################################### # 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 16109 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 16109 1 2 '3D CBCA(CO)NH' . . . 16109 1 3 '3D HBHA(CO)NH' . . . 16109 1 4 '3D HNCA' . . . 16109 1 5 '3D HCCH-TOCSY' . . . 16109 1 6 '3D CCH-TOCSY' . . . 16109 1 7 '3D 1H-15N NOESY' . . . 16109 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $FAWN . . 16109 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 23 23 PRO HA H 1 3.942 0.03 . 1 . . . . . 1 PRO HA . 16109 1 2 . 1 1 23 23 PRO HB2 H 1 1.546 0.03 . 2 . . . . . 1 PRO HB2 . 16109 1 3 . 1 1 23 23 PRO HB3 H 1 1.546 0.03 . 2 . . . . . 1 PRO HB3 . 16109 1 4 . 1 1 23 23 PRO HD2 H 1 3.575 0.03 . 2 . . . . . 1 PRO HD2 . 16109 1 5 . 1 1 23 23 PRO HD3 H 1 3.575 0.03 . 2 . . . . . 1 PRO HD3 . 16109 1 6 . 1 1 23 23 PRO HG2 H 1 1.887 0.03 . 2 . . . . . 1 PRO HG2 . 16109 1 7 . 1 1 23 23 PRO HG3 H 1 1.828 0.03 . 2 . . . . . 1 PRO HG3 . 16109 1 8 . 1 1 23 23 PRO C C 13 178.407 0.3 . 1 . . . . . 1 PRO C . 16109 1 9 . 1 1 23 23 PRO CA C 13 62.640 0.3 . 1 . . . . . 1 PRO CA . 16109 1 10 . 1 1 23 23 PRO CB C 13 31.750 0.3 . 1 . . . . . 1 PRO CB . 16109 1 11 . 1 1 23 23 PRO CD C 13 50.230 0.3 . 1 . . . . . 1 PRO CD . 16109 1 12 . 1 1 23 23 PRO CG C 13 27.090 0.3 . 1 . . . . . 1 PRO CG . 16109 1 13 . 1 1 24 24 VAL H H 1 8.008 0.03 . 1 . . . . . 2 VAL H . 16109 1 14 . 1 1 24 24 VAL HA H 1 4.297 0.03 . 1 . . . . . 2 VAL HA . 16109 1 15 . 1 1 24 24 VAL HB H 1 1.691 0.03 . 1 . . . . . 2 VAL HB . 16109 1 16 . 1 1 24 24 VAL HG11 H 1 0.518 0.03 . 2 . . . . . 2 VAL HG1 . 16109 1 17 . 1 1 24 24 VAL HG12 H 1 0.518 0.03 . 2 . . . . . 2 VAL HG1 . 16109 1 18 . 1 1 24 24 VAL HG13 H 1 0.518 0.03 . 2 . . . . . 2 VAL HG1 . 16109 1 19 . 1 1 24 24 VAL HG21 H 1 0.528 0.03 . 2 . . . . . 2 VAL HG2 . 16109 1 20 . 1 1 24 24 VAL HG22 H 1 0.528 0.03 . 2 . . . . . 2 VAL HG2 . 16109 1 21 . 1 1 24 24 VAL HG23 H 1 0.528 0.03 . 2 . . . . . 2 VAL HG2 . 16109 1 22 . 1 1 24 24 VAL C C 13 175.571 0.3 . 1 . . . . . 2 VAL C . 16109 1 23 . 1 1 24 24 VAL CA C 13 60.030 0.3 . 1 . . . . . 2 VAL CA . 16109 1 24 . 1 1 24 24 VAL CB C 13 34.710 0.3 . 1 . . . . . 2 VAL CB . 16109 1 25 . 1 1 24 24 VAL CG1 C 13 21.010 0.3 . 1 . . . . . 2 VAL CG1 . 16109 1 26 . 1 1 24 24 VAL CG2 C 13 20.416 0.3 . 1 . . . . . 2 VAL CG2 . 16109 1 27 . 1 1 24 24 VAL N N 15 118.399 0.3 . 1 . . . . . 2 VAL N . 16109 1 28 . 1 1 25 25 THR H H 1 8.520 0.03 . 1 . . . . . 3 THR H . 16109 1 29 . 1 1 25 25 THR HA H 1 4.738 0.03 . 1 . . . . . 3 THR HA . 16109 1 30 . 1 1 25 25 THR HB H 1 3.881 0.03 . 1 . . . . . 3 THR HB . 16109 1 31 . 1 1 25 25 THR HG21 H 1 1.020 0.03 . 1 . . . . . 3 THR HG2 . 16109 1 32 . 1 1 25 25 THR HG22 H 1 1.020 0.03 . 1 . . . . . 3 THR HG2 . 16109 1 33 . 1 1 25 25 THR HG23 H 1 1.020 0.03 . 1 . . . . . 3 THR HG2 . 16109 1 34 . 1 1 25 25 THR C C 13 175.275 0.3 . 1 . . . . . 3 THR C . 16109 1 35 . 1 1 25 25 THR CA C 13 62.350 0.3 . 1 . . . . . 3 THR CA . 16109 1 36 . 1 1 25 25 THR CB C 13 69.930 0.3 . 1 . . . . . 3 THR CB . 16109 1 37 . 1 1 25 25 THR CG2 C 13 22.230 0.3 . 1 . . . . . 3 THR CG2 . 16109 1 38 . 1 1 25 25 THR N N 15 121.522 0.3 . 1 . . . . . 3 THR N . 16109 1 39 . 1 1 26 26 LEU H H 1 8.929 0.03 . 1 . . . . . 4 LEU H . 16109 1 40 . 1 1 26 26 LEU HA H 1 5.102 0.03 . 1 . . . . . 4 LEU HA . 16109 1 41 . 1 1 26 26 LEU HB2 H 1 1.432 0.03 . 2 . . . . . 4 LEU HB2 . 16109 1 42 . 1 1 26 26 LEU HB3 H 1 1.345 0.03 . 2 . . . . . 4 LEU HB3 . 16109 1 43 . 1 1 26 26 LEU HD11 H 1 0.639 0.03 . 2 . . . . . 4 LEU HD1 . 16109 1 44 . 1 1 26 26 LEU HD12 H 1 0.639 0.03 . 2 . . . . . 4 LEU HD1 . 16109 1 45 . 1 1 26 26 LEU HD13 H 1 0.639 0.03 . 2 . . . . . 4 LEU HD1 . 16109 1 46 . 1 1 26 26 LEU HD21 H 1 0.597 0.03 . 2 . . . . . 4 LEU HD2 . 16109 1 47 . 1 1 26 26 LEU HD22 H 1 0.597 0.03 . 2 . . . . . 4 LEU HD2 . 16109 1 48 . 1 1 26 26 LEU HD23 H 1 0.597 0.03 . 2 . . . . . 4 LEU HD2 . 16109 1 49 . 1 1 26 26 LEU HG H 1 1.501 0.03 . 1 . . . . . 4 LEU HG . 16109 1 50 . 1 1 26 26 LEU C C 13 176.809 0.3 . 1 . . . . . 4 LEU C . 16109 1 51 . 1 1 26 26 LEU CA C 13 52.850 0.3 . 1 . . . . . 4 LEU CA . 16109 1 52 . 1 1 26 26 LEU CB C 13 45.140 0.3 . 1 . . . . . 4 LEU CB . 16109 1 53 . 1 1 26 26 LEU CD1 C 13 25.820 0.3 . 1 . . . . . 4 LEU CD1 . 16109 1 54 . 1 1 26 26 LEU CD2 C 13 25.290 0.3 . 1 . . . . . 4 LEU CD2 . 16109 1 55 . 1 1 26 26 LEU CG C 13 28.040 0.3 . 1 . . . . . 4 LEU CG . 16109 1 56 . 1 1 26 26 LEU N N 15 127.076 0.3 . 1 . . . . . 4 LEU N . 16109 1 57 . 1 1 27 27 ILE H H 1 8.990 0.03 . 1 . . . . . 5 ILE H . 16109 1 58 . 1 1 27 27 ILE HA H 1 4.682 0.03 . 1 . . . . . 5 ILE HA . 16109 1 59 . 1 1 27 27 ILE HB H 1 1.849 0.03 . 1 . . . . . 5 ILE HB . 16109 1 60 . 1 1 27 27 ILE HD11 H 1 0.618 0.03 . 1 . . . . . 5 ILE HD1 . 16109 1 61 . 1 1 27 27 ILE HD12 H 1 0.618 0.03 . 1 . . . . . 5 ILE HD1 . 16109 1 62 . 1 1 27 27 ILE HD13 H 1 0.618 0.03 . 1 . . . . . 5 ILE HD1 . 16109 1 63 . 1 1 27 27 ILE HG12 H 1 1.353 0.03 . 2 . . . . . 5 ILE HG12 . 16109 1 64 . 1 1 27 27 ILE HG13 H 1 1.096 0.03 . 2 . . . . . 5 ILE HG13 . 16109 1 65 . 1 1 27 27 ILE HG21 H 1 0.677 0.03 . 1 . . . . . 5 ILE HG2 . 16109 1 66 . 1 1 27 27 ILE HG22 H 1 0.677 0.03 . 1 . . . . . 5 ILE HG2 . 16109 1 67 . 1 1 27 27 ILE HG23 H 1 0.677 0.03 . 1 . . . . . 5 ILE HG2 . 16109 1 68 . 1 1 27 27 ILE C C 13 176.962 0.3 . 1 . . . . . 5 ILE C . 16109 1 69 . 1 1 27 27 ILE CA C 13 59.810 0.3 . 1 . . . . . 5 ILE CA . 16109 1 70 . 1 1 27 27 ILE CB C 13 38.590 0.3 . 1 . . . . . 5 ILE CB . 16109 1 71 . 1 1 27 27 ILE CD1 C 13 12.790 0.3 . 1 . . . . . 5 ILE CD1 . 16109 1 72 . 1 1 27 27 ILE CG1 C 13 27.470 0.3 . 1 . . . . . 5 ILE CG1 . 16109 1 73 . 1 1 27 27 ILE CG2 C 13 18.090 0.3 . 1 . . . . . 5 ILE CG2 . 16109 1 74 . 1 1 27 27 ILE N N 15 122.974 0.3 . 1 . . . . . 5 ILE N . 16109 1 75 . 1 1 28 28 ILE H H 1 9.288 0.03 . 1 . . . . . 6 ILE H . 16109 1 76 . 1 1 28 28 ILE HA H 1 5.025 0.03 . 1 . . . . . 6 ILE HA . 16109 1 77 . 1 1 28 28 ILE HB H 1 2.188 0.03 . 1 . . . . . 6 ILE HB . 16109 1 78 . 1 1 28 28 ILE HD11 H 1 0.627 0.03 . 1 . . . . . 6 ILE HD1 . 16109 1 79 . 1 1 28 28 ILE HD12 H 1 0.627 0.03 . 1 . . . . . 6 ILE HD1 . 16109 1 80 . 1 1 28 28 ILE HD13 H 1 0.627 0.03 . 1 . . . . . 6 ILE HD1 . 16109 1 81 . 1 1 28 28 ILE HG12 H 1 1.665 0.03 . 2 . . . . . 6 ILE HG12 . 16109 1 82 . 1 1 28 28 ILE HG13 H 1 1.273 0.03 . 2 . . . . . 6 ILE HG13 . 16109 1 83 . 1 1 28 28 ILE HG21 H 1 0.688 0.03 . 1 . . . . . 6 ILE HG2 . 16109 1 84 . 1 1 28 28 ILE HG22 H 1 0.688 0.03 . 1 . . . . . 6 ILE HG2 . 16109 1 85 . 1 1 28 28 ILE HG23 H 1 0.688 0.03 . 1 . . . . . 6 ILE HG2 . 16109 1 86 . 1 1 28 28 ILE C C 13 178.889 0.3 . 1 . . . . . 6 ILE C . 16109 1 87 . 1 1 28 28 ILE CA C 13 57.620 0.3 . 1 . . . . . 6 ILE CA . 16109 1 88 . 1 1 28 28 ILE CB C 13 36.680 0.3 . 1 . . . . . 6 ILE CB . 16109 1 89 . 1 1 28 28 ILE CD1 C 13 10.000 0.3 . 1 . . . . . 6 ILE CD1 . 16109 1 90 . 1 1 28 28 ILE CG1 C 13 26.910 0.3 . 1 . . . . . 6 ILE CG1 . 16109 1 91 . 1 1 28 28 ILE CG2 C 13 18.460 0.3 . 1 . . . . . 6 ILE CG2 . 16109 1 92 . 1 1 28 28 ILE N N 15 125.520 0.3 . 1 . . . . . 6 ILE N . 16109 1 93 . 1 1 29 29 LYS H H 1 8.832 0.03 . 1 . . . . . 7 LYS H . 16109 1 94 . 1 1 29 29 LYS HA H 1 4.597 0.03 . 1 . . . . . 7 LYS HA . 16109 1 95 . 1 1 29 29 LYS HB2 H 1 1.533 0.03 . 2 . . . . . 7 LYS HB2 . 16109 1 96 . 1 1 29 29 LYS HB3 H 1 1.206 0.03 . 2 . . . . . 7 LYS HB3 . 16109 1 97 . 1 1 29 29 LYS HD2 H 1 1.507 0.03 . 2 . . . . . 7 LYS HD2 . 16109 1 98 . 1 1 29 29 LYS HD3 H 1 1.507 0.03 . 2 . . . . . 7 LYS HD3 . 16109 1 99 . 1 1 29 29 LYS HE2 H 1 3.010 0.03 . 2 . . . . . 7 LYS HE2 . 16109 1 100 . 1 1 29 29 LYS HE3 H 1 2.824 0.03 . 2 . . . . . 7 LYS HE3 . 16109 1 101 . 1 1 29 29 LYS HG2 H 1 1.221 0.03 . 2 . . . . . 7 LYS HG2 . 16109 1 102 . 1 1 29 29 LYS HG3 H 1 1.160 0.03 . 2 . . . . . 7 LYS HG3 . 16109 1 103 . 1 1 29 29 LYS C C 13 176.414 0.3 . 1 . . . . . 7 LYS C . 16109 1 104 . 1 1 29 29 LYS CA C 13 54.240 0.3 . 1 . . . . . 7 LYS CA . 16109 1 105 . 1 1 29 29 LYS CB C 13 34.050 0.3 . 1 . . . . . 7 LYS CB . 16109 1 106 . 1 1 29 29 LYS CD C 13 28.510 0.3 . 1 . . . . . 7 LYS CD . 16109 1 107 . 1 1 29 29 LYS CE C 13 41.570 0.3 . 1 . . . . . 7 LYS CE . 16109 1 108 . 1 1 29 29 LYS CG C 13 24.100 0.3 . 1 . . . . . 7 LYS CG . 16109 1 109 . 1 1 29 29 LYS N N 15 130.704 0.3 . 1 . . . . . 7 LYS N . 16109 1 110 . 1 1 30 30 ALA H H 1 9.021 0.03 . 1 . . . . . 8 ALA H . 16109 1 111 . 1 1 30 30 ALA HA H 1 5.221 0.03 . 1 . . . . . 8 ALA HA . 16109 1 112 . 1 1 30 30 ALA HB1 H 1 1.573 0.03 . 1 . . . . . 8 ALA HB . 16109 1 113 . 1 1 30 30 ALA HB2 H 1 1.573 0.03 . 1 . . . . . 8 ALA HB . 16109 1 114 . 1 1 30 30 ALA HB3 H 1 1.573 0.03 . 1 . . . . . 8 ALA HB . 16109 1 115 . 1 1 30 30 ALA CA C 13 49.220 0.3 . 1 . . . . . 8 ALA CA . 16109 1 116 . 1 1 30 30 ALA CB C 13 20.620 0.3 . 1 . . . . . 8 ALA CB . 16109 1 117 . 1 1 30 30 ALA N N 15 126.869 0.3 . 1 . . . . . 8 ALA N . 16109 1 118 . 1 1 31 31 PRO HA H 1 4.445 0.03 . 1 . . . . . 9 PRO HA . 16109 1 119 . 1 1 31 31 PRO HB2 H 1 2.280 0.03 . 2 . . . . . 9 PRO HB2 . 16109 1 120 . 1 1 31 31 PRO HB3 H 1 1.937 0.03 . 2 . . . . . 9 PRO HB3 . 16109 1 121 . 1 1 31 31 PRO HD2 H 1 3.892 0.03 . 2 . . . . . 9 PRO HD2 . 16109 1 122 . 1 1 31 31 PRO HD3 H 1 3.892 0.03 . 2 . . . . . 9 PRO HD3 . 16109 1 123 . 1 1 31 31 PRO HG2 H 1 2.056 0.03 . 2 . . . . . 9 PRO HG2 . 16109 1 124 . 1 1 31 31 PRO HG3 H 1 1.935 0.03 . 2 . . . . . 9 PRO HG3 . 16109 1 125 . 1 1 31 31 PRO CA C 13 63.990 0.3 . 1 . . . . . 9 PRO CA . 16109 1 126 . 1 1 31 31 PRO CB C 13 31.860 0.3 . 1 . . . . . 9 PRO CB . 16109 1 127 . 1 1 31 31 PRO CD C 13 50.890 0.3 . 1 . . . . . 9 PRO CD . 16109 1 128 . 1 1 31 31 PRO CG C 13 27.390 0.3 . 1 . . . . . 9 PRO CG . 16109 1 129 . 1 1 32 32 ASN HA H 1 4.531 0.03 . 1 . . . . . 10 ASN HA . 16109 1 130 . 1 1 32 32 ASN HB2 H 1 2.917 0.03 . 2 . . . . . 10 ASN HB2 . 16109 1 131 . 1 1 32 32 ASN HB3 H 1 2.803 0.03 . 2 . . . . . 10 ASN HB3 . 16109 1 132 . 1 1 32 32 ASN HD21 H 1 7.615 0.03 . 2 . . . . . 10 ASN HD21 . 16109 1 133 . 1 1 32 32 ASN HD22 H 1 6.862 0.03 . 2 . . . . . 10 ASN HD22 . 16109 1 134 . 1 1 32 32 ASN C C 13 176.666 0.3 . 1 . . . . . 10 ASN C . 16109 1 135 . 1 1 32 32 ASN CA C 13 53.210 0.3 . 1 . . . . . 10 ASN CA . 16109 1 136 . 1 1 32 32 ASN CB C 13 38.150 0.3 . 1 . . . . . 10 ASN CB . 16109 1 137 . 1 1 32 32 ASN ND2 N 15 113.177 0.3 . 1 . . . . . 10 ASN ND2 . 16109 1 138 . 1 1 33 33 GLN H H 1 8.123 0.03 . 1 . . . . . 11 GLN H . 16109 1 139 . 1 1 33 33 GLN N N 15 114.038 0.3 . 1 . . . . . 11 GLN N . 16109 1 140 . 1 1 34 34 LYS HA H 1 3.817 0.03 . 1 . . . . . 12 LYS HA . 16109 1 141 . 1 1 34 34 LYS HB2 H 1 1.570 0.03 . 2 . . . . . 12 LYS HB2 . 16109 1 142 . 1 1 34 34 LYS HB3 H 1 1.382 0.03 . 2 . . . . . 12 LYS HB3 . 16109 1 143 . 1 1 34 34 LYS HD2 H 1 1.511 0.03 . 2 . . . . . 12 LYS HD2 . 16109 1 144 . 1 1 34 34 LYS HD3 H 1 1.511 0.03 . 2 . . . . . 12 LYS HD3 . 16109 1 145 . 1 1 34 34 LYS HE2 H 1 2.843 0.03 . 2 . . . . . 12 LYS HE2 . 16109 1 146 . 1 1 34 34 LYS HE3 H 1 2.843 0.03 . 2 . . . . . 12 LYS HE3 . 16109 1 147 . 1 1 34 34 LYS HG2 H 1 1.026 0.03 . 2 . . . . . 12 LYS HG2 . 16109 1 148 . 1 1 34 34 LYS HG3 H 1 0.911 0.03 . 2 . . . . . 12 LYS HG3 . 16109 1 149 . 1 1 34 34 LYS C C 13 178.002 0.3 . 1 . . . . . 12 LYS C . 16109 1 150 . 1 1 34 34 LYS CA C 13 58.290 0.3 . 1 . . . . . 12 LYS CA . 16109 1 151 . 1 1 34 34 LYS CB C 13 32.570 0.3 . 1 . . . . . 12 LYS CB . 16109 1 152 . 1 1 34 34 LYS CD C 13 29.090 0.3 . 1 . . . . . 12 LYS CD . 16109 1 153 . 1 1 34 34 LYS CE C 13 42.210 0.3 . 1 . . . . . 12 LYS CE . 16109 1 154 . 1 1 34 34 LYS CG C 13 24.510 0.3 . 1 . . . . . 12 LYS CG . 16109 1 155 . 1 1 35 35 TYR H H 1 6.845 0.03 . 1 . . . . . 13 TYR H . 16109 1 156 . 1 1 35 35 TYR HA H 1 4.654 0.03 . 1 . . . . . 13 TYR HA . 16109 1 157 . 1 1 35 35 TYR HB2 H 1 3.116 0.03 . 2 . . . . . 13 TYR HB2 . 16109 1 158 . 1 1 35 35 TYR HB3 H 1 2.570 0.03 . 2 . . . . . 13 TYR HB3 . 16109 1 159 . 1 1 35 35 TYR HD1 H 1 7.135 0.03 . 1 . . . . . 13 TYR HD1 . 16109 1 160 . 1 1 35 35 TYR HD2 H 1 7.135 0.03 . 1 . . . . . 13 TYR HD2 . 16109 1 161 . 1 1 35 35 TYR HE1 H 1 6.748 0.03 . 1 . . . . . 13 TYR HE1 . 16109 1 162 . 1 1 35 35 TYR HE2 H 1 6.748 0.03 . 1 . . . . . 13 TYR HE2 . 16109 1 163 . 1 1 35 35 TYR CA C 13 56.060 0.3 . 1 . . . . . 13 TYR CA . 16109 1 164 . 1 1 35 35 TYR CB C 13 41.000 0.3 . 1 . . . . . 13 TYR CB . 16109 1 165 . 1 1 35 35 TYR CD1 C 13 133.435 0.3 . 1 . . . . . 13 TYR CD1 . 16109 1 166 . 1 1 35 35 TYR CE1 C 13 117.703 0.3 . 1 . . . . . 13 TYR CE1 . 16109 1 167 . 1 1 35 35 TYR N N 15 112.988 0.3 . 1 . . . . . 13 TYR N . 16109 1 168 . 1 1 36 36 SER HA H 1 4.376 0.03 . 1 . . . . . 14 SER HA . 16109 1 169 . 1 1 36 36 SER HB2 H 1 3.887 0.03 . 2 . . . . . 14 SER HB2 . 16109 1 170 . 1 1 36 36 SER HB3 H 1 3.887 0.03 . 2 . . . . . 14 SER HB3 . 16109 1 171 . 1 1 36 36 SER C C 13 177.170 0.3 . 1 . . . . . 14 SER C . 16109 1 172 . 1 1 36 36 SER CA C 13 58.160 0.3 . 1 . . . . . 14 SER CA . 16109 1 173 . 1 1 36 36 SER CB C 13 64.000 0.3 . 1 . . . . . 14 SER CB . 16109 1 174 . 1 1 37 37 ASP H H 1 8.910 0.03 . 1 . . . . . 15 ASP H . 16109 1 175 . 1 1 37 37 ASP HA H 1 4.622 0.03 . 1 . . . . . 15 ASP HA . 16109 1 176 . 1 1 37 37 ASP HB2 H 1 2.482 0.03 . 2 . . . . . 15 ASP HB2 . 16109 1 177 . 1 1 37 37 ASP HB3 H 1 2.357 0.03 . 2 . . . . . 15 ASP HB3 . 16109 1 178 . 1 1 37 37 ASP C C 13 178.221 0.3 . 1 . . . . . 15 ASP C . 16109 1 179 . 1 1 37 37 ASP CA C 13 55.680 0.3 . 1 . . . . . 15 ASP CA . 16109 1 180 . 1 1 37 37 ASP CB C 13 39.640 0.3 . 1 . . . . . 15 ASP CB . 16109 1 181 . 1 1 37 37 ASP N N 15 125.921 0.3 . 1 . . . . . 15 ASP N . 16109 1 182 . 1 1 38 38 GLN H H 1 8.224 0.03 . 1 . . . . . 16 GLN H . 16109 1 183 . 1 1 38 38 GLN HA H 1 4.653 0.03 . 1 . . . . . 16 GLN HA . 16109 1 184 . 1 1 38 38 GLN HB2 H 1 2.122 0.03 . 2 . . . . . 16 GLN HB2 . 16109 1 185 . 1 1 38 38 GLN HB3 H 1 1.865 0.03 . 2 . . . . . 16 GLN HB3 . 16109 1 186 . 1 1 38 38 GLN HE21 H 1 7.035 0.03 . 2 . . . . . 16 GLN HE21 . 16109 1 187 . 1 1 38 38 GLN HE22 H 1 6.792 0.03 . 2 . . . . . 16 GLN HE22 . 16109 1 188 . 1 1 38 38 GLN HG2 H 1 2.561 0.03 . 2 . . . . . 16 GLN HG2 . 16109 1 189 . 1 1 38 38 GLN HG3 H 1 1.955 0.03 . 2 . . . . . 16 GLN HG3 . 16109 1 190 . 1 1 38 38 GLN C C 13 176.655 0.3 . 1 . . . . . 16 GLN C . 16109 1 191 . 1 1 38 38 GLN CA C 13 53.230 0.3 . 1 . . . . . 16 GLN CA . 16109 1 192 . 1 1 38 38 GLN CB C 13 31.390 0.3 . 1 . . . . . 16 GLN CB . 16109 1 193 . 1 1 38 38 GLN CG C 13 33.740 0.3 . 1 . . . . . 16 GLN CG . 16109 1 194 . 1 1 38 38 GLN N N 15 121.123 0.3 . 1 . . . . . 16 GLN N . 16109 1 195 . 1 1 38 38 GLN NE2 N 15 114.544 0.3 . 1 . . . . . 16 GLN NE2 . 16109 1 196 . 1 1 39 39 THR H H 1 8.733 0.03 . 1 . . . . . 17 THR H . 16109 1 197 . 1 1 39 39 THR HA H 1 4.936 0.03 . 1 . . . . . 17 THR HA . 16109 1 198 . 1 1 39 39 THR HB H 1 3.926 0.03 . 1 . . . . . 17 THR HB . 16109 1 199 . 1 1 39 39 THR HG21 H 1 1.023 0.03 . 1 . . . . . 17 THR HG2 . 16109 1 200 . 1 1 39 39 THR HG22 H 1 1.023 0.03 . 1 . . . . . 17 THR HG2 . 16109 1 201 . 1 1 39 39 THR HG23 H 1 1.023 0.03 . 1 . . . . . 17 THR HG2 . 16109 1 202 . 1 1 39 39 THR C C 13 176.173 0.3 . 1 . . . . . 17 THR C . 16109 1 203 . 1 1 39 39 THR CA C 13 62.170 0.3 . 1 . . . . . 17 THR CA . 16109 1 204 . 1 1 39 39 THR CB C 13 69.300 0.3 . 1 . . . . . 17 THR CB . 16109 1 205 . 1 1 39 39 THR CG2 C 13 21.880 0.3 . 1 . . . . . 17 THR CG2 . 16109 1 206 . 1 1 39 39 THR N N 15 120.324 0.3 . 1 . . . . . 17 THR N . 16109 1 207 . 1 1 40 40 ILE H H 1 9.424 0.03 . 1 . . . . . 18 ILE H . 16109 1 208 . 1 1 40 40 ILE HA H 1 4.592 0.03 . 1 . . . . . 18 ILE HA . 16109 1 209 . 1 1 40 40 ILE HB H 1 1.956 0.03 . 1 . . . . . 18 ILE HB . 16109 1 210 . 1 1 40 40 ILE HD11 H 1 0.803 0.03 . 1 . . . . . 18 ILE HD1 . 16109 1 211 . 1 1 40 40 ILE HD12 H 1 0.803 0.03 . 1 . . . . . 18 ILE HD1 . 16109 1 212 . 1 1 40 40 ILE HD13 H 1 0.803 0.03 . 1 . . . . . 18 ILE HD1 . 16109 1 213 . 1 1 40 40 ILE HG12 H 1 1.321 0.03 . 2 . . . . . 18 ILE HG12 . 16109 1 214 . 1 1 40 40 ILE HG13 H 1 1.321 0.03 . 2 . . . . . 18 ILE HG13 . 16109 1 215 . 1 1 40 40 ILE HG21 H 1 0.849 0.03 . 1 . . . . . 18 ILE HG2 . 16109 1 216 . 1 1 40 40 ILE HG22 H 1 0.849 0.03 . 1 . . . . . 18 ILE HG2 . 16109 1 217 . 1 1 40 40 ILE HG23 H 1 0.849 0.03 . 1 . . . . . 18 ILE HG2 . 16109 1 218 . 1 1 40 40 ILE C C 13 176.184 0.3 . 1 . . . . . 18 ILE C . 16109 1 219 . 1 1 40 40 ILE CA C 13 58.200 0.3 . 1 . . . . . 18 ILE CA . 16109 1 220 . 1 1 40 40 ILE CB C 13 41.130 0.3 . 1 . . . . . 18 ILE CB . 16109 1 221 . 1 1 40 40 ILE CD1 C 13 13.010 0.3 . 1 . . . . . 18 ILE CD1 . 16109 1 222 . 1 1 40 40 ILE CG1 C 13 27.530 0.3 . 1 . . . . . 18 ILE CG1 . 16109 1 223 . 1 1 40 40 ILE CG2 C 13 18.040 0.3 . 1 . . . . . 18 ILE CG2 . 16109 1 224 . 1 1 40 40 ILE N N 15 126.321 0.3 . 1 . . . . . 18 ILE N . 16109 1 225 . 1 1 41 41 SER H H 1 8.518 0.03 . 1 . . . . . 19 SER H . 16109 1 226 . 1 1 41 41 SER HA H 1 4.939 0.03 . 1 . . . . . 19 SER HA . 16109 1 227 . 1 1 41 41 SER HB2 H 1 3.604 0.03 . 2 . . . . . 19 SER HB2 . 16109 1 228 . 1 1 41 41 SER HB3 H 1 3.546 0.03 . 2 . . . . . 19 SER HB3 . 16109 1 229 . 1 1 41 41 SER C C 13 175.210 0.3 . 1 . . . . . 19 SER C . 16109 1 230 . 1 1 41 41 SER CA C 13 57.160 0.3 . 1 . . . . . 19 SER CA . 16109 1 231 . 1 1 41 41 SER CB C 13 63.660 0.3 . 1 . . . . . 19 SER CB . 16109 1 232 . 1 1 41 41 SER N N 15 120.959 0.3 . 1 . . . . . 19 SER N . 16109 1 233 . 1 1 42 42 CYS H H 1 8.444 0.03 . 1 . . . . . 20 CYS H . 16109 1 234 . 1 1 42 42 CYS HA H 1 3.546 0.03 . 1 . . . . . 20 CYS HA . 16109 1 235 . 1 1 42 42 CYS HB2 H 1 1.890 0.03 . 2 . . . . . 20 CYS HB2 . 16109 1 236 . 1 1 42 42 CYS HB3 H 1 1.013 0.03 . 2 . . . . . 20 CYS HB3 . 16109 1 237 . 1 1 42 42 CYS CA C 13 55.410 0.3 . 1 . . . . . 20 CYS CA . 16109 1 238 . 1 1 42 42 CYS CB C 13 28.570 0.3 . 1 . . . . . 20 CYS CB . 16109 1 239 . 1 1 42 42 CYS N N 15 120.248 0.3 . 1 . . . . . 20 CYS N . 16109 1 240 . 1 1 43 43 PHE HA H 1 4.580 0.03 . 1 . . . . . 21 PHE HA . 16109 1 241 . 1 1 43 43 PHE HB2 H 1 3.055 0.03 . 2 . . . . . 21 PHE HB2 . 16109 1 242 . 1 1 43 43 PHE HB3 H 1 1.984 0.03 . 2 . . . . . 21 PHE HB3 . 16109 1 243 . 1 1 43 43 PHE HD1 H 1 6.795 0.03 . 1 . . . . . 21 PHE HD1 . 16109 1 244 . 1 1 43 43 PHE HD2 H 1 6.795 0.03 . 1 . . . . . 21 PHE HD2 . 16109 1 245 . 1 1 43 43 PHE HE1 H 1 7.137 0.03 . 1 . . . . . 21 PHE HE1 . 16109 1 246 . 1 1 43 43 PHE HE2 H 1 7.137 0.03 . 1 . . . . . 21 PHE HE2 . 16109 1 247 . 1 1 43 43 PHE HZ H 1 7.283 0.03 . 1 . . . . . 21 PHE HZ . 16109 1 248 . 1 1 43 43 PHE C C 13 177.980 0.3 . 1 . . . . . 21 PHE C . 16109 1 249 . 1 1 43 43 PHE CA C 13 56.490 0.3 . 1 . . . . . 21 PHE CA . 16109 1 250 . 1 1 43 43 PHE CB C 13 42.360 0.3 . 1 . . . . . 21 PHE CB . 16109 1 251 . 1 1 43 43 PHE CD1 C 13 131.731 0.3 . 1 . . . . . 21 PHE CD1 . 16109 1 252 . 1 1 43 43 PHE CE1 C 13 131.731 0.3 . 1 . . . . . 21 PHE CE1 . 16109 1 253 . 1 1 43 43 PHE CZ C 13 131.731 0.3 . 1 . . . . . 21 PHE CZ . 16109 1 254 . 1 1 44 44 LEU H H 1 9.159 0.03 . 1 . . . . . 22 LEU H . 16109 1 255 . 1 1 44 44 LEU HA H 1 3.779 0.03 . 1 . . . . . 22 LEU HA . 16109 1 256 . 1 1 44 44 LEU HB2 H 1 1.781 0.03 . 2 . . . . . 22 LEU HB2 . 16109 1 257 . 1 1 44 44 LEU HB3 H 1 1.129 0.03 . 2 . . . . . 22 LEU HB3 . 16109 1 258 . 1 1 44 44 LEU HD11 H 1 0.784 0.03 . 2 . . . . . 22 LEU HD1 . 16109 1 259 . 1 1 44 44 LEU HD12 H 1 0.784 0.03 . 2 . . . . . 22 LEU HD1 . 16109 1 260 . 1 1 44 44 LEU HD13 H 1 0.784 0.03 . 2 . . . . . 22 LEU HD1 . 16109 1 261 . 1 1 44 44 LEU HD21 H 1 0.426 0.03 . 2 . . . . . 22 LEU HD2 . 16109 1 262 . 1 1 44 44 LEU HD22 H 1 0.426 0.03 . 2 . . . . . 22 LEU HD2 . 16109 1 263 . 1 1 44 44 LEU HD23 H 1 0.426 0.03 . 2 . . . . . 22 LEU HD2 . 16109 1 264 . 1 1 44 44 LEU HG H 1 1.549 0.03 . 1 . . . . . 22 LEU HG . 16109 1 265 . 1 1 44 44 LEU C C 13 178.177 0.3 . 1 . . . . . 22 LEU C . 16109 1 266 . 1 1 44 44 LEU CA C 13 56.980 0.3 . 1 . . . . . 22 LEU CA . 16109 1 267 . 1 1 44 44 LEU CB C 13 42.090 0.3 . 1 . . . . . 22 LEU CB . 16109 1 268 . 1 1 44 44 LEU CD1 C 13 25.480 0.3 . 1 . . . . . 22 LEU CD1 . 16109 1 269 . 1 1 44 44 LEU CD2 C 13 23.680 0.3 . 1 . . . . . 22 LEU CD2 . 16109 1 270 . 1 1 44 44 LEU CG C 13 27.030 0.3 . 1 . . . . . 22 LEU CG . 16109 1 271 . 1 1 44 44 LEU N N 15 120.130 0.3 . 1 . . . . . 22 LEU N . 16109 1 272 . 1 1 45 45 ASN H H 1 8.058 0.03 . 1 . . . . . 23 ASN H . 16109 1 273 . 1 1 45 45 ASN HA H 1 4.650 0.03 . 1 . . . . . 23 ASN HA . 16109 1 274 . 1 1 45 45 ASN HB2 H 1 3.028 0.03 . 2 . . . . . 23 ASN HB2 . 16109 1 275 . 1 1 45 45 ASN HB3 H 1 2.740 0.03 . 2 . . . . . 23 ASN HB3 . 16109 1 276 . 1 1 45 45 ASN C C 13 178.364 0.3 . 1 . . . . . 23 ASN C . 16109 1 277 . 1 1 45 45 ASN CA C 13 52.880 0.3 . 1 . . . . . 23 ASN CA . 16109 1 278 . 1 1 45 45 ASN CB C 13 37.320 0.3 . 1 . . . . . 23 ASN CB . 16109 1 279 . 1 1 45 45 ASN N N 15 112.017 0.3 . 1 . . . . . 23 ASN N . 16109 1 280 . 1 1 46 46 TRP H H 1 7.857 0.03 . 1 . . . . . 24 TRP H . 16109 1 281 . 1 1 46 46 TRP HA H 1 4.712 0.03 . 1 . . . . . 24 TRP HA . 16109 1 282 . 1 1 46 46 TRP HB2 H 1 3.354 0.03 . 2 . . . . . 24 TRP HB2 . 16109 1 283 . 1 1 46 46 TRP HB3 H 1 3.257 0.03 . 2 . . . . . 24 TRP HB3 . 16109 1 284 . 1 1 46 46 TRP HD1 H 1 7.146 0.03 . 1 . . . . . 24 TRP HD1 . 16109 1 285 . 1 1 46 46 TRP HE1 H 1 10.228 0.03 . 1 . . . . . 24 TRP HE1 . 16109 1 286 . 1 1 46 46 TRP HE3 H 1 7.115 0.03 . 1 . . . . . 24 TRP HE3 . 16109 1 287 . 1 1 46 46 TRP HH2 H 1 6.263 0.03 . 1 . . . . . 24 TRP HH2 . 16109 1 288 . 1 1 46 46 TRP HZ2 H 1 7.507 0.03 . 1 . . . . . 24 TRP HZ2 . 16109 1 289 . 1 1 46 46 TRP HZ3 H 1 6.743 0.03 . 1 . . . . . 24 TRP HZ3 . 16109 1 290 . 1 1 46 46 TRP C C 13 178.802 0.3 . 1 . . . . . 24 TRP C . 16109 1 291 . 1 1 46 46 TRP CA C 13 57.240 0.3 . 1 . . . . . 24 TRP CA . 16109 1 292 . 1 1 46 46 TRP CB C 13 29.250 0.3 . 1 . . . . . 24 TRP CB . 16109 1 293 . 1 1 46 46 TRP CD1 C 13 124.206 0.3 . 1 . . . . . 24 TRP CD1 . 16109 1 294 . 1 1 46 46 TRP CE3 C 13 118.640 0.3 . 1 . . . . . 24 TRP CE3 . 16109 1 295 . 1 1 46 46 TRP CH2 C 13 125.039 0.3 . 1 . . . . . 24 TRP CH2 . 16109 1 296 . 1 1 46 46 TRP CZ2 C 13 115.074 0.3 . 1 . . . . . 24 TRP CZ2 . 16109 1 297 . 1 1 46 46 TRP CZ3 C 13 121.913 0.3 . 1 . . . . . 24 TRP CZ3 . 16109 1 298 . 1 1 46 46 TRP N N 15 121.301 0.3 . 1 . . . . . 24 TRP N . 16109 1 299 . 1 1 46 46 TRP NE1 N 15 128.417 0.3 . 1 . . . . . 24 TRP NE1 . 16109 1 300 . 1 1 47 47 THR H H 1 7.473 0.03 . 1 . . . . . 25 THR H . 16109 1 301 . 1 1 47 47 THR HA H 1 5.097 0.03 . 1 . . . . . 25 THR HA . 16109 1 302 . 1 1 47 47 THR HB H 1 4.793 0.03 . 1 . . . . . 25 THR HB . 16109 1 303 . 1 1 47 47 THR HG21 H 1 1.240 0.03 . 1 . . . . . 25 THR HG2 . 16109 1 304 . 1 1 47 47 THR HG22 H 1 1.240 0.03 . 1 . . . . . 25 THR HG2 . 16109 1 305 . 1 1 47 47 THR HG23 H 1 1.240 0.03 . 1 . . . . . 25 THR HG2 . 16109 1 306 . 1 1 47 47 THR C C 13 178.375 0.3 . 1 . . . . . 25 THR C . 16109 1 307 . 1 1 47 47 THR CA C 13 59.940 0.3 . 1 . . . . . 25 THR CA . 16109 1 308 . 1 1 47 47 THR CB C 13 71.080 0.3 . 1 . . . . . 25 THR CB . 16109 1 309 . 1 1 47 47 THR CG2 C 13 22.660 0.3 . 1 . . . . . 25 THR CG2 . 16109 1 310 . 1 1 47 47 THR N N 15 109.055 0.3 . 1 . . . . . 25 THR N . 16109 1 311 . 1 1 48 48 VAL H H 1 8.349 0.03 . 1 . . . . . 26 VAL H . 16109 1 312 . 1 1 48 48 VAL HA H 1 3.433 0.03 . 1 . . . . . 26 VAL HA . 16109 1 313 . 1 1 48 48 VAL HB H 1 2.404 0.03 . 1 . . . . . 26 VAL HB . 16109 1 314 . 1 1 48 48 VAL HG11 H 1 0.743 0.03 . 2 . . . . . 26 VAL HG1 . 16109 1 315 . 1 1 48 48 VAL HG12 H 1 0.743 0.03 . 2 . . . . . 26 VAL HG1 . 16109 1 316 . 1 1 48 48 VAL HG13 H 1 0.743 0.03 . 2 . . . . . 26 VAL HG1 . 16109 1 317 . 1 1 48 48 VAL HG21 H 1 0.814 0.03 . 2 . . . . . 26 VAL HG2 . 16109 1 318 . 1 1 48 48 VAL HG22 H 1 0.814 0.03 . 2 . . . . . 26 VAL HG2 . 16109 1 319 . 1 1 48 48 VAL HG23 H 1 0.814 0.03 . 2 . . . . . 26 VAL HG2 . 16109 1 320 . 1 1 48 48 VAL C C 13 180.548 0.3 . 1 . . . . . 26 VAL C . 16109 1 321 . 1 1 48 48 VAL CA C 13 66.460 0.3 . 1 . . . . . 26 VAL CA . 16109 1 322 . 1 1 48 48 VAL CB C 13 31.540 0.3 . 1 . . . . . 26 VAL CB . 16109 1 323 . 1 1 48 48 VAL CG1 C 13 21.390 0.3 . 1 . . . . . 26 VAL CG1 . 16109 1 324 . 1 1 48 48 VAL CG2 C 13 24.760 0.3 . 1 . . . . . 26 VAL CG2 . 16109 1 325 . 1 1 48 48 VAL N N 15 123.048 0.3 . 1 . . . . . 26 VAL N . 16109 1 326 . 1 1 49 49 GLY H H 1 9.099 0.03 . 1 . . . . . 27 GLY H . 16109 1 327 . 1 1 49 49 GLY HA2 H 1 3.895 0.03 . 2 . . . . . 27 GLY HA2 . 16109 1 328 . 1 1 49 49 GLY HA3 H 1 3.512 0.03 . 2 . . . . . 27 GLY HA3 . 16109 1 329 . 1 1 49 49 GLY C C 13 177.909 0.3 . 1 . . . . . 27 GLY C . 16109 1 330 . 1 1 49 49 GLY CA C 13 47.100 0.3 . 1 . . . . . 27 GLY CA . 16109 1 331 . 1 1 49 49 GLY N N 15 107.086 0.3 . 1 . . . . . 27 GLY N . 16109 1 332 . 1 1 50 50 LYS H H 1 7.937 0.03 . 1 . . . . . 28 LYS H . 16109 1 333 . 1 1 50 50 LYS HA H 1 3.907 0.03 . 1 . . . . . 28 LYS HA . 16109 1 334 . 1 1 50 50 LYS HB2 H 1 1.756 0.03 . 2 . . . . . 28 LYS HB2 . 16109 1 335 . 1 1 50 50 LYS HB3 H 1 1.633 0.03 . 2 . . . . . 28 LYS HB3 . 16109 1 336 . 1 1 50 50 LYS HD2 H 1 1.149 0.03 . 2 . . . . . 28 LYS HD2 . 16109 1 337 . 1 1 50 50 LYS HD3 H 1 0.753 0.03 . 2 . . . . . 28 LYS HD3 . 16109 1 338 . 1 1 50 50 LYS HE2 H 1 1.946 0.03 . 2 . . . . . 28 LYS HE2 . 16109 1 339 . 1 1 50 50 LYS HE3 H 1 1.778 0.03 . 2 . . . . . 28 LYS HE3 . 16109 1 340 . 1 1 50 50 LYS HG2 H 1 0.539 0.03 . 2 . . . . . 28 LYS HG2 . 16109 1 341 . 1 1 50 50 LYS HG3 H 1 0.209 0.03 . 2 . . . . . 28 LYS HG3 . 16109 1 342 . 1 1 50 50 LYS C C 13 180.866 0.3 . 1 . . . . . 28 LYS C . 16109 1 343 . 1 1 50 50 LYS CA C 13 59.000 0.3 . 1 . . . . . 28 LYS CA . 16109 1 344 . 1 1 50 50 LYS CB C 13 31.730 0.3 . 1 . . . . . 28 LYS CB . 16109 1 345 . 1 1 50 50 LYS CD C 13 28.660 0.3 . 1 . . . . . 28 LYS CD . 16109 1 346 . 1 1 50 50 LYS CE C 13 41.690 0.3 . 1 . . . . . 28 LYS CE . 16109 1 347 . 1 1 50 50 LYS CG C 13 24.730 0.3 . 1 . . . . . 28 LYS CG . 16109 1 348 . 1 1 50 50 LYS N N 15 125.227 0.3 . 1 . . . . . 28 LYS N . 16109 1 349 . 1 1 51 51 LEU H H 1 8.364 0.03 . 1 . . . . . 29 LEU H . 16109 1 350 . 1 1 51 51 LEU HA H 1 4.357 0.03 . 1 . . . . . 29 LEU HA . 16109 1 351 . 1 1 51 51 LEU HB2 H 1 2.529 0.03 . 2 . . . . . 29 LEU HB2 . 16109 1 352 . 1 1 51 51 LEU HB3 H 1 1.552 0.03 . 2 . . . . . 29 LEU HB3 . 16109 1 353 . 1 1 51 51 LEU HD11 H 1 1.163 0.03 . 2 . . . . . 29 LEU HD1 . 16109 1 354 . 1 1 51 51 LEU HD12 H 1 1.163 0.03 . 2 . . . . . 29 LEU HD1 . 16109 1 355 . 1 1 51 51 LEU HD13 H 1 1.163 0.03 . 2 . . . . . 29 LEU HD1 . 16109 1 356 . 1 1 51 51 LEU HD21 H 1 0.804 0.03 . 2 . . . . . 29 LEU HD2 . 16109 1 357 . 1 1 51 51 LEU HD22 H 1 0.804 0.03 . 2 . . . . . 29 LEU HD2 . 16109 1 358 . 1 1 51 51 LEU HD23 H 1 0.804 0.03 . 2 . . . . . 29 LEU HD2 . 16109 1 359 . 1 1 51 51 LEU HG H 1 1.604 0.03 . 1 . . . . . 29 LEU HG . 16109 1 360 . 1 1 51 51 LEU C C 13 180.056 0.3 . 1 . . . . . 29 LEU C . 16109 1 361 . 1 1 51 51 LEU CA C 13 58.360 0.3 . 1 . . . . . 29 LEU CA . 16109 1 362 . 1 1 51 51 LEU CB C 13 41.510 0.3 . 1 . . . . . 29 LEU CB . 16109 1 363 . 1 1 51 51 LEU CD1 C 13 23.510 0.3 . 1 . . . . . 29 LEU CD1 . 16109 1 364 . 1 1 51 51 LEU CD2 C 13 26.770 0.3 . 1 . . . . . 29 LEU CD2 . 16109 1 365 . 1 1 51 51 LEU CG C 13 27.310 0.3 . 1 . . . . . 29 LEU CG . 16109 1 366 . 1 1 51 51 LEU N N 15 122.366 0.3 . 1 . . . . . 29 LEU N . 16109 1 367 . 1 1 52 52 LYS H H 1 8.711 0.03 . 1 . . . . . 30 LYS H . 16109 1 368 . 1 1 52 52 LYS HA H 1 4.542 0.03 . 1 . . . . . 30 LYS HA . 16109 1 369 . 1 1 52 52 LYS HB2 H 1 1.952 0.03 . 2 . . . . . 30 LYS HB2 . 16109 1 370 . 1 1 52 52 LYS HB3 H 1 1.421 0.03 . 2 . . . . . 30 LYS HB3 . 16109 1 371 . 1 1 52 52 LYS HD2 H 1 1.628 0.03 . 2 . . . . . 30 LYS HD2 . 16109 1 372 . 1 1 52 52 LYS HD3 H 1 1.598 0.03 . 2 . . . . . 30 LYS HD3 . 16109 1 373 . 1 1 52 52 LYS HE2 H 1 2.951 0.03 . 2 . . . . . 30 LYS HE2 . 16109 1 374 . 1 1 52 52 LYS HE3 H 1 2.951 0.03 . 2 . . . . . 30 LYS HE3 . 16109 1 375 . 1 1 52 52 LYS HG2 H 1 1.306 0.03 . 2 . . . . . 30 LYS HG2 . 16109 1 376 . 1 1 52 52 LYS HG3 H 1 1.306 0.03 . 2 . . . . . 30 LYS HG3 . 16109 1 377 . 1 1 52 52 LYS C C 13 182.257 0.3 . 1 . . . . . 30 LYS C . 16109 1 378 . 1 1 52 52 LYS CA C 13 59.310 0.3 . 1 . . . . . 30 LYS CA . 16109 1 379 . 1 1 52 52 LYS CB C 13 33.380 0.3 . 1 . . . . . 30 LYS CB . 16109 1 380 . 1 1 52 52 LYS CD C 13 30.190 0.3 . 1 . . . . . 30 LYS CD . 16109 1 381 . 1 1 52 52 LYS CE C 13 44.240 0.3 . 1 . . . . . 30 LYS CE . 16109 1 382 . 1 1 52 52 LYS CG C 13 26.760 0.3 . 1 . . . . . 30 LYS CG . 16109 1 383 . 1 1 52 52 LYS N N 15 119.050 0.3 . 1 . . . . . 30 LYS N . 16109 1 384 . 1 1 53 53 THR H H 1 8.130 0.03 . 1 . . . . . 31 THR H . 16109 1 385 . 1 1 53 53 THR HA H 1 3.655 0.03 . 1 . . . . . 31 THR HA . 16109 1 386 . 1 1 53 53 THR HB H 1 4.206 0.03 . 1 . . . . . 31 THR HB . 16109 1 387 . 1 1 53 53 THR HG21 H 1 1.155 0.03 . 1 . . . . . 31 THR HG2 . 16109 1 388 . 1 1 53 53 THR HG22 H 1 1.155 0.03 . 1 . . . . . 31 THR HG2 . 16109 1 389 . 1 1 53 53 THR HG23 H 1 1.155 0.03 . 1 . . . . . 31 THR HG2 . 16109 1 390 . 1 1 53 53 THR C C 13 179.092 0.3 . 1 . . . . . 31 THR C . 16109 1 391 . 1 1 53 53 THR CA C 13 66.890 0.3 . 1 . . . . . 31 THR CA . 16109 1 392 . 1 1 53 53 THR CB C 13 68.370 0.3 . 1 . . . . . 31 THR CB . 16109 1 393 . 1 1 53 53 THR CG2 C 13 21.980 0.3 . 1 . . . . . 31 THR CG2 . 16109 1 394 . 1 1 53 53 THR N N 15 118.206 0.3 . 1 . . . . . 31 THR N . 16109 1 395 . 1 1 54 54 HIS H H 1 8.310 0.03 . 1 . . . . . 32 HIS H . 16109 1 396 . 1 1 54 54 HIS HA H 1 4.566 0.03 . 1 . . . . . 32 HIS HA . 16109 1 397 . 1 1 54 54 HIS HB2 H 1 3.644 0.03 . 2 . . . . . 32 HIS HB2 . 16109 1 398 . 1 1 54 54 HIS HB3 H 1 2.975 0.03 . 2 . . . . . 32 HIS HB3 . 16109 1 399 . 1 1 54 54 HIS HE1 H 1 7.922 0.03 . 1 . . . . . 32 HIS HE1 . 16109 1 400 . 1 1 54 54 HIS C C 13 180.735 0.3 . 1 . . . . . 32 HIS C . 16109 1 401 . 1 1 54 54 HIS CA C 13 60.010 0.3 . 1 . . . . . 32 HIS CA . 16109 1 402 . 1 1 54 54 HIS CB C 13 31.620 0.3 . 1 . . . . . 32 HIS CB . 16109 1 403 . 1 1 54 54 HIS CE1 C 13 140.323 0.3 . 1 . . . . . 32 HIS CE1 . 16109 1 404 . 1 1 54 54 HIS N N 15 124.425 0.3 . 1 . . . . . 32 HIS N . 16109 1 405 . 1 1 55 55 LEU H H 1 9.036 0.03 . 1 . . . . . 33 LEU H . 16109 1 406 . 1 1 55 55 LEU HA H 1 3.958 0.03 . 1 . . . . . 33 LEU HA . 16109 1 407 . 1 1 55 55 LEU HB2 H 1 2.441 0.03 . 2 . . . . . 33 LEU HB2 . 16109 1 408 . 1 1 55 55 LEU HB3 H 1 1.002 0.03 . 2 . . . . . 33 LEU HB3 . 16109 1 409 . 1 1 55 55 LEU HD11 H 1 0.773 0.03 . 2 . . . . . 33 LEU HD1 . 16109 1 410 . 1 1 55 55 LEU HD12 H 1 0.773 0.03 . 2 . . . . . 33 LEU HD1 . 16109 1 411 . 1 1 55 55 LEU HD13 H 1 0.773 0.03 . 2 . . . . . 33 LEU HD1 . 16109 1 412 . 1 1 55 55 LEU HD21 H 1 0.819 0.03 . 2 . . . . . 33 LEU HD2 . 16109 1 413 . 1 1 55 55 LEU HD22 H 1 0.819 0.03 . 2 . . . . . 33 LEU HD2 . 16109 1 414 . 1 1 55 55 LEU HD23 H 1 0.819 0.03 . 2 . . . . . 33 LEU HD2 . 16109 1 415 . 1 1 55 55 LEU HG H 1 2.016 0.03 . 1 . . . . . 33 LEU HG . 16109 1 416 . 1 1 55 55 LEU C C 13 180.877 0.3 . 1 . . . . . 33 LEU C . 16109 1 417 . 1 1 55 55 LEU CA C 13 58.180 0.3 . 1 . . . . . 33 LEU CA . 16109 1 418 . 1 1 55 55 LEU CB C 13 40.710 0.3 . 1 . . . . . 33 LEU CB . 16109 1 419 . 1 1 55 55 LEU CD1 C 13 26.040 0.3 . 1 . . . . . 33 LEU CD1 . 16109 1 420 . 1 1 55 55 LEU CD2 C 13 23.510 0.3 . 1 . . . . . 33 LEU CD2 . 16109 1 421 . 1 1 55 55 LEU CG C 13 27.180 0.3 . 1 . . . . . 33 LEU CG . 16109 1 422 . 1 1 55 55 LEU N N 15 119.746 0.3 . 1 . . . . . 33 LEU N . 16109 1 423 . 1 1 56 56 SER H H 1 8.266 0.03 . 1 . . . . . 34 SER H . 16109 1 424 . 1 1 56 56 SER HA H 1 4.159 0.03 . 1 . . . . . 34 SER HA . 16109 1 425 . 1 1 56 56 SER HB2 H 1 3.916 0.03 . 2 . . . . . 34 SER HB2 . 16109 1 426 . 1 1 56 56 SER HB3 H 1 3.785 0.03 . 2 . . . . . 34 SER HB3 . 16109 1 427 . 1 1 56 56 SER C C 13 176.015 0.3 . 1 . . . . . 34 SER C . 16109 1 428 . 1 1 56 56 SER CA C 13 61.590 0.3 . 1 . . . . . 34 SER CA . 16109 1 429 . 1 1 56 56 SER CB C 13 63.600 0.3 . 1 . . . . . 34 SER CB . 16109 1 430 . 1 1 56 56 SER N N 15 114.534 0.3 . 1 . . . . . 34 SER N . 16109 1 431 . 1 1 57 57 ASN H H 1 7.273 0.03 . 1 . . . . . 35 ASN H . 16109 1 432 . 1 1 57 57 ASN HA H 1 4.799 0.03 . 1 . . . . . 35 ASN HA . 16109 1 433 . 1 1 57 57 ASN HB2 H 1 2.903 0.03 . 2 . . . . . 35 ASN HB2 . 16109 1 434 . 1 1 57 57 ASN HB3 H 1 2.712 0.03 . 2 . . . . . 35 ASN HB3 . 16109 1 435 . 1 1 57 57 ASN HD21 H 1 7.420 0.03 . 2 . . . . . 35 ASN HD21 . 16109 1 436 . 1 1 57 57 ASN HD22 H 1 6.907 0.03 . 2 . . . . . 35 ASN HD22 . 16109 1 437 . 1 1 57 57 ASN C C 13 179.004 0.3 . 1 . . . . . 35 ASN C . 16109 1 438 . 1 1 57 57 ASN CA C 13 54.520 0.3 . 1 . . . . . 35 ASN CA . 16109 1 439 . 1 1 57 57 ASN CB C 13 40.890 0.3 . 1 . . . . . 35 ASN CB . 16109 1 440 . 1 1 57 57 ASN N N 15 115.349 0.3 . 1 . . . . . 35 ASN N . 16109 1 441 . 1 1 57 57 ASN ND2 N 15 114.278 0.3 . 1 . . . . . 35 ASN ND2 . 16109 1 442 . 1 1 58 58 VAL H H 1 7.810 0.03 . 1 . . . . . 36 VAL H . 16109 1 443 . 1 1 58 58 VAL HA H 1 4.309 0.03 . 1 . . . . . 36 VAL HA . 16109 1 444 . 1 1 58 58 VAL HB H 1 2.093 0.03 . 1 . . . . . 36 VAL HB . 16109 1 445 . 1 1 58 58 VAL HG11 H 1 0.640 0.03 . 2 . . . . . 36 VAL HG1 . 16109 1 446 . 1 1 58 58 VAL HG12 H 1 0.640 0.03 . 2 . . . . . 36 VAL HG1 . 16109 1 447 . 1 1 58 58 VAL HG13 H 1 0.640 0.03 . 2 . . . . . 36 VAL HG1 . 16109 1 448 . 1 1 58 58 VAL HG21 H 1 0.486 0.03 . 2 . . . . . 36 VAL HG2 . 16109 1 449 . 1 1 58 58 VAL HG22 H 1 0.486 0.03 . 2 . . . . . 36 VAL HG2 . 16109 1 450 . 1 1 58 58 VAL HG23 H 1 0.486 0.03 . 2 . . . . . 36 VAL HG2 . 16109 1 451 . 1 1 58 58 VAL C C 13 178.446 0.3 . 1 . . . . . 36 VAL C . 16109 1 452 . 1 1 58 58 VAL CA C 13 62.350 0.3 . 1 . . . . . 36 VAL CA . 16109 1 453 . 1 1 58 58 VAL CB C 13 32.980 0.3 . 1 . . . . . 36 VAL CB . 16109 1 454 . 1 1 58 58 VAL CG1 C 13 20.790 0.3 . 1 . . . . . 36 VAL CG1 . 16109 1 455 . 1 1 58 58 VAL CG2 C 13 18.770 0.3 . 1 . . . . . 36 VAL CG2 . 16109 1 456 . 1 1 58 58 VAL N N 15 110.874 0.3 . 1 . . . . . 36 VAL N . 16109 1 457 . 1 1 59 59 TYR H H 1 8.896 0.03 . 1 . . . . . 37 TYR H . 16109 1 458 . 1 1 59 59 TYR HA H 1 4.482 0.03 . 1 . . . . . 37 TYR HA . 16109 1 459 . 1 1 59 59 TYR HB2 H 1 2.848 0.03 . 2 . . . . . 37 TYR HB2 . 16109 1 460 . 1 1 59 59 TYR HB3 H 1 2.814 0.03 . 2 . . . . . 37 TYR HB3 . 16109 1 461 . 1 1 59 59 TYR HD1 H 1 6.860 0.03 . 1 . . . . . 37 TYR HD1 . 16109 1 462 . 1 1 59 59 TYR HD2 H 1 6.860 0.03 . 1 . . . . . 37 TYR HD2 . 16109 1 463 . 1 1 59 59 TYR HE1 H 1 6.580 0.03 . 1 . . . . . 37 TYR HE1 . 16109 1 464 . 1 1 59 59 TYR HE2 H 1 6.580 0.03 . 1 . . . . . 37 TYR HE2 . 16109 1 465 . 1 1 59 59 TYR CA C 13 57.740 0.3 . 1 . . . . . 37 TYR CA . 16109 1 466 . 1 1 59 59 TYR CB C 13 40.440 0.3 . 1 . . . . . 37 TYR CB . 16109 1 467 . 1 1 59 59 TYR CD1 C 13 132.082 0.3 . 1 . . . . . 37 TYR CD1 . 16109 1 468 . 1 1 59 59 TYR CE1 C 13 118.961 0.3 . 1 . . . . . 37 TYR CE1 . 16109 1 469 . 1 1 59 59 TYR N N 15 127.773 0.3 . 1 . . . . . 37 TYR N . 16109 1 470 . 1 1 60 60 PRO HA H 1 3.956 0.03 . 1 . . . . . 38 PRO HA . 16109 1 471 . 1 1 60 60 PRO HB2 H 1 2.003 0.03 . 2 . . . . . 38 PRO HB2 . 16109 1 472 . 1 1 60 60 PRO HB3 H 1 1.015 0.03 . 2 . . . . . 38 PRO HB3 . 16109 1 473 . 1 1 60 60 PRO HD2 H 1 3.065 0.03 . 2 . . . . . 38 PRO HD2 . 16109 1 474 . 1 1 60 60 PRO HD3 H 1 3.065 0.03 . 2 . . . . . 38 PRO HD3 . 16109 1 475 . 1 1 60 60 PRO HG2 H 1 1.546 0.03 . 2 . . . . . 38 PRO HG2 . 16109 1 476 . 1 1 60 60 PRO HG3 H 1 1.036 0.03 . 2 . . . . . 38 PRO HG3 . 16109 1 477 . 1 1 60 60 PRO C C 13 178.511 0.3 . 1 . . . . . 38 PRO C . 16109 1 478 . 1 1 60 60 PRO CA C 13 65.560 0.3 . 1 . . . . . 38 PRO CA . 16109 1 479 . 1 1 60 60 PRO CB C 13 31.860 0.3 . 1 . . . . . 38 PRO CB . 16109 1 480 . 1 1 60 60 PRO CD C 13 49.830 0.3 . 1 . . . . . 38 PRO CD . 16109 1 481 . 1 1 60 60 PRO CG C 13 27.270 0.3 . 1 . . . . . 38 PRO CG . 16109 1 482 . 1 1 61 61 SER H H 1 6.571 0.03 . 1 . . . . . 39 SER H . 16109 1 483 . 1 1 61 61 SER HA H 1 4.238 0.03 . 1 . . . . . 39 SER HA . 16109 1 484 . 1 1 61 61 SER HB2 H 1 4.104 0.03 . 2 . . . . . 39 SER HB2 . 16109 1 485 . 1 1 61 61 SER HB3 H 1 3.766 0.03 . 2 . . . . . 39 SER HB3 . 16109 1 486 . 1 1 61 61 SER C C 13 175.774 0.3 . 1 . . . . . 39 SER C . 16109 1 487 . 1 1 61 61 SER CA C 13 58.290 0.3 . 1 . . . . . 39 SER CA . 16109 1 488 . 1 1 61 61 SER CB C 13 63.420 0.3 . 1 . . . . . 39 SER CB . 16109 1 489 . 1 1 61 61 SER N N 15 108.382 0.3 . 1 . . . . . 39 SER N . 16109 1 490 . 1 1 62 62 LYS H H 1 8.384 0.03 . 1 . . . . . 40 LYS H . 16109 1 491 . 1 1 62 62 LYS HA H 1 3.922 0.03 . 1 . . . . . 40 LYS HA . 16109 1 492 . 1 1 62 62 LYS HB2 H 1 1.869 0.03 . 2 . . . . . 40 LYS HB2 . 16109 1 493 . 1 1 62 62 LYS HB3 H 1 1.842 0.03 . 2 . . . . . 40 LYS HB3 . 16109 1 494 . 1 1 62 62 LYS HD2 H 1 1.686 0.03 . 2 . . . . . 40 LYS HD2 . 16109 1 495 . 1 1 62 62 LYS HD3 H 1 1.588 0.03 . 2 . . . . . 40 LYS HD3 . 16109 1 496 . 1 1 62 62 LYS HE2 H 1 2.959 0.03 . 2 . . . . . 40 LYS HE2 . 16109 1 497 . 1 1 62 62 LYS HE3 H 1 2.959 0.03 . 2 . . . . . 40 LYS HE3 . 16109 1 498 . 1 1 62 62 LYS HG2 H 1 1.351 0.03 . 2 . . . . . 40 LYS HG2 . 16109 1 499 . 1 1 62 62 LYS HG3 H 1 1.212 0.03 . 2 . . . . . 40 LYS HG3 . 16109 1 500 . 1 1 62 62 LYS CA C 13 56.710 0.3 . 1 . . . . . 40 LYS CA . 16109 1 501 . 1 1 62 62 LYS CB C 13 30.640 0.3 . 1 . . . . . 40 LYS CB . 16109 1 502 . 1 1 62 62 LYS CD C 13 28.770 0.3 . 1 . . . . . 40 LYS CD . 16109 1 503 . 1 1 62 62 LYS CE C 13 42.300 0.3 . 1 . . . . . 40 LYS CE . 16109 1 504 . 1 1 62 62 LYS CG C 13 25.000 0.3 . 1 . . . . . 40 LYS CG . 16109 1 505 . 1 1 62 62 LYS N N 15 118.443 0.3 . 1 . . . . . 40 LYS N . 16109 1 506 . 1 1 63 63 PRO HA H 1 4.284 0.03 . 1 . . . . . 41 PRO HA . 16109 1 507 . 1 1 63 63 PRO HB2 H 1 1.967 0.03 . 2 . . . . . 41 PRO HB2 . 16109 1 508 . 1 1 63 63 PRO HB3 H 1 1.647 0.03 . 2 . . . . . 41 PRO HB3 . 16109 1 509 . 1 1 63 63 PRO HD2 H 1 3.836 0.03 . 2 . . . . . 41 PRO HD2 . 16109 1 510 . 1 1 63 63 PRO HD3 H 1 3.575 0.03 . 2 . . . . . 41 PRO HD3 . 16109 1 511 . 1 1 63 63 PRO HG2 H 1 1.828 0.03 . 2 . . . . . 41 PRO HG2 . 16109 1 512 . 1 1 63 63 PRO HG3 H 1 1.506 0.03 . 2 . . . . . 41 PRO HG3 . 16109 1 513 . 1 1 63 63 PRO C C 13 179.464 0.3 . 1 . . . . . 41 PRO C . 16109 1 514 . 1 1 63 63 PRO CA C 13 62.620 0.3 . 1 . . . . . 41 PRO CA . 16109 1 515 . 1 1 63 63 PRO CB C 13 31.640 0.3 . 1 . . . . . 41 PRO CB . 16109 1 516 . 1 1 63 63 PRO CD C 13 50.000 0.3 . 1 . . . . . 41 PRO CD . 16109 1 517 . 1 1 63 63 PRO CG C 13 26.390 0.3 . 1 . . . . . 41 PRO CG . 16109 1 518 . 1 1 64 64 LEU H H 1 8.689 0.03 . 1 . . . . . 42 LEU H . 16109 1 519 . 1 1 64 64 LEU HA H 1 4.212 0.03 . 1 . . . . . 42 LEU HA . 16109 1 520 . 1 1 64 64 LEU HB2 H 1 1.684 0.03 . 2 . . . . . 42 LEU HB2 . 16109 1 521 . 1 1 64 64 LEU HB3 H 1 1.581 0.03 . 2 . . . . . 42 LEU HB3 . 16109 1 522 . 1 1 64 64 LEU HD11 H 1 0.937 0.03 . 2 . . . . . 42 LEU HD1 . 16109 1 523 . 1 1 64 64 LEU HD12 H 1 0.937 0.03 . 2 . . . . . 42 LEU HD1 . 16109 1 524 . 1 1 64 64 LEU HD13 H 1 0.937 0.03 . 2 . . . . . 42 LEU HD1 . 16109 1 525 . 1 1 64 64 LEU HD21 H 1 0.917 0.03 . 2 . . . . . 42 LEU HD2 . 16109 1 526 . 1 1 64 64 LEU HD22 H 1 0.917 0.03 . 2 . . . . . 42 LEU HD2 . 16109 1 527 . 1 1 64 64 LEU HD23 H 1 0.917 0.03 . 2 . . . . . 42 LEU HD2 . 16109 1 528 . 1 1 64 64 LEU HG H 1 1.852 0.03 . 1 . . . . . 42 LEU HG . 16109 1 529 . 1 1 64 64 LEU C C 13 182.476 0.3 . 1 . . . . . 42 LEU C . 16109 1 530 . 1 1 64 64 LEU CA C 13 54.750 0.3 . 1 . . . . . 42 LEU CA . 16109 1 531 . 1 1 64 64 LEU CB C 13 41.360 0.3 . 1 . . . . . 42 LEU CB . 16109 1 532 . 1 1 64 64 LEU CD1 C 13 25.700 0.3 . 1 . . . . . 42 LEU CD1 . 16109 1 533 . 1 1 64 64 LEU CD2 C 13 23.050 0.3 . 1 . . . . . 42 LEU CD2 . 16109 1 534 . 1 1 64 64 LEU CG C 13 27.440 0.3 . 1 . . . . . 42 LEU CG . 16109 1 535 . 1 1 64 64 LEU N N 15 122.677 0.3 . 1 . . . . . 42 LEU N . 16109 1 536 . 1 1 65 65 THR H H 1 8.858 0.03 . 1 . . . . . 43 THR H . 16109 1 537 . 1 1 65 65 THR HA H 1 3.779 0.03 . 1 . . . . . 43 THR HA . 16109 1 538 . 1 1 65 65 THR HB H 1 4.120 0.03 . 1 . . . . . 43 THR HB . 16109 1 539 . 1 1 65 65 THR HG21 H 1 1.153 0.03 . 1 . . . . . 43 THR HG2 . 16109 1 540 . 1 1 65 65 THR HG22 H 1 1.153 0.03 . 1 . . . . . 43 THR HG2 . 16109 1 541 . 1 1 65 65 THR HG23 H 1 1.153 0.03 . 1 . . . . . 43 THR HG2 . 16109 1 542 . 1 1 65 65 THR C C 13 180.078 0.3 . 1 . . . . . 43 THR C . 16109 1 543 . 1 1 65 65 THR CA C 13 66.310 0.3 . 1 . . . . . 43 THR CA . 16109 1 544 . 1 1 65 65 THR CB C 13 68.100 0.3 . 1 . . . . . 43 THR CB . 16109 1 545 . 1 1 65 65 THR CG2 C 13 21.820 0.3 . 1 . . . . . 43 THR CG2 . 16109 1 546 . 1 1 65 65 THR N N 15 116.000 0.3 . 1 . . . . . 43 THR N . 16109 1 547 . 1 1 66 66 LYS H H 1 7.921 0.03 . 1 . . . . . 44 LYS H . 16109 1 548 . 1 1 66 66 LYS HA H 1 4.125 0.03 . 1 . . . . . 44 LYS HA . 16109 1 549 . 1 1 66 66 LYS HB2 H 1 1.824 0.03 . 2 . . . . . 44 LYS HB2 . 16109 1 550 . 1 1 66 66 LYS HB3 H 1 1.736 0.03 . 2 . . . . . 44 LYS HB3 . 16109 1 551 . 1 1 66 66 LYS HD2 H 1 1.630 0.03 . 2 . . . . . 44 LYS HD2 . 16109 1 552 . 1 1 66 66 LYS HD3 H 1 1.530 0.03 . 2 . . . . . 44 LYS HD3 . 16109 1 553 . 1 1 66 66 LYS HE2 H 1 2.952 0.03 . 2 . . . . . 44 LYS HE2 . 16109 1 554 . 1 1 66 66 LYS HE3 H 1 2.880 0.03 . 2 . . . . . 44 LYS HE3 . 16109 1 555 . 1 1 66 66 LYS HG2 H 1 1.266 0.03 . 2 . . . . . 44 LYS HG2 . 16109 1 556 . 1 1 66 66 LYS HG3 H 1 1.266 0.03 . 2 . . . . . 44 LYS HG3 . 16109 1 557 . 1 1 66 66 LYS C C 13 177.953 0.3 . 1 . . . . . 44 LYS C . 16109 1 558 . 1 1 66 66 LYS CA C 13 57.730 0.3 . 1 . . . . . 44 LYS CA . 16109 1 559 . 1 1 66 66 LYS CB C 13 31.890 0.3 . 1 . . . . . 44 LYS CB . 16109 1 560 . 1 1 66 66 LYS CD C 13 29.490 0.3 . 1 . . . . . 44 LYS CD . 16109 1 561 . 1 1 66 66 LYS CE C 13 42.070 0.3 . 1 . . . . . 44 LYS CE . 16109 1 562 . 1 1 66 66 LYS CG C 13 23.500 0.3 . 1 . . . . . 44 LYS CG . 16109 1 563 . 1 1 66 66 LYS N N 15 117.614 0.3 . 1 . . . . . 44 LYS N . 16109 1 564 . 1 1 67 67 ASP H H 1 7.394 0.03 . 1 . . . . . 45 ASP H . 16109 1 565 . 1 1 67 67 ASP HA H 1 4.746 0.03 . 1 . . . . . 45 ASP HA . 16109 1 566 . 1 1 67 67 ASP HB2 H 1 2.848 0.03 . 2 . . . . . 45 ASP HB2 . 16109 1 567 . 1 1 67 67 ASP HB3 H 1 2.495 0.03 . 2 . . . . . 45 ASP HB3 . 16109 1 568 . 1 1 67 67 ASP C C 13 177.876 0.3 . 1 . . . . . 45 ASP C . 16109 1 569 . 1 1 67 67 ASP CA C 13 54.350 0.3 . 1 . . . . . 45 ASP CA . 16109 1 570 . 1 1 67 67 ASP CB C 13 42.090 0.3 . 1 . . . . . 45 ASP CB . 16109 1 571 . 1 1 67 67 ASP N N 15 118.443 0.3 . 1 . . . . . 45 ASP N . 16109 1 572 . 1 1 68 68 GLN H H 1 7.143 0.03 . 1 . . . . . 46 GLN H . 16109 1 573 . 1 1 68 68 GLN HA H 1 4.054 0.03 . 1 . . . . . 46 GLN HA . 16109 1 574 . 1 1 68 68 GLN HB2 H 1 1.786 0.03 . 2 . . . . . 46 GLN HB2 . 16109 1 575 . 1 1 68 68 GLN HB3 H 1 1.730 0.03 . 2 . . . . . 46 GLN HB3 . 16109 1 576 . 1 1 68 68 GLN HG2 H 1 2.354 0.03 . 2 . . . . . 46 GLN HG2 . 16109 1 577 . 1 1 68 68 GLN HG3 H 1 1.641 0.03 . 2 . . . . . 46 GLN HG3 . 16109 1 578 . 1 1 68 68 GLN C C 13 177.515 0.3 . 1 . . . . . 46 GLN C . 16109 1 579 . 1 1 68 68 GLN CA C 13 56.750 0.3 . 1 . . . . . 46 GLN CA . 16109 1 580 . 1 1 68 68 GLN CB C 13 31.150 0.3 . 1 . . . . . 46 GLN CB . 16109 1 581 . 1 1 68 68 GLN CG C 13 33.810 0.3 . 1 . . . . . 46 GLN CG . 16109 1 582 . 1 1 68 68 GLN N N 15 120.205 0.3 . 1 . . . . . 46 GLN N . 16109 1 583 . 1 1 69 69 ARG H H 1 8.269 0.03 . 1 . . . . . 47 ARG H . 16109 1 584 . 1 1 69 69 ARG HA H 1 4.334 0.03 . 1 . . . . . 47 ARG HA . 16109 1 585 . 1 1 69 69 ARG HB2 H 1 1.926 0.03 . 2 . . . . . 47 ARG HB2 . 16109 1 586 . 1 1 69 69 ARG HB3 H 1 1.334 0.03 . 2 . . . . . 47 ARG HB3 . 16109 1 587 . 1 1 69 69 ARG HD2 H 1 3.144 0.03 . 2 . . . . . 47 ARG HD2 . 16109 1 588 . 1 1 69 69 ARG HD3 H 1 3.005 0.03 . 2 . . . . . 47 ARG HD3 . 16109 1 589 . 1 1 69 69 ARG HG2 H 1 1.514 0.03 . 2 . . . . . 47 ARG HG2 . 16109 1 590 . 1 1 69 69 ARG HG3 H 1 1.514 0.03 . 2 . . . . . 47 ARG HG3 . 16109 1 591 . 1 1 69 69 ARG C C 13 175.708 0.3 . 1 . . . . . 47 ARG C . 16109 1 592 . 1 1 69 69 ARG CA C 13 55.010 0.3 . 1 . . . . . 47 ARG CA . 16109 1 593 . 1 1 69 69 ARG CB C 13 31.390 0.3 . 1 . . . . . 47 ARG CB . 16109 1 594 . 1 1 69 69 ARG CD C 13 43.430 0.3 . 1 . . . . . 47 ARG CD . 16109 1 595 . 1 1 69 69 ARG CG C 13 26.880 0.3 . 1 . . . . . 47 ARG CG . 16109 1 596 . 1 1 69 69 ARG N N 15 124.781 0.3 . 1 . . . . . 47 ARG N . 16109 1 597 . 1 1 70 70 LEU H H 1 8.254 0.03 . 1 . . . . . 48 LEU H . 16109 1 598 . 1 1 70 70 LEU HA H 1 5.444 0.03 . 1 . . . . . 48 LEU HA . 16109 1 599 . 1 1 70 70 LEU HB2 H 1 1.522 0.03 . 2 . . . . . 48 LEU HB2 . 16109 1 600 . 1 1 70 70 LEU HB3 H 1 1.078 0.03 . 2 . . . . . 48 LEU HB3 . 16109 1 601 . 1 1 70 70 LEU HD11 H 1 0.746 0.03 . 2 . . . . . 48 LEU HD1 . 16109 1 602 . 1 1 70 70 LEU HD12 H 1 0.746 0.03 . 2 . . . . . 48 LEU HD1 . 16109 1 603 . 1 1 70 70 LEU HD13 H 1 0.746 0.03 . 2 . . . . . 48 LEU HD1 . 16109 1 604 . 1 1 70 70 LEU HD21 H 1 0.717 0.03 . 2 . . . . . 48 LEU HD2 . 16109 1 605 . 1 1 70 70 LEU HD22 H 1 0.717 0.03 . 2 . . . . . 48 LEU HD2 . 16109 1 606 . 1 1 70 70 LEU HD23 H 1 0.717 0.03 . 2 . . . . . 48 LEU HD2 . 16109 1 607 . 1 1 70 70 LEU HG H 1 1.395 0.03 . 1 . . . . . 48 LEU HG . 16109 1 608 . 1 1 70 70 LEU C C 13 177.175 0.3 . 1 . . . . . 48 LEU C . 16109 1 609 . 1 1 70 70 LEU CA C 13 52.810 0.3 . 1 . . . . . 48 LEU CA . 16109 1 610 . 1 1 70 70 LEU CB C 13 45.100 0.3 . 1 . . . . . 48 LEU CB . 16109 1 611 . 1 1 70 70 LEU CD1 C 13 26.900 0.3 . 1 . . . . . 48 LEU CD1 . 16109 1 612 . 1 1 70 70 LEU CD2 C 13 23.950 0.3 . 1 . . . . . 48 LEU CD2 . 16109 1 613 . 1 1 70 70 LEU CG C 13 26.900 0.3 . 1 . . . . . 48 LEU CG . 16109 1 614 . 1 1 70 70 LEU N N 15 122.071 0.3 . 1 . . . . . 48 LEU N . 16109 1 615 . 1 1 71 71 VAL H H 1 9.251 0.03 . 1 . . . . . 49 VAL H . 16109 1 616 . 1 1 71 71 VAL HA H 1 4.889 0.03 . 1 . . . . . 49 VAL HA . 16109 1 617 . 1 1 71 71 VAL HB H 1 1.776 0.03 . 1 . . . . . 49 VAL HB . 16109 1 618 . 1 1 71 71 VAL HG11 H 1 0.603 0.03 . 2 . . . . . 49 VAL HG1 . 16109 1 619 . 1 1 71 71 VAL HG12 H 1 0.603 0.03 . 2 . . . . . 49 VAL HG1 . 16109 1 620 . 1 1 71 71 VAL HG13 H 1 0.603 0.03 . 2 . . . . . 49 VAL HG1 . 16109 1 621 . 1 1 71 71 VAL HG21 H 1 0.719 0.03 . 2 . . . . . 49 VAL HG2 . 16109 1 622 . 1 1 71 71 VAL HG22 H 1 0.719 0.03 . 2 . . . . . 49 VAL HG2 . 16109 1 623 . 1 1 71 71 VAL HG23 H 1 0.719 0.03 . 2 . . . . . 49 VAL HG2 . 16109 1 624 . 1 1 71 71 VAL C C 13 177.208 0.3 . 1 . . . . . 49 VAL C . 16109 1 625 . 1 1 71 71 VAL CA C 13 60.570 0.3 . 1 . . . . . 49 VAL CA . 16109 1 626 . 1 1 71 71 VAL CB C 13 34.580 0.3 . 1 . . . . . 49 VAL CB . 16109 1 627 . 1 1 71 71 VAL CG1 C 13 20.950 0.3 . 1 . . . . . 49 VAL CG1 . 16109 1 628 . 1 1 71 71 VAL CG2 C 13 21.980 0.3 . 1 . . . . . 49 VAL CG2 . 16109 1 629 . 1 1 71 71 VAL N N 15 122.797 0.3 . 1 . . . . . 49 VAL N . 16109 1 630 . 1 1 72 72 TYR H H 1 8.684 0.03 . 1 . . . . . 50 TYR H . 16109 1 631 . 1 1 72 72 TYR HA H 1 5.155 0.03 . 1 . . . . . 50 TYR HA . 16109 1 632 . 1 1 72 72 TYR HB2 H 1 2.828 0.03 . 2 . . . . . 50 TYR HB2 . 16109 1 633 . 1 1 72 72 TYR HB3 H 1 2.748 0.03 . 2 . . . . . 50 TYR HB3 . 16109 1 634 . 1 1 72 72 TYR HD1 H 1 7.221 0.03 . 1 . . . . . 50 TYR HD1 . 16109 1 635 . 1 1 72 72 TYR HD2 H 1 7.221 0.03 . 1 . . . . . 50 TYR HD2 . 16109 1 636 . 1 1 72 72 TYR HE1 H 1 6.974 0.03 . 1 . . . . . 50 TYR HE1 . 16109 1 637 . 1 1 72 72 TYR HE2 H 1 6.974 0.03 . 1 . . . . . 50 TYR HE2 . 16109 1 638 . 1 1 72 72 TYR CA C 13 56.060 0.3 . 1 . . . . . 50 TYR CA . 16109 1 639 . 1 1 72 72 TYR CB C 13 43.140 0.3 . 1 . . . . . 50 TYR CB . 16109 1 640 . 1 1 72 72 TYR CD1 C 13 133.748 0.3 . 1 . . . . . 50 TYR CD1 . 16109 1 641 . 1 1 72 72 TYR CE1 C 13 118.756 0.3 . 1 . . . . . 50 TYR CE1 . 16109 1 642 . 1 1 72 72 TYR N N 15 126.349 0.3 . 1 . . . . . 50 TYR N . 16109 1 643 . 1 1 73 73 SER HA H 1 3.673 0.03 . 1 . . . . . 51 SER HA . 16109 1 644 . 1 1 73 73 SER HB2 H 1 3.882 0.03 . 2 . . . . . 51 SER HB2 . 16109 1 645 . 1 1 73 73 SER HB3 H 1 3.049 0.03 . 2 . . . . . 51 SER HB3 . 16109 1 646 . 1 1 73 73 SER C C 13 177.153 0.3 . 1 . . . . . 51 SER C . 16109 1 647 . 1 1 73 73 SER CA C 13 58.000 0.3 . 1 . . . . . 51 SER CA . 16109 1 648 . 1 1 73 73 SER CB C 13 62.190 0.3 . 1 . . . . . 51 SER CB . 16109 1 649 . 1 1 74 74 GLY H H 1 8.209 0.03 . 1 . . . . . 52 GLY H . 16109 1 650 . 1 1 74 74 GLY HA2 H 1 4.030 0.03 . 2 . . . . . 52 GLY HA2 . 16109 1 651 . 1 1 74 74 GLY HA3 H 1 3.346 0.03 . 2 . . . . . 52 GLY HA3 . 16109 1 652 . 1 1 74 74 GLY C C 13 175.259 0.3 . 1 . . . . . 52 GLY C . 16109 1 653 . 1 1 74 74 GLY CA C 13 44.990 0.3 . 1 . . . . . 52 GLY CA . 16109 1 654 . 1 1 74 74 GLY N N 15 103.501 0.3 . 1 . . . . . 52 GLY N . 16109 1 655 . 1 1 75 75 ARG H H 1 7.816 0.03 . 1 . . . . . 53 ARG H . 16109 1 656 . 1 1 75 75 ARG HA H 1 4.555 0.03 . 1 . . . . . 53 ARG HA . 16109 1 657 . 1 1 75 75 ARG HB2 H 1 1.920 0.03 . 2 . . . . . 53 ARG HB2 . 16109 1 658 . 1 1 75 75 ARG HB3 H 1 1.807 0.03 . 2 . . . . . 53 ARG HB3 . 16109 1 659 . 1 1 75 75 ARG HD2 H 1 3.192 0.03 . 2 . . . . . 53 ARG HD2 . 16109 1 660 . 1 1 75 75 ARG HD3 H 1 3.088 0.03 . 2 . . . . . 53 ARG HD3 . 16109 1 661 . 1 1 75 75 ARG HG2 H 1 1.660 0.03 . 2 . . . . . 53 ARG HG2 . 16109 1 662 . 1 1 75 75 ARG HG3 H 1 1.508 0.03 . 2 . . . . . 53 ARG HG3 . 16109 1 663 . 1 1 75 75 ARG C C 13 176.321 0.3 . 1 . . . . . 53 ARG C . 16109 1 664 . 1 1 75 75 ARG CA C 13 54.590 0.3 . 1 . . . . . 53 ARG CA . 16109 1 665 . 1 1 75 75 ARG CB C 13 32.620 0.3 . 1 . . . . . 53 ARG CB . 16109 1 666 . 1 1 75 75 ARG CD C 13 43.970 0.3 . 1 . . . . . 53 ARG CD . 16109 1 667 . 1 1 75 75 ARG CG C 13 26.700 0.3 . 1 . . . . . 53 ARG CG . 16109 1 668 . 1 1 75 75 ARG N N 15 121.834 0.3 . 1 . . . . . 53 ARG N . 16109 1 669 . 1 1 76 76 LEU H H 1 8.470 0.03 . 1 . . . . . 54 LEU H . 16109 1 670 . 1 1 76 76 LEU HA H 1 4.500 0.03 . 1 . . . . . 54 LEU HA . 16109 1 671 . 1 1 76 76 LEU HB2 H 1 1.630 0.03 . 2 . . . . . 54 LEU HB2 . 16109 1 672 . 1 1 76 76 LEU HB3 H 1 1.427 0.03 . 2 . . . . . 54 LEU HB3 . 16109 1 673 . 1 1 76 76 LEU HD11 H 1 0.830 0.03 . 2 . . . . . 54 LEU HD1 . 16109 1 674 . 1 1 76 76 LEU HD12 H 1 0.830 0.03 . 2 . . . . . 54 LEU HD1 . 16109 1 675 . 1 1 76 76 LEU HD13 H 1 0.830 0.03 . 2 . . . . . 54 LEU HD1 . 16109 1 676 . 1 1 76 76 LEU HD21 H 1 0.808 0.03 . 2 . . . . . 54 LEU HD2 . 16109 1 677 . 1 1 76 76 LEU HD22 H 1 0.808 0.03 . 2 . . . . . 54 LEU HD2 . 16109 1 678 . 1 1 76 76 LEU HD23 H 1 0.808 0.03 . 2 . . . . . 54 LEU HD2 . 16109 1 679 . 1 1 76 76 LEU HG H 1 1.411 0.03 . 1 . . . . . 54 LEU HG . 16109 1 680 . 1 1 76 76 LEU C C 13 179.639 0.3 . 1 . . . . . 54 LEU C . 16109 1 681 . 1 1 76 76 LEU CA C 13 55.260 0.3 . 1 . . . . . 54 LEU CA . 16109 1 682 . 1 1 76 76 LEU CB C 13 42.210 0.3 . 1 . . . . . 54 LEU CB . 16109 1 683 . 1 1 76 76 LEU CD1 C 13 24.210 0.3 . 1 . . . . . 54 LEU CD1 . 16109 1 684 . 1 1 76 76 LEU CD2 C 13 25.290 0.3 . 1 . . . . . 54 LEU CD2 . 16109 1 685 . 1 1 76 76 LEU CG C 13 27.260 0.3 . 1 . . . . . 54 LEU CG . 16109 1 686 . 1 1 76 76 LEU N N 15 127.239 0.3 . 1 . . . . . 54 LEU N . 16109 1 687 . 1 1 77 77 LEU H H 1 8.863 0.03 . 1 . . . . . 55 LEU H . 16109 1 688 . 1 1 77 77 LEU HA H 1 4.605 0.03 . 1 . . . . . 55 LEU HA . 16109 1 689 . 1 1 77 77 LEU HB2 H 1 1.770 0.03 . 2 . . . . . 55 LEU HB2 . 16109 1 690 . 1 1 77 77 LEU HB3 H 1 1.215 0.03 . 2 . . . . . 55 LEU HB3 . 16109 1 691 . 1 1 77 77 LEU HD11 H 1 0.695 0.03 . 2 . . . . . 55 LEU HD1 . 16109 1 692 . 1 1 77 77 LEU HD12 H 1 0.695 0.03 . 2 . . . . . 55 LEU HD1 . 16109 1 693 . 1 1 77 77 LEU HD13 H 1 0.695 0.03 . 2 . . . . . 55 LEU HD1 . 16109 1 694 . 1 1 77 77 LEU HD21 H 1 0.828 0.03 . 2 . . . . . 55 LEU HD2 . 16109 1 695 . 1 1 77 77 LEU HD22 H 1 0.828 0.03 . 2 . . . . . 55 LEU HD2 . 16109 1 696 . 1 1 77 77 LEU HD23 H 1 0.828 0.03 . 2 . . . . . 55 LEU HD2 . 16109 1 697 . 1 1 77 77 LEU HG H 1 1.943 0.03 . 1 . . . . . 55 LEU HG . 16109 1 698 . 1 1 77 77 LEU CA C 13 52.230 0.3 . 1 . . . . . 55 LEU CA . 16109 1 699 . 1 1 77 77 LEU CB C 13 43.090 0.3 . 1 . . . . . 55 LEU CB . 16109 1 700 . 1 1 77 77 LEU CD1 C 13 24.270 0.3 . 1 . . . . . 55 LEU CD1 . 16109 1 701 . 1 1 77 77 LEU CD2 C 13 23.020 0.3 . 1 . . . . . 55 LEU CD2 . 16109 1 702 . 1 1 77 77 LEU CG C 13 25.810 0.3 . 1 . . . . . 55 LEU CG . 16109 1 703 . 1 1 77 77 LEU N N 15 127.741 0.3 . 1 . . . . . 55 LEU N . 16109 1 704 . 1 1 78 78 PRO HA H 1 4.708 0.03 . 1 . . . . . 56 PRO HA . 16109 1 705 . 1 1 78 78 PRO HB2 H 1 2.336 0.03 . 2 . . . . . 56 PRO HB2 . 16109 1 706 . 1 1 78 78 PRO HB3 H 1 1.974 0.03 . 2 . . . . . 56 PRO HB3 . 16109 1 707 . 1 1 78 78 PRO HD2 H 1 4.117 0.03 . 2 . . . . . 56 PRO HD2 . 16109 1 708 . 1 1 78 78 PRO HD3 H 1 3.482 0.03 . 2 . . . . . 56 PRO HD3 . 16109 1 709 . 1 1 78 78 PRO HG2 H 1 2.101 0.03 . 2 . . . . . 56 PRO HG2 . 16109 1 710 . 1 1 78 78 PRO HG3 H 1 1.728 0.03 . 2 . . . . . 56 PRO HG3 . 16109 1 711 . 1 1 78 78 PRO C C 13 179.519 0.3 . 1 . . . . . 56 PRO C . 16109 1 712 . 1 1 78 78 PRO CA C 13 61.780 0.3 . 1 . . . . . 56 PRO CA . 16109 1 713 . 1 1 78 78 PRO CB C 13 32.600 0.3 . 1 . . . . . 56 PRO CB . 16109 1 714 . 1 1 78 78 PRO CD C 13 50.580 0.3 . 1 . . . . . 56 PRO CD . 16109 1 715 . 1 1 78 78 PRO CG C 13 27.090 0.3 . 1 . . . . . 56 PRO CG . 16109 1 716 . 1 1 79 79 ASP H H 1 8.109 0.03 . 1 . . . . . 57 ASP H . 16109 1 717 . 1 1 79 79 ASP HA H 1 4.122 0.03 . 1 . . . . . 57 ASP HA . 16109 1 718 . 1 1 79 79 ASP HB2 H 1 2.570 0.03 . 2 . . . . . 57 ASP HB2 . 16109 1 719 . 1 1 79 79 ASP HB3 H 1 2.450 0.03 . 2 . . . . . 57 ASP HB3 . 16109 1 720 . 1 1 79 79 ASP C C 13 179.782 0.3 . 1 . . . . . 57 ASP C . 16109 1 721 . 1 1 79 79 ASP CA C 13 57.380 0.3 . 1 . . . . . 57 ASP CA . 16109 1 722 . 1 1 79 79 ASP CB C 13 41.200 0.3 . 1 . . . . . 57 ASP CB . 16109 1 723 . 1 1 79 79 ASP N N 15 116.504 0.3 . 1 . . . . . 57 ASP N . 16109 1 724 . 1 1 80 80 HIS H H 1 7.815 0.03 . 1 . . . . . 58 HIS H . 16109 1 725 . 1 1 80 80 HIS HA H 1 4.519 0.03 . 1 . . . . . 58 HIS HA . 16109 1 726 . 1 1 80 80 HIS HB2 H 1 3.248 0.03 . 2 . . . . . 58 HIS HB2 . 16109 1 727 . 1 1 80 80 HIS HB3 H 1 2.912 0.03 . 2 . . . . . 58 HIS HB3 . 16109 1 728 . 1 1 80 80 HIS HD2 H 1 6.931 0.03 . 1 . . . . . 58 HIS HD2 . 16109 1 729 . 1 1 80 80 HIS HE1 H 1 7.699 0.03 . 1 . . . . . 58 HIS HE1 . 16109 1 730 . 1 1 80 80 HIS C C 13 177.668 0.3 . 1 . . . . . 58 HIS C . 16109 1 731 . 1 1 80 80 HIS CA C 13 57.110 0.3 . 1 . . . . . 58 HIS CA . 16109 1 732 . 1 1 80 80 HIS CB C 13 30.770 0.3 . 1 . . . . . 58 HIS CB . 16109 1 733 . 1 1 80 80 HIS CD2 C 13 118.260 0.3 . 1 . . . . . 58 HIS CD2 . 16109 1 734 . 1 1 80 80 HIS CE1 C 13 139.417 0.3 . 1 . . . . . 58 HIS CE1 . 16109 1 735 . 1 1 80 80 HIS N N 15 112.239 0.3 . 1 . . . . . 58 HIS N . 16109 1 736 . 1 1 81 81 LEU H H 1 6.281 0.03 . 1 . . . . . 59 LEU H . 16109 1 737 . 1 1 81 81 LEU HA H 1 4.157 0.03 . 1 . . . . . 59 LEU HA . 16109 1 738 . 1 1 81 81 LEU HB2 H 1 1.305 0.03 . 2 . . . . . 59 LEU HB2 . 16109 1 739 . 1 1 81 81 LEU HB3 H 1 1.305 0.03 . 2 . . . . . 59 LEU HB3 . 16109 1 740 . 1 1 81 81 LEU HD11 H 1 0.719 0.03 . 2 . . . . . 59 LEU HD1 . 16109 1 741 . 1 1 81 81 LEU HD12 H 1 0.719 0.03 . 2 . . . . . 59 LEU HD1 . 16109 1 742 . 1 1 81 81 LEU HD13 H 1 0.719 0.03 . 2 . . . . . 59 LEU HD1 . 16109 1 743 . 1 1 81 81 LEU HD21 H 1 0.754 0.03 . 2 . . . . . 59 LEU HD2 . 16109 1 744 . 1 1 81 81 LEU HD22 H 1 0.754 0.03 . 2 . . . . . 59 LEU HD2 . 16109 1 745 . 1 1 81 81 LEU HD23 H 1 0.754 0.03 . 2 . . . . . 59 LEU HD2 . 16109 1 746 . 1 1 81 81 LEU HG H 1 0.944 0.03 . 1 . . . . . 59 LEU HG . 16109 1 747 . 1 1 81 81 LEU C C 13 178.501 0.3 . 1 . . . . . 59 LEU C . 16109 1 748 . 1 1 81 81 LEU CA C 13 53.970 0.3 . 1 . . . . . 59 LEU CA . 16109 1 749 . 1 1 81 81 LEU CB C 13 43.360 0.3 . 1 . . . . . 59 LEU CB . 16109 1 750 . 1 1 81 81 LEU CD1 C 13 23.180 0.3 . 1 . . . . . 59 LEU CD1 . 16109 1 751 . 1 1 81 81 LEU CD2 C 13 26.040 0.3 . 1 . . . . . 59 LEU CD2 . 16109 1 752 . 1 1 81 81 LEU CG C 13 27.120 0.3 . 1 . . . . . 59 LEU CG . 16109 1 753 . 1 1 81 81 LEU N N 15 120.531 0.3 . 1 . . . . . 59 LEU N . 16109 1 754 . 1 1 82 82 GLN H H 1 8.863 0.03 . 1 . . . . . 60 GLN H . 16109 1 755 . 1 1 82 82 GLN HA H 1 4.891 0.03 . 1 . . . . . 60 GLN HA . 16109 1 756 . 1 1 82 82 GLN HB2 H 1 2.026 0.03 . 2 . . . . . 60 GLN HB2 . 16109 1 757 . 1 1 82 82 GLN HB3 H 1 1.874 0.03 . 2 . . . . . 60 GLN HB3 . 16109 1 758 . 1 1 82 82 GLN HE21 H 1 7.672 0.03 . 2 . . . . . 60 GLN HE21 . 16109 1 759 . 1 1 82 82 GLN HE22 H 1 6.854 0.03 . 2 . . . . . 60 GLN HE22 . 16109 1 760 . 1 1 82 82 GLN HG2 H 1 2.399 0.03 . 2 . . . . . 60 GLN HG2 . 16109 1 761 . 1 1 82 82 GLN HG3 H 1 2.096 0.03 . 2 . . . . . 60 GLN HG3 . 16109 1 762 . 1 1 82 82 GLN C C 13 180.417 0.3 . 1 . . . . . 60 GLN C . 16109 1 763 . 1 1 82 82 GLN CA C 13 54.880 0.3 . 1 . . . . . 60 GLN CA . 16109 1 764 . 1 1 82 82 GLN CB C 13 31.480 0.3 . 1 . . . . . 60 GLN CB . 16109 1 765 . 1 1 82 82 GLN CG C 13 35.650 0.3 . 1 . . . . . 60 GLN CG . 16109 1 766 . 1 1 82 82 GLN N N 15 118.014 0.3 . 1 . . . . . 60 GLN N . 16109 1 767 . 1 1 82 82 GLN NE2 N 15 110.825 0.3 . 1 . . . . . 60 GLN NE2 . 16109 1 768 . 1 1 83 83 LEU H H 1 8.688 0.03 . 1 . . . . . 61 LEU H . 16109 1 769 . 1 1 83 83 LEU HA H 1 3.705 0.03 . 1 . . . . . 61 LEU HA . 16109 1 770 . 1 1 83 83 LEU HB2 H 1 1.919 0.03 . 2 . . . . . 61 LEU HB2 . 16109 1 771 . 1 1 83 83 LEU HB3 H 1 1.015 0.03 . 2 . . . . . 61 LEU HB3 . 16109 1 772 . 1 1 83 83 LEU HD11 H 1 0.778 0.03 . 2 . . . . . 61 LEU HD1 . 16109 1 773 . 1 1 83 83 LEU HD12 H 1 0.778 0.03 . 2 . . . . . 61 LEU HD1 . 16109 1 774 . 1 1 83 83 LEU HD13 H 1 0.778 0.03 . 2 . . . . . 61 LEU HD1 . 16109 1 775 . 1 1 83 83 LEU HD21 H 1 0.488 0.03 . 2 . . . . . 61 LEU HD2 . 16109 1 776 . 1 1 83 83 LEU HD22 H 1 0.488 0.03 . 2 . . . . . 61 LEU HD2 . 16109 1 777 . 1 1 83 83 LEU HD23 H 1 0.488 0.03 . 2 . . . . . 61 LEU HD2 . 16109 1 778 . 1 1 83 83 LEU HG H 1 1.786 0.03 . 1 . . . . . 61 LEU HG . 16109 1 779 . 1 1 83 83 LEU C C 13 181.775 0.3 . 1 . . . . . 61 LEU C . 16109 1 780 . 1 1 83 83 LEU CA C 13 58.510 0.3 . 1 . . . . . 61 LEU CA . 16109 1 781 . 1 1 83 83 LEU CB C 13 40.330 0.3 . 1 . . . . . 61 LEU CB . 16109 1 782 . 1 1 83 83 LEU CD1 C 13 25.810 0.3 . 1 . . . . . 61 LEU CD1 . 16109 1 783 . 1 1 83 83 LEU CD2 C 13 21.520 0.3 . 1 . . . . . 61 LEU CD2 . 16109 1 784 . 1 1 83 83 LEU CG C 13 27.220 0.3 . 1 . . . . . 61 LEU CG . 16109 1 785 . 1 1 83 83 LEU N N 15 121.910 0.3 . 1 . . . . . 61 LEU N . 16109 1 786 . 1 1 84 84 LYS H H 1 8.525 0.03 . 1 . . . . . 62 LYS H . 16109 1 787 . 1 1 84 84 LYS HA H 1 3.972 0.03 . 1 . . . . . 62 LYS HA . 16109 1 788 . 1 1 84 84 LYS HB2 H 1 1.712 0.03 . 2 . . . . . 62 LYS HB2 . 16109 1 789 . 1 1 84 84 LYS HB3 H 1 1.491 0.03 . 2 . . . . . 62 LYS HB3 . 16109 1 790 . 1 1 84 84 LYS HD2 H 1 1.314 0.03 . 2 . . . . . 62 LYS HD2 . 16109 1 791 . 1 1 84 84 LYS HD3 H 1 1.290 0.03 . 2 . . . . . 62 LYS HD3 . 16109 1 792 . 1 1 84 84 LYS HE2 H 1 2.737 0.03 . 2 . . . . . 62 LYS HE2 . 16109 1 793 . 1 1 84 84 LYS HE3 H 1 2.737 0.03 . 2 . . . . . 62 LYS HE3 . 16109 1 794 . 1 1 84 84 LYS HG2 H 1 1.102 0.03 . 2 . . . . . 62 LYS HG2 . 16109 1 795 . 1 1 84 84 LYS HG3 H 1 1.044 0.03 . 2 . . . . . 62 LYS HG3 . 16109 1 796 . 1 1 84 84 LYS C C 13 177.865 0.3 . 1 . . . . . 62 LYS C . 16109 1 797 . 1 1 84 84 LYS CA C 13 57.690 0.3 . 1 . . . . . 62 LYS CA . 16109 1 798 . 1 1 84 84 LYS CB C 13 31.440 0.3 . 1 . . . . . 62 LYS CB . 16109 1 799 . 1 1 84 84 LYS CD C 13 29.100 0.3 . 1 . . . . . 62 LYS CD . 16109 1 800 . 1 1 84 84 LYS CE C 13 42.240 0.3 . 1 . . . . . 62 LYS CE . 16109 1 801 . 1 1 84 84 LYS CG C 13 23.360 0.3 . 1 . . . . . 62 LYS CG . 16109 1 802 . 1 1 84 84 LYS N N 15 115.896 0.3 . 1 . . . . . 62 LYS N . 16109 1 803 . 1 1 85 85 ASP H H 1 7.598 0.03 . 1 . . . . . 63 ASP H . 16109 1 804 . 1 1 85 85 ASP HA H 1 4.710 0.03 . 1 . . . . . 63 ASP HA . 16109 1 805 . 1 1 85 85 ASP HB2 H 1 2.852 0.03 . 2 . . . . . 63 ASP HB2 . 16109 1 806 . 1 1 85 85 ASP HB3 H 1 2.661 0.03 . 2 . . . . . 63 ASP HB3 . 16109 1 807 . 1 1 85 85 ASP C C 13 177.307 0.3 . 1 . . . . . 63 ASP C . 16109 1 808 . 1 1 85 85 ASP CA C 13 55.460 0.3 . 1 . . . . . 63 ASP CA . 16109 1 809 . 1 1 85 85 ASP CB C 13 42.000 0.3 . 1 . . . . . 63 ASP CB . 16109 1 810 . 1 1 85 85 ASP N N 15 118.917 0.3 . 1 . . . . . 63 ASP N . 16109 1 811 . 1 1 86 86 ILE H H 1 7.417 0.03 . 1 . . . . . 64 ILE H . 16109 1 812 . 1 1 86 86 ILE HA H 1 4.027 0.03 . 1 . . . . . 64 ILE HA . 16109 1 813 . 1 1 86 86 ILE HB H 1 1.342 0.03 . 1 . . . . . 64 ILE HB . 16109 1 814 . 1 1 86 86 ILE HD11 H 1 0.576 0.03 . 1 . . . . . 64 ILE HD1 . 16109 1 815 . 1 1 86 86 ILE HD12 H 1 0.576 0.03 . 1 . . . . . 64 ILE HD1 . 16109 1 816 . 1 1 86 86 ILE HD13 H 1 0.576 0.03 . 1 . . . . . 64 ILE HD1 . 16109 1 817 . 1 1 86 86 ILE HG12 H 1 1.367 0.03 . 2 . . . . . 64 ILE HG12 . 16109 1 818 . 1 1 86 86 ILE HG13 H 1 0.822 0.03 . 2 . . . . . 64 ILE HG13 . 16109 1 819 . 1 1 86 86 ILE HG21 H 1 0.574 0.03 . 1 . . . . . 64 ILE HG2 . 16109 1 820 . 1 1 86 86 ILE HG22 H 1 0.574 0.03 . 1 . . . . . 64 ILE HG2 . 16109 1 821 . 1 1 86 86 ILE HG23 H 1 0.574 0.03 . 1 . . . . . 64 ILE HG2 . 16109 1 822 . 1 1 86 86 ILE C C 13 177.055 0.3 . 1 . . . . . 64 ILE C . 16109 1 823 . 1 1 86 86 ILE CA C 13 62.150 0.3 . 1 . . . . . 64 ILE CA . 16109 1 824 . 1 1 86 86 ILE CB C 13 42.670 0.3 . 1 . . . . . 64 ILE CB . 16109 1 825 . 1 1 86 86 ILE CD1 C 13 15.320 0.3 . 1 . . . . . 64 ILE CD1 . 16109 1 826 . 1 1 86 86 ILE CG1 C 13 26.990 0.3 . 1 . . . . . 64 ILE CG1 . 16109 1 827 . 1 1 86 86 ILE CG2 C 13 18.590 0.3 . 1 . . . . . 64 ILE CG2 . 16109 1 828 . 1 1 86 86 ILE N N 15 117.599 0.3 . 1 . . . . . 64 ILE N . 16109 1 829 . 1 1 87 87 LEU H H 1 7.399 0.03 . 1 . . . . . 65 LEU H . 16109 1 830 . 1 1 87 87 LEU HA H 1 3.695 0.03 . 1 . . . . . 65 LEU HA . 16109 1 831 . 1 1 87 87 LEU HB2 H 1 1.041 0.03 . 2 . . . . . 65 LEU HB2 . 16109 1 832 . 1 1 87 87 LEU HB3 H 1 0.473 0.03 . 2 . . . . . 65 LEU HB3 . 16109 1 833 . 1 1 87 87 LEU HD11 H 1 -0.095 0.03 . 2 . . . . . 65 LEU HD1 . 16109 1 834 . 1 1 87 87 LEU HD12 H 1 -0.095 0.03 . 2 . . . . . 65 LEU HD1 . 16109 1 835 . 1 1 87 87 LEU HD13 H 1 -0.095 0.03 . 2 . . . . . 65 LEU HD1 . 16109 1 836 . 1 1 87 87 LEU HD21 H 1 -0.332 0.03 . 2 . . . . . 65 LEU HD2 . 16109 1 837 . 1 1 87 87 LEU HD22 H 1 -0.332 0.03 . 2 . . . . . 65 LEU HD2 . 16109 1 838 . 1 1 87 87 LEU HD23 H 1 -0.332 0.03 . 2 . . . . . 65 LEU HD2 . 16109 1 839 . 1 1 87 87 LEU HG H 1 1.163 0.03 . 1 . . . . . 65 LEU HG . 16109 1 840 . 1 1 87 87 LEU C C 13 179.409 0.3 . 1 . . . . . 65 LEU C . 16109 1 841 . 1 1 87 87 LEU CA C 13 55.040 0.3 . 1 . . . . . 65 LEU CA . 16109 1 842 . 1 1 87 87 LEU CB C 13 40.910 0.3 . 1 . . . . . 65 LEU CB . 16109 1 843 . 1 1 87 87 LEU CD1 C 13 25.670 0.3 . 1 . . . . . 65 LEU CD1 . 16109 1 844 . 1 1 87 87 LEU CD2 C 13 20.060 0.3 . 1 . . . . . 65 LEU CD2 . 16109 1 845 . 1 1 87 87 LEU CG C 13 25.670 0.3 . 1 . . . . . 65 LEU CG . 16109 1 846 . 1 1 87 87 LEU N N 15 116.948 0.3 . 1 . . . . . 65 LEU N . 16109 1 847 . 1 1 88 88 ARG H H 1 7.954 0.03 . 1 . . . . . 66 ARG H . 16109 1 848 . 1 1 88 88 ARG HA H 1 4.227 0.03 . 1 . . . . . 66 ARG HA . 16109 1 849 . 1 1 88 88 ARG HB2 H 1 1.924 0.03 . 2 . . . . . 66 ARG HB2 . 16109 1 850 . 1 1 88 88 ARG HB3 H 1 1.828 0.03 . 2 . . . . . 66 ARG HB3 . 16109 1 851 . 1 1 88 88 ARG HD2 H 1 3.353 0.03 . 2 . . . . . 66 ARG HD2 . 16109 1 852 . 1 1 88 88 ARG HD3 H 1 3.168 0.03 . 2 . . . . . 66 ARG HD3 . 16109 1 853 . 1 1 88 88 ARG HG2 H 1 1.623 0.03 . 2 . . . . . 66 ARG HG2 . 16109 1 854 . 1 1 88 88 ARG HG3 H 1 1.623 0.03 . 2 . . . . . 66 ARG HG3 . 16109 1 855 . 1 1 88 88 ARG C C 13 179.333 0.3 . 1 . . . . . 66 ARG C . 16109 1 856 . 1 1 88 88 ARG CA C 13 56.960 0.3 . 1 . . . . . 66 ARG CA . 16109 1 857 . 1 1 88 88 ARG CB C 13 30.570 0.3 . 1 . . . . . 66 ARG CB . 16109 1 858 . 1 1 88 88 ARG CD C 13 43.340 0.3 . 1 . . . . . 66 ARG CD . 16109 1 859 . 1 1 88 88 ARG CG C 13 28.040 0.3 . 1 . . . . . 66 ARG CG . 16109 1 860 . 1 1 88 88 ARG N N 15 122.752 0.3 . 1 . . . . . 66 ARG N . 16109 1 861 . 1 1 89 89 LYS H H 1 8.374 0.03 . 1 . . . . . 67 LYS H . 16109 1 862 . 1 1 89 89 LYS HA H 1 3.948 0.03 . 1 . . . . . 67 LYS HA . 16109 1 863 . 1 1 89 89 LYS HB2 H 1 1.697 0.03 . 2 . . . . . 67 LYS HB2 . 16109 1 864 . 1 1 89 89 LYS HB3 H 1 1.697 0.03 . 2 . . . . . 67 LYS HB3 . 16109 1 865 . 1 1 89 89 LYS HD2 H 1 1.591 0.03 . 2 . . . . . 67 LYS HD2 . 16109 1 866 . 1 1 89 89 LYS HD3 H 1 1.591 0.03 . 2 . . . . . 67 LYS HD3 . 16109 1 867 . 1 1 89 89 LYS HE2 H 1 2.918 0.03 . 2 . . . . . 67 LYS HE2 . 16109 1 868 . 1 1 89 89 LYS HE3 H 1 2.918 0.03 . 2 . . . . . 67 LYS HE3 . 16109 1 869 . 1 1 89 89 LYS HG2 H 1 1.391 0.03 . 2 . . . . . 67 LYS HG2 . 16109 1 870 . 1 1 89 89 LYS HG3 H 1 1.327 0.03 . 2 . . . . . 67 LYS HG3 . 16109 1 871 . 1 1 89 89 LYS C C 13 179.278 0.3 . 1 . . . . . 67 LYS C . 16109 1 872 . 1 1 89 89 LYS CA C 13 58.560 0.3 . 1 . . . . . 67 LYS CA . 16109 1 873 . 1 1 89 89 LYS CB C 13 32.620 0.3 . 1 . . . . . 67 LYS CB . 16109 1 874 . 1 1 89 89 LYS CD C 13 29.250 0.3 . 1 . . . . . 67 LYS CD . 16109 1 875 . 1 1 89 89 LYS CE C 13 41.940 0.3 . 1 . . . . . 67 LYS CE . 16109 1 876 . 1 1 89 89 LYS CG C 13 24.990 0.3 . 1 . . . . . 67 LYS CG . 16109 1 877 . 1 1 89 89 LYS N N 15 124.661 0.3 . 1 . . . . . 67 LYS N . 16109 1 878 . 1 1 90 90 GLN H H 1 8.616 0.03 . 1 . . . . . 68 GLN H . 16109 1 879 . 1 1 90 90 GLN HA H 1 4.169 0.03 . 1 . . . . . 68 GLN HA . 16109 1 880 . 1 1 90 90 GLN HB2 H 1 2.043 0.03 . 2 . . . . . 68 GLN HB2 . 16109 1 881 . 1 1 90 90 GLN HB3 H 1 1.988 0.03 . 2 . . . . . 68 GLN HB3 . 16109 1 882 . 1 1 90 90 GLN HE21 H 1 7.491 0.03 . 2 . . . . . 68 GLN HE21 . 16109 1 883 . 1 1 90 90 GLN HE22 H 1 6.808 0.03 . 2 . . . . . 68 GLN HE22 . 16109 1 884 . 1 1 90 90 GLN HG2 H 1 2.325 0.03 . 2 . . . . . 68 GLN HG2 . 16109 1 885 . 1 1 90 90 GLN HG3 H 1 2.325 0.03 . 2 . . . . . 68 GLN HG3 . 16109 1 886 . 1 1 90 90 GLN C C 13 177.778 0.3 . 1 . . . . . 68 GLN C . 16109 1 887 . 1 1 90 90 GLN CA C 13 56.670 0.3 . 1 . . . . . 68 GLN CA . 16109 1 888 . 1 1 90 90 GLN CB C 13 28.230 0.3 . 1 . . . . . 68 GLN CB . 16109 1 889 . 1 1 90 90 GLN CG C 13 33.560 0.3 . 1 . . . . . 68 GLN CG . 16109 1 890 . 1 1 90 90 GLN N N 15 115.896 0.3 . 1 . . . . . 68 GLN N . 16109 1 891 . 1 1 90 90 GLN NE2 N 15 112.219 0.3 . 1 . . . . . 68 GLN NE2 . 16109 1 892 . 1 1 91 91 ASP H H 1 7.319 0.03 . 1 . . . . . 69 ASP H . 16109 1 893 . 1 1 91 91 ASP HA H 1 4.523 0.03 . 1 . . . . . 69 ASP HA . 16109 1 894 . 1 1 91 91 ASP HB2 H 1 2.469 0.03 . 2 . . . . . 69 ASP HB2 . 16109 1 895 . 1 1 91 91 ASP HB3 H 1 2.469 0.03 . 2 . . . . . 69 ASP HB3 . 16109 1 896 . 1 1 91 91 ASP C C 13 177.164 0.3 . 1 . . . . . 69 ASP C . 16109 1 897 . 1 1 91 91 ASP CA C 13 54.440 0.3 . 1 . . . . . 69 ASP CA . 16109 1 898 . 1 1 91 91 ASP CB C 13 41.200 0.3 . 1 . . . . . 69 ASP CB . 16109 1 899 . 1 1 91 91 ASP N N 15 121.181 0.3 . 1 . . . . . 69 ASP N . 16109 1 900 . 1 1 92 92 GLU H H 1 8.320 0.03 . 1 . . . . . 70 GLU H . 16109 1 901 . 1 1 92 92 GLU HA H 1 3.892 0.03 . 1 . . . . . 70 GLU HA . 16109 1 902 . 1 1 92 92 GLU HB2 H 1 1.739 0.03 . 2 . . . . . 70 GLU HB2 . 16109 1 903 . 1 1 92 92 GLU HB3 H 1 1.739 0.03 . 2 . . . . . 70 GLU HB3 . 16109 1 904 . 1 1 92 92 GLU HG2 H 1 2.069 0.03 . 2 . . . . . 70 GLU HG2 . 16109 1 905 . 1 1 92 92 GLU HG3 H 1 1.918 0.03 . 2 . . . . . 70 GLU HG3 . 16109 1 906 . 1 1 92 92 GLU C C 13 177.657 0.3 . 1 . . . . . 70 GLU C . 16109 1 907 . 1 1 92 92 GLU CA C 13 57.260 0.3 . 1 . . . . . 70 GLU CA . 16109 1 908 . 1 1 92 92 GLU CB C 13 30.750 0.3 . 1 . . . . . 70 GLU CB . 16109 1 909 . 1 1 92 92 GLU CG C 13 36.240 0.3 . 1 . . . . . 70 GLU CG . 16109 1 910 . 1 1 92 92 GLU N N 15 120.205 0.3 . 1 . . . . . 70 GLU N . 16109 1 911 . 1 1 93 93 TYR H H 1 7.251 0.03 . 1 . . . . . 71 TYR H . 16109 1 912 . 1 1 93 93 TYR HA H 1 4.550 0.03 . 1 . . . . . 71 TYR HA . 16109 1 913 . 1 1 93 93 TYR HB2 H 1 2.811 0.03 . 2 . . . . . 71 TYR HB2 . 16109 1 914 . 1 1 93 93 TYR HB3 H 1 2.626 0.03 . 2 . . . . . 71 TYR HB3 . 16109 1 915 . 1 1 93 93 TYR HD1 H 1 6.843 0.03 . 1 . . . . . 71 TYR HD1 . 16109 1 916 . 1 1 93 93 TYR HD2 H 1 6.843 0.03 . 1 . . . . . 71 TYR HD2 . 16109 1 917 . 1 1 93 93 TYR HE1 H 1 6.695 0.03 . 1 . . . . . 71 TYR HE1 . 16109 1 918 . 1 1 93 93 TYR HE2 H 1 6.695 0.03 . 1 . . . . . 71 TYR HE2 . 16109 1 919 . 1 1 93 93 TYR C C 13 175.861 0.3 . 1 . . . . . 71 TYR C . 16109 1 920 . 1 1 93 93 TYR CA C 13 55.550 0.3 . 1 . . . . . 71 TYR CA . 16109 1 921 . 1 1 93 93 TYR CB C 13 39.680 0.3 . 1 . . . . . 71 TYR CB . 16109 1 922 . 1 1 93 93 TYR CD1 C 13 133.193 0.3 . 1 . . . . . 71 TYR CD1 . 16109 1 923 . 1 1 93 93 TYR CE1 C 13 118.000 0.3 . 1 . . . . . 71 TYR CE1 . 16109 1 924 . 1 1 93 93 TYR N N 15 115.349 0.3 . 1 . . . . . 71 TYR N . 16109 1 925 . 1 1 94 94 HIS H H 1 7.991 0.03 . 1 . . . . . 72 HIS H . 16109 1 926 . 1 1 94 94 HIS HA H 1 5.034 0.03 . 1 . . . . . 72 HIS HA . 16109 1 927 . 1 1 94 94 HIS HB2 H 1 2.941 0.03 . 2 . . . . . 72 HIS HB2 . 16109 1 928 . 1 1 94 94 HIS HB3 H 1 2.667 0.03 . 2 . . . . . 72 HIS HB3 . 16109 1 929 . 1 1 94 94 HIS HE1 H 1 8.113 0.03 . 1 . . . . . 72 HIS HE1 . 16109 1 930 . 1 1 94 94 HIS C C 13 176.157 0.3 . 1 . . . . . 72 HIS C . 16109 1 931 . 1 1 94 94 HIS CA C 13 54.990 0.3 . 1 . . . . . 72 HIS CA . 16109 1 932 . 1 1 94 94 HIS CB C 13 33.910 0.3 . 1 . . . . . 72 HIS CB . 16109 1 933 . 1 1 94 94 HIS CE1 C 13 140.118 0.3 . 1 . . . . . 72 HIS CE1 . 16109 1 934 . 1 1 94 94 HIS N N 15 120.146 0.3 . 1 . . . . . 72 HIS N . 16109 1 935 . 1 1 95 95 MET H H 1 9.227 0.03 . 1 . . . . . 73 MET H . 16109 1 936 . 1 1 95 95 MET HA H 1 5.306 0.03 . 1 . . . . . 73 MET HA . 16109 1 937 . 1 1 95 95 MET HB2 H 1 2.094 0.03 . 2 . . . . . 73 MET HB2 . 16109 1 938 . 1 1 95 95 MET HB3 H 1 1.809 0.03 . 2 . . . . . 73 MET HB3 . 16109 1 939 . 1 1 95 95 MET HG2 H 1 2.473 0.03 . 2 . . . . . 73 MET HG2 . 16109 1 940 . 1 1 95 95 MET HG3 H 1 2.373 0.03 . 2 . . . . . 73 MET HG3 . 16109 1 941 . 1 1 95 95 MET C C 13 176.891 0.3 . 1 . . . . . 73 MET C . 16109 1 942 . 1 1 95 95 MET CA C 13 54.500 0.3 . 1 . . . . . 73 MET CA . 16109 1 943 . 1 1 95 95 MET CB C 13 33.690 0.3 . 1 . . . . . 73 MET CB . 16109 1 944 . 1 1 95 95 MET CG C 13 31.930 0.3 . 1 . . . . . 73 MET CG . 16109 1 945 . 1 1 95 95 MET N N 15 124.691 0.3 . 1 . . . . . 73 MET N . 16109 1 946 . 1 1 96 96 VAL H H 1 9.070 0.03 . 1 . . . . . 74 VAL H . 16109 1 947 . 1 1 96 96 VAL HA H 1 4.719 0.03 . 1 . . . . . 74 VAL HA . 16109 1 948 . 1 1 96 96 VAL HB H 1 1.876 0.03 . 1 . . . . . 74 VAL HB . 16109 1 949 . 1 1 96 96 VAL HG11 H 1 0.838 0.03 . 2 . . . . . 74 VAL HG1 . 16109 1 950 . 1 1 96 96 VAL HG12 H 1 0.838 0.03 . 2 . . . . . 74 VAL HG1 . 16109 1 951 . 1 1 96 96 VAL HG13 H 1 0.838 0.03 . 2 . . . . . 74 VAL HG1 . 16109 1 952 . 1 1 96 96 VAL HG21 H 1 0.793 0.03 . 2 . . . . . 74 VAL HG2 . 16109 1 953 . 1 1 96 96 VAL HG22 H 1 0.793 0.03 . 2 . . . . . 74 VAL HG2 . 16109 1 954 . 1 1 96 96 VAL HG23 H 1 0.793 0.03 . 2 . . . . . 74 VAL HG2 . 16109 1 955 . 1 1 96 96 VAL C C 13 175.653 0.3 . 1 . . . . . 74 VAL C . 16109 1 956 . 1 1 96 96 VAL CA C 13 60.790 0.3 . 1 . . . . . 74 VAL CA . 16109 1 957 . 1 1 96 96 VAL CB C 13 35.290 0.3 . 1 . . . . . 74 VAL CB . 16109 1 958 . 1 1 96 96 VAL CG1 C 13 22.350 0.3 . 1 . . . . . 74 VAL CG1 . 16109 1 959 . 1 1 96 96 VAL CG2 C 13 21.550 0.3 . 1 . . . . . 74 VAL CG2 . 16109 1 960 . 1 1 96 96 VAL N N 15 125.298 0.3 . 1 . . . . . 74 VAL N . 16109 1 961 . 1 1 97 97 HIS H H 1 9.197 0.03 . 1 . . . . . 75 HIS H . 16109 1 962 . 1 1 97 97 HIS HA H 1 5.213 0.03 . 1 . . . . . 75 HIS HA . 16109 1 963 . 1 1 97 97 HIS HB2 H 1 2.923 0.03 . 2 . . . . . 75 HIS HB2 . 16109 1 964 . 1 1 97 97 HIS HB3 H 1 2.799 0.03 . 2 . . . . . 75 HIS HB3 . 16109 1 965 . 1 1 97 97 HIS HE1 H 1 7.854 0.03 . 1 . . . . . 75 HIS HE1 . 16109 1 966 . 1 1 97 97 HIS C C 13 176.245 0.3 . 1 . . . . . 75 HIS C . 16109 1 967 . 1 1 97 97 HIS CA C 13 55.800 0.3 . 1 . . . . . 75 HIS CA . 16109 1 968 . 1 1 97 97 HIS CB C 13 32.170 0.3 . 1 . . . . . 75 HIS CB . 16109 1 969 . 1 1 97 97 HIS CE1 C 13 138.365 0.3 . 1 . . . . . 75 HIS CE1 . 16109 1 970 . 1 1 97 97 HIS N N 15 125.299 0.3 . 1 . . . . . 75 HIS N . 16109 1 971 . 1 1 98 98 LEU H H 1 8.423 0.03 . 1 . . . . . 76 LEU H . 16109 1 972 . 1 1 98 98 LEU HA H 1 5.059 0.03 . 1 . . . . . 76 LEU HA . 16109 1 973 . 1 1 98 98 LEU HB2 H 1 1.495 0.03 . 2 . . . . . 76 LEU HB2 . 16109 1 974 . 1 1 98 98 LEU HB3 H 1 0.916 0.03 . 2 . . . . . 76 LEU HB3 . 16109 1 975 . 1 1 98 98 LEU HD11 H 1 0.497 0.03 . 2 . . . . . 76 LEU HD1 . 16109 1 976 . 1 1 98 98 LEU HD12 H 1 0.497 0.03 . 2 . . . . . 76 LEU HD1 . 16109 1 977 . 1 1 98 98 LEU HD13 H 1 0.497 0.03 . 2 . . . . . 76 LEU HD1 . 16109 1 978 . 1 1 98 98 LEU HD21 H 1 0.177 0.03 . 2 . . . . . 76 LEU HD2 . 16109 1 979 . 1 1 98 98 LEU HD22 H 1 0.177 0.03 . 2 . . . . . 76 LEU HD2 . 16109 1 980 . 1 1 98 98 LEU HD23 H 1 0.177 0.03 . 2 . . . . . 76 LEU HD2 . 16109 1 981 . 1 1 98 98 LEU HG H 1 1.250 0.03 . 1 . . . . . 76 LEU HG . 16109 1 982 . 1 1 98 98 LEU C C 13 177.592 0.3 . 1 . . . . . 76 LEU C . 16109 1 983 . 1 1 98 98 LEU CA C 13 54.150 0.3 . 1 . . . . . 76 LEU CA . 16109 1 984 . 1 1 98 98 LEU CB C 13 43.540 0.3 . 1 . . . . . 76 LEU CB . 16109 1 985 . 1 1 98 98 LEU CD1 C 13 24.140 0.3 . 1 . . . . . 76 LEU CD1 . 16109 1 986 . 1 1 98 98 LEU CD2 C 13 25.210 0.3 . 1 . . . . . 76 LEU CD2 . 16109 1 987 . 1 1 98 98 LEU CG C 13 27.220 0.3 . 1 . . . . . 76 LEU CG . 16109 1 988 . 1 1 98 98 LEU N N 15 126.291 0.3 . 1 . . . . . 76 LEU N . 16109 1 989 . 1 1 99 99 VAL H H 1 8.397 0.03 . 1 . . . . . 77 VAL H . 16109 1 990 . 1 1 99 99 VAL HA H 1 4.215 0.03 . 1 . . . . . 77 VAL HA . 16109 1 991 . 1 1 99 99 VAL HB H 1 2.124 0.03 . 1 . . . . . 77 VAL HB . 16109 1 992 . 1 1 99 99 VAL HG11 H 1 0.809 0.03 . 2 . . . . . 77 VAL HG1 . 16109 1 993 . 1 1 99 99 VAL HG12 H 1 0.809 0.03 . 2 . . . . . 77 VAL HG1 . 16109 1 994 . 1 1 99 99 VAL HG13 H 1 0.809 0.03 . 2 . . . . . 77 VAL HG1 . 16109 1 995 . 1 1 99 99 VAL HG21 H 1 0.706 0.03 . 2 . . . . . 77 VAL HG2 . 16109 1 996 . 1 1 99 99 VAL HG22 H 1 0.706 0.03 . 2 . . . . . 77 VAL HG2 . 16109 1 997 . 1 1 99 99 VAL HG23 H 1 0.706 0.03 . 2 . . . . . 77 VAL HG2 . 16109 1 998 . 1 1 99 99 VAL CA C 13 62.970 0.3 . 1 . . . . . 77 VAL CA . 16109 1 999 . 1 1 99 99 VAL CB C 13 33.810 0.3 . 1 . . . . . 77 VAL CB . 16109 1 1000 . 1 1 99 99 VAL CG1 C 13 22.140 0.3 . 1 . . . . . 77 VAL CG1 . 16109 1 1001 . 1 1 99 99 VAL CG2 C 13 20.430 0.3 . 1 . . . . . 77 VAL CG2 . 16109 1 1002 . 1 1 99 99 VAL N N 15 126.291 0.3 . 1 . . . . . 77 VAL N . 16109 1 stop_ save_