################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18569 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.10 _Assigned_chem_shift_list.Chem_shift_15N_err 0.05 _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 4 '2D DQF-COSY' . . . 18569 1 5 '3D CBCA(CO)NH' . . . 18569 1 6 '3D CBCANH' . . . 18569 1 7 '3D C(CO)NH' . . . 18569 1 8 '3D H(CCO)NH' . . . 18569 1 9 '3D HBHA(CO)NH' . . . 18569 1 10 '3D 1H-15N NOESY' . . . 18569 1 11 '3D 1H-15N TOCSY' . . . 18569 1 12 '3D HNHA' . . . 18569 1 13 '3D HNHB' . . . 18569 1 14 '3D 1H-13C NOESY' . . . 18569 1 15 '3D 1H-13C NOESY aliphatic' . . . 18569 1 16 '3D 1H-13C NOESY aromatic' . . . 18569 1 17 '3D HCCH-TOCSY' . . . 18569 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET H H 1 8.55 0.010 . 1 . . . . 1 MET H . 18569 1 2 . 1 1 1 1 MET HA H 1 4.548 0.010 . 1 . . . . 1 MET HA . 18569 1 3 . 1 1 1 1 MET HB2 H 1 1.994 0.010 . 2 . . . . 1 MET HB2 . 18569 1 4 . 1 1 1 1 MET HB3 H 1 2.118 0.010 . 2 . . . . 1 MET HB3 . 18569 1 5 . 1 1 1 1 MET CA C 13 55.489 0.100 . 1 . . . . 1 MET CA . 18569 1 6 . 1 1 1 1 MET CB C 13 32.848 0.100 . 1 . . . . 1 MET CB . 18569 1 7 . 1 1 1 1 MET N N 15 122.221 0.050 . 1 . . . . 1 MET N . 18569 1 8 . 1 1 2 2 SER H H 1 8.225 0.010 . 1 . . . . 2 SER H . 18569 1 9 . 1 1 2 2 SER HA H 1 4.420 0.010 . 1 . . . . 2 SER HA . 18569 1 10 . 1 1 2 2 SER HB2 H 1 3.805 0.010 . 2 . . . . 2 SER HB2 . 18569 1 11 . 1 1 2 2 SER HB3 H 1 3.857 0.010 . 2 . . . . 2 SER HB3 . 18569 1 12 . 1 1 2 2 SER CA C 13 58.593 0.100 . 1 . . . . 2 SER CA . 18569 1 13 . 1 1 2 2 SER CB C 13 64.057 0.100 . 1 . . . . 2 SER CB . 18569 1 14 . 1 1 2 2 SER N N 15 117.197 0.050 . 1 . . . . 2 SER N . 18569 1 15 . 1 1 3 3 GLU H H 1 8.002 0.010 . 1 . . . . 3 GLU H . 18569 1 16 . 1 1 3 3 GLU HA H 1 4.848 0.010 . 1 . . . . 3 GLU HA . 18569 1 17 . 1 1 3 3 GLU HB2 H 1 1.852 0.010 . 2 . . . . 3 GLU HB2 . 18569 1 18 . 1 1 3 3 GLU HB3 H 1 1.963 0.010 . 2 . . . . 3 GLU HB3 . 18569 1 19 . 1 1 3 3 GLU HG2 H 1 1.981 0.010 . 2 . . . . 3 GLU HG2 . 18569 1 20 . 1 1 3 3 GLU HG3 H 1 2.191 0.010 . 2 . . . . 3 GLU HG3 . 18569 1 21 . 1 1 3 3 GLU CA C 13 55.651 0.100 . 1 . . . . 3 GLU CA . 18569 1 22 . 1 1 3 3 GLU CB C 13 32.952 0.100 . 1 . . . . 3 GLU CB . 18569 1 23 . 1 1 3 3 GLU CG C 13 37.425 0.100 . 1 . . . . 3 GLU CG . 18569 1 24 . 1 1 3 3 GLU N N 15 119.833 0.050 . 1 . . . . 3 GLU N . 18569 1 25 . 1 1 4 4 THR H H 1 8.956 0.010 . 1 . . . . 4 THR H . 18569 1 26 . 1 1 4 4 THR HA H 1 4.634 0.010 . 1 . . . . 4 THR HA . 18569 1 27 . 1 1 4 4 THR HB H 1 4.098 0.010 . 1 . . . . 4 THR HB . 18569 1 28 . 1 1 4 4 THR HG21 H 1 1.196 0.010 . 1 . . . . 4 THR HG21 . 18569 1 29 . 1 1 4 4 THR HG22 H 1 1.196 0.010 . 1 . . . . 4 THR HG22 . 18569 1 30 . 1 1 4 4 THR HG23 H 1 1.196 0.010 . 1 . . . . 4 THR HG23 . 18569 1 31 . 1 1 4 4 THR CA C 13 60.559 0.100 . 1 . . . . 4 THR CA . 18569 1 32 . 1 1 4 4 THR CB C 13 71.367 0.100 . 1 . . . . 4 THR CB . 18569 1 33 . 1 1 4 4 THR CG2 C 13 21.434 0.100 . 1 . . . . 4 THR CG2 . 18569 1 34 . 1 1 4 4 THR N N 15 117.212 0.050 . 1 . . . . 4 THR N . 18569 1 35 . 1 1 5 5 VAL H H 1 8.634 0.010 . 1 . . . . 5 VAL H . 18569 1 36 . 1 1 5 5 VAL HA H 1 4.105 0.010 . 1 . . . . 5 VAL HA . 18569 1 37 . 1 1 5 5 VAL HB H 1 1.850 0.010 . 1 . . . . 5 VAL HB . 18569 1 38 . 1 1 5 5 VAL HG11 H 1 0.674 0.010 . 2 . . . . 5 VAL HG11 . 18569 1 39 . 1 1 5 5 VAL HG12 H 1 0.674 0.010 . 2 . . . . 5 VAL HG12 . 18569 1 40 . 1 1 5 5 VAL HG13 H 1 0.674 0.010 . 2 . . . . 5 VAL HG13 . 18569 1 41 . 1 1 5 5 VAL HG21 H 1 0.533 0.010 . 2 . . . . 5 VAL HG21 . 18569 1 42 . 1 1 5 5 VAL HG22 H 1 0.533 0.010 . 2 . . . . 5 VAL HG22 . 18569 1 43 . 1 1 5 5 VAL HG23 H 1 0.533 0.010 . 2 . . . . 5 VAL HG23 . 18569 1 44 . 1 1 5 5 VAL CA C 13 62.676 0.100 . 1 . . . . 5 VAL CA . 18569 1 45 . 1 1 5 5 VAL CB C 13 32.202 0.100 . 1 . . . . 5 VAL CB . 18569 1 46 . 1 1 5 5 VAL CG1 C 13 21.822 0.100 . 2 . . . . 5 VAL CG1 . 18569 1 47 . 1 1 5 5 VAL CG2 C 13 21.976 0.100 . 2 . . . . 5 VAL CG2 . 18569 1 48 . 1 1 5 5 VAL N N 15 125.977 0.050 . 1 . . . . 5 VAL N . 18569 1 49 . 1 1 6 6 ILE H H 1 8.931 0.010 . 1 . . . . 6 ILE H . 18569 1 50 . 1 1 6 6 ILE HA H 1 4.338 0.010 . 1 . . . . 6 ILE HA . 18569 1 51 . 1 1 6 6 ILE HB H 1 1.961 0.010 . 1 . . . . 6 ILE HB . 18569 1 52 . 1 1 6 6 ILE HG12 H 1 1.193 0.010 . 2 . . . . 6 ILE HG12 . 18569 1 53 . 1 1 6 6 ILE HG13 H 1 1.226 0.010 . 2 . . . . 6 ILE HG13 . 18569 1 54 . 1 1 6 6 ILE HG21 H 1 0.884 0.010 . 1 . . . . 6 ILE HG21 . 18569 1 55 . 1 1 6 6 ILE HG22 H 1 0.884 0.010 . 1 . . . . 6 ILE HG22 . 18569 1 56 . 1 1 6 6 ILE HG23 H 1 0.884 0.010 . 1 . . . . 6 ILE HG23 . 18569 1 57 . 1 1 6 6 ILE HD11 H 1 0.789 0.010 . 1 . . . . 6 ILE HD11 . 18569 1 58 . 1 1 6 6 ILE HD12 H 1 0.789 0.010 . 1 . . . . 6 ILE HD12 . 18569 1 59 . 1 1 6 6 ILE HD13 H 1 0.789 0.010 . 1 . . . . 6 ILE HD13 . 18569 1 60 . 1 1 6 6 ILE CA C 13 61.036 0.100 . 1 . . . . 6 ILE CA . 18569 1 61 . 1 1 6 6 ILE CB C 13 38.211 0.100 . 1 . . . . 6 ILE CB . 18569 1 62 . 1 1 6 6 ILE CG1 C 13 27.151 0.100 . 1 . . . . 6 ILE CG1 . 18569 1 63 . 1 1 6 6 ILE CG2 C 13 17.876 0.100 . 1 . . . . 6 ILE CG2 . 18569 1 64 . 1 1 6 6 ILE CD1 C 13 12.321 0.100 . 1 . . . . 6 ILE CD1 . 18569 1 65 . 1 1 6 6 ILE N N 15 124.282 0.050 . 1 . . . . 6 ILE N . 18569 1 66 . 1 1 7 7 CYS H H 1 7.250 0.010 . 1 . . . . 7 CYS H . 18569 1 67 . 1 1 7 7 CYS HA H 1 4.660 0.010 . 1 . . . . 7 CYS HA . 18569 1 68 . 1 1 7 7 CYS HB2 H 1 2.694 0.010 . 2 . . . . 7 CYS HB2 . 18569 1 69 . 1 1 7 7 CYS HB3 H 1 2.871 0.010 . 2 . . . . 7 CYS HB3 . 18569 1 70 . 1 1 7 7 CYS CA C 13 57.200 0.100 . 1 . . . . 7 CYS CA . 18569 1 71 . 1 1 7 7 CYS CB C 13 29.518 0.100 . 1 . . . . 7 CYS CB . 18569 1 72 . 1 1 7 7 CYS N N 15 114.879 0.050 . 1 . . . . 7 CYS N . 18569 1 73 . 1 1 8 8 SER H H 1 8.558 0.010 . 1 . . . . 8 SER H . 18569 1 74 . 1 1 8 8 SER HA H 1 5.308 0.010 . 1 . . . . 8 SER HA . 18569 1 75 . 1 1 8 8 SER HB2 H 1 3.599 0.010 . 2 . . . . 8 SER HB2 . 18569 1 76 . 1 1 8 8 SER HB3 H 1 3.738 0.010 . 2 . . . . 8 SER HB3 . 18569 1 77 . 1 1 8 8 SER CA C 13 57.456 0.100 . 1 . . . . 8 SER CA . 18569 1 78 . 1 1 8 8 SER CB C 13 64.863 0.100 . 1 . . . . 8 SER CB . 18569 1 79 . 1 1 8 8 SER N N 15 117.870 0.050 . 1 . . . . 8 SER N . 18569 1 80 . 1 1 9 9 SER H H 1 9.230 0.010 . 1 . . . . 9 SER H . 18569 1 81 . 1 1 9 9 SER HA H 1 5.059 0.010 . 1 . . . . 9 SER HA . 18569 1 82 . 1 1 9 9 SER HB2 H 1 3.820 0.010 . 2 . . . . 9 SER HB2 . 18569 1 83 . 1 1 9 9 SER HB3 H 1 3.981 0.010 . 2 . . . . 9 SER HB3 . 18569 1 84 . 1 1 9 9 SER CA C 13 57.852 0.100 . 1 . . . . 9 SER CA . 18569 1 85 . 1 1 9 9 SER CB C 13 67.332 0.100 . 1 . . . . 9 SER CB . 18569 1 86 . 1 1 9 9 SER N N 15 120.237 0.050 . 1 . . . . 9 SER N . 18569 1 87 . 1 1 10 10 ARG H H 1 8.845 0.010 . 1 . . . . 10 ARG H . 18569 1 88 . 1 1 10 10 ARG HA H 1 5.455 0.010 . 1 . . . . 10 ARG HA . 18569 1 89 . 1 1 10 10 ARG HB2 H 1 1.641 0.010 . 2 . . . . 10 ARG HB2 . 18569 1 90 . 1 1 10 10 ARG HB3 H 1 1.747 0.010 . 2 . . . . 10 ARG HB3 . 18569 1 91 . 1 1 10 10 ARG HG2 H 1 1.294 0.010 . 2 . . . . 10 ARG HG2 . 18569 1 92 . 1 1 10 10 ARG HG3 H 1 1.573 0.010 . 2 . . . . 10 ARG HG3 . 18569 1 93 . 1 1 10 10 ARG HD2 H 1 2.907 0.010 . 2 . . . . 10 ARG HD2 . 18569 1 94 . 1 1 10 10 ARG HD3 H 1 2.997 0.010 . 2 . . . . 10 ARG HD3 . 18569 1 95 . 1 1 10 10 ARG HE H 1 7.121 0.010 . 2 . . . . 10 ARG HE . 18569 1 96 . 1 1 10 10 ARG CA C 13 54.855 0.100 . 1 . . . . 10 ARG CA . 18569 1 97 . 1 1 10 10 ARG CB C 13 32.147 0.100 . 1 . . . . 10 ARG CB . 18569 1 98 . 1 1 10 10 ARG CG C 13 27.783 0.100 . 1 . . . . 10 ARG CG . 18569 1 99 . 1 1 10 10 ARG CD C 13 43.320 0.100 . 1 . . . . 10 ARG CD . 18569 1 100 . 1 1 10 10 ARG N N 15 124.809 0.050 . 1 . . . . 10 ARG N . 18569 1 101 . 1 1 10 10 ARG NE N 15 83.45 0.050 . 1 . . . . 10 ARG NE . 18569 1 102 . 1 1 11 11 ALA H H 1 9.181 0.010 . 1 . . . . 11 ALA H . 18569 1 103 . 1 1 11 11 ALA HA H 1 4.825 0.010 . 1 . . . . 11 ALA HA . 18569 1 104 . 1 1 11 11 ALA HB1 H 1 0.502 0.010 . 1 . . . . 11 ALA HB1 . 18569 1 105 . 1 1 11 11 ALA HB2 H 1 0.502 0.010 . 1 . . . . 11 ALA HB2 . 18569 1 106 . 1 1 11 11 ALA HB3 H 1 0.502 0.010 . 1 . . . . 11 ALA HB3 . 18569 1 107 . 1 1 11 11 ALA CA C 13 51.659 0.100 . 1 . . . . 11 ALA CA . 18569 1 108 . 1 1 11 11 ALA CB C 13 23.157 0.100 . 1 . . . . 11 ALA CB . 18569 1 109 . 1 1 11 11 ALA N N 15 125.916 0.050 . 1 . . . . 11 ALA N . 18569 1 110 . 1 1 12 12 THR H H 1 8.952 0.010 . 1 . . . . 12 THR H . 18569 1 111 . 1 1 12 12 THR HA H 1 4.515 0.010 . 1 . . . . 12 THR HA . 18569 1 112 . 1 1 12 12 THR HB H 1 3.782 0.010 . 1 . . . . 12 THR HB . 18569 1 113 . 1 1 12 12 THR HG21 H 1 0.970 0.010 . 1 . . . . 12 THR HG21 . 18569 1 114 . 1 1 12 12 THR HG22 H 1 0.970 0.010 . 1 . . . . 12 THR HG22 . 18569 1 115 . 1 1 12 12 THR HG23 H 1 0.970 0.010 . 1 . . . . 12 THR HG23 . 18569 1 116 . 1 1 12 12 THR CA C 13 62.584 0.100 . 1 . . . . 12 THR CA . 18569 1 117 . 1 1 12 12 THR CB C 13 68.781 0.100 . 1 . . . . 12 THR CB . 18569 1 118 . 1 1 12 12 THR CG2 C 13 21.225 0.100 . 1 . . . . 12 THR CG2 . 18569 1 119 . 1 1 12 12 THR N N 15 119.341 0.050 . 1 . . . . 12 THR N . 18569 1 120 . 1 1 13 13 VAL H H 1 8.283 0.010 . 1 . . . . 13 VAL H . 18569 1 121 . 1 1 13 13 VAL HA H 1 4.236 0.010 . 1 . . . . 13 VAL HA . 18569 1 122 . 1 1 13 13 VAL HB H 1 1.878 0.010 . 1 . . . . 13 VAL HB . 18569 1 123 . 1 1 13 13 VAL HG11 H 1 0.973 0.010 . 2 . . . . 13 VAL HG11 . 18569 1 124 . 1 1 13 13 VAL HG12 H 1 0.973 0.010 . 2 . . . . 13 VAL HG12 . 18569 1 125 . 1 1 13 13 VAL HG13 H 1 0.973 0.010 . 2 . . . . 13 VAL HG13 . 18569 1 126 . 1 1 13 13 VAL HG21 H 1 0.670 0.010 . 2 . . . . 13 VAL HG21 . 18569 1 127 . 1 1 13 13 VAL HG22 H 1 0.670 0.010 . 2 . . . . 13 VAL HG22 . 18569 1 128 . 1 1 13 13 VAL HG23 H 1 0.670 0.010 . 2 . . . . 13 VAL HG23 . 18569 1 129 . 1 1 13 13 VAL CA C 13 62.831 0.100 . 1 . . . . 13 VAL CA . 18569 1 130 . 1 1 13 13 VAL CB C 13 31.259 0.100 . 1 . . . . 13 VAL CB . 18569 1 131 . 1 1 13 13 VAL CG1 C 13 21.720 0.100 . 2 . . . . 13 VAL CG1 . 18569 1 132 . 1 1 13 13 VAL CG2 C 13 21.128 0.100 . 2 . . . . 13 VAL CG2 . 18569 1 133 . 1 1 13 13 VAL N N 15 128.236 0.050 . 1 . . . . 13 VAL N . 18569 1 134 . 1 1 14 14 MET H H 1 9.939 0.010 . 1 . . . . 14 MET H . 18569 1 135 . 1 1 14 14 MET HA H 1 5.485 0.010 . 1 . . . . 14 MET HA . 18569 1 136 . 1 1 14 14 MET HB2 H 1 1.814 0.010 . 2 . . . . 14 MET HB2 . 18569 1 137 . 1 1 14 14 MET HB3 H 1 2.355 0.010 . 2 . . . . 14 MET HB3 . 18569 1 138 . 1 1 14 14 MET HG2 H 1 2.313 0.010 . 2 . . . . 14 MET HG2 . 18569 1 139 . 1 1 14 14 MET HG3 H 1 2.368 0.010 . 2 . . . . 14 MET HG3 . 18569 1 140 . 1 1 14 14 MET HE1 H 1 1.830 0.010 . 1 . . . . 14 MET HE1 . 18569 1 141 . 1 1 14 14 MET HE2 H 1 1.830 0.010 . 1 . . . . 14 MET HE2 . 18569 1 142 . 1 1 14 14 MET HE3 H 1 1.830 0.010 . 1 . . . . 14 MET HE3 . 18569 1 143 . 1 1 14 14 MET C C 13 173.599 0.100 . 1 . . . . 14 MET C . 18569 1 144 . 1 1 14 14 MET CA C 13 53.491 0.100 . 1 . . . . 14 MET CA . 18569 1 145 . 1 1 14 14 MET CB C 13 36.519 0.100 . 1 . . . . 14 MET CB . 18569 1 146 . 1 1 14 14 MET CG C 13 32.126 0.100 . 1 . . . . 14 MET CG . 18569 1 147 . 1 1 14 14 MET CE C 13 17.201 0.100 . 1 . . . . 14 MET CE . 18569 1 148 . 1 1 14 14 MET N N 15 130.060 0.050 . 1 . . . . 14 MET N . 18569 1 149 . 1 1 15 15 LEU H H 1 9.649 0.010 . 1 . . . . 15 LEU H . 18569 1 150 . 1 1 15 15 LEU HA H 1 5.200 0.010 . 1 . . . . 15 LEU HA . 18569 1 151 . 1 1 15 15 LEU HB2 H 1 1.362 0.010 . 2 . . . . 15 LEU HB2 . 18569 1 152 . 1 1 15 15 LEU HB3 H 1 1.432 0.010 . 2 . . . . 15 LEU HB3 . 18569 1 153 . 1 1 15 15 LEU HD11 H 1 0.444 0.010 . 2 . . . . 15 LEU HD11 . 18569 1 154 . 1 1 15 15 LEU HD12 H 1 0.444 0.010 . 2 . . . . 15 LEU HD12 . 18569 1 155 . 1 1 15 15 LEU HD13 H 1 0.444 0.010 . 2 . . . . 15 LEU HD13 . 18569 1 156 . 1 1 15 15 LEU HD21 H 1 0.372 0.010 . 2 . . . . 15 LEU HD21 . 18569 1 157 . 1 1 15 15 LEU HD22 H 1 0.372 0.010 . 2 . . . . 15 LEU HD22 . 18569 1 158 . 1 1 15 15 LEU HD23 H 1 0.372 0.010 . 2 . . . . 15 LEU HD23 . 18569 1 159 . 1 1 15 15 LEU CA C 13 53.698 0.100 . 1 . . . . 15 LEU CA . 18569 1 160 . 1 1 15 15 LEU CB C 13 46.369 0.100 . 1 . . . . 15 LEU CB . 18569 1 161 . 1 1 15 15 LEU CD1 C 13 24.087 0.100 . 2 . . . . 15 LEU CD1 . 18569 1 162 . 1 1 15 15 LEU CD2 C 13 24.815 0.100 . 2 . . . . 15 LEU CD2 . 18569 1 163 . 1 1 15 15 LEU N N 15 121.510 0.050 . 1 . . . . 15 LEU N . 18569 1 164 . 1 1 16 16 TYR H H 1 8.134 0.010 . 1 . . . . 16 TYR H . 18569 1 165 . 1 1 16 16 TYR HA H 1 3.832 0.010 . 1 . . . . 16 TYR HA . 18569 1 166 . 1 1 16 16 TYR HB2 H 1 1.008 0.010 . 2 . . . . 16 TYR HB2 . 18569 1 167 . 1 1 16 16 TYR HB3 H 1 2.110 0.010 . 2 . . . . 16 TYR HB3 . 18569 1 168 . 1 1 16 16 TYR HD1 H 1 5.447 0.010 . 3 . . . . 16 TYR HD1 . 18569 1 169 . 1 1 16 16 TYR HD2 H 1 5.447 0.010 . 3 . . . . 16 TYR HD2 . 18569 1 170 . 1 1 16 16 TYR HE1 H 1 6.246 0.010 . 3 . . . . 16 TYR HE1 . 18569 1 171 . 1 1 16 16 TYR HE2 H 1 6.246 0.010 . 3 . . . . 16 TYR HE2 . 18569 1 172 . 1 1 16 16 TYR CA C 13 58.201 0.100 . 1 . . . . 16 TYR CA . 18569 1 173 . 1 1 16 16 TYR CB C 13 38.381 0.100 . 1 . . . . 16 TYR CB . 18569 1 174 . 1 1 16 16 TYR CD1 C 13 132.23 0.100 . 1 . . . . 16 TYR CD# . 18569 1 175 . 1 1 16 16 TYR CD2 C 13 132.23 0.100 . 1 . . . . 16 TYR CD# . 18569 1 176 . 1 1 16 16 TYR CE1 C 13 117.08 0.100 . 1 . . . . 16 TYR CE# . 18569 1 177 . 1 1 16 16 TYR CE2 C 13 117.08 0.100 . 1 . . . . 16 TYR CE# . 18569 1 178 . 1 1 16 16 TYR N N 15 125.370 0.050 . 1 . . . . 16 TYR N . 18569 1 179 . 1 1 17 17 ASP H H 1 8.108 0.010 . 1 . . . . 17 ASP H . 18569 1 180 . 1 1 17 17 ASP HA H 1 4.471 0.010 . 1 . . . . 17 ASP HA . 18569 1 181 . 1 1 17 17 ASP HB2 H 1 2.332 0.010 . 2 . . . . 17 ASP HB2 . 18569 1 182 . 1 1 17 17 ASP HB3 H 1 2.693 0.010 . 2 . . . . 17 ASP HB3 . 18569 1 183 . 1 1 17 17 ASP CA C 13 51.855 0.100 . 1 . . . . 17 ASP CA . 18569 1 184 . 1 1 17 17 ASP CB C 13 41.313 0.100 . 1 . . . . 17 ASP CB . 18569 1 185 . 1 1 17 17 ASP N N 15 128.675 0.050 . 1 . . . . 17 ASP N . 18569 1 186 . 1 1 18 18 ASP H H 1 8.332 0.010 . 1 . . . . 18 ASP H . 18569 1 187 . 1 1 18 18 ASP HA H 1 4.022 0.010 . 1 . . . . 18 ASP HA . 18569 1 188 . 1 1 18 18 ASP HB2 H 1 2.531 0.010 . 2 . . . . 18 ASP HB2 . 18569 1 189 . 1 1 18 18 ASP HB3 H 1 2.603 0.010 . 2 . . . . 18 ASP HB3 . 18569 1 190 . 1 1 18 18 ASP CA C 13 56.451 0.100 . 1 . . . . 18 ASP CA . 18569 1 191 . 1 1 18 18 ASP CB C 13 41.783 0.100 . 1 . . . . 18 ASP CB . 18569 1 192 . 1 1 18 18 ASP N N 15 124.093 0.050 . 1 . . . . 18 ASP N . 18569 1 193 . 1 1 19 19 GLY H H 1 8.338 0.010 . 1 . . . . 19 GLY H . 18569 1 194 . 1 1 19 19 GLY HA2 H 1 3.764 0.010 . 2 . . . . 19 GLY HA2 . 18569 1 195 . 1 1 19 19 GLY HA3 H 1 3.817 0.010 . 2 . . . . 19 GLY HA3 . 18569 1 196 . 1 1 19 19 GLY CA C 13 46.601 0.100 . 1 . . . . 19 GLY CA . 18569 1 197 . 1 1 19 19 GLY N N 15 106.993 0.050 . 1 . . . . 19 GLY N . 18569 1 198 . 1 1 20 20 ASN H H 1 7.305 0.010 . 1 . . . . 20 ASN H . 18569 1 199 . 1 1 20 20 ASN HA H 1 4.706 0.010 . 1 . . . . 20 ASN HA . 18569 1 200 . 1 1 20 20 ASN HB2 H 1 2.221 0.010 . 2 . . . . 20 ASN HB2 . 18569 1 201 . 1 1 20 20 ASN HB3 H 1 2.574 0.010 . 2 . . . . 20 ASN HB3 . 18569 1 202 . 1 1 20 20 ASN HD21 H 1 8.330 0.010 . 1 . . . . 20 ASN HD21 . 18569 1 203 . 1 1 20 20 ASN HD22 H 1 6.837 0.010 . 1 . . . . 20 ASN HD22 . 18569 1 204 . 1 1 20 20 ASN CA C 13 52.870 0.100 . 1 . . . . 20 ASN CA . 18569 1 205 . 1 1 20 20 ASN CB C 13 39.512 0.100 . 1 . . . . 20 ASN CB . 18569 1 206 . 1 1 20 20 ASN N N 15 116.014 0.050 . 1 . . . . 20 ASN N . 18569 1 207 . 1 1 20 20 ASN ND2 N 15 116.969 0.050 . 1 . . . . 20 ASN ND2 . 18569 1 208 . 1 1 21 21 LYS H H 1 7.677 0.010 . 1 . . . . 21 LYS H . 18569 1 209 . 1 1 21 21 LYS HA H 1 3.546 0.010 . 1 . . . . 21 LYS HA . 18569 1 210 . 1 1 21 21 LYS HB2 H 1 1.712 0.010 . 2 . . . . 21 LYS HB2 . 18569 1 211 . 1 1 21 21 LYS HB3 H 1 2.021 0.010 . 2 . . . . 21 LYS HB3 . 18569 1 212 . 1 1 21 21 LYS HG2 H 1 1.269 0.010 . 1 . . . . 21 LYS HG2 . 18569 1 213 . 1 1 21 21 LYS HG3 H 1 1.269 0.010 . 1 . . . . 21 LYS HG3 . 18569 1 214 . 1 1 21 21 LYS HD2 H 1 1.604 0.010 . 1 . . . . 21 LYS HD2 . 18569 1 215 . 1 1 21 21 LYS HD3 H 1 1.604 0.010 . 1 . . . . 21 LYS HD3 . 18569 1 216 . 1 1 21 21 LYS HE2 H 1 2.991 0.010 . 1 . . . . 21 LYS HE2 . 18569 1 217 . 1 1 21 21 LYS HE3 H 1 2.991 0.010 . 1 . . . . 21 LYS HE3 . 18569 1 218 . 1 1 21 21 LYS CA C 13 56.512 0.100 . 1 . . . . 21 LYS CA . 18569 1 219 . 1 1 21 21 LYS CB C 13 28.845 0.100 . 1 . . . . 21 LYS CB . 18569 1 220 . 1 1 21 21 LYS CG C 13 24.660 0.100 . 1 . . . . 21 LYS CG . 18569 1 221 . 1 1 21 21 LYS CD C 13 29.298 0.100 . 1 . . . . 21 LYS CD . 18569 1 222 . 1 1 21 21 LYS CE C 13 43.009 0.100 . 1 . . . . 21 LYS CE . 18569 1 223 . 1 1 21 21 LYS N N 15 118.573 0.050 . 1 . . . . 21 LYS N . 18569 1 224 . 1 1 22 22 ARG H H 1 6.984 0.010 . 1 . . . . 22 ARG H . 18569 1 225 . 1 1 22 22 ARG HA H 1 4.696 0.010 . 1 . . . . 22 ARG HA . 18569 1 226 . 1 1 22 22 ARG HB2 H 1 1.627 0.010 . 2 . . . . 22 ARG HB2 . 18569 1 227 . 1 1 22 22 ARG HB3 H 1 1.708 0.010 . 2 . . . . 22 ARG HB3 . 18569 1 228 . 1 1 22 22 ARG HG2 H 1 1.301 0.010 . 2 . . . . 22 ARG HG2 . 18569 1 229 . 1 1 22 22 ARG HG3 H 1 1.306 0.010 . 2 . . . . 22 ARG HG3 . 18569 1 230 . 1 1 22 22 ARG HD2 H 1 3.061 0.010 . 2 . . . . 22 ARG HD2 . 18569 1 231 . 1 1 22 22 ARG HD3 H 1 3.061 0.010 . 2 . . . . 22 ARG HD3 . 18569 1 232 . 1 1 22 22 ARG HE H 1 7.309 0.010 . 2 . . . . 22 ARG HE . 18569 1 233 . 1 1 22 22 ARG CA C 13 53.919 0.100 . 1 . . . . 22 ARG CA . 18569 1 234 . 1 1 22 22 ARG CB C 13 33.552 0.100 . 1 . . . . 22 ARG CB . 18569 1 235 . 1 1 22 22 ARG CG C 13 26.218 0.100 . 1 . . . . 22 ARG CG . 18569 1 236 . 1 1 22 22 ARG CD C 13 43.721 0.100 . 1 . . . . 22 ARG CD . 18569 1 237 . 1 1 22 22 ARG N N 15 114.101 0.050 . 1 . . . . 22 ARG N . 18569 1 238 . 1 1 22 22 ARG NE N 15 84.89 0.050 . 1 . . . . 22 ARG NE . 18569 1 239 . 1 1 23 23 TRP H H 1 8.708 0.010 . 1 . . . . 23 TRP H . 18569 1 240 . 1 1 23 23 TRP HA H 1 4.881 0.010 . 1 . . . . 23 TRP HA . 18569 1 241 . 1 1 23 23 TRP HB2 H 1 3.008 0.010 . 2 . . . . 23 TRP HB2 . 18569 1 242 . 1 1 23 23 TRP HB3 H 1 3.008 0.010 . 2 . . . . 23 TRP HB3 . 18569 1 243 . 1 1 23 23 TRP HD1 H 1 7.283 0.010 . 1 . . . . 23 TRP HD1 . 18569 1 244 . 1 1 23 23 TRP HE1 H 1 10.097 0.010 . 1 . . . . 23 TRP HE1 . 18569 1 245 . 1 1 23 23 TRP HE3 H 1 7.271 0.010 . 1 . . . . 23 TRP HE3 . 18569 1 246 . 1 1 23 23 TRP HZ2 H 1 7.185 0.010 . 1 . . . . 23 TRP HZ2 . 18569 1 247 . 1 1 23 23 TRP HZ3 H 1 6.910 0.010 . 1 . . . . 23 TRP HZ3 . 18569 1 248 . 1 1 23 23 TRP HH2 H 1 6.770 0.010 . 1 . . . . 23 TRP HH2 . 18569 1 249 . 1 1 23 23 TRP CA C 13 56.944 0.100 . 1 . . . . 23 TRP CA . 18569 1 250 . 1 1 23 23 TRP CB C 13 30.986 0.100 . 1 . . . . 23 TRP CB . 18569 1 251 . 1 1 23 23 TRP CD1 C 13 127.352 0.100 . 1 . . . . 23 TRP CD1 . 18569 1 252 . 1 1 23 23 TRP CE3 C 13 119.770 0.100 . 1 . . . . 23 TRP CE3 . 18569 1 253 . 1 1 23 23 TRP CZ2 C 13 114.969 0.100 . 1 . . . . 23 TRP CZ2 . 18569 1 254 . 1 1 23 23 TRP CZ3 C 13 121.796 0.100 . 1 . . . . 23 TRP CZ3 . 18569 1 255 . 1 1 23 23 TRP CH2 C 13 124.640 0.100 . 1 . . . . 23 TRP CH2 . 18569 1 256 . 1 1 23 23 TRP N N 15 121.872 0.050 . 1 . . . . 23 TRP N . 18569 1 257 . 1 1 23 23 TRP NE1 N 15 130.048 0.050 . 1 . . . . 23 TRP NE1 . 18569 1 258 . 1 1 24 24 LEU H H 1 9.121 0.010 . 1 . . . . 24 LEU H . 18569 1 259 . 1 1 24 24 LEU HA H 1 5.023 0.010 . 1 . . . . 24 LEU HA . 18569 1 260 . 1 1 24 24 LEU HB2 H 1 1.537 0.010 . 2 . . . . 24 LEU HB2 . 18569 1 261 . 1 1 24 24 LEU HB3 H 1 1.670 0.010 . 2 . . . . 24 LEU HB3 . 18569 1 262 . 1 1 24 24 LEU HG H 1 0.885 0.010 . 1 . . . . 24 LEU HG . 18569 1 263 . 1 1 24 24 LEU HD11 H 1 0.887 0.010 . 2 . . . . 24 LEU HD11 . 18569 1 264 . 1 1 24 24 LEU HD12 H 1 0.887 0.010 . 2 . . . . 24 LEU HD12 . 18569 1 265 . 1 1 24 24 LEU HD13 H 1 0.887 0.010 . 2 . . . . 24 LEU HD13 . 18569 1 266 . 1 1 24 24 LEU HD21 H 1 0.887 0.010 . 2 . . . . 24 LEU HD21 . 18569 1 267 . 1 1 24 24 LEU HD22 H 1 0.887 0.010 . 2 . . . . 24 LEU HD22 . 18569 1 268 . 1 1 24 24 LEU HD23 H 1 0.887 0.010 . 2 . . . . 24 LEU HD23 . 18569 1 269 . 1 1 24 24 LEU CA C 13 52.122 0.100 . 1 . . . . 24 LEU CA . 18569 1 270 . 1 1 24 24 LEU CB C 13 44.178 0.100 . 1 . . . . 24 LEU CB . 18569 1 271 . 1 1 24 24 LEU CG C 13 25.664 0.100 . 1 . . . . 24 LEU CG . 18569 1 272 . 1 1 24 24 LEU N N 15 123.522 0.050 . 1 . . . . 24 LEU N . 18569 1 273 . 1 1 25 25 PRO HA H 1 4.978 0.010 . 1 . . . . 25 PRO HA . 18569 1 274 . 1 1 25 25 PRO HB2 H 1 1.963 0.010 . 2 . . . . 25 PRO HB2 . 18569 1 275 . 1 1 25 25 PRO HB3 H 1 2.180 0.010 . 2 . . . . 25 PRO HB3 . 18569 1 276 . 1 1 25 25 PRO HD2 H 1 3.677 0.010 . 2 . . . . 25 PRO HD2 . 18569 1 277 . 1 1 25 25 PRO HD3 H 1 3.824 0.010 . 2 . . . . 25 PRO HD3 . 18569 1 278 . 1 1 25 25 PRO CA C 13 63.092 0.100 . 1 . . . . 25 PRO CA . 18569 1 279 . 1 1 25 25 PRO CB C 13 31.512 0.100 . 1 . . . . 25 PRO CB . 18569 1 280 . 1 1 25 25 PRO CD C 13 50.283 0.100 . 1 . . . . 25 PRO CD . 18569 1 281 . 1 1 26 26 ALA H H 1 8.411 0.010 . 1 . . . . 26 ALA H . 18569 1 282 . 1 1 26 26 ALA HA H 1 4.472 0.010 . 1 . . . . 26 ALA HA . 18569 1 283 . 1 1 26 26 ALA HB1 H 1 1.502 0.010 . 1 . . . . 26 ALA HB1 . 18569 1 284 . 1 1 26 26 ALA HB2 H 1 1.502 0.010 . 1 . . . . 26 ALA HB2 . 18569 1 285 . 1 1 26 26 ALA HB3 H 1 1.502 0.010 . 1 . . . . 26 ALA HB3 . 18569 1 286 . 1 1 26 26 ALA CA C 13 51.976 0.100 . 1 . . . . 26 ALA CA . 18569 1 287 . 1 1 26 26 ALA CB C 13 20.558 0.100 . 1 . . . . 26 ALA CB . 18569 1 288 . 1 1 26 26 ALA N N 15 126.264 0.050 . 1 . . . . 26 ALA N . 18569 1 289 . 1 1 27 27 GLY H H 1 8.905 0.010 . 1 . . . . 27 GLY H . 18569 1 290 . 1 1 27 27 GLY HA2 H 1 3.953 0.010 . 2 . . . . 27 GLY HA2 . 18569 1 291 . 1 1 27 27 GLY HA3 H 1 4.376 0.010 . 2 . . . . 27 GLY HA3 . 18569 1 292 . 1 1 27 27 GLY CA C 13 44.335 0.100 . 1 . . . . 27 GLY CA . 18569 1 293 . 1 1 27 27 GLY N N 15 110.873 0.050 . 1 . . . . 27 GLY N . 18569 1 294 . 1 1 28 28 THR H H 1 8.690 0.010 . 1 . . . . 28 THR H . 18569 1 295 . 1 1 28 28 THR HA H 1 4.657 0.010 . 1 . . . . 28 THR HA . 18569 1 296 . 1 1 28 28 THR HB H 1 4.235 0.010 . 1 . . . . 28 THR HB . 18569 1 297 . 1 1 28 28 THR HG21 H 1 1.179 0.010 . 1 . . . . 28 THR HG21 . 18569 1 298 . 1 1 28 28 THR HG22 H 1 1.179 0.010 . 1 . . . . 28 THR HG22 . 18569 1 299 . 1 1 28 28 THR HG23 H 1 1.179 0.010 . 1 . . . . 28 THR HG23 . 18569 1 300 . 1 1 28 28 THR CA C 13 60.747 0.100 . 1 . . . . 28 THR CA . 18569 1 301 . 1 1 28 28 THR CB C 13 71.535 0.100 . 1 . . . . 28 THR CB . 18569 1 302 . 1 1 28 28 THR CG2 C 13 21.476 0.100 . 1 . . . . 28 THR CG2 . 18569 1 303 . 1 1 28 28 THR N N 15 111.793 0.050 . 1 . . . . 28 THR N . 18569 1 304 . 1 1 29 29 GLY H H 1 8.527 0.010 . 1 . . . . 29 GLY H . 18569 1 305 . 1 1 29 29 GLY HA2 H 1 3.825 0.010 . 2 . . . . 29 GLY HA2 . 18569 1 306 . 1 1 29 29 GLY HA3 H 1 4.489 0.010 . 2 . . . . 29 GLY HA3 . 18569 1 307 . 1 1 29 29 GLY CA C 13 44.230 0.100 . 1 . . . . 29 GLY CA . 18569 1 308 . 1 1 29 29 GLY N N 15 109.585 0.050 . 1 . . . . 29 GLY N . 18569 1 309 . 1 1 30 30 PRO HA H 1 4.323 0.010 . 1 . . . . 30 PRO HA . 18569 1 310 . 1 1 30 30 PRO HB2 H 1 1.867 0.010 . 2 . . . . 30 PRO HB2 . 18569 1 311 . 1 1 30 30 PRO HB3 H 1 2.315 0.010 . 2 . . . . 30 PRO HB3 . 18569 1 312 . 1 1 30 30 PRO HG2 H 1 2.011 0.010 . 1 . . . . 30 PRO HG2 . 18569 1 313 . 1 1 30 30 PRO HG3 H 1 2.011 0.010 . 1 . . . . 30 PRO HG3 . 18569 1 314 . 1 1 30 30 PRO HD2 H 1 3.585 0.010 . 2 . . . . 30 PRO HD2 . 18569 1 315 . 1 1 30 30 PRO HD3 H 1 3.636 0.010 . 2 . . . . 30 PRO HD3 . 18569 1 316 . 1 1 30 30 PRO CA C 13 62.903 0.100 . 1 . . . . 30 PRO CA . 18569 1 317 . 1 1 30 30 PRO CB C 13 32.193 0.100 . 1 . . . . 30 PRO CB . 18569 1 318 . 1 1 30 30 PRO CG C 13 27.428 0.100 . 1 . . . . 30 PRO CG . 18569 1 319 . 1 1 30 30 PRO CD C 13 49.691 0.100 . 1 . . . . 30 PRO CD . 18569 1 320 . 1 1 31 31 GLN H H 1 8.478 0.010 . 1 . . . . 31 GLN H . 18569 1 321 . 1 1 31 31 GLN HA H 1 4.199 0.010 . 1 . . . . 31 GLN HA . 18569 1 322 . 1 1 31 31 GLN HB2 H 1 1.884 0.010 . 2 . . . . 31 GLN HB2 . 18569 1 323 . 1 1 31 31 GLN HB3 H 1 1.980 0.010 . 2 . . . . 31 GLN HB3 . 18569 1 324 . 1 1 31 31 GLN HG2 H 1 2.182 0.010 . 2 . . . . 31 GLN HG2 . 18569 1 325 . 1 1 31 31 GLN HG3 H 1 2.241 0.010 . 2 . . . . 31 GLN HG3 . 18569 1 326 . 1 1 31 31 GLN HE21 H 1 7.444 0.010 . 1 . . . . 31 GLN HE21 . 18569 1 327 . 1 1 31 31 GLN HE22 H 1 6.648 0.010 . 1 . . . . 31 GLN HE22 . 18569 1 328 . 1 1 31 31 GLN CA C 13 56.708 0.100 . 1 . . . . 31 GLN CA . 18569 1 329 . 1 1 31 31 GLN CB C 13 28.854 0.100 . 1 . . . . 31 GLN CB . 18569 1 330 . 1 1 31 31 GLN CG C 13 33.948 0.100 . 1 . . . . 31 GLN CG . 18569 1 331 . 1 1 31 31 GLN N N 15 122.598 0.050 . 1 . . . . 31 GLN N . 18569 1 332 . 1 1 31 31 GLN NE2 N 15 111.400 0.050 . 1 . . . . 31 GLN NE2 . 18569 1 333 . 1 1 32 32 ALA H H 1 8.862 0.010 . 1 . . . . 32 ALA H . 18569 1 334 . 1 1 32 32 ALA HA H 1 4.586 0.010 . 1 . . . . 32 ALA HA . 18569 1 335 . 1 1 32 32 ALA HB1 H 1 1.324 0.010 . 1 . . . . 32 ALA HB1 . 18569 1 336 . 1 1 32 32 ALA HB2 H 1 1.324 0.010 . 1 . . . . 32 ALA HB2 . 18569 1 337 . 1 1 32 32 ALA HB3 H 1 1.324 0.010 . 1 . . . . 32 ALA HB3 . 18569 1 338 . 1 1 32 32 ALA CA C 13 51.344 0.100 . 1 . . . . 32 ALA CA . 18569 1 339 . 1 1 32 32 ALA CB C 13 22.619 0.100 . 1 . . . . 32 ALA CB . 18569 1 340 . 1 1 32 32 ALA N N 15 127.222 0.050 . 1 . . . . 32 ALA N . 18569 1 341 . 1 1 33 33 PHE H H 1 8.571 0.010 . 1 . . . . 33 PHE H . 18569 1 342 . 1 1 33 33 PHE HA H 1 4.185 0.010 . 1 . . . . 33 PHE HA . 18569 1 343 . 1 1 33 33 PHE HB2 H 1 2.853 0.010 . 2 . . . . 33 PHE HB2 . 18569 1 344 . 1 1 33 33 PHE HB3 H 1 3.065 0.010 . 2 . . . . 33 PHE HB3 . 18569 1 345 . 1 1 33 33 PHE HD1 H 1 7.152 0.010 . 3 . . . . 33 PHE HD1 . 18569 1 346 . 1 1 33 33 PHE HD2 H 1 7.152 0.010 . 3 . . . . 33 PHE HD2 . 18569 1 347 . 1 1 33 33 PHE HE1 H 1 7.314 0.010 . 3 . . . . 33 PHE HE1 . 18569 1 348 . 1 1 33 33 PHE HE2 H 1 7.314 0.010 . 3 . . . . 33 PHE HE2 . 18569 1 349 . 1 1 33 33 PHE CA C 13 59.551 0.100 . 1 . . . . 33 PHE CA . 18569 1 350 . 1 1 33 33 PHE CB C 13 41.091 0.100 . 1 . . . . 33 PHE CB . 18569 1 351 . 1 1 33 33 PHE CD1 C 13 131.51 0.100 . 1 . . . . 33 PHE CD# . 18569 1 352 . 1 1 33 33 PHE CD2 C 13 131.51 0.100 . 1 . . . . 33 PHE CD# . 18569 1 353 . 1 1 33 33 PHE CE1 C 13 131.52 0.100 . 1 . . . . 33 PHE CE# . 18569 1 354 . 1 1 33 33 PHE CE2 C 13 131.52 0.100 . 1 . . . . 33 PHE CE# . 18569 1 355 . 1 1 33 33 PHE N N 15 118.405 0.050 . 1 . . . . 33 PHE N . 18569 1 356 . 1 1 34 34 SER H H 1 8.830 0.010 . 1 . . . . 34 SER H . 18569 1 357 . 1 1 34 34 SER HA H 1 5.156 0.010 . 1 . . . . 34 SER HA . 18569 1 358 . 1 1 34 34 SER HB2 H 1 3.212 0.010 . 2 . . . . 34 SER HB2 . 18569 1 359 . 1 1 34 34 SER HB3 H 1 3.600 0.010 . 2 . . . . 34 SER HB3 . 18569 1 360 . 1 1 34 34 SER CA C 13 59.113 0.100 . 1 . . . . 34 SER CA . 18569 1 361 . 1 1 34 34 SER CB C 13 66.248 0.100 . 1 . . . . 34 SER CB . 18569 1 362 . 1 1 34 34 SER N N 15 115.301 0.050 . 1 . . . . 34 SER N . 18569 1 363 . 1 1 35 35 ARG H H 1 8.576 0.010 . 1 . . . . 35 ARG H . 18569 1 364 . 1 1 35 35 ARG HA H 1 4.849 0.010 . 1 . . . . 35 ARG HA . 18569 1 365 . 1 1 35 35 ARG HB2 H 1 1.796 0.010 . 2 . . . . 35 ARG HB2 . 18569 1 366 . 1 1 35 35 ARG HB3 H 1 1.959 0.010 . 2 . . . . 35 ARG HB3 . 18569 1 367 . 1 1 35 35 ARG HG2 H 1 1.532 0.010 . 2 . . . . 35 ARG HG2 . 18569 1 368 . 1 1 35 35 ARG HG3 H 1 1.599 0.010 . 2 . . . . 35 ARG HG3 . 18569 1 369 . 1 1 35 35 ARG HD2 H 1 3.192 0.010 . 1 . . . . 35 ARG HD2 . 18569 1 370 . 1 1 35 35 ARG HD3 H 1 3.192 0.010 . 1 . . . . 35 ARG HD3 . 18569 1 371 . 1 1 35 35 ARG HE H 1 7.229 0.010 . 1 . . . . 35 ARG HE . 18569 1 372 . 1 1 35 35 ARG CA C 13 55.271 0.100 . 1 . . . . 35 ARG CA . 18569 1 373 . 1 1 35 35 ARG CB C 13 30.118 0.100 . 1 . . . . 35 ARG CB . 18569 1 374 . 1 1 35 35 ARG CG C 13 27.129 0.100 . 1 . . . . 35 ARG CG . 18569 1 375 . 1 1 35 35 ARG CD C 13 43.143 0.100 . 1 . . . . 35 ARG CD . 18569 1 376 . 1 1 35 35 ARG N N 15 122.605 0.050 . 1 . . . . 35 ARG N . 18569 1 377 . 1 1 35 35 ARG NE N 15 83.76 0.050 . 1 . . . . 35 ARG NE . 18569 1 378 . 1 1 36 36 VAL H H 1 9.424 0.010 . 1 . . . . 36 VAL H . 18569 1 379 . 1 1 36 36 VAL HA H 1 4.853 0.010 . 1 . . . . 36 VAL HA . 18569 1 380 . 1 1 36 36 VAL HB H 1 1.698 0.010 . 1 . . . . 36 VAL HB . 18569 1 381 . 1 1 36 36 VAL HG11 H 1 0.622 0.010 . 2 . . . . 36 VAL HG11 . 18569 1 382 . 1 1 36 36 VAL HG12 H 1 0.622 0.010 . 2 . . . . 36 VAL HG12 . 18569 1 383 . 1 1 36 36 VAL HG13 H 1 0.622 0.010 . 2 . . . . 36 VAL HG13 . 18569 1 384 . 1 1 36 36 VAL HG21 H 1 0.539 0.010 . 2 . . . . 36 VAL HG21 . 18569 1 385 . 1 1 36 36 VAL HG22 H 1 0.539 0.010 . 2 . . . . 36 VAL HG22 . 18569 1 386 . 1 1 36 36 VAL HG23 H 1 0.539 0.010 . 2 . . . . 36 VAL HG23 . 18569 1 387 . 1 1 36 36 VAL CA C 13 61.390 0.100 . 1 . . . . 36 VAL CA . 18569 1 388 . 1 1 36 36 VAL CB C 13 32.610 0.100 . 1 . . . . 36 VAL CB . 18569 1 389 . 1 1 36 36 VAL CG1 C 13 22.548 0.100 . 2 . . . . 36 VAL CG1 . 18569 1 390 . 1 1 36 36 VAL CG2 C 13 21.646 0.100 . 2 . . . . 36 VAL CG2 . 18569 1 391 . 1 1 36 36 VAL N N 15 129.726 0.050 . 1 . . . . 36 VAL N . 18569 1 392 . 1 1 37 37 GLN H H 1 9.170 0.010 . 1 . . . . 37 GLN H . 18569 1 393 . 1 1 37 37 GLN HA H 1 5.520 0.010 . 1 . . . . 37 GLN HA . 18569 1 394 . 1 1 37 37 GLN HB2 H 1 1.814 0.010 . 2 . . . . 37 GLN HB2 . 18569 1 395 . 1 1 37 37 GLN HB3 H 1 2.035 0.010 . 2 . . . . 37 GLN HB3 . 18569 1 396 . 1 1 37 37 GLN HG2 H 1 2.238 0.010 . 2 . . . . 37 GLN HG2 . 18569 1 397 . 1 1 37 37 GLN HG3 H 1 2.425 0.010 . 2 . . . . 37 GLN HG3 . 18569 1 398 . 1 1 37 37 GLN HE21 H 1 7.281 0.010 . 1 . . . . 37 GLN HE21 . 18569 1 399 . 1 1 37 37 GLN HE22 H 1 7.009 0.010 . 1 . . . . 37 GLN HE22 . 18569 1 400 . 1 1 37 37 GLN CA C 13 53.887 0.100 . 1 . . . . 37 GLN CA . 18569 1 401 . 1 1 37 37 GLN CB C 13 34.389 0.100 . 1 . . . . 37 GLN CB . 18569 1 402 . 1 1 37 37 GLN CG C 13 34.786 0.100 . 1 . . . . 37 GLN CG . 18569 1 403 . 1 1 37 37 GLN N N 15 124.250 0.050 . 1 . . . . 37 GLN N . 18569 1 404 . 1 1 37 37 GLN NE2 N 15 111.403 0.050 . 1 . . . . 37 GLN NE2 . 18569 1 405 . 1 1 38 38 ILE H H 1 7.603 0.010 . 1 . . . . 38 ILE H . 18569 1 406 . 1 1 38 38 ILE HA H 1 5.069 0.010 . 1 . . . . 38 ILE HA . 18569 1 407 . 1 1 38 38 ILE HB H 1 1.494 0.010 . 1 . . . . 38 ILE HB . 18569 1 408 . 1 1 38 38 ILE HG12 H 1 0.550 0.010 . 2 . . . . 38 ILE HG12 . 18569 1 409 . 1 1 38 38 ILE HG13 H 1 1.314 0.010 . 2 . . . . 38 ILE HG13 . 18569 1 410 . 1 1 38 38 ILE HG21 H 1 0.723 0.010 . 1 . . . . 38 ILE HG21 . 18569 1 411 . 1 1 38 38 ILE HG22 H 1 0.723 0.010 . 1 . . . . 38 ILE HG22 . 18569 1 412 . 1 1 38 38 ILE HG23 H 1 0.723 0.010 . 1 . . . . 38 ILE HG23 . 18569 1 413 . 1 1 38 38 ILE HD11 H 1 -0.160 0.010 . 1 . . . . 38 ILE HD11 . 18569 1 414 . 1 1 38 38 ILE HD12 H 1 -0.160 0.010 . 1 . . . . 38 ILE HD12 . 18569 1 415 . 1 1 38 38 ILE HD13 H 1 -0.160 0.010 . 1 . . . . 38 ILE HD13 . 18569 1 416 . 1 1 38 38 ILE CA C 13 60.692 0.100 . 1 . . . . 38 ILE CA . 18569 1 417 . 1 1 38 38 ILE CB C 13 39.397 0.100 . 1 . . . . 38 ILE CB . 18569 1 418 . 1 1 38 38 ILE CG1 C 13 27.989 0.100 . 1 . . . . 38 ILE CG1 . 18569 1 419 . 1 1 38 38 ILE CG2 C 13 17.144 0.100 . 1 . . . . 38 ILE CG2 . 18569 1 420 . 1 1 38 38 ILE CD1 C 13 12.295 0.100 . 1 . . . . 38 ILE CD1 . 18569 1 421 . 1 1 38 38 ILE N N 15 118.455 0.050 . 1 . . . . 38 ILE N . 18569 1 422 . 1 1 39 39 TYR H H 1 9.485 0.010 . 1 . . . . 39 TYR H . 18569 1 423 . 1 1 39 39 TYR HA H 1 5.286 0.010 . 1 . . . . 39 TYR HA . 18569 1 424 . 1 1 39 39 TYR HB2 H 1 2.776 0.010 . 1 . . . . 39 TYR HB2 . 18569 1 425 . 1 1 39 39 TYR HB3 H 1 2.776 0.010 . 1 . . . . 39 TYR HB3 . 18569 1 426 . 1 1 39 39 TYR HD1 H 1 6.833 0.010 . 3 . . . . 39 TYR HD1 . 18569 1 427 . 1 1 39 39 TYR HD2 H 1 6.833 0.010 . 3 . . . . 39 TYR HD2 . 18569 1 428 . 1 1 39 39 TYR HE1 H 1 6.713 0.010 . 3 . . . . 39 TYR HE1 . 18569 1 429 . 1 1 39 39 TYR HE2 H 1 6.713 0.010 . 3 . . . . 39 TYR HE2 . 18569 1 430 . 1 1 39 39 TYR CA C 13 56.731 0.100 . 1 . . . . 39 TYR CA . 18569 1 431 . 1 1 39 39 TYR CB C 13 42.101 0.100 . 1 . . . . 39 TYR CB . 18569 1 432 . 1 1 39 39 TYR CD1 C 13 132.22 0.100 . 1 . . . . 39 TYR CD# . 18569 1 433 . 1 1 39 39 TYR CD2 C 13 132.22 0.100 . 1 . . . . 39 TYR CD# . 18569 1 434 . 1 1 39 39 TYR CE1 C 13 118.61 0.100 . 1 . . . . 39 TYR CE# . 18569 1 435 . 1 1 39 39 TYR CE2 C 13 118.61 0.100 . 1 . . . . 39 TYR CE# . 18569 1 436 . 1 1 39 39 TYR N N 15 127.018 0.050 . 1 . . . . 39 TYR N . 18569 1 437 . 1 1 40 40 HIS H H 1 9.537 0.010 . 1 . . . . 40 HIS H . 18569 1 438 . 1 1 40 40 HIS HA H 1 5.194 0.010 . 1 . . . . 40 HIS HA . 18569 1 439 . 1 1 40 40 HIS HB2 H 1 2.592 0.010 . 2 . . . . 40 HIS HB2 . 18569 1 440 . 1 1 40 40 HIS HB3 H 1 3.045 0.010 . 2 . . . . 40 HIS HB3 . 18569 1 441 . 1 1 40 40 HIS HD2 H 1 5.721 0.010 . 1 . . . . 40 HIS HD2 . 18569 1 442 . 1 1 40 40 HIS CA C 13 52.293 0.100 . 1 . . . . 40 HIS CA . 18569 1 443 . 1 1 40 40 HIS CB C 13 35.193 0.100 . 1 . . . . 40 HIS CB . 18569 1 444 . 1 1 40 40 HIS CD2 C 13 120.264 0.100 . 1 . . . . 40 HIS CD2 . 18569 1 445 . 1 1 40 40 HIS N N 15 122.206 0.050 . 1 . . . . 40 HIS N . 18569 1 446 . 1 1 41 41 ASN H H 1 8.510 0.010 . 1 . . . . 41 ASN H . 18569 1 447 . 1 1 41 41 ASN HA H 1 5.176 0.010 . 1 . . . . 41 ASN HA . 18569 1 448 . 1 1 41 41 ASN HB2 H 1 2.557 0.010 . 2 . . . . 41 ASN HB2 . 18569 1 449 . 1 1 41 41 ASN HB3 H 1 3.305 0.010 . 2 . . . . 41 ASN HB3 . 18569 1 450 . 1 1 41 41 ASN HD21 H 1 7.703 0.010 . 1 . . . . 41 ASN HD21 . 18569 1 451 . 1 1 41 41 ASN HD22 H 1 6.928 0.010 . 1 . . . . 41 ASN HD22 . 18569 1 452 . 1 1 41 41 ASN CA C 13 49.105 0.100 . 1 . . . . 41 ASN CA . 18569 1 453 . 1 1 41 41 ASN CB C 13 38.828 0.100 . 1 . . . . 41 ASN CB . 18569 1 454 . 1 1 41 41 ASN N N 15 126.051 0.050 . 1 . . . . 41 ASN N . 18569 1 455 . 1 1 41 41 ASN ND2 N 15 112.610 0.050 . 1 . . . . 41 ASN ND2 . 18569 1 456 . 1 1 42 42 PRO HA H 1 3.732 0.010 . 1 . . . . 42 PRO HA . 18569 1 457 . 1 1 42 42 PRO HB2 H 1 1.900 0.010 . 2 . . . . 42 PRO HB2 . 18569 1 458 . 1 1 42 42 PRO HB3 H 1 2.056 0.010 . 2 . . . . 42 PRO HB3 . 18569 1 459 . 1 1 42 42 PRO HG2 H 1 1.709 0.010 . 2 . . . . 42 PRO HG2 . 18569 1 460 . 1 1 42 42 PRO HG3 H 1 1.709 0.010 . 2 . . . . 42 PRO HG3 . 18569 1 461 . 1 1 42 42 PRO HD2 H 1 3.648 0.010 . 2 . . . . 42 PRO HD2 . 18569 1 462 . 1 1 42 42 PRO HD3 H 1 3.792 0.010 . 2 . . . . 42 PRO HD3 . 18569 1 463 . 1 1 42 42 PRO CA C 13 63.941 0.100 . 1 . . . . 42 PRO CA . 18569 1 464 . 1 1 42 42 PRO CB C 13 32.136 0.100 . 1 . . . . 42 PRO CB . 18569 1 465 . 1 1 42 42 PRO CG C 13 26.854 0.100 . 1 . . . . 42 PRO CG . 18569 1 466 . 1 1 42 42 PRO CD C 13 51.154 0.100 . 1 . . . . 42 PRO CD . 18569 1 467 . 1 1 43 43 THR H H 1 7.728 0.010 . 1 . . . . 43 THR H . 18569 1 468 . 1 1 43 43 THR HA H 1 4.010 0.010 . 1 . . . . 43 THR HA . 18569 1 469 . 1 1 43 43 THR HB H 1 4.176 0.010 . 1 . . . . 43 THR HB . 18569 1 470 . 1 1 43 43 THR HG21 H 1 1.200 0.010 . 1 . . . . 43 THR HG21 . 18569 1 471 . 1 1 43 43 THR HG22 H 1 1.200 0.010 . 1 . . . . 43 THR HG22 . 18569 1 472 . 1 1 43 43 THR HG23 H 1 1.200 0.010 . 1 . . . . 43 THR HG23 . 18569 1 473 . 1 1 43 43 THR CA C 13 65.459 0.100 . 1 . . . . 43 THR CA . 18569 1 474 . 1 1 43 43 THR CB C 13 68.353 0.100 . 1 . . . . 43 THR CB . 18569 1 475 . 1 1 43 43 THR CG2 C 13 21.921 0.100 . 1 . . . . 43 THR CG2 . 18569 1 476 . 1 1 43 43 THR N N 15 114.132 0.050 . 1 . . . . 43 THR N . 18569 1 477 . 1 1 44 44 ALA H H 1 6.951 0.010 . 1 . . . . 44 ALA H . 18569 1 478 . 1 1 44 44 ALA HA H 1 4.316 0.010 . 1 . . . . 44 ALA HA . 18569 1 479 . 1 1 44 44 ALA HB1 H 1 1.223 0.010 . 1 . . . . 44 ALA HB1 . 18569 1 480 . 1 1 44 44 ALA HB2 H 1 1.223 0.010 . 1 . . . . 44 ALA HB2 . 18569 1 481 . 1 1 44 44 ALA HB3 H 1 1.223 0.010 . 1 . . . . 44 ALA HB3 . 18569 1 482 . 1 1 44 44 ALA CA C 13 51.536 0.100 . 1 . . . . 44 ALA CA . 18569 1 483 . 1 1 44 44 ALA CB C 13 19.292 0.100 . 1 . . . . 44 ALA CB . 18569 1 484 . 1 1 44 44 ALA N N 15 122.007 0.050 . 1 . . . . 44 ALA N . 18569 1 485 . 1 1 45 45 ASN H H 1 7.921 0.010 . 1 . . . . 45 ASN H . 18569 1 486 . 1 1 45 45 ASN HA H 1 4.224 0.010 . 1 . . . . 45 ASN HA . 18569 1 487 . 1 1 45 45 ASN HB2 H 1 2.538 0.010 . 2 . . . . 45 ASN HB2 . 18569 1 488 . 1 1 45 45 ASN HB3 H 1 3.389 0.010 . 2 . . . . 45 ASN HB3 . 18569 1 489 . 1 1 45 45 ASN HD21 H 1 7.632 0.010 . 1 . . . . 45 ASN HD21 . 18569 1 490 . 1 1 45 45 ASN HD22 H 1 6.600 0.010 . 1 . . . . 45 ASN HD22 . 18569 1 491 . 1 1 45 45 ASN CA C 13 53.705 0.100 . 1 . . . . 45 ASN CA . 18569 1 492 . 1 1 45 45 ASN CB C 13 37.167 0.100 . 1 . . . . 45 ASN CB . 18569 1 493 . 1 1 45 45 ASN N N 15 117.265 0.050 . 1 . . . . 45 ASN N . 18569 1 494 . 1 1 45 45 ASN ND2 N 15 110.125 0.050 . 1 . . . . 45 ASN ND2 . 18569 1 495 . 1 1 46 46 SER H H 1 7.552 0.010 . 1 . . . . 46 SER H . 18569 1 496 . 1 1 46 46 SER HA H 1 5.091 0.010 . 1 . . . . 46 SER HA . 18569 1 497 . 1 1 46 46 SER HB2 H 1 3.564 0.010 . 2 . . . . 46 SER HB2 . 18569 1 498 . 1 1 46 46 SER HB3 H 1 4.136 0.010 . 2 . . . . 46 SER HB3 . 18569 1 499 . 1 1 46 46 SER CA C 13 55.939 0.100 . 1 . . . . 46 SER CA . 18569 1 500 . 1 1 46 46 SER CB C 13 66.829 0.100 . 1 . . . . 46 SER CB . 18569 1 501 . 1 1 46 46 SER N N 15 109.443 0.050 . 1 . . . . 46 SER N . 18569 1 502 . 1 1 47 47 PHE H H 1 9.372 0.010 . 1 . . . . 47 PHE H . 18569 1 503 . 1 1 47 47 PHE HA H 1 5.866 0.010 . 1 . . . . 47 PHE HA . 18569 1 504 . 1 1 47 47 PHE HB2 H 1 2.691 0.010 . 2 . . . . 47 PHE HB2 . 18569 1 505 . 1 1 47 47 PHE HB3 H 1 2.789 0.010 . 2 . . . . 47 PHE HB3 . 18569 1 506 . 1 1 47 47 PHE HD1 H 1 6.943 0.010 . 3 . . . . 47 PHE HD1 . 18569 1 507 . 1 1 47 47 PHE HD2 H 1 6.943 0.010 . 3 . . . . 47 PHE HD2 . 18569 1 508 . 1 1 47 47 PHE HE1 H 1 6.772 0.010 . 3 . . . . 47 PHE HE1 . 18569 1 509 . 1 1 47 47 PHE HE2 H 1 6.772 0.010 . 3 . . . . 47 PHE HE2 . 18569 1 510 . 1 1 47 47 PHE HZ H 1 6.564 0.010 . 1 . . . . 47 PHE HZ . 18569 1 511 . 1 1 47 47 PHE CA C 13 56.725 0.100 . 1 . . . . 47 PHE CA . 18569 1 512 . 1 1 47 47 PHE CB C 13 44.882 0.100 . 1 . . . . 47 PHE CB . 18569 1 513 . 1 1 47 47 PHE CD1 C 13 131.34 0.100 . 1 . . . . 47 PHE CD# . 18569 1 514 . 1 1 47 47 PHE CD2 C 13 131.34 0.100 . 1 . . . . 47 PHE CD# . 18569 1 515 . 1 1 47 47 PHE CE1 C 13 131.24 0.100 . 1 . . . . 47 PHE CE# . 18569 1 516 . 1 1 47 47 PHE CE2 C 13 131.24 0.100 . 1 . . . . 47 PHE CE# . 18569 1 517 . 1 1 47 47 PHE CZ C 13 130.573 0.100 . 1 . . . . 47 PHE CZ . 18569 1 518 . 1 1 47 47 PHE N N 15 120.023 0.050 . 1 . . . . 47 PHE N . 18569 1 519 . 1 1 48 48 ARG H H 1 8.921 0.010 . 1 . . . . 48 ARG H . 18569 1 520 . 1 1 48 48 ARG HA H 1 5.280 0.010 . 1 . . . . 48 ARG HA . 18569 1 521 . 1 1 48 48 ARG HB2 H 1 1.623 0.010 . 2 . . . . 48 ARG HB2 . 18569 1 522 . 1 1 48 48 ARG HB3 H 1 1.823 0.010 . 2 . . . . 48 ARG HB3 . 18569 1 523 . 1 1 48 48 ARG HG2 H 1 1.392 0.010 . 2 . . . . 48 ARG HG2 . 18569 1 524 . 1 1 48 48 ARG HG3 H 1 1.629 0.010 . 2 . . . . 48 ARG HG3 . 18569 1 525 . 1 1 48 48 ARG HD2 H 1 2.966 0.010 . 2 . . . . 48 ARG HD2 . 18569 1 526 . 1 1 48 48 ARG HD3 H 1 3.052 0.010 . 2 . . . . 48 ARG HD3 . 18569 1 527 . 1 1 48 48 ARG HE H 1 7.929 0.010 . 2 . . . . 48 ARG HE . 18569 1 528 . 1 1 48 48 ARG CA C 13 54.909 0.100 . 1 . . . . 48 ARG CA . 18569 1 529 . 1 1 48 48 ARG CB C 13 34.031 0.100 . 1 . . . . 48 ARG CB . 18569 1 530 . 1 1 48 48 ARG CG C 13 27.163 0.100 . 1 . . . . 48 ARG CG . 18569 1 531 . 1 1 48 48 ARG CD C 13 43.282 0.100 . 1 . . . . 48 ARG CD . 18569 1 532 . 1 1 48 48 ARG N N 15 119.124 0.050 . 1 . . . . 48 ARG N . 18569 1 533 . 1 1 48 48 ARG NE N 15 84.70 0.050 . 1 . . . . 48 ARG NE . 18569 1 534 . 1 1 49 49 VAL H H 1 9.211 0.010 . 1 . . . . 49 VAL H . 18569 1 535 . 1 1 49 49 VAL HA H 1 5.096 0.010 . 1 . . . . 49 VAL HA . 18569 1 536 . 1 1 49 49 VAL HB H 1 2.035 0.010 . 1 . . . . 49 VAL HB . 18569 1 537 . 1 1 49 49 VAL HG11 H 1 0.916 0.010 . 2 . . . . 49 VAL HG11 . 18569 1 538 . 1 1 49 49 VAL HG12 H 1 0.916 0.010 . 2 . . . . 49 VAL HG12 . 18569 1 539 . 1 1 49 49 VAL HG13 H 1 0.916 0.010 . 2 . . . . 49 VAL HG13 . 18569 1 540 . 1 1 49 49 VAL HG21 H 1 0.856 0.010 . 2 . . . . 49 VAL HG21 . 18569 1 541 . 1 1 49 49 VAL HG22 H 1 0.856 0.010 . 2 . . . . 49 VAL HG22 . 18569 1 542 . 1 1 49 49 VAL HG23 H 1 0.856 0.010 . 2 . . . . 49 VAL HG23 . 18569 1 543 . 1 1 49 49 VAL CA C 13 60.855 0.100 . 1 . . . . 49 VAL CA . 18569 1 544 . 1 1 49 49 VAL CB C 13 33.735 0.100 . 1 . . . . 49 VAL CB . 18569 1 545 . 1 1 49 49 VAL CG1 C 13 21.571 0.100 . 2 . . . . 49 VAL CG1 . 18569 1 546 . 1 1 49 49 VAL CG2 C 13 21.491 0.100 . 2 . . . . 49 VAL CG2 . 18569 1 547 . 1 1 49 49 VAL N N 15 122.816 0.050 . 1 . . . . 49 VAL N . 18569 1 548 . 1 1 50 50 VAL H H 1 8.880 0.010 . 1 . . . . 50 VAL H . 18569 1 549 . 1 1 50 50 VAL HA H 1 5.103 0.010 . 1 . . . . 50 VAL HA . 18569 1 550 . 1 1 50 50 VAL HB H 1 2.033 0.010 . 1 . . . . 50 VAL HB . 18569 1 551 . 1 1 50 50 VAL HG11 H 1 1.040 0.010 . 2 . . . . 50 VAL HG11 . 18569 1 552 . 1 1 50 50 VAL HG12 H 1 1.040 0.010 . 2 . . . . 50 VAL HG12 . 18569 1 553 . 1 1 50 50 VAL HG13 H 1 1.040 0.010 . 2 . . . . 50 VAL HG13 . 18569 1 554 . 1 1 50 50 VAL HG21 H 1 0.860 0.010 . 2 . . . . 50 VAL HG21 . 18569 1 555 . 1 1 50 50 VAL HG22 H 1 0.860 0.010 . 2 . . . . 50 VAL HG22 . 18569 1 556 . 1 1 50 50 VAL HG23 H 1 0.860 0.010 . 2 . . . . 50 VAL HG23 . 18569 1 557 . 1 1 50 50 VAL CA C 13 60.446 0.100 . 1 . . . . 50 VAL CA . 18569 1 558 . 1 1 50 50 VAL CB C 13 35.446 0.100 . 1 . . . . 50 VAL CB . 18569 1 559 . 1 1 50 50 VAL CG1 C 13 21.001 0.100 . 2 . . . . 50 VAL CG1 . 18569 1 560 . 1 1 50 50 VAL CG2 C 13 21.619 0.100 . 2 . . . . 50 VAL CG2 . 18569 1 561 . 1 1 50 50 VAL N N 15 125.227 0.050 . 1 . . . . 50 VAL N . 18569 1 562 . 1 1 51 51 GLY H H 1 9.055 0.010 . 1 . . . . 51 GLY H . 18569 1 563 . 1 1 51 51 GLY HA2 H 1 3.131 0.010 . 2 . . . . 51 GLY HA2 . 18569 1 564 . 1 1 51 51 GLY HA3 H 1 5.761 0.010 . 2 . . . . 51 GLY HA3 . 18569 1 565 . 1 1 51 51 GLY CA C 13 44.938 0.100 . 1 . . . . 51 GLY CA . 18569 1 566 . 1 1 51 51 GLY N N 15 116.065 0.050 . 1 . . . . 51 GLY N . 18569 1 567 . 1 1 52 52 ARG H H 1 8.132 0.010 . 1 . . . . 52 ARG H . 18569 1 568 . 1 1 52 52 ARG HA H 1 5.403 0.010 . 1 . . . . 52 ARG HA . 18569 1 569 . 1 1 52 52 ARG HB2 H 1 1.574 0.010 . 2 . . . . 52 ARG HB2 . 18569 1 570 . 1 1 52 52 ARG HB3 H 1 1.703 0.010 . 2 . . . . 52 ARG HB3 . 18569 1 571 . 1 1 52 52 ARG HG2 H 1 1.665 0.010 . 1 . . . . 52 ARG HG2 . 18569 1 572 . 1 1 52 52 ARG HG3 H 1 1.665 0.010 . 1 . . . . 52 ARG HG3 . 18569 1 573 . 1 1 52 52 ARG HD2 H 1 3.269 0.010 . 2 . . . . 52 ARG HD2 . 18569 1 574 . 1 1 52 52 ARG HD3 H 1 3.269 0.010 . 2 . . . . 52 ARG HD3 . 18569 1 575 . 1 1 52 52 ARG HE H 1 7.382 0.010 . 2 . . . . 52 ARG HE . 18569 1 576 . 1 1 52 52 ARG CA C 13 53.916 0.100 . 1 . . . . 52 ARG CA . 18569 1 577 . 1 1 52 52 ARG CB C 13 33.805 0.100 . 1 . . . . 52 ARG CB . 18569 1 578 . 1 1 52 52 ARG CG C 13 28.428 0.100 . 1 . . . . 52 ARG CG . 18569 1 579 . 1 1 52 52 ARG CD C 13 43.672 0.100 . 1 . . . . 52 ARG CD . 18569 1 580 . 1 1 52 52 ARG N N 15 123.679 0.050 . 1 . . . . 52 ARG N . 18569 1 581 . 1 1 52 52 ARG NE N 15 85.15 0.050 . 1 . . . . 52 ARG NE . 18569 1 582 . 1 1 53 53 LYS H H 1 9.187 0.010 . 1 . . . . 53 LYS H . 18569 1 583 . 1 1 53 53 LYS HA H 1 4.561 0.010 . 1 . . . . 53 LYS HA . 18569 1 584 . 1 1 53 53 LYS HB2 H 1 1.476 0.010 . 2 . . . . 53 LYS HB2 . 18569 1 585 . 1 1 53 53 LYS HB3 H 1 1.741 0.010 . 2 . . . . 53 LYS HB3 . 18569 1 586 . 1 1 53 53 LYS HG2 H 1 1.212 0.010 . 2 . . . . 53 LYS HG2 . 18569 1 587 . 1 1 53 53 LYS HG3 H 1 1.700 0.010 . 2 . . . . 53 LYS HG3 . 18569 1 588 . 1 1 53 53 LYS HD2 H 1 1.319 0.010 . 1 . . . . 53 LYS HD2 . 18569 1 589 . 1 1 53 53 LYS HD3 H 1 1.319 0.010 . 1 . . . . 53 LYS HD3 . 18569 1 590 . 1 1 53 53 LYS HE2 H 1 2.900 0.010 . 2 . . . . 53 LYS HE2 . 18569 1 591 . 1 1 53 53 LYS HE3 H 1 3.021 0.010 . 2 . . . . 53 LYS HE3 . 18569 1 592 . 1 1 53 53 LYS CA C 13 58.252 0.100 . 1 . . . . 53 LYS CA . 18569 1 593 . 1 1 53 53 LYS CB C 13 34.989 0.100 . 1 . . . . 53 LYS CB . 18569 1 594 . 1 1 53 53 LYS CG C 13 26.649 0.100 . 1 . . . . 53 LYS CG . 18569 1 595 . 1 1 53 53 LYS CD C 13 28.131 0.100 . 1 . . . . 53 LYS CD . 18569 1 596 . 1 1 53 53 LYS CE C 13 42.354 0.100 . 1 . . . . 53 LYS CE . 18569 1 597 . 1 1 53 53 LYS N N 15 125.424 0.050 . 1 . . . . 53 LYS N . 18569 1 598 . 1 1 54 54 MET H H 1 8.933 0.010 . 1 . . . . 54 MET H . 18569 1 599 . 1 1 54 54 MET HA H 1 4.548 0.010 . 1 . . . . 54 MET HA . 18569 1 600 . 1 1 54 54 MET HB2 H 1 1.948 0.010 . 2 . . . . 54 MET HB2 . 18569 1 601 . 1 1 54 54 MET HB3 H 1 2.202 0.010 . 2 . . . . 54 MET HB3 . 18569 1 602 . 1 1 54 54 MET HG2 H 1 2.531 0.010 . 1 . . . . 54 MET HG2 . 18569 1 603 . 1 1 54 54 MET HG3 H 1 2.531 0.010 . 1 . . . . 54 MET HG3 . 18569 1 604 . 1 1 54 54 MET HE1 H 1 2.055 0.010 . 1 . . . . 54 MET HE1 . 18569 1 605 . 1 1 54 54 MET HE2 H 1 2.055 0.010 . 1 . . . . 54 MET HE2 . 18569 1 606 . 1 1 54 54 MET HE3 H 1 2.055 0.010 . 1 . . . . 54 MET HE3 . 18569 1 607 . 1 1 54 54 MET CA C 13 55.343 0.100 . 1 . . . . 54 MET CA . 18569 1 608 . 1 1 54 54 MET CB C 13 30.261 0.100 . 1 . . . . 54 MET CB . 18569 1 609 . 1 1 54 54 MET CG C 13 34.307 0.100 . 1 . . . . 54 MET CG . 18569 1 610 . 1 1 54 54 MET CE C 13 16.902 0.100 . 1 . . . . 54 MET CE . 18569 1 611 . 1 1 54 54 MET N N 15 122.493 0.050 . 1 . . . . 54 MET N . 18569 1 612 . 1 1 55 55 GLN H H 1 8.292 0.010 . 1 . . . . 55 GLN H . 18569 1 613 . 1 1 55 55 GLN HA H 1 4.906 0.010 . 1 . . . . 55 GLN HA . 18569 1 614 . 1 1 55 55 GLN HB2 H 1 1.984 0.010 . 2 . . . . 55 GLN HB2 . 18569 1 615 . 1 1 55 55 GLN HB3 H 1 2.257 0.010 . 2 . . . . 55 GLN HB3 . 18569 1 616 . 1 1 55 55 GLN HG2 H 1 2.050 0.010 . 2 . . . . 55 GLN HG2 . 18569 1 617 . 1 1 55 55 GLN HG3 H 1 2.327 0.010 . 2 . . . . 55 GLN HG3 . 18569 1 618 . 1 1 55 55 GLN HE21 H 1 8.734 0.010 . 1 . . . . 55 GLN HE21 . 18569 1 619 . 1 1 55 55 GLN HE22 H 1 6.738 0.010 . 1 . . . . 55 GLN HE22 . 18569 1 620 . 1 1 55 55 GLN CA C 13 53.167 0.100 . 1 . . . . 55 GLN CA . 18569 1 621 . 1 1 55 55 GLN CB C 13 28.859 0.100 . 1 . . . . 55 GLN CB . 18569 1 622 . 1 1 55 55 GLN CG C 13 32.406 0.100 . 1 . . . . 55 GLN CG . 18569 1 623 . 1 1 55 55 GLN N N 15 120.554 0.050 . 1 . . . . 55 GLN N . 18569 1 624 . 1 1 55 55 GLN NE2 N 15 114.347 0.050 . 1 . . . . 55 GLN NE2 . 18569 1 625 . 1 1 56 56 PRO HA H 1 4.282 0.010 . 1 . . . . 56 PRO HA . 18569 1 626 . 1 1 56 56 PRO HB2 H 1 1.978 0.010 . 2 . . . . 56 PRO HB2 . 18569 1 627 . 1 1 56 56 PRO HB3 H 1 2.419 0.010 . 2 . . . . 56 PRO HB3 . 18569 1 628 . 1 1 56 56 PRO HG2 H 1 2.196 0.010 . 1 . . . . 56 PRO HG2 . 18569 1 629 . 1 1 56 56 PRO HG3 H 1 2.196 0.010 . 1 . . . . 56 PRO HG3 . 18569 1 630 . 1 1 56 56 PRO HD2 H 1 3.760 0.010 . 2 . . . . 56 PRO HD2 . 18569 1 631 . 1 1 56 56 PRO HD3 H 1 3.838 0.010 . 2 . . . . 56 PRO HD3 . 18569 1 632 . 1 1 56 56 PRO CA C 13 66.814 0.100 . 1 . . . . 56 PRO CA . 18569 1 633 . 1 1 56 56 PRO CB C 13 31.993 0.100 . 1 . . . . 56 PRO CB . 18569 1 634 . 1 1 56 56 PRO CG C 13 27.711 0.100 . 1 . . . . 56 PRO CG . 18569 1 635 . 1 1 56 56 PRO CD C 13 50.518 0.100 . 1 . . . . 56 PRO CD . 18569 1 636 . 1 1 57 57 ASP H H 1 8.258 0.010 . 1 . . . . 57 ASP H . 18569 1 637 . 1 1 57 57 ASP HA H 1 4.419 0.010 . 1 . . . . 57 ASP HA . 18569 1 638 . 1 1 57 57 ASP HB2 H 1 2.651 0.010 . 2 . . . . 57 ASP HB2 . 18569 1 639 . 1 1 57 57 ASP HB3 H 1 2.965 0.010 . 2 . . . . 57 ASP HB3 . 18569 1 640 . 1 1 57 57 ASP CA C 13 54.317 0.100 . 1 . . . . 57 ASP CA . 18569 1 641 . 1 1 57 57 ASP CB C 13 39.780 0.100 . 1 . . . . 57 ASP CB . 18569 1 642 . 1 1 57 57 ASP N N 15 113.244 0.050 . 1 . . . . 57 ASP N . 18569 1 643 . 1 1 58 58 GLN H H 1 8.384 0.010 . 1 . . . . 58 GLN H . 18569 1 644 . 1 1 58 58 GLN HA H 1 4.547 0.010 . 1 . . . . 58 GLN HA . 18569 1 645 . 1 1 58 58 GLN HB2 H 1 2.146 0.010 . 2 . . . . 58 GLN HB2 . 18569 1 646 . 1 1 58 58 GLN HB3 H 1 2.200 0.010 . 2 . . . . 58 GLN HB3 . 18569 1 647 . 1 1 58 58 GLN HG2 H 1 2.438 0.010 . 1 . . . . 58 GLN HG2 . 18569 1 648 . 1 1 58 58 GLN HG3 H 1 2.438 0.010 . 1 . . . . 58 GLN HG3 . 18569 1 649 . 1 1 58 58 GLN HE21 H 1 7.431 0.010 . 1 . . . . 58 GLN HE21 . 18569 1 650 . 1 1 58 58 GLN HE22 H 1 6.778 0.010 . 1 . . . . 58 GLN HE22 . 18569 1 651 . 1 1 58 58 GLN CA C 13 55.909 0.100 . 1 . . . . 58 GLN CA . 18569 1 652 . 1 1 58 58 GLN CB C 13 28.063 0.100 . 1 . . . . 58 GLN CB . 18569 1 653 . 1 1 58 58 GLN CG C 13 31.916 0.100 . 1 . . . . 58 GLN CG . 18569 1 654 . 1 1 58 58 GLN N N 15 116.233 0.050 . 1 . . . . 58 GLN N . 18569 1 655 . 1 1 58 58 GLN NE2 N 15 112.474 0.050 . 1 . . . . 58 GLN NE2 . 18569 1 656 . 1 1 59 59 GLN H H 1 7.490 0.010 . 1 . . . . 59 GLN H . 18569 1 657 . 1 1 59 59 GLN HA H 1 3.904 0.010 . 1 . . . . 59 GLN HA . 18569 1 658 . 1 1 59 59 GLN HB2 H 1 1.768 0.010 . 2 . . . . 59 GLN HB2 . 18569 1 659 . 1 1 59 59 GLN HB3 H 1 2.168 0.010 . 2 . . . . 59 GLN HB3 . 18569 1 660 . 1 1 59 59 GLN HG2 H 1 2.002 0.010 . 2 . . . . 59 GLN HG2 . 18569 1 661 . 1 1 59 59 GLN HG3 H 1 2.396 0.010 . 2 . . . . 59 GLN HG3 . 18569 1 662 . 1 1 59 59 GLN HE21 H 1 7.770 0.010 . 1 . . . . 59 GLN HE21 . 18569 1 663 . 1 1 59 59 GLN HE22 H 1 7.071 0.010 . 1 . . . . 59 GLN HE22 . 18569 1 664 . 1 1 59 59 GLN CA C 13 57.511 0.100 . 1 . . . . 59 GLN CA . 18569 1 665 . 1 1 59 59 GLN CB C 13 31.176 0.100 . 1 . . . . 59 GLN CB . 18569 1 666 . 1 1 59 59 GLN CG C 13 34.396 0.100 . 1 . . . . 59 GLN CG . 18569 1 667 . 1 1 59 59 GLN N N 15 116.333 0.050 . 1 . . . . 59 GLN N . 18569 1 668 . 1 1 59 59 GLN NE2 N 15 111.777 0.050 . 1 . . . . 59 GLN NE2 . 18569 1 669 . 1 1 60 60 VAL H H 1 8.791 0.010 . 1 . . . . 60 VAL H . 18569 1 670 . 1 1 60 60 VAL HA H 1 4.491 0.010 . 1 . . . . 60 VAL HA . 18569 1 671 . 1 1 60 60 VAL HB H 1 2.117 0.010 . 1 . . . . 60 VAL HB . 18569 1 672 . 1 1 60 60 VAL HG11 H 1 1.128 0.010 . 2 . . . . 60 VAL HG11 . 18569 1 673 . 1 1 60 60 VAL HG12 H 1 1.128 0.010 . 2 . . . . 60 VAL HG12 . 18569 1 674 . 1 1 60 60 VAL HG13 H 1 1.128 0.010 . 2 . . . . 60 VAL HG13 . 18569 1 675 . 1 1 60 60 VAL HG21 H 1 0.989 0.010 . 2 . . . . 60 VAL HG21 . 18569 1 676 . 1 1 60 60 VAL HG22 H 1 0.989 0.010 . 2 . . . . 60 VAL HG22 . 18569 1 677 . 1 1 60 60 VAL HG23 H 1 0.989 0.010 . 2 . . . . 60 VAL HG23 . 18569 1 678 . 1 1 60 60 VAL CA C 13 63.331 0.100 . 1 . . . . 60 VAL CA . 18569 1 679 . 1 1 60 60 VAL CB C 13 31.763 0.100 . 1 . . . . 60 VAL CB . 18569 1 680 . 1 1 60 60 VAL CG1 C 13 21.832 0.100 . 2 . . . . 60 VAL CG1 . 18569 1 681 . 1 1 60 60 VAL CG2 C 13 21.610 0.100 . 2 . . . . 60 VAL CG2 . 18569 1 682 . 1 1 60 60 VAL N N 15 127.343 0.050 . 1 . . . . 60 VAL N . 18569 1 683 . 1 1 61 61 VAL H H 1 8.433 0.010 . 1 . . . . 61 VAL H . 18569 1 684 . 1 1 61 61 VAL HA H 1 4.525 0.010 . 1 . . . . 61 VAL HA . 18569 1 685 . 1 1 61 61 VAL HB H 1 2.121 0.010 . 1 . . . . 61 VAL HB . 18569 1 686 . 1 1 61 61 VAL HG11 H 1 0.949 0.010 . 2 . . . . 61 VAL HG11 . 18569 1 687 . 1 1 61 61 VAL HG12 H 1 0.949 0.010 . 2 . . . . 61 VAL HG12 . 18569 1 688 . 1 1 61 61 VAL HG13 H 1 0.949 0.010 . 2 . . . . 61 VAL HG13 . 18569 1 689 . 1 1 61 61 VAL HG21 H 1 0.782 0.010 . 2 . . . . 61 VAL HG21 . 18569 1 690 . 1 1 61 61 VAL HG22 H 1 0.782 0.010 . 2 . . . . 61 VAL HG22 . 18569 1 691 . 1 1 61 61 VAL HG23 H 1 0.782 0.010 . 2 . . . . 61 VAL HG23 . 18569 1 692 . 1 1 61 61 VAL CA C 13 61.194 0.100 . 1 . . . . 61 VAL CA . 18569 1 693 . 1 1 61 61 VAL CB C 13 33.183 0.100 . 1 . . . . 61 VAL CB . 18569 1 694 . 1 1 61 61 VAL CG1 C 13 23.709 0.100 . 2 . . . . 61 VAL CG1 . 18569 1 695 . 1 1 61 61 VAL CG2 C 13 19.154 0.100 . 2 . . . . 61 VAL CG2 . 18569 1 696 . 1 1 61 61 VAL N N 15 120.590 0.050 . 1 . . . . 61 VAL N . 18569 1 697 . 1 1 62 62 ILE H H 1 7.259 0.010 . 1 . . . . 62 ILE H . 18569 1 698 . 1 1 62 62 ILE HA H 1 4.134 0.010 . 1 . . . . 62 ILE HA . 18569 1 699 . 1 1 62 62 ILE HB H 1 1.491 0.010 . 1 . . . . 62 ILE HB . 18569 1 700 . 1 1 62 62 ILE HG12 H 1 0.130 0.010 . 2 . . . . 62 ILE HG12 . 18569 1 701 . 1 1 62 62 ILE HG13 H 1 0.383 0.010 . 2 . . . . 62 ILE HG13 . 18569 1 702 . 1 1 62 62 ILE HG21 H 1 0.606 0.010 . 1 . . . . 62 ILE HG21 . 18569 1 703 . 1 1 62 62 ILE HG22 H 1 0.606 0.010 . 1 . . . . 62 ILE HG22 . 18569 1 704 . 1 1 62 62 ILE HG23 H 1 0.606 0.010 . 1 . . . . 62 ILE HG23 . 18569 1 705 . 1 1 62 62 ILE HD11 H 1 -0.129 0.010 . 1 . . . . 62 ILE HD11 . 18569 1 706 . 1 1 62 62 ILE HD12 H 1 -0.129 0.010 . 1 . . . . 62 ILE HD12 . 18569 1 707 . 1 1 62 62 ILE HD13 H 1 -0.129 0.010 . 1 . . . . 62 ILE HD13 . 18569 1 708 . 1 1 62 62 ILE CA C 13 60.662 0.100 . 1 . . . . 62 ILE CA . 18569 1 709 . 1 1 62 62 ILE CB C 13 39.273 0.100 . 1 . . . . 62 ILE CB . 18569 1 710 . 1 1 62 62 ILE CG1 C 13 28.118 0.100 . 1 . . . . 62 ILE CG1 . 18569 1 711 . 1 1 62 62 ILE CG2 C 13 14.929 0.100 . 1 . . . . 62 ILE CG2 . 18569 1 712 . 1 1 62 62 ILE CD1 C 13 13.508 0.100 . 1 . . . . 62 ILE CD1 . 18569 1 713 . 1 1 62 62 ILE N N 15 116.906 0.050 . 1 . . . . 62 ILE N . 18569 1 714 . 1 1 63 63 ASN H H 1 8.178 0.010 . 1 . . . . 63 ASN H . 18569 1 715 . 1 1 63 63 ASN HA H 1 5.445 0.010 . 1 . . . . 63 ASN HA . 18569 1 716 . 1 1 63 63 ASN HB2 H 1 2.655 0.010 . 2 . . . . 63 ASN HB2 . 18569 1 717 . 1 1 63 63 ASN HB3 H 1 2.875 0.010 . 2 . . . . 63 ASN HB3 . 18569 1 718 . 1 1 63 63 ASN HD21 H 1 7.380 0.010 . 1 . . . . 63 ASN HD21 . 18569 1 719 . 1 1 63 63 ASN HD22 H 1 6.704 0.010 . 1 . . . . 63 ASN HD22 . 18569 1 720 . 1 1 63 63 ASN CA C 13 52.709 0.100 . 1 . . . . 63 ASN CA . 18569 1 721 . 1 1 63 63 ASN CB C 13 37.600 0.100 . 1 . . . . 63 ASN CB . 18569 1 722 . 1 1 63 63 ASN N N 15 125.561 0.050 . 1 . . . . 63 ASN N . 18569 1 723 . 1 1 63 63 ASN ND2 N 15 109.397 0.050 . 1 . . . . 63 ASN ND2 . 18569 1 724 . 1 1 64 64 CYS H H 1 8.896 0.010 . 1 . . . . 64 CYS H . 18569 1 725 . 1 1 64 64 CYS HA H 1 5.107 0.010 . 1 . . . . 64 CYS HA . 18569 1 726 . 1 1 64 64 CYS HB2 H 1 2.871 0.010 . 2 . . . . 64 CYS HB2 . 18569 1 727 . 1 1 64 64 CYS HB3 H 1 2.957 0.010 . 2 . . . . 64 CYS HB3 . 18569 1 728 . 1 1 64 64 CYS CA C 13 56.027 0.100 . 1 . . . . 64 CYS CA . 18569 1 729 . 1 1 64 64 CYS CB C 13 31.233 0.100 . 1 . . . . 64 CYS CB . 18569 1 730 . 1 1 64 64 CYS N N 15 120.238 0.050 . 1 . . . . 64 CYS N . 18569 1 731 . 1 1 65 65 ALA H H 1 8.890 0.010 . 1 . . . . 65 ALA H . 18569 1 732 . 1 1 65 65 ALA HA H 1 4.668 0.010 . 1 . . . . 65 ALA HA . 18569 1 733 . 1 1 65 65 ALA HB1 H 1 1.508 0.010 . 1 . . . . 65 ALA HB1 . 18569 1 734 . 1 1 65 65 ALA HB2 H 1 1.508 0.010 . 1 . . . . 65 ALA HB2 . 18569 1 735 . 1 1 65 65 ALA HB3 H 1 1.508 0.010 . 1 . . . . 65 ALA HB3 . 18569 1 736 . 1 1 65 65 ALA CA C 13 52.485 0.100 . 1 . . . . 65 ALA CA . 18569 1 737 . 1 1 65 65 ALA CB C 13 19.507 0.100 . 1 . . . . 65 ALA CB . 18569 1 738 . 1 1 65 65 ALA N N 15 127.393 0.050 . 1 . . . . 65 ALA N . 18569 1 739 . 1 1 66 66 ILE H H 1 8.216 0.010 . 1 . . . . 66 ILE H . 18569 1 740 . 1 1 66 66 ILE HA H 1 4.130 0.010 . 1 . . . . 66 ILE HA . 18569 1 741 . 1 1 66 66 ILE HB H 1 1.600 0.010 . 1 . . . . 66 ILE HB . 18569 1 742 . 1 1 66 66 ILE HG12 H 1 0.882 0.010 . 2 . . . . 66 ILE HG12 . 18569 1 743 . 1 1 66 66 ILE HG13 H 1 1.312 0.010 . 2 . . . . 66 ILE HG13 . 18569 1 744 . 1 1 66 66 ILE HG21 H 1 0.530 0.010 . 1 . . . . 66 ILE HG21 . 18569 1 745 . 1 1 66 66 ILE HG22 H 1 0.530 0.010 . 1 . . . . 66 ILE HG22 . 18569 1 746 . 1 1 66 66 ILE HG23 H 1 0.530 0.010 . 1 . . . . 66 ILE HG23 . 18569 1 747 . 1 1 66 66 ILE HD11 H 1 0.487 0.010 . 1 . . . . 66 ILE HD11 . 18569 1 748 . 1 1 66 66 ILE HD12 H 1 0.487 0.010 . 1 . . . . 66 ILE HD12 . 18569 1 749 . 1 1 66 66 ILE HD13 H 1 0.487 0.010 . 1 . . . . 66 ILE HD13 . 18569 1 750 . 1 1 66 66 ILE CA C 13 61.086 0.100 . 1 . . . . 66 ILE CA . 18569 1 751 . 1 1 66 66 ILE CB C 13 37.702 0.100 . 1 . . . . 66 ILE CB . 18569 1 752 . 1 1 66 66 ILE CG1 C 13 27.209 0.100 . 1 . . . . 66 ILE CG1 . 18569 1 753 . 1 1 66 66 ILE CG2 C 13 17.600 0.100 . 1 . . . . 66 ILE CG2 . 18569 1 754 . 1 1 66 66 ILE CD1 C 13 12.506 0.100 . 1 . . . . 66 ILE CD1 . 18569 1 755 . 1 1 66 66 ILE N N 15 123.527 0.050 . 1 . . . . 66 ILE N . 18569 1 756 . 1 1 67 67 VAL H H 1 6.834 0.010 . 1 . . . . 67 VAL H . 18569 1 757 . 1 1 67 67 VAL HA H 1 4.737 0.010 . 1 . . . . 67 VAL HA . 18569 1 758 . 1 1 67 67 VAL HB H 1 2.345 0.010 . 1 . . . . 67 VAL HB . 18569 1 759 . 1 1 67 67 VAL HG11 H 1 1.011 0.010 . 2 . . . . 67 VAL HG11 . 18569 1 760 . 1 1 67 67 VAL HG12 H 1 1.011 0.010 . 2 . . . . 67 VAL HG12 . 18569 1 761 . 1 1 67 67 VAL HG13 H 1 1.011 0.010 . 2 . . . . 67 VAL HG13 . 18569 1 762 . 1 1 67 67 VAL HG21 H 1 0.918 0.010 . 2 . . . . 67 VAL HG21 . 18569 1 763 . 1 1 67 67 VAL HG22 H 1 0.918 0.010 . 2 . . . . 67 VAL HG22 . 18569 1 764 . 1 1 67 67 VAL HG23 H 1 0.918 0.010 . 2 . . . . 67 VAL HG23 . 18569 1 765 . 1 1 67 67 VAL CA C 13 59.094 0.100 . 1 . . . . 67 VAL CA . 18569 1 766 . 1 1 67 67 VAL CB C 13 35.304 0.100 . 1 . . . . 67 VAL CB . 18569 1 767 . 1 1 67 67 VAL CG1 C 13 21.851 0.100 . 2 . . . . 67 VAL CG1 . 18569 1 768 . 1 1 67 67 VAL CG2 C 13 18.528 0.100 . 2 . . . . 67 VAL CG2 . 18569 1 769 . 1 1 67 67 VAL N N 15 118.360 0.050 . 1 . . . . 67 VAL N . 18569 1 770 . 1 1 68 68 ARG H H 1 8.486 0.010 . 1 . . . . 68 ARG H . 18569 1 771 . 1 1 68 68 ARG HA H 1 3.925 0.010 . 1 . . . . 68 ARG HA . 18569 1 772 . 1 1 68 68 ARG HB2 H 1 1.769 0.010 . 2 . . . . 68 ARG HB2 . 18569 1 773 . 1 1 68 68 ARG HB3 H 1 1.817 0.010 . 2 . . . . 68 ARG HB3 . 18569 1 774 . 1 1 68 68 ARG HG2 H 1 1.594 0.010 . 2 . . . . 68 ARG HG2 . 18569 1 775 . 1 1 68 68 ARG HG3 H 1 1.680 0.010 . 2 . . . . 68 ARG HG3 . 18569 1 776 . 1 1 68 68 ARG HD2 H 1 3.255 0.010 . 2 . . . . 68 ARG HD2 . 18569 1 777 . 1 1 68 68 ARG HD3 H 1 3.255 0.010 . 2 . . . . 68 ARG HD3 . 18569 1 778 . 1 1 68 68 ARG HE H 1 7.283 0.010 . 2 . . . . 68 ARG HE . 18569 1 779 . 1 1 68 68 ARG CA C 13 58.328 0.100 . 1 . . . . 68 ARG CA . 18569 1 780 . 1 1 68 68 ARG CB C 13 30.302 0.100 . 1 . . . . 68 ARG CB . 18569 1 781 . 1 1 68 68 ARG CG C 13 27.484 0.100 . 1 . . . . 68 ARG CG . 18569 1 782 . 1 1 68 68 ARG CD C 13 43.832 0.100 . 1 . . . . 68 ARG CD . 18569 1 783 . 1 1 68 68 ARG N N 15 120.016 0.050 . 1 . . . . 68 ARG N . 18569 1 784 . 1 1 68 68 ARG NE N 15 84.71 0.050 . 1 . . . . 68 ARG NE . 18569 1 785 . 1 1 69 69 GLY H H 1 9.050 0.010 . 1 . . . . 69 GLY H . 18569 1 786 . 1 1 69 69 GLY HA2 H 1 3.664 0.010 . 2 . . . . 69 GLY HA2 . 18569 1 787 . 1 1 69 69 GLY HA3 H 1 4.382 0.010 . 2 . . . . 69 GLY HA3 . 18569 1 788 . 1 1 69 69 GLY CA C 13 44.959 0.100 . 1 . . . . 69 GLY CA . 18569 1 789 . 1 1 69 69 GLY N N 15 113.924 0.050 . 1 . . . . 69 GLY N . 18569 1 790 . 1 1 70 70 VAL H H 1 7.529 0.010 . 1 . . . . 70 VAL H . 18569 1 791 . 1 1 70 70 VAL HA H 1 4.160 0.010 . 1 . . . . 70 VAL HA . 18569 1 792 . 1 1 70 70 VAL HB H 1 2.156 0.010 . 1 . . . . 70 VAL HB . 18569 1 793 . 1 1 70 70 VAL HG11 H 1 1.312 0.010 . 2 . . . . 70 VAL HG11 . 18569 1 794 . 1 1 70 70 VAL HG12 H 1 1.312 0.010 . 2 . . . . 70 VAL HG12 . 18569 1 795 . 1 1 70 70 VAL HG13 H 1 1.312 0.010 . 2 . . . . 70 VAL HG13 . 18569 1 796 . 1 1 70 70 VAL HG21 H 1 0.904 0.010 . 2 . . . . 70 VAL HG21 . 18569 1 797 . 1 1 70 70 VAL HG22 H 1 0.904 0.010 . 2 . . . . 70 VAL HG22 . 18569 1 798 . 1 1 70 70 VAL HG23 H 1 0.904 0.010 . 2 . . . . 70 VAL HG23 . 18569 1 799 . 1 1 70 70 VAL CA C 13 63.926 0.100 . 1 . . . . 70 VAL CA . 18569 1 800 . 1 1 70 70 VAL CB C 13 32.265 0.100 . 1 . . . . 70 VAL CB . 18569 1 801 . 1 1 70 70 VAL CG1 C 13 23.647 0.100 . 2 . . . . 70 VAL CG1 . 18569 1 802 . 1 1 70 70 VAL CG2 C 13 21.448 0.100 . 2 . . . . 70 VAL CG2 . 18569 1 803 . 1 1 70 70 VAL N N 15 121.635 0.050 . 1 . . . . 70 VAL N . 18569 1 804 . 1 1 71 71 LYS H H 1 8.471 0.010 . 1 . . . . 71 LYS H . 18569 1 805 . 1 1 71 71 LYS HA H 1 4.627 0.010 . 1 . . . . 71 LYS HA . 18569 1 806 . 1 1 71 71 LYS HB2 H 1 1.835 0.010 . 1 . . . . 71 LYS HB2 . 18569 1 807 . 1 1 71 71 LYS HB3 H 1 1.835 0.010 . 1 . . . . 71 LYS HB3 . 18569 1 808 . 1 1 71 71 LYS HG2 H 1 1.469 0.010 . 2 . . . . 71 LYS HG2 . 18569 1 809 . 1 1 71 71 LYS HG3 H 1 1.512 0.010 . 2 . . . . 71 LYS HG3 . 18569 1 810 . 1 1 71 71 LYS HD2 H 1 1.702 0.010 . 2 . . . . 71 LYS HD2 . 18569 1 811 . 1 1 71 71 LYS HD3 H 1 1.702 0.010 . 2 . . . . 71 LYS HD3 . 18569 1 812 . 1 1 71 71 LYS HE2 H 1 3.033 0.010 . 1 . . . . 71 LYS HE2 . 18569 1 813 . 1 1 71 71 LYS HE3 H 1 3.033 0.010 . 1 . . . . 71 LYS HE3 . 18569 1 814 . 1 1 71 71 LYS CA C 13 54.368 0.100 . 1 . . . . 71 LYS CA . 18569 1 815 . 1 1 71 71 LYS CB C 13 33.073 0.100 . 1 . . . . 71 LYS CB . 18569 1 816 . 1 1 71 71 LYS CG C 13 24.383 0.100 . 1 . . . . 71 LYS CG . 18569 1 817 . 1 1 71 71 LYS CD C 13 28.812 0.100 . 1 . . . . 71 LYS CD . 18569 1 818 . 1 1 71 71 LYS CE C 13 42.552 0.100 . 1 . . . . 71 LYS CE . 18569 1 819 . 1 1 71 71 LYS N N 15 126.505 0.050 . 1 . . . . 71 LYS N . 18569 1 820 . 1 1 72 72 TYR H H 1 8.761 0.010 . 1 . . . . 72 TYR H . 18569 1 821 . 1 1 72 72 TYR HA H 1 5.048 0.010 . 1 . . . . 72 TYR HA . 18569 1 822 . 1 1 72 72 TYR HB2 H 1 2.453 0.010 . 2 . . . . 72 TYR HB2 . 18569 1 823 . 1 1 72 72 TYR HB3 H 1 2.920 0.010 . 2 . . . . 72 TYR HB3 . 18569 1 824 . 1 1 72 72 TYR HD1 H 1 6.894 0.010 . 3 . . . . 72 TYR HD1 . 18569 1 825 . 1 1 72 72 TYR HD2 H 1 6.894 0.010 . 3 . . . . 72 TYR HD2 . 18569 1 826 . 1 1 72 72 TYR HE1 H 1 6.730 0.010 . 3 . . . . 72 TYR HE1 . 18569 1 827 . 1 1 72 72 TYR HE2 H 1 6.730 0.010 . 3 . . . . 72 TYR HE2 . 18569 1 828 . 1 1 72 72 TYR CA C 13 57.624 0.100 . 1 . . . . 72 TYR CA . 18569 1 829 . 1 1 72 72 TYR CB C 13 40.549 0.100 . 1 . . . . 72 TYR CB . 18569 1 830 . 1 1 72 72 TYR CD1 C 13 133.41 0.100 . 1 . . . . 72 TYR CD# . 18569 1 831 . 1 1 72 72 TYR CD2 C 13 133.41 0.100 . 1 . . . . 72 TYR CD# . 18569 1 832 . 1 1 72 72 TYR CE1 C 13 119.82 0.100 . 1 . . . . 72 TYR CE# . 18569 1 833 . 1 1 72 72 TYR CE2 C 13 119.82 0.100 . 1 . . . . 72 TYR CE# . 18569 1 834 . 1 1 72 72 TYR N N 15 128.275 0.050 . 1 . . . . 72 TYR N . 18569 1 835 . 1 1 73 73 ASN H H 1 9.140 0.010 . 1 . . . . 73 ASN H . 18569 1 836 . 1 1 73 73 ASN HA H 1 4.858 0.010 . 1 . . . . 73 ASN HA . 18569 1 837 . 1 1 73 73 ASN HB2 H 1 2.656 0.010 . 2 . . . . 73 ASN HB2 . 18569 1 838 . 1 1 73 73 ASN HB3 H 1 2.762 0.010 . 2 . . . . 73 ASN HB3 . 18569 1 839 . 1 1 73 73 ASN HD21 H 1 7.248 0.010 . 1 . . . . 73 ASN HD21 . 18569 1 840 . 1 1 73 73 ASN HD22 H 1 6.790 0.010 . 1 . . . . 73 ASN HD22 . 18569 1 841 . 1 1 73 73 ASN CA C 13 52.361 0.100 . 1 . . . . 73 ASN CA . 18569 1 842 . 1 1 73 73 ASN CB C 13 41.363 0.100 . 1 . . . . 73 ASN CB . 18569 1 843 . 1 1 73 73 ASN N N 15 127.063 0.050 . 1 . . . . 73 ASN N . 18569 1 844 . 1 1 73 73 ASN ND2 N 15 110.830 0.050 . 1 . . . . 73 ASN ND2 . 18569 1 845 . 1 1 74 74 GLN H H 1 8.780 0.010 . 1 . . . . 74 GLN H . 18569 1 846 . 1 1 74 74 GLN HA H 1 4.202 0.010 . 1 . . . . 74 GLN HA . 18569 1 847 . 1 1 74 74 GLN HB2 H 1 1.529 0.010 . 2 . . . . 74 GLN HB2 . 18569 1 848 . 1 1 74 74 GLN HB3 H 1 1.695 0.010 . 2 . . . . 74 GLN HB3 . 18569 1 849 . 1 1 74 74 GLN HG2 H 1 0.629 0.010 . 2 . . . . 74 GLN HG2 . 18569 1 850 . 1 1 74 74 GLN HG3 H 1 1.874 0.010 . 2 . . . . 74 GLN HG3 . 18569 1 851 . 1 1 74 74 GLN HE21 H 1 7.349 0.010 . 1 . . . . 74 GLN HE21 . 18569 1 852 . 1 1 74 74 GLN HE22 H 1 6.799 0.010 . 1 . . . . 74 GLN HE22 . 18569 1 853 . 1 1 74 74 GLN CA C 13 54.567 0.100 . 1 . . . . 74 GLN CA . 18569 1 854 . 1 1 74 74 GLN CB C 13 26.375 0.100 . 1 . . . . 74 GLN CB . 18569 1 855 . 1 1 74 74 GLN CG C 13 32.641 0.100 . 1 . . . . 74 GLN CG . 18569 1 856 . 1 1 74 74 GLN N N 15 125.736 0.050 . 1 . . . . 74 GLN N . 18569 1 857 . 1 1 74 74 GLN NE2 N 15 111.805 0.050 . 1 . . . . 74 GLN NE2 . 18569 1 858 . 1 1 75 75 ALA H H 1 7.752 0.010 . 1 . . . . 75 ALA H . 18569 1 859 . 1 1 75 75 ALA HA H 1 4.068 0.010 . 1 . . . . 75 ALA HA . 18569 1 860 . 1 1 75 75 ALA HB1 H 1 1.561 0.010 . 1 . . . . 75 ALA HB1 . 18569 1 861 . 1 1 75 75 ALA HB2 H 1 1.561 0.010 . 1 . . . . 75 ALA HB2 . 18569 1 862 . 1 1 75 75 ALA HB3 H 1 1.561 0.010 . 1 . . . . 75 ALA HB3 . 18569 1 863 . 1 1 75 75 ALA CA C 13 55.830 0.100 . 1 . . . . 75 ALA CA . 18569 1 864 . 1 1 75 75 ALA CB C 13 19.133 0.100 . 1 . . . . 75 ALA CB . 18569 1 865 . 1 1 75 75 ALA N N 15 129.805 0.050 . 1 . . . . 75 ALA N . 18569 1 866 . 1 1 76 76 THR H H 1 8.788 0.010 . 1 . . . . 76 THR H . 18569 1 867 . 1 1 76 76 THR HA H 1 4.868 0.010 . 1 . . . . 76 THR HA . 18569 1 868 . 1 1 76 76 THR HB H 1 4.740 0.010 . 1 . . . . 76 THR HB . 18569 1 869 . 1 1 76 76 THR HG21 H 1 1.308 0.010 . 1 . . . . 76 THR HG21 . 18569 1 870 . 1 1 76 76 THR HG22 H 1 1.308 0.010 . 1 . . . . 76 THR HG22 . 18569 1 871 . 1 1 76 76 THR HG23 H 1 1.308 0.010 . 1 . . . . 76 THR HG23 . 18569 1 872 . 1 1 76 76 THR CA C 13 59.097 0.100 . 1 . . . . 76 THR CA . 18569 1 873 . 1 1 76 76 THR CB C 13 69.684 0.100 . 1 . . . . 76 THR CB . 18569 1 874 . 1 1 76 76 THR CG2 C 13 21.845 0.100 . 1 . . . . 76 THR CG2 . 18569 1 875 . 1 1 76 76 THR N N 15 109.946 0.050 . 1 . . . . 76 THR N . 18569 1 876 . 1 1 77 77 PRO HA H 1 4.539 0.010 . 1 . . . . 77 PRO HA . 18569 1 877 . 1 1 77 77 PRO HB2 H 1 1.872 0.010 . 2 . . . . 77 PRO HB2 . 18569 1 878 . 1 1 77 77 PRO HB3 H 1 2.445 0.010 . 2 . . . . 77 PRO HB3 . 18569 1 879 . 1 1 77 77 PRO HD2 H 1 3.807 0.010 . 2 . . . . 77 PRO HD2 . 18569 1 880 . 1 1 77 77 PRO HD3 H 1 3.949 0.010 . 2 . . . . 77 PRO HD3 . 18569 1 881 . 1 1 77 77 PRO CA C 13 65.271 0.100 . 1 . . . . 77 PRO CA . 18569 1 882 . 1 1 77 77 PRO CB C 13 31.964 0.100 . 1 . . . . 77 PRO CB . 18569 1 883 . 1 1 77 77 PRO CD C 13 50.57 0.100 . 1 . . . . 77 PRO CD . 18569 1 884 . 1 1 78 78 ASN H H 1 7.836 0.010 . 1 . . . . 78 ASN H . 18569 1 885 . 1 1 78 78 ASN HA H 1 4.819 0.010 . 1 . . . . 78 ASN HA . 18569 1 886 . 1 1 78 78 ASN HB2 H 1 2.751 0.010 . 2 . . . . 78 ASN HB2 . 18569 1 887 . 1 1 78 78 ASN HB3 H 1 2.864 0.010 . 2 . . . . 78 ASN HB3 . 18569 1 888 . 1 1 78 78 ASN HD21 H 1 7.276 0.010 . 1 . . . . 78 ASN HD21 . 18569 1 889 . 1 1 78 78 ASN HD22 H 1 6.703 0.010 . 1 . . . . 78 ASN HD22 . 18569 1 890 . 1 1 78 78 ASN CA C 13 53.077 0.100 . 1 . . . . 78 ASN CA . 18569 1 891 . 1 1 78 78 ASN CB C 13 40.441 0.100 . 1 . . . . 78 ASN CB . 18569 1 892 . 1 1 78 78 ASN N N 15 109.677 0.050 . 1 . . . . 78 ASN N . 18569 1 893 . 1 1 78 78 ASN ND2 N 15 111.122 0.050 . 1 . . . . 78 ASN ND2 . 18569 1 894 . 1 1 79 79 PHE H H 1 7.910 0.010 . 1 . . . . 79 PHE H . 18569 1 895 . 1 1 79 79 PHE HA H 1 5.807 0.010 . 1 . . . . 79 PHE HA . 18569 1 896 . 1 1 79 79 PHE HB2 H 1 2.627 0.010 . 2 . . . . 79 PHE HB2 . 18569 1 897 . 1 1 79 79 PHE HB3 H 1 3.199 0.010 . 2 . . . . 79 PHE HB3 . 18569 1 898 . 1 1 79 79 PHE HD1 H 1 6.793 0.010 . 3 . . . . 79 PHE HD1 . 18569 1 899 . 1 1 79 79 PHE HD2 H 1 6.793 0.010 . 3 . . . . 79 PHE HD2 . 18569 1 900 . 1 1 79 79 PHE HE1 H 1 6.356 0.010 . 3 . . . . 79 PHE HE1 . 18569 1 901 . 1 1 79 79 PHE HE2 H 1 6.356 0.010 . 3 . . . . 79 PHE HE2 . 18569 1 902 . 1 1 79 79 PHE HZ H 1 6.546 0.010 . 1 . . . . 79 PHE HZ . 18569 1 903 . 1 1 79 79 PHE CA C 13 56.763 0.100 . 1 . . . . 79 PHE CA . 18569 1 904 . 1 1 79 79 PHE CB C 13 40.939 0.100 . 1 . . . . 79 PHE CB . 18569 1 905 . 1 1 79 79 PHE CD1 C 13 131.22 0.100 . 1 . . . . 79 PHE CD# . 18569 1 906 . 1 1 79 79 PHE CD2 C 13 131.22 0.100 . 1 . . . . 79 PHE CD# . 18569 1 907 . 1 1 79 79 PHE CE1 C 13 130.21 0.100 . 1 . . . . 79 PHE CE# . 18569 1 908 . 1 1 79 79 PHE CE2 C 13 130.21 0.100 . 1 . . . . 79 PHE CE# . 18569 1 909 . 1 1 79 79 PHE CZ C 13 131.102 0.100 . 1 . . . . 79 PHE CZ . 18569 1 910 . 1 1 79 79 PHE N N 15 123.290 0.050 . 1 . . . . 79 PHE N . 18569 1 911 . 1 1 80 80 HIS H H 1 8.095 0.010 . 1 . . . . 80 HIS H . 18569 1 912 . 1 1 80 80 HIS HA H 1 5.555 0.010 . 1 . . . . 80 HIS HA . 18569 1 913 . 1 1 80 80 HIS HB2 H 1 2.859 0.010 . 2 . . . . 80 HIS HB2 . 18569 1 914 . 1 1 80 80 HIS HB3 H 1 3.206 0.010 . 2 . . . . 80 HIS HB3 . 18569 1 915 . 1 1 80 80 HIS HD2 H 1 7.366 0.010 . 1 . . . . 80 HIS HD2 . 18569 1 916 . 1 1 80 80 HIS CA C 13 51.688 0.100 . 1 . . . . 80 HIS CA . 18569 1 917 . 1 1 80 80 HIS CB C 13 35.309 0.100 . 1 . . . . 80 HIS CB . 18569 1 918 . 1 1 80 80 HIS CD2 C 13 115.816 0.100 . 1 . . . . 80 HIS CD2 . 18569 1 919 . 1 1 80 80 HIS N N 15 126.291 0.050 . 1 . . . . 80 HIS N . 18569 1 920 . 1 1 81 81 GLN H H 1 8.822 0.010 . 1 . . . . 81 GLN H . 18569 1 921 . 1 1 81 81 GLN HA H 1 5.687 0.010 . 1 . . . . 81 GLN HA . 18569 1 922 . 1 1 81 81 GLN HB2 H 1 1.974 0.010 . 2 . . . . 81 GLN HB2 . 18569 1 923 . 1 1 81 81 GLN HB3 H 1 2.136 0.010 . 2 . . . . 81 GLN HB3 . 18569 1 924 . 1 1 81 81 GLN HG2 H 1 2.162 0.010 . 2 . . . . 81 GLN HG2 . 18569 1 925 . 1 1 81 81 GLN HG3 H 1 2.162 0.010 . 2 . . . . 81 GLN HG3 . 18569 1 926 . 1 1 81 81 GLN HE21 H 1 6.684 0.010 . 1 . . . . 81 GLN HE21 . 18569 1 927 . 1 1 81 81 GLN HE22 H 1 6.542 0.010 . 1 . . . . 81 GLN HE22 . 18569 1 928 . 1 1 81 81 GLN CA C 13 54.252 0.100 . 1 . . . . 81 GLN CA . 18569 1 929 . 1 1 81 81 GLN CB C 13 33.853 0.100 . 1 . . . . 81 GLN CB . 18569 1 930 . 1 1 81 81 GLN CG C 13 34.022 0.100 . 1 . . . . 81 GLN CG . 18569 1 931 . 1 1 81 81 GLN N N 15 115.637 0.050 . 1 . . . . 81 GLN N . 18569 1 932 . 1 1 81 81 GLN NE2 N 15 108.975 0.050 . 1 . . . . 81 GLN NE2 . 18569 1 933 . 1 1 82 82 TRP H H 1 9.103 0.010 . 1 . . . . 82 TRP H . 18569 1 934 . 1 1 82 82 TRP HA H 1 5.346 0.010 . 1 . . . . 82 TRP HA . 18569 1 935 . 1 1 82 82 TRP HB2 H 1 3.197 0.010 . 2 . . . . 82 TRP HB2 . 18569 1 936 . 1 1 82 82 TRP HB3 H 1 3.651 0.010 . 2 . . . . 82 TRP HB3 . 18569 1 937 . 1 1 82 82 TRP HD1 H 1 7.031 0.010 . 1 . . . . 82 TRP HD1 . 18569 1 938 . 1 1 82 82 TRP HE1 H 1 9.974 0.010 . 1 . . . . 82 TRP HE1 . 18569 1 939 . 1 1 82 82 TRP HE3 H 1 7.412 0.010 . 1 . . . . 82 TRP HE3 . 18569 1 940 . 1 1 82 82 TRP HZ2 H 1 6.888 0.010 . 1 . . . . 82 TRP HZ2 . 18569 1 941 . 1 1 82 82 TRP HZ3 H 1 6.892 0.010 . 1 . . . . 82 TRP HZ3 . 18569 1 942 . 1 1 82 82 TRP HH2 H 1 6.663 0.010 . 1 . . . . 82 TRP HH2 . 18569 1 943 . 1 1 82 82 TRP CA C 13 57.803 0.100 . 1 . . . . 82 TRP CA . 18569 1 944 . 1 1 82 82 TRP CB C 13 32.955 0.100 . 1 . . . . 82 TRP CB . 18569 1 945 . 1 1 82 82 TRP CD1 C 13 126.567 0.100 . 1 . . . . 82 TRP CD1 . 18569 1 946 . 1 1 82 82 TRP CE3 C 13 121.627 0.100 . 1 . . . . 82 TRP CE3 . 18569 1 947 . 1 1 82 82 TRP CZ2 C 13 114.043 0.100 . 1 . . . . 82 TRP CZ2 . 18569 1 948 . 1 1 82 82 TRP CZ3 C 13 121.594 0.100 . 1 . . . . 82 TRP CZ3 . 18569 1 949 . 1 1 82 82 TRP CH2 C 13 122.769 0.100 . 1 . . . . 82 TRP CH2 . 18569 1 950 . 1 1 82 82 TRP N N 15 119.786 0.050 . 1 . . . . 82 TRP N . 18569 1 951 . 1 1 82 82 TRP NE1 N 15 128.171 0.050 . 1 . . . . 82 TRP NE1 . 18569 1 952 . 1 1 83 83 ARG H H 1 8.470 0.010 . 1 . . . . 83 ARG H . 18569 1 953 . 1 1 83 83 ARG HA H 1 5.228 0.010 . 1 . . . . 83 ARG HA . 18569 1 954 . 1 1 83 83 ARG HB2 H 1 1.861 0.010 . 2 . . . . 83 ARG HB2 . 18569 1 955 . 1 1 83 83 ARG HB3 H 1 1.939 0.010 . 2 . . . . 83 ARG HB3 . 18569 1 956 . 1 1 83 83 ARG HG2 H 1 1.606 0.010 . 2 . . . . 83 ARG HG2 . 18569 1 957 . 1 1 83 83 ARG HG3 H 1 1.730 0.010 . 2 . . . . 83 ARG HG3 . 18569 1 958 . 1 1 83 83 ARG HD2 H 1 3.146 0.010 . 2 . . . . 83 ARG HD2 . 18569 1 959 . 1 1 83 83 ARG HD3 H 1 3.267 0.010 . 2 . . . . 83 ARG HD3 . 18569 1 960 . 1 1 83 83 ARG HE H 1 7.247 0.010 . 2 . . . . 83 ARG HE . 18569 1 961 . 1 1 83 83 ARG CA C 13 54.835 0.100 . 1 . . . . 83 ARG CA . 18569 1 962 . 1 1 83 83 ARG CB C 13 33.292 0.100 . 1 . . . . 83 ARG CB . 18569 1 963 . 1 1 83 83 ARG CG C 13 27.543 0.100 . 1 . . . . 83 ARG CG . 18569 1 964 . 1 1 83 83 ARG CD C 13 42.804 0.100 . 1 . . . . 83 ARG CD . 18569 1 965 . 1 1 83 83 ARG N N 15 120.043 0.050 . 1 . . . . 83 ARG N . 18569 1 966 . 1 1 83 83 ARG NE N 15 84.28 0.050 . 1 . . . . 83 ARG NE . 18569 1 967 . 1 1 84 84 ASP H H 1 8.941 0.010 . 1 . . . . 84 ASP H . 18569 1 968 . 1 1 84 84 ASP HA H 1 5.049 0.010 . 1 . . . . 84 ASP HA . 18569 1 969 . 1 1 84 84 ASP HB2 H 1 3.040 0.010 . 2 . . . . 84 ASP HB2 . 18569 1 970 . 1 1 84 84 ASP HB3 H 1 3.281 0.010 . 2 . . . . 84 ASP HB3 . 18569 1 971 . 1 1 84 84 ASP CA C 13 52.667 0.100 . 1 . . . . 84 ASP CA . 18569 1 972 . 1 1 84 84 ASP CB C 13 42.816 0.100 . 1 . . . . 84 ASP CB . 18569 1 973 . 1 1 84 84 ASP N N 15 126.637 0.050 . 1 . . . . 84 ASP N . 18569 1 974 . 1 1 85 85 ALA H H 1 8.518 0.010 . 1 . . . . 85 ALA H . 18569 1 975 . 1 1 85 85 ALA HA H 1 4.100 0.010 . 1 . . . . 85 ALA HA . 18569 1 976 . 1 1 85 85 ALA HB1 H 1 1.564 0.010 . 1 . . . . 85 ALA HB1 . 18569 1 977 . 1 1 85 85 ALA HB2 H 1 1.564 0.010 . 1 . . . . 85 ALA HB2 . 18569 1 978 . 1 1 85 85 ALA HB3 H 1 1.564 0.010 . 1 . . . . 85 ALA HB3 . 18569 1 979 . 1 1 85 85 ALA CA C 13 55.008 0.100 . 1 . . . . 85 ALA CA . 18569 1 980 . 1 1 85 85 ALA CB C 13 18.366 0.100 . 1 . . . . 85 ALA CB . 18569 1 981 . 1 1 85 85 ALA N N 15 121.368 0.050 . 1 . . . . 85 ALA N . 18569 1 982 . 1 1 86 86 ARG H H 1 8.644 0.010 . 1 . . . . 86 ARG H . 18569 1 983 . 1 1 86 86 ARG HA H 1 4.478 0.010 . 1 . . . . 86 ARG HA . 18569 1 984 . 1 1 86 86 ARG HB2 H 1 1.854 0.010 . 2 . . . . 86 ARG HB2 . 18569 1 985 . 1 1 86 86 ARG HB3 H 1 1.980 0.010 . 2 . . . . 86 ARG HB3 . 18569 1 986 . 1 1 86 86 ARG HG2 H 1 1.631 0.010 . 2 . . . . 86 ARG HG2 . 18569 1 987 . 1 1 86 86 ARG HG3 H 1 1.670 0.010 . 2 . . . . 86 ARG HG3 . 18569 1 988 . 1 1 86 86 ARG HD2 H 1 3.257 0.010 . 1 . . . . 86 ARG HD2 . 18569 1 989 . 1 1 86 86 ARG HD3 H 1 3.257 0.010 . 1 . . . . 86 ARG HD3 . 18569 1 990 . 1 1 86 86 ARG HE H 1 7.299 0.010 . 1 . . . . 86 ARG HE . 18569 1 991 . 1 1 86 86 ARG CA C 13 56.544 0.100 . 1 . . . . 86 ARG CA . 18569 1 992 . 1 1 86 86 ARG CB C 13 32.381 0.100 . 1 . . . . 86 ARG CB . 18569 1 993 . 1 1 86 86 ARG CG C 13 27.639 0.100 . 1 . . . . 86 ARG CG . 18569 1 994 . 1 1 86 86 ARG CD C 13 43.423 0.100 . 1 . . . . 86 ARG CD . 18569 1 995 . 1 1 86 86 ARG N N 15 116.981 0.050 . 1 . . . . 86 ARG N . 18569 1 996 . 1 1 86 86 ARG NE N 15 84.79 0.050 . 1 . . . . 86 ARG NE . 18569 1 997 . 1 1 87 87 GLN H H 1 8.618 0.010 . 1 . . . . 87 GLN H . 18569 1 998 . 1 1 87 87 GLN HA H 1 4.494 0.010 . 1 . . . . 87 GLN HA . 18569 1 999 . 1 1 87 87 GLN HB2 H 1 1.461 0.010 . 2 . . . . 87 GLN HB2 . 18569 1 1000 . 1 1 87 87 GLN HB3 H 1 1.767 0.010 . 2 . . . . 87 GLN HB3 . 18569 1 1001 . 1 1 87 87 GLN HG2 H 1 1.619 0.010 . 2 . . . . 87 GLN HG2 . 18569 1 1002 . 1 1 87 87 GLN HG3 H 1 1.945 0.010 . 2 . . . . 87 GLN HG3 . 18569 1 1003 . 1 1 87 87 GLN HE21 H 1 7.489 0.010 . 1 . . . . 87 GLN HE21 . 18569 1 1004 . 1 1 87 87 GLN HE22 H 1 6.700 0.010 . 1 . . . . 87 GLN HE22 . 18569 1 1005 . 1 1 87 87 GLN CA C 13 55.072 0.100 . 1 . . . . 87 GLN CA . 18569 1 1006 . 1 1 87 87 GLN CB C 13 31.909 0.100 . 1 . . . . 87 GLN CB . 18569 1 1007 . 1 1 87 87 GLN CG C 13 33.406 0.100 . 1 . . . . 87 GLN CG . 18569 1 1008 . 1 1 87 87 GLN N N 15 119.852 0.050 . 1 . . . . 87 GLN N . 18569 1 1009 . 1 1 87 87 GLN NE2 N 15 113.034 0.050 . 1 . . . . 87 GLN NE2 . 18569 1 1010 . 1 1 88 88 VAL H H 1 8.191 0.010 . 1 . . . . 88 VAL H . 18569 1 1011 . 1 1 88 88 VAL HA H 1 4.483 0.010 . 1 . . . . 88 VAL HA . 18569 1 1012 . 1 1 88 88 VAL HB H 1 1.791 0.010 . 1 . . . . 88 VAL HB . 18569 1 1013 . 1 1 88 88 VAL HG11 H 1 0.793 0.010 . 1 . . . . 88 VAL HG11 . 18569 1 1014 . 1 1 88 88 VAL HG12 H 1 0.793 0.010 . 1 . . . . 88 VAL HG12 . 18569 1 1015 . 1 1 88 88 VAL HG13 H 1 0.793 0.010 . 1 . . . . 88 VAL HG13 . 18569 1 1016 . 1 1 88 88 VAL HG21 H 1 0.793 0.010 . 1 . . . . 88 VAL HG21 . 18569 1 1017 . 1 1 88 88 VAL HG22 H 1 0.793 0.010 . 1 . . . . 88 VAL HG22 . 18569 1 1018 . 1 1 88 88 VAL HG23 H 1 0.793 0.010 . 1 . . . . 88 VAL HG23 . 18569 1 1019 . 1 1 88 88 VAL CA C 13 61.738 0.100 . 1 . . . . 88 VAL CA . 18569 1 1020 . 1 1 88 88 VAL CB C 13 32.668 0.100 . 1 . . . . 88 VAL CB . 18569 1 1021 . 1 1 88 88 VAL N N 15 121.512 0.050 . 1 . . . . 88 VAL N . 18569 1 1022 . 1 1 89 89 TRP H H 1 8.463 0.010 . 1 . . . . 89 TRP H . 18569 1 1023 . 1 1 89 89 TRP HA H 1 5.055 0.010 . 1 . . . . 89 TRP HA . 18569 1 1024 . 1 1 89 89 TRP HB2 H 1 1.334 0.010 . 2 . . . . 89 TRP HB2 . 18569 1 1025 . 1 1 89 89 TRP HB3 H 1 2.287 0.010 . 2 . . . . 89 TRP HB3 . 18569 1 1026 . 1 1 89 89 TRP HD1 H 1 6.393 0.010 . 1 . . . . 89 TRP HD1 . 18569 1 1027 . 1 1 89 89 TRP HE1 H 1 9.907 0.010 . 1 . . . . 89 TRP HE1 . 18569 1 1028 . 1 1 89 89 TRP HE3 H 1 7.442 0.010 . 1 . . . . 89 TRP HE3 . 18569 1 1029 . 1 1 89 89 TRP HZ2 H 1 7.304 0.010 . 1 . . . . 89 TRP HZ2 . 18569 1 1030 . 1 1 89 89 TRP HZ3 H 1 6.847 0.010 . 1 . . . . 89 TRP HZ3 . 18569 1 1031 . 1 1 89 89 TRP HH2 H 1 7.204 0.010 . 1 . . . . 89 TRP HH2 . 18569 1 1032 . 1 1 89 89 TRP CA C 13 55.654 0.100 . 1 . . . . 89 TRP CA . 18569 1 1033 . 1 1 89 89 TRP CB C 13 31.535 0.100 . 1 . . . . 89 TRP CB . 18569 1 1034 . 1 1 89 89 TRP CD1 C 13 126.274 0.100 . 1 . . . . 89 TRP CD1 . 18569 1 1035 . 1 1 89 89 TRP CE3 C 13 121.006 0.100 . 1 . . . . 89 TRP CE3 . 18569 1 1036 . 1 1 89 89 TRP CZ2 C 13 113.875 0.100 . 1 . . . . 89 TRP CZ2 . 18569 1 1037 . 1 1 89 89 TRP CZ3 C 13 121.853 0.100 . 1 . . . . 89 TRP CZ3 . 18569 1 1038 . 1 1 89 89 TRP CH2 C 13 123.939 0.100 . 1 . . . . 89 TRP CH2 . 18569 1 1039 . 1 1 89 89 TRP N N 15 127.545 0.050 . 1 . . . . 89 TRP N . 18569 1 1040 . 1 1 89 89 TRP NE1 N 15 127.618 0.050 . 1 . . . . 89 TRP NE1 . 18569 1 1041 . 1 1 90 90 GLY H H 1 8.948 0.010 . 1 . . . . 90 GLY H . 18569 1 1042 . 1 1 90 90 GLY HA2 H 1 2.878 0.010 . 2 . . . . 90 GLY HA2 . 18569 1 1043 . 1 1 90 90 GLY HA3 H 1 4.795 0.010 . 2 . . . . 90 GLY HA3 . 18569 1 1044 . 1 1 90 90 GLY CA C 13 44.355 0.100 . 1 . . . . 90 GLY CA . 18569 1 1045 . 1 1 90 90 GLY N N 15 106.599 0.050 . 1 . . . . 90 GLY N . 18569 1 1046 . 1 1 91 91 LEU H H 1 8.484 0.010 . 1 . . . . 91 LEU H . 18569 1 1047 . 1 1 91 91 LEU HA H 1 4.427 0.010 . 1 . . . . 91 LEU HA . 18569 1 1048 . 1 1 91 91 LEU HB2 H 1 -0.270 0.010 . 2 . . . . 91 LEU HB2 . 18569 1 1049 . 1 1 91 91 LEU HB3 H 1 1.139 0.010 . 2 . . . . 91 LEU HB3 . 18569 1 1050 . 1 1 91 91 LEU HG H 1 1.452 0.010 . 1 . . . . 91 LEU HG . 18569 1 1051 . 1 1 91 91 LEU HD11 H 1 0.530 0.010 . 2 . . . . 91 LEU HD11 . 18569 1 1052 . 1 1 91 91 LEU HD12 H 1 0.530 0.010 . 2 . . . . 91 LEU HD12 . 18569 1 1053 . 1 1 91 91 LEU HD13 H 1 0.530 0.010 . 2 . . . . 91 LEU HD13 . 18569 1 1054 . 1 1 91 91 LEU HD21 H 1 0.474 0.010 . 2 . . . . 91 LEU HD21 . 18569 1 1055 . 1 1 91 91 LEU HD22 H 1 0.474 0.010 . 2 . . . . 91 LEU HD22 . 18569 1 1056 . 1 1 91 91 LEU HD23 H 1 0.474 0.010 . 2 . . . . 91 LEU HD23 . 18569 1 1057 . 1 1 91 91 LEU CA C 13 52.646 0.100 . 1 . . . . 91 LEU CA . 18569 1 1058 . 1 1 91 91 LEU CB C 13 44.606 0.100 . 1 . . . . 91 LEU CB . 18569 1 1059 . 1 1 91 91 LEU CG C 13 27.123 0.100 . 1 . . . . 91 LEU CG . 18569 1 1060 . 1 1 91 91 LEU CD1 C 13 25.606 0.100 . 2 . . . . 91 LEU CD1 . 18569 1 1061 . 1 1 91 91 LEU CD2 C 13 27.355 0.100 . 2 . . . . 91 LEU CD2 . 18569 1 1062 . 1 1 91 91 LEU N N 15 121.864 0.050 . 1 . . . . 91 LEU N . 18569 1 1063 . 1 1 92 92 ASN H H 1 8.080 0.010 . 1 . . . . 92 ASN H . 18569 1 1064 . 1 1 92 92 ASN HA H 1 5.376 0.010 . 1 . . . . 92 ASN HA . 18569 1 1065 . 1 1 92 92 ASN HB2 H 1 2.238 0.010 . 2 . . . . 92 ASN HB2 . 18569 1 1066 . 1 1 92 92 ASN HB3 H 1 2.873 0.010 . 2 . . . . 92 ASN HB3 . 18569 1 1067 . 1 1 92 92 ASN HD21 H 1 7.067 0.010 . 1 . . . . 92 ASN HD21 . 18569 1 1068 . 1 1 92 92 ASN HD22 H 1 6.685 0.010 . 1 . . . . 92 ASN HD22 . 18569 1 1069 . 1 1 92 92 ASN CA C 13 50.977 0.100 . 1 . . . . 92 ASN CA . 18569 1 1070 . 1 1 92 92 ASN CB C 13 39.785 0.100 . 1 . . . . 92 ASN CB . 18569 1 1071 . 1 1 92 92 ASN N N 15 120.039 0.050 . 1 . . . . 92 ASN N . 18569 1 1072 . 1 1 92 92 ASN ND2 N 15 110.141 0.050 . 1 . . . . 92 ASN ND2 . 18569 1 1073 . 1 1 93 93 PHE H H 1 9.021 0.010 . 1 . . . . 93 PHE H . 18569 1 1074 . 1 1 93 93 PHE HA H 1 4.565 0.010 . 1 . . . . 93 PHE HA . 18569 1 1075 . 1 1 93 93 PHE HB2 H 1 2.815 0.010 . 2 . . . . 93 PHE HB2 . 18569 1 1076 . 1 1 93 93 PHE HB3 H 1 3.284 0.010 . 2 . . . . 93 PHE HB3 . 18569 1 1077 . 1 1 93 93 PHE HD1 H 1 7.176 0.010 . 3 . . . . 93 PHE HD1 . 18569 1 1078 . 1 1 93 93 PHE HD2 H 1 7.176 0.010 . 3 . . . . 93 PHE HD2 . 18569 1 1079 . 1 1 93 93 PHE HE1 H 1 7.297 0.010 . 3 . . . . 93 PHE HE1 . 18569 1 1080 . 1 1 93 93 PHE HE2 H 1 7.297 0.010 . 3 . . . . 93 PHE HE2 . 18569 1 1081 . 1 1 93 93 PHE CA C 13 59.816 0.100 . 1 . . . . 93 PHE CA . 18569 1 1082 . 1 1 93 93 PHE CB C 13 41.723 0.100 . 1 . . . . 93 PHE CB . 18569 1 1083 . 1 1 93 93 PHE CE1 C 13 130.56 0.100 . 1 . . . . 93 PHE CE# . 18569 1 1084 . 1 1 93 93 PHE CE2 C 13 130.56 0.100 . 1 . . . . 93 PHE CE# . 18569 1 1085 . 1 1 93 93 PHE N N 15 124.400 0.050 . 1 . . . . 93 PHE N . 18569 1 1086 . 1 1 94 94 GLY H H 1 9.178 0.010 . 1 . . . . 94 GLY H . 18569 1 1087 . 1 1 94 94 GLY HA2 H 1 3.582 0.010 . 2 . . . . 94 GLY HA2 . 18569 1 1088 . 1 1 94 94 GLY HA3 H 1 4.093 0.010 . 2 . . . . 94 GLY HA3 . 18569 1 1089 . 1 1 94 94 GLY CA C 13 46.362 0.100 . 1 . . . . 94 GLY CA . 18569 1 1090 . 1 1 94 94 GLY N N 15 107.350 0.050 . 1 . . . . 94 GLY N . 18569 1 1091 . 1 1 95 95 SER H H 1 7.621 0.010 . 1 . . . . 95 SER H . 18569 1 1092 . 1 1 95 95 SER HA H 1 4.841 0.010 . 1 . . . . 95 SER HA . 18569 1 1093 . 1 1 95 95 SER HB2 H 1 4.101 0.010 . 2 . . . . 95 SER HB2 . 18569 1 1094 . 1 1 95 95 SER HB3 H 1 4.284 0.010 . 2 . . . . 95 SER HB3 . 18569 1 1095 . 1 1 95 95 SER CA C 13 57.013 0.100 . 1 . . . . 95 SER CA . 18569 1 1096 . 1 1 95 95 SER CB C 13 66.501 0.100 . 1 . . . . 95 SER CB . 18569 1 1097 . 1 1 95 95 SER N N 15 110.313 0.050 . 1 . . . . 95 SER N . 18569 1 1098 . 1 1 96 96 LYS H H 1 9.119 0.010 . 1 . . . . 96 LYS H . 18569 1 1099 . 1 1 96 96 LYS HA H 1 4.171 0.010 . 1 . . . . 96 LYS HA . 18569 1 1100 . 1 1 96 96 LYS HB2 H 1 1.832 0.010 . 2 . . . . 96 LYS HB2 . 18569 1 1101 . 1 1 96 96 LYS HB3 H 1 1.925 0.010 . 2 . . . . 96 LYS HB3 . 18569 1 1102 . 1 1 96 96 LYS HG2 H 1 1.484 0.010 . 1 . . . . 96 LYS HG2 . 18569 1 1103 . 1 1 96 96 LYS HG3 H 1 1.484 0.010 . 1 . . . . 96 LYS HG3 . 18569 1 1104 . 1 1 96 96 LYS HD2 H 1 1.726 0.010 . 1 . . . . 96 LYS HD2 . 18569 1 1105 . 1 1 96 96 LYS HD3 H 1 1.726 0.010 . 1 . . . . 96 LYS HD3 . 18569 1 1106 . 1 1 96 96 LYS HE2 H 1 3.032 0.010 . 1 . . . . 96 LYS HE2 . 18569 1 1107 . 1 1 96 96 LYS HE3 H 1 3.032 0.010 . 1 . . . . 96 LYS HE3 . 18569 1 1108 . 1 1 96 96 LYS CA C 13 59.083 0.100 . 1 . . . . 96 LYS CA . 18569 1 1109 . 1 1 96 96 LYS CB C 13 32.053 0.100 . 1 . . . . 96 LYS CB . 18569 1 1110 . 1 1 96 96 LYS CG C 13 24.889 0.100 . 1 . . . . 96 LYS CG . 18569 1 1111 . 1 1 96 96 LYS CD C 13 29.423 0.100 . 1 . . . . 96 LYS CD . 18569 1 1112 . 1 1 96 96 LYS CE C 13 42.120 0.100 . 1 . . . . 96 LYS CE . 18569 1 1113 . 1 1 96 96 LYS N N 15 122.924 0.050 . 1 . . . . 96 LYS N . 18569 1 1114 . 1 1 97 97 GLU H H 1 8.869 0.010 . 1 . . . . 97 GLU H . 18569 1 1115 . 1 1 97 97 GLU HA H 1 4.098 0.010 . 1 . . . . 97 GLU HA . 18569 1 1116 . 1 1 97 97 GLU HB2 H 1 1.951 0.010 . 2 . . . . 97 GLU HB2 . 18569 1 1117 . 1 1 97 97 GLU HB3 H 1 2.116 0.010 . 2 . . . . 97 GLU HB3 . 18569 1 1118 . 1 1 97 97 GLU HG2 H 1 2.248 0.010 . 2 . . . . 97 GLU HG2 . 18569 1 1119 . 1 1 97 97 GLU HG3 H 1 2.502 0.010 . 2 . . . . 97 GLU HG3 . 18569 1 1120 . 1 1 97 97 GLU CA C 13 60.601 0.100 . 1 . . . . 97 GLU CA . 18569 1 1121 . 1 1 97 97 GLU CB C 13 28.533 0.100 . 1 . . . . 97 GLU CB . 18569 1 1122 . 1 1 97 97 GLU CG C 13 37.154 0.100 . 1 . . . . 97 GLU CG . 18569 1 1123 . 1 1 97 97 GLU N N 15 122.099 0.050 . 1 . . . . 97 GLU N . 18569 1 1124 . 1 1 98 98 ASP H H 1 7.871 0.010 . 1 . . . . 98 ASP H . 18569 1 1125 . 1 1 98 98 ASP HA H 1 4.431 0.010 . 1 . . . . 98 ASP HA . 18569 1 1126 . 1 1 98 98 ASP HB2 H 1 3.020 0.010 . 1 . . . . 98 ASP HB2 . 18569 1 1127 . 1 1 98 98 ASP HB3 H 1 3.020 0.010 . 1 . . . . 98 ASP HB3 . 18569 1 1128 . 1 1 98 98 ASP CA C 13 57.799 0.100 . 1 . . . . 98 ASP CA . 18569 1 1129 . 1 1 98 98 ASP CB C 13 42.138 0.100 . 1 . . . . 98 ASP CB . 18569 1 1130 . 1 1 98 98 ASP N N 15 120.720 0.050 . 1 . . . . 98 ASP N . 18569 1 1131 . 1 1 99 99 ALA H H 1 7.180 0.010 . 1 . . . . 99 ALA H . 18569 1 1132 . 1 1 99 99 ALA HA H 1 1.647 0.010 . 1 . . . . 99 ALA HA . 18569 1 1133 . 1 1 99 99 ALA HB1 H 1 1.013 0.010 . 1 . . . . 99 ALA HB1 . 18569 1 1134 . 1 1 99 99 ALA HB2 H 1 1.013 0.010 . 1 . . . . 99 ALA HB2 . 18569 1 1135 . 1 1 99 99 ALA HB3 H 1 1.013 0.010 . 1 . . . . 99 ALA HB3 . 18569 1 1136 . 1 1 99 99 ALA CA C 13 53.831 0.100 . 1 . . . . 99 ALA CA . 18569 1 1137 . 1 1 99 99 ALA CB C 13 19.855 0.100 . 1 . . . . 99 ALA CB . 18569 1 1138 . 1 1 99 99 ALA N N 15 122.763 0.050 . 1 . . . . 99 ALA N . 18569 1 1139 . 1 1 100 100 ALA H H 1 8.011 0.010 . 1 . . . . 100 ALA H . 18569 1 1140 . 1 1 100 100 ALA HA H 1 4.119 0.010 . 1 . . . . 100 ALA HA . 18569 1 1141 . 1 1 100 100 ALA HB1 H 1 1.492 0.010 . 1 . . . . 100 ALA HB1 . 18569 1 1142 . 1 1 100 100 ALA HB2 H 1 1.492 0.010 . 1 . . . . 100 ALA HB2 . 18569 1 1143 . 1 1 100 100 ALA HB3 H 1 1.492 0.010 . 1 . . . . 100 ALA HB3 . 18569 1 1144 . 1 1 100 100 ALA CA C 13 54.763 0.100 . 1 . . . . 100 ALA CA . 18569 1 1145 . 1 1 100 100 ALA CB C 13 18.200 0.100 . 1 . . . . 100 ALA CB . 18569 1 1146 . 1 1 100 100 ALA N N 15 119.657 0.050 . 1 . . . . 100 ALA N . 18569 1 1147 . 1 1 101 101 GLN H H 1 7.990 0.010 . 1 . . . . 101 GLN H . 18569 1 1148 . 1 1 101 101 GLN HA H 1 4.077 0.010 . 1 . . . . 101 GLN HA . 18569 1 1149 . 1 1 101 101 GLN HB2 H 1 2.171 0.010 . 2 . . . . 101 GLN HB2 . 18569 1 1150 . 1 1 101 101 GLN HB3 H 1 2.212 0.010 . 2 . . . . 101 GLN HB3 . 18569 1 1151 . 1 1 101 101 GLN HG2 H 1 2.507 0.010 . 2 . . . . 101 GLN HG2 . 18569 1 1152 . 1 1 101 101 GLN HG3 H 1 2.542 0.010 . 2 . . . . 101 GLN HG3 . 18569 1 1153 . 1 1 101 101 GLN HE21 H 1 7.457 0.010 . 1 . . . . 101 GLN HE21 . 18569 1 1154 . 1 1 101 101 GLN HE22 H 1 6.836 0.010 . 1 . . . . 101 GLN HE22 . 18569 1 1155 . 1 1 101 101 GLN CA C 13 58.601 0.100 . 1 . . . . 101 GLN CA . 18569 1 1156 . 1 1 101 101 GLN CB C 13 28.439 0.100 . 1 . . . . 101 GLN CB . 18569 1 1157 . 1 1 101 101 GLN CG C 13 34.142 0.100 . 1 . . . . 101 GLN CG . 18569 1 1158 . 1 1 101 101 GLN N N 15 117.573 0.050 . 1 . . . . 101 GLN N . 18569 1 1159 . 1 1 101 101 GLN NE2 N 15 111.678 0.050 . 1 . . . . 101 GLN NE2 . 18569 1 1160 . 1 1 102 102 PHE H H 1 7.779 0.010 . 1 . . . . 102 PHE H . 18569 1 1161 . 1 1 102 102 PHE HA H 1 4.217 0.010 . 1 . . . . 102 PHE HA . 18569 1 1162 . 1 1 102 102 PHE HB2 H 1 2.981 0.010 . 2 . . . . 102 PHE HB2 . 18569 1 1163 . 1 1 102 102 PHE HB3 H 1 3.147 0.010 . 2 . . . . 102 PHE HB3 . 18569 1 1164 . 1 1 102 102 PHE HD1 H 1 7.377 0.010 . 3 . . . . 102 PHE HD1 . 18569 1 1165 . 1 1 102 102 PHE HD2 H 1 7.377 0.010 . 3 . . . . 102 PHE HD2 . 18569 1 1166 . 1 1 102 102 PHE HE1 H 1 6.869 0.010 . 3 . . . . 102 PHE HE1 . 18569 1 1167 . 1 1 102 102 PHE HE2 H 1 6.869 0.010 . 3 . . . . 102 PHE HE2 . 18569 1 1168 . 1 1 102 102 PHE CA C 13 62.078 0.100 . 1 . . . . 102 PHE CA . 18569 1 1169 . 1 1 102 102 PHE CB C 13 40.210 0.100 . 1 . . . . 102 PHE CB . 18569 1 1170 . 1 1 102 102 PHE CD1 C 13 132.41 0.100 . 1 . . . . 102 PHE CD# . 18569 1 1171 . 1 1 102 102 PHE CD2 C 13 132.41 0.100 . 1 . . . . 102 PHE CD# . 18569 1 1172 . 1 1 102 102 PHE CE1 C 13 130.96 0.100 . 1 . . . . 102 PHE CE# . 18569 1 1173 . 1 1 102 102 PHE CE2 C 13 130.96 0.100 . 1 . . . . 102 PHE CE# . 18569 1 1174 . 1 1 102 102 PHE N N 15 122.727 0.050 . 1 . . . . 102 PHE N . 18569 1 1175 . 1 1 103 103 ALA H H 1 8.653 0.010 . 1 . . . . 103 ALA H . 18569 1 1176 . 1 1 103 103 ALA HA H 1 3.826 0.010 . 1 . . . . 103 ALA HA . 18569 1 1177 . 1 1 103 103 ALA HB1 H 1 1.590 0.010 . 1 . . . . 103 ALA HB1 . 18569 1 1178 . 1 1 103 103 ALA HB2 H 1 1.590 0.010 . 1 . . . . 103 ALA HB2 . 18569 1 1179 . 1 1 103 103 ALA HB3 H 1 1.590 0.010 . 1 . . . . 103 ALA HB3 . 18569 1 1180 . 1 1 103 103 ALA CA C 13 55.174 0.100 . 1 . . . . 103 ALA CA . 18569 1 1181 . 1 1 103 103 ALA CB C 13 18.250 0.100 . 1 . . . . 103 ALA CB . 18569 1 1182 . 1 1 103 103 ALA N N 15 120.217 0.050 . 1 . . . . 103 ALA N . 18569 1 1183 . 1 1 104 104 ALA H H 1 7.725 0.010 . 1 . . . . 104 ALA H . 18569 1 1184 . 1 1 104 104 ALA HA H 1 4.083 0.010 . 1 . . . . 104 ALA HA . 18569 1 1185 . 1 1 104 104 ALA HB1 H 1 1.408 0.010 . 1 . . . . 104 ALA HB1 . 18569 1 1186 . 1 1 104 104 ALA HB2 H 1 1.408 0.010 . 1 . . . . 104 ALA HB2 . 18569 1 1187 . 1 1 104 104 ALA HB3 H 1 1.408 0.010 . 1 . . . . 104 ALA HB3 . 18569 1 1188 . 1 1 104 104 ALA CA C 13 54.625 0.100 . 1 . . . . 104 ALA CA . 18569 1 1189 . 1 1 104 104 ALA CB C 13 17.714 0.100 . 1 . . . . 104 ALA CB . 18569 1 1190 . 1 1 104 104 ALA N N 15 120.050 0.050 . 1 . . . . 104 ALA N . 18569 1 1191 . 1 1 105 105 GLY H H 1 7.624 0.010 . 1 . . . . 105 GLY H . 18569 1 1192 . 1 1 105 105 GLY HA2 H 1 3.444 0.010 . 2 . . . . 105 GLY HA2 . 18569 1 1193 . 1 1 105 105 GLY HA3 H 1 3.590 0.010 . 2 . . . . 105 GLY HA3 . 18569 1 1194 . 1 1 105 105 GLY CA C 13 46.955 0.100 . 1 . . . . 105 GLY CA . 18569 1 1195 . 1 1 105 105 GLY N N 15 108.800 0.050 . 1 . . . . 105 GLY N . 18569 1 1196 . 1 1 106 106 MET H H 1 8.122 0.010 . 1 . . . . 106 MET H . 18569 1 1197 . 1 1 106 106 MET HA H 1 3.642 0.010 . 1 . . . . 106 MET HA . 18569 1 1198 . 1 1 106 106 MET HB2 H 1 1.029 0.010 . 2 . . . . 106 MET HB2 . 18569 1 1199 . 1 1 106 106 MET HB3 H 1 1.029 0.010 . 2 . . . . 106 MET HB3 . 18569 1 1200 . 1 1 106 106 MET HG2 H 1 1.263 0.010 . 2 . . . . 106 MET HG2 . 18569 1 1201 . 1 1 106 106 MET HG3 H 1 1.438 0.010 . 2 . . . . 106 MET HG3 . 18569 1 1202 . 1 1 106 106 MET HE1 H 1 0.892 0.010 . 1 . . . . 106 MET HE1 . 18569 1 1203 . 1 1 106 106 MET HE2 H 1 0.892 0.010 . 1 . . . . 106 MET HE2 . 18569 1 1204 . 1 1 106 106 MET HE3 H 1 0.892 0.010 . 1 . . . . 106 MET HE3 . 18569 1 1205 . 1 1 106 106 MET CA C 13 56.158 0.100 . 1 . . . . 106 MET CA . 18569 1 1206 . 1 1 106 106 MET CB C 13 30.011 0.100 . 1 . . . . 106 MET CB . 18569 1 1207 . 1 1 106 106 MET CG C 13 30.698 0.100 . 1 . . . . 106 MET CG . 18569 1 1208 . 1 1 106 106 MET CE C 13 14.561 0.100 . 1 . . . . 106 MET CE . 18569 1 1209 . 1 1 106 106 MET N N 15 121.943 0.050 . 1 . . . . 106 MET N . 18569 1 1210 . 1 1 107 107 ALA H H 1 7.948 0.010 . 1 . . . . 107 ALA H . 18569 1 1211 . 1 1 107 107 ALA HA H 1 3.843 0.010 . 1 . . . . 107 ALA HA . 18569 1 1212 . 1 1 107 107 ALA HB1 H 1 1.367 0.010 . 1 . . . . 107 ALA HB1 . 18569 1 1213 . 1 1 107 107 ALA HB2 H 1 1.367 0.010 . 1 . . . . 107 ALA HB2 . 18569 1 1214 . 1 1 107 107 ALA HB3 H 1 1.367 0.010 . 1 . . . . 107 ALA HB3 . 18569 1 1215 . 1 1 107 107 ALA CA C 13 55.030 0.100 . 1 . . . . 107 ALA CA . 18569 1 1216 . 1 1 107 107 ALA CB C 13 17.492 0.100 . 1 . . . . 107 ALA CB . 18569 1 1217 . 1 1 107 107 ALA N N 15 120.063 0.050 . 1 . . . . 107 ALA N . 18569 1 1218 . 1 1 108 108 SER H H 1 7.623 0.010 . 1 . . . . 108 SER H . 18569 1 1219 . 1 1 108 108 SER HA H 1 4.033 0.010 . 1 . . . . 108 SER HA . 18569 1 1220 . 1 1 108 108 SER HB2 H 1 3.779 0.010 . 2 . . . . 108 SER HB2 . 18569 1 1221 . 1 1 108 108 SER HB3 H 1 3.849 0.010 . 2 . . . . 108 SER HB3 . 18569 1 1222 . 1 1 108 108 SER CA C 13 61.617 0.100 . 1 . . . . 108 SER CA . 18569 1 1223 . 1 1 108 108 SER CB C 13 62.493 0.100 . 1 . . . . 108 SER CB . 18569 1 1224 . 1 1 108 108 SER N N 15 114.205 0.050 . 1 . . . . 108 SER N . 18569 1 1225 . 1 1 109 109 ALA H H 1 7.576 0.010 . 1 . . . . 109 ALA H . 18569 1 1226 . 1 1 109 109 ALA HA H 1 2.699 0.010 . 1 . . . . 109 ALA HA . 18569 1 1227 . 1 1 109 109 ALA HB1 H 1 0.407 0.010 . 1 . . . . 109 ALA HB1 . 18569 1 1228 . 1 1 109 109 ALA HB2 H 1 0.407 0.010 . 1 . . . . 109 ALA HB2 . 18569 1 1229 . 1 1 109 109 ALA HB3 H 1 0.407 0.010 . 1 . . . . 109 ALA HB3 . 18569 1 1230 . 1 1 109 109 ALA CA C 13 54.298 0.100 . 1 . . . . 109 ALA CA . 18569 1 1231 . 1 1 109 109 ALA CB C 13 17.558 0.100 . 1 . . . . 109 ALA CB . 18569 1 1232 . 1 1 109 109 ALA N N 15 126.267 0.050 . 1 . . . . 109 ALA N . 18569 1 1233 . 1 1 110 110 LEU H H 1 8.027 0.010 . 1 . . . . 110 LEU H . 18569 1 1234 . 1 1 110 110 LEU HA H 1 3.677 0.010 . 1 . . . . 110 LEU HA . 18569 1 1235 . 1 1 110 110 LEU HB2 H 1 1.330 0.010 . 2 . . . . 110 LEU HB2 . 18569 1 1236 . 1 1 110 110 LEU HB3 H 1 1.652 0.010 . 2 . . . . 110 LEU HB3 . 18569 1 1237 . 1 1 110 110 LEU HG H 1 1.486 0.010 . 1 . . . . 110 LEU HG . 18569 1 1238 . 1 1 110 110 LEU HD11 H 1 0.706 0.010 . 2 . . . . 110 LEU HD11 . 18569 1 1239 . 1 1 110 110 LEU HD12 H 1 0.706 0.010 . 2 . . . . 110 LEU HD12 . 18569 1 1240 . 1 1 110 110 LEU HD13 H 1 0.706 0.010 . 2 . . . . 110 LEU HD13 . 18569 1 1241 . 1 1 110 110 LEU HD21 H 1 0.640 0.010 . 2 . . . . 110 LEU HD21 . 18569 1 1242 . 1 1 110 110 LEU HD22 H 1 0.640 0.010 . 2 . . . . 110 LEU HD22 . 18569 1 1243 . 1 1 110 110 LEU HD23 H 1 0.640 0.010 . 2 . . . . 110 LEU HD23 . 18569 1 1244 . 1 1 110 110 LEU CA C 13 57.874 0.100 . 1 . . . . 110 LEU CA . 18569 1 1245 . 1 1 110 110 LEU CB C 13 40.727 0.100 . 1 . . . . 110 LEU CB . 18569 1 1246 . 1 1 110 110 LEU CG C 13 26.989 0.100 . 1 . . . . 110 LEU CG . 18569 1 1247 . 1 1 110 110 LEU CD1 C 13 25.383 0.100 . 2 . . . . 110 LEU CD1 . 18569 1 1248 . 1 1 110 110 LEU CD2 C 13 22.981 0.100 . 2 . . . . 110 LEU CD2 . 18569 1 1249 . 1 1 110 110 LEU N N 15 115.454 0.050 . 1 . . . . 110 LEU N . 18569 1 1250 . 1 1 111 111 GLU H H 1 7.882 0.010 . 1 . . . . 111 GLU H . 18569 1 1251 . 1 1 111 111 GLU HA H 1 3.973 0.010 . 1 . . . . 111 GLU HA . 18569 1 1252 . 1 1 111 111 GLU HB2 H 1 1.954 0.010 . 2 . . . . 111 GLU HB2 . 18569 1 1253 . 1 1 111 111 GLU HB3 H 1 2.016 0.010 . 2 . . . . 111 GLU HB3 . 18569 1 1254 . 1 1 111 111 GLU HG2 H 1 2.170 0.010 . 2 . . . . 111 GLU HG2 . 18569 1 1255 . 1 1 111 111 GLU HG3 H 1 2.308 0.010 . 2 . . . . 111 GLU HG3 . 18569 1 1256 . 1 1 111 111 GLU CA C 13 59.097 0.100 . 1 . . . . 111 GLU CA . 18569 1 1257 . 1 1 111 111 GLU CB C 13 29.494 0.100 . 1 . . . . 111 GLU CB . 18569 1 1258 . 1 1 111 111 GLU CG C 13 36.339 0.100 . 1 . . . . 111 GLU CG . 18569 1 1259 . 1 1 111 111 GLU N N 15 118.765 0.050 . 1 . . . . 111 GLU N . 18569 1 1260 . 1 1 112 112 ALA H H 1 7.516 0.010 . 1 . . . . 112 ALA H . 18569 1 1261 . 1 1 112 112 ALA HA H 1 4.187 0.010 . 1 . . . . 112 ALA HA . 18569 1 1262 . 1 1 112 112 ALA HB1 H 1 1.612 0.010 . 1 . . . . 112 ALA HB1 . 18569 1 1263 . 1 1 112 112 ALA HB2 H 1 1.612 0.010 . 1 . . . . 112 ALA HB2 . 18569 1 1264 . 1 1 112 112 ALA HB3 H 1 1.612 0.010 . 1 . . . . 112 ALA HB3 . 18569 1 1265 . 1 1 112 112 ALA CA C 13 54.447 0.100 . 1 . . . . 112 ALA CA . 18569 1 1266 . 1 1 112 112 ALA CB C 13 18.647 0.100 . 1 . . . . 112 ALA CB . 18569 1 1267 . 1 1 112 112 ALA N N 15 122.311 0.050 . 1 . . . . 112 ALA N . 18569 1 1268 . 1 1 113 113 LEU H H 1 7.787 0.010 . 1 . . . . 113 LEU H . 18569 1 1269 . 1 1 113 113 LEU HA H 1 4.276 0.010 . 1 . . . . 113 LEU HA . 18569 1 1270 . 1 1 113 113 LEU HB2 H 1 1.415 0.010 . 2 . . . . 113 LEU HB2 . 18569 1 1271 . 1 1 113 113 LEU HB3 H 1 1.825 0.010 . 2 . . . . 113 LEU HB3 . 18569 1 1272 . 1 1 113 113 LEU HG H 1 0.615 0.010 . 1 . . . . 113 LEU HG . 18569 1 1273 . 1 1 113 113 LEU HD11 H 1 1.204 0.010 . 2 . . . . 113 LEU HD11 . 18569 1 1274 . 1 1 113 113 LEU HD12 H 1 1.204 0.010 . 2 . . . . 113 LEU HD12 . 18569 1 1275 . 1 1 113 113 LEU HD13 H 1 1.204 0.010 . 2 . . . . 113 LEU HD13 . 18569 1 1276 . 1 1 113 113 LEU HD21 H 1 1.204 0.010 . 2 . . . . 113 LEU HD21 . 18569 1 1277 . 1 1 113 113 LEU HD22 H 1 1.204 0.010 . 2 . . . . 113 LEU HD22 . 18569 1 1278 . 1 1 113 113 LEU HD23 H 1 1.204 0.010 . 2 . . . . 113 LEU HD23 . 18569 1 1279 . 1 1 113 113 LEU CA C 13 56.140 0.100 . 1 . . . . 113 LEU CA . 18569 1 1280 . 1 1 113 113 LEU CB C 13 43.249 0.100 . 1 . . . . 113 LEU CB . 18569 1 1281 . 1 1 113 113 LEU CG C 13 26.217 0.100 . 1 . . . . 113 LEU CG . 18569 1 1282 . 1 1 113 113 LEU N N 15 117.476 0.050 . 1 . . . . 113 LEU N . 18569 1 1283 . 1 1 114 114 GLU H H 1 7.617 0.010 . 1 . . . . 114 GLU H . 18569 1 1284 . 1 1 114 114 GLU HA H 1 4.200 0.010 . 1 . . . . 114 GLU HA . 18569 1 1285 . 1 1 114 114 GLU HB2 H 1 2.076 0.010 . 2 . . . . 114 GLU HB2 . 18569 1 1286 . 1 1 114 114 GLU HB3 H 1 2.187 0.010 . 2 . . . . 114 GLU HB3 . 18569 1 1287 . 1 1 114 114 GLU HG2 H 1 2.364 0.010 . 2 . . . . 114 GLU HG2 . 18569 1 1288 . 1 1 114 114 GLU HG3 H 1 2.413 0.010 . 2 . . . . 114 GLU HG3 . 18569 1 1289 . 1 1 114 114 GLU CA C 13 57.005 0.100 . 1 . . . . 114 GLU CA . 18569 1 1290 . 1 1 114 114 GLU CB C 13 30.079 0.100 . 1 . . . . 114 GLU CB . 18569 1 1291 . 1 1 114 114 GLU CG C 13 36.019 0.100 . 1 . . . . 114 GLU CG . 18569 1 1292 . 1 1 114 114 GLU N N 15 118.580 0.050 . 1 . . . . 114 GLU N . 18569 1 1293 . 1 1 115 115 GLY H H 1 7.593 0.010 . 1 . . . . 115 GLY H . 18569 1 1294 . 1 1 115 115 GLY HA2 H 1 3.764 0.010 . 2 . . . . 115 GLY HA2 . 18569 1 1295 . 1 1 115 115 GLY HA3 H 1 3.809 0.010 . 2 . . . . 115 GLY HA3 . 18569 1 1296 . 1 1 115 115 GLY CA C 13 46.384 0.100 . 1 . . . . 115 GLY CA . 18569 1 1297 . 1 1 115 115 GLY N N 15 113.447 0.050 . 1 . . . . 115 GLY N . 18569 1 stop_ save_