################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11325 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11325 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11325 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11325 1 2 $NMRPipe . . 11325 1 3 $NMRView . . 11325 1 4 $Kujira . . 11325 1 5 $CYANA . . 11325 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 7 7 GLY H H 1 8.428 0.030 . 1 . . . . 7 GLY H . 11325 1 2 . 1 1 7 7 GLY HA2 H 1 4.003 0.030 . 1 . . . . 7 GLY HA2 . 11325 1 3 . 1 1 7 7 GLY HA3 H 1 4.003 0.030 . 1 . . . . 7 GLY HA3 . 11325 1 4 . 1 1 7 7 GLY C C 13 174.300 0.300 . 1 . . . . 7 GLY C . 11325 1 5 . 1 1 7 7 GLY CA C 13 45.391 0.300 . 1 . . . . 7 GLY CA . 11325 1 6 . 1 1 7 7 GLY N N 15 110.806 0.300 . 1 . . . . 7 GLY N . 11325 1 7 . 1 1 8 8 THR H H 1 8.062 0.030 . 1 . . . . 8 THR H . 11325 1 8 . 1 1 8 8 THR HA H 1 4.380 0.030 . 1 . . . . 8 THR HA . 11325 1 9 . 1 1 8 8 THR HB H 1 4.211 0.030 . 1 . . . . 8 THR HB . 11325 1 10 . 1 1 8 8 THR HG21 H 1 1.162 0.030 . 1 . . . . 8 THR HG2 . 11325 1 11 . 1 1 8 8 THR HG22 H 1 1.162 0.030 . 1 . . . . 8 THR HG2 . 11325 1 12 . 1 1 8 8 THR HG23 H 1 1.162 0.030 . 1 . . . . 8 THR HG2 . 11325 1 13 . 1 1 8 8 THR C C 13 174.543 0.300 . 1 . . . . 8 THR C . 11325 1 14 . 1 1 8 8 THR CA C 13 61.679 0.300 . 1 . . . . 8 THR CA . 11325 1 15 . 1 1 8 8 THR CB C 13 69.877 0.300 . 1 . . . . 8 THR CB . 11325 1 16 . 1 1 8 8 THR CG2 C 13 21.623 0.300 . 1 . . . . 8 THR CG2 . 11325 1 17 . 1 1 8 8 THR N N 15 113.449 0.300 . 1 . . . . 8 THR N . 11325 1 18 . 1 1 9 9 SER H H 1 8.349 0.030 . 1 . . . . 9 SER H . 11325 1 19 . 1 1 9 9 SER HA H 1 4.480 0.030 . 1 . . . . 9 SER HA . 11325 1 20 . 1 1 9 9 SER HB2 H 1 3.804 0.030 . 1 . . . . 9 SER HB2 . 11325 1 21 . 1 1 9 9 SER HB3 H 1 3.804 0.030 . 1 . . . . 9 SER HB3 . 11325 1 22 . 1 1 9 9 SER C C 13 174.190 0.300 . 1 . . . . 9 SER C . 11325 1 23 . 1 1 9 9 SER CA C 13 58.207 0.300 . 1 . . . . 9 SER CA . 11325 1 24 . 1 1 9 9 SER CB C 13 63.711 0.300 . 1 . . . . 9 SER CB . 11325 1 25 . 1 1 9 9 SER N N 15 118.574 0.300 . 1 . . . . 9 SER N . 11325 1 26 . 1 1 10 10 ILE H H 1 8.172 0.030 . 1 . . . . 10 ILE H . 11325 1 27 . 1 1 10 10 ILE HA H 1 4.228 0.030 . 1 . . . . 10 ILE HA . 11325 1 28 . 1 1 10 10 ILE HB H 1 1.821 0.030 . 1 . . . . 10 ILE HB . 11325 1 29 . 1 1 10 10 ILE HD11 H 1 0.813 0.030 . 1 . . . . 10 ILE HD1 . 11325 1 30 . 1 1 10 10 ILE HD12 H 1 0.813 0.030 . 1 . . . . 10 ILE HD1 . 11325 1 31 . 1 1 10 10 ILE HD13 H 1 0.813 0.030 . 1 . . . . 10 ILE HD1 . 11325 1 32 . 1 1 10 10 ILE HG12 H 1 1.139 0.030 . 2 . . . . 10 ILE HG12 . 11325 1 33 . 1 1 10 10 ILE HG13 H 1 1.412 0.030 . 2 . . . . 10 ILE HG13 . 11325 1 34 . 1 1 10 10 ILE HG21 H 1 0.848 0.030 . 1 . . . . 10 ILE HG2 . 11325 1 35 . 1 1 10 10 ILE HG22 H 1 0.848 0.030 . 1 . . . . 10 ILE HG2 . 11325 1 36 . 1 1 10 10 ILE HG23 H 1 0.848 0.030 . 1 . . . . 10 ILE HG2 . 11325 1 37 . 1 1 10 10 ILE C C 13 175.267 0.300 . 1 . . . . 10 ILE C . 11325 1 38 . 1 1 10 10 ILE CA C 13 60.988 0.300 . 1 . . . . 10 ILE CA . 11325 1 39 . 1 1 10 10 ILE CB C 13 38.776 0.300 . 1 . . . . 10 ILE CB . 11325 1 40 . 1 1 10 10 ILE CD1 C 13 12.920 0.300 . 1 . . . . 10 ILE CD1 . 11325 1 41 . 1 1 10 10 ILE CG1 C 13 27.173 0.300 . 1 . . . . 10 ILE CG1 . 11325 1 42 . 1 1 10 10 ILE CG2 C 13 17.500 0.300 . 1 . . . . 10 ILE CG2 . 11325 1 43 . 1 1 10 10 ILE N N 15 123.061 0.300 . 1 . . . . 10 ILE N . 11325 1 44 . 1 1 11 11 THR H H 1 7.995 0.030 . 1 . . . . 11 THR H . 11325 1 45 . 1 1 11 11 THR HA H 1 4.099 0.030 . 1 . . . . 11 THR HA . 11325 1 46 . 1 1 11 11 THR HB H 1 4.022 0.030 . 1 . . . . 11 THR HB . 11325 1 47 . 1 1 11 11 THR HG21 H 1 1.135 0.030 . 1 . . . . 11 THR HG2 . 11325 1 48 . 1 1 11 11 THR HG22 H 1 1.135 0.030 . 1 . . . . 11 THR HG2 . 11325 1 49 . 1 1 11 11 THR HG23 H 1 1.135 0.030 . 1 . . . . 11 THR HG2 . 11325 1 50 . 1 1 11 11 THR C C 13 172.559 0.300 . 1 . . . . 11 THR C . 11325 1 51 . 1 1 11 11 THR CA C 13 61.144 0.300 . 1 . . . . 11 THR CA . 11325 1 52 . 1 1 11 11 THR CB C 13 70.664 0.300 . 1 . . . . 11 THR CB . 11325 1 53 . 1 1 11 11 THR CG2 C 13 20.760 0.300 . 1 . . . . 11 THR CG2 . 11325 1 54 . 1 1 11 11 THR N N 15 118.680 0.300 . 1 . . . . 11 THR N . 11325 1 55 . 1 1 12 12 PRO HA H 1 4.277 0.030 . 1 . . . . 12 PRO HA . 11325 1 56 . 1 1 12 12 PRO HB2 H 1 1.780 0.030 . 1 . . . . 12 PRO HB2 . 11325 1 57 . 1 1 12 12 PRO HB3 H 1 1.780 0.030 . 1 . . . . 12 PRO HB3 . 11325 1 58 . 1 1 12 12 PRO HD2 H 1 3.733 0.030 . 2 . . . . 12 PRO HD2 . 11325 1 59 . 1 1 12 12 PRO HD3 H 1 3.675 0.030 . 2 . . . . 12 PRO HD3 . 11325 1 60 . 1 1 12 12 PRO HG2 H 1 1.903 0.030 . 2 . . . . 12 PRO HG2 . 11325 1 61 . 1 1 12 12 PRO HG3 H 1 1.708 0.030 . 2 . . . . 12 PRO HG3 . 11325 1 62 . 1 1 12 12 PRO C C 13 176.807 0.300 . 1 . . . . 12 PRO C . 11325 1 63 . 1 1 12 12 PRO CA C 13 63.009 0.300 . 1 . . . . 12 PRO CA . 11325 1 64 . 1 1 12 12 PRO CB C 13 31.941 0.300 . 1 . . . . 12 PRO CB . 11325 1 65 . 1 1 12 12 PRO CD C 13 50.997 0.300 . 1 . . . . 12 PRO CD . 11325 1 66 . 1 1 12 12 PRO CG C 13 27.125 0.300 . 1 . . . . 12 PRO CG . 11325 1 67 . 1 1 13 13 SER H H 1 8.936 0.030 . 1 . . . . 13 SER H . 11325 1 68 . 1 1 13 13 SER HA H 1 4.482 0.030 . 1 . . . . 13 SER HA . 11325 1 69 . 1 1 13 13 SER HB2 H 1 3.894 0.030 . 2 . . . . 13 SER HB2 . 11325 1 70 . 1 1 13 13 SER HB3 H 1 3.844 0.030 . 2 . . . . 13 SER HB3 . 11325 1 71 . 1 1 13 13 SER C C 13 175.138 0.300 . 1 . . . . 13 SER C . 11325 1 72 . 1 1 13 13 SER CA C 13 58.511 0.300 . 1 . . . . 13 SER CA . 11325 1 73 . 1 1 13 13 SER CB C 13 63.994 0.300 . 1 . . . . 13 SER CB . 11325 1 74 . 1 1 13 13 SER N N 15 118.095 0.300 . 1 . . . . 13 SER N . 11325 1 75 . 1 1 14 14 SER H H 1 8.468 0.030 . 1 . . . . 14 SER H . 11325 1 76 . 1 1 14 14 SER HA H 1 4.326 0.030 . 1 . . . . 14 SER HA . 11325 1 77 . 1 1 14 14 SER HB2 H 1 3.840 0.030 . 1 . . . . 14 SER HB2 . 11325 1 78 . 1 1 14 14 SER HB3 H 1 3.840 0.030 . 1 . . . . 14 SER HB3 . 11325 1 79 . 1 1 14 14 SER C C 13 174.522 0.300 . 1 . . . . 14 SER C . 11325 1 80 . 1 1 14 14 SER CA C 13 59.276 0.300 . 1 . . . . 14 SER CA . 11325 1 81 . 1 1 14 14 SER CB C 13 63.506 0.300 . 1 . . . . 14 SER CB . 11325 1 82 . 1 1 14 14 SER N N 15 117.339 0.300 . 1 . . . . 14 SER N . 11325 1 83 . 1 1 15 15 GLN H H 1 8.169 0.030 . 1 . . . . 15 GLN H . 11325 1 84 . 1 1 15 15 GLN HA H 1 4.338 0.030 . 1 . . . . 15 GLN HA . 11325 1 85 . 1 1 15 15 GLN HB2 H 1 2.077 0.030 . 2 . . . . 15 GLN HB2 . 11325 1 86 . 1 1 15 15 GLN HB3 H 1 1.828 0.030 . 2 . . . . 15 GLN HB3 . 11325 1 87 . 1 1 15 15 GLN HE21 H 1 7.534 0.030 . 2 . . . . 15 GLN HE21 . 11325 1 88 . 1 1 15 15 GLN HE22 H 1 6.792 0.030 . 2 . . . . 15 GLN HE22 . 11325 1 89 . 1 1 15 15 GLN HG2 H 1 2.282 0.030 . 1 . . . . 15 GLN HG2 . 11325 1 90 . 1 1 15 15 GLN HG3 H 1 2.282 0.030 . 1 . . . . 15 GLN HG3 . 11325 1 91 . 1 1 15 15 GLN C C 13 175.661 0.300 . 1 . . . . 15 GLN C . 11325 1 92 . 1 1 15 15 GLN CA C 13 55.273 0.300 . 1 . . . . 15 GLN CA . 11325 1 93 . 1 1 15 15 GLN CB C 13 29.666 0.300 . 1 . . . . 15 GLN CB . 11325 1 94 . 1 1 15 15 GLN CG C 13 34.054 0.300 . 1 . . . . 15 GLN CG . 11325 1 95 . 1 1 15 15 GLN N N 15 120.000 0.300 . 1 . . . . 15 GLN N . 11325 1 96 . 1 1 15 15 GLN NE2 N 15 112.630 0.300 . 1 . . . . 15 GLN NE2 . 11325 1 97 . 1 1 16 16 ASP H H 1 7.898 0.030 . 1 . . . . 16 ASP H . 11325 1 98 . 1 1 16 16 ASP HA H 1 4.525 0.030 . 1 . . . . 16 ASP HA . 11325 1 99 . 1 1 16 16 ASP HB2 H 1 2.034 0.030 . 2 . . . . 16 ASP HB2 . 11325 1 100 . 1 1 16 16 ASP HB3 H 1 2.160 0.030 . 2 . . . . 16 ASP HB3 . 11325 1 101 . 1 1 16 16 ASP C C 13 174.796 0.300 . 1 . . . . 16 ASP C . 11325 1 102 . 1 1 16 16 ASP CA C 13 55.128 0.300 . 1 . . . . 16 ASP CA . 11325 1 103 . 1 1 16 16 ASP CB C 13 41.710 0.300 . 1 . . . . 16 ASP CB . 11325 1 104 . 1 1 16 16 ASP N N 15 122.219 0.300 . 1 . . . . 16 ASP N . 11325 1 105 . 1 1 17 17 ILE H H 1 8.207 0.030 . 1 . . . . 17 ILE H . 11325 1 106 . 1 1 17 17 ILE HA H 1 4.400 0.030 . 1 . . . . 17 ILE HA . 11325 1 107 . 1 1 17 17 ILE HB H 1 1.242 0.030 . 1 . . . . 17 ILE HB . 11325 1 108 . 1 1 17 17 ILE HD11 H 1 0.664 0.030 . 1 . . . . 17 ILE HD1 . 11325 1 109 . 1 1 17 17 ILE HD12 H 1 0.664 0.030 . 1 . . . . 17 ILE HD1 . 11325 1 110 . 1 1 17 17 ILE HD13 H 1 0.664 0.030 . 1 . . . . 17 ILE HD1 . 11325 1 111 . 1 1 17 17 ILE HG12 H 1 0.961 0.030 . 2 . . . . 17 ILE HG12 . 11325 1 112 . 1 1 17 17 ILE HG13 H 1 1.088 0.030 . 2 . . . . 17 ILE HG13 . 11325 1 113 . 1 1 17 17 ILE HG21 H 1 0.612 0.030 . 1 . . . . 17 ILE HG2 . 11325 1 114 . 1 1 17 17 ILE HG22 H 1 0.612 0.030 . 1 . . . . 17 ILE HG2 . 11325 1 115 . 1 1 17 17 ILE HG23 H 1 0.612 0.030 . 1 . . . . 17 ILE HG2 . 11325 1 116 . 1 1 17 17 ILE C C 13 173.838 0.300 . 1 . . . . 17 ILE C . 11325 1 117 . 1 1 17 17 ILE CA C 13 58.777 0.300 . 1 . . . . 17 ILE CA . 11325 1 118 . 1 1 17 17 ILE CB C 13 43.250 0.300 . 1 . . . . 17 ILE CB . 11325 1 119 . 1 1 17 17 ILE CD1 C 13 13.451 0.300 . 1 . . . . 17 ILE CD1 . 11325 1 120 . 1 1 17 17 ILE CG1 C 13 24.744 0.300 . 1 . . . . 17 ILE CG1 . 11325 1 121 . 1 1 17 17 ILE CG2 C 13 18.382 0.300 . 1 . . . . 17 ILE CG2 . 11325 1 122 . 1 1 17 17 ILE N N 15 112.783 0.300 . 1 . . . . 17 ILE N . 11325 1 123 . 1 1 18 18 CYS H H 1 7.976 0.030 . 1 . . . . 18 CYS H . 11325 1 124 . 1 1 18 18 CYS HA H 1 3.937 0.030 . 1 . . . . 18 CYS HA . 11325 1 125 . 1 1 18 18 CYS HB2 H 1 3.253 0.030 . 2 . . . . 18 CYS HB2 . 11325 1 126 . 1 1 18 18 CYS HB3 H 1 1.902 0.030 . 2 . . . . 18 CYS HB3 . 11325 1 127 . 1 1 18 18 CYS C C 13 177.615 0.300 . 1 . . . . 18 CYS C . 11325 1 128 . 1 1 18 18 CYS CA C 13 57.763 0.300 . 1 . . . . 18 CYS CA . 11325 1 129 . 1 1 18 18 CYS CB C 13 31.842 0.300 . 1 . . . . 18 CYS CB . 11325 1 130 . 1 1 18 18 CYS N N 15 122.572 0.300 . 1 . . . . 18 CYS N . 11325 1 131 . 1 1 19 19 ARG H H 1 9.195 0.030 . 1 . . . . 19 ARG H . 11325 1 132 . 1 1 19 19 ARG HA H 1 4.220 0.030 . 1 . . . . 19 ARG HA . 11325 1 133 . 1 1 19 19 ARG HB2 H 1 1.855 0.030 . 2 . . . . 19 ARG HB2 . 11325 1 134 . 1 1 19 19 ARG HB3 H 1 2.008 0.030 . 2 . . . . 19 ARG HB3 . 11325 1 135 . 1 1 19 19 ARG HD2 H 1 2.919 0.030 . 2 . . . . 19 ARG HD2 . 11325 1 136 . 1 1 19 19 ARG HD3 H 1 3.028 0.030 . 2 . . . . 19 ARG HD3 . 11325 1 137 . 1 1 19 19 ARG HG2 H 1 1.324 0.030 . 2 . . . . 19 ARG HG2 . 11325 1 138 . 1 1 19 19 ARG HG3 H 1 1.617 0.030 . 2 . . . . 19 ARG HG3 . 11325 1 139 . 1 1 19 19 ARG C C 13 175.187 0.300 . 1 . . . . 19 ARG C . 11325 1 140 . 1 1 19 19 ARG CA C 13 57.912 0.300 . 1 . . . . 19 ARG CA . 11325 1 141 . 1 1 19 19 ARG CB C 13 29.262 0.300 . 1 . . . . 19 ARG CB . 11325 1 142 . 1 1 19 19 ARG CD C 13 43.770 0.300 . 1 . . . . 19 ARG CD . 11325 1 143 . 1 1 19 19 ARG CG C 13 26.110 0.300 . 1 . . . . 19 ARG CG . 11325 1 144 . 1 1 19 19 ARG N N 15 128.057 0.300 . 1 . . . . 19 ARG N . 11325 1 145 . 1 1 20 20 ILE H H 1 8.746 0.030 . 1 . . . . 20 ILE H . 11325 1 146 . 1 1 20 20 ILE HA H 1 3.875 0.030 . 1 . . . . 20 ILE HA . 11325 1 147 . 1 1 20 20 ILE HB H 1 1.601 0.030 . 1 . . . . 20 ILE HB . 11325 1 148 . 1 1 20 20 ILE HD11 H 1 0.441 0.030 . 1 . . . . 20 ILE HD1 . 11325 1 149 . 1 1 20 20 ILE HD12 H 1 0.441 0.030 . 1 . . . . 20 ILE HD1 . 11325 1 150 . 1 1 20 20 ILE HD13 H 1 0.441 0.030 . 1 . . . . 20 ILE HD1 . 11325 1 151 . 1 1 20 20 ILE HG12 H 1 0.630 0.030 . 2 . . . . 20 ILE HG12 . 11325 1 152 . 1 1 20 20 ILE HG13 H 1 1.290 0.030 . 2 . . . . 20 ILE HG13 . 11325 1 153 . 1 1 20 20 ILE HG21 H 1 0.883 0.030 . 1 . . . . 20 ILE HG2 . 11325 1 154 . 1 1 20 20 ILE HG22 H 1 0.883 0.030 . 1 . . . . 20 ILE HG2 . 11325 1 155 . 1 1 20 20 ILE HG23 H 1 0.883 0.030 . 1 . . . . 20 ILE HG2 . 11325 1 156 . 1 1 20 20 ILE C C 13 175.971 0.300 . 1 . . . . 20 ILE C . 11325 1 157 . 1 1 20 20 ILE CA C 13 63.887 0.300 . 1 . . . . 20 ILE CA . 11325 1 158 . 1 1 20 20 ILE CB C 13 39.135 0.300 . 1 . . . . 20 ILE CB . 11325 1 159 . 1 1 20 20 ILE CD1 C 13 12.968 0.300 . 1 . . . . 20 ILE CD1 . 11325 1 160 . 1 1 20 20 ILE CG1 C 13 28.739 0.300 . 1 . . . . 20 ILE CG1 . 11325 1 161 . 1 1 20 20 ILE CG2 C 13 16.383 0.300 . 1 . . . . 20 ILE CG2 . 11325 1 162 . 1 1 20 20 ILE N N 15 122.133 0.300 . 1 . . . . 20 ILE N . 11325 1 163 . 1 1 21 21 CYS H H 1 8.241 0.030 . 1 . . . . 21 CYS H . 11325 1 164 . 1 1 21 21 CYS HA H 1 4.755 0.030 . 1 . . . . 21 CYS HA . 11325 1 165 . 1 1 21 21 CYS HB2 H 1 3.355 0.030 . 2 . . . . 21 CYS HB2 . 11325 1 166 . 1 1 21 21 CYS HB3 H 1 2.991 0.030 . 2 . . . . 21 CYS HB3 . 11325 1 167 . 1 1 21 21 CYS C C 13 175.971 0.300 . 1 . . . . 21 CYS C . 11325 1 168 . 1 1 21 21 CYS CA C 13 58.689 0.300 . 1 . . . . 21 CYS CA . 11325 1 169 . 1 1 21 21 CYS CB C 13 31.764 0.300 . 1 . . . . 21 CYS CB . 11325 1 170 . 1 1 21 21 CYS N N 15 117.901 0.300 . 1 . . . . 21 CYS N . 11325 1 171 . 1 1 22 22 HIS H H 1 8.025 0.030 . 1 . . . . 22 HIS H . 11325 1 172 . 1 1 22 22 HIS HA H 1 4.467 0.030 . 1 . . . . 22 HIS HA . 11325 1 173 . 1 1 22 22 HIS HB2 H 1 3.423 0.030 . 2 . . . . 22 HIS HB2 . 11325 1 174 . 1 1 22 22 HIS HB3 H 1 3.576 0.030 . 2 . . . . 22 HIS HB3 . 11325 1 175 . 1 1 22 22 HIS HD2 H 1 7.068 0.030 . 1 . . . . 22 HIS HD2 . 11325 1 176 . 1 1 22 22 HIS C C 13 173.614 0.300 . 1 . . . . 22 HIS C . 11325 1 177 . 1 1 22 22 HIS CA C 13 56.940 0.300 . 1 . . . . 22 HIS CA . 11325 1 178 . 1 1 22 22 HIS CB C 13 26.213 0.300 . 1 . . . . 22 HIS CB . 11325 1 179 . 1 1 22 22 HIS CD2 C 13 118.921 0.300 . 1 . . . . 22 HIS CD2 . 11325 1 180 . 1 1 22 22 HIS N N 15 116.291 0.300 . 1 . . . . 22 HIS N . 11325 1 181 . 1 1 23 23 CYS H H 1 8.343 0.030 . 1 . . . . 23 CYS H . 11325 1 182 . 1 1 23 23 CYS HA H 1 4.973 0.030 . 1 . . . . 23 CYS HA . 11325 1 183 . 1 1 23 23 CYS HB2 H 1 3.142 0.030 . 2 . . . . 23 CYS HB2 . 11325 1 184 . 1 1 23 23 CYS HB3 H 1 3.282 0.030 . 2 . . . . 23 CYS HB3 . 11325 1 185 . 1 1 23 23 CYS C C 13 174.615 0.300 . 1 . . . . 23 CYS C . 11325 1 186 . 1 1 23 23 CYS CA C 13 58.584 0.300 . 1 . . . . 23 CYS CA . 11325 1 187 . 1 1 23 23 CYS CB C 13 30.642 0.300 . 1 . . . . 23 CYS CB . 11325 1 188 . 1 1 23 23 CYS N N 15 116.427 0.300 . 1 . . . . 23 CYS N . 11325 1 189 . 1 1 24 24 GLU H H 1 9.032 0.030 . 1 . . . . 24 GLU H . 11325 1 190 . 1 1 24 24 GLU HA H 1 4.505 0.030 . 1 . . . . 24 GLU HA . 11325 1 191 . 1 1 24 24 GLU HB2 H 1 2.330 0.030 . 2 . . . . 24 GLU HB2 . 11325 1 192 . 1 1 24 24 GLU HB3 H 1 2.041 0.030 . 2 . . . . 24 GLU HB3 . 11325 1 193 . 1 1 24 24 GLU HG2 H 1 2.323 0.030 . 2 . . . . 24 GLU HG2 . 11325 1 194 . 1 1 24 24 GLU HG3 H 1 2.364 0.030 . 2 . . . . 24 GLU HG3 . 11325 1 195 . 1 1 24 24 GLU C C 13 178.365 0.300 . 1 . . . . 24 GLU C . 11325 1 196 . 1 1 24 24 GLU CA C 13 56.688 0.300 . 1 . . . . 24 GLU CA . 11325 1 197 . 1 1 24 24 GLU CB C 13 31.346 0.300 . 1 . . . . 24 GLU CB . 11325 1 198 . 1 1 24 24 GLU CG C 13 36.735 0.300 . 1 . . . . 24 GLU CG . 11325 1 199 . 1 1 24 24 GLU N N 15 120.644 0.300 . 1 . . . . 24 GLU N . 11325 1 200 . 1 1 25 25 GLY H H 1 8.997 0.030 . 1 . . . . 25 GLY H . 11325 1 201 . 1 1 25 25 GLY HA2 H 1 4.567 0.030 . 2 . . . . 25 GLY HA2 . 11325 1 202 . 1 1 25 25 GLY HA3 H 1 3.691 0.030 . 2 . . . . 25 GLY HA3 . 11325 1 203 . 1 1 25 25 GLY C C 13 172.050 0.300 . 1 . . . . 25 GLY C . 11325 1 204 . 1 1 25 25 GLY CA C 13 44.622 0.300 . 1 . . . . 25 GLY CA . 11325 1 205 . 1 1 25 25 GLY N N 15 108.482 0.300 . 1 . . . . 25 GLY N . 11325 1 206 . 1 1 26 26 ASP H H 1 7.853 0.030 . 1 . . . . 26 ASP H . 11325 1 207 . 1 1 26 26 ASP HA H 1 4.636 0.030 . 1 . . . . 26 ASP HA . 11325 1 208 . 1 1 26 26 ASP HB2 H 1 3.012 0.030 . 2 . . . . 26 ASP HB2 . 11325 1 209 . 1 1 26 26 ASP HB3 H 1 2.704 0.030 . 2 . . . . 26 ASP HB3 . 11325 1 210 . 1 1 26 26 ASP C C 13 176.133 0.300 . 1 . . . . 26 ASP C . 11325 1 211 . 1 1 26 26 ASP CA C 13 53.329 0.300 . 1 . . . . 26 ASP CA . 11325 1 212 . 1 1 26 26 ASP CB C 13 42.115 0.300 . 1 . . . . 26 ASP CB . 11325 1 213 . 1 1 26 26 ASP N N 15 119.779 0.300 . 1 . . . . 26 ASP N . 11325 1 214 . 1 1 27 27 ASP H H 1 8.223 0.030 . 1 . . . . 27 ASP H . 11325 1 215 . 1 1 27 27 ASP HA H 1 4.257 0.030 . 1 . . . . 27 ASP HA . 11325 1 216 . 1 1 27 27 ASP HB2 H 1 2.567 0.030 . 2 . . . . 27 ASP HB2 . 11325 1 217 . 1 1 27 27 ASP HB3 H 1 2.623 0.030 . 2 . . . . 27 ASP HB3 . 11325 1 218 . 1 1 27 27 ASP C C 13 177.760 0.300 . 1 . . . . 27 ASP C . 11325 1 219 . 1 1 27 27 ASP CA C 13 57.232 0.300 . 1 . . . . 27 ASP CA . 11325 1 220 . 1 1 27 27 ASP CB C 13 40.570 0.300 . 1 . . . . 27 ASP CB . 11325 1 221 . 1 1 27 27 ASP N N 15 116.042 0.300 . 1 . . . . 27 ASP N . 11325 1 222 . 1 1 28 28 GLU H H 1 8.035 0.030 . 1 . . . . 28 GLU H . 11325 1 223 . 1 1 28 28 GLU HA H 1 4.227 0.030 . 1 . . . . 28 GLU HA . 11325 1 224 . 1 1 28 28 GLU HB2 H 1 2.065 0.030 . 2 . . . . 28 GLU HB2 . 11325 1 225 . 1 1 28 28 GLU HB3 H 1 1.969 0.030 . 2 . . . . 28 GLU HB3 . 11325 1 226 . 1 1 28 28 GLU HG2 H 1 2.245 0.030 . 2 . . . . 28 GLU HG2 . 11325 1 227 . 1 1 28 28 GLU HG3 H 1 2.200 0.030 . 2 . . . . 28 GLU HG3 . 11325 1 228 . 1 1 28 28 GLU C C 13 176.900 0.300 . 1 . . . . 28 GLU C . 11325 1 229 . 1 1 28 28 GLU CA C 13 57.763 0.300 . 1 . . . . 28 GLU CA . 11325 1 230 . 1 1 28 28 GLU CB C 13 30.265 0.300 . 1 . . . . 28 GLU CB . 11325 1 231 . 1 1 28 28 GLU CG C 13 36.827 0.300 . 1 . . . . 28 GLU CG . 11325 1 232 . 1 1 28 28 GLU N N 15 117.828 0.300 . 1 . . . . 28 GLU N . 11325 1 233 . 1 1 29 29 SER H H 1 8.113 0.030 . 1 . . . . 29 SER H . 11325 1 234 . 1 1 29 29 SER HA H 1 4.822 0.030 . 1 . . . . 29 SER HA . 11325 1 235 . 1 1 29 29 SER HB2 H 1 3.743 0.030 . 1 . . . . 29 SER HB2 . 11325 1 236 . 1 1 29 29 SER HB3 H 1 3.743 0.030 . 1 . . . . 29 SER HB3 . 11325 1 237 . 1 1 29 29 SER C C 13 171.223 0.300 . 1 . . . . 29 SER C . 11325 1 238 . 1 1 29 29 SER CA C 13 54.452 0.300 . 1 . . . . 29 SER CA . 11325 1 239 . 1 1 29 29 SER CB C 13 63.247 0.300 . 1 . . . . 29 SER CB . 11325 1 240 . 1 1 29 29 SER N N 15 115.458 0.300 . 1 . . . . 29 SER N . 11325 1 241 . 1 1 30 30 PRO HA H 1 4.674 0.030 . 1 . . . . 30 PRO HA . 11325 1 242 . 1 1 30 30 PRO HB2 H 1 2.287 0.030 . 2 . . . . 30 PRO HB2 . 11325 1 243 . 1 1 30 30 PRO HB3 H 1 1.839 0.030 . 2 . . . . 30 PRO HB3 . 11325 1 244 . 1 1 30 30 PRO HD2 H 1 3.406 0.030 . 2 . . . . 30 PRO HD2 . 11325 1 245 . 1 1 30 30 PRO HD3 H 1 3.689 0.030 . 2 . . . . 30 PRO HD3 . 11325 1 246 . 1 1 30 30 PRO HG2 H 1 2.008 0.030 . 2 . . . . 30 PRO HG2 . 11325 1 247 . 1 1 30 30 PRO HG3 H 1 1.859 0.030 . 2 . . . . 30 PRO HG3 . 11325 1 248 . 1 1 30 30 PRO C C 13 177.392 0.300 . 1 . . . . 30 PRO C . 11325 1 249 . 1 1 30 30 PRO CA C 13 62.389 0.300 . 1 . . . . 30 PRO CA . 11325 1 250 . 1 1 30 30 PRO CB C 13 32.755 0.300 . 1 . . . . 30 PRO CB . 11325 1 251 . 1 1 30 30 PRO CD C 13 50.312 0.300 . 1 . . . . 30 PRO CD . 11325 1 252 . 1 1 30 30 PRO CG C 13 27.107 0.300 . 1 . . . . 30 PRO CG . 11325 1 253 . 1 1 31 31 LEU H H 1 8.511 0.030 . 1 . . . . 31 LEU H . 11325 1 254 . 1 1 31 31 LEU HA H 1 4.400 0.030 . 1 . . . . 31 LEU HA . 11325 1 255 . 1 1 31 31 LEU HB2 H 1 1.358 0.030 . 2 . . . . 31 LEU HB2 . 11325 1 256 . 1 1 31 31 LEU HB3 H 1 0.855 0.030 . 2 . . . . 31 LEU HB3 . 11325 1 257 . 1 1 31 31 LEU HD11 H 1 0.231 0.030 . 1 . . . . 31 LEU HD1 . 11325 1 258 . 1 1 31 31 LEU HD12 H 1 0.231 0.030 . 1 . . . . 31 LEU HD1 . 11325 1 259 . 1 1 31 31 LEU HD13 H 1 0.231 0.030 . 1 . . . . 31 LEU HD1 . 11325 1 260 . 1 1 31 31 LEU HD21 H 1 -0.101 0.030 . 1 . . . . 31 LEU HD2 . 11325 1 261 . 1 1 31 31 LEU HD22 H 1 -0.101 0.030 . 1 . . . . 31 LEU HD2 . 11325 1 262 . 1 1 31 31 LEU HD23 H 1 -0.101 0.030 . 1 . . . . 31 LEU HD2 . 11325 1 263 . 1 1 31 31 LEU HG H 1 1.184 0.030 . 1 . . . . 31 LEU HG . 11325 1 264 . 1 1 31 31 LEU C C 13 176.934 0.300 . 1 . . . . 31 LEU C . 11325 1 265 . 1 1 31 31 LEU CA C 13 54.025 0.300 . 1 . . . . 31 LEU CA . 11325 1 266 . 1 1 31 31 LEU CB C 13 41.609 0.300 . 1 . . . . 31 LEU CB . 11325 1 267 . 1 1 31 31 LEU CD1 C 13 25.428 0.300 . 2 . . . . 31 LEU CD1 . 11325 1 268 . 1 1 31 31 LEU CD2 C 13 21.205 0.300 . 2 . . . . 31 LEU CD2 . 11325 1 269 . 1 1 31 31 LEU CG C 13 26.339 0.300 . 1 . . . . 31 LEU CG . 11325 1 270 . 1 1 31 31 LEU N N 15 118.039 0.300 . 1 . . . . 31 LEU N . 11325 1 271 . 1 1 32 32 ILE H H 1 9.107 0.030 . 1 . . . . 32 ILE H . 11325 1 272 . 1 1 32 32 ILE HA H 1 4.787 0.030 . 1 . . . . 32 ILE HA . 11325 1 273 . 1 1 32 32 ILE HB H 1 1.991 0.030 . 1 . . . . 32 ILE HB . 11325 1 274 . 1 1 32 32 ILE HD11 H 1 0.787 0.030 . 1 . . . . 32 ILE HD1 . 11325 1 275 . 1 1 32 32 ILE HD12 H 1 0.787 0.030 . 1 . . . . 32 ILE HD1 . 11325 1 276 . 1 1 32 32 ILE HD13 H 1 0.787 0.030 . 1 . . . . 32 ILE HD1 . 11325 1 277 . 1 1 32 32 ILE HG12 H 1 1.189 0.030 . 1 . . . . 32 ILE HG12 . 11325 1 278 . 1 1 32 32 ILE HG13 H 1 1.189 0.030 . 1 . . . . 32 ILE HG13 . 11325 1 279 . 1 1 32 32 ILE HG21 H 1 0.906 0.030 . 1 . . . . 32 ILE HG2 . 11325 1 280 . 1 1 32 32 ILE HG22 H 1 0.906 0.030 . 1 . . . . 32 ILE HG2 . 11325 1 281 . 1 1 32 32 ILE HG23 H 1 0.906 0.030 . 1 . . . . 32 ILE HG2 . 11325 1 282 . 1 1 32 32 ILE C C 13 175.319 0.300 . 1 . . . . 32 ILE C . 11325 1 283 . 1 1 32 32 ILE CA C 13 59.044 0.300 . 1 . . . . 32 ILE CA . 11325 1 284 . 1 1 32 32 ILE CB C 13 42.003 0.300 . 1 . . . . 32 ILE CB . 11325 1 285 . 1 1 32 32 ILE CD1 C 13 14.494 0.300 . 1 . . . . 32 ILE CD1 . 11325 1 286 . 1 1 32 32 ILE CG1 C 13 26.359 0.300 . 1 . . . . 32 ILE CG1 . 11325 1 287 . 1 1 32 32 ILE CG2 C 13 18.278 0.300 . 1 . . . . 32 ILE CG2 . 11325 1 288 . 1 1 32 32 ILE N N 15 116.736 0.300 . 1 . . . . 32 ILE N . 11325 1 289 . 1 1 33 33 THR H H 1 8.444 0.030 . 1 . . . . 33 THR H . 11325 1 290 . 1 1 33 33 THR HA H 1 4.992 0.030 . 1 . . . . 33 THR HA . 11325 1 291 . 1 1 33 33 THR HB H 1 4.017 0.030 . 1 . . . . 33 THR HB . 11325 1 292 . 1 1 33 33 THR HG21 H 1 0.988 0.030 . 1 . . . . 33 THR HG2 . 11325 1 293 . 1 1 33 33 THR HG22 H 1 0.988 0.030 . 1 . . . . 33 THR HG2 . 11325 1 294 . 1 1 33 33 THR HG23 H 1 0.988 0.030 . 1 . . . . 33 THR HG2 . 11325 1 295 . 1 1 33 33 THR C C 13 175.795 0.300 . 1 . . . . 33 THR C . 11325 1 296 . 1 1 33 33 THR CA C 13 57.611 0.300 . 1 . . . . 33 THR CA . 11325 1 297 . 1 1 33 33 THR CB C 13 69.727 0.300 . 1 . . . . 33 THR CB . 11325 1 298 . 1 1 33 33 THR CG2 C 13 21.872 0.300 . 1 . . . . 33 THR CG2 . 11325 1 299 . 1 1 33 33 THR N N 15 114.986 0.300 . 1 . . . . 33 THR N . 11325 1 300 . 1 1 34 34 PRO HA H 1 4.662 0.030 . 1 . . . . 34 PRO HA . 11325 1 301 . 1 1 34 34 PRO HB2 H 1 2.195 0.030 . 2 . . . . 34 PRO HB2 . 11325 1 302 . 1 1 34 34 PRO HB3 H 1 1.832 0.030 . 2 . . . . 34 PRO HB3 . 11325 1 303 . 1 1 34 34 PRO HD2 H 1 4.190 0.030 . 2 . . . . 34 PRO HD2 . 11325 1 304 . 1 1 34 34 PRO HD3 H 1 3.855 0.030 . 2 . . . . 34 PRO HD3 . 11325 1 305 . 1 1 34 34 PRO HG2 H 1 1.921 0.030 . 2 . . . . 34 PRO HG2 . 11325 1 306 . 1 1 34 34 PRO HG3 H 1 2.265 0.030 . 2 . . . . 34 PRO HG3 . 11325 1 307 . 1 1 34 34 PRO C C 13 174.566 0.300 . 1 . . . . 34 PRO C . 11325 1 308 . 1 1 34 34 PRO CA C 13 63.695 0.300 . 1 . . . . 34 PRO CA . 11325 1 309 . 1 1 34 34 PRO CB C 13 33.606 0.300 . 1 . . . . 34 PRO CB . 11325 1 310 . 1 1 34 34 PRO CD C 13 50.833 0.300 . 1 . . . . 34 PRO CD . 11325 1 311 . 1 1 34 34 PRO CG C 13 26.499 0.300 . 1 . . . . 34 PRO CG . 11325 1 312 . 1 1 35 35 CYS H H 1 7.718 0.030 . 1 . . . . 35 CYS H . 11325 1 313 . 1 1 35 35 CYS HA H 1 4.525 0.030 . 1 . . . . 35 CYS HA . 11325 1 314 . 1 1 35 35 CYS HB2 H 1 3.038 0.030 . 2 . . . . 35 CYS HB2 . 11325 1 315 . 1 1 35 35 CYS HB3 H 1 2.784 0.030 . 2 . . . . 35 CYS HB3 . 11325 1 316 . 1 1 35 35 CYS C C 13 173.985 0.300 . 1 . . . . 35 CYS C . 11325 1 317 . 1 1 35 35 CYS CA C 13 57.961 0.300 . 1 . . . . 35 CYS CA . 11325 1 318 . 1 1 35 35 CYS CB C 13 30.756 0.300 . 1 . . . . 35 CYS CB . 11325 1 319 . 1 1 35 35 CYS N N 15 119.015 0.300 . 1 . . . . 35 CYS N . 11325 1 320 . 1 1 36 36 HIS H H 1 8.437 0.030 . 1 . . . . 36 HIS H . 11325 1 321 . 1 1 36 36 HIS HA H 1 4.612 0.030 . 1 . . . . 36 HIS HA . 11325 1 322 . 1 1 36 36 HIS HB2 H 1 3.244 0.030 . 2 . . . . 36 HIS HB2 . 11325 1 323 . 1 1 36 36 HIS HB3 H 1 2.827 0.030 . 2 . . . . 36 HIS HB3 . 11325 1 324 . 1 1 36 36 HIS HD2 H 1 6.713 0.030 . 1 . . . . 36 HIS HD2 . 11325 1 325 . 1 1 36 36 HIS C C 13 175.724 0.300 . 1 . . . . 36 HIS C . 11325 1 326 . 1 1 36 36 HIS CA C 13 55.415 0.300 . 1 . . . . 36 HIS CA . 11325 1 327 . 1 1 36 36 HIS CB C 13 29.599 0.300 . 1 . . . . 36 HIS CB . 11325 1 328 . 1 1 36 36 HIS CD2 C 13 118.230 0.300 . 1 . . . . 36 HIS CD2 . 11325 1 329 . 1 1 36 36 HIS N N 15 119.058 0.300 . 1 . . . . 36 HIS N . 11325 1 330 . 1 1 37 37 CYS H H 1 8.672 0.030 . 1 . . . . 37 CYS H . 11325 1 331 . 1 1 37 37 CYS HA H 1 3.969 0.030 . 1 . . . . 37 CYS HA . 11325 1 332 . 1 1 37 37 CYS HB2 H 1 2.175 0.030 . 2 . . . . 37 CYS HB2 . 11325 1 333 . 1 1 37 37 CYS HB3 H 1 2.264 0.030 . 2 . . . . 37 CYS HB3 . 11325 1 334 . 1 1 37 37 CYS C C 13 175.292 0.300 . 1 . . . . 37 CYS C . 11325 1 335 . 1 1 37 37 CYS CA C 13 63.129 0.300 . 1 . . . . 37 CYS CA . 11325 1 336 . 1 1 37 37 CYS CB C 13 29.425 0.300 . 1 . . . . 37 CYS CB . 11325 1 337 . 1 1 37 37 CYS N N 15 125.681 0.300 . 1 . . . . 37 CYS N . 11325 1 338 . 1 1 38 38 THR H H 1 8.193 0.030 . 1 . . . . 38 THR H . 11325 1 339 . 1 1 38 38 THR HA H 1 4.289 0.030 . 1 . . . . 38 THR HA . 11325 1 340 . 1 1 38 38 THR HB H 1 4.099 0.030 . 1 . . . . 38 THR HB . 11325 1 341 . 1 1 38 38 THR HG21 H 1 1.044 0.030 . 1 . . . . 38 THR HG2 . 11325 1 342 . 1 1 38 38 THR HG22 H 1 1.044 0.030 . 1 . . . . 38 THR HG2 . 11325 1 343 . 1 1 38 38 THR HG23 H 1 1.044 0.030 . 1 . . . . 38 THR HG2 . 11325 1 344 . 1 1 38 38 THR C C 13 174.786 0.300 . 1 . . . . 38 THR C . 11325 1 345 . 1 1 38 38 THR CA C 13 60.324 0.300 . 1 . . . . 38 THR CA . 11325 1 346 . 1 1 38 38 THR CB C 13 71.037 0.300 . 1 . . . . 38 THR CB . 11325 1 347 . 1 1 38 38 THR CG2 C 13 21.204 0.300 . 1 . . . . 38 THR CG2 . 11325 1 348 . 1 1 38 38 THR N N 15 112.303 0.300 . 1 . . . . 38 THR N . 11325 1 349 . 1 1 39 39 GLY H H 1 8.361 0.030 . 1 . . . . 39 GLY H . 11325 1 350 . 1 1 39 39 GLY HA2 H 1 3.777 0.030 . 2 . . . . 39 GLY HA2 . 11325 1 351 . 1 1 39 39 GLY HA3 H 1 4.268 0.030 . 2 . . . . 39 GLY HA3 . 11325 1 352 . 1 1 39 39 GLY C C 13 175.581 0.300 . 1 . . . . 39 GLY C . 11325 1 353 . 1 1 39 39 GLY CA C 13 45.146 0.300 . 1 . . . . 39 GLY CA . 11325 1 354 . 1 1 39 39 GLY N N 15 110.024 0.300 . 1 . . . . 39 GLY N . 11325 1 355 . 1 1 40 40 SER HA H 1 3.886 0.030 . 1 . . . . 40 SER HA . 11325 1 356 . 1 1 40 40 SER HB2 H 1 3.851 0.030 . 1 . . . . 40 SER HB2 . 11325 1 357 . 1 1 40 40 SER HB3 H 1 3.851 0.030 . 1 . . . . 40 SER HB3 . 11325 1 358 . 1 1 40 40 SER C C 13 175.716 0.300 . 1 . . . . 40 SER C . 11325 1 359 . 1 1 40 40 SER CA C 13 60.413 0.300 . 1 . . . . 40 SER CA . 11325 1 360 . 1 1 40 40 SER CB C 13 63.078 0.300 . 1 . . . . 40 SER CB . 11325 1 361 . 1 1 41 41 LEU H H 1 7.945 0.030 . 1 . . . . 41 LEU H . 11325 1 362 . 1 1 41 41 LEU HA H 1 4.282 0.030 . 1 . . . . 41 LEU HA . 11325 1 363 . 1 1 41 41 LEU HB2 H 1 1.405 0.030 . 2 . . . . 41 LEU HB2 . 11325 1 364 . 1 1 41 41 LEU HB3 H 1 1.466 0.030 . 2 . . . . 41 LEU HB3 . 11325 1 365 . 1 1 41 41 LEU HD11 H 1 0.845 0.030 . 1 . . . . 41 LEU HD1 . 11325 1 366 . 1 1 41 41 LEU HD12 H 1 0.845 0.030 . 1 . . . . 41 LEU HD1 . 11325 1 367 . 1 1 41 41 LEU HD13 H 1 0.845 0.030 . 1 . . . . 41 LEU HD1 . 11325 1 368 . 1 1 41 41 LEU HD21 H 1 0.764 0.030 . 1 . . . . 41 LEU HD2 . 11325 1 369 . 1 1 41 41 LEU HD22 H 1 0.764 0.030 . 1 . . . . 41 LEU HD2 . 11325 1 370 . 1 1 41 41 LEU HD23 H 1 0.764 0.030 . 1 . . . . 41 LEU HD2 . 11325 1 371 . 1 1 41 41 LEU HG H 1 1.496 0.030 . 1 . . . . 41 LEU HG . 11325 1 372 . 1 1 41 41 LEU C C 13 176.307 0.300 . 1 . . . . 41 LEU C . 11325 1 373 . 1 1 41 41 LEU CA C 13 55.036 0.300 . 1 . . . . 41 LEU CA . 11325 1 374 . 1 1 41 41 LEU CB C 13 41.333 0.300 . 1 . . . . 41 LEU CB . 11325 1 375 . 1 1 41 41 LEU CD1 C 13 25.266 0.300 . 2 . . . . 41 LEU CD1 . 11325 1 376 . 1 1 41 41 LEU CD2 C 13 22.914 0.300 . 2 . . . . 41 LEU CD2 . 11325 1 377 . 1 1 41 41 LEU CG C 13 26.828 0.300 . 1 . . . . 41 LEU CG . 11325 1 378 . 1 1 41 41 LEU N N 15 121.074 0.300 . 1 . . . . 41 LEU N . 11325 1 379 . 1 1 42 42 HIS H H 1 7.402 0.030 . 1 . . . . 42 HIS H . 11325 1 380 . 1 1 42 42 HIS HA H 1 4.279 0.030 . 1 . . . . 42 HIS HA . 11325 1 381 . 1 1 42 42 HIS HB2 H 1 2.735 0.030 . 2 . . . . 42 HIS HB2 . 11325 1 382 . 1 1 42 42 HIS HB3 H 1 2.868 0.030 . 2 . . . . 42 HIS HB3 . 11325 1 383 . 1 1 42 42 HIS HD2 H 1 6.535 0.030 . 1 . . . . 42 HIS HD2 . 11325 1 384 . 1 1 42 42 HIS C C 13 175.009 0.300 . 1 . . . . 42 HIS C . 11325 1 385 . 1 1 42 42 HIS CA C 13 56.368 0.300 . 1 . . . . 42 HIS CA . 11325 1 386 . 1 1 42 42 HIS CB C 13 31.167 0.300 . 1 . . . . 42 HIS CB . 11325 1 387 . 1 1 42 42 HIS CD2 C 13 120.411 0.300 . 1 . . . . 42 HIS CD2 . 11325 1 388 . 1 1 42 42 HIS N N 15 116.014 0.300 . 1 . . . . 42 HIS N . 11325 1 389 . 1 1 43 43 PHE H H 1 7.670 0.030 . 1 . . . . 43 PHE H . 11325 1 390 . 1 1 43 43 PHE HA H 1 5.092 0.030 . 1 . . . . 43 PHE HA . 11325 1 391 . 1 1 43 43 PHE HB2 H 1 2.798 0.030 . 2 . . . . 43 PHE HB2 . 11325 1 392 . 1 1 43 43 PHE HB3 H 1 2.898 0.030 . 2 . . . . 43 PHE HB3 . 11325 1 393 . 1 1 43 43 PHE HD1 H 1 6.978 0.030 . 1 . . . . 43 PHE HD1 . 11325 1 394 . 1 1 43 43 PHE HD2 H 1 6.978 0.030 . 1 . . . . 43 PHE HD2 . 11325 1 395 . 1 1 43 43 PHE HE1 H 1 7.182 0.030 . 1 . . . . 43 PHE HE1 . 11325 1 396 . 1 1 43 43 PHE HE2 H 1 7.182 0.030 . 1 . . . . 43 PHE HE2 . 11325 1 397 . 1 1 43 43 PHE HZ H 1 7.039 0.030 . 1 . . . . 43 PHE HZ . 11325 1 398 . 1 1 43 43 PHE C C 13 175.743 0.300 . 1 . . . . 43 PHE C . 11325 1 399 . 1 1 43 43 PHE CA C 13 56.616 0.300 . 1 . . . . 43 PHE CA . 11325 1 400 . 1 1 43 43 PHE CB C 13 41.812 0.300 . 1 . . . . 43 PHE CB . 11325 1 401 . 1 1 43 43 PHE CD1 C 13 131.449 0.300 . 1 . . . . 43 PHE CD1 . 11325 1 402 . 1 1 43 43 PHE CD2 C 13 131.449 0.300 . 1 . . . . 43 PHE CD2 . 11325 1 403 . 1 1 43 43 PHE CE1 C 13 131.540 0.300 . 1 . . . . 43 PHE CE1 . 11325 1 404 . 1 1 43 43 PHE CE2 C 13 131.540 0.300 . 1 . . . . 43 PHE CE2 . 11325 1 405 . 1 1 43 43 PHE CZ C 13 129.537 0.300 . 1 . . . . 43 PHE CZ . 11325 1 406 . 1 1 44 44 VAL H H 1 8.822 0.030 . 1 . . . . 44 VAL H . 11325 1 407 . 1 1 44 44 VAL HA H 1 5.435 0.030 . 1 . . . . 44 VAL HA . 11325 1 408 . 1 1 44 44 VAL HB H 1 2.115 0.030 . 1 . . . . 44 VAL HB . 11325 1 409 . 1 1 44 44 VAL HG11 H 1 0.812 0.030 . 1 . . . . 44 VAL HG1 . 11325 1 410 . 1 1 44 44 VAL HG12 H 1 0.812 0.030 . 1 . . . . 44 VAL HG1 . 11325 1 411 . 1 1 44 44 VAL HG13 H 1 0.812 0.030 . 1 . . . . 44 VAL HG1 . 11325 1 412 . 1 1 44 44 VAL HG21 H 1 0.885 0.030 . 1 . . . . 44 VAL HG2 . 11325 1 413 . 1 1 44 44 VAL HG22 H 1 0.885 0.030 . 1 . . . . 44 VAL HG2 . 11325 1 414 . 1 1 44 44 VAL HG23 H 1 0.885 0.030 . 1 . . . . 44 VAL HG2 . 11325 1 415 . 1 1 44 44 VAL C C 13 175.300 0.300 . 1 . . . . 44 VAL C . 11325 1 416 . 1 1 44 44 VAL CA C 13 58.621 0.300 . 1 . . . . 44 VAL CA . 11325 1 417 . 1 1 44 44 VAL CB C 13 36.593 0.300 . 1 . . . . 44 VAL CB . 11325 1 418 . 1 1 44 44 VAL CG1 C 13 22.371 0.300 . 2 . . . . 44 VAL CG1 . 11325 1 419 . 1 1 44 44 VAL CG2 C 13 20.792 0.300 . 2 . . . . 44 VAL CG2 . 11325 1 420 . 1 1 44 44 VAL N N 15 112.246 0.300 . 1 . . . . 44 VAL N . 11325 1 421 . 1 1 45 45 HIS H H 1 8.726 0.030 . 1 . . . . 45 HIS H . 11325 1 422 . 1 1 45 45 HIS HA H 1 4.986 0.030 . 1 . . . . 45 HIS HA . 11325 1 423 . 1 1 45 45 HIS HB2 H 1 3.527 0.030 . 2 . . . . 45 HIS HB2 . 11325 1 424 . 1 1 45 45 HIS HB3 H 1 3.663 0.030 . 2 . . . . 45 HIS HB3 . 11325 1 425 . 1 1 45 45 HIS HD2 H 1 7.298 0.030 . 1 . . . . 45 HIS HD2 . 11325 1 426 . 1 1 45 45 HIS HE1 H 1 7.164 0.030 . 1 . . . . 45 HIS HE1 . 11325 1 427 . 1 1 45 45 HIS C C 13 177.317 0.300 . 1 . . . . 45 HIS C . 11325 1 428 . 1 1 45 45 HIS CA C 13 57.511 0.300 . 1 . . . . 45 HIS CA . 11325 1 429 . 1 1 45 45 HIS CB C 13 31.424 0.300 . 1 . . . . 45 HIS CB . 11325 1 430 . 1 1 45 45 HIS CD2 C 13 119.625 0.300 . 1 . . . . 45 HIS CD2 . 11325 1 431 . 1 1 45 45 HIS CE1 C 13 138.864 0.300 . 1 . . . . 45 HIS CE1 . 11325 1 432 . 1 1 45 45 HIS N N 15 121.392 0.300 . 1 . . . . 45 HIS N . 11325 1 433 . 1 1 46 46 GLN H H 1 9.869 0.030 . 1 . . . . 46 GLN H . 11325 1 434 . 1 1 46 46 GLN HA H 1 3.888 0.030 . 1 . . . . 46 GLN HA . 11325 1 435 . 1 1 46 46 GLN HB2 H 1 2.137 0.030 . 2 . . . . 46 GLN HB2 . 11325 1 436 . 1 1 46 46 GLN HB3 H 1 2.182 0.030 . 2 . . . . 46 GLN HB3 . 11325 1 437 . 1 1 46 46 GLN HE21 H 1 7.473 0.030 . 2 . . . . 46 GLN HE21 . 11325 1 438 . 1 1 46 46 GLN HE22 H 1 6.874 0.030 . 2 . . . . 46 GLN HE22 . 11325 1 439 . 1 1 46 46 GLN HG2 H 1 2.346 0.030 . 2 . . . . 46 GLN HG2 . 11325 1 440 . 1 1 46 46 GLN HG3 H 1 2.428 0.030 . 2 . . . . 46 GLN HG3 . 11325 1 441 . 1 1 46 46 GLN C C 13 178.096 0.300 . 1 . . . . 46 GLN C . 11325 1 442 . 1 1 46 46 GLN CA C 13 60.378 0.300 . 1 . . . . 46 GLN CA . 11325 1 443 . 1 1 46 46 GLN CB C 13 28.429 0.300 . 1 . . . . 46 GLN CB . 11325 1 444 . 1 1 46 46 GLN CG C 13 33.587 0.300 . 1 . . . . 46 GLN CG . 11325 1 445 . 1 1 46 46 GLN N N 15 127.081 0.300 . 1 . . . . 46 GLN N . 11325 1 446 . 1 1 46 46 GLN NE2 N 15 110.806 0.300 . 1 . . . . 46 GLN NE2 . 11325 1 447 . 1 1 47 47 ALA H H 1 9.262 0.030 . 1 . . . . 47 ALA H . 11325 1 448 . 1 1 47 47 ALA HA H 1 4.186 0.030 . 1 . . . . 47 ALA HA . 11325 1 449 . 1 1 47 47 ALA HB1 H 1 1.442 0.030 . 1 . . . . 47 ALA HB . 11325 1 450 . 1 1 47 47 ALA HB2 H 1 1.442 0.030 . 1 . . . . 47 ALA HB . 11325 1 451 . 1 1 47 47 ALA HB3 H 1 1.442 0.030 . 1 . . . . 47 ALA HB . 11325 1 452 . 1 1 47 47 ALA C C 13 181.020 0.300 . 1 . . . . 47 ALA C . 11325 1 453 . 1 1 47 47 ALA CA C 13 55.520 0.300 . 1 . . . . 47 ALA CA . 11325 1 454 . 1 1 47 47 ALA CB C 13 18.098 0.300 . 1 . . . . 47 ALA CB . 11325 1 455 . 1 1 47 47 ALA N N 15 119.327 0.300 . 1 . . . . 47 ALA N . 11325 1 456 . 1 1 48 48 CYS H H 1 6.607 0.030 . 1 . . . . 48 CYS H . 11325 1 457 . 1 1 48 48 CYS HA H 1 4.042 0.030 . 1 . . . . 48 CYS HA . 11325 1 458 . 1 1 48 48 CYS HB2 H 1 2.934 0.030 . 2 . . . . 48 CYS HB2 . 11325 1 459 . 1 1 48 48 CYS HB3 H 1 3.007 0.030 . 2 . . . . 48 CYS HB3 . 11325 1 460 . 1 1 48 48 CYS C C 13 177.609 0.300 . 1 . . . . 48 CYS C . 11325 1 461 . 1 1 48 48 CYS CA C 13 62.762 0.300 . 1 . . . . 48 CYS CA . 11325 1 462 . 1 1 48 48 CYS CB C 13 28.985 0.300 . 1 . . . . 48 CYS CB . 11325 1 463 . 1 1 48 48 CYS N N 15 116.156 0.300 . 1 . . . . 48 CYS N . 11325 1 464 . 1 1 49 49 LEU H H 1 8.100 0.030 . 1 . . . . 49 LEU H . 11325 1 465 . 1 1 49 49 LEU HA H 1 3.952 0.030 . 1 . . . . 49 LEU HA . 11325 1 466 . 1 1 49 49 LEU HB2 H 1 1.289 0.030 . 2 . . . . 49 LEU HB2 . 11325 1 467 . 1 1 49 49 LEU HB3 H 1 2.046 0.030 . 2 . . . . 49 LEU HB3 . 11325 1 468 . 1 1 49 49 LEU HD11 H 1 0.343 0.030 . 1 . . . . 49 LEU HD1 . 11325 1 469 . 1 1 49 49 LEU HD12 H 1 0.343 0.030 . 1 . . . . 49 LEU HD1 . 11325 1 470 . 1 1 49 49 LEU HD13 H 1 0.343 0.030 . 1 . . . . 49 LEU HD1 . 11325 1 471 . 1 1 49 49 LEU HD21 H 1 0.655 0.030 . 1 . . . . 49 LEU HD2 . 11325 1 472 . 1 1 49 49 LEU HD22 H 1 0.655 0.030 . 1 . . . . 49 LEU HD2 . 11325 1 473 . 1 1 49 49 LEU HD23 H 1 0.655 0.030 . 1 . . . . 49 LEU HD2 . 11325 1 474 . 1 1 49 49 LEU HG H 1 1.397 0.030 . 1 . . . . 49 LEU HG . 11325 1 475 . 1 1 49 49 LEU C C 13 177.963 0.300 . 1 . . . . 49 LEU C . 11325 1 476 . 1 1 49 49 LEU CA C 13 57.862 0.300 . 1 . . . . 49 LEU CA . 11325 1 477 . 1 1 49 49 LEU CB C 13 41.563 0.300 . 1 . . . . 49 LEU CB . 11325 1 478 . 1 1 49 49 LEU CD1 C 13 22.277 0.300 . 2 . . . . 49 LEU CD1 . 11325 1 479 . 1 1 49 49 LEU CD2 C 13 26.374 0.300 . 2 . . . . 49 LEU CD2 . 11325 1 480 . 1 1 49 49 LEU CG C 13 26.359 0.300 . 1 . . . . 49 LEU CG . 11325 1 481 . 1 1 49 49 LEU N N 15 121.388 0.300 . 1 . . . . 49 LEU N . 11325 1 482 . 1 1 50 50 GLN H H 1 8.515 0.030 . 1 . . . . 50 GLN H . 11325 1 483 . 1 1 50 50 GLN HA H 1 3.924 0.030 . 1 . . . . 50 GLN HA . 11325 1 484 . 1 1 50 50 GLN HB2 H 1 2.144 0.030 . 2 . . . . 50 GLN HB2 . 11325 1 485 . 1 1 50 50 GLN HB3 H 1 2.179 0.030 . 2 . . . . 50 GLN HB3 . 11325 1 486 . 1 1 50 50 GLN HE21 H 1 6.987 0.030 . 2 . . . . 50 GLN HE21 . 11325 1 487 . 1 1 50 50 GLN HE22 H 1 7.448 0.030 . 2 . . . . 50 GLN HE22 . 11325 1 488 . 1 1 50 50 GLN HG2 H 1 2.541 0.030 . 2 . . . . 50 GLN HG2 . 11325 1 489 . 1 1 50 50 GLN HG3 H 1 2.489 0.030 . 2 . . . . 50 GLN HG3 . 11325 1 490 . 1 1 50 50 GLN C C 13 178.655 0.300 . 1 . . . . 50 GLN C . 11325 1 491 . 1 1 50 50 GLN CA C 13 59.179 0.300 . 1 . . . . 50 GLN CA . 11325 1 492 . 1 1 50 50 GLN CB C 13 28.170 0.300 . 1 . . . . 50 GLN CB . 11325 1 493 . 1 1 50 50 GLN CG C 13 33.984 0.300 . 1 . . . . 50 GLN CG . 11325 1 494 . 1 1 50 50 GLN N N 15 116.583 0.300 . 1 . . . . 50 GLN N . 11325 1 495 . 1 1 50 50 GLN NE2 N 15 111.966 0.300 . 1 . . . . 50 GLN NE2 . 11325 1 496 . 1 1 51 51 GLN H H 1 7.635 0.030 . 1 . . . . 51 GLN H . 11325 1 497 . 1 1 51 51 GLN HA H 1 4.108 0.030 . 1 . . . . 51 GLN HA . 11325 1 498 . 1 1 51 51 GLN HB2 H 1 2.233 0.030 . 1 . . . . 51 GLN HB2 . 11325 1 499 . 1 1 51 51 GLN HB3 H 1 2.233 0.030 . 1 . . . . 51 GLN HB3 . 11325 1 500 . 1 1 51 51 GLN HG2 H 1 2.471 0.030 . 2 . . . . 51 GLN HG2 . 11325 1 501 . 1 1 51 51 GLN HG3 H 1 2.517 0.030 . 2 . . . . 51 GLN HG3 . 11325 1 502 . 1 1 51 51 GLN C C 13 177.995 0.300 . 1 . . . . 51 GLN C . 11325 1 503 . 1 1 51 51 GLN CA C 13 58.461 0.300 . 1 . . . . 51 GLN CA . 11325 1 504 . 1 1 51 51 GLN CB C 13 28.287 0.300 . 1 . . . . 51 GLN CB . 11325 1 505 . 1 1 51 51 GLN CG C 13 33.701 0.300 . 1 . . . . 51 GLN CG . 11325 1 506 . 1 1 51 51 GLN N N 15 117.635 0.300 . 1 . . . . 51 GLN N . 11325 1 507 . 1 1 52 52 TRP H H 1 8.242 0.030 . 1 . . . . 52 TRP H . 11325 1 508 . 1 1 52 52 TRP HA H 1 4.325 0.030 . 1 . . . . 52 TRP HA . 11325 1 509 . 1 1 52 52 TRP HB2 H 1 3.497 0.030 . 2 . . . . 52 TRP HB2 . 11325 1 510 . 1 1 52 52 TRP HB3 H 1 3.330 0.030 . 2 . . . . 52 TRP HB3 . 11325 1 511 . 1 1 52 52 TRP HD1 H 1 7.246 0.030 . 1 . . . . 52 TRP HD1 . 11325 1 512 . 1 1 52 52 TRP HE1 H 1 10.326 0.030 . 1 . . . . 52 TRP HE1 . 11325 1 513 . 1 1 52 52 TRP HE3 H 1 7.455 0.030 . 1 . . . . 52 TRP HE3 . 11325 1 514 . 1 1 52 52 TRP HH2 H 1 7.315 0.030 . 1 . . . . 52 TRP HH2 . 11325 1 515 . 1 1 52 52 TRP HZ2 H 1 7.567 0.030 . 1 . . . . 52 TRP HZ2 . 11325 1 516 . 1 1 52 52 TRP HZ3 H 1 6.844 0.030 . 1 . . . . 52 TRP HZ3 . 11325 1 517 . 1 1 52 52 TRP C C 13 179.259 0.300 . 1 . . . . 52 TRP C . 11325 1 518 . 1 1 52 52 TRP CA C 13 61.056 0.300 . 1 . . . . 52 TRP CA . 11325 1 519 . 1 1 52 52 TRP CB C 13 28.933 0.300 . 1 . . . . 52 TRP CB . 11325 1 520 . 1 1 52 52 TRP CD1 C 13 126.985 0.300 . 1 . . . . 52 TRP CD1 . 11325 1 521 . 1 1 52 52 TRP CE3 C 13 120.141 0.300 . 1 . . . . 52 TRP CE3 . 11325 1 522 . 1 1 52 52 TRP CH2 C 13 124.515 0.300 . 1 . . . . 52 TRP CH2 . 11325 1 523 . 1 1 52 52 TRP CZ2 C 13 114.918 0.300 . 1 . . . . 52 TRP CZ2 . 11325 1 524 . 1 1 52 52 TRP CZ3 C 13 121.680 0.300 . 1 . . . . 52 TRP CZ3 . 11325 1 525 . 1 1 52 52 TRP N N 15 122.867 0.300 . 1 . . . . 52 TRP N . 11325 1 526 . 1 1 52 52 TRP NE1 N 15 130.217 0.300 . 1 . . . . 52 TRP NE1 . 11325 1 527 . 1 1 53 53 ILE H H 1 8.957 0.030 . 1 . . . . 53 ILE H . 11325 1 528 . 1 1 53 53 ILE HA H 1 3.392 0.030 . 1 . . . . 53 ILE HA . 11325 1 529 . 1 1 53 53 ILE HB H 1 1.874 0.030 . 1 . . . . 53 ILE HB . 11325 1 530 . 1 1 53 53 ILE HD11 H 1 0.749 0.030 . 1 . . . . 53 ILE HD1 . 11325 1 531 . 1 1 53 53 ILE HD12 H 1 0.749 0.030 . 1 . . . . 53 ILE HD1 . 11325 1 532 . 1 1 53 53 ILE HD13 H 1 0.749 0.030 . 1 . . . . 53 ILE HD1 . 11325 1 533 . 1 1 53 53 ILE HG12 H 1 1.782 0.030 . 2 . . . . 53 ILE HG12 . 11325 1 534 . 1 1 53 53 ILE HG13 H 1 1.303 0.030 . 2 . . . . 53 ILE HG13 . 11325 1 535 . 1 1 53 53 ILE HG21 H 1 0.882 0.030 . 1 . . . . 53 ILE HG2 . 11325 1 536 . 1 1 53 53 ILE HG22 H 1 0.882 0.030 . 1 . . . . 53 ILE HG2 . 11325 1 537 . 1 1 53 53 ILE HG23 H 1 0.882 0.030 . 1 . . . . 53 ILE HG2 . 11325 1 538 . 1 1 53 53 ILE C C 13 178.291 0.300 . 1 . . . . 53 ILE C . 11325 1 539 . 1 1 53 53 ILE CA C 13 65.301 0.300 . 1 . . . . 53 ILE CA . 11325 1 540 . 1 1 53 53 ILE CB C 13 38.568 0.300 . 1 . . . . 53 ILE CB . 11325 1 541 . 1 1 53 53 ILE CD1 C 13 14.671 0.300 . 1 . . . . 53 ILE CD1 . 11325 1 542 . 1 1 53 53 ILE CG1 C 13 28.602 0.300 . 1 . . . . 53 ILE CG1 . 11325 1 543 . 1 1 53 53 ILE CG2 C 13 16.872 0.300 . 1 . . . . 53 ILE CG2 . 11325 1 544 . 1 1 53 53 ILE N N 15 122.006 0.300 . 1 . . . . 53 ILE N . 11325 1 545 . 1 1 54 54 LYS H H 1 7.427 0.030 . 1 . . . . 54 LYS H . 11325 1 546 . 1 1 54 54 LYS HA H 1 4.035 0.030 . 1 . . . . 54 LYS HA . 11325 1 547 . 1 1 54 54 LYS HB2 H 1 1.892 0.030 . 1 . . . . 54 LYS HB2 . 11325 1 548 . 1 1 54 54 LYS HB3 H 1 1.892 0.030 . 1 . . . . 54 LYS HB3 . 11325 1 549 . 1 1 54 54 LYS HD2 H 1 1.662 0.030 . 1 . . . . 54 LYS HD2 . 11325 1 550 . 1 1 54 54 LYS HD3 H 1 1.662 0.030 . 1 . . . . 54 LYS HD3 . 11325 1 551 . 1 1 54 54 LYS HE2 H 1 2.950 0.030 . 1 . . . . 54 LYS HE2 . 11325 1 552 . 1 1 54 54 LYS HE3 H 1 2.950 0.030 . 1 . . . . 54 LYS HE3 . 11325 1 553 . 1 1 54 54 LYS HG2 H 1 1.533 0.030 . 2 . . . . 54 LYS HG2 . 11325 1 554 . 1 1 54 54 LYS HG3 H 1 1.427 0.030 . 2 . . . . 54 LYS HG3 . 11325 1 555 . 1 1 54 54 LYS C C 13 178.547 0.300 . 1 . . . . 54 LYS C . 11325 1 556 . 1 1 54 54 LYS CA C 13 58.831 0.300 . 1 . . . . 54 LYS CA . 11325 1 557 . 1 1 54 54 LYS CB C 13 32.402 0.300 . 1 . . . . 54 LYS CB . 11325 1 558 . 1 1 54 54 LYS CD C 13 29.215 0.300 . 1 . . . . 54 LYS CD . 11325 1 559 . 1 1 54 54 LYS CE C 13 42.111 0.300 . 1 . . . . 54 LYS CE . 11325 1 560 . 1 1 54 54 LYS CG C 13 25.048 0.300 . 1 . . . . 54 LYS CG . 11325 1 561 . 1 1 54 54 LYS N N 15 117.935 0.300 . 1 . . . . 54 LYS N . 11325 1 562 . 1 1 55 55 SER H H 1 7.974 0.030 . 1 . . . . 55 SER H . 11325 1 563 . 1 1 55 55 SER HA H 1 4.272 0.030 . 1 . . . . 55 SER HA . 11325 1 564 . 1 1 55 55 SER HB2 H 1 3.833 0.030 . 2 . . . . 55 SER HB2 . 11325 1 565 . 1 1 55 55 SER HB3 H 1 3.887 0.030 . 2 . . . . 55 SER HB3 . 11325 1 566 . 1 1 55 55 SER C C 13 175.085 0.300 . 1 . . . . 55 SER C . 11325 1 567 . 1 1 55 55 SER CA C 13 60.256 0.300 . 1 . . . . 55 SER CA . 11325 1 568 . 1 1 55 55 SER CB C 13 63.496 0.300 . 1 . . . . 55 SER CB . 11325 1 569 . 1 1 55 55 SER N N 15 112.969 0.300 . 1 . . . . 55 SER N . 11325 1 570 . 1 1 56 56 SER H H 1 7.884 0.030 . 1 . . . . 56 SER H . 11325 1 571 . 1 1 56 56 SER HA H 1 4.213 0.030 . 1 . . . . 56 SER HA . 11325 1 572 . 1 1 56 56 SER HB2 H 1 3.346 0.030 . 2 . . . . 56 SER HB2 . 11325 1 573 . 1 1 56 56 SER HB3 H 1 3.102 0.030 . 2 . . . . 56 SER HB3 . 11325 1 574 . 1 1 56 56 SER C C 13 174.542 0.300 . 1 . . . . 56 SER C . 11325 1 575 . 1 1 56 56 SER CA C 13 58.487 0.300 . 1 . . . . 56 SER CA . 11325 1 576 . 1 1 56 56 SER CB C 13 64.703 0.300 . 1 . . . . 56 SER CB . 11325 1 577 . 1 1 56 56 SER N N 15 115.994 0.300 . 1 . . . . 56 SER N . 11325 1 578 . 1 1 57 57 ASP H H 1 8.044 0.030 . 1 . . . . 57 ASP H . 11325 1 579 . 1 1 57 57 ASP HA H 1 4.390 0.030 . 1 . . . . 57 ASP HA . 11325 1 580 . 1 1 57 57 ASP HB2 H 1 2.953 0.030 . 2 . . . . 57 ASP HB2 . 11325 1 581 . 1 1 57 57 ASP HB3 H 1 2.454 0.030 . 2 . . . . 57 ASP HB3 . 11325 1 582 . 1 1 57 57 ASP C C 13 175.078 0.300 . 1 . . . . 57 ASP C . 11325 1 583 . 1 1 57 57 ASP CA C 13 55.154 0.300 . 1 . . . . 57 ASP CA . 11325 1 584 . 1 1 57 57 ASP CB C 13 40.372 0.300 . 1 . . . . 57 ASP CB . 11325 1 585 . 1 1 57 57 ASP N N 15 122.160 0.300 . 1 . . . . 57 ASP N . 11325 1 586 . 1 1 58 58 THR H H 1 7.484 0.030 . 1 . . . . 58 THR H . 11325 1 587 . 1 1 58 58 THR HA H 1 4.346 0.030 . 1 . . . . 58 THR HA . 11325 1 588 . 1 1 58 58 THR HB H 1 3.776 0.030 . 1 . . . . 58 THR HB . 11325 1 589 . 1 1 58 58 THR HG21 H 1 1.300 0.030 . 1 . . . . 58 THR HG2 . 11325 1 590 . 1 1 58 58 THR HG22 H 1 1.300 0.030 . 1 . . . . 58 THR HG2 . 11325 1 591 . 1 1 58 58 THR HG23 H 1 1.300 0.030 . 1 . . . . 58 THR HG2 . 11325 1 592 . 1 1 58 58 THR C C 13 173.064 0.300 . 1 . . . . 58 THR C . 11325 1 593 . 1 1 58 58 THR CA C 13 61.871 0.300 . 1 . . . . 58 THR CA . 11325 1 594 . 1 1 58 58 THR CB C 13 69.693 0.300 . 1 . . . . 58 THR CB . 11325 1 595 . 1 1 58 58 THR CG2 C 13 21.720 0.300 . 1 . . . . 58 THR CG2 . 11325 1 596 . 1 1 58 58 THR N N 15 113.432 0.300 . 1 . . . . 58 THR N . 11325 1 597 . 1 1 59 59 ARG H H 1 8.508 0.030 . 1 . . . . 59 ARG H . 11325 1 598 . 1 1 59 59 ARG HA H 1 4.542 0.030 . 1 . . . . 59 ARG HA . 11325 1 599 . 1 1 59 59 ARG HB2 H 1 2.094 0.030 . 2 . . . . 59 ARG HB2 . 11325 1 600 . 1 1 59 59 ARG HB3 H 1 1.755 0.030 . 2 . . . . 59 ARG HB3 . 11325 1 601 . 1 1 59 59 ARG HD2 H 1 3.151 0.030 . 1 . . . . 59 ARG HD2 . 11325 1 602 . 1 1 59 59 ARG HD3 H 1 3.151 0.030 . 1 . . . . 59 ARG HD3 . 11325 1 603 . 1 1 59 59 ARG HG2 H 1 1.600 0.030 . 1 . . . . 59 ARG HG2 . 11325 1 604 . 1 1 59 59 ARG HG3 H 1 1.600 0.030 . 1 . . . . 59 ARG HG3 . 11325 1 605 . 1 1 59 59 ARG C C 13 175.283 0.300 . 1 . . . . 59 ARG C . 11325 1 606 . 1 1 59 59 ARG CA C 13 55.857 0.300 . 1 . . . . 59 ARG CA . 11325 1 607 . 1 1 59 59 ARG CB C 13 31.156 0.300 . 1 . . . . 59 ARG CB . 11325 1 608 . 1 1 59 59 ARG CD C 13 43.161 0.300 . 1 . . . . 59 ARG CD . 11325 1 609 . 1 1 59 59 ARG CG C 13 27.518 0.300 . 1 . . . . 59 ARG CG . 11325 1 610 . 1 1 59 59 ARG N N 15 120.990 0.300 . 1 . . . . 59 ARG N . 11325 1 611 . 1 1 60 60 CYS H H 1 7.692 0.030 . 1 . . . . 60 CYS H . 11325 1 612 . 1 1 60 60 CYS HA H 1 4.693 0.030 . 1 . . . . 60 CYS HA . 11325 1 613 . 1 1 60 60 CYS HB2 H 1 2.338 0.030 . 2 . . . . 60 CYS HB2 . 11325 1 614 . 1 1 60 60 CYS HB3 H 1 2.422 0.030 . 2 . . . . 60 CYS HB3 . 11325 1 615 . 1 1 60 60 CYS C C 13 172.704 0.300 . 1 . . . . 60 CYS C . 11325 1 616 . 1 1 60 60 CYS CA C 13 55.288 0.300 . 1 . . . . 60 CYS CA . 11325 1 617 . 1 1 60 60 CYS CB C 13 30.627 0.300 . 1 . . . . 60 CYS CB . 11325 1 618 . 1 1 60 60 CYS N N 15 115.012 0.300 . 1 . . . . 60 CYS N . 11325 1 619 . 1 1 61 61 CYS H H 1 7.961 0.030 . 1 . . . . 61 CYS H . 11325 1 620 . 1 1 61 61 CYS HA H 1 4.213 0.030 . 1 . . . . 61 CYS HA . 11325 1 621 . 1 1 61 61 CYS HB2 H 1 3.191 0.030 . 2 . . . . 61 CYS HB2 . 11325 1 622 . 1 1 61 61 CYS HB3 H 1 2.572 0.030 . 2 . . . . 61 CYS HB3 . 11325 1 623 . 1 1 61 61 CYS C C 13 177.658 0.300 . 1 . . . . 61 CYS C . 11325 1 624 . 1 1 61 61 CYS CA C 13 59.274 0.300 . 1 . . . . 61 CYS CA . 11325 1 625 . 1 1 61 61 CYS CB C 13 31.344 0.300 . 1 . . . . 61 CYS CB . 11325 1 626 . 1 1 61 61 CYS N N 15 125.731 0.300 . 1 . . . . 61 CYS N . 11325 1 627 . 1 1 62 62 GLU H H 1 9.251 0.030 . 1 . . . . 62 GLU H . 11325 1 628 . 1 1 62 62 GLU HA H 1 4.108 0.030 . 1 . . . . 62 GLU HA . 11325 1 629 . 1 1 62 62 GLU HB2 H 1 2.138 0.030 . 1 . . . . 62 GLU HB2 . 11325 1 630 . 1 1 62 62 GLU HB3 H 1 2.138 0.030 . 1 . . . . 62 GLU HB3 . 11325 1 631 . 1 1 62 62 GLU HG2 H 1 2.380 0.030 . 1 . . . . 62 GLU HG2 . 11325 1 632 . 1 1 62 62 GLU HG3 H 1 2.380 0.030 . 1 . . . . 62 GLU HG3 . 11325 1 633 . 1 1 62 62 GLU C C 13 176.298 0.300 . 1 . . . . 62 GLU C . 11325 1 634 . 1 1 62 62 GLU CA C 13 58.570 0.300 . 1 . . . . 62 GLU CA . 11325 1 635 . 1 1 62 62 GLU CB C 13 29.750 0.300 . 1 . . . . 62 GLU CB . 11325 1 636 . 1 1 62 62 GLU CG C 13 36.177 0.300 . 1 . . . . 62 GLU CG . 11325 1 637 . 1 1 62 62 GLU N N 15 130.324 0.300 . 1 . . . . 62 GLU N . 11325 1 638 . 1 1 63 63 LEU H H 1 9.075 0.030 . 1 . . . . 63 LEU H . 11325 1 639 . 1 1 63 63 LEU HA H 1 4.421 0.030 . 1 . . . . 63 LEU HA . 11325 1 640 . 1 1 63 63 LEU HB2 H 1 1.801 0.030 . 2 . . . . 63 LEU HB2 . 11325 1 641 . 1 1 63 63 LEU HB3 H 1 1.442 0.030 . 2 . . . . 63 LEU HB3 . 11325 1 642 . 1 1 63 63 LEU HD11 H 1 0.979 0.030 . 1 . . . . 63 LEU HD1 . 11325 1 643 . 1 1 63 63 LEU HD12 H 1 0.979 0.030 . 1 . . . . 63 LEU HD1 . 11325 1 644 . 1 1 63 63 LEU HD13 H 1 0.979 0.030 . 1 . . . . 63 LEU HD1 . 11325 1 645 . 1 1 63 63 LEU HD21 H 1 0.866 0.030 . 1 . . . . 63 LEU HD2 . 11325 1 646 . 1 1 63 63 LEU HD22 H 1 0.866 0.030 . 1 . . . . 63 LEU HD2 . 11325 1 647 . 1 1 63 63 LEU HD23 H 1 0.866 0.030 . 1 . . . . 63 LEU HD2 . 11325 1 648 . 1 1 63 63 LEU HG H 1 1.634 0.030 . 1 . . . . 63 LEU HG . 11325 1 649 . 1 1 63 63 LEU C C 13 177.870 0.300 . 1 . . . . 63 LEU C . 11325 1 650 . 1 1 63 63 LEU CA C 13 56.789 0.300 . 1 . . . . 63 LEU CA . 11325 1 651 . 1 1 63 63 LEU CB C 13 42.793 0.300 . 1 . . . . 63 LEU CB . 11325 1 652 . 1 1 63 63 LEU CD1 C 13 25.362 0.300 . 2 . . . . 63 LEU CD1 . 11325 1 653 . 1 1 63 63 LEU CD2 C 13 23.297 0.300 . 2 . . . . 63 LEU CD2 . 11325 1 654 . 1 1 63 63 LEU CG C 13 27.568 0.300 . 1 . . . . 63 LEU CG . 11325 1 655 . 1 1 63 63 LEU N N 15 122.377 0.300 . 1 . . . . 63 LEU N . 11325 1 656 . 1 1 64 64 CYS H H 1 8.327 0.030 . 1 . . . . 64 CYS H . 11325 1 657 . 1 1 64 64 CYS HA H 1 4.824 0.030 . 1 . . . . 64 CYS HA . 11325 1 658 . 1 1 64 64 CYS HB2 H 1 2.574 0.030 . 2 . . . . 64 CYS HB2 . 11325 1 659 . 1 1 64 64 CYS HB3 H 1 3.199 0.030 . 2 . . . . 64 CYS HB3 . 11325 1 660 . 1 1 64 64 CYS C C 13 176.427 0.300 . 1 . . . . 64 CYS C . 11325 1 661 . 1 1 64 64 CYS CA C 13 59.085 0.300 . 1 . . . . 64 CYS CA . 11325 1 662 . 1 1 64 64 CYS CB C 13 31.344 0.300 . 1 . . . . 64 CYS CB . 11325 1 663 . 1 1 64 64 CYS N N 15 118.672 0.300 . 1 . . . . 64 CYS N . 11325 1 664 . 1 1 65 65 LYS H H 1 7.507 0.030 . 1 . . . . 65 LYS H . 11325 1 665 . 1 1 65 65 LYS HA H 1 4.050 0.030 . 1 . . . . 65 LYS HA . 11325 1 666 . 1 1 65 65 LYS HB2 H 1 1.867 0.030 . 2 . . . . 65 LYS HB2 . 11325 1 667 . 1 1 65 65 LYS HB3 H 1 2.151 0.030 . 2 . . . . 65 LYS HB3 . 11325 1 668 . 1 1 65 65 LYS HD2 H 1 1.479 0.030 . 2 . . . . 65 LYS HD2 . 11325 1 669 . 1 1 65 65 LYS HD3 H 1 1.515 0.030 . 2 . . . . 65 LYS HD3 . 11325 1 670 . 1 1 65 65 LYS HE2 H 1 2.934 0.030 . 2 . . . . 65 LYS HE2 . 11325 1 671 . 1 1 65 65 LYS HE3 H 1 2.877 0.030 . 2 . . . . 65 LYS HE3 . 11325 1 672 . 1 1 65 65 LYS HG2 H 1 1.113 0.030 . 2 . . . . 65 LYS HG2 . 11325 1 673 . 1 1 65 65 LYS HG3 H 1 1.279 0.030 . 2 . . . . 65 LYS HG3 . 11325 1 674 . 1 1 65 65 LYS C C 13 175.187 0.300 . 1 . . . . 65 LYS C . 11325 1 675 . 1 1 65 65 LYS CA C 13 57.527 0.300 . 1 . . . . 65 LYS CA . 11325 1 676 . 1 1 65 65 LYS CB C 13 28.404 0.300 . 1 . . . . 65 LYS CB . 11325 1 677 . 1 1 65 65 LYS CD C 13 28.281 0.300 . 1 . . . . 65 LYS CD . 11325 1 678 . 1 1 65 65 LYS CE C 13 42.525 0.300 . 1 . . . . 65 LYS CE . 11325 1 679 . 1 1 65 65 LYS CG C 13 24.783 0.300 . 1 . . . . 65 LYS CG . 11325 1 680 . 1 1 65 65 LYS N N 15 115.778 0.300 . 1 . . . . 65 LYS N . 11325 1 681 . 1 1 66 66 TYR H H 1 8.217 0.030 . 1 . . . . 66 TYR H . 11325 1 682 . 1 1 66 66 TYR HA H 1 4.138 0.030 . 1 . . . . 66 TYR HA . 11325 1 683 . 1 1 66 66 TYR HB2 H 1 3.078 0.030 . 2 . . . . 66 TYR HB2 . 11325 1 684 . 1 1 66 66 TYR HB3 H 1 2.554 0.030 . 2 . . . . 66 TYR HB3 . 11325 1 685 . 1 1 66 66 TYR HD1 H 1 6.688 0.030 . 1 . . . . 66 TYR HD1 . 11325 1 686 . 1 1 66 66 TYR HD2 H 1 6.688 0.030 . 1 . . . . 66 TYR HD2 . 11325 1 687 . 1 1 66 66 TYR HE1 H 1 6.645 0.030 . 1 . . . . 66 TYR HE1 . 11325 1 688 . 1 1 66 66 TYR HE2 H 1 6.645 0.030 . 1 . . . . 66 TYR HE2 . 11325 1 689 . 1 1 66 66 TYR C C 13 174.706 0.300 . 1 . . . . 66 TYR C . 11325 1 690 . 1 1 66 66 TYR CA C 13 59.144 0.300 . 1 . . . . 66 TYR CA . 11325 1 691 . 1 1 66 66 TYR CB C 13 40.695 0.300 . 1 . . . . 66 TYR CB . 11325 1 692 . 1 1 66 66 TYR CD1 C 13 132.818 0.300 . 1 . . . . 66 TYR CD1 . 11325 1 693 . 1 1 66 66 TYR CD2 C 13 132.818 0.300 . 1 . . . . 66 TYR CD2 . 11325 1 694 . 1 1 66 66 TYR CE1 C 13 118.238 0.300 . 1 . . . . 66 TYR CE1 . 11325 1 695 . 1 1 66 66 TYR CE2 C 13 118.238 0.300 . 1 . . . . 66 TYR CE2 . 11325 1 696 . 1 1 66 66 TYR N N 15 122.299 0.300 . 1 . . . . 66 TYR N . 11325 1 697 . 1 1 67 67 GLU H H 1 7.921 0.030 . 1 . . . . 67 GLU H . 11325 1 698 . 1 1 67 67 GLU HA H 1 4.188 0.030 . 1 . . . . 67 GLU HA . 11325 1 699 . 1 1 67 67 GLU HB2 H 1 1.718 0.030 . 2 . . . . 67 GLU HB2 . 11325 1 700 . 1 1 67 67 GLU HB3 H 1 1.783 0.030 . 2 . . . . 67 GLU HB3 . 11325 1 701 . 1 1 67 67 GLU HG2 H 1 2.089 0.030 . 2 . . . . 67 GLU HG2 . 11325 1 702 . 1 1 67 67 GLU HG3 H 1 2.201 0.030 . 2 . . . . 67 GLU HG3 . 11325 1 703 . 1 1 67 67 GLU C C 13 175.103 0.300 . 1 . . . . 67 GLU C . 11325 1 704 . 1 1 67 67 GLU CA C 13 55.676 0.300 . 1 . . . . 67 GLU CA . 11325 1 705 . 1 1 67 67 GLU CB C 13 30.098 0.300 . 1 . . . . 67 GLU CB . 11325 1 706 . 1 1 67 67 GLU CG C 13 36.438 0.300 . 1 . . . . 67 GLU CG . 11325 1 707 . 1 1 67 67 GLU N N 15 124.860 0.300 . 1 . . . . 67 GLU N . 11325 1 708 . 1 1 68 68 PHE H H 1 7.606 0.030 . 1 . . . . 68 PHE H . 11325 1 709 . 1 1 68 68 PHE HA H 1 4.624 0.030 . 1 . . . . 68 PHE HA . 11325 1 710 . 1 1 68 68 PHE HB2 H 1 3.091 0.030 . 2 . . . . 68 PHE HB2 . 11325 1 711 . 1 1 68 68 PHE HB3 H 1 2.746 0.030 . 2 . . . . 68 PHE HB3 . 11325 1 712 . 1 1 68 68 PHE HD1 H 1 7.180 0.030 . 1 . . . . 68 PHE HD1 . 11325 1 713 . 1 1 68 68 PHE HD2 H 1 7.180 0.030 . 1 . . . . 68 PHE HD2 . 11325 1 714 . 1 1 68 68 PHE HE1 H 1 7.266 0.030 . 1 . . . . 68 PHE HE1 . 11325 1 715 . 1 1 68 68 PHE HE2 H 1 7.266 0.030 . 1 . . . . 68 PHE HE2 . 11325 1 716 . 1 1 68 68 PHE HZ H 1 7.297 0.030 . 1 . . . . 68 PHE HZ . 11325 1 717 . 1 1 68 68 PHE C C 13 176.279 0.300 . 1 . . . . 68 PHE C . 11325 1 718 . 1 1 68 68 PHE CA C 13 57.967 0.300 . 1 . . . . 68 PHE CA . 11325 1 719 . 1 1 68 68 PHE CB C 13 39.746 0.300 . 1 . . . . 68 PHE CB . 11325 1 720 . 1 1 68 68 PHE CD1 C 13 131.565 0.300 . 1 . . . . 68 PHE CD1 . 11325 1 721 . 1 1 68 68 PHE CD2 C 13 131.565 0.300 . 1 . . . . 68 PHE CD2 . 11325 1 722 . 1 1 68 68 PHE CE1 C 13 131.502 0.300 . 1 . . . . 68 PHE CE1 . 11325 1 723 . 1 1 68 68 PHE CE2 C 13 131.502 0.300 . 1 . . . . 68 PHE CE2 . 11325 1 724 . 1 1 68 68 PHE CZ C 13 129.269 0.300 . 1 . . . . 68 PHE CZ . 11325 1 725 . 1 1 68 68 PHE N N 15 122.421 0.300 . 1 . . . . 68 PHE N . 11325 1 726 . 1 1 69 69 ILE H H 1 8.846 0.030 . 1 . . . . 69 ILE H . 11325 1 727 . 1 1 69 69 ILE HA H 1 4.188 0.030 . 1 . . . . 69 ILE HA . 11325 1 728 . 1 1 69 69 ILE HB H 1 1.887 0.030 . 1 . . . . 69 ILE HB . 11325 1 729 . 1 1 69 69 ILE HD11 H 1 0.855 0.030 . 1 . . . . 69 ILE HD1 . 11325 1 730 . 1 1 69 69 ILE HD12 H 1 0.855 0.030 . 1 . . . . 69 ILE HD1 . 11325 1 731 . 1 1 69 69 ILE HD13 H 1 0.855 0.030 . 1 . . . . 69 ILE HD1 . 11325 1 732 . 1 1 69 69 ILE HG12 H 1 1.596 0.030 . 2 . . . . 69 ILE HG12 . 11325 1 733 . 1 1 69 69 ILE HG13 H 1 1.244 0.030 . 2 . . . . 69 ILE HG13 . 11325 1 734 . 1 1 69 69 ILE HG21 H 1 0.874 0.030 . 1 . . . . 69 ILE HG2 . 11325 1 735 . 1 1 69 69 ILE HG22 H 1 0.874 0.030 . 1 . . . . 69 ILE HG2 . 11325 1 736 . 1 1 69 69 ILE HG23 H 1 0.874 0.030 . 1 . . . . 69 ILE HG2 . 11325 1 737 . 1 1 69 69 ILE C C 13 175.814 0.300 . 1 . . . . 69 ILE C . 11325 1 738 . 1 1 69 69 ILE CA C 13 60.695 0.300 . 1 . . . . 69 ILE CA . 11325 1 739 . 1 1 69 69 ILE CB C 13 38.607 0.300 . 1 . . . . 69 ILE CB . 11325 1 740 . 1 1 69 69 ILE CD1 C 13 12.542 0.300 . 1 . . . . 69 ILE CD1 . 11325 1 741 . 1 1 69 69 ILE CG1 C 13 27.128 0.300 . 1 . . . . 69 ILE CG1 . 11325 1 742 . 1 1 69 69 ILE CG2 C 13 17.563 0.300 . 1 . . . . 69 ILE CG2 . 11325 1 743 . 1 1 69 69 ILE N N 15 123.171 0.300 . 1 . . . . 69 ILE N . 11325 1 744 . 1 1 70 70 MET H H 1 8.531 0.030 . 1 . . . . 70 MET H . 11325 1 745 . 1 1 70 70 MET HA H 1 4.568 0.030 . 1 . . . . 70 MET HA . 11325 1 746 . 1 1 70 70 MET HB2 H 1 2.028 0.030 . 2 . . . . 70 MET HB2 . 11325 1 747 . 1 1 70 70 MET HB3 H 1 1.949 0.030 . 2 . . . . 70 MET HB3 . 11325 1 748 . 1 1 70 70 MET HE1 H 1 2.026 0.030 . 1 . . . . 70 MET HE . 11325 1 749 . 1 1 70 70 MET HE2 H 1 2.026 0.030 . 1 . . . . 70 MET HE . 11325 1 750 . 1 1 70 70 MET HE3 H 1 2.026 0.030 . 1 . . . . 70 MET HE . 11325 1 751 . 1 1 70 70 MET HG2 H 1 2.436 0.030 . 2 . . . . 70 MET HG2 . 11325 1 752 . 1 1 70 70 MET HG3 H 1 2.528 0.030 . 2 . . . . 70 MET HG3 . 11325 1 753 . 1 1 70 70 MET C C 13 175.721 0.300 . 1 . . . . 70 MET C . 11325 1 754 . 1 1 70 70 MET CA C 13 54.602 0.300 . 1 . . . . 70 MET CA . 11325 1 755 . 1 1 70 70 MET CB C 13 33.738 0.300 . 1 . . . . 70 MET CB . 11325 1 756 . 1 1 70 70 MET CE C 13 17.325 0.300 . 1 . . . . 70 MET CE . 11325 1 757 . 1 1 70 70 MET CG C 13 32.149 0.300 . 1 . . . . 70 MET CG . 11325 1 758 . 1 1 70 70 MET N N 15 125.264 0.300 . 1 . . . . 70 MET N . 11325 1 759 . 1 1 71 71 GLU H H 1 8.316 0.030 . 1 . . . . 71 GLU H . 11325 1 760 . 1 1 71 71 GLU HA H 1 4.355 0.030 . 1 . . . . 71 GLU HA . 11325 1 761 . 1 1 71 71 GLU HB2 H 1 1.904 0.030 . 2 . . . . 71 GLU HB2 . 11325 1 762 . 1 1 71 71 GLU HB3 H 1 2.007 0.030 . 2 . . . . 71 GLU HB3 . 11325 1 763 . 1 1 71 71 GLU HG2 H 1 2.209 0.030 . 1 . . . . 71 GLU HG2 . 11325 1 764 . 1 1 71 71 GLU HG3 H 1 2.209 0.030 . 1 . . . . 71 GLU HG3 . 11325 1 765 . 1 1 71 71 GLU C C 13 176.290 0.300 . 1 . . . . 71 GLU C . 11325 1 766 . 1 1 71 71 GLU CA C 13 56.268 0.300 . 1 . . . . 71 GLU CA . 11325 1 767 . 1 1 71 71 GLU CB C 13 30.658 0.300 . 1 . . . . 71 GLU CB . 11325 1 768 . 1 1 71 71 GLU CG C 13 36.293 0.300 . 1 . . . . 71 GLU CG . 11325 1 769 . 1 1 71 71 GLU N N 15 122.278 0.300 . 1 . . . . 71 GLU N . 11325 1 770 . 1 1 72 72 THR H H 1 8.341 0.030 . 1 . . . . 72 THR H . 11325 1 771 . 1 1 72 72 THR HA H 1 4.298 0.030 . 1 . . . . 72 THR HA . 11325 1 772 . 1 1 72 72 THR HB H 1 4.142 0.030 . 1 . . . . 72 THR HB . 11325 1 773 . 1 1 72 72 THR HG21 H 1 1.149 0.030 . 1 . . . . 72 THR HG2 . 11325 1 774 . 1 1 72 72 THR HG22 H 1 1.149 0.030 . 1 . . . . 72 THR HG2 . 11325 1 775 . 1 1 72 72 THR HG23 H 1 1.149 0.030 . 1 . . . . 72 THR HG2 . 11325 1 776 . 1 1 72 72 THR C C 13 174.359 0.300 . 1 . . . . 72 THR C . 11325 1 777 . 1 1 72 72 THR CA C 13 61.931 0.300 . 1 . . . . 72 THR CA . 11325 1 778 . 1 1 72 72 THR CB C 13 69.659 0.300 . 1 . . . . 72 THR CB . 11325 1 779 . 1 1 72 72 THR CG2 C 13 21.424 0.300 . 1 . . . . 72 THR CG2 . 11325 1 780 . 1 1 72 72 THR N N 15 116.898 0.300 . 1 . . . . 72 THR N . 11325 1 781 . 1 1 73 73 LYS H H 1 8.440 0.030 . 1 . . . . 73 LYS H . 11325 1 782 . 1 1 73 73 LYS HA H 1 4.331 0.030 . 1 . . . . 73 LYS HA . 11325 1 783 . 1 1 73 73 LYS HB2 H 1 1.736 0.030 . 2 . . . . 73 LYS HB2 . 11325 1 784 . 1 1 73 73 LYS HB3 H 1 1.811 0.030 . 2 . . . . 73 LYS HB3 . 11325 1 785 . 1 1 73 73 LYS HD2 H 1 1.643 0.030 . 1 . . . . 73 LYS HD2 . 11325 1 786 . 1 1 73 73 LYS HD3 H 1 1.643 0.030 . 1 . . . . 73 LYS HD3 . 11325 1 787 . 1 1 73 73 LYS HE2 H 1 2.953 0.030 . 1 . . . . 73 LYS HE2 . 11325 1 788 . 1 1 73 73 LYS HE3 H 1 2.953 0.030 . 1 . . . . 73 LYS HE3 . 11325 1 789 . 1 1 73 73 LYS HG2 H 1 1.385 0.030 . 1 . . . . 73 LYS HG2 . 11325 1 790 . 1 1 73 73 LYS HG3 H 1 1.385 0.030 . 1 . . . . 73 LYS HG3 . 11325 1 791 . 1 1 73 73 LYS C C 13 176.341 0.300 . 1 . . . . 73 LYS C . 11325 1 792 . 1 1 73 73 LYS CA C 13 56.160 0.300 . 1 . . . . 73 LYS CA . 11325 1 793 . 1 1 73 73 LYS CB C 13 32.981 0.300 . 1 . . . . 73 LYS CB . 11325 1 794 . 1 1 73 73 LYS CD C 13 29.074 0.300 . 1 . . . . 73 LYS CD . 11325 1 795 . 1 1 73 73 LYS CE C 13 42.126 0.300 . 1 . . . . 73 LYS CE . 11325 1 796 . 1 1 73 73 LYS CG C 13 24.656 0.300 . 1 . . . . 73 LYS CG . 11325 1 797 . 1 1 73 73 LYS N N 15 124.499 0.300 . 1 . . . . 73 LYS N . 11325 1 798 . 1 1 74 74 LEU H H 1 8.372 0.030 . 1 . . . . 74 LEU H . 11325 1 799 . 1 1 74 74 LEU HA H 1 4.375 0.030 . 1 . . . . 74 LEU HA . 11325 1 800 . 1 1 74 74 LEU HB2 H 1 1.637 0.030 . 2 . . . . 74 LEU HB2 . 11325 1 801 . 1 1 74 74 LEU HB3 H 1 1.569 0.030 . 2 . . . . 74 LEU HB3 . 11325 1 802 . 1 1 74 74 LEU HD11 H 1 0.894 0.030 . 1 . . . . 74 LEU HD1 . 11325 1 803 . 1 1 74 74 LEU HD12 H 1 0.894 0.030 . 1 . . . . 74 LEU HD1 . 11325 1 804 . 1 1 74 74 LEU HD13 H 1 0.894 0.030 . 1 . . . . 74 LEU HD1 . 11325 1 805 . 1 1 74 74 LEU HD21 H 1 0.835 0.030 . 1 . . . . 74 LEU HD2 . 11325 1 806 . 1 1 74 74 LEU HD22 H 1 0.835 0.030 . 1 . . . . 74 LEU HD2 . 11325 1 807 . 1 1 74 74 LEU HD23 H 1 0.835 0.030 . 1 . . . . 74 LEU HD2 . 11325 1 808 . 1 1 74 74 LEU HG H 1 1.620 0.030 . 1 . . . . 74 LEU HG . 11325 1 809 . 1 1 74 74 LEU C C 13 176.563 0.300 . 1 . . . . 74 LEU C . 11325 1 810 . 1 1 74 74 LEU CA C 13 55.185 0.300 . 1 . . . . 74 LEU CA . 11325 1 811 . 1 1 74 74 LEU CB C 13 42.340 0.300 . 1 . . . . 74 LEU CB . 11325 1 812 . 1 1 74 74 LEU CD1 C 13 24.863 0.300 . 2 . . . . 74 LEU CD1 . 11325 1 813 . 1 1 74 74 LEU CD2 C 13 23.271 0.300 . 2 . . . . 74 LEU CD2 . 11325 1 814 . 1 1 74 74 LEU CG C 13 27.116 0.300 . 1 . . . . 74 LEU CG . 11325 1 815 . 1 1 74 74 LEU N N 15 124.135 0.300 . 1 . . . . 74 LEU N . 11325 1 816 . 1 1 75 75 SER H H 1 7.854 0.030 . 1 . . . . 75 SER H . 11325 1 817 . 1 1 75 75 SER HA H 1 4.393 0.030 . 1 . . . . 75 SER HA . 11325 1 818 . 1 1 75 75 SER HB2 H 1 3.861 0.030 . 1 . . . . 75 SER HB2 . 11325 1 819 . 1 1 75 75 SER HB3 H 1 3.861 0.030 . 1 . . . . 75 SER HB3 . 11325 1 820 . 1 1 75 75 SER C C 13 178.512 0.300 . 1 . . . . 75 SER C . 11325 1 821 . 1 1 75 75 SER CA C 13 59.822 0.300 . 1 . . . . 75 SER CA . 11325 1 822 . 1 1 75 75 SER CB C 13 64.717 0.300 . 1 . . . . 75 SER CB . 11325 1 823 . 1 1 75 75 SER N N 15 121.708 0.300 . 1 . . . . 75 SER N . 11325 1 stop_ save_