################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34965 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' . . . 34965 1 2 '3D CBCA(CO)NH' . . . 34965 1 3 '3D HCCH-TOCSY' . . . 34965 1 4 '3D 1H-13C NOESY' . . . 34965 1 5 '3D 1H-15N NOESY' . . . 34965 1 6 '2D 1H-13C HSQC' . . . 34965 1 7 '2D 1H-15N HSQC' . . . 34965 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLY HA2 H 1 3.888 0.020 . 2 . . . . A 26 GLY HA2 . 34965 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.876 0.020 . 2 . . . . A 26 GLY HA3 . 34965 1 3 . 1 . 1 1 1 GLY CA C 13 43.392 0.3 . 1 . . . . A 26 GLY CA . 34965 1 4 . 1 . 1 2 2 PRO HA H 1 4.390 0.020 . 1 . . . . A 27 PRO HA . 34965 1 5 . 1 . 1 2 2 PRO HB2 H 1 2.252 0.020 . 2 . . . . A 27 PRO HB2 . 34965 1 6 . 1 . 1 2 2 PRO HB3 H 1 1.866 0.020 . 2 . . . . A 27 PRO HB3 . 34965 1 7 . 1 . 1 2 2 PRO HG2 H 1 1.941 0.020 . 1 . . . . A 27 PRO HG2 . 34965 1 8 . 1 . 1 2 2 PRO HG3 H 1 1.941 0.020 . 1 . . . . A 27 PRO HG3 . 34965 1 9 . 1 . 1 2 2 PRO HD2 H 1 3.515 0.020 . 2 . . . . A 27 PRO HD2 . 34965 1 10 . 1 . 1 2 2 PRO HD3 H 1 3.489 0.020 . 2 . . . . A 27 PRO HD3 . 34965 1 11 . 1 . 1 2 2 PRO CA C 13 63.000 0.3 . 1 . . . . A 27 PRO CA . 34965 1 12 . 1 . 1 2 2 PRO CB C 13 32.118 0.3 . 1 . . . . A 27 PRO CB . 34965 1 13 . 1 . 1 2 2 PRO CG C 13 26.880 0.3 . 1 . . . . A 27 PRO CG . 34965 1 14 . 1 . 1 2 2 PRO CD C 13 49.446 0.3 . 1 . . . . A 27 PRO CD . 34965 1 15 . 1 . 1 3 3 MET H H 1 8.468 0.020 . 1 . . . . A 28 MET H . 34965 1 16 . 1 . 1 3 3 MET HA H 1 4.376 0.020 . 1 . . . . A 28 MET HA . 34965 1 17 . 1 . 1 3 3 MET HB2 H 1 2.547 0.020 . 2 . . . . A 28 MET HB2 . 34965 1 18 . 1 . 1 3 3 MET HB3 H 1 2.502 0.020 . 2 . . . . A 28 MET HB3 . 34965 1 19 . 1 . 1 3 3 MET HG2 H 1 1.995 0.020 . 2 . . . . A 28 MET HG2 . 34965 1 20 . 1 . 1 3 3 MET HG3 H 1 1.963 0.020 . 2 . . . . A 28 MET HG3 . 34965 1 21 . 1 . 1 3 3 MET HE1 H 1 1.968 0.020 . 1 . . . . A 28 MET HE1 . 34965 1 22 . 1 . 1 3 3 MET HE2 H 1 1.968 0.020 . 1 . . . . A 28 MET HE2 . 34965 1 23 . 1 . 1 3 3 MET HE3 H 1 1.968 0.020 . 1 . . . . A 28 MET HE3 . 34965 1 24 . 1 . 1 3 3 MET CA C 13 55.474 0.3 . 1 . . . . A 28 MET CA . 34965 1 25 . 1 . 1 3 3 MET CB C 13 31.910 0.3 . 1 . . . . A 28 MET CB . 34965 1 26 . 1 . 1 3 3 MET CG C 13 32.763 0.3 . 1 . . . . A 28 MET CG . 34965 1 27 . 1 . 1 3 3 MET CE C 13 16.737 0.3 . 1 . . . . A 28 MET CE . 34965 1 28 . 1 . 1 3 3 MET N N 15 120.930 0.3 . 1 . . . . A 28 MET N . 34965 1 29 . 1 . 1 4 4 LYS H H 1 8.311 0.020 . 1 . . . . A 29 LYS H . 34965 1 30 . 1 . 1 4 4 LYS HA H 1 4.173 0.020 . 1 . . . . A 29 LYS HA . 34965 1 31 . 1 . 1 4 4 LYS HB2 H 1 1.598 0.020 . 2 . . . . A 29 LYS HB2 . 34965 1 32 . 1 . 1 4 4 LYS HB3 H 1 1.583 0.020 . 2 . . . . A 29 LYS HB3 . 34965 1 33 . 1 . 1 4 4 LYS HG2 H 1 1.373 0.020 . 2 . . . . A 29 LYS HG2 . 34965 1 34 . 1 . 1 4 4 LYS HG3 H 1 1.319 0.020 . 2 . . . . A 29 LYS HG3 . 34965 1 35 . 1 . 1 4 4 LYS HD2 H 1 1.809 0.020 . 2 . . . . A 29 LYS HD2 . 34965 1 36 . 1 . 1 4 4 LYS HD3 H 1 1.637 0.020 . 2 . . . . A 29 LYS HD3 . 34965 1 37 . 1 . 1 4 4 LYS HE2 H 1 2.916 0.020 . 1 . . . . A 29 LYS HE2 . 34965 1 38 . 1 . 1 4 4 LYS HE3 H 1 2.916 0.020 . 1 . . . . A 29 LYS HE3 . 34965 1 39 . 1 . 1 4 4 LYS CA C 13 56.314 0.3 . 1 . . . . A 29 LYS CA . 34965 1 40 . 1 . 1 4 4 LYS CB C 13 28.902 0.3 . 1 . . . . A 29 LYS CB . 34965 1 41 . 1 . 1 4 4 LYS CG C 13 24.583 0.3 . 1 . . . . A 29 LYS CG . 34965 1 42 . 1 . 1 4 4 LYS CD C 13 32.365 0.3 . 1 . . . . A 29 LYS CD . 34965 1 43 . 1 . 1 4 4 LYS CE C 13 41.971 0.3 . 1 . . . . A 29 LYS CE . 34965 1 44 . 1 . 1 4 4 LYS N N 15 123.225 0.3 . 1 . . . . A 29 LYS N . 34965 1 45 . 1 . 1 5 5 GLU H H 1 8.400 0.020 . 1 . . . . A 30 GLU H . 34965 1 46 . 1 . 1 5 5 GLU HA H 1 4.173 0.020 . 1 . . . . A 30 GLU HA . 34965 1 47 . 1 . 1 5 5 GLU HB2 H 1 1.950 0.020 . 2 . . . . A 30 GLU HB2 . 34965 1 48 . 1 . 1 5 5 GLU HB3 H 1 1.843 0.020 . 2 . . . . A 30 GLU HB3 . 34965 1 49 . 1 . 1 5 5 GLU HG2 H 1 2.172 0.020 . 1 . . . . A 30 GLU HG2 . 34965 1 50 . 1 . 1 5 5 GLU HG3 H 1 2.172 0.020 . 1 . . . . A 30 GLU HG3 . 34965 1 51 . 1 . 1 5 5 GLU CA C 13 56.340 0.3 . 1 . . . . A 30 GLU CA . 34965 1 52 . 1 . 1 5 5 GLU CB C 13 30.254 0.3 . 1 . . . . A 30 GLU CB . 34965 1 53 . 1 . 1 5 5 GLU CG C 13 36.138 0.3 . 1 . . . . A 30 GLU CG . 34965 1 54 . 1 . 1 5 5 GLU N N 15 122.290 0.3 . 1 . . . . A 30 GLU N . 34965 1 55 . 1 . 1 6 6 ALA H H 1 8.304 0.020 . 1 . . . . A 31 ALA H . 34965 1 56 . 1 . 1 6 6 ALA HA H 1 4.231 0.020 . 1 . . . . A 31 ALA HA . 34965 1 57 . 1 . 1 6 6 ALA HB1 H 1 1.316 0.020 . 1 . . . . A 31 ALA HB1 . 34965 1 58 . 1 . 1 6 6 ALA HB2 H 1 1.316 0.020 . 1 . . . . A 31 ALA HB2 . 34965 1 59 . 1 . 1 6 6 ALA HB3 H 1 1.316 0.020 . 1 . . . . A 31 ALA HB3 . 34965 1 60 . 1 . 1 6 6 ALA CA C 13 52.378 0.3 . 1 . . . . A 31 ALA CA . 34965 1 61 . 1 . 1 6 6 ALA CB C 13 19.120 0.3 . 1 . . . . A 31 ALA CB . 34965 1 62 . 1 . 1 6 6 ALA N N 15 125.749 0.3 . 1 . . . . A 31 ALA N . 34965 1 63 . 1 . 1 7 7 LYS H H 1 8.264 0.020 . 1 . . . . A 32 LYS H . 34965 1 64 . 1 . 1 7 7 LYS HA H 1 4.186 0.020 . 1 . . . . A 32 LYS HA . 34965 1 65 . 1 . 1 7 7 LYS HB2 H 1 1.744 0.020 . 2 . . . . A 32 LYS HB2 . 34965 1 66 . 1 . 1 7 7 LYS HB3 H 1 1.693 0.020 . 2 . . . . A 32 LYS HB3 . 34965 1 67 . 1 . 1 7 7 LYS HG2 H 1 1.361 0.020 . 2 . . . . A 32 LYS HG2 . 34965 1 68 . 1 . 1 7 7 LYS HG3 H 1 1.338 0.020 . 2 . . . . A 32 LYS HG3 . 34965 1 69 . 1 . 1 7 7 LYS HD2 H 1 1.598 0.020 . 1 . . . . A 32 LYS HD2 . 34965 1 70 . 1 . 1 7 7 LYS HD3 H 1 1.598 0.020 . 1 . . . . A 32 LYS HD3 . 34965 1 71 . 1 . 1 7 7 LYS HE2 H 1 2.918 0.020 . 1 . . . . A 32 LYS HE2 . 34965 1 72 . 1 . 1 7 7 LYS HE3 H 1 2.918 0.020 . 1 . . . . A 32 LYS HE3 . 34965 1 73 . 1 . 1 7 7 LYS CA C 13 56.403 0.3 . 1 . . . . A 32 LYS CA . 34965 1 74 . 1 . 1 7 7 LYS CB C 13 32.775 0.3 . 1 . . . . A 32 LYS CB . 34965 1 75 . 1 . 1 7 7 LYS CG C 13 24.530 0.3 . 1 . . . . A 32 LYS CG . 34965 1 76 . 1 . 1 7 7 LYS CD C 13 28.802 0.3 . 1 . . . . A 32 LYS CD . 34965 1 77 . 1 . 1 7 7 LYS CE C 13 41.930 0.3 . 1 . . . . A 32 LYS CE . 34965 1 78 . 1 . 1 7 7 LYS N N 15 120.612 0.3 . 1 . . . . A 32 LYS N . 34965 1 79 . 1 . 1 8 8 ASP H H 1 8.195 0.020 . 1 . . . . A 33 ASP H . 34965 1 80 . 1 . 1 8 8 ASP HA H 1 4.509 0.020 . 1 . . . . A 33 ASP HA . 34965 1 81 . 1 . 1 8 8 ASP HB2 H 1 2.720 0.020 . 2 . . . . A 33 ASP HB2 . 34965 1 82 . 1 . 1 8 8 ASP HB3 H 1 2.581 0.020 . 2 . . . . A 33 ASP HB3 . 34965 1 83 . 1 . 1 8 8 ASP CA C 13 54.080 0.3 . 1 . . . . A 33 ASP CA . 34965 1 84 . 1 . 1 8 8 ASP CB C 13 41.228 0.3 . 1 . . . . A 33 ASP CB . 34965 1 85 . 1 . 1 8 8 ASP N N 15 120.967 0.3 . 1 . . . . A 33 ASP N . 34965 1 86 . 1 . 1 9 9 ALA H H 1 8.173 0.020 . 1 . . . . A 34 ALA H . 34965 1 87 . 1 . 1 9 9 ALA HA H 1 4.230 0.020 . 1 . . . . A 34 ALA HA . 34965 1 88 . 1 . 1 9 9 ALA HB1 H 1 1.302 0.020 . 1 . . . . A 34 ALA HB1 . 34965 1 89 . 1 . 1 9 9 ALA HB2 H 1 1.302 0.020 . 1 . . . . A 34 ALA HB2 . 34965 1 90 . 1 . 1 9 9 ALA HB3 H 1 1.302 0.020 . 1 . . . . A 34 ALA HB3 . 34965 1 91 . 1 . 1 9 9 ALA CA C 13 52.816 0.3 . 1 . . . . A 34 ALA CA . 34965 1 92 . 1 . 1 9 9 ALA CB C 13 18.971 0.3 . 1 . . . . A 34 ALA CB . 34965 1 93 . 1 . 1 9 9 ALA N N 15 125.192 0.3 . 1 . . . . A 34 ALA N . 34965 1 94 . 1 . 1 10 10 ARG H H 1 8.228 0.020 . 1 . . . . A 35 ARG H . 34965 1 95 . 1 . 1 10 10 ARG HA H 1 4.162 0.020 . 1 . . . . A 35 ARG HA . 34965 1 96 . 1 . 1 10 10 ARG HB2 H 1 1.593 0.020 . 2 . . . . A 35 ARG HB2 . 34965 1 97 . 1 . 1 10 10 ARG HB3 H 1 1.607 0.020 . 2 . . . . A 35 ARG HB3 . 34965 1 98 . 1 . 1 10 10 ARG HG2 H 1 1.458 0.020 . 2 . . . . A 35 ARG HG2 . 34965 1 99 . 1 . 1 10 10 ARG HG3 H 1 1.440 0.020 . 2 . . . . A 35 ARG HG3 . 34965 1 100 . 1 . 1 10 10 ARG HD2 H 1 3.035 0.020 . 2 . . . . A 35 ARG HD2 . 34965 1 101 . 1 . 1 10 10 ARG HD3 H 1 3.107 0.020 . 2 . . . . A 35 ARG HD3 . 34965 1 102 . 1 . 1 10 10 ARG CA C 13 56.603 0.3 . 1 . . . . A 35 ARG CA . 34965 1 103 . 1 . 1 10 10 ARG CB C 13 30.599 0.3 . 1 . . . . A 35 ARG CB . 34965 1 104 . 1 . 1 10 10 ARG CG C 13 26.755 0.3 . 1 . . . . A 35 ARG CG . 34965 1 105 . 1 . 1 10 10 ARG CD C 13 43.240 0.3 . 1 . . . . A 35 ARG CD . 34965 1 106 . 1 . 1 10 10 ARG N N 15 118.622 0.3 . 1 . . . . A 35 ARG N . 34965 1 107 . 1 . 1 10 10 ARG NE N 15 166.804 0.3 . 1 . . . . A 35 ARG NE . 34965 1 108 . 1 . 1 11 11 TYR H H 1 7.979 0.020 . 1 . . . . A 36 TYR H . 34965 1 109 . 1 . 1 11 11 TYR HA H 1 4.969 0.020 . 1 . . . . A 36 TYR HA . 34965 1 110 . 1 . 1 11 11 TYR HB2 H 1 2.878 0.020 . 2 . . . . A 36 TYR HB2 . 34965 1 111 . 1 . 1 11 11 TYR HB3 H 1 2.778 0.020 . 2 . . . . A 36 TYR HB3 . 34965 1 112 . 1 . 1 11 11 TYR HD1 H 1 6.952 0.020 . 1 . . . . A 36 TYR HD1 . 34965 1 113 . 1 . 1 11 11 TYR HD2 H 1 6.952 0.020 . 1 . . . . A 36 TYR HD2 . 34965 1 114 . 1 . 1 11 11 TYR HE1 H 1 6.705 0.020 . 1 . . . . A 36 TYR HE1 . 34965 1 115 . 1 . 1 11 11 TYR HE2 H 1 6.705 0.020 . 1 . . . . A 36 TYR HE2 . 34965 1 116 . 1 . 1 11 11 TYR CA C 13 57.336 0.3 . 1 . . . . A 36 TYR CA . 34965 1 117 . 1 . 1 11 11 TYR CB C 13 39.757 0.3 . 1 . . . . A 36 TYR CB . 34965 1 118 . 1 . 1 11 11 TYR CD1 C 13 133.121 0.3 . 1 . . . . A 36 TYR CD1 . 34965 1 119 . 1 . 1 11 11 TYR CD2 C 13 133.121 0.3 . 1 . . . . A 36 TYR CD2 . 34965 1 120 . 1 . 1 11 11 TYR CE1 C 13 118.019 0.3 . 1 . . . . A 36 TYR CE1 . 34965 1 121 . 1 . 1 11 11 TYR CE2 C 13 118.019 0.3 . 1 . . . . A 36 TYR CE2 . 34965 1 122 . 1 . 1 11 11 TYR N N 15 119.876 0.3 . 1 . . . . A 36 TYR N . 34965 1 123 . 1 . 1 12 12 THR H H 1 8.613 0.020 . 1 . . . . A 37 THR H . 34965 1 124 . 1 . 1 12 12 THR HA H 1 4.443 0.020 . 1 . . . . A 37 THR HA . 34965 1 125 . 1 . 1 12 12 THR HB H 1 4.250 0.020 . 1 . . . . A 37 THR HB . 34965 1 126 . 1 . 1 12 12 THR HG21 H 1 1.298 0.020 . 1 . . . . A 37 THR HG21 . 34965 1 127 . 1 . 1 12 12 THR HG22 H 1 1.298 0.020 . 1 . . . . A 37 THR HG22 . 34965 1 128 . 1 . 1 12 12 THR HG23 H 1 1.298 0.020 . 1 . . . . A 37 THR HG23 . 34965 1 129 . 1 . 1 12 12 THR CA C 13 61.626 0.3 . 1 . . . . A 37 THR CA . 34965 1 130 . 1 . 1 12 12 THR CB C 13 70.252 0.3 . 1 . . . . A 37 THR CB . 34965 1 131 . 1 . 1 12 12 THR CG2 C 13 21.184 0.3 . 1 . . . . A 37 THR CG2 . 34965 1 132 . 1 . 1 12 12 THR N N 15 118.076 0.3 . 1 . . . . A 37 THR N . 34965 1 133 . 1 . 1 13 13 ASN H H 1 9.236 0.020 . 1 . . . . A 38 ASN H . 34965 1 134 . 1 . 1 13 13 ASN HA H 1 4.383 0.020 . 1 . . . . A 38 ASN HA . 34965 1 135 . 1 . 1 13 13 ASN HB2 H 1 3.036 0.020 . 2 . . . . A 38 ASN HB2 . 34965 1 136 . 1 . 1 13 13 ASN HB3 H 1 3.006 0.020 . 2 . . . . A 38 ASN HB3 . 34965 1 137 . 1 . 1 13 13 ASN HD21 H 1 8.200 0.020 . 1 . . . . A 38 ASN HD21 . 34965 1 138 . 1 . 1 13 13 ASN HD22 H 1 7.013 0.020 . 1 . . . . A 38 ASN HD22 . 34965 1 139 . 1 . 1 13 13 ASN CA C 13 53.623 0.3 . 1 . . . . A 38 ASN CA . 34965 1 140 . 1 . 1 13 13 ASN CB C 13 37.239 0.3 . 1 . . . . A 38 ASN CB . 34965 1 141 . 1 . 1 13 13 ASN N N 15 125.583 0.3 . 1 . . . . A 38 ASN N . 34965 1 142 . 1 . 1 13 13 ASN ND2 N 15 114.369 0.3 . 1 . . . . A 38 ASN ND2 . 34965 1 143 . 1 . 1 14 14 GLY H H 1 8.139 0.020 . 1 . . . . A 39 GLY H . 34965 1 144 . 1 . 1 14 14 GLY HA2 H 1 4.055 0.020 . 2 . . . . A 39 GLY HA2 . 34965 1 145 . 1 . 1 14 14 GLY HA3 H 1 3.378 0.020 . 2 . . . . A 39 GLY HA3 . 34965 1 146 . 1 . 1 14 14 GLY CA C 13 45.084 0.3 . 1 . . . . A 39 GLY CA . 34965 1 147 . 1 . 1 14 14 GLY N N 15 102.568 0.3 . 1 . . . . A 39 GLY N . 34965 1 148 . 1 . 1 15 15 HIS H H 1 7.800 0.020 . 1 . . . . A 40 HIS H . 34965 1 149 . 1 . 1 15 15 HIS HA H 1 4.727 0.020 . 1 . . . . A 40 HIS HA . 34965 1 150 . 1 . 1 15 15 HIS HB2 H 1 2.171 0.020 . 2 . . . . A 40 HIS HB2 . 34965 1 151 . 1 . 1 15 15 HIS HB3 H 1 1.933 0.020 . 2 . . . . A 40 HIS HB3 . 34965 1 152 . 1 . 1 15 15 HIS HD1 H 1 12.332 0.020 . 1 . . . . A 40 HIS HD1 . 34965 1 153 . 1 . 1 15 15 HIS HD2 H 1 7.355 0.020 . 1 . . . . A 40 HIS HD2 . 34965 1 154 . 1 . 1 15 15 HIS HE1 H 1 7.180 0.020 . 1 . . . . A 40 HIS HE1 . 34965 1 155 . 1 . 1 15 15 HIS CA C 13 55.791 0.3 . 1 . . . . A 40 HIS CA . 34965 1 156 . 1 . 1 15 15 HIS CB C 13 30.332 0.3 . 1 . . . . A 40 HIS CB . 34965 1 157 . 1 . 1 15 15 HIS CD2 C 13 121.977 0.3 . 1 . . . . A 40 HIS CD2 . 34965 1 158 . 1 . 1 15 15 HIS CE1 C 13 138.431 0.3 . 1 . . . . A 40 HIS CE1 . 34965 1 159 . 1 . 1 15 15 HIS N N 15 120.599 0.3 . 1 . . . . A 40 HIS N . 34965 1 160 . 1 . 1 15 15 HIS NE2 N 15 184.540 0.3 . 1 . . . . A 40 HIS NE2 . 34965 1 161 . 1 . 1 16 16 LEU H H 1 8.363 0.020 . 1 . . . . A 41 LEU H . 34965 1 162 . 1 . 1 16 16 LEU HA H 1 4.532 0.020 . 1 . . . . A 41 LEU HA . 34965 1 163 . 1 . 1 16 16 LEU HB2 H 1 1.524 0.020 . 2 . . . . A 41 LEU HB2 . 34965 1 164 . 1 . 1 16 16 LEU HB3 H 1 1.253 0.020 . 2 . . . . A 41 LEU HB3 . 34965 1 165 . 1 . 1 16 16 LEU HG H 1 1.537 0.020 . 1 . . . . A 41 LEU HG . 34965 1 166 . 1 . 1 16 16 LEU HD11 H 1 0.558 0.020 . 2 . . . . A 41 LEU HD11 . 34965 1 167 . 1 . 1 16 16 LEU HD12 H 1 0.558 0.020 . 2 . . . . A 41 LEU HD12 . 34965 1 168 . 1 . 1 16 16 LEU HD13 H 1 0.558 0.020 . 2 . . . . A 41 LEU HD13 . 34965 1 169 . 1 . 1 16 16 LEU HD21 H 1 0.409 0.020 . 2 . . . . A 41 LEU HD21 . 34965 1 170 . 1 . 1 16 16 LEU HD22 H 1 0.409 0.020 . 2 . . . . A 41 LEU HD22 . 34965 1 171 . 1 . 1 16 16 LEU HD23 H 1 0.409 0.020 . 2 . . . . A 41 LEU HD23 . 34965 1 172 . 1 . 1 16 16 LEU CA C 13 52.299 0.3 . 1 . . . . A 41 LEU CA . 34965 1 173 . 1 . 1 16 16 LEU CB C 13 41.924 0.3 . 1 . . . . A 41 LEU CB . 34965 1 174 . 1 . 1 16 16 LEU CG C 13 42.106 0.3 . 1 . . . . A 41 LEU CG . 34965 1 175 . 1 . 1 16 16 LEU CD1 C 13 24.693 0.3 . 1 . . . . A 41 LEU CD1 . 34965 1 176 . 1 . 1 16 16 LEU CD2 C 13 23.935 0.3 . 1 . . . . A 41 LEU CD2 . 34965 1 177 . 1 . 1 16 16 LEU N N 15 128.008 0.3 . 1 . . . . A 41 LEU N . 34965 1 178 . 1 . 1 17 17 PHE H H 1 7.557 0.020 . 1 . . . . A 42 PHE H . 34965 1 179 . 1 . 1 17 17 PHE HA H 1 5.094 0.020 . 1 . . . . A 42 PHE HA . 34965 1 180 . 1 . 1 17 17 PHE HB2 H 1 2.926 0.020 . 2 . . . . A 42 PHE HB2 . 34965 1 181 . 1 . 1 17 17 PHE HB3 H 1 2.874 0.020 . 2 . . . . A 42 PHE HB3 . 34965 1 182 . 1 . 1 17 17 PHE HD1 H 1 7.002 0.020 . 1 . . . . A 42 PHE HD1 . 34965 1 183 . 1 . 1 17 17 PHE HD2 H 1 7.002 0.020 . 1 . . . . A 42 PHE HD2 . 34965 1 184 . 1 . 1 17 17 PHE HE1 H 1 6.805 0.020 . 1 . . . . A 42 PHE HE1 . 34965 1 185 . 1 . 1 17 17 PHE HE2 H 1 6.805 0.020 . 1 . . . . A 42 PHE HE2 . 34965 1 186 . 1 . 1 17 17 PHE HZ H 1 6.608 0.020 . 1 . . . . A 42 PHE HZ . 34965 1 187 . 1 . 1 17 17 PHE CA C 13 59.048 0.3 . 1 . . . . A 42 PHE CA . 34965 1 188 . 1 . 1 17 17 PHE CB C 13 39.900 0.3 . 1 . . . . A 42 PHE CB . 34965 1 189 . 1 . 1 17 17 PHE CD1 C 13 130.896 0.3 . 1 . . . . A 42 PHE CD1 . 34965 1 190 . 1 . 1 17 17 PHE CD2 C 13 130.896 0.3 . 1 . . . . A 42 PHE CD2 . 34965 1 191 . 1 . 1 17 17 PHE CE1 C 13 130.896 0.3 . 1 . . . . A 42 PHE CE1 . 34965 1 192 . 1 . 1 17 17 PHE CE2 C 13 130.896 0.3 . 1 . . . . A 42 PHE CE2 . 34965 1 193 . 1 . 1 17 17 PHE CZ C 13 130.555 0.3 . 1 . . . . A 42 PHE CZ . 34965 1 194 . 1 . 1 17 17 PHE N N 15 118.227 0.3 . 1 . . . . A 42 PHE N . 34965 1 195 . 1 . 1 18 18 THR H H 1 9.272 0.020 . 1 . . . . A 43 THR H . 34965 1 196 . 1 . 1 18 18 THR HA H 1 4.627 0.020 . 1 . . . . A 43 THR HA . 34965 1 197 . 1 . 1 18 18 THR HB H 1 4.060 0.020 . 1 . . . . A 43 THR HB . 34965 1 198 . 1 . 1 18 18 THR HG21 H 1 1.169 0.020 . 1 . . . . A 43 THR HG21 . 34965 1 199 . 1 . 1 18 18 THR HG22 H 1 1.169 0.020 . 1 . . . . A 43 THR HG22 . 34965 1 200 . 1 . 1 18 18 THR HG23 H 1 1.169 0.020 . 1 . . . . A 43 THR HG23 . 34965 1 201 . 1 . 1 18 18 THR CA C 13 60.453 0.3 . 1 . . . . A 43 THR CA . 34965 1 202 . 1 . 1 18 18 THR CB C 13 71.486 0.3 . 1 . . . . A 43 THR CB . 34965 1 203 . 1 . 1 18 18 THR CG2 C 13 20.007 0.3 . 1 . . . . A 43 THR CG2 . 34965 1 204 . 1 . 1 18 18 THR N N 15 117.706 0.3 . 1 . . . . A 43 THR N . 34965 1 205 . 1 . 1 19 19 THR H H 1 8.245 0.020 . 1 . . . . A 44 THR H . 34965 1 206 . 1 . 1 19 19 THR HA H 1 4.810 0.020 . 1 . . . . A 44 THR HA . 34965 1 207 . 1 . 1 19 19 THR HB H 1 3.951 0.020 . 1 . . . . A 44 THR HB . 34965 1 208 . 1 . 1 19 19 THR HG21 H 1 1.130 0.020 . 1 . . . . A 44 THR HG21 . 34965 1 209 . 1 . 1 19 19 THR HG22 H 1 1.130 0.020 . 1 . . . . A 44 THR HG22 . 34965 1 210 . 1 . 1 19 19 THR HG23 H 1 1.130 0.020 . 1 . . . . A 44 THR HG23 . 34965 1 211 . 1 . 1 19 19 THR CA C 13 63.300 0.3 . 1 . . . . A 44 THR CA . 34965 1 212 . 1 . 1 19 19 THR CB C 13 69.612 0.3 . 1 . . . . A 44 THR CB . 34965 1 213 . 1 . 1 19 19 THR CG2 C 13 22.051 0.3 . 1 . . . . A 44 THR CG2 . 34965 1 214 . 1 . 1 19 19 THR N N 15 120.565 0.3 . 1 . . . . A 44 THR N . 34965 1 215 . 1 . 1 20 20 ILE H H 1 8.686 0.020 . 1 . . . . A 45 ILE H . 34965 1 216 . 1 . 1 20 20 ILE HA H 1 4.598 0.020 . 1 . . . . A 45 ILE HA . 34965 1 217 . 1 . 1 20 20 ILE HB H 1 1.691 0.020 . 1 . . . . A 45 ILE HB . 34965 1 218 . 1 . 1 20 20 ILE HG12 H 1 1.272 0.020 . 2 . . . . A 45 ILE HG12 . 34965 1 219 . 1 . 1 20 20 ILE HG13 H 1 0.904 0.020 . 2 . . . . A 45 ILE HG13 . 34965 1 220 . 1 . 1 20 20 ILE HG21 H 1 0.708 0.020 . 1 . . . . A 45 ILE HG21 . 34965 1 221 . 1 . 1 20 20 ILE HG22 H 1 0.708 0.020 . 1 . . . . A 45 ILE HG22 . 34965 1 222 . 1 . 1 20 20 ILE HG23 H 1 0.708 0.020 . 1 . . . . A 45 ILE HG23 . 34965 1 223 . 1 . 1 20 20 ILE HD11 H 1 0.715 0.020 . 1 . . . . A 45 ILE HD11 . 34965 1 224 . 1 . 1 20 20 ILE HD12 H 1 0.715 0.020 . 1 . . . . A 45 ILE HD12 . 34965 1 225 . 1 . 1 20 20 ILE HD13 H 1 0.715 0.020 . 1 . . . . A 45 ILE HD13 . 34965 1 226 . 1 . 1 20 20 ILE CA C 13 59.164 0.3 . 1 . . . . A 45 ILE CA . 34965 1 227 . 1 . 1 20 20 ILE CB C 13 42.388 0.3 . 1 . . . . A 45 ILE CB . 34965 1 228 . 1 . 1 20 20 ILE CG1 C 13 26.820 0.3 . 1 . . . . A 45 ILE CG1 . 34965 1 229 . 1 . 1 20 20 ILE CG2 C 13 17.829 0.3 . 1 . . . . A 45 ILE CG2 . 34965 1 230 . 1 . 1 20 20 ILE CD1 C 13 14.336 0.3 . 1 . . . . A 45 ILE CD1 . 34965 1 231 . 1 . 1 20 20 ILE N N 15 122.468 0.3 . 1 . . . . A 45 ILE N . 34965 1 232 . 1 . 1 21 21 SER H H 1 8.182 0.020 . 1 . . . . A 46 SER H . 34965 1 233 . 1 . 1 21 21 SER HA H 1 4.819 0.020 . 1 . . . . A 46 SER HA . 34965 1 234 . 1 . 1 21 21 SER HB2 H 1 3.800 0.020 . 2 . . . . A 46 SER HB2 . 34965 1 235 . 1 . 1 21 21 SER HB3 H 1 3.740 0.020 . 2 . . . . A 46 SER HB3 . 34965 1 236 . 1 . 1 21 21 SER CA C 13 57.999 0.3 . 1 . . . . A 46 SER CA . 34965 1 237 . 1 . 1 21 21 SER CB C 13 63.314 0.3 . 1 . . . . A 46 SER CB . 34965 1 238 . 1 . 1 21 21 SER N N 15 118.417 0.3 . 1 . . . . A 46 SER N . 34965 1 239 . 1 . 1 22 22 VAL H H 1 7.854 0.020 . 1 . . . . A 47 VAL H . 34965 1 240 . 1 . 1 22 22 VAL HA H 1 4.033 0.020 . 1 . . . . A 47 VAL HA . 34965 1 241 . 1 . 1 22 22 VAL HB H 1 1.916 0.020 . 1 . . . . A 47 VAL HB . 34965 1 242 . 1 . 1 22 22 VAL HG11 H 1 0.749 0.020 . 2 . . . . A 47 VAL HG11 . 34965 1 243 . 1 . 1 22 22 VAL HG12 H 1 0.749 0.020 . 2 . . . . A 47 VAL HG12 . 34965 1 244 . 1 . 1 22 22 VAL HG13 H 1 0.749 0.020 . 2 . . . . A 47 VAL HG13 . 34965 1 245 . 1 . 1 22 22 VAL HG21 H 1 0.544 0.020 . 2 . . . . A 47 VAL HG21 . 34965 1 246 . 1 . 1 22 22 VAL HG22 H 1 0.544 0.020 . 2 . . . . A 47 VAL HG22 . 34965 1 247 . 1 . 1 22 22 VAL HG23 H 1 0.544 0.020 . 2 . . . . A 47 VAL HG23 . 34965 1 248 . 1 . 1 22 22 VAL CA C 13 61.704 0.3 . 1 . . . . A 47 VAL CA . 34965 1 249 . 1 . 1 22 22 VAL CB C 13 33.066 0.3 . 1 . . . . A 47 VAL CB . 34965 1 250 . 1 . 1 22 22 VAL CG1 C 13 21.608 0.3 . 1 . . . . A 47 VAL CG1 . 34965 1 251 . 1 . 1 22 22 VAL CG2 C 13 21.195 0.3 . 1 . . . . A 47 VAL CG2 . 34965 1 252 . 1 . 1 22 22 VAL N N 15 123.740 0.3 . 1 . . . . A 47 VAL N . 34965 1 253 . 1 . 1 23 23 SER H H 1 8.476 0.020 . 1 . . . . A 48 SER H . 34965 1 254 . 1 . 1 23 23 SER HA H 1 4.503 0.020 . 1 . . . . A 48 SER HA . 34965 1 255 . 1 . 1 23 23 SER HB2 H 1 3.679 0.020 . 2 . . . . A 48 SER HB2 . 34965 1 256 . 1 . 1 23 23 SER HB3 H 1 3.703 0.020 . 2 . . . . A 48 SER HB3 . 34965 1 257 . 1 . 1 23 23 SER CA C 13 57.180 0.3 . 1 . . . . A 48 SER CA . 34965 1 258 . 1 . 1 23 23 SER CB C 13 64.064 0.3 . 1 . . . . A 48 SER CB . 34965 1 259 . 1 . 1 23 23 SER N N 15 120.567 0.3 . 1 . . . . A 48 SER N . 34965 1 260 . 1 . 1 24 24 GLY H H 1 8.135 0.020 . 1 . . . . A 49 GLY H . 34965 1 261 . 1 . 1 24 24 GLY HA2 H 1 3.885 0.020 . 2 . . . . A 49 GLY HA2 . 34965 1 262 . 1 . 1 24 24 GLY HA3 H 1 3.842 0.020 . 2 . . . . A 49 GLY HA3 . 34965 1 263 . 1 . 1 24 24 GLY CA C 13 44.770 0.3 . 1 . . . . A 49 GLY CA . 34965 1 264 . 1 . 1 24 24 GLY N N 15 111.030 0.3 . 1 . . . . A 49 GLY N . 34965 1 265 . 1 . 1 25 25 MET H H 1 8.354 0.020 . 1 . . . . A 50 MET H . 34965 1 266 . 1 . 1 25 25 MET HA H 1 4.334 0.020 . 1 . . . . A 50 MET HA . 34965 1 267 . 1 . 1 25 25 MET HB2 H 1 1.958 0.020 . 2 . . . . A 50 MET HB2 . 34965 1 268 . 1 . 1 25 25 MET HB3 H 1 1.880 0.020 . 2 . . . . A 50 MET HB3 . 34965 1 269 . 1 . 1 25 25 MET HG2 H 1 2.407 0.020 . 1 . . . . A 50 MET HG2 . 34965 1 270 . 1 . 1 25 25 MET HG3 H 1 2.407 0.020 . 1 . . . . A 50 MET HG3 . 34965 1 271 . 1 . 1 25 25 MET HE1 H 1 2.033 0.020 . 1 . . . . A 50 MET HE1 . 34965 1 272 . 1 . 1 25 25 MET HE2 H 1 2.033 0.020 . 1 . . . . A 50 MET HE2 . 34965 1 273 . 1 . 1 25 25 MET HE3 H 1 2.033 0.020 . 1 . . . . A 50 MET HE3 . 34965 1 274 . 1 . 1 25 25 MET CA C 13 55.989 0.3 . 1 . . . . A 50 MET CA . 34965 1 275 . 1 . 1 25 25 MET CB C 13 31.186 0.3 . 1 . . . . A 50 MET CB . 34965 1 276 . 1 . 1 25 25 MET CG C 13 31.854 0.3 . 1 . . . . A 50 MET CG . 34965 1 277 . 1 . 1 25 25 MET CE C 13 16.881 0.3 . 1 . . . . A 50 MET CE . 34965 1 278 . 1 . 1 25 25 MET N N 15 121.648 0.3 . 1 . . . . A 50 MET N . 34965 1 279 . 1 . 1 26 26 THR H H 1 8.638 0.020 . 1 . . . . A 51 THR H . 34965 1 280 . 1 . 1 26 26 THR HA H 1 4.256 0.020 . 1 . . . . A 51 THR HA . 34965 1 281 . 1 . 1 26 26 THR HB H 1 3.748 0.020 . 1 . . . . A 51 THR HB . 34965 1 282 . 1 . 1 26 26 THR HG21 H 1 0.999 0.020 . 1 . . . . A 51 THR HG21 . 34965 1 283 . 1 . 1 26 26 THR HG22 H 1 0.999 0.020 . 1 . . . . A 51 THR HG22 . 34965 1 284 . 1 . 1 26 26 THR HG23 H 1 0.999 0.020 . 1 . . . . A 51 THR HG23 . 34965 1 285 . 1 . 1 26 26 THR CA C 13 62.246 0.3 . 1 . . . . A 51 THR CA . 34965 1 286 . 1 . 1 26 26 THR CB C 13 71.127 0.3 . 1 . . . . A 51 THR CB . 34965 1 287 . 1 . 1 26 26 THR CG2 C 13 20.744 0.3 . 1 . . . . A 51 THR CG2 . 34965 1 288 . 1 . 1 26 26 THR N N 15 123.720 0.3 . 1 . . . . A 51 THR N . 34965 1 289 . 1 . 1 27 27 MET H H 1 8.638 0.020 . 1 . . . . A 52 MET H . 34965 1 290 . 1 . 1 27 27 MET HA H 1 4.526 0.020 . 1 . . . . A 52 MET HA . 34965 1 291 . 1 . 1 27 27 MET HB2 H 1 1.791 0.020 . 2 . . . . A 52 MET HB2 . 34965 1 292 . 1 . 1 27 27 MET HB3 H 1 1.574 0.020 . 2 . . . . A 52 MET HB3 . 34965 1 293 . 1 . 1 27 27 MET HG2 H 1 2.389 0.020 . 2 . . . . A 52 MET HG2 . 34965 1 294 . 1 . 1 27 27 MET HG3 H 1 2.278 0.020 . 2 . . . . A 52 MET HG3 . 34965 1 295 . 1 . 1 27 27 MET HE1 H 1 1.801 0.020 . 1 . . . . A 52 MET HE1 . 34965 1 296 . 1 . 1 27 27 MET HE2 H 1 1.801 0.020 . 1 . . . . A 52 MET HE2 . 34965 1 297 . 1 . 1 27 27 MET HE3 H 1 1.801 0.020 . 1 . . . . A 52 MET HE3 . 34965 1 298 . 1 . 1 27 27 MET CA C 13 52.805 0.3 . 1 . . . . A 52 MET CA . 34965 1 299 . 1 . 1 27 27 MET CB C 13 32.624 0.3 . 1 . . . . A 52 MET CB . 34965 1 300 . 1 . 1 27 27 MET CG C 13 31.631 0.3 . 1 . . . . A 52 MET CG . 34965 1 301 . 1 . 1 27 27 MET CE C 13 16.548 0.3 . 1 . . . . A 52 MET CE . 34965 1 302 . 1 . 1 27 27 MET N N 15 125.240 0.3 . 1 . . . . A 52 MET N . 34965 1 303 . 1 . 1 28 28 CYS H H 1 8.253 0.020 . 1 . . . . A 53 CYS H . 34965 1 304 . 1 . 1 28 28 CYS HA H 1 4.500 0.020 . 1 . . . . A 53 CYS HA . 34965 1 305 . 1 . 1 28 28 CYS HB2 H 1 3.430 0.020 . 2 . . . . A 53 CYS HB2 . 34965 1 306 . 1 . 1 28 28 CYS HB3 H 1 2.010 0.020 . 2 . . . . A 53 CYS HB3 . 34965 1 307 . 1 . 1 28 28 CYS CA C 13 58.123 0.3 . 1 . . . . A 53 CYS CA . 34965 1 308 . 1 . 1 28 28 CYS CB C 13 31.381 0.3 . 1 . . . . A 53 CYS CB . 34965 1 309 . 1 . 1 28 28 CYS N N 15 124.356 0.3 . 1 . . . . A 53 CYS N . 34965 1 310 . 1 . 1 29 29 TYR H H 1 9.014 0.020 . 1 . . . . A 54 TYR H . 34965 1 311 . 1 . 1 29 29 TYR HA H 1 4.018 0.020 . 1 . . . . A 54 TYR HA . 34965 1 312 . 1 . 1 29 29 TYR HB2 H 1 3.484 0.020 . 2 . . . . A 54 TYR HB2 . 34965 1 313 . 1 . 1 29 29 TYR HB3 H 1 2.442 0.020 . 2 . . . . A 54 TYR HB3 . 34965 1 314 . 1 . 1 29 29 TYR HD1 H 1 6.909 0.020 . 1 . . . . A 54 TYR HD1 . 34965 1 315 . 1 . 1 29 29 TYR HD2 H 1 6.909 0.020 . 1 . . . . A 54 TYR HD2 . 34965 1 316 . 1 . 1 29 29 TYR HE1 H 1 6.744 0.020 . 1 . . . . A 54 TYR HE1 . 34965 1 317 . 1 . 1 29 29 TYR HE2 H 1 6.744 0.020 . 1 . . . . A 54 TYR HE2 . 34965 1 318 . 1 . 1 29 29 TYR CA C 13 61.090 0.3 . 1 . . . . A 54 TYR CA . 34965 1 319 . 1 . 1 29 29 TYR CB C 13 40.273 0.3 . 1 . . . . A 54 TYR CB . 34965 1 320 . 1 . 1 29 29 TYR CD1 C 13 133.343 0.3 . 1 . . . . A 54 TYR CD1 . 34965 1 321 . 1 . 1 29 29 TYR CD2 C 13 133.343 0.3 . 1 . . . . A 54 TYR CD2 . 34965 1 322 . 1 . 1 29 29 TYR CE1 C 13 118.066 0.3 . 1 . . . . A 54 TYR CE1 . 34965 1 323 . 1 . 1 29 29 TYR CE2 C 13 118.066 0.3 . 1 . . . . A 54 TYR CE2 . 34965 1 324 . 1 . 1 29 29 TYR N N 15 130.571 0.3 . 1 . . . . A 54 TYR N . 34965 1 325 . 1 . 1 30 30 ALA H H 1 8.797 0.020 . 1 . . . . A 55 ALA H . 34965 1 326 . 1 . 1 30 30 ALA HA H 1 4.181 0.020 . 1 . . . . A 55 ALA HA . 34965 1 327 . 1 . 1 30 30 ALA HB1 H 1 1.450 0.020 . 1 . . . . A 55 ALA HB1 . 34965 1 328 . 1 . 1 30 30 ALA HB2 H 1 1.450 0.020 . 1 . . . . A 55 ALA HB2 . 34965 1 329 . 1 . 1 30 30 ALA HB3 H 1 1.450 0.020 . 1 . . . . A 55 ALA HB3 . 34965 1 330 . 1 . 1 30 30 ALA CA C 13 53.925 0.3 . 1 . . . . A 55 ALA CA . 34965 1 331 . 1 . 1 30 30 ALA CB C 13 20.361 0.3 . 1 . . . . A 55 ALA CB . 34965 1 332 . 1 . 1 30 30 ALA N N 15 119.445 0.3 . 1 . . . . A 55 ALA N . 34965 1 333 . 1 . 1 31 31 CYS H H 1 8.025 0.020 . 1 . . . . A 56 CYS H . 34965 1 334 . 1 . 1 31 31 CYS HA H 1 4.880 0.020 . 1 . . . . A 56 CYS HA . 34965 1 335 . 1 . 1 31 31 CYS HB2 H 1 3.188 0.020 . 2 . . . . A 56 CYS HB2 . 34965 1 336 . 1 . 1 31 31 CYS HB3 H 1 2.847 0.020 . 2 . . . . A 56 CYS HB3 . 34965 1 337 . 1 . 1 31 31 CYS CA C 13 57.898 0.3 . 1 . . . . A 56 CYS CA . 34965 1 338 . 1 . 1 31 31 CYS CB C 13 31.355 0.3 . 1 . . . . A 56 CYS CB . 34965 1 339 . 1 . 1 31 31 CYS N N 15 114.616 0.3 . 1 . . . . A 56 CYS N . 34965 1 340 . 1 . 1 32 32 ASN H H 1 8.058 0.020 . 1 . . . . A 57 ASN H . 34965 1 341 . 1 . 1 32 32 ASN HA H 1 4.354 0.020 . 1 . . . . A 57 ASN HA . 34965 1 342 . 1 . 1 32 32 ASN HB2 H 1 2.957 0.020 . 2 . . . . A 57 ASN HB2 . 34965 1 343 . 1 . 1 32 32 ASN HB3 H 1 2.700 0.020 . 2 . . . . A 57 ASN HB3 . 34965 1 344 . 1 . 1 32 32 ASN HD21 H 1 7.292 0.020 . 1 . . . . A 57 ASN HD21 . 34965 1 345 . 1 . 1 32 32 ASN HD22 H 1 6.573 0.020 . 1 . . . . A 57 ASN HD22 . 34965 1 346 . 1 . 1 32 32 ASN CA C 13 55.099 0.3 . 1 . . . . A 57 ASN CA . 34965 1 347 . 1 . 1 32 32 ASN CB C 13 37.411 0.3 . 1 . . . . A 57 ASN CB . 34965 1 348 . 1 . 1 32 32 ASN N N 15 118.139 0.3 . 1 . . . . A 57 ASN N . 34965 1 349 . 1 . 1 32 32 ASN ND2 N 15 112.172 0.3 . 1 . . . . A 57 ASN ND2 . 34965 1 350 . 1 . 1 33 33 LYS H H 1 7.751 0.020 . 1 . . . . A 58 LYS H . 34965 1 351 . 1 . 1 33 33 LYS HA H 1 4.708 0.020 . 1 . . . . A 58 LYS HA . 34965 1 352 . 1 . 1 33 33 LYS HB2 H 1 1.999 0.020 . 2 . . . . A 58 LYS HB2 . 34965 1 353 . 1 . 1 33 33 LYS HB3 H 1 1.975 0.020 . 2 . . . . A 58 LYS HB3 . 34965 1 354 . 1 . 1 33 33 LYS HG2 H 1 1.523 0.020 . 2 . . . . A 58 LYS HG2 . 34965 1 355 . 1 . 1 33 33 LYS HG3 H 1 1.414 0.020 . 2 . . . . A 58 LYS HG3 . 34965 1 356 . 1 . 1 33 33 LYS HD2 H 1 1.651 0.020 . 2 . . . . A 58 LYS HD2 . 34965 1 357 . 1 . 1 33 33 LYS HD3 H 1 1.624 0.020 . 2 . . . . A 58 LYS HD3 . 34965 1 358 . 1 . 1 33 33 LYS HE2 H 1 2.960 0.020 . 1 . . . . A 58 LYS HE2 . 34965 1 359 . 1 . 1 33 33 LYS HE3 H 1 2.960 0.020 . 1 . . . . A 58 LYS HE3 . 34965 1 360 . 1 . 1 33 33 LYS CA C 13 54.543 0.3 . 1 . . . . A 58 LYS CA . 34965 1 361 . 1 . 1 33 33 LYS CB C 13 35.310 0.3 . 1 . . . . A 58 LYS CB . 34965 1 362 . 1 . 1 33 33 LYS CG C 13 25.095 0.3 . 1 . . . . A 58 LYS CG . 34965 1 363 . 1 . 1 33 33 LYS CD C 13 28.654 0.3 . 1 . . . . A 58 LYS CD . 34965 1 364 . 1 . 1 33 33 LYS CE C 13 42.215 0.3 . 1 . . . . A 58 LYS CE . 34965 1 365 . 1 . 1 33 33 LYS N N 15 116.311 0.3 . 1 . . . . A 58 LYS N . 34965 1 366 . 1 . 1 34 34 SER H H 1 8.521 0.020 . 1 . . . . A 59 SER H . 34965 1 367 . 1 . 1 34 34 SER HA H 1 4.473 0.020 . 1 . . . . A 59 SER HA . 34965 1 368 . 1 . 1 34 34 SER HB2 H 1 3.712 0.020 . 2 . . . . A 59 SER HB2 . 34965 1 369 . 1 . 1 34 34 SER HB3 H 1 3.693 0.020 . 2 . . . . A 59 SER HB3 . 34965 1 370 . 1 . 1 34 34 SER CA C 13 59.051 0.3 . 1 . . . . A 59 SER CA . 34965 1 371 . 1 . 1 34 34 SER CB C 13 63.878 0.3 . 1 . . . . A 59 SER CB . 34965 1 372 . 1 . 1 34 34 SER N N 15 116.175 0.3 . 1 . . . . A 59 SER N . 34965 1 373 . 1 . 1 35 35 ILE H H 1 8.614 0.020 . 1 . . . . A 60 ILE H . 34965 1 374 . 1 . 1 35 35 ILE HA H 1 4.167 0.020 . 1 . . . . A 60 ILE HA . 34965 1 375 . 1 . 1 35 35 ILE HB H 1 1.483 0.020 . 1 . . . . A 60 ILE HB . 34965 1 376 . 1 . 1 35 35 ILE HG12 H 1 1.144 0.020 . 2 . . . . A 60 ILE HG12 . 34965 1 377 . 1 . 1 35 35 ILE HG13 H 1 -0.463 0.020 . 2 . . . . A 60 ILE HG13 . 34965 1 378 . 1 . 1 35 35 ILE HG21 H 1 0.763 0.020 . 1 . . . . A 60 ILE HG21 . 34965 1 379 . 1 . 1 35 35 ILE HG22 H 1 0.763 0.020 . 1 . . . . A 60 ILE HG22 . 34965 1 380 . 1 . 1 35 35 ILE HG23 H 1 0.763 0.020 . 1 . . . . A 60 ILE HG23 . 34965 1 381 . 1 . 1 35 35 ILE HD11 H 1 0.175 0.020 . 1 . . . . A 60 ILE HD11 . 34965 1 382 . 1 . 1 35 35 ILE HD12 H 1 0.175 0.020 . 1 . . . . A 60 ILE HD12 . 34965 1 383 . 1 . 1 35 35 ILE HD13 H 1 0.175 0.020 . 1 . . . . A 60 ILE HD13 . 34965 1 384 . 1 . 1 35 35 ILE CA C 13 61.359 0.3 . 1 . . . . A 60 ILE CA . 34965 1 385 . 1 . 1 35 35 ILE CB C 13 37.989 0.3 . 1 . . . . A 60 ILE CB . 34965 1 386 . 1 . 1 35 35 ILE CG1 C 13 26.100 0.3 . 1 . . . . A 60 ILE CG1 . 34965 1 387 . 1 . 1 35 35 ILE CG2 C 13 17.741 0.3 . 1 . . . . A 60 ILE CG2 . 34965 1 388 . 1 . 1 35 35 ILE CD1 C 13 13.530 0.3 . 1 . . . . A 60 ILE CD1 . 34965 1 389 . 1 . 1 35 35 ILE N N 15 124.624 0.3 . 1 . . . . A 60 ILE N . 34965 1 390 . 1 . 1 36 36 THR H H 1 8.137 0.020 . 1 . . . . A 61 THR H . 34965 1 391 . 1 . 1 36 36 THR HA H 1 4.415 0.020 . 1 . . . . A 61 THR HA . 34965 1 392 . 1 . 1 36 36 THR HB H 1 4.362 0.020 . 1 . . . . A 61 THR HB . 34965 1 393 . 1 . 1 36 36 THR HG21 H 1 1.092 0.020 . 1 . . . . A 61 THR HG21 . 34965 1 394 . 1 . 1 36 36 THR HG22 H 1 1.092 0.020 . 1 . . . . A 61 THR HG22 . 34965 1 395 . 1 . 1 36 36 THR HG23 H 1 1.092 0.020 . 1 . . . . A 61 THR HG23 . 34965 1 396 . 1 . 1 36 36 THR CA C 13 61.412 0.3 . 1 . . . . A 61 THR CA . 34965 1 397 . 1 . 1 36 36 THR CB C 13 68.796 0.3 . 1 . . . . A 61 THR CB . 34965 1 398 . 1 . 1 36 36 THR CG2 C 13 21.516 0.3 . 1 . . . . A 61 THR CG2 . 34965 1 399 . 1 . 1 37 37 ALA H H 1 7.165 0.020 . 1 . . . . A 62 ALA H . 34965 1 400 . 1 . 1 37 37 ALA HA H 1 4.391 0.020 . 1 . . . . A 62 ALA HA . 34965 1 401 . 1 . 1 37 37 ALA HB1 H 1 1.615 0.020 . 1 . . . . A 62 ALA HB1 . 34965 1 402 . 1 . 1 37 37 ALA HB2 H 1 1.615 0.020 . 1 . . . . A 62 ALA HB2 . 34965 1 403 . 1 . 1 37 37 ALA HB3 H 1 1.615 0.020 . 1 . . . . A 62 ALA HB3 . 34965 1 404 . 1 . 1 37 37 ALA CA C 13 51.642 0.3 . 1 . . . . A 62 ALA CA . 34965 1 405 . 1 . 1 37 37 ALA CB C 13 20.408 0.3 . 1 . . . . A 62 ALA CB . 34965 1 406 . 1 . 1 37 37 ALA N N 15 124.939 0.3 . 1 . . . . A 62 ALA N . 34965 1 407 . 1 . 1 38 38 LYS H H 1 8.245 0.020 . 1 . . . . A 63 LYS H . 34965 1 408 . 1 . 1 38 38 LYS HA H 1 4.187 0.020 . 1 . . . . A 63 LYS HA . 34965 1 409 . 1 . 1 38 38 LYS HB2 H 1 1.910 0.020 . 2 . . . . A 63 LYS HB2 . 34965 1 410 . 1 . 1 38 38 LYS HB3 H 1 1.795 0.020 . 2 . . . . A 63 LYS HB3 . 34965 1 411 . 1 . 1 38 38 LYS HG2 H 1 1.504 0.020 . 1 . . . . A 63 LYS HG2 . 34965 1 412 . 1 . 1 38 38 LYS HD2 H 1 1.643 0.020 . 1 . . . . A 63 LYS HD2 . 34965 1 413 . 1 . 1 38 38 LYS HE2 H 1 2.954 0.020 . 1 . . . . A 63 LYS HE2 . 34965 1 414 . 1 . 1 38 38 LYS HE3 H 1 2.954 0.020 . 1 . . . . A 63 LYS HE3 . 34965 1 415 . 1 . 1 38 38 LYS CA C 13 57.308 0.3 . 1 . . . . A 63 LYS CA . 34965 1 416 . 1 . 1 38 38 LYS CB C 13 32.278 0.3 . 1 . . . . A 63 LYS CB . 34965 1 417 . 1 . 1 38 38 LYS CG C 13 24.869 0.3 . 1 . . . . A 63 LYS CG . 34965 1 418 . 1 . 1 38 38 LYS CD C 13 28.834 0.3 . 1 . . . . A 63 LYS CD . 34965 1 419 . 1 . 1 38 38 LYS CE C 13 42.080 0.3 . 1 . . . . A 63 LYS CE . 34965 1 420 . 1 . 1 38 38 LYS N N 15 115.182 0.3 . 1 . . . . A 63 LYS N . 34965 1 421 . 1 . 1 39 39 GLU H H 1 7.409 0.020 . 1 . . . . A 64 GLU H . 34965 1 422 . 1 . 1 39 39 GLU HA H 1 5.145 0.020 . 1 . . . . A 64 GLU HA . 34965 1 423 . 1 . 1 39 39 GLU HB2 H 1 1.908 0.020 . 2 . . . . A 64 GLU HB2 . 34965 1 424 . 1 . 1 39 39 GLU HB3 H 1 1.818 0.020 . 2 . . . . A 64 GLU HB3 . 34965 1 425 . 1 . 1 39 39 GLU HG2 H 1 2.072 0.020 . 1 . . . . A 64 GLU HG2 . 34965 1 426 . 1 . 1 39 39 GLU HG3 H 1 2.072 0.020 . 1 . . . . A 64 GLU HG3 . 34965 1 427 . 1 . 1 39 39 GLU CA C 13 54.420 0.3 . 1 . . . . A 64 GLU CA . 34965 1 428 . 1 . 1 39 39 GLU CB C 13 33.587 0.3 . 1 . . . . A 64 GLU CB . 34965 1 429 . 1 . 1 39 39 GLU CG C 13 36.355 0.3 . 1 . . . . A 64 GLU CG . 34965 1 430 . 1 . 1 39 39 GLU N N 15 116.338 0.3 . 1 . . . . A 64 GLU N . 34965 1 431 . 1 . 1 40 40 ALA H H 1 8.669 0.020 . 1 . . . . A 65 ALA H . 34965 1 432 . 1 . 1 40 40 ALA HA H 1 4.540 0.020 . 1 . . . . A 65 ALA HA . 34965 1 433 . 1 . 1 40 40 ALA HB1 H 1 1.135 0.020 . 1 . . . . A 65 ALA HB1 . 34965 1 434 . 1 . 1 40 40 ALA HB2 H 1 1.135 0.020 . 1 . . . . A 65 ALA HB2 . 34965 1 435 . 1 . 1 40 40 ALA HB3 H 1 1.135 0.020 . 1 . . . . A 65 ALA HB3 . 34965 1 436 . 1 . 1 40 40 ALA CA C 13 50.455 0.3 . 1 . . . . A 65 ALA CA . 34965 1 437 . 1 . 1 40 40 ALA CB C 13 21.953 0.3 . 1 . . . . A 65 ALA CB . 34965 1 438 . 1 . 1 40 40 ALA N N 15 123.796 0.3 . 1 . . . . A 65 ALA N . 34965 1 439 . 1 . 1 41 41 LEU H H 1 8.275 0.020 . 1 . . . . A 66 LEU H . 34965 1 440 . 1 . 1 41 41 LEU HA H 1 5.281 0.020 . 1 . . . . A 66 LEU HA . 34965 1 441 . 1 . 1 41 41 LEU HB2 H 1 1.280 0.020 . 2 . . . . A 66 LEU HB2 . 34965 1 442 . 1 . 1 41 41 LEU HB3 H 1 0.848 0.020 . 2 . . . . A 66 LEU HB3 . 34965 1 443 . 1 . 1 41 41 LEU HG H 1 1.341 0.020 . 1 . . . . A 66 LEU HG . 34965 1 444 . 1 . 1 41 41 LEU HD11 H 1 0.592 0.020 . 2 . . . . A 66 LEU HD11 . 34965 1 445 . 1 . 1 41 41 LEU HD12 H 1 0.592 0.020 . 2 . . . . A 66 LEU HD12 . 34965 1 446 . 1 . 1 41 41 LEU HD13 H 1 0.592 0.020 . 2 . . . . A 66 LEU HD13 . 34965 1 447 . 1 . 1 41 41 LEU HD21 H 1 0.314 0.020 . 2 . . . . A 66 LEU HD21 . 34965 1 448 . 1 . 1 41 41 LEU HD22 H 1 0.314 0.020 . 2 . . . . A 66 LEU HD22 . 34965 1 449 . 1 . 1 41 41 LEU HD23 H 1 0.314 0.020 . 2 . . . . A 66 LEU HD23 . 34965 1 450 . 1 . 1 41 41 LEU CA C 13 53.047 0.3 . 1 . . . . A 66 LEU CA . 34965 1 451 . 1 . 1 41 41 LEU CB C 13 45.103 0.3 . 1 . . . . A 66 LEU CB . 34965 1 452 . 1 . 1 41 41 LEU CG C 13 26.145 0.3 . 1 . . . . A 66 LEU CG . 34965 1 453 . 1 . 1 41 41 LEU CD1 C 13 23.126 0.3 . 1 . . . . A 66 LEU CD1 . 34965 1 454 . 1 . 1 41 41 LEU CD2 C 13 26.039 0.3 . 1 . . . . A 66 LEU CD2 . 34965 1 455 . 1 . 1 41 41 LEU N N 15 117.720 0.3 . 1 . . . . A 66 LEU N . 34965 1 456 . 1 . 1 42 42 ILE H H 1 8.997 0.020 . 1 . . . . A 67 ILE H . 34965 1 457 . 1 . 1 42 42 ILE HA H 1 5.558 0.020 . 1 . . . . A 67 ILE HA . 34965 1 458 . 1 . 1 42 42 ILE HB H 1 1.517 0.020 . 1 . . . . A 67 ILE HB . 34965 1 459 . 1 . 1 42 42 ILE HG12 H 1 1.450 0.020 . 2 . . . . A 67 ILE HG12 . 34965 1 460 . 1 . 1 42 42 ILE HG13 H 1 0.580 0.020 . 2 . . . . A 67 ILE HG13 . 34965 1 461 . 1 . 1 42 42 ILE HG21 H 1 0.743 0.020 . 1 . . . . A 67 ILE HG21 . 34965 1 462 . 1 . 1 42 42 ILE HG22 H 1 0.743 0.020 . 1 . . . . A 67 ILE HG22 . 34965 1 463 . 1 . 1 42 42 ILE HG23 H 1 0.743 0.020 . 1 . . . . A 67 ILE HG23 . 34965 1 464 . 1 . 1 42 42 ILE HD11 H 1 0.653 0.020 . 1 . . . . A 67 ILE HD11 . 34965 1 465 . 1 . 1 42 42 ILE HD12 H 1 0.653 0.020 . 1 . . . . A 67 ILE HD12 . 34965 1 466 . 1 . 1 42 42 ILE HD13 H 1 0.653 0.020 . 1 . . . . A 67 ILE HD13 . 34965 1 467 . 1 . 1 42 42 ILE CA C 13 57.858 0.3 . 1 . . . . A 67 ILE CA . 34965 1 468 . 1 . 1 42 42 ILE CB C 13 42.875 0.3 . 1 . . . . A 67 ILE CB . 34965 1 469 . 1 . 1 42 42 ILE CG1 C 13 28.367 0.3 . 1 . . . . A 67 ILE CG1 . 34965 1 470 . 1 . 1 42 42 ILE CG2 C 13 17.113 0.3 . 1 . . . . A 67 ILE CG2 . 34965 1 471 . 1 . 1 42 42 ILE CD1 C 13 14.102 0.3 . 1 . . . . A 67 ILE CD1 . 34965 1 472 . 1 . 1 42 42 ILE N N 15 117.299 0.3 . 1 . . . . A 67 ILE N . 34965 1 473 . 1 . 1 43 43 CYS H H 1 7.816 0.020 . 1 . . . . A 68 CYS H . 34965 1 474 . 1 . 1 43 43 CYS HA H 1 5.387 0.020 . 1 . . . . A 68 CYS HA . 34965 1 475 . 1 . 1 43 43 CYS HB2 H 1 3.327 0.020 . 2 . . . . A 68 CYS HB2 . 34965 1 476 . 1 . 1 43 43 CYS HB3 H 1 2.296 0.020 . 2 . . . . A 68 CYS HB3 . 34965 1 477 . 1 . 1 43 43 CYS CA C 13 54.497 0.3 . 1 . . . . A 68 CYS CA . 34965 1 478 . 1 . 1 43 43 CYS CB C 13 31.780 0.3 . 1 . . . . A 68 CYS CB . 34965 1 479 . 1 . 1 43 43 CYS N N 15 126.401 0.3 . 1 . . . . A 68 CYS N . 34965 1 480 . 1 . 1 44 44 PRO HA H 1 4.415 0.020 . 1 . . . . A 69 PRO HA . 34965 1 481 . 1 . 1 44 44 PRO HB2 H 1 2.228 0.020 . 2 . . . . A 69 PRO HB2 . 34965 1 482 . 1 . 1 44 44 PRO HB3 H 1 2.219 0.020 . 2 . . . . A 69 PRO HB3 . 34965 1 483 . 1 . 1 44 44 PRO HG2 H 1 1.953 0.020 . 1 . . . . A 69 PRO HG2 . 34965 1 484 . 1 . 1 44 44 PRO HG3 H 1 1.953 0.020 . 1 . . . . A 69 PRO HG3 . 34965 1 485 . 1 . 1 44 44 PRO HD2 H 1 3.930 0.020 . 2 . . . . A 69 PRO HD2 . 34965 1 486 . 1 . 1 44 44 PRO HD3 H 1 3.902 0.020 . 2 . . . . A 69 PRO HD3 . 34965 1 487 . 1 . 1 44 44 PRO CA C 13 63.236 0.3 . 1 . . . . A 69 PRO CA . 34965 1 488 . 1 . 1 44 44 PRO CB C 13 32.179 0.3 . 1 . . . . A 69 PRO CB . 34965 1 489 . 1 . 1 44 44 PRO CD C 13 51.948 0.3 . 1 . . . . A 69 PRO CD . 34965 1 490 . 1 . 1 45 45 THR H H 1 8.589 0.020 . 1 . . . . A 70 THR H . 34965 1 491 . 1 . 1 45 45 THR HA H 1 3.943 0.020 . 1 . . . . A 70 THR HA . 34965 1 492 . 1 . 1 45 45 THR HB H 1 3.968 0.020 . 1 . . . . A 70 THR HB . 34965 1 493 . 1 . 1 45 45 THR HG21 H 1 1.025 0.020 . 1 . . . . A 70 THR HG21 . 34965 1 494 . 1 . 1 45 45 THR HG22 H 1 1.025 0.020 . 1 . . . . A 70 THR HG22 . 34965 1 495 . 1 . 1 45 45 THR HG23 H 1 1.025 0.020 . 1 . . . . A 70 THR HG23 . 34965 1 496 . 1 . 1 45 45 THR CA C 13 65.191 0.3 . 1 . . . . A 70 THR CA . 34965 1 497 . 1 . 1 45 45 THR CB C 13 67.801 0.3 . 1 . . . . A 70 THR CB . 34965 1 498 . 1 . 1 45 45 THR CG2 C 13 23.602 0.3 . 1 . . . . A 70 THR CG2 . 34965 1 499 . 1 . 1 45 45 THR N N 15 118.846 0.3 . 1 . . . . A 70 THR N . 34965 1 500 . 1 . 1 46 46 CYS H H 1 7.695 0.020 . 1 . . . . A 71 CYS H . 34965 1 501 . 1 . 1 46 46 CYS HA H 1 4.470 0.020 . 1 . . . . A 71 CYS HA . 34965 1 502 . 1 . 1 46 46 CYS HB2 H 1 3.072 0.020 . 2 . . . . A 71 CYS HB2 . 34965 1 503 . 1 . 1 46 46 CYS HB3 H 1 2.788 0.020 . 2 . . . . A 71 CYS HB3 . 34965 1 504 . 1 . 1 46 46 CYS CA C 13 58.448 0.3 . 1 . . . . A 71 CYS CA . 34965 1 505 . 1 . 1 46 46 CYS CB C 13 30.458 0.3 . 1 . . . . A 71 CYS CB . 34965 1 506 . 1 . 1 46 46 CYS N N 15 119.544 0.3 . 1 . . . . A 71 CYS N . 34965 1 507 . 1 . 1 47 47 ASN H H 1 8.205 0.020 . 1 . . . . A 72 ASN H . 34965 1 508 . 1 . 1 47 47 ASN HA H 1 4.418 0.020 . 1 . . . . A 72 ASN HA . 34965 1 509 . 1 . 1 47 47 ASN HB2 H 1 3.107 0.020 . 2 . . . . A 72 ASN HB2 . 34965 1 510 . 1 . 1 47 47 ASN HB3 H 1 2.378 0.020 . 2 . . . . A 72 ASN HB3 . 34965 1 511 . 1 . 1 47 47 ASN HD21 H 1 7.282 0.020 . 1 . . . . A 72 ASN HD21 . 34965 1 512 . 1 . 1 47 47 ASN HD22 H 1 6.483 0.020 . 1 . . . . A 72 ASN HD22 . 34965 1 513 . 1 . 1 47 47 ASN CA C 13 54.154 0.3 . 1 . . . . A 72 ASN CA . 34965 1 514 . 1 . 1 47 47 ASN CB C 13 37.563 0.3 . 1 . . . . A 72 ASN CB . 34965 1 515 . 1 . 1 47 47 ASN N N 15 120.528 0.3 . 1 . . . . A 72 ASN N . 34965 1 516 . 1 . 1 47 47 ASN ND2 N 15 110.651 0.3 . 1 . . . . A 72 ASN ND2 . 34965 1 517 . 1 . 1 48 48 VAL H H 1 7.173 0.020 . 1 . . . . A 73 VAL H . 34965 1 518 . 1 . 1 48 48 VAL HA H 1 4.476 0.020 . 1 . . . . A 73 VAL HA . 34965 1 519 . 1 . 1 48 48 VAL HB H 1 1.710 0.020 . 1 . . . . A 73 VAL HB . 34965 1 520 . 1 . 1 48 48 VAL HG11 H 1 0.709 0.020 . 2 . . . . A 73 VAL HG11 . 34965 1 521 . 1 . 1 48 48 VAL HG12 H 1 0.709 0.020 . 2 . . . . A 73 VAL HG12 . 34965 1 522 . 1 . 1 48 48 VAL HG13 H 1 0.709 0.020 . 2 . . . . A 73 VAL HG13 . 34965 1 523 . 1 . 1 48 48 VAL HG21 H 1 0.087 0.020 . 2 . . . . A 73 VAL HG21 . 34965 1 524 . 1 . 1 48 48 VAL HG22 H 1 0.087 0.020 . 2 . . . . A 73 VAL HG22 . 34965 1 525 . 1 . 1 48 48 VAL HG23 H 1 0.087 0.020 . 2 . . . . A 73 VAL HG23 . 34965 1 526 . 1 . 1 48 48 VAL CA C 13 60.079 0.3 . 1 . . . . A 73 VAL CA . 34965 1 527 . 1 . 1 48 48 VAL CB C 13 33.653 0.3 . 1 . . . . A 73 VAL CB . 34965 1 528 . 1 . 1 48 48 VAL CG1 C 13 18.494 0.3 . 1 . . . . A 73 VAL CG1 . 34965 1 529 . 1 . 1 48 48 VAL CG2 C 13 20.957 0.3 . 1 . . . . A 73 VAL CG2 . 34965 1 530 . 1 . 1 48 48 VAL N N 15 111.946 0.3 . 1 . . . . A 73 VAL N . 34965 1 531 . 1 . 1 49 49 THR H H 1 7.798 0.020 . 1 . . . . A 74 THR H . 34965 1 532 . 1 . 1 49 49 THR HA H 1 5.279 0.020 . 1 . . . . A 74 THR HA . 34965 1 533 . 1 . 1 49 49 THR HB H 1 3.705 0.020 . 1 . . . . A 74 THR HB . 34965 1 534 . 1 . 1 49 49 THR HG21 H 1 0.853 0.020 . 1 . . . . A 74 THR HG21 . 34965 1 535 . 1 . 1 49 49 THR HG22 H 1 0.853 0.020 . 1 . . . . A 74 THR HG22 . 34965 1 536 . 1 . 1 49 49 THR HG23 H 1 0.853 0.020 . 1 . . . . A 74 THR HG23 . 34965 1 537 . 1 . 1 49 49 THR CA C 13 60.784 0.3 . 1 . . . . A 74 THR CA . 34965 1 538 . 1 . 1 49 49 THR CB C 13 70.091 0.3 . 1 . . . . A 74 THR CB . 34965 1 539 . 1 . 1 49 49 THR CG2 C 13 20.958 0.3 . 1 . . . . A 74 THR CG2 . 34965 1 540 . 1 . 1 49 49 THR N N 15 116.769 0.3 . 1 . . . . A 74 THR N . 34965 1 541 . 1 . 1 50 50 ILE H H 1 9.109 0.020 . 1 . . . . A 75 ILE H . 34965 1 542 . 1 . 1 50 50 ILE HA H 1 5.759 0.020 . 1 . . . . A 75 ILE HA . 34965 1 543 . 1 . 1 50 50 ILE HB H 1 1.835 0.020 . 1 . . . . A 75 ILE HB . 34965 1 544 . 1 . 1 50 50 ILE HG12 H 1 0.968 0.020 . 2 . . . . A 75 ILE HG12 . 34965 1 545 . 1 . 1 50 50 ILE HG13 H 1 0.418 0.020 . 2 . . . . A 75 ILE HG13 . 34965 1 546 . 1 . 1 50 50 ILE HG21 H 1 0.981 0.020 . 1 . . . . A 75 ILE HG21 . 34965 1 547 . 1 . 1 50 50 ILE HG22 H 1 0.981 0.020 . 1 . . . . A 75 ILE HG22 . 34965 1 548 . 1 . 1 50 50 ILE HG23 H 1 0.981 0.020 . 1 . . . . A 75 ILE HG23 . 34965 1 549 . 1 . 1 50 50 ILE HD11 H 1 0.100 0.020 . 1 . . . . A 75 ILE HD11 . 34965 1 550 . 1 . 1 50 50 ILE HD12 H 1 0.100 0.020 . 1 . . . . A 75 ILE HD12 . 34965 1 551 . 1 . 1 50 50 ILE HD13 H 1 0.100 0.020 . 1 . . . . A 75 ILE HD13 . 34965 1 552 . 1 . 1 50 50 ILE CA C 13 57.980 0.3 . 1 . . . . A 75 ILE CA . 34965 1 553 . 1 . 1 50 50 ILE CB C 13 44.237 0.3 . 1 . . . . A 75 ILE CB . 34965 1 554 . 1 . 1 50 50 ILE CG1 C 13 25.373 0.3 . 1 . . . . A 75 ILE CG1 . 34965 1 555 . 1 . 1 50 50 ILE CG2 C 13 20.352 0.3 . 1 . . . . A 75 ILE CG2 . 34965 1 556 . 1 . 1 50 50 ILE CD1 C 13 14.430 0.3 . 1 . . . . A 75 ILE CD1 . 34965 1 557 . 1 . 1 50 50 ILE N N 15 115.839 0.3 . 1 . . . . A 75 ILE N . 34965 1 558 . 1 . 1 51 51 HIS H H 1 8.731 0.020 . 1 . . . . A 76 HIS H . 34965 1 559 . 1 . 1 51 51 HIS HA H 1 4.476 0.020 . 1 . . . . A 76 HIS HA . 34965 1 560 . 1 . 1 51 51 HIS HB2 H 1 3.455 0.020 . 2 . . . . A 76 HIS HB2 . 34965 1 561 . 1 . 1 51 51 HIS HB3 H 1 3.432 0.020 . 2 . . . . A 76 HIS HB3 . 34965 1 562 . 1 . 1 51 51 HIS HD1 H 1 8.252 0.020 . 1 . . . . A 76 HIS HD1 . 34965 1 563 . 1 . 1 51 51 HIS HD2 H 1 7.516 0.020 . 1 . . . . A 76 HIS HD2 . 34965 1 564 . 1 . 1 51 51 HIS HE1 H 1 7.150 0.020 . 1 . . . . A 76 HIS HE1 . 34965 1 565 . 1 . 1 51 51 HIS CA C 13 58.511 0.3 . 1 . . . . A 76 HIS CA . 34965 1 566 . 1 . 1 51 51 HIS CB C 13 31.649 0.3 . 1 . . . . A 76 HIS CB . 34965 1 567 . 1 . 1 51 51 HIS CD2 C 13 119.542 0.3 . 1 . . . . A 76 HIS CD2 . 34965 1 568 . 1 . 1 51 51 HIS CE1 C 13 138.475 0.3 . 1 . . . . A 76 HIS CE1 . 34965 1 569 . 1 . 1 51 51 HIS N N 15 117.484 0.3 . 1 . . . . A 76 HIS N . 34965 1 570 . 1 . 1 51 51 HIS NE2 N 15 184.540 0.3 . 1 . . . . A 76 HIS NE2 . 34965 1 571 . 1 . 1 52 52 ASN H H 1 9.131 0.020 . 1 . . . . A 77 ASN H . 34965 1 572 . 1 . 1 52 52 ASN HA H 1 4.015 0.020 . 1 . . . . A 77 ASN HA . 34965 1 573 . 1 . 1 52 52 ASN HB2 H 1 2.740 0.020 . 2 . . . . A 77 ASN HB2 . 34965 1 574 . 1 . 1 52 52 ASN HB3 H 1 2.645 0.020 . 2 . . . . A 77 ASN HB3 . 34965 1 575 . 1 . 1 52 52 ASN HD21 H 1 7.486 0.020 . 1 . . . . A 77 ASN HD21 . 34965 1 576 . 1 . 1 52 52 ASN HD22 H 1 6.653 0.020 . 1 . . . . A 77 ASN HD22 . 34965 1 577 . 1 . 1 52 52 ASN CA C 13 57.332 0.3 . 1 . . . . A 77 ASN CA . 34965 1 578 . 1 . 1 52 52 ASN CB C 13 37.893 0.3 . 1 . . . . A 77 ASN CB . 34965 1 579 . 1 . 1 52 52 ASN N N 15 122.241 0.3 . 1 . . . . A 77 ASN N . 34965 1 580 . 1 . 1 52 52 ASN ND2 N 15 112.177 0.3 . 1 . . . . A 77 ASN ND2 . 34965 1 581 . 1 . 1 53 53 ARG H H 1 8.240 0.020 . 1 . . . . A 78 ARG H . 34965 1 582 . 1 . 1 53 53 ARG HA H 1 4.221 0.020 . 1 . . . . A 78 ARG HA . 34965 1 583 . 1 . 1 53 53 ARG HB2 H 1 1.790 0.020 . 2 . . . . A 78 ARG HB2 . 34965 1 584 . 1 . 1 53 53 ARG HB3 H 1 1.654 0.020 . 2 . . . . A 78 ARG HB3 . 34965 1 585 . 1 . 1 53 53 ARG HG2 H 1 1.665 0.020 . 2 . . . . A 78 ARG HG2 . 34965 1 586 . 1 . 1 53 53 ARG HG3 H 1 1.510 0.020 . 2 . . . . A 78 ARG HG3 . 34965 1 587 . 1 . 1 53 53 ARG HD2 H 1 2.993 0.020 . 2 . . . . A 78 ARG HD2 . 34965 1 588 . 1 . 1 53 53 ARG HD3 H 1 2.976 0.020 . 2 . . . . A 78 ARG HD3 . 34965 1 589 . 1 . 1 53 53 ARG HE H 1 7.583 0.020 . 1 . . . . A 78 ARG HE . 34965 1 590 . 1 . 1 53 53 ARG CA C 13 57.298 0.3 . 1 . . . . A 78 ARG CA . 34965 1 591 . 1 . 1 53 53 ARG CB C 13 28.826 0.3 . 1 . . . . A 78 ARG CB . 34965 1 592 . 1 . 1 53 53 ARG CG C 13 27.398 0.3 . 1 . . . . A 78 ARG CG . 34965 1 593 . 1 . 1 53 53 ARG CD C 13 43.046 0.3 . 1 . . . . A 78 ARG CD . 34965 1 594 . 1 . 1 53 53 ARG N N 15 112.848 0.3 . 1 . . . . A 78 ARG N . 34965 1 595 . 1 . 1 54 54 CYS H H 1 7.501 0.020 . 1 . . . . A 79 CYS H . 34965 1 596 . 1 . 1 54 54 CYS HA H 1 4.264 0.020 . 1 . . . . A 79 CYS HA . 34965 1 597 . 1 . 1 54 54 CYS HB2 H 1 3.083 0.020 . 2 . . . . A 79 CYS HB2 . 34965 1 598 . 1 . 1 54 54 CYS HB3 H 1 2.767 0.020 . 2 . . . . A 79 CYS HB3 . 34965 1 599 . 1 . 1 54 54 CYS CA C 13 61.126 0.3 . 1 . . . . A 79 CYS CA . 34965 1 600 . 1 . 1 54 54 CYS CB C 13 29.895 0.3 . 1 . . . . A 79 CYS CB . 34965 1 601 . 1 . 1 54 54 CYS N N 15 119.991 0.3 . 1 . . . . A 79 CYS N . 34965 1 602 . 1 . 1 55 55 LYS H H 1 6.990 0.020 . 1 . . . . A 80 LYS H . 34965 1 603 . 1 . 1 55 55 LYS HA H 1 3.410 0.020 . 1 . . . . A 80 LYS HA . 34965 1 604 . 1 . 1 55 55 LYS HB2 H 1 1.299 0.020 . 2 . . . . A 80 LYS HB2 . 34965 1 605 . 1 . 1 55 55 LYS HB3 H 1 1.480 0.020 . 2 . . . . A 80 LYS HB3 . 34965 1 606 . 1 . 1 55 55 LYS HG2 H 1 1.166 0.020 . 2 . . . . A 80 LYS HG2 . 34965 1 607 . 1 . 1 55 55 LYS HG3 H 1 1.077 0.020 . 2 . . . . A 80 LYS HG3 . 34965 1 608 . 1 . 1 55 55 LYS HD2 H 1 1.442 0.020 . 2 . . . . A 80 LYS HD2 . 34965 1 609 . 1 . 1 55 55 LYS HD3 H 1 1.432 0.020 . 2 . . . . A 80 LYS HD3 . 34965 1 610 . 1 . 1 55 55 LYS HE2 H 1 2.870 0.020 . 2 . . . . A 80 LYS HE2 . 34965 1 611 . 1 . 1 55 55 LYS HE3 H 1 2.864 0.020 . 2 . . . . A 80 LYS HE3 . 34965 1 612 . 1 . 1 55 55 LYS CA C 13 59.726 0.3 . 1 . . . . A 80 LYS CA . 34965 1 613 . 1 . 1 55 55 LYS CB C 13 32.283 0.3 . 1 . . . . A 80 LYS CB . 34965 1 614 . 1 . 1 55 55 LYS CG C 13 23.429 0.3 . 1 . . . . A 80 LYS CG . 34965 1 615 . 1 . 1 55 55 LYS CD C 13 29.261 0.3 . 1 . . . . A 80 LYS CD . 34965 1 616 . 1 . 1 55 55 LYS CE C 13 41.721 0.3 . 1 . . . . A 80 LYS CE . 34965 1 617 . 1 . 1 55 55 LYS N N 15 119.893 0.3 . 1 . . . . A 80 LYS N . 34965 1 618 . 1 . 1 56 56 ASP H H 1 8.011 0.020 . 1 . . . . A 81 ASP H . 34965 1 619 . 1 . 1 56 56 ASP HA H 1 4.612 0.020 . 1 . . . . A 81 ASP HA . 34965 1 620 . 1 . 1 56 56 ASP HB2 H 1 2.718 0.020 . 2 . . . . A 81 ASP HB2 . 34965 1 621 . 1 . 1 56 56 ASP HB3 H 1 2.476 0.020 . 2 . . . . A 81 ASP HB3 . 34965 1 622 . 1 . 1 56 56 ASP CA C 13 55.468 0.3 . 1 . . . . A 81 ASP CA . 34965 1 623 . 1 . 1 56 56 ASP CB C 13 40.768 0.3 . 1 . . . . A 81 ASP CB . 34965 1 624 . 1 . 1 56 56 ASP N N 15 115.132 0.3 . 1 . . . . A 81 ASP N . 34965 1 625 . 1 . 1 57 57 THR H H 1 7.512 0.020 . 1 . . . . A 82 THR H . 34965 1 626 . 1 . 1 57 57 THR HA H 1 4.249 0.020 . 1 . . . . A 82 THR HA . 34965 1 627 . 1 . 1 57 57 THR HB H 1 4.204 0.020 . 1 . . . . A 82 THR HB . 34965 1 628 . 1 . 1 57 57 THR HG21 H 1 1.127 0.020 . 1 . . . . A 82 THR HG21 . 34965 1 629 . 1 . 1 57 57 THR HG22 H 1 1.127 0.020 . 1 . . . . A 82 THR HG22 . 34965 1 630 . 1 . 1 57 57 THR HG23 H 1 1.127 0.020 . 1 . . . . A 82 THR HG23 . 34965 1 631 . 1 . 1 57 57 THR CA C 13 61.968 0.3 . 1 . . . . A 82 THR CA . 34965 1 632 . 1 . 1 57 57 THR CB C 13 69.360 0.3 . 1 . . . . A 82 THR CB . 34965 1 633 . 1 . 1 57 57 THR CG2 C 13 21.829 0.3 . 1 . . . . A 82 THR CG2 . 34965 1 634 . 1 . 1 57 57 THR N N 15 110.810 0.3 . 1 . . . . A 82 THR N . 34965 1 635 . 1 . 1 58 58 LEU H H 1 6.803 0.020 . 1 . . . . A 83 LEU H . 34965 1 636 . 1 . 1 58 58 LEU HA H 1 4.300 0.020 . 1 . . . . A 83 LEU HA . 34965 1 637 . 1 . 1 58 58 LEU HB2 H 1 1.804 0.020 . 2 . . . . A 83 LEU HB2 . 34965 1 638 . 1 . 1 58 58 LEU HB3 H 1 1.451 0.020 . 2 . . . . A 83 LEU HB3 . 34965 1 639 . 1 . 1 58 58 LEU HG H 1 2.267 0.020 . 1 . . . . A 83 LEU HG . 34965 1 640 . 1 . 1 58 58 LEU HD11 H 1 1.015 0.020 . 2 . . . . A 83 LEU HD11 . 34965 1 641 . 1 . 1 58 58 LEU HD12 H 1 1.015 0.020 . 2 . . . . A 83 LEU HD12 . 34965 1 642 . 1 . 1 58 58 LEU HD13 H 1 1.015 0.020 . 2 . . . . A 83 LEU HD13 . 34965 1 643 . 1 . 1 58 58 LEU HD21 H 1 0.704 0.020 . 2 . . . . A 83 LEU HD21 . 34965 1 644 . 1 . 1 58 58 LEU HD22 H 1 0.704 0.020 . 2 . . . . A 83 LEU HD22 . 34965 1 645 . 1 . 1 58 58 LEU HD23 H 1 0.704 0.020 . 2 . . . . A 83 LEU HD23 . 34965 1 646 . 1 . 1 58 58 LEU CA C 13 54.815 0.3 . 1 . . . . A 83 LEU CA . 34965 1 647 . 1 . 1 58 58 LEU CB C 13 43.061 0.3 . 1 . . . . A 83 LEU CB . 34965 1 648 . 1 . 1 58 58 LEU CG C 13 25.824 0.3 . 1 . . . . A 83 LEU CG . 34965 1 649 . 1 . 1 58 58 LEU CD1 C 13 24.758 0.3 . 1 . . . . A 83 LEU CD1 . 34965 1 650 . 1 . 1 58 58 LEU CD2 C 13 26.150 0.3 . 1 . . . . A 83 LEU CD2 . 34965 1 651 . 1 . 1 58 58 LEU N N 15 122.596 0.3 . 1 . . . . A 83 LEU N . 34965 1 652 . 1 . 1 59 59 ALA H H 1 8.317 0.020 . 1 . . . . A 84 ALA H . 34965 1 653 . 1 . 1 59 59 ALA HA H 1 4.309 0.020 . 1 . . . . A 84 ALA HA . 34965 1 654 . 1 . 1 59 59 ALA HB1 H 1 1.459 0.020 . 1 . . . . A 84 ALA HB1 . 34965 1 655 . 1 . 1 59 59 ALA HB2 H 1 1.459 0.020 . 1 . . . . A 84 ALA HB2 . 34965 1 656 . 1 . 1 59 59 ALA HB3 H 1 1.459 0.020 . 1 . . . . A 84 ALA HB3 . 34965 1 657 . 1 . 1 59 59 ALA CA C 13 51.877 0.3 . 1 . . . . A 84 ALA CA . 34965 1 658 . 1 . 1 59 59 ALA CB C 13 19.457 0.3 . 1 . . . . A 84 ALA CB . 34965 1 659 . 1 . 1 59 59 ALA N N 15 126.995 0.3 . 1 . . . . A 84 ALA N . 34965 1 660 . 1 . 1 60 60 ASN H H 1 8.257 0.020 . 1 . . . . A 85 ASN H . 34965 1 661 . 1 . 1 60 60 ASN HA H 1 4.537 0.020 . 1 . . . . A 85 ASN HA . 34965 1 662 . 1 . 1 60 60 ASN HB2 H 1 2.805 0.020 . 2 . . . . A 85 ASN HB2 . 34965 1 663 . 1 . 1 60 60 ASN HB3 H 1 2.473 0.020 . 2 . . . . A 85 ASN HB3 . 34965 1 664 . 1 . 1 60 60 ASN HD21 H 1 7.379 0.020 . 1 . . . . A 85 ASN HD21 . 34965 1 665 . 1 . 1 60 60 ASN HD22 H 1 6.820 0.020 . 1 . . . . A 85 ASN HD22 . 34965 1 666 . 1 . 1 60 60 ASN CA C 13 53.512 0.3 . 1 . . . . A 85 ASN CA . 34965 1 667 . 1 . 1 60 60 ASN CB C 13 39.026 0.3 . 1 . . . . A 85 ASN CB . 34965 1 668 . 1 . 1 60 60 ASN N N 15 116.619 0.3 . 1 . . . . A 85 ASN N . 34965 1 669 . 1 . 1 60 60 ASN ND2 N 15 113.001 0.3 . 1 . . . . A 85 ASN ND2 . 34965 1 670 . 1 . 1 61 61 CYS H H 1 7.142 0.020 . 1 . . . . A 86 CYS H . 34965 1 671 . 1 . 1 61 61 CYS HA H 1 3.263 0.020 . 1 . . . . A 86 CYS HA . 34965 1 672 . 1 . 1 61 61 CYS HB2 H 1 2.194 0.020 . 2 . . . . A 86 CYS HB2 . 34965 1 673 . 1 . 1 61 61 CYS HB3 H 1 1.150 0.020 . 2 . . . . A 86 CYS HB3 . 34965 1 674 . 1 . 1 61 61 CYS CA C 13 64.838 0.3 . 1 . . . . A 86 CYS CA . 34965 1 675 . 1 . 1 61 61 CYS CB C 13 28.976 0.3 . 1 . . . . A 86 CYS CB . 34965 1 676 . 1 . 1 61 61 CYS N N 15 124.584 0.3 . 1 . . . . A 86 CYS N . 34965 1 677 . 1 . 1 62 62 THR H H 1 7.926 0.020 . 1 . . . . A 87 THR H . 34965 1 678 . 1 . 1 62 62 THR HA H 1 3.759 0.020 . 1 . . . . A 87 THR HA . 34965 1 679 . 1 . 1 62 62 THR HB H 1 4.030 0.020 . 1 . . . . A 87 THR HB . 34965 1 680 . 1 . 1 62 62 THR HG21 H 1 1.108 0.020 . 1 . . . . A 87 THR HG21 . 34965 1 681 . 1 . 1 62 62 THR HG22 H 1 1.108 0.020 . 1 . . . . A 87 THR HG22 . 34965 1 682 . 1 . 1 62 62 THR HG23 H 1 1.108 0.020 . 1 . . . . A 87 THR HG23 . 34965 1 683 . 1 . 1 62 62 THR CA C 13 66.083 0.3 . 1 . . . . A 87 THR CA . 34965 1 684 . 1 . 1 62 62 THR CB C 13 68.697 0.3 . 1 . . . . A 87 THR CB . 34965 1 685 . 1 . 1 62 62 THR CG2 C 13 21.562 0.3 . 1 . . . . A 87 THR CG2 . 34965 1 686 . 1 . 1 62 62 THR N N 15 112.448 0.3 . 1 . . . . A 87 THR N . 34965 1 687 . 1 . 1 63 63 LYS H H 1 7.631 0.020 . 1 . . . . A 88 LYS H . 34965 1 688 . 1 . 1 63 63 LYS HA H 1 4.015 0.020 . 1 . . . . A 88 LYS HA . 34965 1 689 . 1 . 1 63 63 LYS HB2 H 1 1.862 0.020 . 2 . . . . A 88 LYS HB2 . 34965 1 690 . 1 . 1 63 63 LYS HB3 H 1 1.814 0.020 . 2 . . . . A 88 LYS HB3 . 34965 1 691 . 1 . 1 63 63 LYS HG2 H 1 1.458 0.020 . 1 . . . . A 88 LYS HG2 . 34965 1 692 . 1 . 1 63 63 LYS HG3 H 1 1.458 0.020 . 1 . . . . A 88 LYS HG3 . 34965 1 693 . 1 . 1 63 63 LYS HD2 H 1 1.639 0.020 . 1 . . . . A 88 LYS HD2 . 34965 1 694 . 1 . 1 63 63 LYS HD3 H 1 1.639 0.020 . 1 . . . . A 88 LYS HD3 . 34965 1 695 . 1 . 1 63 63 LYS HE2 H 1 2.928 0.020 . 1 . . . . A 88 LYS HE2 . 34965 1 696 . 1 . 1 63 63 LYS HE3 H 1 2.928 0.020 . 1 . . . . A 88 LYS HE3 . 34965 1 697 . 1 . 1 63 63 LYS CA C 13 58.259 0.3 . 1 . . . . A 88 LYS CA . 34965 1 698 . 1 . 1 63 63 LYS CB C 13 32.003 0.3 . 1 . . . . A 88 LYS CB . 34965 1 699 . 1 . 1 63 63 LYS CG C 13 25.030 0.3 . 1 . . . . A 88 LYS CG . 34965 1 700 . 1 . 1 63 63 LYS CD C 13 28.824 0.3 . 1 . . . . A 88 LYS CD . 34965 1 701 . 1 . 1 63 63 LYS CE C 13 42.044 0.3 . 1 . . . . A 88 LYS CE . 34965 1 702 . 1 . 1 63 63 LYS N N 15 121.103 0.3 . 1 . . . . A 88 LYS N . 34965 1 703 . 1 . 1 64 64 VAL H H 1 8.222 0.020 . 1 . . . . A 89 VAL H . 34965 1 704 . 1 . 1 64 64 VAL HA H 1 3.597 0.020 . 1 . . . . A 89 VAL HA . 34965 1 705 . 1 . 1 64 64 VAL HB H 1 2.082 0.020 . 1 . . . . A 89 VAL HB . 34965 1 706 . 1 . 1 64 64 VAL HG11 H 1 1.029 0.020 . 2 . . . . A 89 VAL HG11 . 34965 1 707 . 1 . 1 64 64 VAL HG12 H 1 1.029 0.020 . 2 . . . . A 89 VAL HG12 . 34965 1 708 . 1 . 1 64 64 VAL HG13 H 1 1.029 0.020 . 2 . . . . A 89 VAL HG13 . 34965 1 709 . 1 . 1 64 64 VAL HG21 H 1 0.866 0.020 . 2 . . . . A 89 VAL HG21 . 34965 1 710 . 1 . 1 64 64 VAL HG22 H 1 0.866 0.020 . 2 . . . . A 89 VAL HG22 . 34965 1 711 . 1 . 1 64 64 VAL HG23 H 1 0.866 0.020 . 2 . . . . A 89 VAL HG23 . 34965 1 712 . 1 . 1 64 64 VAL CA C 13 66.388 0.3 . 1 . . . . A 89 VAL CA . 34965 1 713 . 1 . 1 64 64 VAL CB C 13 31.755 0.3 . 1 . . . . A 89 VAL CB . 34965 1 714 . 1 . 1 64 64 VAL CG1 C 13 23.400 0.3 . 1 . . . . A 89 VAL CG1 . 34965 1 715 . 1 . 1 64 64 VAL CG2 C 13 21.817 0.3 . 1 . . . . A 89 VAL CG2 . 34965 1 716 . 1 . 1 64 64 VAL N N 15 121.837 0.3 . 1 . . . . A 89 VAL N . 34965 1 717 . 1 . 1 65 65 LYS H H 1 8.595 0.020 . 1 . . . . A 90 LYS H . 34965 1 718 . 1 . 1 65 65 LYS HA H 1 3.889 0.020 . 1 . . . . A 90 LYS HA . 34965 1 719 . 1 . 1 65 65 LYS HB2 H 1 1.811 0.020 . 2 . . . . A 90 LYS HB2 . 34965 1 720 . 1 . 1 65 65 LYS HB3 H 1 1.721 0.020 . 2 . . . . A 90 LYS HB3 . 34965 1 721 . 1 . 1 65 65 LYS HG2 H 1 1.307 0.020 . 1 . . . . A 90 LYS HG2 . 34965 1 722 . 1 . 1 65 65 LYS HG3 H 1 1.307 0.020 . 1 . . . . A 90 LYS HG3 . 34965 1 723 . 1 . 1 65 65 LYS HD2 H 1 1.499 0.020 . 1 . . . . A 90 LYS HD2 . 34965 1 724 . 1 . 1 65 65 LYS HD3 H 1 1.499 0.020 . 1 . . . . A 90 LYS HD3 . 34965 1 725 . 1 . 1 65 65 LYS HE2 H 1 2.869 0.020 . 1 . . . . A 90 LYS HE2 . 34965 1 726 . 1 . 1 65 65 LYS HE3 H 1 2.869 0.020 . 1 . . . . A 90 LYS HE3 . 34965 1 727 . 1 . 1 65 65 LYS CA C 13 59.373 0.3 . 1 . . . . A 90 LYS CA . 34965 1 728 . 1 . 1 65 65 LYS CB C 13 32.097 0.3 . 1 . . . . A 90 LYS CB . 34965 1 729 . 1 . 1 65 65 LYS CG C 13 24.631 0.3 . 1 . . . . A 90 LYS CG . 34965 1 730 . 1 . 1 65 65 LYS CD C 13 29.260 0.3 . 1 . . . . A 90 LYS CD . 34965 1 731 . 1 . 1 65 65 LYS CE C 13 41.756 0.3 . 1 . . . . A 90 LYS CE . 34965 1 732 . 1 . 1 65 65 LYS N N 15 120.229 0.3 . 1 . . . . A 90 LYS N . 34965 1 733 . 1 . 1 66 66 GLN H H 1 7.749 0.020 . 1 . . . . A 91 GLN H . 34965 1 734 . 1 . 1 66 66 GLN HA H 1 4.053 0.020 . 1 . . . . A 91 GLN HA . 34965 1 735 . 1 . 1 66 66 GLN HB2 H 1 2.115 0.020 . 2 . . . . A 91 GLN HB2 . 34965 1 736 . 1 . 1 66 66 GLN HB3 H 1 2.066 0.020 . 2 . . . . A 91 GLN HB3 . 34965 1 737 . 1 . 1 66 66 GLN HG2 H 1 2.509 0.020 . 2 . . . . A 91 GLN HG2 . 34965 1 738 . 1 . 1 66 66 GLN HG3 H 1 2.321 0.020 . 2 . . . . A 91 GLN HG3 . 34965 1 739 . 1 . 1 66 66 GLN HE21 H 1 7.383 0.020 . 1 . . . . A 91 GLN HE21 . 34965 1 740 . 1 . 1 66 66 GLN HE22 H 1 6.769 0.020 . 1 . . . . A 91 GLN HE22 . 34965 1 741 . 1 . 1 66 66 GLN CA C 13 58.114 0.3 . 1 . . . . A 91 GLN CA . 34965 1 742 . 1 . 1 66 66 GLN CB C 13 28.506 0.3 . 1 . . . . A 91 GLN CB . 34965 1 743 . 1 . 1 66 66 GLN CG C 13 33.903 0.3 . 1 . . . . A 91 GLN CG . 34965 1 744 . 1 . 1 66 66 GLN N N 15 117.825 0.3 . 1 . . . . A 91 GLN N . 34965 1 745 . 1 . 1 66 66 GLN NE2 N 15 111.592 0.3 . 1 . . . . A 91 GLN NE2 . 34965 1 746 . 1 . 1 67 67 LYS H H 1 7.938 0.020 . 1 . . . . A 92 LYS H . 34965 1 747 . 1 . 1 67 67 LYS HA H 1 4.058 0.020 . 1 . . . . A 92 LYS HA . 34965 1 748 . 1 . 1 67 67 LYS HB2 H 1 1.980 0.020 . 2 . . . . A 92 LYS HB2 . 34965 1 749 . 1 . 1 67 67 LYS HB3 H 1 1.975 0.020 . 2 . . . . A 92 LYS HB3 . 34965 1 750 . 1 . 1 67 67 LYS HG2 H 1 1.473 0.020 . 1 . . . . A 92 LYS HG2 . 34965 1 751 . 1 . 1 67 67 LYS HD2 H 1 1.694 0.020 . 1 . . . . A 92 LYS HD2 . 34965 1 752 . 1 . 1 67 67 LYS HD3 H 1 1.694 0.020 . 1 . . . . A 92 LYS HD3 . 34965 1 753 . 1 . 1 67 67 LYS HE2 H 1 2.972 0.020 . 2 . . . . A 92 LYS HE2 . 34965 1 754 . 1 . 1 67 67 LYS HE3 H 1 2.950 0.020 . 2 . . . . A 92 LYS HE3 . 34965 1 755 . 1 . 1 67 67 LYS CA C 13 58.385 0.3 . 1 . . . . A 92 LYS CA . 34965 1 756 . 1 . 1 67 67 LYS CB C 13 32.298 0.3 . 1 . . . . A 92 LYS CB . 34965 1 757 . 1 . 1 67 67 LYS CG C 13 24.937 0.3 . 1 . . . . A 92 LYS CG . 34965 1 758 . 1 . 1 67 67 LYS CD C 13 29.184 0.3 . 1 . . . . A 92 LYS CD . 34965 1 759 . 1 . 1 67 67 LYS CE C 13 42.020 0.3 . 1 . . . . A 92 LYS CE . 34965 1 760 . 1 . 1 67 67 LYS N N 15 120.688 0.3 . 1 . . . . A 92 LYS N . 34965 1 761 . 1 . 1 68 68 GLN H H 1 8.265 0.020 . 1 . . . . A 93 GLN H . 34965 1 762 . 1 . 1 68 68 GLN HA H 1 4.229 0.020 . 1 . . . . A 93 GLN HA . 34965 1 763 . 1 . 1 68 68 GLN HB2 H 1 2.148 0.020 . 2 . . . . A 93 GLN HB2 . 34965 1 764 . 1 . 1 68 68 GLN HB3 H 1 2.044 0.020 . 2 . . . . A 93 GLN HB3 . 34965 1 765 . 1 . 1 68 68 GLN HG2 H 1 2.452 0.020 . 2 . . . . A 93 GLN HG2 . 34965 1 766 . 1 . 1 68 68 GLN HG3 H 1 2.270 0.020 . 2 . . . . A 93 GLN HG3 . 34965 1 767 . 1 . 1 68 68 GLN HE21 H 1 7.050 0.020 . 1 . . . . A 93 GLN HE21 . 34965 1 768 . 1 . 1 68 68 GLN HE22 H 1 6.869 0.020 . 1 . . . . A 93 GLN HE22 . 34965 1 769 . 1 . 1 68 68 GLN CA C 13 57.343 0.3 . 1 . . . . A 93 GLN CA . 34965 1 770 . 1 . 1 68 68 GLN CB C 13 29.629 0.3 . 1 . . . . A 93 GLN CB . 34965 1 771 . 1 . 1 68 68 GLN CG C 13 33.835 0.3 . 1 . . . . A 93 GLN CG . 34965 1 772 . 1 . 1 68 68 GLN N N 15 118.945 0.3 . 1 . . . . A 93 GLN N . 34965 1 773 . 1 . 1 68 68 GLN NE2 N 15 111.657 0.3 . 1 . . . . A 93 GLN NE2 . 34965 1 774 . 1 . 1 69 69 GLN H H 1 8.133 0.020 . 1 . . . . A 94 GLN H . 34965 1 775 . 1 . 1 69 69 GLN HA H 1 4.137 0.020 . 1 . . . . A 94 GLN HA . 34965 1 776 . 1 . 1 69 69 GLN HB2 H 1 2.068 0.020 . 2 . . . . A 94 GLN HB2 . 34965 1 777 . 1 . 1 69 69 GLN HB3 H 1 2.059 0.020 . 2 . . . . A 94 GLN HB3 . 34965 1 778 . 1 . 1 69 69 GLN HG2 H 1 2.439 0.020 . 2 . . . . A 94 GLN HG2 . 34965 1 779 . 1 . 1 69 69 GLN HG3 H 1 2.333 0.020 . 2 . . . . A 94 GLN HG3 . 34965 1 780 . 1 . 1 69 69 GLN HE21 H 1 7.432 0.020 . 1 . . . . A 94 GLN HE21 . 34965 1 781 . 1 . 1 69 69 GLN HE22 H 1 6.795 0.020 . 1 . . . . A 94 GLN HE22 . 34965 1 782 . 1 . 1 69 69 GLN CA C 13 57.189 0.3 . 1 . . . . A 94 GLN CA . 34965 1 783 . 1 . 1 69 69 GLN CB C 13 28.692 0.3 . 1 . . . . A 94 GLN CB . 34965 1 784 . 1 . 1 69 69 GLN CG C 13 33.883 0.3 . 1 . . . . A 94 GLN CG . 34965 1 785 . 1 . 1 69 69 GLN N N 15 119.905 0.3 . 1 . . . . A 94 GLN N . 34965 1 786 . 1 . 1 69 69 GLN NE2 N 15 111.890 0.3 . 1 . . . . A 94 GLN NE2 . 34965 1 787 . 1 . 1 70 70 LYS H H 1 7.962 0.020 . 1 . . . . A 95 LYS H . 34965 1 788 . 1 . 1 70 70 LYS HA H 1 4.071 0.020 . 1 . . . . A 95 LYS HA . 34965 1 789 . 1 . 1 70 70 LYS HB2 H 1 1.982 0.020 . 2 . . . . A 95 LYS HB2 . 34965 1 790 . 1 . 1 70 70 LYS HB3 H 1 1.808 0.020 . 2 . . . . A 95 LYS HB3 . 34965 1 791 . 1 . 1 70 70 LYS HG2 H 1 1.488 0.020 . 1 . . . . A 95 LYS HG2 . 34965 1 792 . 1 . 1 70 70 LYS HG3 H 1 1.488 0.020 . 1 . . . . A 95 LYS HG3 . 34965 1 793 . 1 . 1 70 70 LYS HD2 H 1 1.701 0.020 . 1 . . . . A 95 LYS HD2 . 34965 1 794 . 1 . 1 70 70 LYS HD3 H 1 1.701 0.020 . 1 . . . . A 95 LYS HD3 . 34965 1 795 . 1 . 1 70 70 LYS HE2 H 1 2.496 0.020 . 1 . . . . A 95 LYS HE2 . 34965 1 796 . 1 . 1 70 70 LYS HE3 H 1 2.496 0.020 . 1 . . . . A 95 LYS HE3 . 34965 1 797 . 1 . 1 70 70 LYS CA C 13 58.437 0.3 . 1 . . . . A 95 LYS CA . 34965 1 798 . 1 . 1 70 70 LYS CB C 13 32.409 0.3 . 1 . . . . A 95 LYS CB . 34965 1 799 . 1 . 1 70 70 LYS CG C 13 24.803 0.3 . 1 . . . . A 95 LYS CG . 34965 1 800 . 1 . 1 70 70 LYS CD C 13 28.975 0.3 . 1 . . . . A 95 LYS CD . 34965 1 801 . 1 . 1 70 70 LYS CE C 13 31.840 0.3 . 1 . . . . A 95 LYS CE . 34965 1 802 . 1 . 1 70 70 LYS N N 15 120.707 0.3 . 1 . . . . A 95 LYS N . 34965 1 803 . 1 . 1 71 71 ALA H H 1 7.982 0.020 . 1 . . . . A 96 ALA H . 34965 1 804 . 1 . 1 71 71 ALA HA H 1 4.183 0.020 . 1 . . . . A 96 ALA HA . 34965 1 805 . 1 . 1 71 71 ALA HB1 H 1 1.384 0.020 . 1 . . . . A 96 ALA HB1 . 34965 1 806 . 1 . 1 71 71 ALA HB2 H 1 1.384 0.020 . 1 . . . . A 96 ALA HB2 . 34965 1 807 . 1 . 1 71 71 ALA HB3 H 1 1.384 0.020 . 1 . . . . A 96 ALA HB3 . 34965 1 808 . 1 . 1 71 71 ALA CA C 13 53.033 0.3 . 1 . . . . A 96 ALA CA . 34965 1 809 . 1 . 1 71 71 ALA CB C 13 18.682 0.3 . 1 . . . . A 96 ALA CB . 34965 1 810 . 1 . 1 71 71 ALA N N 15 123.066 0.3 . 1 . . . . A 96 ALA N . 34965 1 811 . 1 . 1 72 72 ALA H H 1 7.888 0.020 . 1 . . . . A 97 ALA H . 34965 1 812 . 1 . 1 72 72 ALA HA H 1 4.192 0.020 . 1 . . . . A 97 ALA HA . 34965 1 813 . 1 . 1 72 72 ALA HB1 H 1 1.360 0.020 . 1 . . . . A 97 ALA HB1 . 34965 1 814 . 1 . 1 72 72 ALA HB2 H 1 1.360 0.020 . 1 . . . . A 97 ALA HB2 . 34965 1 815 . 1 . 1 72 72 ALA HB3 H 1 1.360 0.020 . 1 . . . . A 97 ALA HB3 . 34965 1 816 . 1 . 1 72 72 ALA CA C 13 52.660 0.3 . 1 . . . . A 97 ALA CA . 34965 1 817 . 1 . 1 72 72 ALA CB C 13 18.651 0.3 . 1 . . . . A 97 ALA CB . 34965 1 818 . 1 . 1 72 72 ALA N N 15 121.378 0.3 . 1 . . . . A 97 ALA N . 34965 1 819 . 1 . 1 73 73 LEU H H 1 7.796 0.020 . 1 . . . . A 98 LEU H . 34965 1 820 . 1 . 1 73 73 LEU HA H 1 4.251 0.020 . 1 . . . . A 98 LEU HA . 34965 1 821 . 1 . 1 73 73 LEU HB2 H 1 1.629 0.020 . 2 . . . . A 98 LEU HB2 . 34965 1 822 . 1 . 1 73 73 LEU HB3 H 1 1.611 0.020 . 2 . . . . A 98 LEU HB3 . 34965 1 823 . 1 . 1 73 73 LEU HG H 1 1.558 0.020 . 1 . . . . A 98 LEU HG . 34965 1 824 . 1 . 1 73 73 LEU HD11 H 1 0.871 0.020 . 2 . . . . A 98 LEU HD11 . 34965 1 825 . 1 . 1 73 73 LEU HD12 H 1 0.871 0.020 . 2 . . . . A 98 LEU HD12 . 34965 1 826 . 1 . 1 73 73 LEU HD13 H 1 0.871 0.020 . 2 . . . . A 98 LEU HD13 . 34965 1 827 . 1 . 1 73 73 LEU HD21 H 1 0.814 0.020 . 2 . . . . A 98 LEU HD21 . 34965 1 828 . 1 . 1 73 73 LEU HD22 H 1 0.814 0.020 . 2 . . . . A 98 LEU HD22 . 34965 1 829 . 1 . 1 73 73 LEU HD23 H 1 0.814 0.020 . 2 . . . . A 98 LEU HD23 . 34965 1 830 . 1 . 1 73 73 LEU CA C 13 55.113 0.3 . 1 . . . . A 98 LEU CA . 34965 1 831 . 1 . 1 73 73 LEU CB C 13 42.176 0.3 . 1 . . . . A 98 LEU CB . 34965 1 832 . 1 . 1 73 73 LEU CG C 13 28.961 0.3 . 1 . . . . A 98 LEU CG . 34965 1 833 . 1 . 1 73 73 LEU CD1 C 13 24.737 0.3 . 1 . . . . A 98 LEU CD1 . 34965 1 834 . 1 . 1 73 73 LEU CD2 C 13 23.283 0.3 . 1 . . . . A 98 LEU CD2 . 34965 1 835 . 1 . 1 73 73 LEU N N 15 119.545 0.3 . 1 . . . . A 98 LEU N . 34965 1 836 . 1 . 1 74 74 LEU H H 1 7.872 0.020 . 1 . . . . A 99 LEU H . 34965 1 837 . 1 . 1 74 74 LEU HA H 1 4.287 0.020 . 1 . . . . A 99 LEU HA . 34965 1 838 . 1 . 1 74 74 LEU HB2 H 1 1.577 0.020 . 2 . . . . A 99 LEU HB2 . 34965 1 839 . 1 . 1 74 74 LEU HB3 H 1 1.553 0.020 . 2 . . . . A 99 LEU HB3 . 34965 1 840 . 1 . 1 74 74 LEU HG H 1 1.574 0.020 . 1 . . . . A 99 LEU HG . 34965 1 841 . 1 . 1 74 74 LEU HD11 H 1 0.859 0.020 . 2 . . . . A 99 LEU HD11 . 34965 1 842 . 1 . 1 74 74 LEU HD12 H 1 0.859 0.020 . 2 . . . . A 99 LEU HD12 . 34965 1 843 . 1 . 1 74 74 LEU HD13 H 1 0.859 0.020 . 2 . . . . A 99 LEU HD13 . 34965 1 844 . 1 . 1 74 74 LEU HD21 H 1 0.804 0.020 . 2 . . . . A 99 LEU HD21 . 34965 1 845 . 1 . 1 74 74 LEU HD22 H 1 0.804 0.020 . 2 . . . . A 99 LEU HD22 . 34965 1 846 . 1 . 1 74 74 LEU HD23 H 1 0.804 0.020 . 2 . . . . A 99 LEU HD23 . 34965 1 847 . 1 . 1 74 74 LEU CA C 13 54.917 0.3 . 1 . . . . A 99 LEU CA . 34965 1 848 . 1 . 1 74 74 LEU CB C 13 42.023 0.3 . 1 . . . . A 99 LEU CB . 34965 1 849 . 1 . 1 74 74 LEU CG C 13 26.704 0.3 . 1 . . . . A 99 LEU CG . 34965 1 850 . 1 . 1 74 74 LEU CD1 C 13 24.895 0.3 . 1 . . . . A 99 LEU CD1 . 34965 1 851 . 1 . 1 74 74 LEU CD2 C 13 23.177 0.3 . 1 . . . . A 99 LEU CD2 . 34965 1 852 . 1 . 1 74 74 LEU N N 15 122.396 0.3 . 1 . . . . A 99 LEU N . 34965 1 853 . 1 . 1 75 75 LYS H H 1 7.664 0.020 . 1 . . . . A 100 LYS H . 34965 1 854 . 1 . 1 75 75 LYS HA H 1 4.069 0.020 . 1 . . . . A 100 LYS HA . 34965 1 855 . 1 . 1 75 75 LYS HB2 H 1 1.726 0.020 . 2 . . . . A 100 LYS HB2 . 34965 1 856 . 1 . 1 75 75 LYS HB3 H 1 1.634 0.020 . 2 . . . . A 100 LYS HB3 . 34965 1 857 . 1 . 1 75 75 LYS HG2 H 1 1.306 0.020 . 1 . . . . A 100 LYS HG2 . 34965 1 858 . 1 . 1 75 75 LYS HG3 H 1 1.306 0.020 . 1 . . . . A 100 LYS HG3 . 34965 1 859 . 1 . 1 75 75 LYS HD2 H 1 1.602 0.020 . 1 . . . . A 100 LYS HD2 . 34965 1 860 . 1 . 1 75 75 LYS HD3 H 1 1.602 0.020 . 1 . . . . A 100 LYS HD3 . 34965 1 861 . 1 . 1 75 75 LYS HE2 H 1 2.918 0.020 . 1 . . . . A 100 LYS HE2 . 34965 1 862 . 1 . 1 75 75 LYS HE3 H 1 2.918 0.020 . 1 . . . . A 100 LYS HE3 . 34965 1 863 . 1 . 1 75 75 LYS CA C 13 57.456 0.3 . 1 . . . . A 100 LYS CA . 34965 1 864 . 1 . 1 75 75 LYS CB C 13 33.667 0.3 . 1 . . . . A 100 LYS CB . 34965 1 865 . 1 . 1 75 75 LYS CG C 13 24.591 0.3 . 1 . . . . A 100 LYS CG . 34965 1 866 . 1 . 1 75 75 LYS CD C 13 29.053 0.3 . 1 . . . . A 100 LYS CD . 34965 1 867 . 1 . 1 75 75 LYS CE C 13 41.960 0.3 . 1 . . . . A 100 LYS CE . 34965 1 868 . 1 . 1 75 75 LYS N N 15 126.759 0.3 . 1 . . . . A 100 LYS N . 34965 1 stop_ save_