################################### # 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 25338 _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 _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 1 '3D HNCACB' 1 $CypB-GSFGPDLRAGD isotropic 25338 1 2 '3D CBCA(CO)NH' 1 $CypB-GSFGPDLRAGD isotropic 25338 1 3 '2D 1H-15N HSQC/HMQC' 1 $CypB-GSFGPDLRAGD isotropic 25338 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CcpNmr_Analysis . . 25338 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 30 30 LYS CA C 13 54.832 0.000 . 1 . . . . . 30 LYS CA . 25338 1 2 . 1 1 30 30 LYS CB C 13 33.202 0.000 . 1 . . . . . 30 LYS CB . 25338 1 3 . 1 1 31 31 GLY H H 1 8.589 0.002 . 1 . . . . . 31 GLY H . 25338 1 4 . 1 1 31 31 GLY CA C 13 44.288 0.000 . 1 . . . . . 31 GLY CA . 25338 1 5 . 1 1 31 31 GLY N N 15 111.573 0.09 . 1 . . . . . 31 GLY N . 25338 1 6 . 1 1 32 32 PRO CA C 13 61.942 0.046 . 1 . . . . . 32 PRO CA . 25338 1 7 . 1 1 32 32 PRO CB C 13 31.611 0.000 . 1 . . . . . 32 PRO CB . 25338 1 8 . 1 1 33 33 LYS H H 1 7.998 0.002 . 1 . . . . . 33 LYS H . 25338 1 9 . 1 1 33 33 LYS CA C 13 54.873 0.000 . 1 . . . . . 33 LYS CA . 25338 1 10 . 1 1 33 33 LYS CB C 13 33.933 0.000 . 1 . . . . . 33 LYS CB . 25338 1 11 . 1 1 33 33 LYS N N 15 115.687 0.036 . 1 . . . . . 33 LYS N . 25338 1 12 . 1 1 34 34 VAL H H 1 8.914 0.0 . 1 . . . . . 34 VAL H . 25338 1 13 . 1 1 34 34 VAL CA C 13 62.422 0.000 . 1 . . . . . 34 VAL CA . 25338 1 14 . 1 1 34 34 VAL CB C 13 31.209 0.000 . 1 . . . . . 34 VAL CB . 25338 1 15 . 1 1 34 34 VAL N N 15 126.692 0.029 . 1 . . . . . 34 VAL N . 25338 1 16 . 1 1 35 35 THR H H 1 8.706 0.007 . 1 . . . . . 35 THR H . 25338 1 17 . 1 1 35 35 THR CA C 13 61.407 0.086 . 1 . . . . . 35 THR CA . 25338 1 18 . 1 1 35 35 THR CB C 13 69.110 0.172 . 1 . . . . . 35 THR CB . 25338 1 19 . 1 1 35 35 THR N N 15 113.302 0.044 . 1 . . . . . 35 THR N . 25338 1 20 . 1 1 36 36 VAL H H 1 7.898 0.004 . 1 . . . . . 36 VAL H . 25338 1 21 . 1 1 36 36 VAL CA C 13 61.751 0.033 . 1 . . . . . 36 VAL CA . 25338 1 22 . 1 1 36 36 VAL CB C 13 32.402 0.000 . 1 . . . . . 36 VAL CB . 25338 1 23 . 1 1 36 36 VAL N N 15 121.205 0.125 . 1 . . . . . 36 VAL N . 25338 1 24 . 1 1 37 37 LYS H H 1 8.213 0.002 . 1 . . . . . 37 LYS H . 25338 1 25 . 1 1 37 37 LYS CA C 13 54.175 0.056 . 1 . . . . . 37 LYS CA . 25338 1 26 . 1 1 37 37 LYS CB C 13 37.424 0.000 . 1 . . . . . 37 LYS CB . 25338 1 27 . 1 1 37 37 LYS N N 15 123.752 0.013 . 1 . . . . . 37 LYS N . 25338 1 28 . 1 1 38 38 VAL H H 1 8.451 0.002 . 1 . . . . . 38 VAL H . 25338 1 29 . 1 1 38 38 VAL CA C 13 59.618 0.025 . 1 . . . . . 38 VAL CA . 25338 1 30 . 1 1 38 38 VAL CB C 13 38.976 0.051 . 1 . . . . . 38 VAL CB . 25338 1 31 . 1 1 38 38 VAL N N 15 119.903 0.189 . 1 . . . . . 38 VAL N . 25338 1 32 . 1 1 39 39 TYR H H 1 8.480 0.003 . 1 . . . . . 39 TYR H . 25338 1 33 . 1 1 39 39 TYR CA C 13 54.222 0.000 . 1 . . . . . 39 TYR CA . 25338 1 34 . 1 1 39 39 TYR CB C 13 42.407 0.000 . 1 . . . . . 39 TYR CB . 25338 1 35 . 1 1 39 39 TYR N N 15 122.113 0.105 . 1 . . . . . 39 TYR N . 25338 1 36 . 1 1 40 40 PHE H H 1 9.200 0.006 . 1 . . . . . 40 PHE H . 25338 1 37 . 1 1 40 40 PHE CA C 13 53.199 0.01 . 1 . . . . . 40 PHE CA . 25338 1 38 . 1 1 40 40 PHE CB C 13 42.769 0.000 . 1 . . . . . 40 PHE CB . 25338 1 39 . 1 1 40 40 PHE N N 15 117.212 0.064 . 1 . . . . . 40 PHE N . 25338 1 40 . 1 1 41 41 ASP H H 1 9.075 0.002 . 1 . . . . . 41 ASP H . 25338 1 41 . 1 1 41 41 ASP CA C 13 54.676 0.037 . 1 . . . . . 41 ASP CA . 25338 1 42 . 1 1 41 41 ASP CB C 13 42.054 0.135 . 1 . . . . . 41 ASP CB . 25338 1 43 . 1 1 41 41 ASP N N 15 123.672 0.107 . 1 . . . . . 41 ASP N . 25338 1 44 . 1 1 42 42 LEU H H 1 8.770 0.004 . 1 . . . . . 42 LEU H . 25338 1 45 . 1 1 42 42 LEU CA C 13 53.678 0.034 . 1 . . . . . 42 LEU CA . 25338 1 46 . 1 1 42 42 LEU CB C 13 44.845 0.000 . 1 . . . . . 42 LEU CB . 25338 1 47 . 1 1 42 42 LEU N N 15 121.611 0.148 . 1 . . . . . 42 LEU N . 25338 1 48 . 1 1 43 43 ARG H H 1 8.964 0.003 . 1 . . . . . 43 ARG H . 25338 1 49 . 1 1 43 43 ARG CA C 13 54.698 0.000 . 1 . . . . . 43 ARG CA . 25338 1 50 . 1 1 43 43 ARG CB C 13 35.027 0.001 . 1 . . . . . 43 ARG CB . 25338 1 51 . 1 1 43 43 ARG N N 15 123.719 0.165 . 1 . . . . . 43 ARG N . 25338 1 52 . 1 1 44 44 ILE H H 1 8.613 0.004 . 1 . . . . . 44 ILE H . 25338 1 53 . 1 1 44 44 ILE CA C 13 61.154 0.017 . 1 . . . . . 44 ILE CA . 25338 1 54 . 1 1 44 44 ILE CB C 13 38.866 0.000 . 1 . . . . . 44 ILE CB . 25338 1 55 . 1 1 44 44 ILE N N 15 121.769 0.018 . 1 . . . . . 44 ILE N . 25338 1 56 . 1 1 45 45 GLY H H 1 9.738 0.002 . 1 . . . . . 45 GLY H . 25338 1 57 . 1 1 45 45 GLY CA C 13 47.249 0.000 . 1 . . . . . 45 GLY CA . 25338 1 58 . 1 1 45 45 GLY N N 15 119.524 0.022 . 1 . . . . . 45 GLY N . 25338 1 59 . 1 1 46 46 ASP H H 1 8.918 0.003 . 1 . . . . . 46 ASP H . 25338 1 60 . 1 1 46 46 ASP CA C 13 53.913 0.07 . 1 . . . . . 46 ASP CA . 25338 1 61 . 1 1 46 46 ASP CB C 13 41.061 0.034 . 1 . . . . . 46 ASP CB . 25338 1 62 . 1 1 46 46 ASP N N 15 125.426 0.077 . 1 . . . . . 46 ASP N . 25338 1 63 . 1 1 47 47 GLU H H 1 7.869 0.003 . 1 . . . . . 47 GLU H . 25338 1 64 . 1 1 47 47 GLU CA C 13 55.082 0.000 . 1 . . . . . 47 GLU CA . 25338 1 65 . 1 1 47 47 GLU CB C 13 32.099 0.105 . 1 . . . . . 47 GLU CB . 25338 1 66 . 1 1 47 47 GLU N N 15 120.891 0.066 . 1 . . . . . 47 GLU N . 25338 1 67 . 1 1 48 48 ASP H H 1 8.896 0.001 . 1 . . . . . 48 ASP H . 25338 1 68 . 1 1 48 48 ASP CA C 13 55.356 0.000 . 1 . . . . . 48 ASP CA . 25338 1 69 . 1 1 48 48 ASP CB C 13 40.604 0.006 . 1 . . . . . 48 ASP CB . 25338 1 70 . 1 1 48 48 ASP N N 15 127.551 0.054 . 1 . . . . . 48 ASP N . 25338 1 71 . 1 1 49 49 VAL H H 1 8.292 0.0 . 1 . . . . . 49 VAL H . 25338 1 72 . 1 1 49 49 VAL CA C 13 61.529 0.027 . 1 . . . . . 49 VAL CA . 25338 1 73 . 1 1 49 49 VAL CB C 13 32.413 0.000 . 1 . . . . . 49 VAL CB . 25338 1 74 . 1 1 49 49 VAL N N 15 115.630 0.096 . 1 . . . . . 49 VAL N . 25338 1 75 . 1 1 50 50 GLY H H 1 7.714 0.003 . 1 . . . . . 50 GLY H . 25338 1 76 . 1 1 50 50 GLY CA C 13 44.529 0.016 . 1 . . . . . 50 GLY CA . 25338 1 77 . 1 1 50 50 GLY N N 15 108.796 0.168 . 1 . . . . . 50 GLY N . 25338 1 78 . 1 1 51 51 ARG H H 1 8.058 0.003 . 1 . . . . . 51 ARG H . 25338 1 79 . 1 1 51 51 ARG CA C 13 54.415 0.000 . 1 . . . . . 51 ARG CA . 25338 1 80 . 1 1 51 51 ARG CB C 13 34.379 0.000 . 1 . . . . . 51 ARG CB . 25338 1 81 . 1 1 51 51 ARG N N 15 119.421 0.11 . 1 . . . . . 51 ARG N . 25338 1 82 . 1 1 52 52 VAL H H 1 9.262 0.002 . 1 . . . . . 52 VAL H . 25338 1 83 . 1 1 52 52 VAL CA C 13 60.243 0.042 . 1 . . . . . 52 VAL CA . 25338 1 84 . 1 1 52 52 VAL CB C 13 34.792 0.069 . 1 . . . . . 52 VAL CB . 25338 1 85 . 1 1 52 52 VAL N N 15 125.934 0.051 . 1 . . . . . 52 VAL N . 25338 1 86 . 1 1 53 53 ILE H H 1 8.317 0.003 . 1 . . . . . 53 ILE H . 25338 1 87 . 1 1 53 53 ILE CA C 13 59.339 0.04 . 1 . . . . . 53 ILE CA . 25338 1 88 . 1 1 53 53 ILE CB C 13 39.639 0.000 . 1 . . . . . 53 ILE CB . 25338 1 89 . 1 1 53 53 ILE N N 15 123.835 0.119 . 1 . . . . . 53 ILE N . 25338 1 90 . 1 1 54 54 PHE H H 1 9.670 0.005 . 1 . . . . . 54 PHE H . 25338 1 91 . 1 1 54 54 PHE CA C 13 55.389 0.022 . 1 . . . . . 54 PHE CA . 25338 1 92 . 1 1 54 54 PHE CB C 13 41.838 0.000 . 1 . . . . . 54 PHE CB . 25338 1 93 . 1 1 54 54 PHE N N 15 125.760 0.136 . 1 . . . . . 54 PHE N . 25338 1 94 . 1 1 55 55 GLY H H 1 9.497 0.003 . 1 . . . . . 55 GLY H . 25338 1 95 . 1 1 55 55 GLY CA C 13 46.045 0.051 . 1 . . . . . 55 GLY CA . 25338 1 96 . 1 1 55 55 GLY N N 15 110.093 0.047 . 1 . . . . . 55 GLY N . 25338 1 97 . 1 1 56 56 LEU H H 1 8.056 0.004 . 1 . . . . . 56 LEU H . 25338 1 98 . 1 1 56 56 LEU CA C 13 52.884 0.013 . 1 . . . . . 56 LEU CA . 25338 1 99 . 1 1 56 56 LEU CB C 13 42.755 0.000 . 1 . . . . . 56 LEU CB . 25338 1 100 . 1 1 56 56 LEU N N 15 123.558 0.135 . 1 . . . . . 56 LEU N . 25338 1 101 . 1 1 57 57 PHE H H 1 7.317 0.006 . 1 . . . . . 57 PHE H . 25338 1 102 . 1 1 57 57 PHE CA C 13 55.018 0.005 . 1 . . . . . 57 PHE CA . 25338 1 103 . 1 1 57 57 PHE CB C 13 37.182 0.051 . 1 . . . . . 57 PHE CB . 25338 1 104 . 1 1 57 57 PHE N N 15 122.533 0.05 . 1 . . . . . 57 PHE N . 25338 1 105 . 1 1 58 58 GLY H H 1 8.126 0.009 . 1 . . . . . 58 GLY H . 25338 1 106 . 1 1 58 58 GLY CA C 13 46.926 0.006 . 1 . . . . . 58 GLY CA . 25338 1 107 . 1 1 58 58 GLY N N 15 110.199 0.045 . 1 . . . . . 58 GLY N . 25338 1 108 . 1 1 59 59 LYS H H 1 8.877 0.004 . 1 . . . . . 59 LYS H . 25338 1 109 . 1 1 59 59 LYS CA C 13 56.261 0.038 . 1 . . . . . 59 LYS CA . 25338 1 110 . 1 1 59 59 LYS CB C 13 31.665 0.018 . 1 . . . . . 59 LYS CB . 25338 1 111 . 1 1 59 59 LYS N N 15 117.123 0.02 . 1 . . . . . 59 LYS N . 25338 1 112 . 1 1 60 60 THR H H 1 7.448 0.01 . 1 . . . . . 60 THR H . 25338 1 113 . 1 1 60 60 THR CA C 13 65.922 0.016 . 1 . . . . . 60 THR CA . 25338 1 114 . 1 1 60 60 THR CB C 13 69.898 0.000 . 1 . . . . . 60 THR CB . 25338 1 115 . 1 1 60 60 THR N N 15 118.068 0.034 . 1 . . . . . 60 THR N . 25338 1 116 . 1 1 61 61 VAL H H 1 7.797 0.005 . 1 . . . . . 61 VAL H . 25338 1 117 . 1 1 61 61 VAL CA C 13 56.818 0.000 . 1 . . . . . 61 VAL CA . 25338 1 118 . 1 1 61 61 VAL CB C 13 31.475 0.000 . 1 . . . . . 61 VAL CB . 25338 1 119 . 1 1 61 61 VAL N N 15 115.135 0.13 . 1 . . . . . 61 VAL N . 25338 1 120 . 1 1 62 62 PRO CA C 13 66.131 0.000 . 1 . . . . . 62 PRO CA . 25338 1 121 . 1 1 63 63 LYS H H 1 10.536 0.005 . 1 . . . . . 63 LYS H . 25338 1 122 . 1 1 63 63 LYS CA C 13 59.558 0.000 . 1 . . . . . 63 LYS CA . 25338 1 123 . 1 1 63 63 LYS CB C 13 31.493 0.000 . 1 . . . . . 63 LYS CB . 25338 1 124 . 1 1 63 63 LYS N N 15 119.463 0.032 . 1 . . . . . 63 LYS N . 25338 1 125 . 1 1 64 64 THR H H 1 10.075 0.004 . 1 . . . . . 64 THR H . 25338 1 126 . 1 1 64 64 THR CA C 13 67.200 0.000 . 1 . . . . . 64 THR CA . 25338 1 127 . 1 1 64 64 THR CB C 13 68.672 0.000 . 1 . . . . . 64 THR CB . 25338 1 128 . 1 1 64 64 THR N N 15 123.510 0.078 . 1 . . . . . 64 THR N . 25338 1 129 . 1 1 65 65 VAL H H 1 8.870 0.003 . 1 . . . . . 65 VAL H . 25338 1 130 . 1 1 65 65 VAL CA C 13 68.426 0.023 . 1 . . . . . 65 VAL CA . 25338 1 131 . 1 1 65 65 VAL CB C 13 31.517 0.000 . 1 . . . . . 65 VAL CB . 25338 1 132 . 1 1 65 65 VAL N N 15 126.209 0.047 . 1 . . . . . 65 VAL N . 25338 1 133 . 1 1 66 66 ASP H H 1 8.985 0.006 . 1 . . . . . 66 ASP H . 25338 1 134 . 1 1 66 66 ASP CA C 13 57.345 0.000 . 1 . . . . . 66 ASP CA . 25338 1 135 . 1 1 66 66 ASP CB C 13 39.547 0.000 . 1 . . . . . 66 ASP CB . 25338 1 136 . 1 1 66 66 ASP N N 15 119.354 0.042 . 1 . . . . . 66 ASP N . 25338 1 137 . 1 1 67 67 ASN H H 1 7.129 0.002 . 1 . . . . . 67 ASN H . 25338 1 138 . 1 1 67 67 ASN CA C 13 56.728 0.08 . 1 . . . . . 67 ASN CA . 25338 1 139 . 1 1 67 67 ASN CB C 13 39.705 0.000 . 1 . . . . . 67 ASN CB . 25338 1 140 . 1 1 67 67 ASN N N 15 115.759 0.029 . 1 . . . . . 67 ASN N . 25338 1 141 . 1 1 68 68 PHE H H 1 7.293 0.004 . 1 . . . . . 68 PHE H . 25338 1 142 . 1 1 68 68 PHE CA C 13 62.107 0.031 . 1 . . . . . 68 PHE CA . 25338 1 143 . 1 1 68 68 PHE CB C 13 40.341 0.000 . 1 . . . . . 68 PHE CB . 25338 1 144 . 1 1 68 68 PHE N N 15 120.086 0.075 . 1 . . . . . 68 PHE N . 25338 1 145 . 1 1 69 69 VAL H H 1 8.965 0.006 . 1 . . . . . 69 VAL H . 25338 1 146 . 1 1 69 69 VAL CA C 13 66.859 0.056 . 1 . . . . . 69 VAL CA . 25338 1 147 . 1 1 69 69 VAL CB C 13 32.375 0.000 . 1 . . . . . 69 VAL CB . 25338 1 148 . 1 1 69 69 VAL N N 15 116.158 0.063 . 1 . . . . . 69 VAL N . 25338 1 149 . 1 1 70 70 ALA H H 1 7.796 0.006 . 1 . . . . . 70 ALA H . 25338 1 150 . 1 1 70 70 ALA CA C 13 54.161 0.006 . 1 . . . . . 70 ALA CA . 25338 1 151 . 1 1 70 70 ALA CB C 13 18.744 0.000 . 1 . . . . . 70 ALA CB . 25338 1 152 . 1 1 70 70 ALA N N 15 119.301 0.057 . 1 . . . . . 70 ALA N . 25338 1 153 . 1 1 71 71 LEU H H 1 8.159 0.001 . 1 . . . . . 71 LEU H . 25338 1 154 . 1 1 71 71 LEU CA C 13 56.757 0.013 . 1 . . . . . 71 LEU CA . 25338 1 155 . 1 1 71 71 LEU CB C 13 40.547 0.000 . 1 . . . . . 71 LEU CB . 25338 1 156 . 1 1 71 71 LEU N N 15 121.274 0.087 . 1 . . . . . 71 LEU N . 25338 1 157 . 1 1 72 72 ALA H H 1 8.273 0.004 . 1 . . . . . 72 ALA H . 25338 1 158 . 1 1 72 72 ALA CA C 13 53.994 0.013 . 1 . . . . . 72 ALA CA . 25338 1 159 . 1 1 72 72 ALA CB C 13 19.322 0.025 . 1 . . . . . 72 ALA CB . 25338 1 160 . 1 1 72 72 ALA N N 15 126.018 0.14 . 1 . . . . . 72 ALA N . 25338 1 161 . 1 1 73 73 THR H H 1 8.473 0.001 . 1 . . . . . 73 THR H . 25338 1 162 . 1 1 73 73 THR CA C 13 62.556 0.042 . 1 . . . . . 73 THR CA . 25338 1 163 . 1 1 73 73 THR CB C 13 69.614 0.000 . 1 . . . . . 73 THR CB . 25338 1 164 . 1 1 73 73 THR N N 15 106.157 0.21 . 1 . . . . . 73 THR N . 25338 1 165 . 1 1 74 74 GLY H H 1 7.623 0.001 . 1 . . . . . 74 GLY H . 25338 1 166 . 1 1 74 74 GLY CA C 13 45.681 0.013 . 1 . . . . . 74 GLY CA . 25338 1 167 . 1 1 74 74 GLY N N 15 108.971 0.044 . 1 . . . . . 74 GLY N . 25338 1 168 . 1 1 75 75 GLU H H 1 7.992 0.003 . 1 . . . . . 75 GLU H . 25338 1 169 . 1 1 75 75 GLU CA C 13 58.805 0.055 . 1 . . . . . 75 GLU CA . 25338 1 170 . 1 1 75 75 GLU CB C 13 30.401 0.000 . 1 . . . . . 75 GLU CB . 25338 1 171 . 1 1 75 75 GLU N N 15 119.864 0.133 . 1 . . . . . 75 GLU N . 25338 1 172 . 1 1 76 76 LYS H H 1 9.140 0.003 . 1 . . . . . 76 LYS H . 25338 1 173 . 1 1 76 76 LYS CA C 13 53.923 0.039 . 1 . . . . . 76 LYS CA . 25338 1 174 . 1 1 76 76 LYS CB C 13 30.438 0.026 . 1 . . . . . 76 LYS CB . 25338 1 175 . 1 1 76 76 LYS N N 15 117.603 0.025 . 1 . . . . . 76 LYS N . 25338 1 176 . 1 1 77 77 GLY H H 1 7.898 0.005 . 1 . . . . . 77 GLY H . 25338 1 177 . 1 1 77 77 GLY CA C 13 44.657 0.033 . 1 . . . . . 77 GLY CA . 25338 1 178 . 1 1 77 77 GLY N N 15 105.904 0.087 . 1 . . . . . 77 GLY N . 25338 1 179 . 1 1 78 78 PHE H H 1 6.372 0.002 . 1 . . . . . 78 PHE H . 25338 1 180 . 1 1 78 78 PHE CA C 13 53.702 0.005 . 1 . . . . . 78 PHE CA . 25338 1 181 . 1 1 78 78 PHE CB C 13 39.576 0.000 . 1 . . . . . 78 PHE CB . 25338 1 182 . 1 1 78 78 PHE N N 15 113.762 0.079 . 1 . . . . . 78 PHE N . 25338 1 183 . 1 1 79 79 GLY H H 1 7.769 0.003 . 1 . . . . . 79 GLY H . 25338 1 184 . 1 1 79 79 GLY CA C 13 45.537 0.01 . 1 . . . . . 79 GLY CA . 25338 1 185 . 1 1 79 79 GLY N N 15 104.867 0.055 . 1 . . . . . 79 GLY N . 25338 1 186 . 1 1 80 80 TYR H H 1 6.930 0.004 . 1 . . . . . 80 TYR H . 25338 1 187 . 1 1 80 80 TYR CA C 13 56.937 0.044 . 1 . . . . . 80 TYR CA . 25338 1 188 . 1 1 80 80 TYR CB C 13 38.757 0.000 . 1 . . . . . 80 TYR CB . 25338 1 189 . 1 1 80 80 TYR N N 15 113.544 0.066 . 1 . . . . . 80 TYR N . 25338 1 190 . 1 1 81 81 LYS H H 1 8.631 0.003 . 1 . . . . . 81 LYS H . 25338 1 191 . 1 1 81 81 LYS CA C 13 60.805 0.008 . 1 . . . . . 81 LYS CA . 25338 1 192 . 1 1 81 81 LYS CB C 13 31.277 0.000 . 1 . . . . . 81 LYS CB . 25338 1 193 . 1 1 81 81 LYS N N 15 125.634 0.185 . 1 . . . . . 81 LYS N . 25338 1 194 . 1 1 82 82 ASN H H 1 9.598 0.006 . 1 . . . . . 82 ASN H . 25338 1 195 . 1 1 82 82 ASN CA C 13 56.446 0.084 . 1 . . . . . 82 ASN CA . 25338 1 196 . 1 1 82 82 ASN CB C 13 37.426 0.1 . 1 . . . . . 82 ASN CB . 25338 1 197 . 1 1 82 82 ASN N N 15 120.448 0.127 . 1 . . . . . 82 ASN N . 25338 1 198 . 1 1 83 83 SER H H 1 8.427 0.004 . 1 . . . . . 83 SER H . 25338 1 199 . 1 1 83 83 SER CA C 13 58.495 0.089 . 1 . . . . . 83 SER CA . 25338 1 200 . 1 1 83 83 SER CB C 13 65.063 0.107 . 1 . . . . . 83 SER CB . 25338 1 201 . 1 1 83 83 SER N N 15 115.846 0.09 . 1 . . . . . 83 SER N . 25338 1 202 . 1 1 84 84 LYS H H 1 8.828 0.001 . 1 . . . . . 84 LYS H . 25338 1 203 . 1 1 84 84 LYS CA C 13 54.714 0.018 . 1 . . . . . 84 LYS CA . 25338 1 204 . 1 1 84 84 LYS CB C 13 35.869 0.000 . 1 . . . . . 84 LYS CB . 25338 1 205 . 1 1 84 84 LYS N N 15 115.019 0.065 . 1 . . . . . 84 LYS N . 25338 1 206 . 1 1 85 85 PHE H H 1 8.915 0.005 . 1 . . . . . 85 PHE H . 25338 1 207 . 1 1 85 85 PHE CA C 13 58.278 0.000 . 1 . . . . . 85 PHE CA . 25338 1 208 . 1 1 85 85 PHE CB C 13 38.399 0.000 . 1 . . . . . 85 PHE CB . 25338 1 209 . 1 1 85 85 PHE N N 15 122.484 0.12 . 1 . . . . . 85 PHE N . 25338 1 210 . 1 1 86 86 HIS H H 1 7.600 0.006 . 1 . . . . . 86 HIS H . 25338 1 211 . 1 1 86 86 HIS CA C 13 56.852 0.02 . 1 . . . . . 86 HIS CA . 25338 1 212 . 1 1 86 86 HIS CB C 13 31.961 0.000 . 1 . . . . . 86 HIS CB . 25338 1 213 . 1 1 86 86 HIS N N 15 120.265 0.116 . 1 . . . . . 86 HIS N . 25338 1 214 . 1 1 87 87 ARG H H 1 7.001 0.002 . 1 . . . . . 87 ARG H . 25338 1 215 . 1 1 87 87 ARG CA C 13 55.290 0.000 . 1 . . . . . 87 ARG CA . 25338 1 216 . 1 1 87 87 ARG CB C 13 33.377 0.000 . 1 . . . . . 87 ARG CB . 25338 1 217 . 1 1 87 87 ARG N N 15 123.703 0.124 . 1 . . . . . 87 ARG N . 25338 1 218 . 1 1 88 88 VAL CA C 13 62.123 0.000 . 1 . . . . . 88 VAL CA . 25338 1 219 . 1 1 89 89 ILE H H 1 8.616 0.0 . 1 . . . . . 89 ILE H . 25338 1 220 . 1 1 89 89 ILE CA C 13 60.919 0.000 . 1 . . . . . 89 ILE CA . 25338 1 221 . 1 1 89 89 ILE CB C 13 40.732 0.14 . 1 . . . . . 89 ILE CB . 25338 1 222 . 1 1 89 89 ILE N N 15 126.050 0.232 . 1 . . . . . 89 ILE N . 25338 1 223 . 1 1 90 90 LYS H H 1 8.955 0.003 . 1 . . . . . 90 LYS H . 25338 1 224 . 1 1 90 90 LYS CA C 13 57.722 0.000 . 1 . . . . . 90 LYS CA . 25338 1 225 . 1 1 90 90 LYS CB C 13 32.113 0.000 . 1 . . . . . 90 LYS CB . 25338 1 226 . 1 1 90 90 LYS N N 15 129.615 0.071 . 1 . . . . . 90 LYS N . 25338 1 227 . 1 1 91 91 ASP H H 1 9.723 0.005 . 1 . . . . . 91 ASP H . 25338 1 228 . 1 1 91 91 ASP CA C 13 56.272 0.005 . 1 . . . . . 91 ASP CA . 25338 1 229 . 1 1 91 91 ASP CB C 13 38.810 0.041 . 1 . . . . . 91 ASP CB . 25338 1 230 . 1 1 91 91 ASP N N 15 120.398 0.126 . 1 . . . . . 91 ASP N . 25338 1 231 . 1 1 92 92 PHE H H 1 7.807 0.002 . 1 . . . . . 92 PHE H . 25338 1 232 . 1 1 92 92 PHE CA C 13 57.154 0.000 . 1 . . . . . 92 PHE CA . 25338 1 233 . 1 1 92 92 PHE CB C 13 39.034 0.000 . 1 . . . . . 92 PHE CB . 25338 1 234 . 1 1 92 92 PHE N N 15 114.829 0.037 . 1 . . . . . 92 PHE N . 25338 1 235 . 1 1 93 93 MET H H 1 8.349 0.004 . 1 . . . . . 93 MET H . 25338 1 236 . 1 1 93 93 MET CA C 13 54.395 0.01 . 1 . . . . . 93 MET CA . 25338 1 237 . 1 1 93 93 MET CB C 13 34.962 0.000 . 1 . . . . . 93 MET CB . 25338 1 238 . 1 1 93 93 MET N N 15 112.350 0.154 . 1 . . . . . 93 MET N . 25338 1 239 . 1 1 94 94 ILE H H 1 8.259 0.002 . 1 . . . . . 94 ILE H . 25338 1 240 . 1 1 94 94 ILE CA C 13 60.166 0.000 . 1 . . . . . 94 ILE CA . 25338 1 241 . 1 1 94 94 ILE N N 15 109.116 0.081 . 1 . . . . . 94 ILE N . 25338 1 242 . 1 1 95 95 GLN H H 1 9.142 0.002 . 1 . . . . . 95 GLN H . 25338 1 243 . 1 1 95 95 GLN CA C 13 54.511 0.000 . 1 . . . . . 95 GLN CA . 25338 1 244 . 1 1 95 95 GLN N N 15 126.381 0.038 . 1 . . . . . 95 GLN N . 25338 1 245 . 1 1 96 96 GLY H H 1 7.349 0.004 . 1 . . . . . 96 GLY H . 25338 1 246 . 1 1 96 96 GLY CA C 13 44.999 0.000 . 1 . . . . . 96 GLY CA . 25338 1 247 . 1 1 96 96 GLY N N 15 110.470 0.016 . 1 . . . . . 96 GLY N . 25338 1 248 . 1 1 97 97 GLY H H 1 9.299 0.0 . 1 . . . . . 97 GLY H . 25338 1 249 . 1 1 97 97 GLY CA C 13 46.518 0.021 . 1 . . . . . 97 GLY CA . 25338 1 250 . 1 1 97 97 GLY N N 15 106.528 0.033 . 1 . . . . . 97 GLY N . 25338 1 251 . 1 1 98 98 ASP H H 1 10.215 0.004 . 1 . . . . . 98 ASP H . 25338 1 252 . 1 1 98 98 ASP CA C 13 51.869 0.014 . 1 . . . . . 98 ASP CA . 25338 1 253 . 1 1 98 98 ASP CB C 13 38.600 0.000 . 1 . . . . . 98 ASP CB . 25338 1 254 . 1 1 98 98 ASP N N 15 124.844 0.08 . 1 . . . . . 98 ASP N . 25338 1 255 . 1 1 99 99 PHE H H 1 6.556 0.004 . 1 . . . . . 99 PHE H . 25338 1 256 . 1 1 99 99 PHE CA C 13 55.769 0.116 . 1 . . . . . 99 PHE CA . 25338 1 257 . 1 1 99 99 PHE CB C 13 39.267 0.000 . 1 . . . . . 99 PHE CB . 25338 1 258 . 1 1 99 99 PHE N N 15 116.208 0.072 . 1 . . . . . 99 PHE N . 25338 1 259 . 1 1 100 100 THR H H 1 7.534 0.003 . 1 . . . . . 100 THR H . 25338 1 260 . 1 1 100 100 THR CA C 13 61.869 0.015 . 1 . . . . . 100 THR CA . 25338 1 261 . 1 1 100 100 THR CB C 13 68.153 0.006 . 1 . . . . . 100 THR CB . 25338 1 262 . 1 1 100 100 THR N N 15 111.718 0.046 . 1 . . . . . 100 THR N . 25338 1 263 . 1 1 101 101 ARG H H 1 8.611 0.004 . 1 . . . . . 101 ARG H . 25338 1 264 . 1 1 101 101 ARG CA C 13 55.936 0.073 . 1 . . . . . 101 ARG CA . 25338 1 265 . 1 1 101 101 ARG N N 15 122.356 0.145 . 1 . . . . . 101 ARG N . 25338 1 266 . 1 1 102 102 GLY H H 1 7.433 0.004 . 1 . . . . . 102 GLY H . 25338 1 267 . 1 1 102 102 GLY CA C 13 46.110 0.003 . 1 . . . . . 102 GLY CA . 25338 1 268 . 1 1 102 102 GLY N N 15 105.998 0.04 . 1 . . . . . 102 GLY N . 25338 1 269 . 1 1 103 103 ASP H H 1 7.441 0.001 . 1 . . . . . 103 ASP H . 25338 1 270 . 1 1 103 103 ASP CA C 13 52.418 0.003 . 1 . . . . . 103 ASP CA . 25338 1 271 . 1 1 103 103 ASP CB C 13 41.649 0.000 . 1 . . . . . 103 ASP CB . 25338 1 272 . 1 1 103 103 ASP N N 15 115.523 0.023 . 1 . . . . . 103 ASP N . 25338 1 273 . 1 1 104 104 GLY H H 1 9.385 0.005 . 1 . . . . . 104 GLY H . 25338 1 274 . 1 1 104 104 GLY CA C 13 45.351 0.137 . 1 . . . . . 104 GLY CA . 25338 1 275 . 1 1 104 104 GLY N N 15 110.890 0.073 . 1 . . . . . 104 GLY N . 25338 1 276 . 1 1 105 105 THR H H 1 8.429 0.005 . 1 . . . . . 105 THR H . 25338 1 277 . 1 1 105 105 THR CA C 13 61.895 0.000 . 1 . . . . . 105 THR CA . 25338 1 278 . 1 1 105 105 THR N N 15 113.735 0.029 . 1 . . . . . 105 THR N . 25338 1 279 . 1 1 106 106 GLY H H 1 8.607 0.004 . 1 . . . . . 106 GLY H . 25338 1 280 . 1 1 106 106 GLY CA C 13 44.971 0.008 . 1 . . . . . 106 GLY CA . 25338 1 281 . 1 1 106 106 GLY N N 15 113.687 0.04 . 1 . . . . . 106 GLY N . 25338 1 282 . 1 1 107 107 GLY H H 1 8.126 0.003 . 1 . . . . . 107 GLY H . 25338 1 283 . 1 1 107 107 GLY CA C 13 43.342 0.021 . 1 . . . . . 107 GLY CA . 25338 1 284 . 1 1 107 107 GLY N N 15 107.945 0.043 . 1 . . . . . 107 GLY N . 25338 1 285 . 1 1 108 108 LYS H H 1 7.015 0.005 . 1 . . . . . 108 LYS H . 25338 1 286 . 1 1 108 108 LYS CA C 13 56.005 0.034 . 1 . . . . . 108 LYS CA . 25338 1 287 . 1 1 108 108 LYS CB C 13 34.716 0.000 . 1 . . . . . 108 LYS CB . 25338 1 288 . 1 1 108 108 LYS N N 15 114.927 0.07 . 1 . . . . . 108 LYS N . 25338 1 289 . 1 1 109 109 SER H H 1 7.752 0.002 . 1 . . . . . 109 SER H . 25338 1 290 . 1 1 109 109 SER CA C 13 56.399 0.037 . 1 . . . . . 109 SER CA . 25338 1 291 . 1 1 109 109 SER CB C 13 70.376 0.000 . 1 . . . . . 109 SER CB . 25338 1 292 . 1 1 109 109 SER N N 15 114.435 0.049 . 1 . . . . . 109 SER N . 25338 1 293 . 1 1 110 110 ILE H H 1 8.684 0.005 . 1 . . . . . 110 ILE H . 25338 1 294 . 1 1 110 110 ILE CA C 13 63.526 0.000 . 1 . . . . . 110 ILE CA . 25338 1 295 . 1 1 110 110 ILE CB C 13 37.317 0.000 . 1 . . . . . 110 ILE CB . 25338 1 296 . 1 1 110 110 ILE N N 15 111.704 0.115 . 1 . . . . . 110 ILE N . 25338 1 297 . 1 1 111 111 TYR H H 1 8.081 0.001 . 1 . . . . . 111 TYR H . 25338 1 298 . 1 1 111 111 TYR CA C 13 55.840 0.082 . 1 . . . . . 111 TYR CA . 25338 1 299 . 1 1 111 111 TYR CB C 13 39.050 0.000 . 1 . . . . . 111 TYR CB . 25338 1 300 . 1 1 111 111 TYR N N 15 120.641 0.009 . 1 . . . . . 111 TYR N . 25338 1 301 . 1 1 112 112 GLY H H 1 7.023 0.002 . 1 . . . . . 112 GLY H . 25338 1 302 . 1 1 112 112 GLY CA C 13 43.555 0.04 . 1 . . . . . 112 GLY CA . 25338 1 303 . 1 1 112 112 GLY N N 15 105.916 0.196 . 1 . . . . . 112 GLY N . 25338 1 304 . 1 1 113 113 GLU H H 1 9.274 0.005 . 1 . . . . . 113 GLU H . 25338 1 305 . 1 1 113 113 GLU CA C 13 61.320 0.046 . 1 . . . . . 113 GLU CA . 25338 1 306 . 1 1 113 113 GLU CB C 13 30.041 0.154 . 1 . . . . . 113 GLU CB . 25338 1 307 . 1 1 113 113 GLU N N 15 124.752 0.118 . 1 . . . . . 113 GLU N . 25338 1 308 . 1 1 114 114 ARG H H 1 7.869 0.003 . 1 . . . . . 114 ARG H . 25338 1 309 . 1 1 114 114 ARG CA C 13 52.767 0.035 . 1 . . . . . 114 ARG CA . 25338 1 310 . 1 1 114 114 ARG CB C 13 34.710 0.000 . 1 . . . . . 114 ARG CB . 25338 1 311 . 1 1 114 114 ARG N N 15 111.537 0.043 . 1 . . . . . 114 ARG N . 25338 1 312 . 1 1 115 115 PHE H H 1 9.094 0.003 . 1 . . . . . 115 PHE H . 25338 1 313 . 1 1 115 115 PHE CA C 13 54.992 0.000 . 1 . . . . . 115 PHE CA . 25338 1 314 . 1 1 115 115 PHE CB C 13 39.435 0.000 . 1 . . . . . 115 PHE CB . 25338 1 315 . 1 1 115 115 PHE N N 15 117.973 0.04 . 1 . . . . . 115 PHE N . 25338 1 316 . 1 1 116 116 PRO CA C 13 62.166 0.000 . 1 . . . . . 116 PRO CA . 25338 1 317 . 1 1 116 116 PRO CB C 13 33.025 0.000 . 1 . . . . . 116 PRO CB . 25338 1 318 . 1 1 117 117 ASP H H 1 9.189 0.003 . 1 . . . . . 117 ASP H . 25338 1 319 . 1 1 117 117 ASP CA C 13 54.886 0.000 . 1 . . . . . 117 ASP CA . 25338 1 320 . 1 1 117 117 ASP CB C 13 40.777 0.000 . 1 . . . . . 117 ASP CB . 25338 1 321 . 1 1 117 117 ASP N N 15 120.429 0.05 . 1 . . . . . 117 ASP N . 25338 1 322 . 1 1 118 118 GLU H H 1 9.188 0.000 . 1 . . . . . 118 GLU H . 25338 1 323 . 1 1 118 118 GLU CA C 13 60.224 0.069 . 1 . . . . . 118 GLU CA . 25338 1 324 . 1 1 118 118 GLU N N 15 131.849 0.000 . 1 . . . . . 118 GLU N . 25338 1 325 . 1 1 119 119 ASN H H 1 6.952 0.003 . 1 . . . . . 119 ASN H . 25338 1 326 . 1 1 119 119 ASN CA C 13 52.739 0.007 . 1 . . . . . 119 ASN CA . 25338 1 327 . 1 1 119 119 ASN CB C 13 39.454 0.000 . 1 . . . . . 119 ASN CB . 25338 1 328 . 1 1 119 119 ASN N N 15 106.445 0.191 . 1 . . . . . 119 ASN N . 25338 1 329 . 1 1 120 120 PHE H H 1 8.352 0.002 . 1 . . . . . 120 PHE H . 25338 1 330 . 1 1 120 120 PHE CA C 13 55.414 0.000 . 1 . . . . . 120 PHE CA . 25338 1 331 . 1 1 120 120 PHE CB C 13 38.841 0.000 . 1 . . . . . 120 PHE CB . 25338 1 332 . 1 1 120 120 PHE N N 15 113.172 0.012 . 1 . . . . . 120 PHE N . 25338 1 333 . 1 1 121 121 LYS H H 1 8.455 0.002 . 1 . . . . . 121 LYS H . 25338 1 334 . 1 1 121 121 LYS CA C 13 59.712 0.000 . 1 . . . . . 121 LYS CA . 25338 1 335 . 1 1 121 121 LYS CB C 13 32.996 0.012 . 1 . . . . . 121 LYS CB . 25338 1 336 . 1 1 121 121 LYS N N 15 119.397 0.013 . 1 . . . . . 121 LYS N . 25338 1 337 . 1 1 122 122 LEU H H 1 7.657 0.005 . 1 . . . . . 122 LEU H . 25338 1 338 . 1 1 122 122 LEU CA C 13 53.010 0.011 . 1 . . . . . 122 LEU CA . 25338 1 339 . 1 1 122 122 LEU CB C 13 42.622 0.000 . 1 . . . . . 122 LEU CB . 25338 1 340 . 1 1 122 122 LEU N N 15 115.013 0.115 . 1 . . . . . 122 LEU N . 25338 1 341 . 1 1 123 123 LYS H H 1 5.710 0.007 . 1 . . . . . 123 LYS H . 25338 1 342 . 1 1 123 123 LYS CA C 13 53.978 0.023 . 1 . . . . . 123 LYS CA . 25338 1 343 . 1 1 123 123 LYS CB C 13 34.492 0.000 . 1 . . . . . 123 LYS CB . 25338 1 344 . 1 1 123 123 LYS N N 15 118.738 0.102 . 1 . . . . . 123 LYS N . 25338 1 345 . 1 1 124 124 HIS H H 1 9.446 0.006 . 1 . . . . . 124 HIS H . 25338 1 346 . 1 1 124 124 HIS CA C 13 54.693 0.000 . 1 . . . . . 124 HIS CA . 25338 1 347 . 1 1 124 124 HIS CB C 13 26.307 0.000 . 1 . . . . . 124 HIS CB . 25338 1 348 . 1 1 124 124 HIS N N 15 117.315 0.051 . 1 . . . . . 124 HIS N . 25338 1 349 . 1 1 125 125 TYR H H 1 5.804 0.005 . 1 . . . . . 125 TYR H . 25338 1 350 . 1 1 125 125 TYR CA C 13 62.196 0.000 . 1 . . . . . 125 TYR CA . 25338 1 351 . 1 1 125 125 TYR CB C 13 39.045 0.000 . 1 . . . . . 125 TYR CB . 25338 1 352 . 1 1 125 125 TYR N N 15 115.987 0.122 . 1 . . . . . 125 TYR N . 25338 1 353 . 1 1 126 126 GLY H H 1 7.072 0.001 . 1 . . . . . 126 GLY H . 25338 1 354 . 1 1 126 126 GLY CA C 13 44.854 0.000 . 1 . . . . . 126 GLY CA . 25338 1 355 . 1 1 126 126 GLY N N 15 101.266 0.009 . 1 . . . . . 126 GLY N . 25338 1 356 . 1 1 127 127 PRO CA C 13 63.442 0.000 . 1 . . . . . 127 PRO CA . 25338 1 357 . 1 1 128 128 GLY H H 1 9.277 0.002 . 1 . . . . . 128 GLY H . 25338 1 358 . 1 1 128 128 GLY CA C 13 46.159 0.000 . 1 . . . . . 128 GLY CA . 25338 1 359 . 1 1 128 128 GLY N N 15 111.924 0.191 . 1 . . . . . 128 GLY N . 25338 1 360 . 1 1 129 129 TRP H H 1 8.051 0.013 . 1 . . . . . 129 TRP H . 25338 1 361 . 1 1 129 129 TRP CA C 13 59.401 0.141 . 1 . . . . . 129 TRP CA . 25338 1 362 . 1 1 129 129 TRP CB C 13 28.636 0.000 . 1 . . . . . 129 TRP CB . 25338 1 363 . 1 1 129 129 TRP N N 15 123.103 0.023 . 1 . . . . . 129 TRP N . 25338 1 364 . 1 1 130 130 VAL H H 1 8.295 0.003 . 1 . . . . . 130 VAL H . 25338 1 365 . 1 1 130 130 VAL CA C 13 60.586 0.068 . 1 . . . . . 130 VAL CA . 25338 1 366 . 1 1 130 130 VAL CB C 13 32.704 0.000 . 1 . . . . . 130 VAL CB . 25338 1 367 . 1 1 130 130 VAL N N 15 122.228 0.037 . 1 . . . . . 130 VAL N . 25338 1 368 . 1 1 131 131 SER H H 1 8.237 0.006 . 1 . . . . . 131 SER H . 25338 1 369 . 1 1 131 131 SER CA C 13 54.268 0.000 . 1 . . . . . 131 SER CA . 25338 1 370 . 1 1 131 131 SER CB C 13 64.367 0.000 . 1 . . . . . 131 SER CB . 25338 1 371 . 1 1 131 131 SER N N 15 121.759 0.126 . 1 . . . . . 131 SER N . 25338 1 372 . 1 1 132 132 MET H H 1 8.791 0.004 . 1 . . . . . 132 MET H . 25338 1 373 . 1 1 132 132 MET CA C 13 53.970 0.000 . 1 . . . . . 132 MET CA . 25338 1 374 . 1 1 132 132 MET N N 15 123.300 0.052 . 1 . . . . . 132 MET N . 25338 1 375 . 1 1 133 133 ALA H H 1 8.260 0.000 . 1 . . . . . 133 ALA H . 25338 1 376 . 1 1 133 133 ALA N N 15 127.616 0.000 . 1 . . . . . 133 ALA N . 25338 1 377 . 1 1 136 136 GLY CA C 13 42.876 0.000 . 1 . . . . . 136 GLY CA . 25338 1 378 . 1 1 137 137 LYS H H 1 8.607 0.001 . 1 . . . . . 137 LYS H . 25338 1 379 . 1 1 137 137 LYS CA C 13 57.925 0.001 . 1 . . . . . 137 LYS CA . 25338 1 380 . 1 1 137 137 LYS CB C 13 32.733 0.057 . 1 . . . . . 137 LYS CB . 25338 1 381 . 1 1 137 137 LYS N N 15 122.960 0.059 . 1 . . . . . 137 LYS N . 25338 1 382 . 1 1 138 138 ASP H H 1 8.321 0.006 . 1 . . . . . 138 ASP H . 25338 1 383 . 1 1 138 138 ASP CA C 13 55.790 0.000 . 1 . . . . . 138 ASP CA . 25338 1 384 . 1 1 138 138 ASP CB C 13 39.009 0.000 . 1 . . . . . 138 ASP CB . 25338 1 385 . 1 1 138 138 ASP N N 15 121.368 0.086 . 1 . . . . . 138 ASP N . 25338 1 386 . 1 1 139 139 THR H H 1 10.214 0.001 . 1 . . . . . 139 THR H . 25338 1 387 . 1 1 139 139 THR CA C 13 60.566 0.000 . 1 . . . . . 139 THR CA . 25338 1 388 . 1 1 139 139 THR CB C 13 68.644 0.000 . 1 . . . . . 139 THR CB . 25338 1 389 . 1 1 139 139 THR N N 15 109.897 0.024 . 1 . . . . . 139 THR N . 25338 1 390 . 1 1 140 140 ASN H H 1 6.927 0.006 . 1 . . . . . 140 ASN H . 25338 1 391 . 1 1 140 140 ASN CA C 13 55.303 0.105 . 1 . . . . . 140 ASN CA . 25338 1 392 . 1 1 140 140 ASN CB C 13 40.194 0.000 . 1 . . . . . 140 ASN CB . 25338 1 393 . 1 1 140 140 ASN N N 15 118.185 0.022 . 1 . . . . . 140 ASN N . 25338 1 394 . 1 1 141 141 GLY H H 1 9.466 0.007 . 1 . . . . . 141 GLY H . 25338 1 395 . 1 1 141 141 GLY CA C 13 46.235 0.000 . 1 . . . . . 141 GLY CA . 25338 1 396 . 1 1 141 141 GLY N N 15 110.069 0.062 . 1 . . . . . 141 GLY N . 25338 1 397 . 1 1 144 144 PHE H H 1 8.295 0.002 . 1 . . . . . 144 PHE H . 25338 1 398 . 1 1 144 144 PHE CA C 13 55.540 0.000 . 1 . . . . . 144 PHE CA . 25338 1 399 . 1 1 144 144 PHE CB C 13 43.093 0.000 . 1 . . . . . 144 PHE CB . 25338 1 400 . 1 1 144 144 PHE N N 15 119.572 0.025 . 1 . . . . . 144 PHE N . 25338 1 401 . 1 1 145 145 PHE H H 1 9.939 0.004 . 1 . . . . . 145 PHE H . 25338 1 402 . 1 1 145 145 PHE CA C 13 55.361 0.000 . 1 . . . . . 145 PHE CA . 25338 1 403 . 1 1 145 145 PHE CB C 13 43.874 0.000 . 1 . . . . . 145 PHE CB . 25338 1 404 . 1 1 145 145 PHE N N 15 116.557 0.006 . 1 . . . . . 145 PHE N . 25338 1 405 . 1 1 146 146 ILE H H 1 9.255 0.008 . 1 . . . . . 146 ILE H . 25338 1 406 . 1 1 146 146 ILE CA C 13 58.798 0.028 . 1 . . . . . 146 ILE CA . 25338 1 407 . 1 1 146 146 ILE CB C 13 40.872 0.000 . 1 . . . . . 146 ILE CB . 25338 1 408 . 1 1 146 146 ILE N N 15 119.287 0.021 . 1 . . . . . 146 ILE N . 25338 1 409 . 1 1 147 147 THR H H 1 9.539 0.015 . 1 . . . . . 147 THR H . 25338 1 410 . 1 1 147 147 THR CA C 13 62.819 0.000 . 1 . . . . . 147 THR CA . 25338 1 411 . 1 1 147 147 THR CB C 13 69.795 0.000 . 1 . . . . . 147 THR CB . 25338 1 412 . 1 1 147 147 THR N N 15 117.237 0.034 . 1 . . . . . 147 THR N . 25338 1 413 . 1 1 148 148 THR H H 1 9.068 0.005 . 1 . . . . . 148 THR H . 25338 1 414 . 1 1 148 148 THR CA C 13 61.384 0.12 . 1 . . . . . 148 THR CA . 25338 1 415 . 1 1 148 148 THR CB C 13 67.190 0.000 . 1 . . . . . 148 THR CB . 25338 1 416 . 1 1 148 148 THR N N 15 112.175 0.053 . 1 . . . . . 148 THR N . 25338 1 417 . 1 1 149 149 VAL H H 1 7.837 0.004 . 1 . . . . . 149 VAL H . 25338 1 418 . 1 1 149 149 VAL CA C 13 59.516 0.000 . 1 . . . . . 149 VAL CA . 25338 1 419 . 1 1 149 149 VAL CB C 13 37.718 0.058 . 1 . . . . . 149 VAL CB . 25338 1 420 . 1 1 149 149 VAL N N 15 114.634 0.135 . 1 . . . . . 149 VAL N . 25338 1 421 . 1 1 150 150 LYS H H 1 8.686 0.004 . 1 . . . . . 150 LYS H . 25338 1 422 . 1 1 150 150 LYS CA C 13 58.072 0.023 . 1 . . . . . 150 LYS CA . 25338 1 423 . 1 1 150 150 LYS CB C 13 33.392 0.167 . 1 . . . . . 150 LYS CB . 25338 1 424 . 1 1 150 150 LYS N N 15 119.499 0.066 . 1 . . . . . 150 LYS N . 25338 1 425 . 1 1 151 151 THR H H 1 6.671 0.004 . 1 . . . . . 151 THR H . 25338 1 426 . 1 1 151 151 THR CA C 13 56.759 0.000 . 1 . . . . . 151 THR CA . 25338 1 427 . 1 1 151 151 THR CB C 13 67.843 0.066 . 1 . . . . . 151 THR CB . 25338 1 428 . 1 1 151 151 THR N N 15 117.801 0.122 . 1 . . . . . 151 THR N . 25338 1 429 . 1 1 152 152 ALA H H 1 8.917 0.006 . 1 . . . . . 152 ALA H . 25338 1 430 . 1 1 152 152 ALA CA C 13 54.768 0.009 . 1 . . . . . 152 ALA CA . 25338 1 431 . 1 1 152 152 ALA CB C 13 18.516 0.029 . 1 . . . . . 152 ALA CB . 25338 1 432 . 1 1 152 152 ALA N N 15 126.910 0.016 . 1 . . . . . 152 ALA N . 25338 1 433 . 1 1 153 153 TRP H H 1 7.276 0.001 . 1 . . . . . 153 TRP H . 25338 1 434 . 1 1 153 153 TRP CA C 13 60.219 0.128 . 1 . . . . . 153 TRP CA . 25338 1 435 . 1 1 153 153 TRP CB C 13 27.239 0.000 . 1 . . . . . 153 TRP CB . 25338 1 436 . 1 1 153 153 TRP N N 15 114.275 0.094 . 1 . . . . . 153 TRP N . 25338 1 437 . 1 1 154 154 LEU H H 1 6.779 0.01 . 1 . . . . . 154 LEU H . 25338 1 438 . 1 1 154 154 LEU CA C 13 53.889 0.009 . 1 . . . . . 154 LEU CA . 25338 1 439 . 1 1 154 154 LEU CB C 13 40.049 0.068 . 1 . . . . . 154 LEU CB . 25338 1 440 . 1 1 154 154 LEU N N 15 119.473 0.094 . 1 . . . . . 154 LEU N . 25338 1 441 . 1 1 155 155 ASP H H 1 7.507 0.003 . 1 . . . . . 155 ASP H . 25338 1 442 . 1 1 155 155 ASP CA C 13 55.461 0.000 . 1 . . . . . 155 ASP CA . 25338 1 443 . 1 1 155 155 ASP CB C 13 38.770 0.000 . 1 . . . . . 155 ASP CB . 25338 1 444 . 1 1 155 155 ASP N N 15 123.522 0.103 . 1 . . . . . 155 ASP N . 25338 1 445 . 1 1 156 156 GLY H H 1 9.680 0.002 . 1 . . . . . 156 GLY H . 25338 1 446 . 1 1 156 156 GLY CA C 13 44.689 0.014 . 1 . . . . . 156 GLY CA . 25338 1 447 . 1 1 156 156 GLY N N 15 112.331 0.013 . 1 . . . . . 156 GLY N . 25338 1 448 . 1 1 157 157 LYS H H 1 7.787 0.000 . 1 . . . . . 157 LYS H . 25338 1 449 . 1 1 157 157 LYS CA C 13 56.432 0.000 . 1 . . . . . 157 LYS CA . 25338 1 450 . 1 1 157 157 LYS CB C 13 35.304 0.003 . 1 . . . . . 157 LYS CB . 25338 1 451 . 1 1 157 157 LYS N N 15 115.418 0.000 . 1 . . . . . 157 LYS N . 25338 1 452 . 1 1 158 158 HIS H H 1 7.344 0.002 . 1 . . . . . 158 HIS H . 25338 1 453 . 1 1 158 158 HIS CA C 13 54.674 0.000 . 1 . . . . . 158 HIS CA . 25338 1 454 . 1 1 158 158 HIS CB C 13 31.829 0.000 . 1 . . . . . 158 HIS CB . 25338 1 455 . 1 1 158 158 HIS N N 15 119.272 0.135 . 1 . . . . . 158 HIS N . 25338 1 456 . 1 1 161 161 PHE H H 1 8.522 0.016 . 1 . . . . . 161 PHE H . 25338 1 457 . 1 1 161 161 PHE CA C 13 56.362 0.000 . 1 . . . . . 161 PHE CA . 25338 1 458 . 1 1 161 161 PHE CB C 13 42.326 0.153 . 1 . . . . . 161 PHE CB . 25338 1 459 . 1 1 161 161 PHE N N 15 118.572 0.022 . 1 . . . . . 161 PHE N . 25338 1 460 . 1 1 162 162 GLY H H 1 7.441 0.002 . 1 . . . . . 162 GLY H . 25338 1 461 . 1 1 162 162 GLY CA C 13 46.283 0.032 . 1 . . . . . 162 GLY CA . 25338 1 462 . 1 1 162 162 GLY N N 15 109.046 0.055 . 1 . . . . . 162 GLY N . 25338 1 463 . 1 1 163 163 LYS H H 1 8.377 0.005 . 1 . . . . . 163 LYS H . 25338 1 464 . 1 1 163 163 LYS CA C 13 54.564 0.000 . 1 . . . . . 163 LYS CA . 25338 1 465 . 1 1 163 163 LYS CB C 13 36.658 0.000 . 1 . . . . . 163 LYS CB . 25338 1 466 . 1 1 163 163 LYS N N 15 117.593 0.03 . 1 . . . . . 163 LYS N . 25338 1 467 . 1 1 164 164 VAL H H 1 9.300 0.003 . 1 . . . . . 164 VAL H . 25338 1 468 . 1 1 164 164 VAL CA C 13 64.503 0.000 . 1 . . . . . 164 VAL CA . 25338 1 469 . 1 1 164 164 VAL CB C 13 32.526 0.000 . 1 . . . . . 164 VAL CB . 25338 1 470 . 1 1 164 164 VAL N N 15 127.170 0.048 . 1 . . . . . 164 VAL N . 25338 1 471 . 1 1 165 165 LEU H H 1 9.192 0.01 . 1 . . . . . 165 LEU H . 25338 1 472 . 1 1 165 165 LEU CA C 13 55.070 0.000 . 1 . . . . . 165 LEU CA . 25338 1 473 . 1 1 165 165 LEU CB C 13 43.738 0.000 . 1 . . . . . 165 LEU CB . 25338 1 474 . 1 1 165 165 LEU N N 15 129.030 0.171 . 1 . . . . . 165 LEU N . 25338 1 475 . 1 1 166 166 GLU H H 1 7.635 0.004 . 1 . . . . . 166 GLU H . 25338 1 476 . 1 1 166 166 GLU CA C 13 55.026 0.021 . 1 . . . . . 166 GLU CA . 25338 1 477 . 1 1 166 166 GLU CB C 13 33.788 0.052 . 1 . . . . . 166 GLU CB . 25338 1 478 . 1 1 166 166 GLU N N 15 116.668 0.015 . 1 . . . . . 166 GLU N . 25338 1 479 . 1 1 167 167 GLY H H 1 9.062 0.002 . 1 . . . . . 167 GLY H . 25338 1 480 . 1 1 167 167 GLY CA C 13 46.014 0.045 . 1 . . . . . 167 GLY CA . 25338 1 481 . 1 1 167 167 GLY N N 15 109.586 0.024 . 1 . . . . . 167 GLY N . 25338 1 482 . 1 1 168 168 MET H H 1 9.132 0.004 . 1 . . . . . 168 MET H . 25338 1 483 . 1 1 168 168 MET CA C 13 56.850 0.025 . 1 . . . . . 168 MET CA . 25338 1 484 . 1 1 168 168 MET CB C 13 29.781 0.000 . 1 . . . . . 168 MET CB . 25338 1 485 . 1 1 168 168 MET N N 15 123.453 0.088 . 1 . . . . . 168 MET N . 25338 1 486 . 1 1 169 169 GLU H H 1 9.769 0.002 . 1 . . . . . 169 GLU H . 25338 1 487 . 1 1 169 169 GLU CA C 13 59.557 0.035 . 1 . . . . . 169 GLU CA . 25338 1 488 . 1 1 169 169 GLU CB C 13 28.112 0.000 . 1 . . . . . 169 GLU CB . 25338 1 489 . 1 1 169 169 GLU N N 15 117.808 0.043 . 1 . . . . . 169 GLU N . 25338 1 490 . 1 1 170 170 VAL H H 1 7.517 0.003 . 1 . . . . . 170 VAL H . 25338 1 491 . 1 1 170 170 VAL CA C 13 65.702 0.018 . 1 . . . . . 170 VAL CA . 25338 1 492 . 1 1 170 170 VAL CB C 13 31.004 0.000 . 1 . . . . . 170 VAL CB . 25338 1 493 . 1 1 170 170 VAL N N 15 123.273 0.22 . 1 . . . . . 170 VAL N . 25338 1 494 . 1 1 171 171 VAL H H 1 7.254 0.005 . 1 . . . . . 171 VAL H . 25338 1 495 . 1 1 171 171 VAL CA C 13 67.026 0.025 . 1 . . . . . 171 VAL CA . 25338 1 496 . 1 1 171 171 VAL CB C 13 30.974 0.000 . 1 . . . . . 171 VAL CB . 25338 1 497 . 1 1 171 171 VAL N N 15 120.397 0.048 . 1 . . . . . 171 VAL N . 25338 1 498 . 1 1 172 172 ARG H H 1 8.443 0.001 . 1 . . . . . 172 ARG H . 25338 1 499 . 1 1 172 172 ARG CA C 13 58.112 0.058 . 1 . . . . . 172 ARG CA . 25338 1 500 . 1 1 172 172 ARG CB C 13 29.625 0.000 . 1 . . . . . 172 ARG CB . 25338 1 501 . 1 1 172 172 ARG N N 15 116.105 0.039 . 1 . . . . . 172 ARG N . 25338 1 502 . 1 1 173 173 LYS H H 1 7.520 0.003 . 1 . . . . . 173 LYS H . 25338 1 503 . 1 1 173 173 LYS CA C 13 59.578 0.008 . 1 . . . . . 173 LYS CA . 25338 1 504 . 1 1 173 173 LYS CB C 13 32.145 0.076 . 1 . . . . . 173 LYS CB . 25338 1 505 . 1 1 173 173 LYS N N 15 121.759 0.062 . 1 . . . . . 173 LYS N . 25338 1 506 . 1 1 174 174 VAL H H 1 7.750 0.003 . 1 . . . . . 174 VAL H . 25338 1 507 . 1 1 174 174 VAL CA C 13 66.948 0.07 . 1 . . . . . 174 VAL CA . 25338 1 508 . 1 1 174 174 VAL CB C 13 31.265 0.000 . 1 . . . . . 174 VAL CB . 25338 1 509 . 1 1 174 174 VAL N N 15 119.466 0.054 . 1 . . . . . 174 VAL N . 25338 1 510 . 1 1 175 175 GLU H H 1 8.676 0.003 . 1 . . . . . 175 GLU H . 25338 1 511 . 1 1 175 175 GLU CA C 13 58.263 0.038 . 1 . . . . . 175 GLU CA . 25338 1 512 . 1 1 175 175 GLU CB C 13 29.967 0.000 . 1 . . . . . 175 GLU CB . 25338 1 513 . 1 1 175 175 GLU N N 15 118.236 0.056 . 1 . . . . . 175 GLU N . 25338 1 514 . 1 1 176 176 SER H H 1 7.229 0.001 . 1 . . . . . 176 SER H . 25338 1 515 . 1 1 176 176 SER CA C 13 58.688 0.09 . 1 . . . . . 176 SER CA . 25338 1 516 . 1 1 176 176 SER CB C 13 64.318 0.063 . 1 . . . . . 176 SER CB . 25338 1 517 . 1 1 176 176 SER N N 15 108.552 0.201 . 1 . . . . . 176 SER N . 25338 1 518 . 1 1 177 177 THR H H 1 7.812 0.004 . 1 . . . . . 177 THR H . 25338 1 519 . 1 1 177 177 THR CA C 13 63.476 0.07 . 1 . . . . . 177 THR CA . 25338 1 520 . 1 1 177 177 THR CB C 13 69.933 0.014 . 1 . . . . . 177 THR CB . 25338 1 521 . 1 1 177 177 THR N N 15 121.397 0.072 . 1 . . . . . 177 THR N . 25338 1 522 . 1 1 178 178 LYS H H 1 8.096 0.004 . 1 . . . . . 178 LYS H . 25338 1 523 . 1 1 178 178 LYS CA C 13 57.848 0.055 . 1 . . . . . 178 LYS CA . 25338 1 524 . 1 1 178 178 LYS CB C 13 32.861 0.038 . 1 . . . . . 178 LYS CB . 25338 1 525 . 1 1 178 178 LYS N N 15 125.693 0.084 . 1 . . . . . 178 LYS N . 25338 1 526 . 1 1 179 179 THR H H 1 8.550 0.004 . 1 . . . . . 179 THR H . 25338 1 527 . 1 1 179 179 THR CA C 13 59.287 0.172 . 1 . . . . . 179 THR CA . 25338 1 528 . 1 1 179 179 THR CB C 13 72.742 0.096 . 1 . . . . . 179 THR CB . 25338 1 529 . 1 1 179 179 THR N N 15 115.087 0.039 . 1 . . . . . 179 THR N . 25338 1 530 . 1 1 180 180 ASP H H 1 8.380 0.002 . 1 . . . . . 180 ASP H . 25338 1 531 . 1 1 180 180 ASP CA C 13 52.159 0.065 . 1 . . . . . 180 ASP CA . 25338 1 532 . 1 1 180 180 ASP CB C 13 41.465 0.032 . 1 . . . . . 180 ASP CB . 25338 1 533 . 1 1 180 180 ASP N N 15 119.592 0.12 . 1 . . . . . 180 ASP N . 25338 1 534 . 1 1 181 181 SER H H 1 8.368 0.002 . 1 . . . . . 181 SER H . 25338 1 535 . 1 1 181 181 SER CA C 13 60.813 0.147 . 1 . . . . . 181 SER CA . 25338 1 536 . 1 1 181 181 SER CB C 13 62.783 0.11 . 1 . . . . . 181 SER CB . 25338 1 537 . 1 1 181 181 SER N N 15 112.218 0.127 . 1 . . . . . 181 SER N . 25338 1 538 . 1 1 182 182 ARG H H 1 8.539 0.004 . 1 . . . . . 182 ARG H . 25338 1 539 . 1 1 182 182 ARG CA C 13 55.260 0.016 . 1 . . . . . 182 ARG CA . 25338 1 540 . 1 1 182 182 ARG CB C 13 29.295 0.000 . 1 . . . . . 182 ARG CB . 25338 1 541 . 1 1 182 182 ARG N N 15 123.032 0.131 . 1 . . . . . 182 ARG N . 25338 1 542 . 1 1 183 183 ASP H H 1 8.330 0.002 . 1 . . . . . 183 ASP H . 25338 1 543 . 1 1 183 183 ASP CA C 13 56.323 0.059 . 1 . . . . . 183 ASP CA . 25338 1 544 . 1 1 183 183 ASP CB C 13 39.164 0.000 . 1 . . . . . 183 ASP CB . 25338 1 545 . 1 1 183 183 ASP N N 15 113.647 0.111 . 1 . . . . . 183 ASP N . 25338 1 546 . 1 1 184 184 LYS H H 1 8.490 0.003 . 1 . . . . . 184 LYS H . 25338 1 547 . 1 1 184 184 LYS CA C 13 53.256 0.000 . 1 . . . . . 184 LYS CA . 25338 1 548 . 1 1 184 184 LYS CB C 13 34.638 0.000 . 1 . . . . . 184 LYS CB . 25338 1 549 . 1 1 184 184 LYS N N 15 122.645 0.162 . 1 . . . . . 184 LYS N . 25338 1 550 . 1 1 186 186 LEU H H 1 8.632 0.001 . 1 . . . . . 186 LEU H . 25338 1 551 . 1 1 186 186 LEU CA C 13 57.271 0.041 . 1 . . . . . 186 LEU CA . 25338 1 552 . 1 1 186 186 LEU CB C 13 41.554 0.000 . 1 . . . . . 186 LEU CB . 25338 1 553 . 1 1 186 186 LEU N N 15 125.517 0.018 . 1 . . . . . 186 LEU N . 25338 1 554 . 1 1 187 187 LYS H H 1 8.014 0.004 . 1 . . . . . 187 LYS H . 25338 1 555 . 1 1 187 187 LYS CA C 13 54.277 0.016 . 1 . . . . . 187 LYS CA . 25338 1 556 . 1 1 187 187 LYS CB C 13 34.870 0.043 . 1 . . . . . 187 LYS CB . 25338 1 557 . 1 1 187 187 LYS N N 15 119.841 0.019 . 1 . . . . . 187 LYS N . 25338 1 558 . 1 1 188 188 ASP H H 1 8.282 0.003 . 1 . . . . . 188 ASP H . 25338 1 559 . 1 1 188 188 ASP CA C 13 54.877 0.109 . 1 . . . . . 188 ASP CA . 25338 1 560 . 1 1 188 188 ASP CB C 13 40.817 0.037 . 1 . . . . . 188 ASP CB . 25338 1 561 . 1 1 188 188 ASP N N 15 117.444 0.049 . 1 . . . . . 188 ASP N . 25338 1 562 . 1 1 189 189 VAL H H 1 9.851 0.009 . 1 . . . . . 189 VAL H . 25338 1 563 . 1 1 189 189 VAL CA C 13 61.007 0.000 . 1 . . . . . 189 VAL CA . 25338 1 564 . 1 1 189 189 VAL CB C 13 32.223 0.000 . 1 . . . . . 189 VAL CB . 25338 1 565 . 1 1 189 189 VAL N N 15 127.935 0.071 . 1 . . . . . 189 VAL N . 25338 1 566 . 1 1 190 190 ILE H H 1 8.988 0.004 . 1 . . . . . 190 ILE H . 25338 1 567 . 1 1 190 190 ILE CA C 13 59.184 0.008 . 1 . . . . . 190 ILE CA . 25338 1 568 . 1 1 190 190 ILE CB C 13 43.022 0.024 . 1 . . . . . 190 ILE CB . 25338 1 569 . 1 1 190 190 ILE N N 15 124.780 0.007 . 1 . . . . . 190 ILE N . 25338 1 570 . 1 1 191 191 ILE H H 1 8.518 0.002 . 1 . . . . . 191 ILE H . 25338 1 571 . 1 1 191 191 ILE CA C 13 60.796 0.000 . 1 . . . . . 191 ILE CA . 25338 1 572 . 1 1 191 191 ILE CB C 13 36.225 0.000 . 1 . . . . . 191 ILE CB . 25338 1 573 . 1 1 191 191 ILE N N 15 124.686 0.041 . 1 . . . . . 191 ILE N . 25338 1 574 . 1 1 192 192 ALA H H 1 8.776 0.001 . 1 . . . . . 192 ALA H . 25338 1 575 . 1 1 192 192 ALA CA C 13 53.837 0.051 . 1 . . . . . 192 ALA CA . 25338 1 576 . 1 1 192 192 ALA CB C 13 18.981 0.061 . 1 . . . . . 192 ALA CB . 25338 1 577 . 1 1 192 192 ALA N N 15 134.222 0.163 . 1 . . . . . 192 ALA N . 25338 1 578 . 1 1 193 193 ASP H H 1 8.003 0.004 . 1 . . . . . 193 ASP H . 25338 1 579 . 1 1 193 193 ASP CA C 13 53.414 0.025 . 1 . . . . . 193 ASP CA . 25338 1 580 . 1 1 193 193 ASP CB C 13 44.016 0.015 . 1 . . . . . 193 ASP CB . 25338 1 581 . 1 1 193 193 ASP N N 15 110.842 0.159 . 1 . . . . . 193 ASP N . 25338 1 582 . 1 1 194 194 CYS H H 1 8.316 0.004 . 1 . . . . . 194 CYS H . 25338 1 583 . 1 1 194 194 CYS CA C 13 54.956 0.000 . 1 . . . . . 194 CYS CA . 25338 1 584 . 1 1 194 194 CYS CB C 13 31.685 0.000 . 1 . . . . . 194 CYS CB . 25338 1 585 . 1 1 194 194 CYS N N 15 115.775 0.025 . 1 . . . . . 194 CYS N . 25338 1 586 . 1 1 195 195 GLY H H 1 6.774 0.0 . 1 . . . . . 195 GLY H . 25338 1 587 . 1 1 195 195 GLY CA C 13 45.395 0.038 . 1 . . . . . 195 GLY CA . 25338 1 588 . 1 1 195 195 GLY N N 15 102.102 0.022 . 1 . . . . . 195 GLY N . 25338 1 589 . 1 1 196 196 LYS H H 1 8.818 0.001 . 1 . . . . . 196 LYS H . 25338 1 590 . 1 1 196 196 LYS CA C 13 54.455 0.025 . 1 . . . . . 196 LYS CA . 25338 1 591 . 1 1 196 196 LYS CB C 13 36.477 0.026 . 1 . . . . . 196 LYS CB . 25338 1 592 . 1 1 196 196 LYS N N 15 119.445 0.1 . 1 . . . . . 196 LYS N . 25338 1 593 . 1 1 197 197 ILE H H 1 8.757 0.005 . 1 . . . . . 197 ILE H . 25338 1 594 . 1 1 197 197 ILE CA C 13 61.010 0.000 . 1 . . . . . 197 ILE CA . 25338 1 595 . 1 1 197 197 ILE CB C 13 41.984 0.000 . 1 . . . . . 197 ILE CB . 25338 1 596 . 1 1 197 197 ILE N N 15 125.613 0.063 . 1 . . . . . 197 ILE N . 25338 1 597 . 1 1 198 198 GLU H H 1 8.732 0.001 . 1 . . . . . 198 GLU H . 25338 1 598 . 1 1 198 198 GLU CA C 13 56.919 0.013 . 1 . . . . . 198 GLU CA . 25338 1 599 . 1 1 198 198 GLU CB C 13 30.206 0.025 . 1 . . . . . 198 GLU CB . 25338 1 600 . 1 1 198 198 GLU N N 15 125.352 0.014 . 1 . . . . . 198 GLU N . 25338 1 601 . 1 1 199 199 VAL H H 1 9.165 0.003 . 1 . . . . . 199 VAL H . 25338 1 602 . 1 1 199 199 VAL CA C 13 60.775 0.003 . 1 . . . . . 199 VAL CA . 25338 1 603 . 1 1 199 199 VAL CB C 13 33.987 0.025 . 1 . . . . . 199 VAL CB . 25338 1 604 . 1 1 199 199 VAL N N 15 123.526 0.043 . 1 . . . . . 199 VAL N . 25338 1 605 . 1 1 200 200 GLU H H 1 8.960 0.002 . 1 . . . . . 200 GLU H . 25338 1 606 . 1 1 200 200 GLU CA C 13 59.240 0.022 . 1 . . . . . 200 GLU CA . 25338 1 607 . 1 1 200 200 GLU CB C 13 29.813 0.038 . 1 . . . . . 200 GLU CB . 25338 1 608 . 1 1 200 200 GLU N N 15 128.131 0.031 . 1 . . . . . 200 GLU N . 25338 1 609 . 1 1 201 201 LYS H H 1 7.782 0.001 . 1 . . . . . 201 LYS H . 25338 1 610 . 1 1 201 201 LYS CA C 13 52.586 0.000 . 1 . . . . . 201 LYS CA . 25338 1 611 . 1 1 201 201 LYS CB C 13 34.106 0.000 . 1 . . . . . 201 LYS CB . 25338 1 612 . 1 1 201 201 LYS N N 15 117.552 0.026 . 1 . . . . . 201 LYS N . 25338 1 613 . 1 1 202 202 PRO CA C 13 63.756 0.000 . 1 . . . . . 202 PRO CA . 25338 1 614 . 1 1 202 202 PRO CB C 13 32.927 0.000 . 1 . . . . . 202 PRO CB . 25338 1 615 . 1 1 203 203 PHE H H 1 7.224 0.002 . 1 . . . . . 203 PHE H . 25338 1 616 . 1 1 203 203 PHE CA C 13 53.867 0.048 . 1 . . . . . 203 PHE CA . 25338 1 617 . 1 1 203 203 PHE CB C 13 41.359 0.000 . 1 . . . . . 203 PHE CB . 25338 1 618 . 1 1 203 203 PHE N N 15 117.261 0.026 . 1 . . . . . 203 PHE N . 25338 1 619 . 1 1 204 204 ALA H H 1 8.919 0.002 . 1 . . . . . 204 ALA H . 25338 1 620 . 1 1 204 204 ALA CA C 13 51.265 0.01 . 1 . . . . . 204 ALA CA . 25338 1 621 . 1 1 204 204 ALA CB C 13 20.365 0.055 . 1 . . . . . 204 ALA CB . 25338 1 622 . 1 1 204 204 ALA N N 15 125.518 0.164 . 1 . . . . . 204 ALA N . 25338 1 623 . 1 1 205 205 ILE H H 1 7.833 0.002 . 1 . . . . . 205 ILE H . 25338 1 624 . 1 1 205 205 ILE CA C 13 58.861 0.139 . 1 . . . . . 205 ILE CA . 25338 1 625 . 1 1 205 205 ILE CB C 13 41.281 0.088 . 1 . . . . . 205 ILE CB . 25338 1 626 . 1 1 205 205 ILE N N 15 115.006 0.067 . 1 . . . . . 205 ILE N . 25338 1 627 . 1 1 206 206 ALA H H 1 8.207 0.003 . 1 . . . . . 206 ALA H . 25338 1 628 . 1 1 206 206 ALA CA C 13 51.726 0.016 . 1 . . . . . 206 ALA CA . 25338 1 629 . 1 1 206 206 ALA CB C 13 19.814 0.02 . 1 . . . . . 206 ALA CB . 25338 1 630 . 1 1 206 206 ALA N N 15 122.438 0.086 . 1 . . . . . 206 ALA N . 25338 1 631 . 1 1 207 207 LYS H H 1 8.439 0.002 . 1 . . . . . 207 LYS H . 25338 1 632 . 1 1 207 207 LYS CA C 13 55.626 0.055 . 1 . . . . . 207 LYS CA . 25338 1 633 . 1 1 207 207 LYS CB C 13 30.126 0.063 . 1 . . . . . 207 LYS CB . 25338 1 634 . 1 1 207 207 LYS N N 15 122.437 0.119 . 1 . . . . . 207 LYS N . 25338 1 635 . 1 1 208 208 GLU H H 1 7.910 0.003 . 1 . . . . . 208 GLU H . 25338 1 636 . 1 1 208 208 GLU CA C 13 56.793 0.000 . 1 . . . . . 208 GLU CA . 25338 1 637 . 1 1 208 208 GLU CB C 13 31.613 0.000 . 1 . . . . . 208 GLU CB . 25338 1 638 . 1 1 208 208 GLU N N 15 126.609 0.189 . 1 . . . . . 208 GLU N . 25338 1 stop_ save_