################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30309 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 3D_15N-separated_NOESY . . . 30309 1 2 3D_13C-separated_NOESY . . . 30309 1 3 '3D HNCO' . . . 30309 1 4 '3D HNCACB' . . . 30309 1 5 '3D CBCA(CO)NH' . . . 30309 1 6 '3D HCCH-TOCSY' . . . 30309 1 7 '2D 1H-13C HSQC aliphatic' . . . 30309 1 8 '2D 1H-15N HSQC' . . . 30309 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.088 0.007 . 1 . . . . A 1 MET HA . 30309 1 2 . 1 1 1 1 MET HB2 H 1 2.086 0.006 . 2 . . . . A 1 MET HB2 . 30309 1 3 . 1 1 1 1 MET HB3 H 1 2.086 0.006 . 2 . . . . A 1 MET HB3 . 30309 1 4 . 1 1 1 1 MET HG2 H 1 2.558 0.006 . 2 . . . . A 1 MET HG2 . 30309 1 5 . 1 1 1 1 MET HG3 H 1 2.558 0.006 . 2 . . . . A 1 MET HG3 . 30309 1 6 . 1 1 1 1 MET HE1 H 1 2.030 0.000 . 1 . . . . A 1 MET HE1 . 30309 1 7 . 1 1 1 1 MET HE2 H 1 2.030 0.000 . 1 . . . . A 1 MET HE2 . 30309 1 8 . 1 1 1 1 MET HE3 H 1 2.030 0.000 . 1 . . . . A 1 MET HE3 . 30309 1 9 . 1 1 1 1 MET C C 13 173.266 0.000 . 1 . . . . A 1 MET C . 30309 1 10 . 1 1 1 1 MET CA C 13 55.287 0.088 . 1 . . . . A 1 MET CA . 30309 1 11 . 1 1 1 1 MET CG C 13 31.423 0.044 . 1 . . . . A 1 MET CG . 30309 1 12 . 1 1 1 1 MET CE C 13 16.949 0.000 . 1 . . . . A 1 MET CE . 30309 1 13 . 1 1 2 2 ASN H H 1 9.920 0.002 . 1 . . . . A 2 ASN H . 30309 1 14 . 1 1 2 2 ASN HA H 1 5.017 0.004 . 1 . . . . A 2 ASN HA . 30309 1 15 . 1 1 2 2 ASN HB2 H 1 3.061 0.007 . 2 . . . . A 2 ASN HB2 . 30309 1 16 . 1 1 2 2 ASN HB3 H 1 2.969 0.007 . 2 . . . . A 2 ASN HB3 . 30309 1 17 . 1 1 2 2 ASN HD21 H 1 8.057 0.000 . 2 . . . . A 2 ASN HD21 . 30309 1 18 . 1 1 2 2 ASN HD22 H 1 7.258 0.001 . 2 . . . . A 2 ASN HD22 . 30309 1 19 . 1 1 2 2 ASN C C 13 175.369 0.000 . 1 . . . . A 2 ASN C . 30309 1 20 . 1 1 2 2 ASN CA C 13 51.489 0.065 . 1 . . . . A 2 ASN CA . 30309 1 21 . 1 1 2 2 ASN CB C 13 40.589 0.011 . 1 . . . . A 2 ASN CB . 30309 1 22 . 1 1 2 2 ASN N N 15 122.264 0.039 . 1 . . . . A 2 ASN N . 30309 1 23 . 1 1 2 2 ASN ND2 N 15 116.339 0.028 . 1 . . . . A 2 ASN ND2 . 30309 1 24 . 1 1 3 3 ALA H H 1 8.915 0.001 . 1 . . . . A 3 ALA H . 30309 1 25 . 1 1 3 3 ALA HA H 1 3.748 0.005 . 1 . . . . A 3 ALA HA . 30309 1 26 . 1 1 3 3 ALA HB1 H 1 1.304 0.004 . 1 . . . . A 3 ALA HB1 . 30309 1 27 . 1 1 3 3 ALA HB2 H 1 1.304 0.004 . 1 . . . . A 3 ALA HB2 . 30309 1 28 . 1 1 3 3 ALA HB3 H 1 1.304 0.004 . 1 . . . . A 3 ALA HB3 . 30309 1 29 . 1 1 3 3 ALA C C 13 178.255 0.000 . 1 . . . . A 3 ALA C . 30309 1 30 . 1 1 3 3 ALA CA C 13 55.624 0.041 . 1 . . . . A 3 ALA CA . 30309 1 31 . 1 1 3 3 ALA CB C 13 18.743 0.075 . 1 . . . . A 3 ALA CB . 30309 1 32 . 1 1 3 3 ALA N N 15 118.929 0.026 . 1 . . . . A 3 ALA N . 30309 1 33 . 1 1 4 4 ILE H H 1 8.079 0.001 . 1 . . . . A 4 ILE H . 30309 1 34 . 1 1 4 4 ILE HA H 1 3.600 0.007 . 1 . . . . A 4 ILE HA . 30309 1 35 . 1 1 4 4 ILE HB H 1 1.999 0.005 . 1 . . . . A 4 ILE HB . 30309 1 36 . 1 1 4 4 ILE HG12 H 1 1.306 0.005 . 2 . . . . A 4 ILE HG12 . 30309 1 37 . 1 1 4 4 ILE HG13 H 1 1.268 0.007 . 2 . . . . A 4 ILE HG13 . 30309 1 38 . 1 1 4 4 ILE HG21 H 1 0.949 0.006 . 1 . . . . A 4 ILE HG21 . 30309 1 39 . 1 1 4 4 ILE HG22 H 1 0.949 0.006 . 1 . . . . A 4 ILE HG22 . 30309 1 40 . 1 1 4 4 ILE HG23 H 1 0.949 0.006 . 1 . . . . A 4 ILE HG23 . 30309 1 41 . 1 1 4 4 ILE HD11 H 1 0.869 0.002 . 1 . . . . A 4 ILE HD11 . 30309 1 42 . 1 1 4 4 ILE HD12 H 1 0.869 0.002 . 1 . . . . A 4 ILE HD12 . 30309 1 43 . 1 1 4 4 ILE HD13 H 1 0.869 0.002 . 1 . . . . A 4 ILE HD13 . 30309 1 44 . 1 1 4 4 ILE C C 13 177.314 0.000 . 1 . . . . A 4 ILE C . 30309 1 45 . 1 1 4 4 ILE CA C 13 66.039 0.076 . 1 . . . . A 4 ILE CA . 30309 1 46 . 1 1 4 4 ILE CB C 13 37.422 0.029 . 1 . . . . A 4 ILE CB . 30309 1 47 . 1 1 4 4 ILE CG1 C 13 31.415 0.039 . 1 . . . . A 4 ILE CG1 . 30309 1 48 . 1 1 4 4 ILE CG2 C 13 20.984 0.083 . 1 . . . . A 4 ILE CG2 . 30309 1 49 . 1 1 4 4 ILE CD1 C 13 15.198 0.046 . 1 . . . . A 4 ILE CD1 . 30309 1 50 . 1 1 4 4 ILE N N 15 114.599 0.009 . 1 . . . . A 4 ILE N . 30309 1 51 . 1 1 5 5 ASP H H 1 7.850 0.002 . 1 . . . . A 5 ASP H . 30309 1 52 . 1 1 5 5 ASP HA H 1 4.161 0.005 . 1 . . . . A 5 ASP HA . 30309 1 53 . 1 1 5 5 ASP HB2 H 1 2.967 0.003 . 2 . . . . A 5 ASP HB2 . 30309 1 54 . 1 1 5 5 ASP HB3 H 1 2.628 0.007 . 2 . . . . A 5 ASP HB3 . 30309 1 55 . 1 1 5 5 ASP C C 13 178.829 0.000 . 1 . . . . A 5 ASP C . 30309 1 56 . 1 1 5 5 ASP CA C 13 58.330 0.031 . 1 . . . . A 5 ASP CA . 30309 1 57 . 1 1 5 5 ASP CB C 13 41.662 0.022 . 1 . . . . A 5 ASP CB . 30309 1 58 . 1 1 5 5 ASP N N 15 119.382 0.031 . 1 . . . . A 5 ASP N . 30309 1 59 . 1 1 6 6 ILE H H 1 7.775 0.002 . 1 . . . . A 6 ILE H . 30309 1 60 . 1 1 6 6 ILE HA H 1 3.672 0.008 . 1 . . . . A 6 ILE HA . 30309 1 61 . 1 1 6 6 ILE HB H 1 1.904 0.005 . 1 . . . . A 6 ILE HB . 30309 1 62 . 1 1 6 6 ILE HG12 H 1 1.506 0.007 . 2 . . . . A 6 ILE HG12 . 30309 1 63 . 1 1 6 6 ILE HG13 H 1 1.349 0.004 . 2 . . . . A 6 ILE HG13 . 30309 1 64 . 1 1 6 6 ILE HG21 H 1 0.998 0.004 . 1 . . . . A 6 ILE HG21 . 30309 1 65 . 1 1 6 6 ILE HG22 H 1 0.998 0.004 . 1 . . . . A 6 ILE HG22 . 30309 1 66 . 1 1 6 6 ILE HG23 H 1 0.998 0.004 . 1 . . . . A 6 ILE HG23 . 30309 1 67 . 1 1 6 6 ILE HD11 H 1 0.767 0.005 . 1 . . . . A 6 ILE HD11 . 30309 1 68 . 1 1 6 6 ILE HD12 H 1 0.767 0.005 . 1 . . . . A 6 ILE HD12 . 30309 1 69 . 1 1 6 6 ILE HD13 H 1 0.767 0.005 . 1 . . . . A 6 ILE HD13 . 30309 1 70 . 1 1 6 6 ILE C C 13 177.869 0.000 . 1 . . . . A 6 ILE C . 30309 1 71 . 1 1 6 6 ILE CA C 13 64.055 0.021 . 1 . . . . A 6 ILE CA . 30309 1 72 . 1 1 6 6 ILE CB C 13 37.020 0.039 . 1 . . . . A 6 ILE CB . 30309 1 73 . 1 1 6 6 ILE CG2 C 13 18.274 0.067 . 1 . . . . A 6 ILE CG2 . 30309 1 74 . 1 1 6 6 ILE CD1 C 13 12.100 0.065 . 1 . . . . A 6 ILE CD1 . 30309 1 75 . 1 1 6 6 ILE N N 15 118.485 0.016 . 1 . . . . A 6 ILE N . 30309 1 76 . 1 1 7 7 ALA H H 1 7.952 0.003 . 1 . . . . A 7 ALA H . 30309 1 77 . 1 1 7 7 ALA HA H 1 4.179 0.003 . 1 . . . . A 7 ALA HA . 30309 1 78 . 1 1 7 7 ALA HB1 H 1 1.549 0.004 . 1 . . . . A 7 ALA HB1 . 30309 1 79 . 1 1 7 7 ALA HB2 H 1 1.549 0.004 . 1 . . . . A 7 ALA HB2 . 30309 1 80 . 1 1 7 7 ALA HB3 H 1 1.549 0.004 . 1 . . . . A 7 ALA HB3 . 30309 1 81 . 1 1 7 7 ALA C C 13 178.947 0.000 . 1 . . . . A 7 ALA C . 30309 1 82 . 1 1 7 7 ALA CA C 13 55.294 0.004 . 1 . . . . A 7 ALA CA . 30309 1 83 . 1 1 7 7 ALA CB C 13 19.396 0.061 . 1 . . . . A 7 ALA CB . 30309 1 84 . 1 1 7 7 ALA N N 15 124.263 0.027 . 1 . . . . A 7 ALA N . 30309 1 85 . 1 1 8 8 ILE H H 1 8.464 0.003 . 1 . . . . A 8 ILE H . 30309 1 86 . 1 1 8 8 ILE HA H 1 3.261 0.003 . 1 . . . . A 8 ILE HA . 30309 1 87 . 1 1 8 8 ILE HB H 1 1.796 0.008 . 1 . . . . A 8 ILE HB . 30309 1 88 . 1 1 8 8 ILE HG12 H 1 1.887 0.008 . 2 . . . . A 8 ILE HG12 . 30309 1 89 . 1 1 8 8 ILE HG13 H 1 0.495 0.006 . 2 . . . . A 8 ILE HG13 . 30309 1 90 . 1 1 8 8 ILE HG21 H 1 0.600 0.004 . 1 . . . . A 8 ILE HG21 . 30309 1 91 . 1 1 8 8 ILE HG22 H 1 0.600 0.004 . 1 . . . . A 8 ILE HG22 . 30309 1 92 . 1 1 8 8 ILE HG23 H 1 0.600 0.004 . 1 . . . . A 8 ILE HG23 . 30309 1 93 . 1 1 8 8 ILE HD11 H 1 0.688 0.004 . 1 . . . . A 8 ILE HD11 . 30309 1 94 . 1 1 8 8 ILE HD12 H 1 0.688 0.004 . 1 . . . . A 8 ILE HD12 . 30309 1 95 . 1 1 8 8 ILE HD13 H 1 0.688 0.004 . 1 . . . . A 8 ILE HD13 . 30309 1 96 . 1 1 8 8 ILE C C 13 177.617 0.000 . 1 . . . . A 8 ILE C . 30309 1 97 . 1 1 8 8 ILE CA C 13 65.825 0.036 . 1 . . . . A 8 ILE CA . 30309 1 98 . 1 1 8 8 ILE CB C 13 37.984 0.031 . 1 . . . . A 8 ILE CB . 30309 1 99 . 1 1 8 8 ILE CG1 C 13 30.894 0.015 . 1 . . . . A 8 ILE CG1 . 30309 1 100 . 1 1 8 8 ILE CG2 C 13 16.675 0.048 . 1 . . . . A 8 ILE CG2 . 30309 1 101 . 1 1 8 8 ILE CD1 C 13 14.958 0.058 . 1 . . . . A 8 ILE CD1 . 30309 1 102 . 1 1 8 8 ILE N N 15 117.811 0.018 . 1 . . . . A 8 ILE N . 30309 1 103 . 1 1 9 9 ASN H H 1 7.887 0.003 . 1 . . . . A 9 ASN H . 30309 1 104 . 1 1 9 9 ASN HA H 1 4.287 0.001 . 1 . . . . A 9 ASN HA . 30309 1 105 . 1 1 9 9 ASN HB2 H 1 2.819 0.003 . 2 . . . . A 9 ASN HB2 . 30309 1 106 . 1 1 9 9 ASN HB3 H 1 2.819 0.003 . 2 . . . . A 9 ASN HB3 . 30309 1 107 . 1 1 9 9 ASN HD21 H 1 7.574 0.002 . 2 . . . . A 9 ASN HD21 . 30309 1 108 . 1 1 9 9 ASN HD22 H 1 6.866 0.001 . 2 . . . . A 9 ASN HD22 . 30309 1 109 . 1 1 9 9 ASN C C 13 177.481 0.000 . 1 . . . . A 9 ASN C . 30309 1 110 . 1 1 9 9 ASN CA C 13 55.919 0.018 . 1 . . . . A 9 ASN CA . 30309 1 111 . 1 1 9 9 ASN CB C 13 38.297 0.042 . 1 . . . . A 9 ASN CB . 30309 1 112 . 1 1 9 9 ASN N N 15 117.507 0.019 . 1 . . . . A 9 ASN N . 30309 1 113 . 1 1 9 9 ASN ND2 N 15 111.854 0.045 . 1 . . . . A 9 ASN ND2 . 30309 1 114 . 1 1 10 10 LYS H H 1 8.183 0.002 . 1 . . . . A 10 LYS H . 30309 1 115 . 1 1 10 10 LYS HA H 1 4.114 0.006 . 1 . . . . A 10 LYS HA . 30309 1 116 . 1 1 10 10 LYS HB2 H 1 2.177 0.019 . 2 . . . . A 10 LYS HB2 . 30309 1 117 . 1 1 10 10 LYS HB3 H 1 2.108 0.005 . 2 . . . . A 10 LYS HB3 . 30309 1 118 . 1 1 10 10 LYS HG2 H 1 1.661 0.197 . 2 . . . . A 10 LYS HG2 . 30309 1 119 . 1 1 10 10 LYS HG3 H 1 1.661 0.197 . 2 . . . . A 10 LYS HG3 . 30309 1 120 . 1 1 10 10 LYS HD2 H 1 1.751 0.005 . 2 . . . . A 10 LYS HD2 . 30309 1 121 . 1 1 10 10 LYS HD3 H 1 1.498 0.005 . 2 . . . . A 10 LYS HD3 . 30309 1 122 . 1 1 10 10 LYS HE2 H 1 3.036 0.009 . 2 . . . . A 10 LYS HE2 . 30309 1 123 . 1 1 10 10 LYS HE3 H 1 3.013 0.010 . 2 . . . . A 10 LYS HE3 . 30309 1 124 . 1 1 10 10 LYS C C 13 178.346 0.000 . 1 . . . . A 10 LYS C . 30309 1 125 . 1 1 10 10 LYS CA C 13 58.237 0.028 . 1 . . . . A 10 LYS CA . 30309 1 126 . 1 1 10 10 LYS CB C 13 31.976 0.046 . 1 . . . . A 10 LYS CB . 30309 1 127 . 1 1 10 10 LYS CD C 13 24.424 0.070 . 1 . . . . A 10 LYS CD . 30309 1 128 . 1 1 10 10 LYS CE C 13 42.023 0.026 . 1 . . . . A 10 LYS CE . 30309 1 129 . 1 1 10 10 LYS N N 15 120.215 0.027 . 1 . . . . A 10 LYS N . 30309 1 130 . 1 1 11 11 LEU H H 1 7.691 0.002 . 1 . . . . A 11 LEU H . 30309 1 131 . 1 1 11 11 LEU HA H 1 4.273 0.004 . 1 . . . . A 11 LEU HA . 30309 1 132 . 1 1 11 11 LEU HB2 H 1 1.575 0.004 . 2 . . . . A 11 LEU HB2 . 30309 1 133 . 1 1 11 11 LEU HB3 H 1 1.430 0.011 . 2 . . . . A 11 LEU HB3 . 30309 1 134 . 1 1 11 11 LEU HG H 1 1.366 0.012 . 1 . . . . A 11 LEU HG . 30309 1 135 . 1 1 11 11 LEU HD11 H 1 0.262 0.004 . 1 . . . . A 11 LEU HD11 . 30309 1 136 . 1 1 11 11 LEU HD12 H 1 0.262 0.004 . 1 . . . . A 11 LEU HD12 . 30309 1 137 . 1 1 11 11 LEU HD13 H 1 0.262 0.004 . 1 . . . . A 11 LEU HD13 . 30309 1 138 . 1 1 11 11 LEU HD21 H 1 0.618 0.007 . 1 . . . . A 11 LEU HD21 . 30309 1 139 . 1 1 11 11 LEU HD22 H 1 0.618 0.007 . 1 . . . . A 11 LEU HD22 . 30309 1 140 . 1 1 11 11 LEU HD23 H 1 0.618 0.007 . 1 . . . . A 11 LEU HD23 . 30309 1 141 . 1 1 11 11 LEU C C 13 178.371 0.000 . 1 . . . . A 11 LEU C . 30309 1 142 . 1 1 11 11 LEU CA C 13 55.216 0.045 . 1 . . . . A 11 LEU CA . 30309 1 143 . 1 1 11 11 LEU CB C 13 42.572 0.037 . 1 . . . . A 11 LEU CB . 30309 1 144 . 1 1 11 11 LEU CD1 C 13 25.034 0.050 . 1 . . . . A 11 LEU CD1 . 30309 1 145 . 1 1 11 11 LEU CD2 C 13 22.019 0.032 . 1 . . . . A 11 LEU CD2 . 30309 1 146 . 1 1 11 11 LEU N N 15 117.116 0.012 . 1 . . . . A 11 LEU N . 30309 1 147 . 1 1 12 12 GLY H H 1 8.427 0.001 . 1 . . . . A 12 GLY H . 30309 1 148 . 1 1 12 12 GLY HA2 H 1 4.414 0.007 . 2 . . . . A 12 GLY HA2 . 30309 1 149 . 1 1 12 12 GLY HA3 H 1 3.630 0.005 . 2 . . . . A 12 GLY HA3 . 30309 1 150 . 1 1 12 12 GLY C C 13 173.325 0.000 . 1 . . . . A 12 GLY C . 30309 1 151 . 1 1 12 12 GLY CA C 13 45.738 0.026 . 1 . . . . A 12 GLY CA . 30309 1 152 . 1 1 12 12 GLY N N 15 108.396 0.015 . 1 . . . . A 12 GLY N . 30309 1 153 . 1 1 13 13 SER H H 1 7.095 0.003 . 1 . . . . A 13 SER H . 30309 1 154 . 1 1 13 13 SER HA H 1 4.521 0.003 . 1 . . . . A 13 SER HA . 30309 1 155 . 1 1 13 13 SER HB2 H 1 4.238 0.004 . 2 . . . . A 13 SER HB2 . 30309 1 156 . 1 1 13 13 SER HB3 H 1 4.090 0.006 . 2 . . . . A 13 SER HB3 . 30309 1 157 . 1 1 13 13 SER C C 13 174.035 0.000 . 1 . . . . A 13 SER C . 30309 1 158 . 1 1 13 13 SER CA C 13 57.756 0.026 . 1 . . . . A 13 SER CA . 30309 1 159 . 1 1 13 13 SER CB C 13 64.911 0.051 . 1 . . . . A 13 SER CB . 30309 1 160 . 1 1 13 13 SER N N 15 108.953 0.017 . 1 . . . . A 13 SER N . 30309 1 161 . 1 1 14 14 VAL H H 1 8.870 0.003 . 1 . . . . A 14 VAL H . 30309 1 162 . 1 1 14 14 VAL HA H 1 3.445 0.006 . 1 . . . . A 14 VAL HA . 30309 1 163 . 1 1 14 14 VAL HB H 1 2.005 0.004 . 1 . . . . A 14 VAL HB . 30309 1 164 . 1 1 14 14 VAL HG11 H 1 0.813 0.005 . 1 . . . . A 14 VAL HG11 . 30309 1 165 . 1 1 14 14 VAL HG12 H 1 0.813 0.005 . 1 . . . . A 14 VAL HG12 . 30309 1 166 . 1 1 14 14 VAL HG13 H 1 0.813 0.005 . 1 . . . . A 14 VAL HG13 . 30309 1 167 . 1 1 14 14 VAL HG21 H 1 0.985 0.003 . 1 . . . . A 14 VAL HG21 . 30309 1 168 . 1 1 14 14 VAL HG22 H 1 0.985 0.003 . 1 . . . . A 14 VAL HG22 . 30309 1 169 . 1 1 14 14 VAL HG23 H 1 0.985 0.003 . 1 . . . . A 14 VAL HG23 . 30309 1 170 . 1 1 14 14 VAL C C 13 177.865 0.000 . 1 . . . . A 14 VAL C . 30309 1 171 . 1 1 14 14 VAL CA C 13 66.776 0.050 . 1 . . . . A 14 VAL CA . 30309 1 172 . 1 1 14 14 VAL CB C 13 31.608 0.000 . 1 . . . . A 14 VAL CB . 30309 1 173 . 1 1 14 14 VAL CG1 C 13 21.222 0.041 . 1 . . . . A 14 VAL CG1 . 30309 1 174 . 1 1 14 14 VAL CG2 C 13 23.191 0.067 . 1 . . . . A 14 VAL CG2 . 30309 1 175 . 1 1 14 14 VAL N N 15 121.861 0.020 . 1 . . . . A 14 VAL N . 30309 1 176 . 1 1 15 15 SER H H 1 8.409 0.001 . 1 . . . . A 15 SER H . 30309 1 177 . 1 1 15 15 SER HA H 1 3.839 0.005 . 1 . . . . A 15 SER HA . 30309 1 178 . 1 1 15 15 SER HB2 H 1 3.827 0.017 . 2 . . . . A 15 SER HB2 . 30309 1 179 . 1 1 15 15 SER HB3 H 1 3.827 0.017 . 2 . . . . A 15 SER HB3 . 30309 1 180 . 1 1 15 15 SER C C 13 176.859 0.000 . 1 . . . . A 15 SER C . 30309 1 181 . 1 1 15 15 SER CA C 13 61.623 0.040 . 1 . . . . A 15 SER CA . 30309 1 182 . 1 1 15 15 SER CB C 13 61.874 0.000 . 1 . . . . A 15 SER CB . 30309 1 183 . 1 1 15 15 SER N N 15 114.368 0.015 . 1 . . . . A 15 SER N . 30309 1 184 . 1 1 16 16 ALA H H 1 8.237 0.002 . 1 . . . . A 16 ALA H . 30309 1 185 . 1 1 16 16 ALA HA H 1 4.148 0.003 . 1 . . . . A 16 ALA HA . 30309 1 186 . 1 1 16 16 ALA HB1 H 1 1.315 0.002 . 1 . . . . A 16 ALA HB1 . 30309 1 187 . 1 1 16 16 ALA HB2 H 1 1.315 0.002 . 1 . . . . A 16 ALA HB2 . 30309 1 188 . 1 1 16 16 ALA HB3 H 1 1.315 0.002 . 1 . . . . A 16 ALA HB3 . 30309 1 189 . 1 1 16 16 ALA C C 13 180.578 0.000 . 1 . . . . A 16 ALA C . 30309 1 190 . 1 1 16 16 ALA CA C 13 54.714 0.041 . 1 . . . . A 16 ALA CA . 30309 1 191 . 1 1 16 16 ALA CB C 13 19.008 0.056 . 1 . . . . A 16 ALA CB . 30309 1 192 . 1 1 16 16 ALA N N 15 124.435 0.019 . 1 . . . . A 16 ALA N . 30309 1 193 . 1 1 17 17 LEU H H 1 7.444 0.002 . 1 . . . . A 17 LEU H . 30309 1 194 . 1 1 17 17 LEU HA H 1 4.011 0.007 . 1 . . . . A 17 LEU HA . 30309 1 195 . 1 1 17 17 LEU HB2 H 1 1.798 0.003 . 2 . . . . A 17 LEU HB2 . 30309 1 196 . 1 1 17 17 LEU HB3 H 1 1.149 0.007 . 2 . . . . A 17 LEU HB3 . 30309 1 197 . 1 1 17 17 LEU HG H 1 1.482 0.010 . 1 . . . . A 17 LEU HG . 30309 1 198 . 1 1 17 17 LEU HD11 H 1 0.698 0.003 . 1 . . . . A 17 LEU HD11 . 30309 1 199 . 1 1 17 17 LEU HD12 H 1 0.698 0.003 . 1 . . . . A 17 LEU HD12 . 30309 1 200 . 1 1 17 17 LEU HD13 H 1 0.698 0.003 . 1 . . . . A 17 LEU HD13 . 30309 1 201 . 1 1 17 17 LEU HD21 H 1 0.869 0.003 . 1 . . . . A 17 LEU HD21 . 30309 1 202 . 1 1 17 17 LEU HD22 H 1 0.869 0.003 . 1 . . . . A 17 LEU HD22 . 30309 1 203 . 1 1 17 17 LEU HD23 H 1 0.869 0.003 . 1 . . . . A 17 LEU HD23 . 30309 1 204 . 1 1 17 17 LEU C C 13 177.132 0.000 . 1 . . . . A 17 LEU C . 30309 1 205 . 1 1 17 17 LEU CA C 13 57.359 0.071 . 1 . . . . A 17 LEU CA . 30309 1 206 . 1 1 17 17 LEU CB C 13 41.217 0.037 . 1 . . . . A 17 LEU CB . 30309 1 207 . 1 1 17 17 LEU CD1 C 13 24.128 0.044 . 1 . . . . A 17 LEU CD1 . 30309 1 208 . 1 1 17 17 LEU CD2 C 13 27.933 0.042 . 1 . . . . A 17 LEU CD2 . 30309 1 209 . 1 1 17 17 LEU N N 15 120.112 0.018 . 1 . . . . A 17 LEU N . 30309 1 210 . 1 1 18 18 ALA H H 1 8.506 0.001 . 1 . . . . A 18 ALA H . 30309 1 211 . 1 1 18 18 ALA HA H 1 3.555 0.005 . 1 . . . . A 18 ALA HA . 30309 1 212 . 1 1 18 18 ALA HB1 H 1 1.293 0.003 . 1 . . . . A 18 ALA HB1 . 30309 1 213 . 1 1 18 18 ALA HB2 H 1 1.293 0.003 . 1 . . . . A 18 ALA HB2 . 30309 1 214 . 1 1 18 18 ALA HB3 H 1 1.293 0.003 . 1 . . . . A 18 ALA HB3 . 30309 1 215 . 1 1 18 18 ALA C C 13 179.219 0.000 . 1 . . . . A 18 ALA C . 30309 1 216 . 1 1 18 18 ALA CA C 13 55.392 0.050 . 1 . . . . A 18 ALA CA . 30309 1 217 . 1 1 18 18 ALA CB C 13 17.337 0.072 . 1 . . . . A 18 ALA CB . 30309 1 218 . 1 1 18 18 ALA N N 15 121.364 0.014 . 1 . . . . A 18 ALA N . 30309 1 219 . 1 1 19 19 ALA H H 1 7.892 0.005 . 1 . . . . A 19 ALA H . 30309 1 220 . 1 1 19 19 ALA HA H 1 4.134 0.002 . 1 . . . . A 19 ALA HA . 30309 1 221 . 1 1 19 19 ALA HB1 H 1 1.439 0.003 . 1 . . . . A 19 ALA HB1 . 30309 1 222 . 1 1 19 19 ALA HB2 H 1 1.439 0.003 . 1 . . . . A 19 ALA HB2 . 30309 1 223 . 1 1 19 19 ALA HB3 H 1 1.439 0.003 . 1 . . . . A 19 ALA HB3 . 30309 1 224 . 1 1 19 19 ALA C C 13 180.676 0.000 . 1 . . . . A 19 ALA C . 30309 1 225 . 1 1 19 19 ALA CA C 13 54.640 0.035 . 1 . . . . A 19 ALA CA . 30309 1 226 . 1 1 19 19 ALA CB C 13 17.957 0.036 . 1 . . . . A 19 ALA CB . 30309 1 227 . 1 1 19 19 ALA N N 15 118.224 0.020 . 1 . . . . A 19 ALA N . 30309 1 228 . 1 1 20 20 ALA H H 1 7.696 0.002 . 1 . . . . A 20 ALA H . 30309 1 229 . 1 1 20 20 ALA HA H 1 4.125 0.005 . 1 . . . . A 20 ALA HA . 30309 1 230 . 1 1 20 20 ALA HB1 H 1 1.430 0.003 . 1 . . . . A 20 ALA HB1 . 30309 1 231 . 1 1 20 20 ALA HB2 H 1 1.430 0.003 . 1 . . . . A 20 ALA HB2 . 30309 1 232 . 1 1 20 20 ALA HB3 H 1 1.430 0.003 . 1 . . . . A 20 ALA HB3 . 30309 1 233 . 1 1 20 20 ALA C C 13 179.525 0.000 . 1 . . . . A 20 ALA C . 30309 1 234 . 1 1 20 20 ALA CA C 13 54.700 0.008 . 1 . . . . A 20 ALA CA . 30309 1 235 . 1 1 20 20 ALA CB C 13 17.730 0.078 . 1 . . . . A 20 ALA CB . 30309 1 236 . 1 1 20 20 ALA N N 15 120.628 0.021 . 1 . . . . A 20 ALA N . 30309 1 237 . 1 1 21 21 LEU H H 1 7.838 0.002 . 1 . . . . A 21 LEU H . 30309 1 238 . 1 1 21 21 LEU HA H 1 4.483 0.002 . 1 . . . . A 21 LEU HA . 30309 1 239 . 1 1 21 21 LEU HB2 H 1 1.781 0.022 . 2 . . . . A 21 LEU HB2 . 30309 1 240 . 1 1 21 21 LEU HB3 H 1 1.713 0.008 . 2 . . . . A 21 LEU HB3 . 30309 1 241 . 1 1 21 21 LEU HG H 1 1.960 0.005 . 1 . . . . A 21 LEU HG . 30309 1 242 . 1 1 21 21 LEU HD11 H 1 0.990 0.004 . 1 . . . . A 21 LEU HD11 . 30309 1 243 . 1 1 21 21 LEU HD12 H 1 0.990 0.004 . 1 . . . . A 21 LEU HD12 . 30309 1 244 . 1 1 21 21 LEU HD13 H 1 0.990 0.004 . 1 . . . . A 21 LEU HD13 . 30309 1 245 . 1 1 21 21 LEU HD21 H 1 1.017 0.007 . 1 . . . . A 21 LEU HD21 . 30309 1 246 . 1 1 21 21 LEU HD22 H 1 1.017 0.007 . 1 . . . . A 21 LEU HD22 . 30309 1 247 . 1 1 21 21 LEU HD23 H 1 1.017 0.007 . 1 . . . . A 21 LEU HD23 . 30309 1 248 . 1 1 21 21 LEU C C 13 177.380 0.000 . 1 . . . . A 21 LEU C . 30309 1 249 . 1 1 21 21 LEU CA C 13 54.901 0.003 . 1 . . . . A 21 LEU CA . 30309 1 250 . 1 1 21 21 LEU CB C 13 43.154 0.042 . 1 . . . . A 21 LEU CB . 30309 1 251 . 1 1 21 21 LEU CD1 C 13 26.059 0.042 . 1 . . . . A 21 LEU CD1 . 30309 1 252 . 1 1 21 21 LEU CD2 C 13 24.342 0.044 . 1 . . . . A 21 LEU CD2 . 30309 1 253 . 1 1 21 21 LEU N N 15 115.444 0.017 . 1 . . . . A 21 LEU N . 30309 1 254 . 1 1 22 22 GLY H H 1 8.008 0.001 . 1 . . . . A 22 GLY H . 30309 1 255 . 1 1 22 22 GLY HA2 H 1 3.974 0.005 . 2 . . . . A 22 GLY HA2 . 30309 1 256 . 1 1 22 22 GLY HA3 H 1 3.974 0.005 . 2 . . . . A 22 GLY HA3 . 30309 1 257 . 1 1 22 22 GLY C C 13 175.216 0.000 . 1 . . . . A 22 GLY C . 30309 1 258 . 1 1 22 22 GLY CA C 13 46.988 0.034 . 1 . . . . A 22 GLY CA . 30309 1 259 . 1 1 22 22 GLY N N 15 110.186 0.013 . 1 . . . . A 22 GLY N . 30309 1 260 . 1 1 23 23 VAL H H 1 7.930 0.004 . 1 . . . . A 23 VAL H . 30309 1 261 . 1 1 23 23 VAL HA H 1 4.733 0.004 . 1 . . . . A 23 VAL HA . 30309 1 262 . 1 1 23 23 VAL HB H 1 2.147 0.003 . 1 . . . . A 23 VAL HB . 30309 1 263 . 1 1 23 23 VAL HG11 H 1 0.956 0.002 . 1 . . . . A 23 VAL HG11 . 30309 1 264 . 1 1 23 23 VAL HG12 H 1 0.956 0.002 . 1 . . . . A 23 VAL HG12 . 30309 1 265 . 1 1 23 23 VAL HG13 H 1 0.956 0.002 . 1 . . . . A 23 VAL HG13 . 30309 1 266 . 1 1 23 23 VAL HG21 H 1 0.537 0.004 . 1 . . . . A 23 VAL HG21 . 30309 1 267 . 1 1 23 23 VAL HG22 H 1 0.537 0.004 . 1 . . . . A 23 VAL HG22 . 30309 1 268 . 1 1 23 23 VAL HG23 H 1 0.537 0.004 . 1 . . . . A 23 VAL HG23 . 30309 1 269 . 1 1 23 23 VAL C C 13 173.965 0.000 . 1 . . . . A 23 VAL C . 30309 1 270 . 1 1 23 23 VAL CA C 13 58.410 0.030 . 1 . . . . A 23 VAL CA . 30309 1 271 . 1 1 23 23 VAL CB C 13 35.008 0.000 . 1 . . . . A 23 VAL CB . 30309 1 272 . 1 1 23 23 VAL CG1 C 13 21.712 0.181 . 1 . . . . A 23 VAL CG1 . 30309 1 273 . 1 1 23 23 VAL CG2 C 13 18.589 0.066 . 1 . . . . A 23 VAL CG2 . 30309 1 274 . 1 1 23 23 VAL N N 15 111.438 0.017 . 1 . . . . A 23 VAL N . 30309 1 275 . 1 1 24 24 ASN H H 1 8.157 0.003 . 1 . . . . A 24 ASN H . 30309 1 276 . 1 1 24 24 ASN HA H 1 4.706 0.011 . 1 . . . . A 24 ASN HA . 30309 1 277 . 1 1 24 24 ASN HB2 H 1 2.901 0.006 . 2 . . . . A 24 ASN HB2 . 30309 1 278 . 1 1 24 24 ASN HB3 H 1 2.809 0.008 . 2 . . . . A 24 ASN HB3 . 30309 1 279 . 1 1 24 24 ASN HD21 H 1 7.684 0.000 . 2 . . . . A 24 ASN HD21 . 30309 1 280 . 1 1 24 24 ASN HD22 H 1 6.948 0.001 . 2 . . . . A 24 ASN HD22 . 30309 1 281 . 1 1 24 24 ASN C C 13 176.680 0.000 . 1 . . . . A 24 ASN C . 30309 1 282 . 1 1 24 24 ASN CA C 13 52.283 0.048 . 1 . . . . A 24 ASN CA . 30309 1 283 . 1 1 24 24 ASN CB C 13 39.464 0.031 . 1 . . . . A 24 ASN CB . 30309 1 284 . 1 1 24 24 ASN N N 15 117.085 0.013 . 1 . . . . A 24 ASN N . 30309 1 285 . 1 1 24 24 ASN ND2 N 15 113.277 0.013 . 1 . . . . A 24 ASN ND2 . 30309 1 286 . 1 1 25 25 GLN H H 1 9.001 0.003 . 1 . . . . A 25 GLN H . 30309 1 287 . 1 1 25 25 GLN HA H 1 3.487 0.004 . 1 . . . . A 25 GLN HA . 30309 1 288 . 1 1 25 25 GLN HB2 H 1 1.945 0.007 . 2 . . . . A 25 GLN HB2 . 30309 1 289 . 1 1 25 25 GLN HB3 H 1 1.945 0.007 . 2 . . . . A 25 GLN HB3 . 30309 1 290 . 1 1 25 25 GLN HG2 H 1 2.348 0.004 . 2 . . . . A 25 GLN HG2 . 30309 1 291 . 1 1 25 25 GLN HG3 H 1 2.082 0.007 . 2 . . . . A 25 GLN HG3 . 30309 1 292 . 1 1 25 25 GLN HE21 H 1 7.563 0.001 . 2 . . . . A 25 GLN HE21 . 30309 1 293 . 1 1 25 25 GLN HE22 H 1 6.934 0.001 . 2 . . . . A 25 GLN HE22 . 30309 1 294 . 1 1 25 25 GLN C C 13 177.287 0.000 . 1 . . . . A 25 GLN C . 30309 1 295 . 1 1 25 25 GLN CA C 13 60.164 0.024 . 1 . . . . A 25 GLN CA . 30309 1 296 . 1 1 25 25 GLN CB C 13 28.150 0.000 . 1 . . . . A 25 GLN CB . 30309 1 297 . 1 1 25 25 GLN N N 15 121.223 0.024 . 1 . . . . A 25 GLN N . 30309 1 298 . 1 1 25 25 GLN NE2 N 15 112.223 0.025 . 1 . . . . A 25 GLN NE2 . 30309 1 299 . 1 1 26 26 SER H H 1 8.497 0.001 . 1 . . . . A 26 SER H . 30309 1 300 . 1 1 26 26 SER HA H 1 3.989 0.001 . 1 . . . . A 26 SER HA . 30309 1 301 . 1 1 26 26 SER HB2 H 1 3.797 0.003 . 2 . . . . A 26 SER HB2 . 30309 1 302 . 1 1 26 26 SER HB3 H 1 3.797 0.003 . 2 . . . . A 26 SER HB3 . 30309 1 303 . 1 1 26 26 SER C C 13 176.499 0.000 . 1 . . . . A 26 SER C . 30309 1 304 . 1 1 26 26 SER CA C 13 60.913 0.161 . 1 . . . . A 26 SER CA . 30309 1 305 . 1 1 26 26 SER CB C 13 62.209 0.060 . 1 . . . . A 26 SER CB . 30309 1 306 . 1 1 26 26 SER N N 15 114.418 0.032 . 1 . . . . A 26 SER N . 30309 1 307 . 1 1 27 27 ALA H H 1 7.301 0.004 . 1 . . . . A 27 ALA H . 30309 1 308 . 1 1 27 27 ALA HA H 1 3.887 0.007 . 1 . . . . A 27 ALA HA . 30309 1 309 . 1 1 27 27 ALA HB1 H 1 1.115 0.002 . 1 . . . . A 27 ALA HB1 . 30309 1 310 . 1 1 27 27 ALA HB2 H 1 1.115 0.002 . 1 . . . . A 27 ALA HB2 . 30309 1 311 . 1 1 27 27 ALA HB3 H 1 1.115 0.002 . 1 . . . . A 27 ALA HB3 . 30309 1 312 . 1 1 27 27 ALA C C 13 177.271 0.000 . 1 . . . . A 27 ALA C . 30309 1 313 . 1 1 27 27 ALA CA C 13 54.692 0.064 . 1 . . . . A 27 ALA CA . 30309 1 314 . 1 1 27 27 ALA CB C 13 17.493 0.068 . 1 . . . . A 27 ALA CB . 30309 1 315 . 1 1 27 27 ALA N N 15 125.156 0.024 . 1 . . . . A 27 ALA N . 30309 1 316 . 1 1 28 28 ILE H H 1 6.356 0.001 . 1 . . . . A 28 ILE H . 30309 1 317 . 1 1 28 28 ILE HA H 1 2.726 0.005 . 1 . . . . A 28 ILE HA . 30309 1 318 . 1 1 28 28 ILE HB H 1 1.927 0.003 . 1 . . . . A 28 ILE HB . 30309 1 319 . 1 1 28 28 ILE HG12 H 1 1.096 0.007 . 2 . . . . A 28 ILE HG12 . 30309 1 320 . 1 1 28 28 ILE HG13 H 1 0.887 0.010 . 2 . . . . A 28 ILE HG13 . 30309 1 321 . 1 1 28 28 ILE HG21 H 1 0.716 0.005 . 1 . . . . A 28 ILE HG21 . 30309 1 322 . 1 1 28 28 ILE HG22 H 1 0.716 0.005 . 1 . . . . A 28 ILE HG22 . 30309 1 323 . 1 1 28 28 ILE HG23 H 1 0.716 0.005 . 1 . . . . A 28 ILE HG23 . 30309 1 324 . 1 1 28 28 ILE HD11 H 1 0.090 0.004 . 1 . . . . A 28 ILE HD11 . 30309 1 325 . 1 1 28 28 ILE HD12 H 1 0.090 0.004 . 1 . . . . A 28 ILE HD12 . 30309 1 326 . 1 1 28 28 ILE HD13 H 1 0.090 0.004 . 1 . . . . A 28 ILE HD13 . 30309 1 327 . 1 1 28 28 ILE C C 13 178.213 0.000 . 1 . . . . A 28 ILE C . 30309 1 328 . 1 1 28 28 ILE CA C 13 61.666 0.030 . 1 . . . . A 28 ILE CA . 30309 1 329 . 1 1 28 28 ILE CB C 13 34.429 0.045 . 1 . . . . A 28 ILE CB . 30309 1 330 . 1 1 28 28 ILE CG1 C 13 27.053 0.010 . 1 . . . . A 28 ILE CG1 . 30309 1 331 . 1 1 28 28 ILE CG2 C 13 19.718 0.042 . 1 . . . . A 28 ILE CG2 . 30309 1 332 . 1 1 28 28 ILE CD1 C 13 9.800 0.056 . 1 . . . . A 28 ILE CD1 . 30309 1 333 . 1 1 28 28 ILE N N 15 112.474 0.017 . 1 . . . . A 28 ILE N . 30309 1 334 . 1 1 29 29 SER H H 1 7.908 0.002 . 1 . . . . A 29 SER H . 30309 1 335 . 1 1 29 29 SER HA H 1 3.860 0.005 . 1 . . . . A 29 SER HA . 30309 1 336 . 1 1 29 29 SER HB2 H 1 3.946 0.001 . 2 . . . . A 29 SER HB2 . 30309 1 337 . 1 1 29 29 SER HB3 H 1 3.946 0.001 . 2 . . . . A 29 SER HB3 . 30309 1 338 . 1 1 29 29 SER C C 13 176.969 0.000 . 1 . . . . A 29 SER C . 30309 1 339 . 1 1 29 29 SER CA C 13 62.100 0.000 . 1 . . . . A 29 SER CA . 30309 1 340 . 1 1 29 29 SER N N 15 113.387 0.018 . 1 . . . . A 29 SER N . 30309 1 341 . 1 1 30 30 GLN H H 1 7.740 0.001 . 1 . . . . A 30 GLN H . 30309 1 342 . 1 1 30 30 GLN HA H 1 4.186 0.002 . 1 . . . . A 30 GLN HA . 30309 1 343 . 1 1 30 30 GLN HB2 H 1 2.296 0.009 . 2 . . . . A 30 GLN HB2 . 30309 1 344 . 1 1 30 30 GLN HB3 H 1 2.296 0.009 . 2 . . . . A 30 GLN HB3 . 30309 1 345 . 1 1 30 30 GLN HG2 H 1 2.578 0.004 . 2 . . . . A 30 GLN HG2 . 30309 1 346 . 1 1 30 30 GLN HG3 H 1 2.347 0.008 . 2 . . . . A 30 GLN HG3 . 30309 1 347 . 1 1 30 30 GLN HE21 H 1 7.458 0.000 . 2 . . . . A 30 GLN HE21 . 30309 1 348 . 1 1 30 30 GLN HE22 H 1 6.904 0.001 . 2 . . . . A 30 GLN HE22 . 30309 1 349 . 1 1 30 30 GLN C C 13 178.817 0.000 . 1 . . . . A 30 GLN C . 30309 1 350 . 1 1 30 30 GLN CA C 13 59.172 0.055 . 1 . . . . A 30 GLN CA . 30309 1 351 . 1 1 30 30 GLN CB C 13 28.414 0.031 . 1 . . . . A 30 GLN CB . 30309 1 352 . 1 1 30 30 GLN CG C 13 34.112 0.043 . 1 . . . . A 30 GLN CG . 30309 1 353 . 1 1 30 30 GLN N N 15 123.328 0.020 . 1 . . . . A 30 GLN N . 30309 1 354 . 1 1 30 30 GLN NE2 N 15 111.709 0.015 . 1 . . . . A 30 GLN NE2 . 30309 1 355 . 1 1 31 31 TRP H H 1 8.946 0.005 . 1 . . . . A 31 TRP H . 30309 1 356 . 1 1 31 31 TRP HA H 1 4.827 0.006 . 1 . . . . A 31 TRP HA . 30309 1 357 . 1 1 31 31 TRP HB2 H 1 3.365 0.011 . 2 . . . . A 31 TRP HB2 . 30309 1 358 . 1 1 31 31 TRP HB3 H 1 3.283 0.011 . 2 . . . . A 31 TRP HB3 . 30309 1 359 . 1 1 31 31 TRP HD1 H 1 7.035 0.003 . 1 . . . . A 31 TRP HD1 . 30309 1 360 . 1 1 31 31 TRP HE1 H 1 10.440 0.002 . 1 . . . . A 31 TRP HE1 . 30309 1 361 . 1 1 31 31 TRP HE3 H 1 7.188 0.006 . 1 . . . . A 31 TRP HE3 . 30309 1 362 . 1 1 31 31 TRP HZ2 H 1 7.488 0.004 . 1 . . . . A 31 TRP HZ2 . 30309 1 363 . 1 1 31 31 TRP HZ3 H 1 6.736 0.008 . 1 . . . . A 31 TRP HZ3 . 30309 1 364 . 1 1 31 31 TRP HH2 H 1 6.895 0.006 . 1 . . . . A 31 TRP HH2 . 30309 1 365 . 1 1 31 31 TRP C C 13 179.359 0.000 . 1 . . . . A 31 TRP C . 30309 1 366 . 1 1 31 31 TRP CA C 13 57.756 0.000 . 1 . . . . A 31 TRP CA . 30309 1 367 . 1 1 31 31 TRP CB C 13 29.811 0.043 . 1 . . . . A 31 TRP CB . 30309 1 368 . 1 1 31 31 TRP CD1 C 13 125.946 0.022 . 1 . . . . A 31 TRP CD1 . 30309 1 369 . 1 1 31 31 TRP CE3 C 13 119.249 0.043 . 1 . . . . A 31 TRP CE3 . 30309 1 370 . 1 1 31 31 TRP CZ2 C 13 114.678 0.028 . 1 . . . . A 31 TRP CZ2 . 30309 1 371 . 1 1 31 31 TRP CZ3 C 13 120.480 0.019 . 1 . . . . A 31 TRP CZ3 . 30309 1 372 . 1 1 31 31 TRP CH2 C 13 123.361 0.048 . 1 . . . . A 31 TRP CH2 . 30309 1 373 . 1 1 31 31 TRP N N 15 121.421 0.025 . 1 . . . . A 31 TRP N . 30309 1 374 . 1 1 31 31 TRP NE1 N 15 129.256 0.009 . 1 . . . . A 31 TRP NE1 . 30309 1 375 . 1 1 32 32 ARG H H 1 8.815 0.001 . 1 . . . . A 32 ARG H . 30309 1 376 . 1 1 32 32 ARG HA H 1 3.862 0.005 . 1 . . . . A 32 ARG HA . 30309 1 377 . 1 1 32 32 ARG HB2 H 1 1.916 0.004 . 2 . . . . A 32 ARG HB2 . 30309 1 378 . 1 1 32 32 ARG HB3 H 1 1.916 0.004 . 2 . . . . A 32 ARG HB3 . 30309 1 379 . 1 1 32 32 ARG HG2 H 1 1.759 0.007 . 2 . . . . A 32 ARG HG2 . 30309 1 380 . 1 1 32 32 ARG HG3 H 1 1.529 0.006 . 2 . . . . A 32 ARG HG3 . 30309 1 381 . 1 1 32 32 ARG HD2 H 1 3.081 0.003 . 2 . . . . A 32 ARG HD2 . 30309 1 382 . 1 1 32 32 ARG HD3 H 1 2.875 0.005 . 2 . . . . A 32 ARG HD3 . 30309 1 383 . 1 1 32 32 ARG HE H 1 8.012 0.001 . 1 . . . . A 32 ARG HE . 30309 1 384 . 1 1 32 32 ARG C C 13 178.259 0.000 . 1 . . . . A 32 ARG C . 30309 1 385 . 1 1 32 32 ARG CA C 13 59.614 0.064 . 1 . . . . A 32 ARG CA . 30309 1 386 . 1 1 32 32 ARG CB C 13 30.848 0.026 . 1 . . . . A 32 ARG CB . 30309 1 387 . 1 1 32 32 ARG CD C 13 43.994 0.018 . 1 . . . . A 32 ARG CD . 30309 1 388 . 1 1 32 32 ARG N N 15 117.728 0.019 . 1 . . . . A 32 ARG N . 30309 1 389 . 1 1 32 32 ARG NE N 15 83.81 0.018 . 1 . . . . A 32 ARG NE . 30309 1 390 . 1 1 33 33 ALA H H 1 7.726 0.002 . 1 . . . . A 33 ALA H . 30309 1 391 . 1 1 33 33 ALA HA H 1 4.168 0.006 . 1 . . . . A 33 ALA HA . 30309 1 392 . 1 1 33 33 ALA HB1 H 1 1.549 0.002 . 1 . . . . A 33 ALA HB1 . 30309 1 393 . 1 1 33 33 ALA HB2 H 1 1.549 0.002 . 1 . . . . A 33 ALA HB2 . 30309 1 394 . 1 1 33 33 ALA HB3 H 1 1.549 0.002 . 1 . . . . A 33 ALA HB3 . 30309 1 395 . 1 1 33 33 ALA C C 13 179.407 0.000 . 1 . . . . A 33 ALA C . 30309 1 396 . 1 1 33 33 ALA CA C 13 54.655 0.009 . 1 . . . . A 33 ALA CA . 30309 1 397 . 1 1 33 33 ALA CB C 13 18.487 0.053 . 1 . . . . A 33 ALA CB . 30309 1 398 . 1 1 33 33 ALA N N 15 120.105 0.017 . 1 . . . . A 33 ALA N . 30309 1 399 . 1 1 34 34 ARG H H 1 7.963 0.005 . 1 . . . . A 34 ARG H . 30309 1 400 . 1 1 34 34 ARG HA H 1 4.379 0.003 . 1 . . . . A 34 ARG HA . 30309 1 401 . 1 1 34 34 ARG HB2 H 1 2.071 0.011 . 2 . . . . A 34 ARG HB2 . 30309 1 402 . 1 1 34 34 ARG HB3 H 1 2.041 0.019 . 2 . . . . A 34 ARG HB3 . 30309 1 403 . 1 1 34 34 ARG HG2 H 1 1.834 0.013 . 2 . . . . A 34 ARG HG2 . 30309 1 404 . 1 1 34 34 ARG HG3 H 1 1.815 0.019 . 2 . . . . A 34 ARG HG3 . 30309 1 405 . 1 1 34 34 ARG HD2 H 1 3.253 0.009 . 2 . . . . A 34 ARG HD2 . 30309 1 406 . 1 1 34 34 ARG HD3 H 1 3.206 0.001 . 2 . . . . A 34 ARG HD3 . 30309 1 407 . 1 1 34 34 ARG HE H 1 7.254 0.004 . 1 . . . . A 34 ARG HE . 30309 1 408 . 1 1 34 34 ARG C C 13 177.402 0.000 . 1 . . . . A 34 ARG C . 30309 1 409 . 1 1 34 34 ARG CA C 13 56.407 0.020 . 1 . . . . A 34 ARG CA . 30309 1 410 . 1 1 34 34 ARG CB C 13 31.220 0.028 . 1 . . . . A 34 ARG CB . 30309 1 411 . 1 1 34 34 ARG N N 15 115.209 0.016 . 1 . . . . A 34 ARG N . 30309 1 412 . 1 1 34 34 ARG NE N 15 84.42 0.012 . 1 . . . . A 34 ARG NE . 30309 1 413 . 1 1 35 35 GLY H H 1 8.460 0.001 . 1 . . . . A 35 GLY H . 30309 1 414 . 1 1 35 35 GLY HA2 H 1 4.197 0.003 . 2 . . . . A 35 GLY HA2 . 30309 1 415 . 1 1 35 35 GLY HA3 H 1 3.636 0.004 . 2 . . . . A 35 GLY HA3 . 30309 1 416 . 1 1 35 35 GLY C C 13 174.024 0.000 . 1 . . . . A 35 GLY C . 30309 1 417 . 1 1 35 35 GLY CA C 13 45.857 0.033 . 1 . . . . A 35 GLY CA . 30309 1 418 . 1 1 35 35 GLY N N 15 107.680 0.017 . 1 . . . . A 35 GLY N . 30309 1 419 . 1 1 36 36 ARG H H 1 7.393 0.002 . 1 . . . . A 36 ARG H . 30309 1 420 . 1 1 36 36 ARG HA H 1 4.844 0.005 . 1 . . . . A 36 ARG HA . 30309 1 421 . 1 1 36 36 ARG HB2 H 1 1.384 0.003 . 2 . . . . A 36 ARG HB2 . 30309 1 422 . 1 1 36 36 ARG HB3 H 1 1.277 0.016 . 2 . . . . A 36 ARG HB3 . 30309 1 423 . 1 1 36 36 ARG HG2 H 1 1.454 0.007 . 2 . . . . A 36 ARG HG2 . 30309 1 424 . 1 1 36 36 ARG HG3 H 1 1.454 0.007 . 2 . . . . A 36 ARG HG3 . 30309 1 425 . 1 1 36 36 ARG HD2 H 1 2.937 0.008 . 2 . . . . A 36 ARG HD2 . 30309 1 426 . 1 1 36 36 ARG HD3 H 1 2.859 0.002 . 2 . . . . A 36 ARG HD3 . 30309 1 427 . 1 1 36 36 ARG C C 13 174.091 0.000 . 1 . . . . A 36 ARG C . 30309 1 428 . 1 1 36 36 ARG CA C 13 54.170 0.020 . 1 . . . . A 36 ARG CA . 30309 1 429 . 1 1 36 36 ARG CB C 13 35.775 0.017 . 1 . . . . A 36 ARG CB . 30309 1 430 . 1 1 36 36 ARG N N 15 116.900 0.014 . 1 . . . . A 36 ARG N . 30309 1 431 . 1 1 37 37 VAL H H 1 8.040 0.008 . 1 . . . . A 37 VAL H . 30309 1 432 . 1 1 37 37 VAL HA H 1 3.946 0.006 . 1 . . . . A 37 VAL HA . 30309 1 433 . 1 1 37 37 VAL HB H 1 1.133 0.003 . 1 . . . . A 37 VAL HB . 30309 1 434 . 1 1 37 37 VAL HG11 H 1 0.687 0.002 . 1 . . . . A 37 VAL HG11 . 30309 1 435 . 1 1 37 37 VAL HG12 H 1 0.687 0.002 . 1 . . . . A 37 VAL HG12 . 30309 1 436 . 1 1 37 37 VAL HG13 H 1 0.687 0.002 . 1 . . . . A 37 VAL HG13 . 30309 1 437 . 1 1 37 37 VAL HG21 H 1 0.590 0.005 . 1 . . . . A 37 VAL HG21 . 30309 1 438 . 1 1 37 37 VAL HG22 H 1 0.590 0.005 . 1 . . . . A 37 VAL HG22 . 30309 1 439 . 1 1 37 37 VAL HG23 H 1 0.590 0.005 . 1 . . . . A 37 VAL HG23 . 30309 1 440 . 1 1 37 37 VAL CA C 13 57.549 0.028 . 1 . . . . A 37 VAL CA . 30309 1 441 . 1 1 37 37 VAL CB C 13 30.175 0.000 . 1 . . . . A 37 VAL CB . 30309 1 442 . 1 1 37 37 VAL CG1 C 13 23.029 0.064 . 1 . . . . A 37 VAL CG1 . 30309 1 443 . 1 1 37 37 VAL CG2 C 13 21.132 0.055 . 1 . . . . A 37 VAL CG2 . 30309 1 444 . 1 1 37 37 VAL N N 15 113.879 0.026 . 1 . . . . A 37 VAL N . 30309 1 445 . 1 1 38 38 PRO HA H 1 4.078 0.002 . 1 . . . . A 38 PRO HA . 30309 1 446 . 1 1 38 38 PRO HB2 H 1 2.229 0.012 . 2 . . . . A 38 PRO HB2 . 30309 1 447 . 1 1 38 38 PRO HB3 H 1 1.411 0.007 . 2 . . . . A 38 PRO HB3 . 30309 1 448 . 1 1 38 38 PRO HG2 H 1 1.866 0.006 . 2 . . . . A 38 PRO HG2 . 30309 1 449 . 1 1 38 38 PRO HG3 H 1 1.636 0.008 . 2 . . . . A 38 PRO HG3 . 30309 1 450 . 1 1 38 38 PRO HD2 H 1 1.486 0.002 . 2 . . . . A 38 PRO HD2 . 30309 1 451 . 1 1 38 38 PRO HD3 H 1 1.401 0.010 . 2 . . . . A 38 PRO HD3 . 30309 1 452 . 1 1 38 38 PRO C C 13 174.201 0.000 . 1 . . . . A 38 PRO C . 30309 1 453 . 1 1 38 38 PRO CA C 13 62.820 0.038 . 1 . . . . A 38 PRO CA . 30309 1 454 . 1 1 38 38 PRO CB C 13 32.007 0.047 . 1 . . . . A 38 PRO CB . 30309 1 455 . 1 1 38 38 PRO CD C 13 49.168 0.040 . 1 . . . . A 38 PRO CD . 30309 1 456 . 1 1 39 39 ALA H H 1 8.123 0.002 . 1 . . . . A 39 ALA H . 30309 1 457 . 1 1 39 39 ALA HA H 1 3.929 0.003 . 1 . . . . A 39 ALA HA . 30309 1 458 . 1 1 39 39 ALA HB1 H 1 1.246 0.004 . 1 . . . . A 39 ALA HB1 . 30309 1 459 . 1 1 39 39 ALA HB2 H 1 1.246 0.004 . 1 . . . . A 39 ALA HB2 . 30309 1 460 . 1 1 39 39 ALA HB3 H 1 1.246 0.004 . 1 . . . . A 39 ALA HB3 . 30309 1 461 . 1 1 39 39 ALA C C 13 178.459 0.000 . 1 . . . . A 39 ALA C . 30309 1 462 . 1 1 39 39 ALA CA C 13 53.454 0.057 . 1 . . . . A 39 ALA CA . 30309 1 463 . 1 1 39 39 ALA CB C 13 18.120 0.069 . 1 . . . . A 39 ALA CB . 30309 1 464 . 1 1 39 39 ALA N N 15 121.995 0.028 . 1 . . . . A 39 ALA N . 30309 1 465 . 1 1 40 40 GLY H H 1 8.700 0.001 . 1 . . . . A 40 GLY H . 30309 1 466 . 1 1 40 40 GLY HA2 H 1 4.203 0.002 . 2 . . . . A 40 GLY HA2 . 30309 1 467 . 1 1 40 40 GLY HA3 H 1 3.743 0.004 . 2 . . . . A 40 GLY HA3 . 30309 1 468 . 1 1 40 40 GLY C C 13 175.074 0.000 . 1 . . . . A 40 GLY C . 30309 1 469 . 1 1 40 40 GLY CA C 13 45.365 0.048 . 1 . . . . A 40 GLY CA . 30309 1 470 . 1 1 40 40 GLY N N 15 111.195 0.015 . 1 . . . . A 40 GLY N . 30309 1 471 . 1 1 41 41 ARG H H 1 7.929 0.001 . 1 . . . . A 41 ARG H . 30309 1 472 . 1 1 41 41 ARG HA H 1 4.573 0.002 . 1 . . . . A 41 ARG HA . 30309 1 473 . 1 1 41 41 ARG HB2 H 1 1.696 0.006 . 2 . . . . A 41 ARG HB2 . 30309 1 474 . 1 1 41 41 ARG HB3 H 1 1.589 0.006 . 2 . . . . A 41 ARG HB3 . 30309 1 475 . 1 1 41 41 ARG HG2 H 1 1.317 0.005 . 2 . . . . A 41 ARG HG2 . 30309 1 476 . 1 1 41 41 ARG HG3 H 1 1.279 0.006 . 2 . . . . A 41 ARG HG3 . 30309 1 477 . 1 1 41 41 ARG HD2 H 1 3.378 0.005 . 2 . . . . A 41 ARG HD2 . 30309 1 478 . 1 1 41 41 ARG HD3 H 1 2.964 0.002 . 2 . . . . A 41 ARG HD3 . 30309 1 479 . 1 1 41 41 ARG HE H 1 7.851 0.001 . 1 . . . . A 41 ARG HE . 30309 1 480 . 1 1 41 41 ARG C C 13 178.942 0.000 . 1 . . . . A 41 ARG C . 30309 1 481 . 1 1 41 41 ARG CA C 13 54.629 0.045 . 1 . . . . A 41 ARG CA . 30309 1 482 . 1 1 41 41 ARG CB C 13 28.656 0.000 . 1 . . . . A 41 ARG CB . 30309 1 483 . 1 1 41 41 ARG CD C 13 42.275 0.035 . 1 . . . . A 41 ARG CD . 30309 1 484 . 1 1 41 41 ARG N N 15 114.418 0.022 . 1 . . . . A 41 ARG N . 30309 1 485 . 1 1 41 41 ARG NE N 15 81.98 0.019 . 1 . . . . A 41 ARG NE . 30309 1 486 . 1 1 42 42 CYS H H 1 9.626 0.002 . 1 . . . . A 42 CYS H . 30309 1 487 . 1 1 42 42 CYS HA H 1 4.331 0.003 . 1 . . . . A 42 CYS HA . 30309 1 488 . 1 1 42 42 CYS HB2 H 1 3.035 0.007 . 2 . . . . A 42 CYS HB2 . 30309 1 489 . 1 1 42 42 CYS HB3 H 1 2.942 0.014 . 2 . . . . A 42 CYS HB3 . 30309 1 490 . 1 1 42 42 CYS C C 13 176.587 0.000 . 1 . . . . A 42 CYS C . 30309 1 491 . 1 1 42 42 CYS CA C 13 60.161 0.048 . 1 . . . . A 42 CYS CA . 30309 1 492 . 1 1 42 42 CYS CB C 13 36.523 0.061 . 1 . . . . A 42 CYS CB . 30309 1 493 . 1 1 42 42 CYS N N 15 121.548 0.023 . 1 . . . . A 42 CYS N . 30309 1 494 . 1 1 43 43 ILE H H 1 7.937 0.001 . 1 . . . . A 43 ILE H . 30309 1 495 . 1 1 43 43 ILE HA H 1 3.929 0.002 . 1 . . . . A 43 ILE HA . 30309 1 496 . 1 1 43 43 ILE HB H 1 1.702 0.004 . 1 . . . . A 43 ILE HB . 30309 1 497 . 1 1 43 43 ILE HG12 H 1 1.431 0.003 . 2 . . . . A 43 ILE HG12 . 30309 1 498 . 1 1 43 43 ILE HG13 H 1 1.168 0.006 . 2 . . . . A 43 ILE HG13 . 30309 1 499 . 1 1 43 43 ILE HG21 H 1 0.874 0.005 . 1 . . . . A 43 ILE HG21 . 30309 1 500 . 1 1 43 43 ILE HG22 H 1 0.874 0.005 . 1 . . . . A 43 ILE HG22 . 30309 1 501 . 1 1 43 43 ILE HG23 H 1 0.874 0.005 . 1 . . . . A 43 ILE HG23 . 30309 1 502 . 1 1 43 43 ILE HD11 H 1 0.838 0.003 . 1 . . . . A 43 ILE HD11 . 30309 1 503 . 1 1 43 43 ILE HD12 H 1 0.838 0.003 . 1 . . . . A 43 ILE HD12 . 30309 1 504 . 1 1 43 43 ILE HD13 H 1 0.838 0.003 . 1 . . . . A 43 ILE HD13 . 30309 1 505 . 1 1 43 43 ILE C C 13 176.489 0.000 . 1 . . . . A 43 ILE C . 30309 1 506 . 1 1 43 43 ILE CA C 13 63.740 0.063 . 1 . . . . A 43 ILE CA . 30309 1 507 . 1 1 43 43 ILE CB C 13 37.961 0.054 . 1 . . . . A 43 ILE CB . 30309 1 508 . 1 1 43 43 ILE CG1 C 13 27.946 0.054 . 1 . . . . A 43 ILE CG1 . 30309 1 509 . 1 1 43 43 ILE CG2 C 13 17.044 0.060 . 1 . . . . A 43 ILE CG2 . 30309 1 510 . 1 1 43 43 ILE CD1 C 13 13.727 0.069 . 1 . . . . A 43 ILE CD1 . 30309 1 511 . 1 1 43 43 ILE N N 15 117.917 0.028 . 1 . . . . A 43 ILE N . 30309 1 512 . 1 1 44 44 ASP H H 1 6.867 0.002 . 1 . . . . A 44 ASP H . 30309 1 513 . 1 1 44 44 ASP HA H 1 4.590 0.003 . 1 . . . . A 44 ASP HA . 30309 1 514 . 1 1 44 44 ASP HB2 H 1 2.799 0.004 . 2 . . . . A 44 ASP HB2 . 30309 1 515 . 1 1 44 44 ASP HB3 H 1 2.799 0.004 . 2 . . . . A 44 ASP HB3 . 30309 1 516 . 1 1 44 44 ASP C C 13 177.251 0.000 . 1 . . . . A 44 ASP C . 30309 1 517 . 1 1 44 44 ASP CA C 13 56.359 0.008 . 1 . . . . A 44 ASP CA . 30309 1 518 . 1 1 44 44 ASP CB C 13 42.198 0.035 . 1 . . . . A 44 ASP CB . 30309 1 519 . 1 1 44 44 ASP N N 15 119.294 0.015 . 1 . . . . A 44 ASP N . 30309 1 520 . 1 1 45 45 ILE H H 1 7.577 0.001 . 1 . . . . A 45 ILE H . 30309 1 521 . 1 1 45 45 ILE HA H 1 3.938 0.005 . 1 . . . . A 45 ILE HA . 30309 1 522 . 1 1 45 45 ILE HB H 1 2.426 0.007 . 1 . . . . A 45 ILE HB . 30309 1 523 . 1 1 45 45 ILE HG12 H 1 1.686 0.006 . 2 . . . . A 45 ILE HG12 . 30309 1 524 . 1 1 45 45 ILE HG13 H 1 1.517 0.010 . 2 . . . . A 45 ILE HG13 . 30309 1 525 . 1 1 45 45 ILE HG21 H 1 0.845 0.006 . 1 . . . . A 45 ILE HG21 . 30309 1 526 . 1 1 45 45 ILE HG22 H 1 0.845 0.006 . 1 . . . . A 45 ILE HG22 . 30309 1 527 . 1 1 45 45 ILE HG23 H 1 0.845 0.006 . 1 . . . . A 45 ILE HG23 . 30309 1 528 . 1 1 45 45 ILE HD11 H 1 0.901 0.004 . 1 . . . . A 45 ILE HD11 . 30309 1 529 . 1 1 45 45 ILE HD12 H 1 0.901 0.004 . 1 . . . . A 45 ILE HD12 . 30309 1 530 . 1 1 45 45 ILE HD13 H 1 0.901 0.004 . 1 . . . . A 45 ILE HD13 . 30309 1 531 . 1 1 45 45 ILE C C 13 178.240 0.000 . 1 . . . . A 45 ILE C . 30309 1 532 . 1 1 45 45 ILE CA C 13 62.232 0.047 . 1 . . . . A 45 ILE CA . 30309 1 533 . 1 1 45 45 ILE CB C 13 36.895 0.000 . 1 . . . . A 45 ILE CB . 30309 1 534 . 1 1 45 45 ILE CG2 C 13 18.395 0.067 . 1 . . . . A 45 ILE CG2 . 30309 1 535 . 1 1 45 45 ILE CD1 C 13 10.788 0.054 . 1 . . . . A 45 ILE CD1 . 30309 1 536 . 1 1 45 45 ILE N N 15 118.106 0.014 . 1 . . . . A 45 ILE N . 30309 1 537 . 1 1 46 46 GLU H H 1 8.640 0.002 . 1 . . . . A 46 GLU H . 30309 1 538 . 1 1 46 46 GLU HA H 1 4.311 0.003 . 1 . . . . A 46 GLU HA . 30309 1 539 . 1 1 46 46 GLU HB2 H 1 1.993 0.003 . 2 . . . . A 46 GLU HB2 . 30309 1 540 . 1 1 46 46 GLU HB3 H 1 1.993 0.003 . 2 . . . . A 46 GLU HB3 . 30309 1 541 . 1 1 46 46 GLU HG2 H 1 2.414 0.002 . 2 . . . . A 46 GLU HG2 . 30309 1 542 . 1 1 46 46 GLU HG3 H 1 2.210 0.008 . 2 . . . . A 46 GLU HG3 . 30309 1 543 . 1 1 46 46 GLU C C 13 177.852 0.000 . 1 . . . . A 46 GLU C . 30309 1 544 . 1 1 46 46 GLU CA C 13 58.391 0.028 . 1 . . . . A 46 GLU CA . 30309 1 545 . 1 1 46 46 GLU CB C 13 29.395 0.048 . 1 . . . . A 46 GLU CB . 30309 1 546 . 1 1 46 46 GLU N N 15 117.008 0.014 . 1 . . . . A 46 GLU N . 30309 1 547 . 1 1 47 47 LEU H H 1 7.015 0.004 . 1 . . . . A 47 LEU H . 30309 1 548 . 1 1 47 47 LEU HA H 1 3.950 0.004 . 1 . . . . A 47 LEU HA . 30309 1 549 . 1 1 47 47 LEU HB2 H 1 1.175 0.007 . 2 . . . . A 47 LEU HB2 . 30309 1 550 . 1 1 47 47 LEU HB3 H 1 0.765 0.014 . 2 . . . . A 47 LEU HB3 . 30309 1 551 . 1 1 47 47 LEU HG H 1 1.590 0.005 . 1 . . . . A 47 LEU HG . 30309 1 552 . 1 1 47 47 LEU HD11 H 1 0.871 0.003 . 1 . . . . A 47 LEU HD11 . 30309 1 553 . 1 1 47 47 LEU HD12 H 1 0.871 0.003 . 1 . . . . A 47 LEU HD12 . 30309 1 554 . 1 1 47 47 LEU HD13 H 1 0.871 0.003 . 1 . . . . A 47 LEU HD13 . 30309 1 555 . 1 1 47 47 LEU HD21 H 1 0.733 0.003 . 1 . . . . A 47 LEU HD21 . 30309 1 556 . 1 1 47 47 LEU HD22 H 1 0.733 0.003 . 1 . . . . A 47 LEU HD22 . 30309 1 557 . 1 1 47 47 LEU HD23 H 1 0.733 0.003 . 1 . . . . A 47 LEU HD23 . 30309 1 558 . 1 1 47 47 LEU C C 13 178.804 0.000 . 1 . . . . A 47 LEU C . 30309 1 559 . 1 1 47 47 LEU CA C 13 57.016 0.033 . 1 . . . . A 47 LEU CA . 30309 1 560 . 1 1 47 47 LEU CB C 13 41.207 0.036 . 1 . . . . A 47 LEU CB . 30309 1 561 . 1 1 47 47 LEU CD1 C 13 24.862 0.030 . 1 . . . . A 47 LEU CD1 . 30309 1 562 . 1 1 47 47 LEU CD2 C 13 23.011 0.011 . 1 . . . . A 47 LEU CD2 . 30309 1 563 . 1 1 47 47 LEU N N 15 118.734 0.016 . 1 . . . . A 47 LEU N . 30309 1 564 . 1 1 48 48 TYR H H 1 7.995 0.002 . 1 . . . . A 48 TYR H . 30309 1 565 . 1 1 48 48 TYR HA H 1 4.743 0.005 . 1 . . . . A 48 TYR HA . 30309 1 566 . 1 1 48 48 TYR HB2 H 1 3.439 0.004 . 2 . . . . A 48 TYR HB2 . 30309 1 567 . 1 1 48 48 TYR HB3 H 1 2.762 0.006 . 2 . . . . A 48 TYR HB3 . 30309 1 568 . 1 1 48 48 TYR HD1 H 1 7.065 0.006 . 3 . . . . A 48 TYR HD1 . 30309 1 569 . 1 1 48 48 TYR HD2 H 1 7.065 0.006 . 3 . . . . A 48 TYR HD2 . 30309 1 570 . 1 1 48 48 TYR HE1 H 1 6.723 0.008 . 3 . . . . A 48 TYR HE1 . 30309 1 571 . 1 1 48 48 TYR HE2 H 1 6.723 0.008 . 3 . . . . A 48 TYR HE2 . 30309 1 572 . 1 1 48 48 TYR C C 13 175.387 0.000 . 1 . . . . A 48 TYR C . 30309 1 573 . 1 1 48 48 TYR CA C 13 57.285 0.043 . 1 . . . . A 48 TYR CA . 30309 1 574 . 1 1 48 48 TYR CB C 13 39.660 0.021 . 1 . . . . A 48 TYR CB . 30309 1 575 . 1 1 48 48 TYR CD1 C 13 132.971 0.041 . 1 . . . . A 48 TYR CD1 . 30309 1 576 . 1 1 48 48 TYR CD2 C 13 132.971 0.041 . 1 . . . . A 48 TYR CD2 . 30309 1 577 . 1 1 48 48 TYR CE1 C 13 118.360 0.052 . 1 . . . . A 48 TYR CE1 . 30309 1 578 . 1 1 48 48 TYR CE2 C 13 118.360 0.052 . 1 . . . . A 48 TYR CE2 . 30309 1 579 . 1 1 48 48 TYR N N 15 115.121 0.014 . 1 . . . . A 48 TYR N . 30309 1 580 . 1 1 49 49 THR H H 1 7.261 0.001 . 1 . . . . A 49 THR H . 30309 1 581 . 1 1 49 49 THR HA H 1 4.467 0.005 . 1 . . . . A 49 THR HA . 30309 1 582 . 1 1 49 49 THR HB H 1 4.422 0.020 . 1 . . . . A 49 THR HB . 30309 1 583 . 1 1 49 49 THR HG21 H 1 1.261 0.003 . 1 . . . . A 49 THR HG21 . 30309 1 584 . 1 1 49 49 THR HG22 H 1 1.261 0.003 . 1 . . . . A 49 THR HG22 . 30309 1 585 . 1 1 49 49 THR HG23 H 1 1.261 0.003 . 1 . . . . A 49 THR HG23 . 30309 1 586 . 1 1 49 49 THR C C 13 175.376 0.000 . 1 . . . . A 49 THR C . 30309 1 587 . 1 1 49 49 THR CA C 13 61.095 0.025 . 1 . . . . A 49 THR CA . 30309 1 588 . 1 1 49 49 THR CB C 13 70.505 0.049 . 1 . . . . A 49 THR CB . 30309 1 589 . 1 1 49 49 THR CG2 C 13 22.772 0.035 . 1 . . . . A 49 THR CG2 . 30309 1 590 . 1 1 49 49 THR N N 15 105.269 0.014 . 1 . . . . A 49 THR N . 30309 1 591 . 1 1 50 50 ASP H H 1 8.359 0.001 . 1 . . . . A 50 ASP H . 30309 1 592 . 1 1 50 50 ASP HA H 1 4.461 0.005 . 1 . . . . A 50 ASP HA . 30309 1 593 . 1 1 50 50 ASP HB2 H 1 2.874 0.006 . 2 . . . . A 50 ASP HB2 . 30309 1 594 . 1 1 50 50 ASP HB3 H 1 2.740 0.006 . 2 . . . . A 50 ASP HB3 . 30309 1 595 . 1 1 50 50 ASP C C 13 175.937 0.000 . 1 . . . . A 50 ASP C . 30309 1 596 . 1 1 50 50 ASP CA C 13 55.079 0.025 . 1 . . . . A 50 ASP CA . 30309 1 597 . 1 1 50 50 ASP CB C 13 40.760 0.031 . 1 . . . . A 50 ASP CB . 30309 1 598 . 1 1 50 50 ASP N N 15 119.061 0.016 . 1 . . . . A 50 ASP N . 30309 1 599 . 1 1 51 51 GLY H H 1 8.390 0.001 . 1 . . . . A 51 GLY H . 30309 1 600 . 1 1 51 51 GLY HA2 H 1 3.983 0.001 . 2 . . . . A 51 GLY HA2 . 30309 1 601 . 1 1 51 51 GLY HA3 H 1 3.784 0.002 . 2 . . . . A 51 GLY HA3 . 30309 1 602 . 1 1 51 51 GLY C C 13 175.987 0.000 . 1 . . . . A 51 GLY C . 30309 1 603 . 1 1 51 51 GLY CA C 13 45.994 0.016 . 1 . . . . A 51 GLY CA . 30309 1 604 . 1 1 51 51 GLY N N 15 106.027 0.018 . 1 . . . . A 51 GLY N . 30309 1 605 . 1 1 52 52 ARG H H 1 8.007 0.001 . 1 . . . . A 52 ARG H . 30309 1 606 . 1 1 52 52 ARG HA H 1 4.056 0.004 . 1 . . . . A 52 ARG HA . 30309 1 607 . 1 1 52 52 ARG HB2 H 1 1.808 0.004 . 2 . . . . A 52 ARG HB2 . 30309 1 608 . 1 1 52 52 ARG HB3 H 1 1.808 0.004 . 2 . . . . A 52 ARG HB3 . 30309 1 609 . 1 1 52 52 ARG HG2 H 1 1.662 0.000 . 2 . . . . A 52 ARG HG2 . 30309 1 610 . 1 1 52 52 ARG HG3 H 1 1.662 0.000 . 2 . . . . A 52 ARG HG3 . 30309 1 611 . 1 1 52 52 ARG HD2 H 1 3.192 0.000 . 2 . . . . A 52 ARG HD2 . 30309 1 612 . 1 1 52 52 ARG HD3 H 1 3.192 0.000 . 2 . . . . A 52 ARG HD3 . 30309 1 613 . 1 1 52 52 ARG C C 13 176.222 0.000 . 1 . . . . A 52 ARG C . 30309 1 614 . 1 1 52 52 ARG CA C 13 58.307 0.043 . 1 . . . . A 52 ARG CA . 30309 1 615 . 1 1 52 52 ARG CB C 13 31.331 0.000 . 1 . . . . A 52 ARG CB . 30309 1 616 . 1 1 52 52 ARG N N 15 118.617 0.015 . 1 . . . . A 52 ARG N . 30309 1 617 . 1 1 53 53 VAL H H 1 7.254 0.001 . 1 . . . . A 53 VAL H . 30309 1 618 . 1 1 53 53 VAL HA H 1 4.264 0.005 . 1 . . . . A 53 VAL HA . 30309 1 619 . 1 1 53 53 VAL HB H 1 1.873 0.004 . 1 . . . . A 53 VAL HB . 30309 1 620 . 1 1 53 53 VAL HG11 H 1 0.857 0.003 . 1 . . . . A 53 VAL HG11 . 30309 1 621 . 1 1 53 53 VAL HG12 H 1 0.857 0.003 . 1 . . . . A 53 VAL HG12 . 30309 1 622 . 1 1 53 53 VAL HG13 H 1 0.857 0.003 . 1 . . . . A 53 VAL HG13 . 30309 1 623 . 1 1 53 53 VAL HG21 H 1 0.879 0.005 . 1 . . . . A 53 VAL HG21 . 30309 1 624 . 1 1 53 53 VAL HG22 H 1 0.879 0.005 . 1 . . . . A 53 VAL HG22 . 30309 1 625 . 1 1 53 53 VAL HG23 H 1 0.879 0.005 . 1 . . . . A 53 VAL HG23 . 30309 1 626 . 1 1 53 53 VAL C C 13 173.848 0.000 . 1 . . . . A 53 VAL C . 30309 1 627 . 1 1 53 53 VAL CA C 13 60.058 0.056 . 1 . . . . A 53 VAL CA . 30309 1 628 . 1 1 53 53 VAL CB C 13 34.671 0.000 . 1 . . . . A 53 VAL CB . 30309 1 629 . 1 1 53 53 VAL CG1 C 13 20.808 0.024 . 1 . . . . A 53 VAL CG1 . 30309 1 630 . 1 1 53 53 VAL CG2 C 13 20.836 0.056 . 1 . . . . A 53 VAL CG2 . 30309 1 631 . 1 1 53 53 VAL N N 15 114.250 0.018 . 1 . . . . A 53 VAL N . 30309 1 632 . 1 1 54 54 GLU H H 1 8.685 0.002 . 1 . . . . A 54 GLU H . 30309 1 633 . 1 1 54 54 GLU HA H 1 4.132 0.001 . 1 . . . . A 54 GLU HA . 30309 1 634 . 1 1 54 54 GLU HB2 H 1 1.921 0.006 . 2 . . . . A 54 GLU HB2 . 30309 1 635 . 1 1 54 54 GLU HB3 H 1 1.921 0.006 . 2 . . . . A 54 GLU HB3 . 30309 1 636 . 1 1 54 54 GLU HG2 H 1 2.194 0.004 . 2 . . . . A 54 GLU HG2 . 30309 1 637 . 1 1 54 54 GLU HG3 H 1 2.194 0.004 . 2 . . . . A 54 GLU HG3 . 30309 1 638 . 1 1 54 54 GLU C C 13 174.938 0.000 . 1 . . . . A 54 GLU C . 30309 1 639 . 1 1 54 54 GLU CA C 13 56.692 0.000 . 1 . . . . A 54 GLU CA . 30309 1 640 . 1 1 54 54 GLU CB C 13 30.280 0.016 . 1 . . . . A 54 GLU CB . 30309 1 641 . 1 1 54 54 GLU N N 15 126.153 0.021 . 1 . . . . A 54 GLU N . 30309 1 642 . 1 1 55 55 CYS H H 1 9.079 0.002 . 1 . . . . A 55 CYS H . 30309 1 643 . 1 1 55 55 CYS HA H 1 4.407 0.002 . 1 . . . . A 55 CYS HA . 30309 1 644 . 1 1 55 55 CYS HB2 H 1 3.148 0.004 . 2 . . . . A 55 CYS HB2 . 30309 1 645 . 1 1 55 55 CYS HB3 H 1 2.684 0.005 . 2 . . . . A 55 CYS HB3 . 30309 1 646 . 1 1 55 55 CYS C C 13 172.893 0.000 . 1 . . . . A 55 CYS C . 30309 1 647 . 1 1 55 55 CYS CA C 13 56.849 0.052 . 1 . . . . A 55 CYS CA . 30309 1 648 . 1 1 55 55 CYS CB C 13 39.096 0.054 . 1 . . . . A 55 CYS CB . 30309 1 649 . 1 1 55 55 CYS N N 15 126.500 0.018 . 1 . . . . A 55 CYS N . 30309 1 650 . 1 1 56 56 ARG H H 1 9.116 0.003 . 1 . . . . A 56 ARG H . 30309 1 651 . 1 1 56 56 ARG HA H 1 4.735 0.004 . 1 . . . . A 56 ARG HA . 30309 1 652 . 1 1 56 56 ARG HB2 H 1 1.847 0.004 . 2 . . . . A 56 ARG HB2 . 30309 1 653 . 1 1 56 56 ARG HB3 H 1 1.676 0.090 . 2 . . . . A 56 ARG HB3 . 30309 1 654 . 1 1 56 56 ARG HG2 H 1 1.601 0.011 . 2 . . . . A 56 ARG HG2 . 30309 1 655 . 1 1 56 56 ARG HG3 H 1 1.547 0.000 . 2 . . . . A 56 ARG HG3 . 30309 1 656 . 1 1 56 56 ARG HD2 H 1 3.159 0.007 . 2 . . . . A 56 ARG HD2 . 30309 1 657 . 1 1 56 56 ARG HD3 H 1 3.159 0.007 . 2 . . . . A 56 ARG HD3 . 30309 1 658 . 1 1 56 56 ARG HE H 1 7.250 0.002 . 1 . . . . A 56 ARG HE . 30309 1 659 . 1 1 56 56 ARG C C 13 174.587 0.000 . 1 . . . . A 56 ARG C . 30309 1 660 . 1 1 56 56 ARG CA C 13 55.040 0.057 . 1 . . . . A 56 ARG CA . 30309 1 661 . 1 1 56 56 ARG CB C 13 33.263 0.063 . 1 . . . . A 56 ARG CB . 30309 1 662 . 1 1 56 56 ARG N N 15 130.115 0.016 . 1 . . . . A 56 ARG N . 30309 1 663 . 1 1 56 56 ARG NE N 15 84.51 0.000 . 1 . . . . A 56 ARG NE . 30309 1 664 . 1 1 57 57 GLU H H 1 8.581 0.004 . 1 . . . . A 57 GLU H . 30309 1 665 . 1 1 57 57 GLU HA H 1 5.137 0.004 . 1 . . . . A 57 GLU HA . 30309 1 666 . 1 1 57 57 GLU HB2 H 1 1.779 0.006 . 2 . . . . A 57 GLU HB2 . 30309 1 667 . 1 1 57 57 GLU HB3 H 1 1.779 0.006 . 2 . . . . A 57 GLU HB3 . 30309 1 668 . 1 1 57 57 GLU HG2 H 1 2.262 0.005 . 2 . . . . A 57 GLU HG2 . 30309 1 669 . 1 1 57 57 GLU HG3 H 1 2.063 0.006 . 2 . . . . A 57 GLU HG3 . 30309 1 670 . 1 1 57 57 GLU C C 13 177.946 0.000 . 1 . . . . A 57 GLU C . 30309 1 671 . 1 1 57 57 GLU CA C 13 53.912 0.055 . 1 . . . . A 57 GLU CA . 30309 1 672 . 1 1 57 57 GLU CB C 13 33.404 0.030 . 1 . . . . A 57 GLU CB . 30309 1 673 . 1 1 57 57 GLU N N 15 119.961 0.016 . 1 . . . . A 57 GLU N . 30309 1 674 . 1 1 58 58 LEU H H 1 8.244 0.003 . 1 . . . . A 58 LEU H . 30309 1 675 . 1 1 58 58 LEU HA H 1 4.230 0.003 . 1 . . . . A 58 LEU HA . 30309 1 676 . 1 1 58 58 LEU HB2 H 1 1.467 0.003 . 2 . . . . A 58 LEU HB2 . 30309 1 677 . 1 1 58 58 LEU HB3 H 1 1.367 0.010 . 2 . . . . A 58 LEU HB3 . 30309 1 678 . 1 1 58 58 LEU HG H 1 1.235 0.005 . 1 . . . . A 58 LEU HG . 30309 1 679 . 1 1 58 58 LEU HD11 H 1 0.702 0.005 . 1 . . . . A 58 LEU HD11 . 30309 1 680 . 1 1 58 58 LEU HD12 H 1 0.702 0.005 . 1 . . . . A 58 LEU HD12 . 30309 1 681 . 1 1 58 58 LEU HD13 H 1 0.702 0.005 . 1 . . . . A 58 LEU HD13 . 30309 1 682 . 1 1 58 58 LEU HD21 H 1 0.730 0.007 . 1 . . . . A 58 LEU HD21 . 30309 1 683 . 1 1 58 58 LEU HD22 H 1 0.730 0.007 . 1 . . . . A 58 LEU HD22 . 30309 1 684 . 1 1 58 58 LEU HD23 H 1 0.730 0.007 . 1 . . . . A 58 LEU HD23 . 30309 1 685 . 1 1 58 58 LEU C C 13 176.188 0.000 . 1 . . . . A 58 LEU C . 30309 1 686 . 1 1 58 58 LEU CA C 13 54.330 0.036 . 1 . . . . A 58 LEU CA . 30309 1 687 . 1 1 58 58 LEU CB C 13 43.208 0.013 . 1 . . . . A 58 LEU CB . 30309 1 688 . 1 1 58 58 LEU CD1 C 13 25.022 0.030 . 1 . . . . A 58 LEU CD1 . 30309 1 689 . 1 1 58 58 LEU CD2 C 13 23.658 0.027 . 1 . . . . A 58 LEU CD2 . 30309 1 690 . 1 1 58 58 LEU N N 15 122.587 0.041 . 1 . . . . A 58 LEU N . 30309 1 691 . 1 1 59 59 ARG H H 1 8.369 0.001 . 1 . . . . A 59 ARG H . 30309 1 692 . 1 1 59 59 ARG HA H 1 4.515 0.004 . 1 . . . . A 59 ARG HA . 30309 1 693 . 1 1 59 59 ARG HB2 H 1 1.858 0.002 . 2 . . . . A 59 ARG HB2 . 30309 1 694 . 1 1 59 59 ARG HB3 H 1 1.713 0.005 . 2 . . . . A 59 ARG HB3 . 30309 1 695 . 1 1 59 59 ARG HG2 H 1 2.353 0.000 . 2 . . . . A 59 ARG HG2 . 30309 1 696 . 1 1 59 59 ARG HG3 H 1 2.353 0.000 . 2 . . . . A 59 ARG HG3 . 30309 1 697 . 1 1 59 59 ARG HD2 H 1 3.183 0.004 . 2 . . . . A 59 ARG HD2 . 30309 1 698 . 1 1 59 59 ARG HD3 H 1 3.183 0.004 . 2 . . . . A 59 ARG HD3 . 30309 1 699 . 1 1 59 59 ARG HE H 1 7.401 0.000 . 1 . . . . A 59 ARG HE . 30309 1 700 . 1 1 59 59 ARG CA C 13 54.131 0.032 . 1 . . . . A 59 ARG CA . 30309 1 701 . 1 1 59 59 ARG CB C 13 29.999 0.047 . 1 . . . . A 59 ARG CB . 30309 1 702 . 1 1 59 59 ARG N N 15 122.417 0.026 . 1 . . . . A 59 ARG N . 30309 1 703 . 1 1 59 59 ARG NE N 15 84.71 0.000 . 1 . . . . A 59 ARG NE . 30309 1 704 . 1 1 60 60 PRO HA H 1 4.323 0.003 . 1 . . . . A 60 PRO HA . 30309 1 705 . 1 1 60 60 PRO HB2 H 1 2.221 0.003 . 2 . . . . A 60 PRO HB2 . 30309 1 706 . 1 1 60 60 PRO HB3 H 1 1.880 0.006 . 2 . . . . A 60 PRO HB3 . 30309 1 707 . 1 1 60 60 PRO HG2 H 1 1.998 0.004 . 2 . . . . A 60 PRO HG2 . 30309 1 708 . 1 1 60 60 PRO HG3 H 1 1.964 0.007 . 2 . . . . A 60 PRO HG3 . 30309 1 709 . 1 1 60 60 PRO HD2 H 1 3.741 0.008 . 2 . . . . A 60 PRO HD2 . 30309 1 710 . 1 1 60 60 PRO HD3 H 1 3.636 0.003 . 2 . . . . A 60 PRO HD3 . 30309 1 711 . 1 1 60 60 PRO C C 13 176.435 0.000 . 1 . . . . A 60 PRO C . 30309 1 712 . 1 1 60 60 PRO CA C 13 63.437 0.046 . 1 . . . . A 60 PRO CA . 30309 1 713 . 1 1 60 60 PRO CB C 13 32.000 0.057 . 1 . . . . A 60 PRO CB . 30309 1 714 . 1 1 60 60 PRO CD C 13 50.534 0.047 . 1 . . . . A 60 PRO CD . 30309 1 715 . 1 1 61 61 ASP H H 1 8.439 0.001 . 1 . . . . A 61 ASP H . 30309 1 716 . 1 1 61 61 ASP HA H 1 4.520 0.001 . 1 . . . . A 61 ASP HA . 30309 1 717 . 1 1 61 61 ASP HB2 H 1 2.594 0.001 . 2 . . . . A 61 ASP HB2 . 30309 1 718 . 1 1 61 61 ASP HB3 H 1 2.594 0.001 . 2 . . . . A 61 ASP HB3 . 30309 1 719 . 1 1 61 61 ASP C C 13 176.330 0.000 . 1 . . . . A 61 ASP C . 30309 1 720 . 1 1 61 61 ASP CA C 13 54.313 0.016 . 1 . . . . A 61 ASP CA . 30309 1 721 . 1 1 61 61 ASP CB C 13 40.946 0.051 . 1 . . . . A 61 ASP CB . 30309 1 722 . 1 1 61 61 ASP N N 15 119.967 0.023 . 1 . . . . A 61 ASP N . 30309 1 723 . 1 1 62 62 VAL H H 1 7.854 0.002 . 1 . . . . A 62 VAL H . 30309 1 724 . 1 1 62 62 VAL HA H 1 4.004 0.004 . 1 . . . . A 62 VAL HA . 30309 1 725 . 1 1 62 62 VAL HB H 1 1.949 0.003 . 1 . . . . A 62 VAL HB . 30309 1 726 . 1 1 62 62 VAL HG11 H 1 0.738 0.005 . 1 . . . . A 62 VAL HG11 . 30309 1 727 . 1 1 62 62 VAL HG12 H 1 0.738 0.005 . 1 . . . . A 62 VAL HG12 . 30309 1 728 . 1 1 62 62 VAL HG13 H 1 0.738 0.005 . 1 . . . . A 62 VAL HG13 . 30309 1 729 . 1 1 62 62 VAL HG21 H 1 0.749 0.005 . 1 . . . . A 62 VAL HG21 . 30309 1 730 . 1 1 62 62 VAL HG22 H 1 0.749 0.005 . 1 . . . . A 62 VAL HG22 . 30309 1 731 . 1 1 62 62 VAL HG23 H 1 0.749 0.005 . 1 . . . . A 62 VAL HG23 . 30309 1 732 . 1 1 62 62 VAL C C 13 175.991 0.000 . 1 . . . . A 62 VAL C . 30309 1 733 . 1 1 62 62 VAL CA C 13 62.503 0.062 . 1 . . . . A 62 VAL CA . 30309 1 734 . 1 1 62 62 VAL CB C 13 32.559 0.046 . 1 . . . . A 62 VAL CB . 30309 1 735 . 1 1 62 62 VAL CG1 C 13 20.989 0.057 . 1 . . . . A 62 VAL CG1 . 30309 1 736 . 1 1 62 62 VAL CG2 C 13 20.259 0.000 . 1 . . . . A 62 VAL CG2 . 30309 1 737 . 1 1 62 62 VAL N N 15 119.188 0.025 . 1 . . . . A 62 VAL N . 30309 1 738 . 1 1 63 63 PHE H H 1 8.252 0.002 . 1 . . . . A 63 PHE H . 30309 1 739 . 1 1 63 63 PHE HA H 1 4.549 0.004 . 1 . . . . A 63 PHE HA . 30309 1 740 . 1 1 63 63 PHE HB2 H 1 3.151 0.006 . 2 . . . . A 63 PHE HB2 . 30309 1 741 . 1 1 63 63 PHE HB3 H 1 2.985 0.004 . 2 . . . . A 63 PHE HB3 . 30309 1 742 . 1 1 63 63 PHE HD1 H 1 7.225 0.009 . 3 . . . . A 63 PHE HD1 . 30309 1 743 . 1 1 63 63 PHE HD2 H 1 7.225 0.009 . 3 . . . . A 63 PHE HD2 . 30309 1 744 . 1 1 63 63 PHE C C 13 176.474 0.000 . 1 . . . . A 63 PHE C . 30309 1 745 . 1 1 63 63 PHE CA C 13 58.183 0.059 . 1 . . . . A 63 PHE CA . 30309 1 746 . 1 1 63 63 PHE CB C 13 39.381 0.038 . 1 . . . . A 63 PHE CB . 30309 1 747 . 1 1 63 63 PHE CD1 C 13 131.728 0.000 . 1 . . . . A 63 PHE CD1 . 30309 1 748 . 1 1 63 63 PHE CD2 C 13 131.728 0.000 . 1 . . . . A 63 PHE CD2 . 30309 1 749 . 1 1 63 63 PHE N N 15 122.824 0.056 . 1 . . . . A 63 PHE N . 30309 1 750 . 1 1 64 64 GLY H H 1 8.295 0.006 . 1 . . . . A 64 GLY H . 30309 1 751 . 1 1 64 64 GLY HA2 H 1 3.854 0.002 . 2 . . . . A 64 GLY HA2 . 30309 1 752 . 1 1 64 64 GLY HA3 H 1 3.854 0.002 . 2 . . . . A 64 GLY HA3 . 30309 1 753 . 1 1 64 64 GLY C C 13 173.937 0.000 . 1 . . . . A 64 GLY C . 30309 1 754 . 1 1 64 64 GLY CA C 13 45.462 0.034 . 1 . . . . A 64 GLY CA . 30309 1 755 . 1 1 64 64 GLY N N 15 110.670 0.030 . 1 . . . . A 64 GLY N . 30309 1 756 . 1 1 65 65 ALA H H 1 8.100 0.001 . 1 . . . . A 65 ALA H . 30309 1 757 . 1 1 65 65 ALA HA H 1 4.248 0.003 . 1 . . . . A 65 ALA HA . 30309 1 758 . 1 1 65 65 ALA HB1 H 1 1.352 0.003 . 1 . . . . A 65 ALA HB1 . 30309 1 759 . 1 1 65 65 ALA HB2 H 1 1.352 0.003 . 1 . . . . A 65 ALA HB2 . 30309 1 760 . 1 1 65 65 ALA HB3 H 1 1.352 0.003 . 1 . . . . A 65 ALA HB3 . 30309 1 761 . 1 1 65 65 ALA C C 13 177.880 0.000 . 1 . . . . A 65 ALA C . 30309 1 762 . 1 1 65 65 ALA CA C 13 52.675 0.056 . 1 . . . . A 65 ALA CA . 30309 1 763 . 1 1 65 65 ALA CB C 13 19.295 0.085 . 1 . . . . A 65 ALA CB . 30309 1 764 . 1 1 65 65 ALA N N 15 123.608 0.023 . 1 . . . . A 65 ALA N . 30309 1 765 . 1 1 66 66 LEU H H 1 8.199 0.001 . 1 . . . . A 66 LEU H . 30309 1 766 . 1 1 66 66 LEU HA H 1 4.251 0.002 . 1 . . . . A 66 LEU HA . 30309 1 767 . 1 1 66 66 LEU HB2 H 1 1.574 0.005 . 2 . . . . A 66 LEU HB2 . 30309 1 768 . 1 1 66 66 LEU HB3 H 1 1.483 0.004 . 2 . . . . A 66 LEU HB3 . 30309 1 769 . 1 1 66 66 LEU HD11 H 1 0.871 0.002 . 1 . . . . A 66 LEU HD11 . 30309 1 770 . 1 1 66 66 LEU HD12 H 1 0.871 0.002 . 1 . . . . A 66 LEU HD12 . 30309 1 771 . 1 1 66 66 LEU HD13 H 1 0.871 0.002 . 1 . . . . A 66 LEU HD13 . 30309 1 772 . 1 1 66 66 LEU HD21 H 1 0.808 0.003 . 1 . . . . A 66 LEU HD21 . 30309 1 773 . 1 1 66 66 LEU HD22 H 1 0.808 0.003 . 1 . . . . A 66 LEU HD22 . 30309 1 774 . 1 1 66 66 LEU HD23 H 1 0.808 0.003 . 1 . . . . A 66 LEU HD23 . 30309 1 775 . 1 1 66 66 LEU C C 13 177.373 0.000 . 1 . . . . A 66 LEU C . 30309 1 776 . 1 1 66 66 LEU CA C 13 55.119 0.086 . 1 . . . . A 66 LEU CA . 30309 1 777 . 1 1 66 66 LEU CB C 13 42.255 0.014 . 1 . . . . A 66 LEU CB . 30309 1 778 . 1 1 66 66 LEU CD1 C 13 24.998 0.000 . 1 . . . . A 66 LEU CD1 . 30309 1 779 . 1 1 66 66 LEU CD2 C 13 23.405 0.011 . 1 . . . . A 66 LEU CD2 . 30309 1 780 . 1 1 66 66 LEU N N 15 120.595 0.021 . 1 . . . . A 66 LEU N . 30309 1 781 . 1 1 67 67 GLU H H 1 8.210 0.001 . 1 . . . . A 67 GLU H . 30309 1 782 . 1 1 67 67 GLU HA H 1 4.146 0.003 . 1 . . . . A 67 GLU HA . 30309 1 783 . 1 1 67 67 GLU HB2 H 1 2.137 0.013 . 2 . . . . A 67 GLU HB2 . 30309 1 784 . 1 1 67 67 GLU HB3 H 1 2.113 0.014 . 2 . . . . A 67 GLU HB3 . 30309 1 785 . 1 1 67 67 GLU HG2 H 1 1.841 0.004 . 2 . . . . A 67 GLU HG2 . 30309 1 786 . 1 1 67 67 GLU HG3 H 1 1.841 0.004 . 2 . . . . A 67 GLU HG3 . 30309 1 787 . 1 1 67 67 GLU C C 13 173.892 0.000 . 1 . . . . A 67 GLU C . 30309 1 788 . 1 1 67 67 GLU CA C 13 56.538 0.033 . 1 . . . . A 67 GLU CA . 30309 1 789 . 1 1 67 67 GLU CB C 13 30.350 0.000 . 1 . . . . A 67 GLU CB . 30309 1 790 . 1 1 67 67 GLU N N 15 120.913 0.044 . 1 . . . . A 67 GLU N . 30309 1 791 . 1 1 68 68 HIS H H 1 8.210 0.002 . 1 . . . . A 68 HIS H . 30309 1 792 . 1 1 68 68 HIS HA H 1 4.403 0.000 . 1 . . . . A 68 HIS HA . 30309 1 793 . 1 1 68 68 HIS HB2 H 1 3.188 0.000 . 2 . . . . A 68 HIS HB2 . 30309 1 794 . 1 1 68 68 HIS HB3 H 1 3.048 0.000 . 2 . . . . A 68 HIS HB3 . 30309 1 795 . 1 1 68 68 HIS C C 13 176.084 0.000 . 1 . . . . A 68 HIS C . 30309 1 796 . 1 1 68 68 HIS CA C 13 57.180 0.000 . 1 . . . . A 68 HIS CA . 30309 1 797 . 1 1 68 68 HIS CB C 13 30.167 0.000 . 1 . . . . A 68 HIS CB . 30309 1 798 . 1 1 68 68 HIS N N 15 125.400 0.017 . 1 . . . . A 68 HIS N . 30309 1 799 . 1 1 69 69 HIS H H 1 8.312 0.002 . 1 . . . . A 69 HIS H . 30309 1 800 . 1 1 69 69 HIS HA H 1 4.541 0.000 . 1 . . . . A 69 HIS HA . 30309 1 801 . 1 1 69 69 HIS HB2 H 1 2.995 0.012 . 2 . . . . A 69 HIS HB2 . 30309 1 802 . 1 1 69 69 HIS HB3 H 1 2.995 0.012 . 2 . . . . A 69 HIS HB3 . 30309 1 803 . 1 1 69 69 HIS CA C 13 55.913 0.000 . 1 . . . . A 69 HIS CA . 30309 1 804 . 1 1 69 69 HIS CB C 13 30.221 0.000 . 1 . . . . A 69 HIS CB . 30309 1 805 . 1 1 69 69 HIS N N 15 119.724 0.018 . 1 . . . . A 69 HIS N . 30309 1 stop_ save_