################################### # 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 36469 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $Chemical_shift_reference1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _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 '2D 1H-15N HSQC' 2 $sample_2 isotropic 36469 1 2 '2D NOESY' 2 $sample_2 isotropic 36469 1 3 '3D CBCA(CO)NH' 2 $sample_2 isotropic 36469 1 4 '3D 1H-15N NOESY' 2 $sample_2 isotropic 36469 1 5 '3D 1H-13C NOESY' 2 $sample_2 isotropic 36469 1 6 '3D HNCA' 2 $sample_2 isotropic 36469 1 7 '3D 1H-15N TOCSY' 2 $sample_2 isotropic 36469 1 8 '3D HCCH-TOCSY' 2 $sample_2 isotropic 36469 1 9 '3D HNCACB' 2 $sample_2 isotropic 36469 1 10 '3D C(CO)NH' 2 $sample_2 isotropic 36469 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 ALA H1 H 1 7.401 0.001 . . . . . . A 1 ALA H1 . 36469 1 2 . 1 . 1 1 1 ALA N N 15 116.952 0.21 . 1 . . . . A 1 ALA N . 36469 1 3 . 1 . 1 2 2 LYS H H 1 8.365 0.011 . 1 . . . . A 2 LYS H . 36469 1 4 . 1 . 1 2 2 LYS HA H 1 4.593 0 . 1 . . . . A 2 LYS HA . 36469 1 5 . 1 . 1 2 2 LYS HB2 H 1 1.825 0 . . . . . . A 2 LYS HB2 . 36469 1 6 . 1 . 1 2 2 LYS HB3 H 1 1.825 0 . . . . . . A 2 LYS HB3 . 36469 1 7 . 1 . 1 2 2 LYS HG2 H 1 1.505 0 . . . . . . A 2 LYS HG2 . 36469 1 8 . 1 . 1 2 2 LYS HG3 H 1 1.505 0 . . . . . . A 2 LYS HG3 . 36469 1 9 . 1 . 1 2 2 LYS HD2 H 1 1.708 0 . . . . . . A 2 LYS HD2 . 36469 1 10 . 1 . 1 2 2 LYS HD3 H 1 1.708 0 . . . . . . A 2 LYS HD3 . 36469 1 11 . 1 . 1 2 2 LYS HE2 H 1 2.985 0.03 . . . . . . A 2 LYS HE2 . 36469 1 12 . 1 . 1 2 2 LYS HE3 H 1 2.985 0.03 . . . . . . A 2 LYS HE3 . 36469 1 13 . 1 . 1 2 2 LYS CA C 13 49.834 0.149 . 1 . . . . A 2 LYS CA . 36469 1 14 . 1 . 1 2 2 LYS N N 15 124.27 0.093 . 1 . . . . A 2 LYS N . 36469 1 15 . 1 . 1 3 3 LYS H H 1 8.348 0.005 . 1 . . . . A 3 LYS H . 36469 1 16 . 1 . 1 3 3 LYS HA H 1 4.313 0 . 1 . . . . A 3 LYS HA . 36469 1 17 . 1 . 1 3 3 LYS HB2 H 1 1.813 0 . . . . . . A 3 LYS HB2 . 36469 1 18 . 1 . 1 3 3 LYS HB3 H 1 1.813 0 . . . . . . A 3 LYS HB3 . 36469 1 19 . 1 . 1 3 3 LYS HG2 H 1 1.458 0 . . . . . . A 3 LYS HG2 . 36469 1 20 . 1 . 1 3 3 LYS HG3 H 1 1.458 0 . . . . . . A 3 LYS HG3 . 36469 1 21 . 1 . 1 3 3 LYS HD2 H 1 1.74 0 . . . . . . A 3 LYS HD2 . 36469 1 22 . 1 . 1 3 3 LYS HD3 H 1 1.74 0 . . . . . . A 3 LYS HD3 . 36469 1 23 . 1 . 1 3 3 LYS HE2 H 1 3.022 0 . . . . . . A 3 LYS HE2 . 36469 1 24 . 1 . 1 3 3 LYS HE3 H 1 3.022 0 . . . . . . A 3 LYS HE3 . 36469 1 25 . 1 . 1 3 3 LYS CA C 13 53.338 0 . 1 . . . . A 3 LYS CA . 36469 1 26 . 1 . 1 3 3 LYS CB C 13 30.44 0 . 1 . . . . A 3 LYS CB . 36469 1 27 . 1 . 1 3 3 LYS N N 15 121.425 0.047 . 1 . . . . A 3 LYS N . 36469 1 28 . 1 . 1 4 4 PRO HA H 1 4.407 0.001 . 1 . . . . A 4 PRO HA . 36469 1 29 . 1 . 1 4 4 PRO HB2 H 1 2.255 0 . . . . . . A 4 PRO HB2 . 36469 1 30 . 1 . 1 4 4 PRO HB3 H 1 2.255 0 . . . . . . A 4 PRO HB3 . 36469 1 31 . 1 . 1 4 4 PRO HG2 H 1 1.991 0 . . . . . . A 4 PRO HG2 . 36469 1 32 . 1 . 1 4 4 PRO HG3 H 1 1.828 0 . . . . . . A 4 PRO HG3 . 36469 1 33 . 1 . 1 4 4 PRO HD2 H 1 3.813 0 . . . . . . A 4 PRO HD2 . 36469 1 34 . 1 . 1 4 4 PRO HD3 H 1 3.636 0 . . . . . . A 4 PRO HD3 . 36469 1 35 . 1 . 1 4 4 PRO CA C 13 60.105 0.057 . 1 . . . . A 4 PRO CA . 36469 1 36 . 1 . 1 4 4 PRO CB C 13 29.459 0 . 1 . . . . A 4 PRO CB . 36469 1 37 . 1 . 1 5 5 PHE H H 1 8.309 0.002 . 1 . . . . A 5 PHE H . 36469 1 38 . 1 . 1 5 5 PHE HA H 1 4.606 0 . 1 . . . . A 5 PHE HA . 36469 1 39 . 1 . 1 5 5 PHE HB2 H 1 3.092 0 . . . . . . A 5 PHE HB2 . 36469 1 40 . 1 . 1 5 5 PHE HB3 H 1 3.092 0 . . . . . . A 5 PHE HB3 . 36469 1 41 . 1 . 1 5 5 PHE CA C 13 55.143 0.008 . 1 . . . . A 5 PHE CA . 36469 1 42 . 1 . 1 5 5 PHE CB C 13 36.853 0 . 1 . . . . A 5 PHE CB . 36469 1 43 . 1 . 1 5 5 PHE N N 15 121.327 0.118 . 1 . . . . A 5 PHE N . 36469 1 44 . 1 . 1 6 6 VAL H H 1 7.95 0.003 . 1 . . . . A 6 VAL H . 36469 1 45 . 1 . 1 6 6 VAL HA H 1 3.99 0 . 1 . . . . A 6 VAL HA . 36469 1 46 . 1 . 1 6 6 VAL HB H 1 1.922 0 . 1 . . . . A 6 VAL HB . 36469 1 47 . 1 . 1 6 6 VAL HG11 H 1 0.878 0 . . . . . . A 6 VAL HG11 . 36469 1 48 . 1 . 1 6 6 VAL HG12 H 1 0.878 0 . . . . . . A 6 VAL HG12 . 36469 1 49 . 1 . 1 6 6 VAL HG13 H 1 0.878 0 . . . . . . A 6 VAL HG13 . 36469 1 50 . 1 . 1 6 6 VAL HG21 H 1 0.878 0 . . . . . . A 6 VAL HG21 . 36469 1 51 . 1 . 1 6 6 VAL HG22 H 1 0.878 0 . . . . . . A 6 VAL HG22 . 36469 1 52 . 1 . 1 6 6 VAL HG23 H 1 0.878 0 . . . . . . A 6 VAL HG23 . 36469 1 53 . 1 . 1 6 6 VAL CA C 13 59.246 0.002 . 1 . . . . A 6 VAL CA . 36469 1 54 . 1 . 1 6 6 VAL CB C 13 30.401 0.026 . 1 . . . . A 6 VAL CB . 36469 1 55 . 1 . 1 6 6 VAL N N 15 123.904 0.115 . 1 . . . . A 6 VAL N . 36469 1 56 . 1 . 1 7 7 GLN H H 1 8.354 0.002 . 1 . . . . A 7 GLN H . 36469 1 57 . 1 . 1 7 7 GLN HA H 1 4.257 0 . 1 . . . . A 7 GLN HA . 36469 1 58 . 1 . 1 7 7 GLN HB2 H 1 2.061 0 . . . . . . A 7 GLN HB2 . 36469 1 59 . 1 . 1 7 7 GLN HB3 H 1 2.061 0 . . . . . . A 7 GLN HB3 . 36469 1 60 . 1 . 1 7 7 GLN HG2 H 1 2.346 0 . . . . . . A 7 GLN HG2 . 36469 1 61 . 1 . 1 7 7 GLN HG3 H 1 2.346 0 . . . . . . A 7 GLN HG3 . 36469 1 62 . 1 . 1 7 7 GLN CA C 13 53.182 0.13 . 1 . . . . A 7 GLN CA . 36469 1 63 . 1 . 1 7 7 GLN CB C 13 26.907 0.062 . 1 . . . . A 7 GLN CB . 36469 1 64 . 1 . 1 7 7 GLN N N 15 124.958 0.126 . 1 . . . . A 7 GLN N . 36469 1 65 . 1 . 1 8 8 ARG H H 1 8.424 0.005 . 1 . . . . A 8 ARG H . 36469 1 66 . 1 . 1 8 8 ARG HA H 1 4.353 0 . 1 . . . . A 8 ARG HA . 36469 1 67 . 1 . 1 8 8 ARG HB2 H 1 1.805 0 . . . . . . A 8 ARG HB2 . 36469 1 68 . 1 . 1 8 8 ARG HB3 H 1 1.805 0 . . . . . . A 8 ARG HB3 . 36469 1 69 . 1 . 1 8 8 ARG HG2 H 1 1.631 0 . . . . . . A 8 ARG HG2 . 36469 1 70 . 1 . 1 8 8 ARG HG3 H 1 1.631 0 . . . . . . A 8 ARG HG3 . 36469 1 71 . 1 . 1 8 8 ARG HD2 H 1 3.204 0 . . . . . . A 8 ARG HD2 . 36469 1 72 . 1 . 1 8 8 ARG HD3 H 1 3.204 0 . . . . . . A 8 ARG HD3 . 36469 1 73 . 1 . 1 8 8 ARG CA C 13 53.519 0.078 . 1 . . . . A 8 ARG CA . 36469 1 74 . 1 . 1 8 8 ARG CB C 13 28.16 0 . 1 . . . . A 8 ARG CB . 36469 1 75 . 1 . 1 8 8 ARG N N 15 123.765 0.035 . 1 . . . . A 8 ARG N . 36469 1 76 . 1 . 1 9 9 VAL H H 1 8.205 0.006 . 1 . . . . A 9 VAL H . 36469 1 77 . 1 . 1 9 9 VAL HA H 1 4.094 0 . 1 . . . . A 9 VAL HA . 36469 1 78 . 1 . 1 9 9 VAL HB H 1 2.066 0 . 1 . . . . A 9 VAL HB . 36469 1 79 . 1 . 1 9 9 VAL HG11 H 1 0.936 0 . . . . . . A 9 VAL HG11 . 36469 1 80 . 1 . 1 9 9 VAL HG12 H 1 0.936 0 . . . . . . A 9 VAL HG12 . 36469 1 81 . 1 . 1 9 9 VAL HG13 H 1 0.936 0 . . . . . . A 9 VAL HG13 . 36469 1 82 . 1 . 1 9 9 VAL HG21 H 1 0.936 0 . . . . . . A 9 VAL HG21 . 36469 1 83 . 1 . 1 9 9 VAL HG22 H 1 0.936 0 . . . . . . A 9 VAL HG22 . 36469 1 84 . 1 . 1 9 9 VAL HG23 H 1 0.936 0 . . . . . . A 9 VAL HG23 . 36469 1 85 . 1 . 1 9 9 VAL CA C 13 59.64 0.018 . 1 . . . . A 9 VAL CA . 36469 1 86 . 1 . 1 9 9 VAL CB C 13 30.091 0.014 . 1 . . . . A 9 VAL CB . 36469 1 87 . 1 . 1 9 9 VAL N N 15 121.843 0.067 . 1 . . . . A 9 VAL N . 36469 1 88 . 1 . 1 10 10 LYS H H 1 8.444 0.002 . 1 . . . . A 10 LYS H . 36469 1 89 . 1 . 1 10 10 LYS HA H 1 4.289 0.009 . 1 . . . . A 10 LYS HA . 36469 1 90 . 1 . 1 10 10 LYS HB2 H 1 1.819 0 . . . . . . A 10 LYS HB2 . 36469 1 91 . 1 . 1 10 10 LYS HB3 H 1 1.819 0 . . . . . . A 10 LYS HB3 . 36469 1 92 . 1 . 1 10 10 LYS HG2 H 1 1.401 0 . . . . . . A 10 LYS HG2 . 36469 1 93 . 1 . 1 10 10 LYS HG3 H 1 1.401 0 . . . . . . A 10 LYS HG3 . 36469 1 94 . 1 . 1 10 10 LYS HD2 H 1 1.727 0 . . . . . . A 10 LYS HD2 . 36469 1 95 . 1 . 1 10 10 LYS HD3 H 1 1.727 0 . . . . . . A 10 LYS HD3 . 36469 1 96 . 1 . 1 10 10 LYS HE2 H 1 2.989 0.008 . . . . . . A 10 LYS HE2 . 36469 1 97 . 1 . 1 10 10 LYS HE3 H 1 2.989 0.008 . . . . . . A 10 LYS HE3 . 36469 1 98 . 1 . 1 10 10 LYS CA C 13 53.84 0.239 . 1 . . . . A 10 LYS CA . 36469 1 99 . 1 . 1 10 10 LYS CB C 13 30.243 0.015 . 1 . . . . A 10 LYS CB . 36469 1 100 . 1 . 1 10 10 LYS N N 15 125.641 0.113 . 1 . . . . A 10 LYS N . 36469 1 101 . 1 . 1 11 11 ASN H H 1 8.456 0.005 . 1 . . . . A 11 ASN H . 36469 1 102 . 1 . 1 11 11 ASN HA H 1 4.271 0 . 1 . . . . A 11 ASN HA . 36469 1 103 . 1 . 1 11 11 ASN HB2 H 1 2.815 0 . . . . . . A 11 ASN HB2 . 36469 1 104 . 1 . 1 11 11 ASN HB3 H 1 2.815 0 . . . . . . A 11 ASN HB3 . 36469 1 105 . 1 . 1 11 11 ASN CA C 13 50.493 0.091 . 1 . . . . A 11 ASN CA . 36469 1 106 . 1 . 1 11 11 ASN CB C 13 36.195 0.028 . 1 . . . . A 11 ASN CB . 36469 1 107 . 1 . 1 11 11 ASN N N 15 120.341 0.139 . 1 . . . . A 11 ASN N . 36469 1 108 . 1 . 1 12 12 ALA H H 1 8.345 0.014 . 1 . . . . A 12 ALA H . 36469 1 109 . 1 . 1 12 12 ALA HA H 1 4.283 0.006 . 1 . . . . A 12 ALA HA . 36469 1 110 . 1 . 1 12 12 ALA HB1 H 1 1.395 0 . 1 . . . . A 12 ALA HB1 . 36469 1 111 . 1 . 1 12 12 ALA HB2 H 1 1.395 0 . 1 . . . . A 12 ALA HB2 . 36469 1 112 . 1 . 1 12 12 ALA HB3 H 1 1.395 0 . 1 . . . . A 12 ALA HB3 . 36469 1 113 . 1 . 1 12 12 ALA CA C 13 50.231 0.058 . 1 . . . . A 12 ALA CA . 36469 1 114 . 1 . 1 12 12 ALA CB C 13 16.386 0.077 . 1 . . . . A 12 ALA CB . 36469 1 115 . 1 . 1 12 12 ALA N N 15 124.679 0.098 . 1 . . . . A 12 ALA N . 36469 1 116 . 1 . 1 13 13 ALA H H 1 8.274 0.002 . 1 . . . . A 13 ALA H . 36469 1 117 . 1 . 1 13 13 ALA HA H 1 4.336 0 . 1 . . . . A 13 ALA HA . 36469 1 118 . 1 . 1 13 13 ALA HB1 H 1 1.434 0 . 1 . . . . A 13 ALA HB1 . 36469 1 119 . 1 . 1 13 13 ALA HB2 H 1 1.434 0 . 1 . . . . A 13 ALA HB2 . 36469 1 120 . 1 . 1 13 13 ALA HB3 H 1 1.434 0 . 1 . . . . A 13 ALA HB3 . 36469 1 121 . 1 . 1 13 13 ALA CA C 13 50.145 0.027 . 1 . . . . A 13 ALA CA . 36469 1 122 . 1 . 1 13 13 ALA CB C 13 16.342 0.007 . 1 . . . . A 13 ALA CB . 36469 1 123 . 1 . 1 13 13 ALA N N 15 122.863 0.156 . 1 . . . . A 13 ALA N . 36469 1 124 . 1 . 1 14 14 SER H H 1 8.153 0.004 . 1 . . . . A 14 SER H . 36469 1 125 . 1 . 1 14 14 SER HA H 1 4.399 0 . 1 . . . . A 14 SER HA . 36469 1 126 . 1 . 1 14 14 SER HB2 H 1 3.921 0 . . . . . . A 14 SER HB2 . 36469 1 127 . 1 . 1 14 14 SER HB3 H 1 3.921 0 . . . . . . A 14 SER HB3 . 36469 1 128 . 1 . 1 14 14 SER CA C 13 55.828 0.07 . 1 . . . . A 14 SER CA . 36469 1 129 . 1 . 1 14 14 SER CB C 13 61.063 0.009 . 1 . . . . A 14 SER CB . 36469 1 130 . 1 . 1 14 14 SER N N 15 114.809 0.011 . 1 . . . . A 14 SER N . 36469 1 131 . 1 . 1 15 15 LYS H H 1 8.26 0.002 . 1 . . . . A 15 LYS H . 36469 1 132 . 1 . 1 15 15 LYS HA H 1 4.295 0 . 1 . . . . A 15 LYS HA . 36469 1 133 . 1 . 1 15 15 LYS HB2 H 1 1.823 0 . . . . . . A 15 LYS HB2 . 36469 1 134 . 1 . 1 15 15 LYS HB3 H 1 1.823 0 . . . . . . A 15 LYS HB3 . 36469 1 135 . 1 . 1 15 15 LYS HG2 H 1 1.418 0 . . . . . . A 15 LYS HG2 . 36469 1 136 . 1 . 1 15 15 LYS HG3 H 1 1.418 0 . . . . . . A 15 LYS HG3 . 36469 1 137 . 1 . 1 15 15 LYS HD2 H 1 1.685 0 . . . . . . A 15 LYS HD2 . 36469 1 138 . 1 . 1 15 15 LYS HD3 H 1 1.685 0 . . . . . . A 15 LYS HD3 . 36469 1 139 . 1 . 1 15 15 LYS HE2 H 1 2.992 0 . . . . . . A 15 LYS HE2 . 36469 1 140 . 1 . 1 15 15 LYS HE3 H 1 2.992 0 . . . . . . A 15 LYS HE3 . 36469 1 141 . 1 . 1 15 15 LYS CA C 13 53.958 0.072 . 1 . . . . A 15 LYS CA . 36469 1 142 . 1 . 1 15 15 LYS CB C 13 30.052 0.027 . 1 . . . . A 15 LYS CB . 36469 1 143 . 1 . 1 15 15 LYS N N 15 123.325 0.068 . 1 . . . . A 15 LYS N . 36469 1 144 . 1 . 1 16 16 ALA H H 1 8.132 0.003 . 1 . . . . A 16 ALA H . 36469 1 145 . 1 . 1 16 16 ALA HA H 1 4.279 0 . 1 . . . . A 16 ALA HA . 36469 1 146 . 1 . 1 16 16 ALA HB1 H 1 1.338 0 . 1 . . . . A 16 ALA HB1 . 36469 1 147 . 1 . 1 16 16 ALA HB2 H 1 1.338 0 . 1 . . . . A 16 ALA HB2 . 36469 1 148 . 1 . 1 16 16 ALA HB3 H 1 1.338 0 . 1 . . . . A 16 ALA HB3 . 36469 1 149 . 1 . 1 16 16 ALA CA C 13 50.076 0.015 . 1 . . . . A 16 ALA CA . 36469 1 150 . 1 . 1 16 16 ALA CB C 13 16.401 0.007 . 1 . . . . A 16 ALA CB . 36469 1 151 . 1 . 1 16 16 ALA N N 15 124.057 0.107 . 1 . . . . A 16 ALA N . 36469 1 152 . 1 . 1 17 17 TYR H H 1 8.049 0.005 . 1 . . . . A 17 TYR H . 36469 1 153 . 1 . 1 17 17 TYR HA H 1 4.497 0 . 1 . . . . A 17 TYR HA . 36469 1 154 . 1 . 1 17 17 TYR HB2 H 1 3.015 0 . . . . . . A 17 TYR HB2 . 36469 1 155 . 1 . 1 17 17 TYR HB3 H 1 3.015 0 . . . . . . A 17 TYR HB3 . 36469 1 156 . 1 . 1 17 17 TYR HD1 H 1 6.924 0 . . . . . . A 17 TYR HD1 . 36469 1 157 . 1 . 1 17 17 TYR HD2 H 1 6.924 0 . . . . . . A 17 TYR HD2 . 36469 1 158 . 1 . 1 17 17 TYR HE1 H 1 6.443 0 . . . . . . A 17 TYR HE1 . 36469 1 159 . 1 . 1 17 17 TYR HE2 H 1 6.443 0 . . . . . . A 17 TYR HE2 . 36469 1 160 . 1 . 1 17 17 TYR CA C 13 55.638 0.014 . 1 . . . . A 17 TYR CA . 36469 1 161 . 1 . 1 17 17 TYR CB C 13 35.962 0.017 . 1 . . . . A 17 TYR CB . 36469 1 162 . 1 . 1 17 17 TYR N N 15 119.502 0.09 . 1 . . . . A 17 TYR N . 36469 1 163 . 1 . 1 18 18 ASN H H 1 8.23 0.004 . 1 . . . . A 18 ASN H . 36469 1 164 . 1 . 1 18 18 ASN HA H 1 4.602 0 . 1 . . . . A 18 ASN HA . 36469 1 165 . 1 . 1 18 18 ASN HB2 H 1 2.779 0 . . . . . . A 18 ASN HB2 . 36469 1 166 . 1 . 1 18 18 ASN HB3 H 1 2.779 0 . . . . . . A 18 ASN HB3 . 36469 1 167 . 1 . 1 18 18 ASN CA C 13 50.684 0.013 . 1 . . . . A 18 ASN CA . 36469 1 168 . 1 . 1 18 18 ASN CB C 13 36.075 0.017 . 1 . . . . A 18 ASN CB . 36469 1 169 . 1 . 1 18 18 ASN N N 15 120.534 0.105 . 1 . . . . A 18 ASN N . 36469 1 170 . 1 . 1 19 19 LYS H H 1 8.137 0.002 . 1 . . . . A 19 LYS H . 36469 1 171 . 1 . 1 19 19 LYS HA H 1 4.222 0.003 . 1 . . . . A 19 LYS HA . 36469 1 172 . 1 . 1 19 19 LYS HB2 H 1 1.857 0 . . . . . . A 19 LYS HB2 . 36469 1 173 . 1 . 1 19 19 LYS HB3 H 1 1.857 0 . . . . . . A 19 LYS HB3 . 36469 1 174 . 1 . 1 19 19 LYS HG2 H 1 1.431 0 . . . . . . A 19 LYS HG2 . 36469 1 175 . 1 . 1 19 19 LYS HG3 H 1 1.431 0 . . . . . . A 19 LYS HG3 . 36469 1 176 . 1 . 1 19 19 LYS HD2 H 1 1.694 0 . . . . . . A 19 LYS HD2 . 36469 1 177 . 1 . 1 19 19 LYS HD3 H 1 1.694 0 . . . . . . A 19 LYS HD3 . 36469 1 178 . 1 . 1 19 19 LYS HE2 H 1 2.992 0 . . . . . . A 19 LYS HE2 . 36469 1 179 . 1 . 1 19 19 LYS HE3 H 1 2.992 0 . . . . . . A 19 LYS HE3 . 36469 1 180 . 1 . 1 19 19 LYS CA C 13 54.295 0.042 . 1 . . . . A 19 LYS CA . 36469 1 181 . 1 . 1 19 19 LYS CB C 13 30.07 0.019 . 1 . . . . A 19 LYS CB . 36469 1 182 . 1 . 1 19 19 LYS N N 15 121.656 0.187 . 1 . . . . A 19 LYS N . 36469 1 183 . 1 . 1 20 20 LEU H H 1 8.061 0.004 . 1 . . . . A 20 LEU H . 36469 1 184 . 1 . 1 20 20 LEU HA H 1 4.311 0.003 . 1 . . . . A 20 LEU HA . 36469 1 185 . 1 . 1 20 20 LEU HB2 H 1 1.715 0 . . . . . . A 20 LEU HB2 . 36469 1 186 . 1 . 1 20 20 LEU HB3 H 1 1.715 0 . . . . . . A 20 LEU HB3 . 36469 1 187 . 1 . 1 20 20 LEU HG H 1 1.592 0 . 1 . . . . A 20 LEU HG . 36469 1 188 . 1 . 1 20 20 LEU HD11 H 1 0.922 0 . . . . . . A 20 LEU HD11 . 36469 1 189 . 1 . 1 20 20 LEU HD12 H 1 0.922 0 . . . . . . A 20 LEU HD12 . 36469 1 190 . 1 . 1 20 20 LEU HD13 H 1 0.922 0 . . . . . . A 20 LEU HD13 . 36469 1 191 . 1 . 1 20 20 LEU HD21 H 1 0.87 0 . . . . . . A 20 LEU HD21 . 36469 1 192 . 1 . 1 20 20 LEU HD22 H 1 0.87 0 . . . . . . A 20 LEU HD22 . 36469 1 193 . 1 . 1 20 20 LEU HD23 H 1 0.87 0 . . . . . . A 20 LEU HD23 . 36469 1 194 . 1 . 1 20 20 LEU CA C 13 52.819 0.024 . 1 . . . . A 20 LEU CA . 36469 1 195 . 1 . 1 20 20 LEU CB C 13 39.421 0.046 . 1 . . . . A 20 LEU CB . 36469 1 196 . 1 . 1 20 20 LEU N N 15 121.534 0.106 . 1 . . . . A 20 LEU N . 36469 1 197 . 1 . 1 21 21 LYS H H 1 8.064 0.002 . 1 . . . . A 21 LYS H . 36469 1 198 . 1 . 1 21 21 LYS HA H 1 4.277 0.016 . 1 . . . . A 21 LYS HA . 36469 1 199 . 1 . 1 21 21 LYS HB2 H 1 1.828 0 . . . . . . A 21 LYS HB2 . 36469 1 200 . 1 . 1 21 21 LYS HB3 H 1 1.828 0 . . . . . . A 21 LYS HB3 . 36469 1 201 . 1 . 1 21 21 LYS HG2 H 1 1.408 0 . . . . . . A 21 LYS HG2 . 36469 1 202 . 1 . 1 21 21 LYS HG3 H 1 1.408 0 . . . . . . A 21 LYS HG3 . 36469 1 203 . 1 . 1 21 21 LYS HD2 H 1 1.69 0 . . . . . . A 21 LYS HD2 . 36469 1 204 . 1 . 1 21 21 LYS HD3 H 1 1.69 0 . . . . . . A 21 LYS HD3 . 36469 1 205 . 1 . 1 21 21 LYS HE2 H 1 2.992 0 . . . . . . A 21 LYS HE2 . 36469 1 206 . 1 . 1 21 21 LYS HE3 H 1 2.992 0 . . . . . . A 21 LYS HE3 . 36469 1 207 . 1 . 1 21 21 LYS CA C 13 54.031 0.031 . 1 . . . . A 21 LYS CA . 36469 1 208 . 1 . 1 21 21 LYS CB C 13 30.111 0.044 . 1 . . . . A 21 LYS CB . 36469 1 209 . 1 . 1 21 21 LYS N N 15 120.996 0.105 . 1 . . . . A 21 LYS N . 36469 1 210 . 1 . 1 22 22 GLY H H 1 8.292 0.003 . 1 . . . . A 22 GLY H . 36469 1 211 . 1 . 1 22 22 GLY HA2 H 1 3.942 0 . . . . . . A 22 GLY HA2 . 36469 1 212 . 1 . 1 22 22 GLY HA3 H 1 3.942 0 . . . . . . A 22 GLY HA3 . 36469 1 213 . 1 . 1 22 22 GLY CA C 13 42.746 0.028 . 1 . . . . A 22 GLY CA . 36469 1 214 . 1 . 1 22 22 GLY N N 15 109.614 0.139 . 1 . . . . A 22 GLY N . 36469 1 215 . 1 . 1 23 23 LEU H H 1 8.001 0.003 . 1 . . . . A 23 LEU H . 36469 1 216 . 1 . 1 23 23 LEU HA H 1 4.323 0.011 . 1 . . . . A 23 LEU HA . 36469 1 217 . 1 . 1 23 23 LEU HB2 H 1 1.673 0 . . . . . . A 23 LEU HB2 . 36469 1 218 . 1 . 1 23 23 LEU HB3 H 1 1.673 0 . . . . . . A 23 LEU HB3 . 36469 1 219 . 1 . 1 23 23 LEU HG H 1 1.586 0 . 1 . . . . A 23 LEU HG . 36469 1 220 . 1 . 1 23 23 LEU HD11 H 1 0.92 0 . . . . . . A 23 LEU HD11 . 36469 1 221 . 1 . 1 23 23 LEU HD12 H 1 0.92 0 . . . . . . A 23 LEU HD12 . 36469 1 222 . 1 . 1 23 23 LEU HD13 H 1 0.92 0 . . . . . . A 23 LEU HD13 . 36469 1 223 . 1 . 1 23 23 LEU HD21 H 1 0.858 0 . . . . . . A 23 LEU HD21 . 36469 1 224 . 1 . 1 23 23 LEU HD22 H 1 0.858 0 . . . . . . A 23 LEU HD22 . 36469 1 225 . 1 . 1 23 23 LEU HD23 H 1 0.858 0 . . . . . . A 23 LEU HD23 . 36469 1 226 . 1 . 1 23 23 LEU CA C 13 52.581 0.06 . 1 . . . . A 23 LEU CA . 36469 1 227 . 1 . 1 23 23 LEU CB C 13 39.842 0 . 1 . . . . A 23 LEU CB . 36469 1 228 . 1 . 1 23 23 LEU N N 15 121.613 0.022 . 1 . . . . A 23 LEU N . 36469 1 229 . 1 . 1 24 24 ALA H H 1 8.481 0.003 . 1 . . . . A 24 ALA H . 36469 1 230 . 1 . 1 24 24 ALA HA H 1 4.329 0 . 1 . . . . A 24 ALA HA . 36469 1 231 . 1 . 1 24 24 ALA HB1 H 1 1.405 0 . 1 . . . . A 24 ALA HB1 . 36469 1 232 . 1 . 1 24 24 ALA HB2 H 1 1.405 0 . 1 . . . . A 24 ALA HB2 . 36469 1 233 . 1 . 1 24 24 ALA HB3 H 1 1.405 0 . 1 . . . . A 24 ALA HB3 . 36469 1 234 . 1 . 1 24 24 ALA CA C 13 49.846 0.2 . 1 . . . . A 24 ALA CA . 36469 1 235 . 1 . 1 24 24 ALA CB C 13 16.441 0.202 . 1 . . . . A 24 ALA CB . 36469 1 236 . 1 . 1 24 24 ALA N N 15 126.844 0.127 . 1 . . . . A 24 ALA N . 36469 1 237 . 1 . 1 25 25 MET H H 1 8.245 0.002 . 1 . . . . A 25 MET H . 36469 1 238 . 1 . 1 25 25 MET HA H 1 4.437 0 . 1 . . . . A 25 MET HA . 36469 1 239 . 1 . 1 25 25 MET HB2 H 1 2.095 0 . . . . . . A 25 MET HB2 . 36469 1 240 . 1 . 1 25 25 MET HB3 H 1 2.019 0 . . . . . . A 25 MET HB3 . 36469 1 241 . 1 . 1 25 25 MET HG2 H 1 2.607 0 . . . . . . A 25 MET HG2 . 36469 1 242 . 1 . 1 25 25 MET HG3 H 1 2.532 0 . . . . . . A 25 MET HG3 . 36469 1 243 . 1 . 1 25 25 MET HE1 H 1 1.74 0 . 1 . . . . A 25 MET HE1 . 36469 1 244 . 1 . 1 25 25 MET HE2 H 1 1.74 0 . 1 . . . . A 25 MET HE2 . 36469 1 245 . 1 . 1 25 25 MET HE3 H 1 1.74 0 . 1 . . . . A 25 MET HE3 . 36469 1 246 . 1 . 1 25 25 MET CA C 13 52.925 0.002 . 1 . . . . A 25 MET CA . 36469 1 247 . 1 . 1 25 25 MET CB C 13 30.25 0.009 . 1 . . . . A 25 MET CB . 36469 1 248 . 1 . 1 25 25 MET N N 15 118.879 0.147 . 1 . . . . A 25 MET N . 36469 1 249 . 1 . 1 26 26 GLN H H 1 8.105 0.003 . 1 . . . . A 26 GLN H . 36469 1 250 . 1 . 1 26 26 GLN HA H 1 4.408 0 . 1 . . . . A 26 GLN HA . 36469 1 251 . 1 . 1 26 26 GLN HB2 H 1 2.099 0 . . . . . . A 26 GLN HB2 . 36469 1 252 . 1 . 1 26 26 GLN HB3 H 1 1.942 0 . . . . . . A 26 GLN HB3 . 36469 1 253 . 1 . 1 26 26 GLN HG2 H 1 2.332 0 . . . . . . A 26 GLN HG2 . 36469 1 254 . 1 . 1 26 26 GLN HG3 H 1 2.332 0 . . . . . . A 26 GLN HG3 . 36469 1 255 . 1 . 1 26 26 GLN CA C 13 52.557 0.047 . 1 . . . . A 26 GLN CA . 36469 1 256 . 1 . 1 26 26 GLN CB C 13 27.571 0.058 . 1 . . . . A 26 GLN CB . 36469 1 257 . 1 . 1 26 26 GLN N N 15 119.549 0.098 . 1 . . . . A 26 GLN N . 36469 1 258 . 1 . 1 27 27 SER H H 1 8.296 0.004 . 1 . . . . A 27 SER H . 36469 1 259 . 1 . 1 27 27 SER HA H 1 4.393 0 . 1 . . . . A 27 SER HA . 36469 1 260 . 1 . 1 27 27 SER HB2 H 1 3.658 0 . . . . . . A 27 SER HB2 . 36469 1 261 . 1 . 1 27 27 SER HB3 H 1 3.658 0 . . . . . . A 27 SER HB3 . 36469 1 262 . 1 . 1 27 27 SER CA C 13 56.122 0.065 . 1 . . . . A 27 SER CA . 36469 1 263 . 1 . 1 27 27 SER CB C 13 61.027 0.075 . 1 . . . . A 27 SER CB . 36469 1 264 . 1 . 1 27 27 SER N N 15 115.317 0.02 . 1 . . . . A 27 SER N . 36469 1 265 . 1 . 1 28 28 GLN H H 1 8.916 0.002 . 1 . . . . A 28 GLN H . 36469 1 266 . 1 . 1 28 28 GLN HA H 1 4.239 0.002 . 1 . . . . A 28 GLN HA . 36469 1 267 . 1 . 1 28 28 GLN HB2 H 1 2.058 0 . . . . . . A 28 GLN HB2 . 36469 1 268 . 1 . 1 28 28 GLN HB3 H 1 1.958 0 . . . . . . A 28 GLN HB3 . 36469 1 269 . 1 . 1 28 28 GLN HG2 H 1 2.269 0 . . . . . . A 28 GLN HG2 . 36469 1 270 . 1 . 1 28 28 GLN HG3 H 1 2.269 0 . . . . . . A 28 GLN HG3 . 36469 1 271 . 1 . 1 28 28 GLN CA C 13 52.676 0.026 . 1 . . . . A 28 GLN CA . 36469 1 272 . 1 . 1 28 28 GLN CB C 13 26.101 0.039 . 1 . . . . A 28 GLN CB . 36469 1 273 . 1 . 1 28 28 GLN N N 15 127.59 0.125 . 1 . . . . A 28 GLN N . 36469 1 274 . 1 . 1 29 29 TYR H H 1 8.309 0.002 . 1 . . . . A 29 TYR H . 36469 1 275 . 1 . 1 29 29 TYR HA H 1 4.03 0 . 1 . . . . A 29 TYR HA . 36469 1 276 . 1 . 1 29 29 TYR HB2 H 1 3.008 0 . . . . . . A 29 TYR HB2 . 36469 1 277 . 1 . 1 29 29 TYR HB3 H 1 2.722 0 . . . . . . A 29 TYR HB3 . 36469 1 278 . 1 . 1 29 29 TYR HD1 H 1 6.9 0 . . . . . . A 29 TYR HD1 . 36469 1 279 . 1 . 1 29 29 TYR HD2 H 1 6.9 0 . . . . . . A 29 TYR HD2 . 36469 1 280 . 1 . 1 29 29 TYR HE1 H 1 6.747 0 . . . . . . A 29 TYR HE1 . 36469 1 281 . 1 . 1 29 29 TYR HE2 H 1 6.747 0 . . . . . . A 29 TYR HE2 . 36469 1 282 . 1 . 1 29 29 TYR CA C 13 56.226 0.013 . 1 . . . . A 29 TYR CA . 36469 1 283 . 1 . 1 29 29 TYR CB C 13 33.707 0.03 . 1 . . . . A 29 TYR CB . 36469 1 284 . 1 . 1 29 29 TYR N N 15 117.398 0.135 . 1 . . . . A 29 TYR N . 36469 1 285 . 1 . 1 30 30 GLY H H 1 7.861 0.002 . 1 . . . . A 30 GLY H . 36469 1 286 . 1 . 1 30 30 GLY HA2 H 1 4.148 0.001 . . . . . . A 30 GLY HA2 . 36469 1 287 . 1 . 1 30 30 GLY HA3 H 1 3.644 0 . . . . . . A 30 GLY HA3 . 36469 1 288 . 1 . 1 30 30 GLY CA C 13 42.891 0.006 . 1 . . . . A 30 GLY CA . 36469 1 289 . 1 . 1 30 30 GLY N N 15 105.444 0.118 . 1 . . . . A 30 GLY N . 36469 1 290 . 1 . 1 31 31 CYS H H 1 7.831 0.002 . 1 . . . . A 31 CYS H . 36469 1 291 . 1 . 1 31 31 CYS HA H 1 4.726 0.006 . 1 . . . . A 31 CYS HA . 36469 1 292 . 1 . 1 31 31 CYS HB2 H 1 3.611 0 . . . . . . A 31 CYS HB2 . 36469 1 293 . 1 . 1 31 31 CYS HB3 H 1 2.73 0 . . . . . . A 31 CYS HB3 . 36469 1 294 . 1 . 1 31 31 CYS CA C 13 52.28 0.02 . 1 . . . . A 31 CYS CA . 36469 1 295 . 1 . 1 31 31 CYS CB C 13 31.994 0 . 1 . . . . A 31 CYS CB . 36469 1 296 . 1 . 1 31 31 CYS N N 15 121.239 0.119 . 1 . . . . A 31 CYS N . 36469 1 297 . 1 . 1 32 32 PRO HA H 1 4.753 0.008 . 1 . . . . A 32 PRO HA . 36469 1 298 . 1 . 1 32 32 PRO HB2 H 1 2.519 0 . . . . . . A 32 PRO HB2 . 36469 1 299 . 1 . 1 32 32 PRO HB3 H 1 2.519 0 . . . . . . A 32 PRO HB3 . 36469 1 300 . 1 . 1 32 32 PRO HG2 H 1 2.228 0 . . . . . . A 32 PRO HG2 . 36469 1 301 . 1 . 1 32 32 PRO HG3 H 1 1.883 0 . . . . . . A 32 PRO HG3 . 36469 1 302 . 1 . 1 32 32 PRO HD2 H 1 3.561 0 . . . . . . A 32 PRO HD2 . 36469 1 303 . 1 . 1 32 32 PRO HD3 H 1 3.259 0 . . . . . . A 32 PRO HD3 . 36469 1 304 . 1 . 1 32 32 PRO CA C 13 60.652 0.111 . 1 . . . . A 32 PRO CA . 36469 1 305 . 1 . 1 33 33 ILE H H 1 7.449 0.001 . 1 . . . . A 33 ILE H . 36469 1 306 . 1 . 1 33 33 ILE HA H 1 3.794 0 . 1 . . . . A 33 ILE HA . 36469 1 307 . 1 . 1 33 33 ILE HB H 1 2.012 0 . 1 . . . . A 33 ILE HB . 36469 1 308 . 1 . 1 33 33 ILE HG12 H 1 1.546 0 . . . . . . A 33 ILE HG12 . 36469 1 309 . 1 . 1 33 33 ILE HG13 H 1 1.546 0 . . . . . . A 33 ILE HG13 . 36469 1 310 . 1 . 1 33 33 ILE HG21 H 1 1.3 0 . 1 . . . . A 33 ILE HG21 . 36469 1 311 . 1 . 1 33 33 ILE HG22 H 1 1.3 0 . 1 . . . . A 33 ILE HG22 . 36469 1 312 . 1 . 1 33 33 ILE HG23 H 1 1.3 0 . 1 . . . . A 33 ILE HG23 . 36469 1 313 . 1 . 1 33 33 ILE HD11 H 1 1.014 0 . 1 . . . . A 33 ILE HD11 . 36469 1 314 . 1 . 1 33 33 ILE HD12 H 1 1.014 0 . 1 . . . . A 33 ILE HD12 . 36469 1 315 . 1 . 1 33 33 ILE HD13 H 1 1.014 0 . 1 . . . . A 33 ILE HD13 . 36469 1 316 . 1 . 1 33 33 ILE CA C 13 61.297 0.098 . 1 . . . . A 33 ILE CA . 36469 1 317 . 1 . 1 33 33 ILE CB C 13 35.096 0.047 . 1 . . . . A 33 ILE CB . 36469 1 318 . 1 . 1 33 33 ILE N N 15 124.723 0.045 . 1 . . . . A 33 ILE N . 36469 1 319 . 1 . 1 34 34 ILE H H 1 7.656 0.003 . 1 . . . . A 34 ILE H . 36469 1 320 . 1 . 1 34 34 ILE HA H 1 4.564 0 . 1 . . . . A 34 ILE HA . 36469 1 321 . 1 . 1 34 34 ILE HB H 1 2.005 0 . 1 . . . . A 34 ILE HB . 36469 1 322 . 1 . 1 34 34 ILE HG12 H 1 1.584 0 . . . . . . A 34 ILE HG12 . 36469 1 323 . 1 . 1 34 34 ILE HG13 H 1 1.584 0 . . . . . . A 34 ILE HG13 . 36469 1 324 . 1 . 1 34 34 ILE HG21 H 1 1.119 0 . 1 . . . . A 34 ILE HG21 . 36469 1 325 . 1 . 1 34 34 ILE HG22 H 1 1.119 0 . 1 . . . . A 34 ILE HG22 . 36469 1 326 . 1 . 1 34 34 ILE HG23 H 1 1.119 0 . 1 . . . . A 34 ILE HG23 . 36469 1 327 . 1 . 1 34 34 ILE CA C 13 56.919 0.019 . 1 . . . . A 34 ILE CA . 36469 1 328 . 1 . 1 34 34 ILE CB C 13 38.139 0.057 . 1 . . . . A 34 ILE CB . 36469 1 329 . 1 . 1 34 34 ILE N N 15 115.316 0.103 . 1 . . . . A 34 ILE N . 36469 1 330 . 1 . 1 35 35 SER H H 1 8.869 0.005 . 1 . . . . A 35 SER H . 36469 1 331 . 1 . 1 35 35 SER HA H 1 4.715 0 . 1 . . . . A 35 SER HA . 36469 1 332 . 1 . 1 35 35 SER HB2 H 1 3.97 0 . . . . . . A 35 SER HB2 . 36469 1 333 . 1 . 1 35 35 SER HB3 H 1 3.83 0 . . . . . . A 35 SER HB3 . 36469 1 334 . 1 . 1 35 35 SER CA C 13 56.294 0.074 . 1 . . . . A 35 SER CA . 36469 1 335 . 1 . 1 35 35 SER CB C 13 62.545 0.016 . 1 . . . . A 35 SER CB . 36469 1 336 . 1 . 1 35 35 SER N N 15 116.284 0.101 . 1 . . . . A 35 SER N . 36469 1 337 . 1 . 1 36 36 ASN H H 1 8.397 0.003 . 1 . . . . A 36 ASN H . 36469 1 338 . 1 . 1 36 36 ASN HA H 1 4.42 0 . 1 . . . . A 36 ASN HA . 36469 1 339 . 1 . 1 36 36 ASN HB2 H 1 2.868 0 . . . . . . A 36 ASN HB2 . 36469 1 340 . 1 . 1 36 36 ASN HB3 H 1 2.868 0 . . . . . . A 36 ASN HB3 . 36469 1 341 . 1 . 1 36 36 ASN CA C 13 54.355 0.069 . 1 . . . . A 36 ASN CA . 36469 1 342 . 1 . 1 36 36 ASN CB C 13 34.67 0.006 . 1 . . . . A 36 ASN CB . 36469 1 343 . 1 . 1 36 36 ASN N N 15 119.521 0.116 . 1 . . . . A 36 ASN N . 36469 1 344 . 1 . 1 37 37 MET H H 1 7.487 0.003 . 1 . . . . A 37 MET H . 36469 1 345 . 1 . 1 37 37 MET HA H 1 4.434 0 . 1 . . . . A 37 MET HA . 36469 1 346 . 1 . 1 37 37 MET HB2 H 1 2.354 0 . . . . . . A 37 MET HB2 . 36469 1 347 . 1 . 1 37 37 MET HB3 H 1 2.354 0 . . . . . . A 37 MET HB3 . 36469 1 348 . 1 . 1 37 37 MET HG2 H 1 2.685 0 . . . . . . A 37 MET HG2 . 36469 1 349 . 1 . 1 37 37 MET HG3 H 1 2.547 0 . . . . . . A 37 MET HG3 . 36469 1 350 . 1 . 1 37 37 MET HE1 H 1 2.154 0 . 1 . . . . A 37 MET HE1 . 36469 1 351 . 1 . 1 37 37 MET HE2 H 1 2.154 0 . 1 . . . . A 37 MET HE2 . 36469 1 352 . 1 . 1 37 37 MET HE3 H 1 2.154 0 . 1 . . . . A 37 MET HE3 . 36469 1 353 . 1 . 1 37 37 MET CA C 13 55.885 0.056 . 1 . . . . A 37 MET CA . 36469 1 354 . 1 . 1 37 37 MET CB C 13 29.33 0.087 . 1 . . . . A 37 MET CB . 36469 1 355 . 1 . 1 37 37 MET N N 15 120.251 0.109 . 1 . . . . A 37 MET N . 36469 1 356 . 1 . 1 38 38 CYS H H 1 9.034 0.001 . 1 . . . . A 38 CYS H . 36469 1 357 . 1 . 1 38 38 CYS HA H 1 4.407 0 . 1 . . . . A 38 CYS HA . 36469 1 358 . 1 . 1 38 38 CYS HB2 H 1 3.381 0 . . . . . . A 38 CYS HB2 . 36469 1 359 . 1 . 1 38 38 CYS HB3 H 1 3.381 0 . . . . . . A 38 CYS HB3 . 36469 1 360 . 1 . 1 38 38 CYS CA C 13 54.575 0.001 . 1 . . . . A 38 CYS CA . 36469 1 361 . 1 . 1 38 38 CYS CB C 13 33.545 0.011 . 1 . . . . A 38 CYS CB . 36469 1 362 . 1 . 1 38 38 CYS N N 15 123.457 0.142 . 1 . . . . A 38 CYS N . 36469 1 363 . 1 . 1 39 39 GLU H H 1 8.239 0.002 . 1 . . . . A 39 GLU H . 36469 1 364 . 1 . 1 39 39 GLU HA H 1 3.658 0.006 . 1 . . . . A 39 GLU HA . 36469 1 365 . 1 . 1 39 39 GLU HB2 H 1 2.157 0 . . . . . . A 39 GLU HB2 . 36469 1 366 . 1 . 1 39 39 GLU HB3 H 1 1.998 0 . . . . . . A 39 GLU HB3 . 36469 1 367 . 1 . 1 39 39 GLU HG2 H 1 2.377 0.008 . . . . . . A 39 GLU HG2 . 36469 1 368 . 1 . 1 39 39 GLU HG3 H 1 2.377 0.008 . . . . . . A 39 GLU HG3 . 36469 1 369 . 1 . 1 39 39 GLU CA C 13 57.71 0.099 . 1 . . . . A 39 GLU CA . 36469 1 370 . 1 . 1 39 39 GLU CB C 13 26.59 0.019 . 1 . . . . A 39 GLU CB . 36469 1 371 . 1 . 1 39 39 GLU N N 15 118.45 0.133 . 1 . . . . A 39 GLU N . 36469 1 372 . 1 . 1 40 40 ASP H H 1 8.095 0.002 . 1 . . . . A 40 ASP H . 36469 1 373 . 1 . 1 40 40 ASP HA H 1 4.321 0 . 1 . . . . A 40 ASP HA . 36469 1 374 . 1 . 1 40 40 ASP HB2 H 1 2.819 0 . . . . . . A 40 ASP HB2 . 36469 1 375 . 1 . 1 40 40 ASP HB3 H 1 2.663 0 . . . . . . A 40 ASP HB3 . 36469 1 376 . 1 . 1 40 40 ASP CA C 13 55.02 0.001 . 1 . . . . A 40 ASP CA . 36469 1 377 . 1 . 1 40 40 ASP CB C 13 38.484 0.037 . 1 . . . . A 40 ASP CB . 36469 1 378 . 1 . 1 40 40 ASP N N 15 118.828 0.138 . 1 . . . . A 40 ASP N . 36469 1 379 . 1 . 1 41 41 HIS H H 1 7.868 0.004 . 1 . . . . A 41 HIS H . 36469 1 380 . 1 . 1 41 41 HIS HA H 1 4.14 0 . 1 . . . . A 41 HIS HA . 36469 1 381 . 1 . 1 41 41 HIS HB2 H 1 3.07 0 . . . . . . A 41 HIS HB2 . 36469 1 382 . 1 . 1 41 41 HIS HB3 H 1 3.07 0 . . . . . . A 41 HIS HB3 . 36469 1 383 . 1 . 1 41 41 HIS HD2 H 1 6.584 0 . 1 . . . . A 41 HIS HD2 . 36469 1 384 . 1 . 1 41 41 HIS HE1 H 1 7.802 0 . 1 . . . . A 41 HIS HE1 . 36469 1 385 . 1 . 1 41 41 HIS CA C 13 56.786 0.003 . 1 . . . . A 41 HIS CA . 36469 1 386 . 1 . 1 41 41 HIS CB C 13 25.991 0.032 . 1 . . . . A 41 HIS CB . 36469 1 387 . 1 . 1 41 41 HIS N N 15 119.519 0.065 . 1 . . . . A 41 HIS N . 36469 1 388 . 1 . 1 42 42 CYS H H 1 8.166 0.006 . 1 . . . . A 42 CYS H . 36469 1 389 . 1 . 1 42 42 CYS HA H 1 3.99 0 . 1 . . . . A 42 CYS HA . 36469 1 390 . 1 . 1 42 42 CYS HB2 H 1 2.363 0 . . . . . . A 42 CYS HB2 . 36469 1 391 . 1 . 1 42 42 CYS HB3 H 1 2.236 0 . . . . . . A 42 CYS HB3 . 36469 1 392 . 1 . 1 42 42 CYS CA C 13 53.211 0.023 . 1 . . . . A 42 CYS CA . 36469 1 393 . 1 . 1 42 42 CYS CB C 13 32.926 0.018 . 1 . . . . A 42 CYS CB . 36469 1 394 . 1 . 1 42 42 CYS N N 15 116.335 0.139 . 1 . . . . A 42 CYS N . 36469 1 395 . 1 . 1 43 43 ARG H H 1 8.675 0.004 . 1 . . . . A 43 ARG H . 36469 1 396 . 1 . 1 43 43 ARG HA H 1 4.35 0 . 1 . . . . A 43 ARG HA . 36469 1 397 . 1 . 1 43 43 ARG HB2 H 1 2.06 0 . . . . . . A 43 ARG HB2 . 36469 1 398 . 1 . 1 43 43 ARG HB3 H 1 2.06 0 . . . . . . A 43 ARG HB3 . 36469 1 399 . 1 . 1 43 43 ARG HG2 H 1 1.948 0 . . . . . . A 43 ARG HG2 . 36469 1 400 . 1 . 1 43 43 ARG HG3 H 1 1.948 0 . . . . . . A 43 ARG HG3 . 36469 1 401 . 1 . 1 43 43 ARG HD2 H 1 3.242 0 . . . . . . A 43 ARG HD2 . 36469 1 402 . 1 . 1 43 43 ARG HD3 H 1 3.242 0 . . . . . . A 43 ARG HD3 . 36469 1 403 . 1 . 1 43 43 ARG CA C 13 56.843 0.035 . 1 . . . . A 43 ARG CA . 36469 1 404 . 1 . 1 43 43 ARG CB C 13 26.965 0.035 . 1 . . . . A 43 ARG CB . 36469 1 405 . 1 . 1 43 43 ARG N N 15 124.029 0.146 . 1 . . . . A 43 ARG N . 36469 1 406 . 1 . 1 44 44 ARG H H 1 7.735 0.004 . 1 . . . . A 44 ARG H . 36469 1 407 . 1 . 1 44 44 ARG HA H 1 4.119 0 . 1 . . . . A 44 ARG HA . 36469 1 408 . 1 . 1 44 44 ARG HB2 H 1 1.904 0 . . . . . . A 44 ARG HB2 . 36469 1 409 . 1 . 1 44 44 ARG HB3 H 1 1.904 0 . . . . . . A 44 ARG HB3 . 36469 1 410 . 1 . 1 44 44 ARG HG2 H 1 1.718 0 . . . . . . A 44 ARG HG2 . 36469 1 411 . 1 . 1 44 44 ARG HG3 H 1 1.718 0 . . . . . . A 44 ARG HG3 . 36469 1 412 . 1 . 1 44 44 ARG HD2 H 1 3.24 0 . . . . . . A 44 ARG HD2 . 36469 1 413 . 1 . 1 44 44 ARG HD3 H 1 3.24 0 . . . . . . A 44 ARG HD3 . 36469 1 414 . 1 . 1 44 44 ARG CA C 13 56.332 0.016 . 1 . . . . A 44 ARG CA . 36469 1 415 . 1 . 1 44 44 ARG CB C 13 27.19 0.025 . 1 . . . . A 44 ARG CB . 36469 1 416 . 1 . 1 44 44 ARG N N 15 120.957 0.052 . 1 . . . . A 44 ARG N . 36469 1 417 . 1 . 1 45 45 LYS H H 1 7.253 0.003 . 1 . . . . A 45 LYS H . 36469 1 418 . 1 . 1 45 45 LYS HA H 1 4.467 0.006 . 1 . . . . A 45 LYS HA . 36469 1 419 . 1 . 1 45 45 LYS HB2 H 1 1.926 0 . . . . . . A 45 LYS HB2 . 36469 1 420 . 1 . 1 45 45 LYS HB3 H 1 1.709 0 . . . . . . A 45 LYS HB3 . 36469 1 421 . 1 . 1 45 45 LYS HG2 H 1 1.3 0 . . . . . . A 45 LYS HG2 . 36469 1 422 . 1 . 1 45 45 LYS HG3 H 1 1.3 0 . . . . . . A 45 LYS HG3 . 36469 1 423 . 1 . 1 45 45 LYS HD2 H 1 1.534 0 . . . . . . A 45 LYS HD2 . 36469 1 424 . 1 . 1 45 45 LYS HD3 H 1 1.534 0 . . . . . . A 45 LYS HD3 . 36469 1 425 . 1 . 1 45 45 LYS HE2 H 1 2.602 0 . . . . . . A 45 LYS HE2 . 36469 1 426 . 1 . 1 45 45 LYS HE3 H 1 2.602 0 . . . . . . A 45 LYS HE3 . 36469 1 427 . 1 . 1 45 45 LYS CA C 13 52.228 0.037 . 1 . . . . A 45 LYS CA . 36469 1 428 . 1 . 1 45 45 LYS CB C 13 29.377 0.003 . 1 . . . . A 45 LYS CB . 36469 1 429 . 1 . 1 45 45 LYS N N 15 117.161 0.131 . 1 . . . . A 45 LYS N . 36469 1 430 . 1 . 1 46 46 LYS H H 1 7.989 0.002 . 1 . . . . A 46 LYS H . 36469 1 431 . 1 . 1 46 46 LYS HA H 1 3.9 0.003 . 1 . . . . A 46 LYS HA . 36469 1 432 . 1 . 1 46 46 LYS HB2 H 1 2.102 0 . . . . . . A 46 LYS HB2 . 36469 1 433 . 1 . 1 46 46 LYS HB3 H 1 2.002 0 . . . . . . A 46 LYS HB3 . 36469 1 434 . 1 . 1 46 46 LYS HG2 H 1 1.345 0 . . . . . . A 46 LYS HG2 . 36469 1 435 . 1 . 1 46 46 LYS HG3 H 1 1.345 0 . . . . . . A 46 LYS HG3 . 36469 1 436 . 1 . 1 46 46 LYS HD2 H 1 1.715 0 . . . . . . A 46 LYS HD2 . 36469 1 437 . 1 . 1 46 46 LYS HD3 H 1 1.668 0 . . . . . . A 46 LYS HD3 . 36469 1 438 . 1 . 1 46 46 LYS HE2 H 1 2.995 0 . . . . . . A 46 LYS HE2 . 36469 1 439 . 1 . 1 46 46 LYS HE3 H 1 2.995 0 . . . . . . A 46 LYS HE3 . 36469 1 440 . 1 . 1 46 46 LYS CA C 13 54.534 0.053 . 1 . . . . A 46 LYS CA . 36469 1 441 . 1 . 1 46 46 LYS N N 15 114.391 0.121 . 1 . . . . A 46 LYS N . 36469 1 442 . 1 . 1 47 47 MET H H 1 7.818 0.004 . 1 . . . . A 47 MET H . 36469 1 443 . 1 . 1 47 47 MET HA H 1 4.678 0 . 1 . . . . A 47 MET HA . 36469 1 444 . 1 . 1 47 47 MET HB2 H 1 2.498 0 . . . . . . A 47 MET HB2 . 36469 1 445 . 1 . 1 47 47 MET HB3 H 1 2.498 0 . . . . . . A 47 MET HB3 . 36469 1 446 . 1 . 1 47 47 MET HG2 H 1 2.329 0 . . . . . . A 47 MET HG2 . 36469 1 447 . 1 . 1 47 47 MET HG3 H 1 2.329 0 . . . . . . A 47 MET HG3 . 36469 1 448 . 1 . 1 47 47 MET HE1 H 1 1.419 0 . 1 . . . . A 47 MET HE1 . 36469 1 449 . 1 . 1 47 47 MET HE2 H 1 1.419 0 . 1 . . . . A 47 MET HE2 . 36469 1 450 . 1 . 1 47 47 MET HE3 H 1 1.419 0 . 1 . . . . A 47 MET HE3 . 36469 1 451 . 1 . 1 47 47 MET CA C 13 52.029 0.025 . 1 . . . . A 47 MET CA . 36469 1 452 . 1 . 1 47 47 MET CB C 13 35.54 0.037 . 1 . . . . A 47 MET CB . 36469 1 453 . 1 . 1 47 47 MET N N 15 118.493 0.022 . 1 . . . . A 47 MET N . 36469 1 454 . 1 . 1 48 48 GLU H H 1 8.774 0.004 . 1 . . . . A 48 GLU H . 36469 1 455 . 1 . 1 48 48 GLU HA H 1 4.635 0 . 1 . . . . A 48 GLU HA . 36469 1 456 . 1 . 1 48 48 GLU HB2 H 1 2.046 0 . . . . . . A 48 GLU HB2 . 36469 1 457 . 1 . 1 48 48 GLU HB3 H 1 1.849 0 . . . . . . A 48 GLU HB3 . 36469 1 458 . 1 . 1 48 48 GLU HG2 H 1 2.296 0 . . . . . . A 48 GLU HG2 . 36469 1 459 . 1 . 1 48 48 GLU HG3 H 1 2.195 0 . . . . . . A 48 GLU HG3 . 36469 1 460 . 1 . 1 48 48 GLU CA C 13 52.148 0.011 . 1 . . . . A 48 GLU CA . 36469 1 461 . 1 . 1 48 48 GLU CB C 13 28.875 0.007 . 1 . . . . A 48 GLU CB . 36469 1 462 . 1 . 1 48 48 GLU N N 15 119.782 0.111 . 1 . . . . A 48 GLU N . 36469 1 463 . 1 . 1 49 49 GLY H H 1 8.917 0.002 . 1 . . . . A 49 GLY H . 36469 1 464 . 1 . 1 49 49 GLY CA C 13 43.678 0.009 . 1 . . . . A 49 GLY CA . 36469 1 465 . 1 . 1 49 49 GLY N N 15 109.113 0.115 . 1 . . . . A 49 GLY N . 36469 1 466 . 1 . 1 50 50 GLN H H 1 8.433 0.003 . 1 . . . . A 50 GLN H . 36469 1 467 . 1 . 1 50 50 GLN HA H 1 4.542 0 . 1 . . . . A 50 GLN HA . 36469 1 468 . 1 . 1 50 50 GLN HB2 H 1 2.034 0 . . . . . . A 50 GLN HB2 . 36469 1 469 . 1 . 1 50 50 GLN HB3 H 1 2.034 0 . . . . . . A 50 GLN HB3 . 36469 1 470 . 1 . 1 50 50 GLN HG2 H 1 2.396 0 . . . . . . A 50 GLN HG2 . 36469 1 471 . 1 . 1 50 50 GLN HG3 H 1 2.396 0 . . . . . . A 50 GLN HG3 . 36469 1 472 . 1 . 1 50 50 GLN CA C 13 51.944 0.008 . 1 . . . . A 50 GLN CA . 36469 1 473 . 1 . 1 50 50 GLN CB C 13 30.08 0.003 . 1 . . . . A 50 GLN CB . 36469 1 474 . 1 . 1 50 50 GLN N N 15 119.37 0.121 . 1 . . . . A 50 GLN N . 36469 1 475 . 1 . 1 51 51 CYS H H 1 9.123 0.002 . 1 . . . . A 51 CYS H . 36469 1 476 . 1 . 1 51 51 CYS HA H 1 5.482 0.005 . 1 . . . . A 51 CYS HA . 36469 1 477 . 1 . 1 51 51 CYS HB2 H 1 3.189 0 . . . . . . A 51 CYS HB2 . 36469 1 478 . 1 . 1 51 51 CYS HB3 H 1 2.88 0 . . . . . . A 51 CYS HB3 . 36469 1 479 . 1 . 1 51 51 CYS CA C 13 51.271 0.005 . 1 . . . . A 51 CYS CA . 36469 1 480 . 1 . 1 51 51 CYS CB C 13 33.407 0.014 . 1 . . . . A 51 CYS CB . 36469 1 481 . 1 . 1 51 51 CYS N N 15 120.995 0.014 . 1 . . . . A 51 CYS N . 36469 1 482 . 1 . 1 52 52 ASP H H 1 9.28 0.002 . 1 . . . . A 52 ASP H . 36469 1 483 . 1 . 1 52 52 ASP HA H 1 4.685 0 . 1 . . . . A 52 ASP HA . 36469 1 484 . 1 . 1 52 52 ASP HB2 H 1 2.703 0 . . . . . . A 52 ASP HB2 . 36469 1 485 . 1 . 1 52 52 ASP HB3 H 1 2.403 0 . . . . . . A 52 ASP HB3 . 36469 1 486 . 1 . 1 52 52 ASP CA C 13 50.898 0.181 . 1 . . . . A 52 ASP CA . 36469 1 487 . 1 . 1 52 52 ASP CB C 13 38.778 0.002 . 1 . . . . A 52 ASP CB . 36469 1 488 . 1 . 1 52 52 ASP N N 15 125.57 0.134 . 1 . . . . A 52 ASP N . 36469 1 489 . 1 . 1 53 53 LEU H H 1 8.973 0.002 . 1 . . . . A 53 LEU H . 36469 1 490 . 1 . 1 53 53 LEU HA H 1 3.482 0.008 . 1 . . . . A 53 LEU HA . 36469 1 491 . 1 . 1 53 53 LEU HB2 H 1 2.17 0 . . . . . . A 53 LEU HB2 . 36469 1 492 . 1 . 1 53 53 LEU HB3 H 1 2.17 0 . . . . . . A 53 LEU HB3 . 36469 1 493 . 1 . 1 53 53 LEU HG H 1 1.541 0 . 1 . . . . A 53 LEU HG . 36469 1 494 . 1 . 1 53 53 LEU HD11 H 1 0.94 0 . . . . . . A 53 LEU HD11 . 36469 1 495 . 1 . 1 53 53 LEU HD12 H 1 0.94 0 . . . . . . A 53 LEU HD12 . 36469 1 496 . 1 . 1 53 53 LEU HD13 H 1 0.94 0 . . . . . . A 53 LEU HD13 . 36469 1 497 . 1 . 1 53 53 LEU HD21 H 1 0.893 0 . . . . . . A 53 LEU HD21 . 36469 1 498 . 1 . 1 53 53 LEU HD22 H 1 0.893 0 . . . . . . A 53 LEU HD22 . 36469 1 499 . 1 . 1 53 53 LEU HD23 H 1 0.893 0 . . . . . . A 53 LEU HD23 . 36469 1 500 . 1 . 1 53 53 LEU CA C 13 54.508 0.009 . 1 . . . . A 53 LEU CA . 36469 1 501 . 1 . 1 53 53 LEU CB C 13 36.487 0.013 . 1 . . . . A 53 LEU CB . 36469 1 502 . 1 . 1 53 53 LEU N N 15 123.824 0.118 . 1 . . . . A 53 LEU N . 36469 1 503 . 1 . 1 54 54 LEU H H 1 7.44 0.002 . 1 . . . . A 54 LEU H . 36469 1 504 . 1 . 1 54 54 LEU HA H 1 4.023 0.003 . 1 . . . . A 54 LEU HA . 36469 1 505 . 1 . 1 54 54 LEU HB2 H 1 1.673 0 . . . . . . A 54 LEU HB2 . 36469 1 506 . 1 . 1 54 54 LEU HB3 H 1 1.673 0 . . . . . . A 54 LEU HB3 . 36469 1 507 . 1 . 1 54 54 LEU HG H 1 1.319 0 . 1 . . . . A 54 LEU HG . 36469 1 508 . 1 . 1 54 54 LEU HD11 H 1 0.873 0 . . . . . . A 54 LEU HD11 . 36469 1 509 . 1 . 1 54 54 LEU HD12 H 1 0.873 0 . . . . . . A 54 LEU HD12 . 36469 1 510 . 1 . 1 54 54 LEU HD13 H 1 0.873 0 . . . . . . A 54 LEU HD13 . 36469 1 511 . 1 . 1 54 54 LEU HD21 H 1 0.814 0 . . . . . . A 54 LEU HD21 . 36469 1 512 . 1 . 1 54 54 LEU HD22 H 1 0.814 0 . . . . . . A 54 LEU HD22 . 36469 1 513 . 1 . 1 54 54 LEU HD23 H 1 0.814 0 . . . . . . A 54 LEU HD23 . 36469 1 514 . 1 . 1 54 54 LEU CA C 13 53.647 0.003 . 1 . . . . A 54 LEU CA . 36469 1 515 . 1 . 1 54 54 LEU CB C 13 39.598 0.05 . 1 . . . . A 54 LEU CB . 36469 1 516 . 1 . 1 54 54 LEU N N 15 118.987 0.119 . 1 . . . . A 54 LEU N . 36469 1 517 . 1 . 1 55 55 ASP H H 1 7.84 0.002 . 1 . . . . A 55 ASP H . 36469 1 518 . 1 . 1 55 55 ASP HA H 1 4.586 0 . 1 . . . . A 55 ASP HA . 36469 1 519 . 1 . 1 55 55 ASP HB2 H 1 2.695 0 . . . . . . A 55 ASP HB2 . 36469 1 520 . 1 . 1 55 55 ASP HB3 H 1 2.495 0 . . . . . . A 55 ASP HB3 . 36469 1 521 . 1 . 1 55 55 ASP CA C 13 51.162 0.026 . 1 . . . . A 55 ASP CA . 36469 1 522 . 1 . 1 55 55 ASP CB C 13 39.835 0.033 . 1 . . . . A 55 ASP CB . 36469 1 523 . 1 . 1 55 55 ASP N N 15 116.854 0.129 . 1 . . . . A 55 ASP N . 36469 1 524 . 1 . 1 56 56 CYS H H 1 8.657 0.003 . 1 . . . . A 56 CYS H . 36469 1 525 . 1 . 1 56 56 CYS HA H 1 5.192 0.002 . 1 . . . . A 56 CYS HA . 36469 1 526 . 1 . 1 56 56 CYS HB2 H 1 3.057 0 . . . . . . A 56 CYS HB2 . 36469 1 527 . 1 . 1 56 56 CYS HB3 H 1 2.704 0 . . . . . . A 56 CYS HB3 . 36469 1 528 . 1 . 1 56 56 CYS CA C 13 52.367 0.147 . 1 . . . . A 56 CYS CA . 36469 1 529 . 1 . 1 56 56 CYS CB C 13 34.972 0.021 . 1 . . . . A 56 CYS CB . 36469 1 530 . 1 . 1 56 56 CYS N N 15 120.459 0.128 . 1 . . . . A 56 CYS N . 36469 1 531 . 1 . 1 57 57 VAL H H 1 9.075 0.003 . 1 . . . . A 57 VAL H . 36469 1 532 . 1 . 1 57 57 VAL HA H 1 4.283 0 . 1 . . . . A 57 VAL HA . 36469 1 533 . 1 . 1 57 57 VAL HB H 1 2.139 0 . 1 . . . . A 57 VAL HB . 36469 1 534 . 1 . 1 57 57 VAL HG11 H 1 0.978 0 . . . . . . A 57 VAL HG11 . 36469 1 535 . 1 . 1 57 57 VAL HG12 H 1 0.978 0 . . . . . . A 57 VAL HG12 . 36469 1 536 . 1 . 1 57 57 VAL HG13 H 1 0.978 0 . . . . . . A 57 VAL HG13 . 36469 1 537 . 1 . 1 57 57 VAL HG21 H 1 0.891 0 . . . . . . A 57 VAL HG21 . 36469 1 538 . 1 . 1 57 57 VAL HG22 H 1 0.891 0 . . . . . . A 57 VAL HG22 . 36469 1 539 . 1 . 1 57 57 VAL HG23 H 1 0.891 0 . . . . . . A 57 VAL HG23 . 36469 1 540 . 1 . 1 57 57 VAL CA C 13 59.126 0.002 . 1 . . . . A 57 VAL CA . 36469 1 541 . 1 . 1 57 57 VAL CB C 13 30.73 0.002 . 1 . . . . A 57 VAL CB . 36469 1 542 . 1 . 1 57 57 VAL N N 15 131.507 0.131 . 1 . . . . A 57 VAL N . 36469 1 543 . 1 . 1 58 58 CYS H H 1 8.784 0.005 . 1 . . . . A 58 CYS H . 36469 1 544 . 1 . 1 58 58 CYS HA H 1 6.002 0.002 . 1 . . . . A 58 CYS HA . 36469 1 545 . 1 . 1 58 58 CYS HB2 H 1 3.164 0 . . . . . . A 58 CYS HB2 . 36469 1 546 . 1 . 1 58 58 CYS HB3 H 1 2.705 0 . . . . . . A 58 CYS HB3 . 36469 1 547 . 1 . 1 58 58 CYS CB C 13 34.66 0.02 . 1 . . . . A 58 CYS CB . 36469 1 548 . 1 . 1 58 58 CYS N N 15 125.958 0.12 . 1 . . . . A 58 CYS N . 36469 1 549 . 1 . 1 59 59 SER H H 1 9.395 0.1 . 1 . . . . A 59 SER H . 36469 1 550 . 1 . 1 59 59 SER HA H 1 4.408 0 . 1 . . . . A 59 SER HA . 36469 1 551 . 1 . 1 59 59 SER HB2 H 1 3.839 0 . . . . . . A 59 SER HB2 . 36469 1 552 . 1 . 1 59 59 SER HB3 H 1 3.732 0 . . . . . . A 59 SER HB3 . 36469 1 553 . 1 . 1 59 59 SER CA C 13 57.407 0.13 . 1 . . . . A 59 SER CA . 36469 1 554 . 1 . 1 59 59 SER CB C 13 63.264 0 . 1 . . . . A 59 SER CB . 36469 1 555 . 1 . 1 59 59 SER N N 15 124.536 0.118 . 1 . . . . A 59 SER N . 36469 1 stop_ save_