARG CB C 13 30.949 0.300 . 1 . . . . 69 ARG CB . 10276 1 807 . 1 1 69 69 ARG CD C 13 43.302 0.300 . 1 . . . . 69 ARG CD . 10276 1 808 . 1 1 69 69 ARG CG C 13 27.001 0.300 . 1 . . . . 69 ARG CG . 10276 1 809 . 1 1 69 69 ARG N N 15 124.540 0.300 . 1 . . . . 69 ARG N . 10276 1 810 . 1 1 70 70 ASP H H 1 8.365 0.030 . 1 . . . . 70 ASP H . 10276 1 811 . 1 1 70 70 ASP HA H 1 4.780 0.030 . 1 . . . . 70 ASP HA . 10276 1 812 . 1 1 70 70 ASP HB2 H 1 2.565 0.030 . 2 . . . . 70 ASP HB2 . 10276 1 813 . 1 1 70 70 ASP HB3 H 1 2.764 0.030 . 2 . . . . 70 ASP HB3 . 10276 1 814 . 1 1 70 70 ASP C C 13 175.319 0.300 . 1 . . . . 70 ASP C . 10276 1 815 . 1 1 70 70 ASP CA C 13 51.882 0.300 . 1 . . . . 70 ASP CA . 10276 1 816 . 1 1 70 70 ASP CB C 13 41.312 0.300 . 1 . . . . 70 ASP CB . 10276 1 817 . 1 1 70 70 ASP N N 15 123.498 0.300 . 1 . . . . 70 ASP N . 10276 1 818 . 1 1 71 71 PRO HA H 1 4.355 0.030 . 1 . . . . 71 PRO HA . 10276 1 819 . 1 1 71 71 PRO HB2 H 1 2.215 0.030 . 2 . . . . 71 PRO HB2 . 10276 1 820 . 1 1 71 71 PRO HB3 H 1 1.906 0.030 . 2 . . . . 71 PRO HB3 . 10276 1 821 . 1 1 71 71 PRO HD2 H 1 3.779 0.030 . 1 . . . . 71 PRO HD2 . 10276 1 822 . 1 1 71 71 PRO HD3 H 1 3.779 0.030 . 1 . . . . 71 PRO HD3 . 10276 1 823 . 1 1 71 71 PRO HG2 H 1 1.925 0.030 . 1 . . . . 71 PRO HG2 . 10276 1 824 . 1 1 71 71 PRO HG3 H 1 1.925 0.030 . 1 . . . . 71 PRO HG3 . 10276 1 825 . 1 1 71 71 PRO C C 13 177.091 0.300 . 1 . . . . 71 PRO C . 10276 1 826 . 1 1 71 71 PRO CA C 13 63.777 0.300 . 1 . . . . 71 PRO CA . 10276 1 827 . 1 1 71 71 PRO CB C 13 32.118 0.300 . 1 . . . . 71 PRO CB . 10276 1 828 . 1 1 71 71 PRO CD C 13 50.935 0.300 . 1 . . . . 71 PRO CD . 10276 1 829 . 1 1 71 71 PRO CG C 13 27.131 0.300 . 1 . . . . 71 PRO CG . 10276 1 830 . 1 1 72 72 ASN H H 1 8.521 0.030 . 1 . . . . 72 ASN H . 10276 1 831 . 1 1 72 72 ASN HA H 1 4.764 0.030 . 1 . . . . 72 ASN HA . 10276 1 832 . 1 1 72 72 ASN HB2 H 1 2.868 0.030 . 2 . . . . 72 ASN HB2 . 10276 1 833 . 1 1 72 72 ASN HB3 H 1 2.750 0.030 . 2 . . . . 72 ASN HB3 . 10276 1 834 . 1 1 72 72 ASN HD21 H 1 7.805 0.030 . 2 . . . . 72 ASN HD21 . 10276 1 835 . 1 1 72 72 ASN HD22 H 1 6.952 0.030 . 2 . . . . 72 ASN HD22 . 10276 1 836 . 1 1 72 72 ASN C C 13 175.312 0.300 . 1 . . . . 72 ASN C . 10276 1 837 . 1 1 72 72 ASN CA C 13 53.471 0.300 . 1 . . . . 72 ASN CA . 10276 1 838 . 1 1 72 72 ASN CB C 13 38.869 0.300 . 1 . . . . 72 ASN CB . 10276 1 839 . 1 1 72 72 ASN N N 15 117.256 0.300 . 1 . . . . 72 ASN N . 10276 1 840 . 1 1 72 72 ASN ND2 N 15 114.316 0.300 . 1 . . . . 72 ASN ND2 . 10276 1 841 . 1 1 73 73 SER H H 1 7.937 0.030 . 1 . . . . 73 SER H . 10276 1 842 . 1 1 73 73 SER HA H 1 4.429 0.030 . 1 . . . . 73 SER HA . 10276 1 843 . 1 1 73 73 SER HB2 H 1 3.876 0.030 . 1 . . . . 73 SER HB2 . 10276 1 844 . 1 1 73 73 SER HB3 H 1 3.876 0.030 . 1 . . . . 73 SER HB3 . 10276 1 845 . 1 1 73 73 SER C C 13 174.532 0.300 . 1 . . . . 73 SER C . 10276 1 846 . 1 1 73 73 SER CA C 13 58.642 0.300 . 1 . . . . 73 SER CA . 10276 1 847 . 1 1 73 73 SER CB C 13 64.137 0.300 . 1 . . . . 73 SER CB . 10276 1 848 . 1 1 73 73 SER N N 15 115.503 0.300 . 1 . . . . 73 SER N . 10276 1 849 . 1 1 74 74 GLY H H 1 8.206 0.030 . 1 . . . . 74 GLY H . 10276 1 850 . 1 1 74 74 GLY HA2 H 1 4.071 0.030 . 2 . . . . 74 GLY HA2 . 10276 1 851 . 1 1 74 74 GLY HA3 H 1 4.123 0.030 . 2 . . . . 74 GLY HA3 . 10276 1 852 . 1 1 74 74 GLY C C 13 171.781 0.300 . 1 . . . . 74 GLY C . 10276 1 853 . 1 1 74 74 GLY CA C 13 44.682 0.300 . 1 . . . . 74 GLY CA . 10276 1 854 . 1 1 74 74 GLY N N 15 110.659 0.300 . 1 . . . . 74 GLY N . 10276 1 855 . 1 1 75 75 PRO HA H 1 4.446 0.030 . 1 . . . . 75 PRO HA . 10276 1 856 . 1 1 75 75 PRO HB2 H 1 2.265 0.030 . 2 . . . . 75 PRO HB2 . 10276 1 857 . 1 1 75 75 PRO HB3 H 1 1.955 0.030 . 2 . . . . 75 PRO HB3 . 10276 1 858 . 1 1 75 75 PRO HD2 H 1 3.581 0.030 . 1 . . . . 75 PRO HD2 . 10276 1 859 . 1 1 75 75 PRO HD3 H 1 3.581 0.030 . 1 . . . . 75 PRO HD3 . 10276 1 860 . 1 1 75 75 PRO HG2 H 1 1.975 0.030 . 1 . . . . 75 PRO HG2 . 10276 1 861 . 1 1 75 75 PRO HG3 H 1 1.975 0.030 . 1 . . . . 75 PRO HG3 . 10276 1 862 . 1 1 75 75 PRO C C 13 177.407 0.300 . 1 . . . . 75 PRO C . 10276 1 863 . 1 1 75 75 PRO CA C 13 63.212 0.300 . 1 . . . . 75 PRO CA . 10276 1 864 . 1 1 75 75 PRO CB C 13 32.182 0.300 . 1 . . . . 75 PRO CB . 10276 1 865 . 1 1 75 75 PRO CD C 13 49.766 0.300 . 1 . . . . 75 PRO CD . 10276 1 866 . 1 1 75 75 PRO CG C 13 27.131 0.300 . 1 . . . . 75 PRO CG . 10276 1 867 . 1 1 76 76 SER H H 1 8.504 0.030 . 1 . . . . 76 SER H . 10276 1 868 . 1 1 76 76 SER HA H 1 4.489 0.030 . 1 . . . . 76 SER HA . 10276 1 869 . 1 1 76 76 SER HB2 H 1 3.869 0.030 . 1 . . . . 76 SER HB2 . 10276 1 870 . 1 1 76 76 SER HB3 H 1 3.869 0.030 . 1 . . . . 76 SER HB3 . 10276 1 871 . 1 1 76 76 SER C C 13 174.677 0.300 . 1 . . . . 76 SER C . 10276 1 872 . 1 1 76 76 SER CA C 13 58.359 0.300 . 1 . . . . 76 SER CA . 10276 1 873 . 1 1 76 76 SER CB C 13 64.013 0.300 . 1 . . . . 76 SER CB . 10276 1 874 . 1 1 76 76 SER N N 15 116.388 0.300 . 1 . . . . 76 SER N . 10276 1 875 . 1 1 77 77 SER H H 1 8.312 0.030 . 1 . . . . 77 SER H . 10276 1 876 . 1 1 77 77 SER C C 13 173.914 0.300 . 1 . . . . 77 SER C . 10276 1 877 . 1 1 77 77 SER CA C 13 58.342 0.300 . 1 . . . . 77 SER CA . 10276 1 878 . 1 1 77 77 SER CB C 13 64.013 0.300 . 1 . . . . 77 SER CB . 10276 1 879 . 1 1 77 77 SER N N 15 117.873 0.300 . 1 . . . . 77 SER N . 10276 1 stop_ save_