################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16505 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _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 3 '3D CBCA(CO)NH' . . . 16505 1 4 '3D C(CO)NH' . . . 16505 1 6 '3D HNCACB' . . . 16505 1 7 '3D HBHA(CO)NH' . . . 16505 1 8 '3D H(CCO)NH' . . . 16505 1 9 '3D HCCH-TOCSY' . . . 16505 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 1 1 MET HA H 1 4.24 . . 1 . . . . 1 MET HA . 16505 1 2 . 1 1 1 1 MET HB2 H 1 2.23 . . 2 . . . . 1 MET HB2 . 16505 1 3 . 1 1 1 1 MET HB3 H 1 2.59 . . 2 . . . . 1 MET HB3 . 16505 1 4 . 1 1 1 1 MET HG2 H 1 2.67 . . 2 . . . . 1 MET HG2 . 16505 1 5 . 1 1 1 1 MET CA C 13 55.28 . . 1 . . . . 1 MET CA . 16505 1 6 . 1 1 1 1 MET CB C 13 33.27 . . 1 . . . . 1 MET CB . 16505 1 7 . 1 1 1 1 MET CG C 13 30.79 . . 1 . . . . 1 MET CG . 16505 1 8 . 1 1 2 2 LYS H H 1 8.56 . . 1 . . . . 2 LYS H . 16505 1 9 . 1 1 2 2 LYS HA H 1 4.46 . . 1 . . . . 2 LYS HA . 16505 1 10 . 1 1 2 2 LYS HB2 H 1 1.88 . . 2 . . . . 2 LYS HB2 . 16505 1 11 . 1 1 2 2 LYS HB3 H 1 1.84 . . 2 . . . . 2 LYS HB3 . 16505 1 12 . 1 1 2 2 LYS HD2 H 1 1.78 . . 2 . . . . 2 LYS HD2 . 16505 1 13 . 1 1 2 2 LYS HE2 H 1 3.11 . . 2 . . . . 2 LYS HE2 . 16505 1 14 . 1 1 2 2 LYS HG2 H 1 1.55 . . 2 . . . . 2 LYS HG2 . 16505 1 15 . 1 1 2 2 LYS CA C 13 56.54 . . 1 . . . . 2 LYS CA . 16505 1 16 . 1 1 2 2 LYS CB C 13 33.28 . . 1 . . . . 2 LYS CB . 16505 1 17 . 1 1 2 2 LYS CD C 13 29.17 . . 1 . . . . 2 LYS CD . 16505 1 18 . 1 1 2 2 LYS CE C 13 42.35 . . 1 . . . . 2 LYS CE . 16505 1 19 . 1 1 2 2 LYS CG C 13 24.66 . . 1 . . . . 2 LYS CG . 16505 1 20 . 1 1 2 2 LYS N N 15 123.67 . . 1 . . . . 2 LYS N . 16505 1 21 . 1 1 3 3 LYS H H 1 8.27 . . 1 . . . . 3 LYS H . 16505 1 22 . 1 1 3 3 LYS HA H 1 4.39 . . 1 . . . . 3 LYS HA . 16505 1 23 . 1 1 3 3 LYS HB2 H 1 1.87 . . 2 . . . . 3 LYS HB2 . 16505 1 24 . 1 1 3 3 LYS HB3 H 1 1.80 . . 2 . . . . 3 LYS HB3 . 16505 1 25 . 1 1 3 3 LYS HD2 H 1 1.76 . . 2 . . . . 3 LYS HD2 . 16505 1 26 . 1 1 3 3 LYS HE2 H 1 3.06 . . 2 . . . . 3 LYS HE2 . 16505 1 27 . 1 1 3 3 LYS HG2 H 1 1.47 . . 2 . . . . 3 LYS HG2 . 16505 1 28 . 1 1 3 3 LYS CA C 13 56.53 . . 1 . . . . 3 LYS CA . 16505 1 29 . 1 1 3 3 LYS CB C 13 33.14 . . 1 . . . . 3 LYS CB . 16505 1 30 . 1 1 3 3 LYS CD C 13 29.1 . . 1 . . . . 3 LYS CD . 16505 1 31 . 1 1 3 3 LYS CE C 13 42.18 . . 1 . . . . 3 LYS CE . 16505 1 32 . 1 1 3 3 LYS CG C 13 24.66 . . 1 . . . . 3 LYS CG . 16505 1 33 . 1 1 3 3 LYS N N 15 121.87 . . 1 . . . . 3 LYS N . 16505 1 34 . 1 1 4 4 ARG H H 1 8.10 . . 1 . . . . 4 ARG H . 16505 1 35 . 1 1 4 4 ARG HA H 1 4.67 . . 1 . . . . 4 ARG HA . 16505 1 36 . 1 1 4 4 ARG HB2 H 1 1.77 . . 2 . . . . 4 ARG HB2 . 16505 1 37 . 1 1 4 4 ARG HB3 H 1 1.88 . . 2 . . . . 4 ARG HB3 . 16505 1 38 . 1 1 4 4 ARG HD2 H 1 3.27 . . 2 . . . . 4 ARG HD2 . 16505 1 39 . 1 1 4 4 ARG HG2 H 1 1.72 . . 2 . . . . 4 ARG HG2 . 16505 1 40 . 1 1 4 4 ARG CA C 13 53.87 . . 1 . . . . 4 ARG CA . 16505 1 41 . 1 1 4 4 ARG CB C 13 30.62 . . 1 . . . . 4 ARG CB . 16505 1 42 . 1 1 4 4 ARG CD C 13 43.28 . . 1 . . . . 4 ARG CD . 16505 1 43 . 1 1 4 4 ARG CG C 13 26.85 . . 1 . . . . 4 ARG CG . 16505 1 44 . 1 1 4 4 ARG N N 15 121.45 . . 1 . . . . 4 ARG N . 16505 1 45 . 1 1 5 5 PRO HA H 1 4.44 . . 1 . . . . 5 PRO HA . 16505 1 46 . 1 1 5 5 PRO CA C 13 62.84 . . 1 . . . . 5 PRO CA . 16505 1 47 . 1 1 5 5 PRO CB C 13 32.19 . . 1 . . . . 5 PRO CB . 16505 1 48 . 1 1 5 5 PRO CD C 13 50.38 . . 1 . . . . 5 PRO CD . 16505 1 49 . 1 1 5 5 PRO CG C 13 27.34 . . 1 . . . . 5 PRO CG . 16505 1 50 . 1 1 6 6 LYS H H 1 8.26 . . 1 . . . . 6 LYS H . 16505 1 51 . 1 1 6 6 LYS CA C 13 54.14 . . 1 . . . . 6 LYS CA . 16505 1 52 . 1 1 6 6 LYS CB C 13 32.8 . . 1 . . . . 6 LYS CB . 16505 1 53 . 1 1 6 6 LYS N N 15 121.92 . . 1 . . . . 6 LYS N . 16505 1 54 . 1 1 10 10 TRP HA H 1 4.64 . . 1 . . . . 10 TRP HA . 16505 1 55 . 1 1 10 10 TRP HB2 H 1 3.31 . . 2 . . . . 10 TRP HB2 . 16505 1 56 . 1 1 10 10 TRP HB3 H 1 3.23 . . 2 . . . . 10 TRP HB3 . 16505 1 57 . 1 1 10 10 TRP CA C 13 57.6 . . 1 . . . . 10 TRP CA . 16505 1 58 . 1 1 10 10 TRP CB C 13 29.66 . . 1 . . . . 10 TRP CB . 16505 1 59 . 1 1 11 11 ASN H H 1 8.35 . . 1 . . . . 11 ASN H . 16505 1 60 . 1 1 11 11 ASN HA H 1 4.76 . . 1 . . . . 11 ASN HA . 16505 1 61 . 1 1 11 11 ASN HB2 H 1 2.75 . . 2 . . . . 11 ASN HB2 . 16505 1 62 . 1 1 11 11 ASN HB3 H 1 2.61 . . 2 . . . . 11 ASN HB3 . 16505 1 63 . 1 1 11 11 ASN CA C 13 53.19 . . 1 . . . . 11 ASN CA . 16505 1 64 . 1 1 11 11 ASN CB C 13 38.72 . . 1 . . . . 11 ASN CB . 16505 1 65 . 1 1 11 11 ASN N N 15 119.29 . . 1 . . . . 11 ASN N . 16505 1 66 . 1 1 12 12 THR H H 1 8.00 . . 1 . . . . 12 THR H . 16505 1 67 . 1 1 12 12 THR HA H 1 4.36 . . 1 . . . . 12 THR HA . 16505 1 68 . 1 1 12 12 THR HB H 1 4.23 . . 1 . . . . 12 THR HB . 16505 1 69 . 1 1 12 12 THR HG21 H 1 1.23 . . 1 . . . . 12 THR HG1 . 16505 1 70 . 1 1 12 12 THR HG22 H 1 1.23 . . 1 . . . . 12 THR HG1 . 16505 1 71 . 1 1 12 12 THR HG23 H 1 1.23 . . 1 . . . . 12 THR HG1 . 16505 1 72 . 1 1 12 12 THR CA C 13 62.05 . . 1 . . . . 12 THR CA . 16505 1 73 . 1 1 12 12 THR CB C 13 69.6 . . 1 . . . . 12 THR CB . 16505 1 74 . 1 1 12 12 THR CG2 C 13 21.72 . . 1 . . . . 12 THR CG2 . 16505 1 75 . 1 1 12 12 THR N N 15 112.66 . . 1 . . . . 12 THR N . 16505 1 76 . 1 1 13 13 GLY H H 1 8.42 . . 1 . . . . 13 GLY H . 16505 1 77 . 1 1 13 13 GLY CA C 13 45.64 . . 1 . . . . 13 GLY CA . 16505 1 78 . 1 1 13 13 GLY N N 15 110.44 . . 1 . . . . 13 GLY N . 16505 1 79 . 1 1 14 14 GLY HA2 H 1 4.04 . . 2 . . . . 14 GLY HA2 . 16505 1 80 . 1 1 14 14 GLY CA C 13 45.34 . . 1 . . . . 14 GLY CA . 16505 1 81 . 1 1 15 15 SER H H 1 8.15 . . 1 . . . . 15 SER H . 16505 1 82 . 1 1 15 15 SER HA H 1 4.48 . . 1 . . . . 15 SER HA . 16505 1 83 . 1 1 15 15 SER HB2 H 1 3.88 . . 2 . . . . 15 SER HB2 . 16505 1 84 . 1 1 15 15 SER CA C 13 58.4 . . 1 . . . . 15 SER CA . 16505 1 85 . 1 1 15 15 SER CB C 13 64.13 . . 1 . . . . 15 SER CB . 16505 1 86 . 1 1 15 15 SER N N 15 114.94 . . 1 . . . . 15 SER N . 16505 1 87 . 1 1 16 16 ARG H H 1 8.23 . . 1 . . . . 16 ARG H . 16505 1 88 . 1 1 16 16 ARG HA H 1 4.32 . . 1 . . . . 16 ARG HA . 16505 1 89 . 1 1 16 16 ARG HB2 H 1 1.74 . . 2 . . . . 16 ARG HB2 . 16505 1 90 . 1 1 16 16 ARG HD2 H 1 3.15 . . 2 . . . . 16 ARG HD2 . 16505 1 91 . 1 1 16 16 ARG HG2 H 1 1.50 . . 2 . . . . 16 ARG HG2 . 16505 1 92 . 1 1 16 16 ARG CA C 13 56.14 . . 1 . . . . 16 ARG CA . 16505 1 93 . 1 1 16 16 ARG CB C 13 31.07 . . 1 . . . . 16 ARG CB . 16505 1 94 . 1 1 16 16 ARG CD C 13 43.28 . . 1 . . . . 16 ARG CD . 16505 1 95 . 1 1 16 16 ARG CG C 13 27.22 . . 1 . . . . 16 ARG CG . 16505 1 96 . 1 1 16 16 ARG N N 15 121.80 . . 1 . . . . 16 ARG N . 16505 1 97 . 1 1 17 17 TYR H H 1 8.13 . . 1 . . . . 17 TYR H . 16505 1 98 . 1 1 17 17 TYR HA H 1 4.84 . . 1 . . . . 17 TYR HA . 16505 1 99 . 1 1 17 17 TYR HB2 H 1 2.86 . . 2 . . . . 17 TYR HB2 . 16505 1 100 . 1 1 17 17 TYR HB3 H 1 3.08 . . 2 . . . . 17 TYR HB3 . 16505 1 101 . 1 1 17 17 TYR CA C 13 55.84 . . 1 . . . . 17 TYR CA . 16505 1 102 . 1 1 17 17 TYR CB C 13 38.44 . . 1 . . . . 17 TYR CB . 16505 1 103 . 1 1 17 17 TYR N N 15 120.62 . . 1 . . . . 17 TYR N . 16505 1 104 . 1 1 19 19 GLY HA2 H 1 3.94 . . 2 . . . . 19 GLY HA2 . 16505 1 105 . 1 1 19 19 GLY CA C 13 45.64 . . 1 . . . . 19 GLY CA . 16505 1 106 . 1 1 20 20 GLN H H 1 8.16 . . 1 . . . . 20 GLN H . 16505 1 107 . 1 1 20 20 GLN HA H 1 4.37 . . 1 . . . . 20 GLN HA . 16505 1 108 . 1 1 20 20 GLN HB2 H 1 2.19 . . 2 . . . . 20 GLN HB2 . 16505 1 109 . 1 1 20 20 GLN HB3 H 1 1.98 . . 2 . . . . 20 GLN HB3 . 16505 1 110 . 1 1 20 20 GLN HG2 H 1 2.39 . . 2 . . . . 20 GLN HG2 . 16505 1 111 . 1 1 20 20 GLN CA C 13 56.14 . . 1 . . . . 20 GLN CA . 16505 1 112 . 1 1 20 20 GLN CB C 13 29.57 . . 1 . . . . 20 GLN CB . 16505 1 113 . 1 1 20 20 GLN CG C 13 33.89 . . 1 . . . . 20 GLN CG . 16505 1 114 . 1 1 20 20 GLN N N 15 118.92 . . 1 . . . . 20 GLN N . 16505 1 115 . 1 1 21 21 GLY H H 1 8.47 . . 1 . . . . 21 GLY H . 16505 1 116 . 1 1 21 21 GLY HA2 H 1 4.03 . . 2 . . . . 21 GLY HA2 . 16505 1 117 . 1 1 21 21 GLY CA C 13 45.22 . . 1 . . . . 21 GLY CA . 16505 1 118 . 1 1 21 21 GLY N N 15 109.52 . . 1 . . . . 21 GLY N . 16505 1 119 . 1 1 22 22 SER H H 1 8.15 . . 1 . . . . 22 SER H . 16505 1 120 . 1 1 22 22 SER HA H 1 4.81 . . 1 . . . . 22 SER HA . 16505 1 121 . 1 1 22 22 SER HB2 H 1 3.87 . . 2 . . . . 22 SER HB2 . 16505 1 122 . 1 1 22 22 SER CA C 13 56.35 . . 1 . . . . 22 SER CA . 16505 1 123 . 1 1 22 22 SER CB C 13 63.54 . . 1 . . . . 22 SER CB . 16505 1 124 . 1 1 22 22 SER N N 15 116.02 . . 1 . . . . 22 SER N . 16505 1 125 . 1 1 26 26 ASN H H 1 8.29 . . 1 . . . . 26 ASN H . 16505 1 126 . 1 1 26 26 ASN HA H 1 4.75 . . 1 . . . . 26 ASN HA . 16505 1 127 . 1 1 26 26 ASN HB2 H 1 2.77 . . 2 . . . . 26 ASN HB2 . 16505 1 128 . 1 1 26 26 ASN CA C 13 53.26 . . 1 . . . . 26 ASN CA . 16505 1 129 . 1 1 26 26 ASN CB C 13 39.15 . . 1 . . . . 26 ASN CB . 16505 1 130 . 1 1 26 26 ASN N N 15 118.01 . . 1 . . . . 26 ASN N . 16505 1 131 . 1 1 27 27 ARG H H 1 8.11 . . 1 . . . . 27 ARG H . 16505 1 132 . 1 1 27 27 ARG HA H 1 4.28 . . 1 . . . . 27 ARG HA . 16505 1 133 . 1 1 27 27 ARG HB2 H 1 1.69 . . 2 . . . . 27 ARG HB2 . 16505 1 134 . 1 1 27 27 ARG HD2 H 1 3.16 . . 2 . . . . 27 ARG HD2 . 16505 1 135 . 1 1 27 27 ARG HG2 H 1 1.49 . . 2 . . . . 27 ARG HG2 . 16505 1 136 . 1 1 27 27 ARG CA C 13 56.13 . . 1 . . . . 27 ARG CA . 16505 1 137 . 1 1 27 27 ARG CB C 13 31.09 . . 1 . . . . 27 ARG CB . 16505 1 138 . 1 1 27 27 ARG CD C 13 43.15 . . 1 . . . . 27 ARG CD . 16505 1 139 . 1 1 27 27 ARG CG C 13 27.01 . . 1 . . . . 27 ARG CG . 16505 1 140 . 1 1 27 27 ARG N N 15 119.92 . . 1 . . . . 27 ARG N . 16505 1 141 . 1 1 30 30 PRO HA H 1 4.46 . . 1 . . . . 30 PRO HA . 16505 1 142 . 1 1 30 30 PRO HB2 H 1 2.3 . . 2 . . . . 30 PRO HB2 . 16505 1 143 . 1 1 30 30 PRO HB3 H 1 1.92 . . 2 . . . . 30 PRO HB3 . 16505 1 144 . 1 1 30 30 PRO HD2 H 1 3.73 . . 2 . . . . 30 PRO HD2 . 16505 1 145 . 1 1 30 30 PRO HG2 H 1 1.99 . . 2 . . . . 30 PRO HG2 . 16505 1 146 . 1 1 30 30 PRO CA C 13 63.27 . . 1 . . . . 30 PRO CA . 16505 1 147 . 1 1 30 30 PRO CB C 13 32.07 . . 1 . . . . 30 PRO CB . 16505 1 148 . 1 1 30 30 PRO CD C 13 50.07 . . 1 . . . . 30 PRO CD . 16505 1 149 . 1 1 30 30 PRO CG C 13 27.52 . . 1 . . . . 30 PRO CG . 16505 1 150 . 1 1 31 31 GLN H H 1 8.49 . . 1 . . . . 31 GLN H . 16505 1 151 . 1 1 31 31 GLN HA H 1 4.33 . . 1 . . . . 31 GLN HA . 16505 1 152 . 1 1 31 31 GLN HB2 H 1 2.08 . . 2 . . . . 31 GLN HB2 . 16505 1 153 . 1 1 31 31 GLN HG2 H 1 2.41 . . 2 . . . . 31 GLN HG2 . 16505 1 154 . 1 1 31 31 GLN CA C 13 55.94 . . 1 . . . . 31 GLN CA . 16505 1 155 . 1 1 31 31 GLN CB C 13 29.54 . . 1 . . . . 31 GLN CB . 16505 1 156 . 1 1 31 31 GLN CG C 13 33.91 . . 1 . . . . 31 GLN CG . 16505 1 157 . 1 1 31 31 GLN N N 15 119.30 . . 1 . . . . 31 GLN N . 16505 1 158 . 1 1 35 35 THR H H 1 8.01 . . 1 . . . . 35 THR H . 16505 1 159 . 1 1 35 35 THR HA H 1 4.35 . . 1 . . . . 35 THR HA . 16505 1 160 . 1 1 35 35 THR HB H 1 4.15 . . 1 . . . . 35 THR HB . 16505 1 161 . 1 1 35 35 THR HG21 H 1 1.11 . . 1 . . . . 35 THR HG1 . 16505 1 162 . 1 1 35 35 THR HG22 H 1 1.11 . . 1 . . . . 35 THR HG1 . 16505 1 163 . 1 1 35 35 THR HG23 H 1 1.11 . . 1 . . . . 35 THR HG1 . 16505 1 164 . 1 1 35 35 THR CA C 13 61.88 . . 1 . . . . 35 THR CA . 16505 1 165 . 1 1 35 35 THR CB C 13 69.77 . . 1 . . . . 35 THR CB . 16505 1 166 . 1 1 35 35 THR CG2 C 13 21.57 . . 1 . . . . 35 THR CG2 . 16505 1 167 . 1 1 35 35 THR N N 15 112.66 . . 1 . . . . 35 THR N . 16505 1 168 . 1 1 36 36 TRP H H 1 8.23 . . 1 . . . . 36 TRP H . 16505 1 169 . 1 1 36 36 TRP HA H 1 4.65 . . 1 . . . . 36 TRP HA . 16505 1 170 . 1 1 36 36 TRP HB2 H 1 3.30 . . 2 . . . . 36 TRP HB2 . 16505 1 171 . 1 1 36 36 TRP CA C 13 57.56 . . 1 . . . . 36 TRP CA . 16505 1 172 . 1 1 36 36 TRP CB C 13 29.7 . . 1 . . . . 36 TRP CB . 16505 1 173 . 1 1 36 36 TRP N N 15 122.57 . . 1 . . . . 36 TRP N . 16505 1 174 . 1 1 37 37 GLY H H 1 8.24 . . 1 . . . . 37 GLY H . 16505 1 175 . 1 1 37 37 GLY HA2 H 1 3.89 . . 2 . . . . 37 GLY HA2 . 16505 1 176 . 1 1 37 37 GLY CA C 13 45.31 . . 1 . . . . 37 GLY CA . 16505 1 177 . 1 1 37 37 GLY N N 15 109.62 . . 1 . . . . 37 GLY N . 16505 1 178 . 1 1 38 38 GLN H H 1 7.99 . . 1 . . . . 38 GLN H . 16505 1 179 . 1 1 38 38 GLN HA H 1 4.62 . . 1 . . . . 38 GLN HA . 16505 1 180 . 1 1 38 38 GLN HB2 H 1 2.08 . . 2 . . . . 38 GLN HB2 . 16505 1 181 . 1 1 38 38 GLN HB3 H 1 1.90 . . 2 . . . . 38 GLN HB3 . 16505 1 182 . 1 1 38 38 GLN HG2 H 1 2.34 . . 2 . . . . 38 GLN HG2 . 16505 1 183 . 1 1 38 38 GLN CA C 13 53.54 . . 1 . . . . 38 GLN CA . 16505 1 184 . 1 1 38 38 GLN CB C 13 29.15 . . 1 . . . . 38 GLN CB . 16505 1 185 . 1 1 38 38 GLN CG C 13 33.34 . . 1 . . . . 38 GLN CG . 16505 1 186 . 1 1 38 38 GLN N N 15 119.56 . . 1 . . . . 38 GLN N . 16505 1 187 . 1 1 39 39 PRO HA H 1 4.35 . . 1 . . . . 39 PRO HA . 16505 1 188 . 1 1 39 39 PRO HB2 H 1 1.80 . . 2 . . . . 39 PRO HB2 . 16505 1 189 . 1 1 39 39 PRO HB3 H 1 2.20 . . 2 . . . . 39 PRO HB3 . 16505 1 190 . 1 1 39 39 PRO HD2 H 1 3.73 . . 2 . . . . 39 PRO HD2 . 16505 1 191 . 1 1 39 39 PRO HD3 H 1 3.63 . . 2 . . . . 39 PRO HD3 . 16505 1 192 . 1 1 39 39 PRO HG2 H 1 1.92 . . 2 . . . . 39 PRO HG2 . 16505 1 193 . 1 1 39 39 PRO HG3 H 1 1.95 . . 2 . . . . 39 PRO HG3 . 16505 1 194 . 1 1 39 39 PRO CA C 13 63.28 . . 1 . . . . 39 PRO CA . 16505 1 195 . 1 1 39 39 PRO CB C 13 32.04 . . 1 . . . . 39 PRO CB . 16505 1 196 . 1 1 39 39 PRO CD C 13 50.41 . . 1 . . . . 39 PRO CD . 16505 1 197 . 1 1 39 39 PRO CG C 13 27.44 . . 1 . . . . 39 PRO CG . 16505 1 198 . 1 1 40 40 HIS H H 1 8.48 . . 1 . . . . 40 HIS H . 16505 1 199 . 1 1 40 40 HIS HA H 1 4.71 . . 1 . . . . 40 HIS HA . 16505 1 200 . 1 1 40 40 HIS HB2 H 1 3.29 . . 2 . . . . 40 HIS HB2 . 16505 1 201 . 1 1 40 40 HIS HB3 H 1 3.20 . . 2 . . . . 40 HIS HB3 . 16505 1 202 . 1 1 40 40 HIS CA C 13 55.26 . . 1 . . . . 40 HIS CA . 16505 1 203 . 1 1 40 40 HIS CB C 13 29.16 . . 1 . . . . 40 HIS CB . 16505 1 204 . 1 1 40 40 HIS N N 15 117.67 . . 1 . . . . 40 HIS N . 16505 1 205 . 1 1 41 41 GLY H H 1 8.36 . . 1 . . . . 41 GLY H . 16505 1 206 . 1 1 41 41 GLY CA C 13 45.50 . . 1 . . . . 41 GLY CA . 16505 1 207 . 1 1 41 41 GLY N N 15 109.22 . . 1 . . . . 41 GLY N . 16505 1 208 . 1 1 43 43 GLY HA2 H 1 3.94 . . 2 . . . . 43 GLY HA2 . 16505 1 209 . 1 1 43 43 GLY CA C 13 45.32 . . 1 . . . . 43 GLY CA . 16505 1 210 . 1 1 44 44 TRP H H 1 8.10 . . 1 . . . . 44 TRP H . 16505 1 211 . 1 1 44 44 TRP HA H 1 4.62 . . 1 . . . . 44 TRP HA . 16505 1 212 . 1 1 44 44 TRP HB2 H 1 3.37 . . 2 . . . . 44 TRP HB2 . 16505 1 213 . 1 1 44 44 TRP HB3 H 1 3.23 . . 2 . . . . 44 TRP HB3 . 16505 1 214 . 1 1 44 44 TRP HD1 H 1 7.27 . . 1 . . . . 44 TRP HD1 . 16505 1 215 . 1 1 44 44 TRP HE1 H 1 10.13 . . 1 . . . . 44 TRP HE1 . 16505 1 216 . 1 1 44 44 TRP HE3 H 1 7.60 . . 1 . . . . 44 TRP HE3 . 16505 1 217 . 1 1 44 44 TRP CA C 13 57.56 . . 1 . . . . 44 TRP CA . 16505 1 218 . 1 1 44 44 TRP CB C 13 29.60 . . 1 . . . . 44 TRP CB . 16505 1 219 . 1 1 44 44 TRP N N 15 120.52 . . 1 . . . . 44 TRP N . 16505 1 220 . 1 1 45 45 GLY H H 1 8.35 . . 1 . . . . 45 GLY H . 16505 1 221 . 1 1 45 45 GLY HA2 H 1 3.89 . . 2 . . . . 45 GLY HA2 . 16505 1 222 . 1 1 45 45 GLY CA C 13 45.50 . . 1 . . . . 45 GLY CA . 16505 1 223 . 1 1 45 45 GLY N N 15 109.85 . . 1 . . . . 45 GLY N . 16505 1 224 . 1 1 46 46 GLN H H 1 7.99 . . 1 . . . . 46 GLN H . 16505 1 225 . 1 1 46 46 GLN HA H 1 4.62 . . 1 . . . . 46 GLN HA . 16505 1 226 . 1 1 46 46 GLN HB2 H 1 2.08 . . 2 . . . . 46 GLN HB2 . 16505 1 227 . 1 1 46 46 GLN HB3 H 1 1.90 . . 2 . . . . 46 GLN HB3 . 16505 1 228 . 1 1 46 46 GLN HG2 H 1 2.34 . . 2 . . . . 46 GLN HG2 . 16505 1 229 . 1 1 46 46 GLN CA C 13 53.54 . . 1 . . . . 46 GLN CA . 16505 1 230 . 1 1 46 46 GLN CB C 13 29.15 . . 1 . . . . 46 GLN CB . 16505 1 231 . 1 1 46 46 GLN CG C 13 33.34 . . 1 . . . . 46 GLN CG . 16505 1 232 . 1 1 46 46 GLN N N 15 119.56 . . 1 . . . . 46 GLN N . 16505 1 233 . 1 1 47 47 PRO HA H 1 4.35 . . 1 . . . . 47 PRO HA . 16505 1 234 . 1 1 47 47 PRO HB2 H 1 1.80 . . 2 . . . . 47 PRO HB2 . 16505 1 235 . 1 1 47 47 PRO HB3 H 1 2.20 . . 2 . . . . 47 PRO HB3 . 16505 1 236 . 1 1 47 47 PRO HD2 H 1 3.73 . . 2 . . . . 47 PRO HD2 . 16505 1 237 . 1 1 47 47 PRO HD3 H 1 3.63 . . 2 . . . . 47 PRO HD3 . 16505 1 238 . 1 1 47 47 PRO HG2 H 1 1.92 . . 2 . . . . 47 PRO HG2 . 16505 1 239 . 1 1 47 47 PRO HG3 H 1 1.95 . . 2 . . . . 47 PRO HG3 . 16505 1 240 . 1 1 47 47 PRO CA C 13 63.25 . . 1 . . . . 47 PRO CA . 16505 1 241 . 1 1 47 47 PRO CB C 13 32.04 . . 1 . . . . 47 PRO CB . 16505 1 242 . 1 1 47 47 PRO CD C 13 50.41 . . 1 . . . . 47 PRO CD . 16505 1 243 . 1 1 47 47 PRO CG C 13 27.44 . . 1 . . . . 47 PRO CG . 16505 1 244 . 1 1 48 48 HIS H H 1 8.48 . . 1 . . . . 48 HIS H . 16505 1 245 . 1 1 48 48 HIS HA H 1 4.71 . . 1 . . . . 48 HIS HA . 16505 1 246 . 1 1 48 48 HIS HB2 H 1 3.29 . . 2 . . . . 48 HIS HB2 . 16505 1 247 . 1 1 48 48 HIS HB3 H 1 3.20 . . 2 . . . . 48 HIS HB3 . 16505 1 248 . 1 1 48 48 HIS CA C 13 55.26 . . 1 . . . . 48 HIS CA . 16505 1 249 . 1 1 48 48 HIS CB C 13 29.16 . . 1 . . . . 48 HIS CB . 16505 1 250 . 1 1 48 48 HIS N N 15 117.67 . . 1 . . . . 48 HIS N . 16505 1 251 . 1 1 49 49 GLY H H 1 8.36 . . 1 . . . . 49 GLY H . 16505 1 252 . 1 1 49 49 GLY CA C 13 45.50 . . 1 . . . . 49 GLY CA . 16505 1 253 . 1 1 49 49 GLY N N 15 109.22 . . 1 . . . . 49 GLY N . 16505 1 254 . 1 1 51 51 GLY HA2 H 1 3.94 . . 2 . . . . 51 GLY HA2 . 16505 1 255 . 1 1 51 51 GLY CA C 13 45.32 . . 1 . . . . 51 GLY CA . 16505 1 256 . 1 1 52 52 TRP H H 1 8.10 . . 1 . . . . 52 TRP H . 16505 1 257 . 1 1 52 52 TRP HA H 1 4.62 . . 1 . . . . 52 TRP HA . 16505 1 258 . 1 1 52 52 TRP HB2 H 1 3.37 . . 2 . . . . 52 TRP HB2 . 16505 1 259 . 1 1 52 52 TRP HB3 H 1 3.23 . . 2 . . . . 52 TRP HB3 . 16505 1 260 . 1 1 52 52 TRP HD1 H 1 7.27 . . 1 . . . . 52 TRP HD1 . 16505 1 261 . 1 1 52 52 TRP HE1 H 1 10.13 . . 1 . . . . 52 TRP HE1 . 16505 1 262 . 1 1 52 52 TRP HE3 H 1 7.60 . . 1 . . . . 52 TRP HE3 . 16505 1 263 . 1 1 52 52 TRP CA C 13 57.56 . . 1 . . . . 52 TRP CA . 16505 1 264 . 1 1 52 52 TRP CB C 13 29.60 . . 1 . . . . 52 TRP CB . 16505 1 265 . 1 1 52 52 TRP N N 15 120.52 . . 1 . . . . 52 TRP N . 16505 1 266 . 1 1 53 53 GLY H H 1 8.35 . . 1 . . . . 53 GLY H . 16505 1 267 . 1 1 53 53 GLY HA2 H 1 3.89 . . 2 . . . . 53 GLY HA2 . 16505 1 268 . 1 1 53 53 GLY CA C 13 45.50 . . 1 . . . . 53 GLY CA . 16505 1 269 . 1 1 53 53 GLY N N 15 109.85 . . 1 . . . . 53 GLY N . 16505 1 270 . 1 1 54 54 GLN H H 1 7.99 . . 1 . . . . 54 GLN H . 16505 1 271 . 1 1 54 54 GLN HA H 1 4.62 . . 1 . . . . 54 GLN HA . 16505 1 272 . 1 1 54 54 GLN HB2 H 1 2.08 . . 2 . . . . 54 GLN HB2 . 16505 1 273 . 1 1 54 54 GLN HB3 H 1 1.90 . . 2 . . . . 54 GLN HB3 . 16505 1 274 . 1 1 54 54 GLN HG2 H 1 2.34 . . 2 . . . . 54 GLN HG2 . 16505 1 275 . 1 1 54 54 GLN CA C 13 53.54 . . 1 . . . . 54 GLN CA . 16505 1 276 . 1 1 54 54 GLN CB C 13 29.15 . . 1 . . . . 54 GLN CB . 16505 1 277 . 1 1 54 54 GLN CG C 13 33.34 . . 1 . . . . 54 GLN CG . 16505 1 278 . 1 1 54 54 GLN N N 15 119.56 . . 1 . . . . 54 GLN N . 16505 1 279 . 1 1 55 55 PRO HA H 1 4.35 . . 1 . . . . 55 PRO HA . 16505 1 280 . 1 1 55 55 PRO HB2 H 1 1.80 . . 2 . . . . 55 PRO HB2 . 16505 1 281 . 1 1 55 55 PRO HB3 H 1 2.20 . . 2 . . . . 55 PRO HB3 . 16505 1 282 . 1 1 55 55 PRO HD2 H 1 3.73 . . 2 . . . . 55 PRO HD2 . 16505 1 283 . 1 1 55 55 PRO HD3 H 1 3.63 . . 2 . . . . 55 PRO HD3 . 16505 1 284 . 1 1 55 55 PRO HG2 H 1 1.92 . . 2 . . . . 55 PRO HG2 . 16505 1 285 . 1 1 55 55 PRO HG3 H 1 1.95 . . 2 . . . . 55 PRO HG3 . 16505 1 286 . 1 1 55 55 PRO CA C 13 63.25 . . 1 . . . . 55 PRO CA . 16505 1 287 . 1 1 55 55 PRO CB C 13 32.04 . . 1 . . . . 55 PRO CB . 16505 1 288 . 1 1 55 55 PRO CD C 13 50.41 . . 1 . . . . 55 PRO CD . 16505 1 289 . 1 1 55 55 PRO CG C 13 27.44 . . 1 . . . . 55 PRO CG . 16505 1 290 . 1 1 56 56 HIS H H 1 8.48 . . 1 . . . . 56 HIS H . 16505 1 291 . 1 1 56 56 HIS HA H 1 4.71 . . 1 . . . . 56 HIS HA . 16505 1 292 . 1 1 56 56 HIS HB2 H 1 3.29 . . 2 . . . . 56 HIS HB2 . 16505 1 293 . 1 1 56 56 HIS HB3 H 1 3.20 . . 2 . . . . 56 HIS HB3 . 16505 1 294 . 1 1 56 56 HIS CA C 13 55.26 . . 1 . . . . 56 HIS CA . 16505 1 295 . 1 1 56 56 HIS CB C 13 29.16 . . 1 . . . . 56 HIS CB . 16505 1 296 . 1 1 56 56 HIS N N 15 117.67 . . 1 . . . . 56 HIS N . 16505 1 297 . 1 1 57 57 GLY H H 1 8.36 . . 1 . . . . 57 GLY H . 16505 1 298 . 1 1 57 57 GLY CA C 13 45.50 . . 1 . . . . 57 GLY CA . 16505 1 299 . 1 1 57 57 GLY N N 15 109.22 . . 1 . . . . 57 GLY N . 16505 1 300 . 1 1 59 59 GLY HA2 H 1 3.94 . . 2 . . . . 59 GLY HA2 . 16505 1 301 . 1 1 59 59 GLY CA C 13 45.32 . . 1 . . . . 59 GLY CA . 16505 1 302 . 1 1 60 60 TRP H H 1 8.10 . . 1 . . . . 60 TRP H . 16505 1 303 . 1 1 60 60 TRP HA H 1 4.62 . . 1 . . . . 60 TRP HA . 16505 1 304 . 1 1 60 60 TRP HB2 H 1 3.37 . . 2 . . . . 60 TRP HB2 . 16505 1 305 . 1 1 60 60 TRP HB3 H 1 3.23 . . 2 . . . . 60 TRP HB3 . 16505 1 306 . 1 1 60 60 TRP HD1 H 1 7.27 . . 1 . . . . 60 TRP HD1 . 16505 1 307 . 1 1 60 60 TRP HE1 H 1 10.13 . . 1 . . . . 60 TRP HE1 . 16505 1 308 . 1 1 60 60 TRP HE3 H 1 7.60 . . 1 . . . . 60 TRP HE3 . 16505 1 309 . 1 1 60 60 TRP CA C 13 57.56 . . 1 . . . . 60 TRP CA . 16505 1 310 . 1 1 60 60 TRP CB C 13 29.60 . . 1 . . . . 60 TRP CB . 16505 1 311 . 1 1 60 60 TRP N N 15 120.52 . . 1 . . . . 60 TRP N . 16505 1 312 . 1 1 61 61 GLY H H 1 8.35 . . 1 . . . . 61 GLY H . 16505 1 313 . 1 1 61 61 GLY HA2 H 1 3.89 . . 2 . . . . 61 GLY HA2 . 16505 1 314 . 1 1 61 61 GLY CA C 13 45.50 . . 1 . . . . 61 GLY CA . 16505 1 315 . 1 1 61 61 GLY N N 15 109.85 . . 1 . . . . 61 GLY N . 16505 1 316 . 1 1 62 62 GLN H H 1 7.99 . . 1 . . . . 62 GLN H . 16505 1 317 . 1 1 62 62 GLN HA H 1 4.62 . . 1 . . . . 62 GLN HA . 16505 1 318 . 1 1 62 62 GLN HB2 H 1 2.08 . . 2 . . . . 62 GLN HB2 . 16505 1 319 . 1 1 62 62 GLN HB3 H 1 1.90 . . 2 . . . . 62 GLN HB3 . 16505 1 320 . 1 1 62 62 GLN HG2 H 1 2.34 . . 2 . . . . 62 GLN HG2 . 16505 1 321 . 1 1 62 62 GLN CA C 13 53.54 . . 1 . . . . 62 GLN CA . 16505 1 322 . 1 1 62 62 GLN CB C 13 29.15 . . 1 . . . . 62 GLN CB . 16505 1 323 . 1 1 62 62 GLN CG C 13 33.34 . . 1 . . . . 62 GLN CG . 16505 1 324 . 1 1 62 62 GLN N N 15 119.56 . . 1 . . . . 62 GLN N . 16505 1 325 . 1 1 63 63 PRO HA H 1 4.35 . . 1 . . . . 63 PRO HA . 16505 1 326 . 1 1 63 63 PRO HB2 H 1 1.80 . . 2 . . . . 63 PRO HB2 . 16505 1 327 . 1 1 63 63 PRO HB3 H 1 2.20 . . 2 . . . . 63 PRO HB3 . 16505 1 328 . 1 1 63 63 PRO HD2 H 1 3.73 . . 2 . . . . 63 PRO HD2 . 16505 1 329 . 1 1 63 63 PRO HD3 H 1 3.63 . . 2 . . . . 63 PRO HD3 . 16505 1 330 . 1 1 63 63 PRO HG2 H 1 1.92 . . 2 . . . . 63 PRO HG2 . 16505 1 331 . 1 1 63 63 PRO HG3 H 1 1.95 . . 2 . . . . 63 PRO HG3 . 16505 1 332 . 1 1 63 63 PRO CA C 13 63.25 . . 1 . . . . 63 PRO CA . 16505 1 333 . 1 1 63 63 PRO CB C 13 32.04 . . 1 . . . . 63 PRO CB . 16505 1 334 . 1 1 63 63 PRO CD C 13 50.41 . . 1 . . . . 63 PRO CD . 16505 1 335 . 1 1 63 63 PRO CG C 13 27.44 . . 1 . . . . 63 PRO CG . 16505 1 336 . 1 1 64 64 HIS H H 1 8.48 . . 1 . . . . 64 HIS H . 16505 1 337 . 1 1 64 64 HIS HA H 1 4.71 . . 1 . . . . 64 HIS HA . 16505 1 338 . 1 1 64 64 HIS HB2 H 1 3.29 . . 2 . . . . 64 HIS HB2 . 16505 1 339 . 1 1 64 64 HIS HB3 H 1 3.20 . . 2 . . . . 64 HIS HB3 . 16505 1 340 . 1 1 64 64 HIS CA C 13 55.26 . . 1 . . . . 64 HIS CA . 16505 1 341 . 1 1 64 64 HIS CB C 13 29.16 . . 1 . . . . 64 HIS CB . 16505 1 342 . 1 1 64 64 HIS N N 15 117.67 . . 1 . . . . 64 HIS N . 16505 1 343 . 1 1 65 65 GLY H H 1 8.36 . . 1 . . . . 65 GLY H . 16505 1 344 . 1 1 65 65 GLY CA C 13 45.50 . . 1 . . . . 65 GLY CA . 16505 1 345 . 1 1 65 65 GLY N N 15 109.22 . . 1 . . . . 65 GLY N . 16505 1 346 . 1 1 67 67 GLY HA2 H 1 3.94 . . 2 . . . . 67 GLY HA2 . 16505 1 347 . 1 1 67 67 GLY CA C 13 45.32 . . 1 . . . . 67 GLY CA . 16505 1 348 . 1 1 68 68 TRP H H 1 8.10 . . 1 . . . . 68 TRP H . 16505 1 349 . 1 1 68 68 TRP HA H 1 4.62 . . 1 . . . . 68 TRP HA . 16505 1 350 . 1 1 68 68 TRP HB2 H 1 3.37 . . 2 . . . . 68 TRP HB2 . 16505 1 351 . 1 1 68 68 TRP HB3 H 1 3.23 . . 2 . . . . 68 TRP HB3 . 16505 1 352 . 1 1 68 68 TRP HD1 H 1 7.27 . . 1 . . . . 68 TRP HD1 . 16505 1 353 . 1 1 68 68 TRP HE1 H 1 10.13 . . 1 . . . . 68 TRP HE1 . 16505 1 354 . 1 1 68 68 TRP HE3 H 1 7.60 . . 1 . . . . 68 TRP HE3 . 16505 1 355 . 1 1 68 68 TRP CA C 13 57.56 . . 1 . . . . 68 TRP CA . 16505 1 356 . 1 1 68 68 TRP CB C 13 29.60 . . 1 . . . . 68 TRP CB . 16505 1 357 . 1 1 68 68 TRP N N 15 120.52 . . 1 . . . . 68 TRP N . 16505 1 358 . 1 1 69 69 GLY H H 1 8.35 . . 1 . . . . 69 GLY H . 16505 1 359 . 1 1 69 69 GLY HA2 H 1 3.89 . . 2 . . . . 69 GLY HA2 . 16505 1 360 . 1 1 69 69 GLY CA C 13 45.50 . . 1 . . . . 69 GLY CA . 16505 1 361 . 1 1 69 69 GLY N N 15 109.85 . . 1 . . . . 69 GLY N . 16505 1 362 . 1 1 70 70 GLN H H 1 7.99 . . 1 . . . . 70 GLN H . 16505 1 363 . 1 1 70 70 GLN HA H 1 4.62 . . 1 . . . . 70 GLN HA . 16505 1 364 . 1 1 70 70 GLN HB2 H 1 2.08 . . 2 . . . . 70 GLN HB2 . 16505 1 365 . 1 1 70 70 GLN HB3 H 1 1.90 . . 2 . . . . 70 GLN HB3 . 16505 1 366 . 1 1 70 70 GLN HG2 H 1 2.34 . . 2 . . . . 70 GLN HG2 . 16505 1 367 . 1 1 70 70 GLN CA C 13 53.54 . . 1 . . . . 70 GLN CA . 16505 1 368 . 1 1 70 70 GLN CB C 13 29.15 . . 1 . . . . 70 GLN CB . 16505 1 369 . 1 1 70 70 GLN CG C 13 33.34 . . 1 . . . . 70 GLN CG . 16505 1 370 . 1 1 70 70 GLN N N 15 119.56 . . 1 . . . . 70 GLN N . 16505 1 371 . 1 1 74 74 THR H H 1 8.01 . . 1 . . . . 74 THR H . 16505 1 372 . 1 1 74 74 THR HA H 1 4.32 . . 1 . . . . 74 THR HA . 16505 1 373 . 1 1 74 74 THR HB H 1 4.22 . . 1 . . . . 74 THR HB . 16505 1 374 . 1 1 74 74 THR HG21 H 1 1.19 . . 1 . . . . 74 THR HG1 . 16505 1 375 . 1 1 74 74 THR HG22 H 1 1.19 . . 1 . . . . 74 THR HG1 . 16505 1 376 . 1 1 74 74 THR HG23 H 1 1.19 . . 1 . . . . 74 THR HG1 . 16505 1 377 . 1 1 74 74 THR CA C 13 62.18 . . 1 . . . . 74 THR CA . 16505 1 378 . 1 1 74 74 THR CB C 13 69.79 . . 1 . . . . 74 THR CB . 16505 1 379 . 1 1 74 74 THR CG2 C 13 21.74 . . 1 . . . . 74 THR CG2 . 16505 1 380 . 1 1 74 74 THR N N 15 112.66 . . 1 . . . . 74 THR N . 16505 1 381 . 1 1 75 75 HIS H H 1 8.44 . . 1 . . . . 75 HIS H . 16505 1 382 . 1 1 75 75 HIS HA H 1 4.72 . . 1 . . . . 75 HIS HA . 16505 1 383 . 1 1 75 75 HIS HB2 H 1 3.36 . . 2 . . . . 75 HIS HB2 . 16505 1 384 . 1 1 75 75 HIS HB3 H 1 3.09 . . 2 . . . . 75 HIS HB3 . 16505 1 385 . 1 1 75 75 HIS CA C 13 55.44 . . 1 . . . . 75 HIS CA . 16505 1 386 . 1 1 75 75 HIS CB C 13 28.69 . . 1 . . . . 75 HIS CB . 16505 1 387 . 1 1 75 75 HIS N N 15 119.56 . . 1 . . . . 75 HIS N . 16505 1 388 . 1 1 76 76 ASN H H 1 8.30 . . 1 . . . . 76 ASN H . 16505 1 389 . 1 1 76 76 ASN HA H 1 4.67 . . 1 . . . . 76 ASN HA . 16505 1 390 . 1 1 76 76 ASN HB2 H 1 2.74 . . 2 . . . . 76 ASN HB2 . 16505 1 391 . 1 1 76 76 ASN CA C 13 53.25 . . 1 . . . . 76 ASN CA . 16505 1 392 . 1 1 76 76 ASN CB C 13 39.05 . . 1 . . . . 76 ASN CB . 16505 1 393 . 1 1 76 76 ASN N N 15 118.87 . . 1 . . . . 76 ASN N . 16505 1 394 . 1 1 77 77 GLN H H 1 8.35 . . 1 . . . . 77 GLN H . 16505 1 395 . 1 1 77 77 GLN HA H 1 4.24 . . 1 . . . . 77 GLN HA . 16505 1 396 . 1 1 77 77 GLN HB2 H 1 1.98 . . 2 . . . . 77 GLN HB2 . 16505 1 397 . 1 1 77 77 GLN HB3 H 1 2.12 . . 2 . . . . 77 GLN HB3 . 16505 1 398 . 1 1 77 77 GLN HG2 H 1 2.17 . . 2 . . . . 77 GLN HG2 . 16505 1 399 . 1 1 77 77 GLN CA C 13 56.42 . . 1 . . . . 77 GLN CA . 16505 1 400 . 1 1 77 77 GLN CB C 13 29.20 . . 1 . . . . 77 GLN CB . 16505 1 401 . 1 1 77 77 GLN CG C 13 33.62 . . 1 . . . . 77 GLN CG . 16505 1 402 . 1 1 77 77 GLN N N 15 119.47 . . 1 . . . . 77 GLN N . 16505 1 403 . 1 1 78 78 TRP H H 1 8.08 . . 1 . . . . 78 TRP H . 16505 1 404 . 1 1 78 78 TRP HA H 1 4.68 . . 1 . . . . 78 TRP HA . 16505 1 405 . 1 1 78 78 TRP HB2 H 1 3.33 . . 2 . . . . 78 TRP HB2 . 16505 1 406 . 1 1 78 78 TRP CA C 13 57.43 . . 1 . . . . 78 TRP CA . 16505 1 407 . 1 1 78 78 TRP CB C 13 29.48 . . 1 . . . . 78 TRP CB . 16505 1 408 . 1 1 78 78 TRP N N 15 120.12 . . 1 . . . . 78 TRP N . 16505 1 409 . 1 1 79 79 ASN H H 1 8.10 . . 1 . . . . 79 ASN H . 16505 1 410 . 1 1 79 79 ASN HA H 1 4.71 . . 1 . . . . 79 ASN HA . 16505 1 411 . 1 1 79 79 ASN HB2 H 1 2.71 . . 2 . . . . 79 ASN HB2 . 16505 1 412 . 1 1 79 79 ASN CA C 13 52.94 . . 1 . . . . 79 ASN CA . 16505 1 413 . 1 1 79 79 ASN CB C 13 39.07 . . 1 . . . . 79 ASN CB . 16505 1 414 . 1 1 79 79 ASN N N 15 118.80 . . 1 . . . . 79 ASN N . 16505 1 415 . 1 1 80 80 LYS H H 1 7.91 . . 1 . . . . 80 LYS H . 16505 1 416 . 1 1 80 80 LYS HA H 1 4.53 . . 1 . . . . 80 LYS HA . 16505 1 417 . 1 1 80 80 LYS HB2 H 1 1.71 . . 2 . . . . 80 LYS HB2 . 16505 1 418 . 1 1 80 80 LYS HB3 H 1 1.85 . . 2 . . . . 80 LYS HB3 . 16505 1 419 . 1 1 80 80 LYS HD2 H 1 1.72 . . 2 . . . . 80 LYS HD2 . 16505 1 420 . 1 1 80 80 LYS HE2 H 1 3.03 . . 2 . . . . 80 LYS HE2 . 16505 1 421 . 1 1 80 80 LYS HG2 H 1 1.44 . . 2 . . . . 80 LYS HG2 . 16505 1 422 . 1 1 80 80 LYS CA C 13 54.39 . . 1 . . . . 80 LYS CA . 16505 1 423 . 1 1 80 80 LYS CB C 13 32.81 . . 1 . . . . 80 LYS CB . 16505 1 424 . 1 1 80 80 LYS CD C 13 29.15 . . 1 . . . . 80 LYS CD . 16505 1 425 . 1 1 80 80 LYS CE C 13 41.91 . . 1 . . . . 80 LYS CE . 16505 1 426 . 1 1 80 80 LYS CG C 13 24.43 . . 1 . . . . 80 LYS CG . 16505 1 427 . 1 1 80 80 LYS N N 15 121.48 . . 1 . . . . 80 LYS N . 16505 1 428 . 1 1 81 81 PRO HA H 1 4.50 . . 1 . . . . 81 PRO HA . 16505 1 429 . 1 1 81 81 PRO HB2 H 1 1.97 . . 2 . . . . 81 PRO HB2 . 16505 1 430 . 1 1 81 81 PRO HB3 H 1 2.32 . . 2 . . . . 81 PRO HB3 . 16505 1 431 . 1 1 81 81 PRO HD2 H 1 3.76 . . 2 . . . . 81 PRO HD2 . 16505 1 432 . 1 1 81 81 PRO HG2 H 1 2.04 . . 2 . . . . 81 PRO HG2 . 16505 1 433 . 1 1 81 81 PRO CA C 13 63.25 . . 1 . . . . 81 PRO CA . 16505 1 434 . 1 1 81 81 PRO CB C 13 32.18 . . 1 . . . . 81 PRO CB . 16505 1 435 . 1 1 81 81 PRO CD C 13 50.48 . . 1 . . . . 81 PRO CD . 16505 1 436 . 1 1 81 81 PRO CG C 13 27.30 . . 1 . . . . 81 PRO CG . 16505 1 437 . 1 1 82 82 SER H H 1 8.27 . . 1 . . . . 82 SER H . 16505 1 438 . 1 1 82 82 SER HA H 1 4.48 . . 1 . . . . 82 SER HA . 16505 1 439 . 1 1 82 82 SER HB2 H 1 3.89 . . 2 . . . . 82 SER HB2 . 16505 1 440 . 1 1 82 82 SER CA C 13 58.24 . . 1 . . . . 82 SER CA . 16505 1 441 . 1 1 82 82 SER CB C 13 64.09 . . 1 . . . . 82 SER CB . 16505 1 442 . 1 1 82 82 SER N N 15 115.48 . . 1 . . . . 82 SER N . 16505 1 443 . 1 1 83 83 LYS H H 1 8.19 . . 1 . . . . 83 LYS H . 16505 1 444 . 1 1 83 83 LYS HA H 1 4.62 . . 1 . . . . 83 LYS HA . 16505 1 445 . 1 1 83 83 LYS HB2 H 1 1.84 . . 2 . . . . 83 LYS HB2 . 16505 1 446 . 1 1 83 83 LYS HG2 H 1 1.51 . . 2 . . . . 83 LYS HG2 . 16505 1 447 . 1 1 83 83 LYS CA C 13 54.30 . . 1 . . . . 83 LYS CA . 16505 1 448 . 1 1 83 83 LYS CB C 13 32.84 . . 1 . . . . 83 LYS CB . 16505 1 449 . 1 1 83 83 LYS N N 15 123.66 . . 1 . . . . 83 LYS N . 16505 1 450 . 1 1 84 84 PRO HA H 1 4.46 . . 1 . . . . 84 PRO HA . 16505 1 451 . 1 1 84 84 PRO HB2 H 1 2.32 . . 2 . . . . 84 PRO HB2 . 16505 1 452 . 1 1 84 84 PRO HB3 H 1 1.99 . . 2 . . . . 84 PRO HB3 . 16505 1 453 . 1 1 84 84 PRO HD2 H 1 3.69 . . 2 . . . . 84 PRO HD2 . 16505 1 454 . 1 1 84 84 PRO HD3 H 1 3.81 . . 2 . . . . 84 PRO HD3 . 16505 1 455 . 1 1 84 84 PRO HG2 H 1 2.04 . . 2 . . . . 84 PRO HG2 . 16505 1 456 . 1 1 84 84 PRO CA C 13 63.46 . . 1 . . . . 84 PRO CA . 16505 1 457 . 1 1 84 84 PRO CB C 13 32.04 . . 1 . . . . 84 PRO CB . 16505 1 458 . 1 1 84 84 PRO CD C 13 50.51 . . 1 . . . . 84 PRO CD . 16505 1 459 . 1 1 84 84 PRO CG C 13 27.44 . . 1 . . . . 84 PRO CG . 16505 1 460 . 1 1 85 85 LYS H H 1 7.87 . . 1 . . . . 85 LYS H . 16505 1 461 . 1 1 85 85 LYS HA H 1 4.21 . . 1 . . . . 85 LYS HA . 16505 1 462 . 1 1 85 85 LYS HB2 H 1 1.90 . . 2 . . . . 85 LYS HB2 . 16505 1 463 . 1 1 85 85 LYS HB3 H 1 1.76 . . 2 . . . . 85 LYS HB3 . 16505 1 464 . 1 1 85 85 LYS HD2 H 1 1.74 . . 2 . . . . 85 LYS HD2 . 16505 1 465 . 1 1 85 85 LYS HE2 H 1 3.06 . . 2 . . . . 85 LYS HE2 . 16505 1 466 . 1 1 85 85 LYS HG2 H 1 1.48 . . 2 . . . . 85 LYS HG2 . 16505 1 467 . 1 1 85 85 LYS CA C 13 57.39 . . 1 . . . . 85 LYS CA . 16505 1 468 . 1 1 85 85 LYS CB C 13 34.18 . . 1 . . . . 85 LYS CB . 16505 1 469 . 1 1 85 85 LYS CD C 13 29.01 . . 1 . . . . 85 LYS CD . 16505 1 470 . 1 1 85 85 LYS CG C 13 24.85 . . 1 . . . . 85 LYS CG . 16505 1 471 . 1 1 85 85 LYS N N 15 125.86 . . 1 . . . . 85 LYS N . 16505 1 stop_ save_