################################### # 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 18844 _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 '2D 1H-15N HSQC' . . . 18844 1 2 '3D HNCA' . . . 18844 1 3 '3D HNCACB' . . . 18844 1 4 '3D HNCO' . . . 18844 1 5 '3D CBCA(CO)NH' . . . 18844 1 6 '3D HCCH-TOCSY' . . . 18844 1 7 '3D 1H-15N NOESY' . . . 18844 1 8 '3D 1H-13C NOESY' . . . 18844 1 9 '3D HBHA(CO)NH' . . . 18844 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.412 0.003 . . . . . A 1 MET HA . 18844 1 2 . 1 1 1 1 MET HB2 H 1 1.930 0.016 . . . . . A 1 MET HB2 . 18844 1 3 . 1 1 1 1 MET HB3 H 1 1.930 0.016 . . . . . A 1 MET HB3 . 18844 1 4 . 1 1 1 1 MET H H 1 8.962 0.002 . . . . . A 1 MET H1 . 18844 1 5 . 1 1 1 1 MET CA C 13 55.355 0.007 . . . . . A 1 MET CA . 18844 1 6 . 1 1 1 1 MET CB C 13 33.581 0.052 . . . . . A 1 MET CB . 18844 1 7 . 1 1 1 1 MET N N 15 120.525 0.046 . . . . . A 1 MET N . 18844 1 8 . 1 1 2 2 ALA H H 1 8.410 0.002 . . . . . A 2 ALA H . 18844 1 9 . 1 1 2 2 ALA HA H 1 4.033 0.005 . . . . . A 2 ALA HA . 18844 1 10 . 1 1 2 2 ALA HB1 H 1 1.202 0.004 . . . . . A 2 ALA HB1 . 18844 1 11 . 1 1 2 2 ALA HB2 H 1 1.202 0.004 . . . . . A 2 ALA HB2 . 18844 1 12 . 1 1 2 2 ALA HB3 H 1 1.202 0.004 . . . . . A 2 ALA HB3 . 18844 1 13 . 1 1 2 2 ALA CA C 13 53.215 0.026 . . . . . A 2 ALA CA . 18844 1 14 . 1 1 2 2 ALA CB C 13 19.376 0.023 . . . . . A 2 ALA CB . 18844 1 15 . 1 1 2 2 ALA N N 15 126.014 0.052 . . . . . A 2 ALA N . 18844 1 16 . 1 1 3 3 LEU H H 1 8.271 0.003 . . . . . A 3 LEU H . 18844 1 17 . 1 1 3 3 LEU HA H 1 4.646 0.004 . . . . . A 3 LEU HA . 18844 1 18 . 1 1 3 3 LEU HB2 H 1 1.430 0.009 . . . . . A 3 LEU HB2 . 18844 1 19 . 1 1 3 3 LEU HB3 H 1 1.048 0.093 . . . . . A 3 LEU HB3 . 18844 1 20 . 1 1 3 3 LEU HG H 1 1.395 0.005 . . . . . A 3 LEU HG . 18844 1 21 . 1 1 3 3 LEU HD11 H 1 0.622 0.003 . . . . . A 3 LEU HD11 . 18844 1 22 . 1 1 3 3 LEU HD12 H 1 0.622 0.003 . . . . . A 3 LEU HD12 . 18844 1 23 . 1 1 3 3 LEU HD13 H 1 0.622 0.003 . . . . . A 3 LEU HD13 . 18844 1 24 . 1 1 3 3 LEU CA C 13 51.817 0.032 . . . . . A 3 LEU CA . 18844 1 25 . 1 1 3 3 LEU CB C 13 43.557 0.032 . . . . . A 3 LEU CB . 18844 1 26 . 1 1 3 3 LEU CG C 13 27.410 0.001 . . . . . A 3 LEU CG . 18844 1 27 . 1 1 3 3 LEU CD1 C 13 25.969 0.028 . . . . . A 3 LEU CD1 . 18844 1 28 . 1 1 3 3 LEU N N 15 123.255 0.040 . . . . . A 3 LEU N . 18844 1 29 . 1 1 4 4 PRO HA H 1 4.606 0.003 . . . . . A 4 PRO HA . 18844 1 30 . 1 1 4 4 PRO HB2 H 1 1.886 0.002 . . . . . A 4 PRO HB2 . 18844 1 31 . 1 1 4 4 PRO HB3 H 1 2.021 0.006 . . . . . A 4 PRO HB3 . 18844 1 32 . 1 1 4 4 PRO HG2 H 1 2.000 0.003 . . . . . A 4 PRO HG2 . 18844 1 33 . 1 1 4 4 PRO HG3 H 1 1.902 0.004 . . . . . A 4 PRO HG3 . 18844 1 34 . 1 1 4 4 PRO HD2 H 1 3.516 0.006 . . . . . A 4 PRO HD2 . 18844 1 35 . 1 1 4 4 PRO HD3 H 1 3.516 0.006 . . . . . A 4 PRO HD3 . 18844 1 36 . 1 1 4 4 PRO CA C 13 63.240 0.022 . . . . . A 4 PRO CA . 18844 1 37 . 1 1 4 4 PRO CB C 13 32.070 0.081 . . . . . A 4 PRO CB . 18844 1 38 . 1 1 4 4 PRO CG C 13 28.149 0.002 . . . . . A 4 PRO CG . 18844 1 39 . 1 1 4 4 PRO CD C 13 50.521 0.001 . . . . . A 4 PRO CD . 18844 1 40 . 1 1 5 5 ILE H H 1 8.317 0.005 . . . . . A 5 ILE H . 18844 1 41 . 1 1 5 5 ILE HA H 1 4.359 0.005 . . . . . A 5 ILE HA . 18844 1 42 . 1 1 5 5 ILE HB H 1 1.555 0.006 . . . . . A 5 ILE HB . 18844 1 43 . 1 1 5 5 ILE HG12 H 1 1.507 0.004 . . . . . A 5 ILE HG12 . 18844 1 44 . 1 1 5 5 ILE HG13 H 1 0.878 0.004 . . . . . A 5 ILE HG13 . 18844 1 45 . 1 1 5 5 ILE HG21 H 1 0.729 0.005 . . . . . A 5 ILE HG21 . 18844 1 46 . 1 1 5 5 ILE HG22 H 1 0.729 0.005 . . . . . A 5 ILE HG22 . 18844 1 47 . 1 1 5 5 ILE HG23 H 1 0.729 0.005 . . . . . A 5 ILE HG23 . 18844 1 48 . 1 1 5 5 ILE HD11 H 1 0.605 0.007 . . . . . A 5 ILE HD11 . 18844 1 49 . 1 1 5 5 ILE HD12 H 1 0.605 0.007 . . . . . A 5 ILE HD12 . 18844 1 50 . 1 1 5 5 ILE HD13 H 1 0.605 0.007 . . . . . A 5 ILE HD13 . 18844 1 51 . 1 1 5 5 ILE CA C 13 60.833 0.030 . . . . . A 5 ILE CA . 18844 1 52 . 1 1 5 5 ILE CB C 13 43.943 0.098 . . . . . A 5 ILE CB . 18844 1 53 . 1 1 5 5 ILE CG1 C 13 27.203 0.031 . . . . . A 5 ILE CG1 . 18844 1 54 . 1 1 5 5 ILE CG2 C 13 18.205 0.015 . . . . . A 5 ILE CG2 . 18844 1 55 . 1 1 5 5 ILE CD1 C 13 14.599 0.010 . . . . . A 5 ILE CD1 . 18844 1 56 . 1 1 5 5 ILE N N 15 122.161 0.029 . . . . . A 5 ILE N . 18844 1 57 . 1 1 6 6 ILE H H 1 8.408 0.006 . . . . . A 6 ILE H . 18844 1 58 . 1 1 6 6 ILE HA H 1 4.921 0.004 . . . . . A 6 ILE HA . 18844 1 59 . 1 1 6 6 ILE HB H 1 1.545 0.006 . . . . . A 6 ILE HB . 18844 1 60 . 1 1 6 6 ILE HG12 H 1 1.350 0.005 . . . . . A 6 ILE HG12 . 18844 1 61 . 1 1 6 6 ILE HG13 H 1 0.976 0.006 . . . . . A 6 ILE HG13 . 18844 1 62 . 1 1 6 6 ILE HG21 H 1 0.690 0.008 . . . . . A 6 ILE HG21 . 18844 1 63 . 1 1 6 6 ILE HG22 H 1 0.690 0.008 . . . . . A 6 ILE HG22 . 18844 1 64 . 1 1 6 6 ILE HG23 H 1 0.690 0.008 . . . . . A 6 ILE HG23 . 18844 1 65 . 1 1 6 6 ILE HD11 H 1 0.689 0.006 . . . . . A 6 ILE HD11 . 18844 1 66 . 1 1 6 6 ILE HD12 H 1 0.689 0.006 . . . . . A 6 ILE HD12 . 18844 1 67 . 1 1 6 6 ILE HD13 H 1 0.689 0.006 . . . . . A 6 ILE HD13 . 18844 1 68 . 1 1 6 6 ILE CA C 13 59.865 0.074 . . . . . A 6 ILE CA . 18844 1 69 . 1 1 6 6 ILE CB C 13 40.264 0.053 . . . . . A 6 ILE CB . 18844 1 70 . 1 1 6 6 ILE CG1 C 13 28.159 0.030 . . . . . A 6 ILE CG1 . 18844 1 71 . 1 1 6 6 ILE CG2 C 13 18.042 0.023 . . . . . A 6 ILE CG2 . 18844 1 72 . 1 1 6 6 ILE CD1 C 13 13.314 0.015 . . . . . A 6 ILE CD1 . 18844 1 73 . 1 1 6 6 ILE N N 15 125.649 0.071 . . . . . A 6 ILE N . 18844 1 74 . 1 1 7 7 VAL H H 1 9.155 0.005 . . . . . A 7 VAL H . 18844 1 75 . 1 1 7 7 VAL HA H 1 4.930 0.006 . . . . . A 7 VAL HA . 18844 1 76 . 1 1 7 7 VAL HB H 1 1.861 0.006 . . . . . A 7 VAL HB . 18844 1 77 . 1 1 7 7 VAL HG11 H 1 0.840 0.002 . . . . . A 7 VAL HG11 . 18844 1 78 . 1 1 7 7 VAL HG12 H 1 0.840 0.002 . . . . . A 7 VAL HG12 . 18844 1 79 . 1 1 7 7 VAL HG13 H 1 0.840 0.002 . . . . . A 7 VAL HG13 . 18844 1 80 . 1 1 7 7 VAL CA C 13 60.363 0.065 . . . . . A 7 VAL CA . 18844 1 81 . 1 1 7 7 VAL CB C 13 34.759 0.047 . . . . . A 7 VAL CB . 18844 1 82 . 1 1 7 7 VAL CG1 C 13 21.786 0.015 . . . . . A 7 VAL CG1 . 18844 1 83 . 1 1 7 7 VAL N N 15 125.741 0.049 . . . . . A 7 VAL N . 18844 1 84 . 1 1 8 8 LYS H H 1 9.174 0.003 . . . . . A 8 LYS H . 18844 1 85 . 1 1 8 8 LYS HA H 1 5.232 0.006 . . . . . A 8 LYS HA . 18844 1 86 . 1 1 8 8 LYS HB2 H 1 2.006 0.007 . . . . . A 8 LYS HB2 . 18844 1 87 . 1 1 8 8 LYS HB3 H 1 1.553 0.007 . . . . . A 8 LYS HB3 . 18844 1 88 . 1 1 8 8 LYS HG2 H 1 1.331 0.003 . . . . . A 8 LYS HG2 . 18844 1 89 . 1 1 8 8 LYS HG3 H 1 1.286 0.003 . . . . . A 8 LYS HG3 . 18844 1 90 . 1 1 8 8 LYS HD2 H 1 1.582 0.005 . . . . . A 8 LYS HD2 . 18844 1 91 . 1 1 8 8 LYS HD3 H 1 1.582 0.005 . . . . . A 8 LYS HD3 . 18844 1 92 . 1 1 8 8 LYS HE2 H 1 2.856 0.006 . . . . . A 8 LYS HE2 . 18844 1 93 . 1 1 8 8 LYS HE3 H 1 2.784 0.003 . . . . . A 8 LYS HE3 . 18844 1 94 . 1 1 8 8 LYS CA C 13 55.275 0.014 . . . . . A 8 LYS CA . 18844 1 95 . 1 1 8 8 LYS CB C 13 34.935 0.035 . . . . . A 8 LYS CB . 18844 1 96 . 1 1 8 8 LYS CG C 13 25.461 0.019 . . . . . A 8 LYS CG . 18844 1 97 . 1 1 8 8 LYS CD C 13 29.787 0.015 . . . . . A 8 LYS CD . 18844 1 98 . 1 1 8 8 LYS N N 15 128.098 0.027 . . . . . A 8 LYS N . 18844 1 99 . 1 1 9 9 TRP H H 1 8.844 0.006 . . . . . A 9 TRP H . 18844 1 100 . 1 1 9 9 TRP HA H 1 5.185 0.002 . . . . . A 9 TRP HA . 18844 1 101 . 1 1 9 9 TRP HB2 H 1 3.237 0.002 . . . . . A 9 TRP HB2 . 18844 1 102 . 1 1 9 9 TRP HB3 H 1 3.116 0.002 . . . . . A 9 TRP HB3 . 18844 1 103 . 1 1 9 9 TRP HD1 H 1 6.949 0.009 . . . . . A 9 TRP HD1 . 18844 1 104 . 1 1 9 9 TRP HE1 H 1 10.238 0.000 . . . . . A 9 TRP HE1 . 18844 1 105 . 1 1 9 9 TRP HE3 H 1 7.605 0.002 . . . . . A 9 TRP HE3 . 18844 1 106 . 1 1 9 9 TRP HZ2 H 1 7.662 0.004 . . . . . A 9 TRP HZ2 . 18844 1 107 . 1 1 9 9 TRP CA C 13 57.734 0.040 . . . . . A 9 TRP CA . 18844 1 108 . 1 1 9 9 TRP CB C 13 31.561 0.048 . . . . . A 9 TRP CB . 18844 1 109 . 1 1 9 9 TRP N N 15 125.952 0.081 . . . . . A 9 TRP N . 18844 1 110 . 1 1 9 9 TRP NE1 N 15 128.679 0.000 . . . . . A 9 TRP NE1 . 18844 1 111 . 1 1 10 10 GLY H H 1 8.683 0.005 . . . . . A 10 GLY H . 18844 1 112 . 1 1 10 10 GLY HA2 H 1 3.309 0.004 . . . . . A 10 GLY HA2 . 18844 1 113 . 1 1 10 10 GLY HA3 H 1 3.132 0.002 . . . . . A 10 GLY HA3 . 18844 1 114 . 1 1 10 10 GLY CA C 13 47.101 0.050 . . . . . A 10 GLY CA . 18844 1 115 . 1 1 10 10 GLY N N 15 117.044 0.042 . . . . . A 10 GLY N . 18844 1 116 . 1 1 11 11 GLY H H 1 8.600 0.005 . . . . . A 11 GLY H . 18844 1 117 . 1 1 11 11 GLY HA2 H 1 3.863 0.007 . . . . . A 11 GLY HA2 . 18844 1 118 . 1 1 11 11 GLY HA3 H 1 3.749 0.002 . . . . . A 11 GLY HA3 . 18844 1 119 . 1 1 11 11 GLY CA C 13 45.460 0.030 . . . . . A 11 GLY CA . 18844 1 120 . 1 1 11 11 GLY N N 15 109.364 0.048 . . . . . A 11 GLY N . 18844 1 121 . 1 1 12 12 GLN H H 1 7.865 0.002 . . . . . A 12 GLN H . 18844 1 122 . 1 1 12 12 GLN HA H 1 4.483 0.007 . . . . . A 12 GLN HA . 18844 1 123 . 1 1 12 12 GLN HB2 H 1 2.124 0.005 . . . . . A 12 GLN HB2 . 18844 1 124 . 1 1 12 12 GLN HB3 H 1 1.808 0.005 . . . . . A 12 GLN HB3 . 18844 1 125 . 1 1 12 12 GLN HG2 H 1 2.047 0.002 . . . . . A 12 GLN HG2 . 18844 1 126 . 1 1 12 12 GLN HG3 H 1 2.047 0.002 . . . . . A 12 GLN HG3 . 18844 1 127 . 1 1 12 12 GLN CA C 13 54.502 0.041 . . . . . A 12 GLN CA . 18844 1 128 . 1 1 12 12 GLN CB C 13 32.178 0.033 . . . . . A 12 GLN CB . 18844 1 129 . 1 1 12 12 GLN CG C 13 32.510 0.003 . . . . . A 12 GLN CG . 18844 1 130 . 1 1 12 12 GLN N N 15 119.388 0.023 . . . . . A 12 GLN N . 18844 1 131 . 1 1 13 13 GLU H H 1 8.172 0.002 . . . . . A 13 GLU H . 18844 1 132 . 1 1 13 13 GLU HA H 1 4.880 0.003 . . . . . A 13 GLU HA . 18844 1 133 . 1 1 13 13 GLU HB2 H 1 1.648 0.014 . . . . . A 13 GLU HB2 . 18844 1 134 . 1 1 13 13 GLU HB3 H 1 1.648 0.014 . . . . . A 13 GLU HB3 . 18844 1 135 . 1 1 13 13 GLU HG2 H 1 2.118 0.003 . . . . . A 13 GLU HG2 . 18844 1 136 . 1 1 13 13 GLU HG3 H 1 1.801 0.006 . . . . . A 13 GLU HG3 . 18844 1 137 . 1 1 13 13 GLU CA C 13 55.655 0.026 . . . . . A 13 GLU CA . 18844 1 138 . 1 1 13 13 GLU CB C 13 32.306 0.073 . . . . . A 13 GLU CB . 18844 1 139 . 1 1 13 13 GLU CG C 13 37.597 0.020 . . . . . A 13 GLU CG . 18844 1 140 . 1 1 13 13 GLU N N 15 119.756 0.053 . . . . . A 13 GLU N . 18844 1 141 . 1 1 14 14 TYR H H 1 9.381 0.006 . . . . . A 14 TYR H . 18844 1 142 . 1 1 14 14 TYR HA H 1 4.601 0.005 . . . . . A 14 TYR HA . 18844 1 143 . 1 1 14 14 TYR HB2 H 1 2.791 0.007 . . . . . A 14 TYR HB2 . 18844 1 144 . 1 1 14 14 TYR HB3 H 1 2.680 0.028 . . . . . A 14 TYR HB3 . 18844 1 145 . 1 1 14 14 TYR HD1 H 1 7.111 0.000 . . . . . A 14 TYR HD1 . 18844 1 146 . 1 1 14 14 TYR HE1 H 1 6.955 0.002 . . . . . A 14 TYR HE1 . 18844 1 147 . 1 1 14 14 TYR CA C 13 57.246 0.049 . . . . . A 14 TYR CA . 18844 1 148 . 1 1 14 14 TYR CB C 13 40.544 0.050 . . . . . A 14 TYR CB . 18844 1 149 . 1 1 14 14 TYR N N 15 122.812 0.030 . . . . . A 14 TYR N . 18844 1 150 . 1 1 15 15 SER H H 1 8.802 0.004 . . . . . A 15 SER H . 18844 1 151 . 1 1 15 15 SER HA H 1 4.747 0.006 . . . . . A 15 SER HA . 18844 1 152 . 1 1 15 15 SER HB2 H 1 3.714 0.004 . . . . . A 15 SER HB2 . 18844 1 153 . 1 1 15 15 SER HB3 H 1 3.714 0.004 . . . . . A 15 SER HB3 . 18844 1 154 . 1 1 15 15 SER CA C 13 58.099 0.071 . . . . . A 15 SER CA . 18844 1 155 . 1 1 15 15 SER CB C 13 63.394 0.052 . . . . . A 15 SER CB . 18844 1 156 . 1 1 15 15 SER N N 15 118.339 0.042 . . . . . A 15 SER N . 18844 1 157 . 1 1 16 16 VAL H H 1 9.005 0.004 . . . . . A 16 VAL H . 18844 1 158 . 1 1 16 16 VAL HA H 1 4.205 0.005 . . . . . A 16 VAL HA . 18844 1 159 . 1 1 16 16 VAL HB H 1 2.022 0.006 . . . . . A 16 VAL HB . 18844 1 160 . 1 1 16 16 VAL HG11 H 1 0.737 0.006 . . . . . A 16 VAL HG11 . 18844 1 161 . 1 1 16 16 VAL HG12 H 1 0.737 0.006 . . . . . A 16 VAL HG12 . 18844 1 162 . 1 1 16 16 VAL HG13 H 1 0.737 0.006 . . . . . A 16 VAL HG13 . 18844 1 163 . 1 1 16 16 VAL HG21 H 1 0.465 0.006 . . . . . A 16 VAL HG21 . 18844 1 164 . 1 1 16 16 VAL HG22 H 1 0.465 0.006 . . . . . A 16 VAL HG22 . 18844 1 165 . 1 1 16 16 VAL HG23 H 1 0.465 0.006 . . . . . A 16 VAL HG23 . 18844 1 166 . 1 1 16 16 VAL CA C 13 62.344 0.044 . . . . . A 16 VAL CA . 18844 1 167 . 1 1 16 16 VAL CB C 13 32.528 0.053 . . . . . A 16 VAL CB . 18844 1 168 . 1 1 16 16 VAL CG1 C 13 20.319 0.045 . . . . . A 16 VAL CG1 . 18844 1 169 . 1 1 16 16 VAL CG2 C 13 20.730 0.010 . . . . . A 16 VAL CG2 . 18844 1 170 . 1 1 16 16 VAL N N 15 128.611 0.028 . . . . . A 16 VAL N . 18844 1 171 . 1 1 17 17 THR H H 1 8.746 0.005 . . . . . A 17 THR H . 18844 1 172 . 1 1 17 17 THR HA H 1 4.533 0.010 . . . . . A 17 THR HA . 18844 1 173 . 1 1 17 17 THR HB H 1 4.389 0.007 . . . . . A 17 THR HB . 18844 1 174 . 1 1 17 17 THR HG21 H 1 1.016 0.004 . . . . . A 17 THR HG21 . 18844 1 175 . 1 1 17 17 THR HG22 H 1 1.016 0.004 . . . . . A 17 THR HG22 . 18844 1 176 . 1 1 17 17 THR HG23 H 1 1.016 0.004 . . . . . A 17 THR HG23 . 18844 1 177 . 1 1 17 17 THR CA C 13 62.331 0.047 . . . . . A 17 THR CA . 18844 1 178 . 1 1 17 17 THR CB C 13 70.040 0.073 . . . . . A 17 THR CB . 18844 1 179 . 1 1 17 17 THR CG2 C 13 21.863 0.004 . . . . . A 17 THR CG2 . 18844 1 180 . 1 1 17 17 THR N N 15 116.170 0.030 . . . . . A 17 THR N . 18844 1 181 . 1 1 18 18 THR H H 1 6.812 0.003 . . . . . A 18 THR H . 18844 1 182 . 1 1 18 18 THR HA H 1 4.173 0.003 . . . . . A 18 THR HA . 18844 1 183 . 1 1 18 18 THR HB H 1 4.270 0.003 . . . . . A 18 THR HB . 18844 1 184 . 1 1 18 18 THR HG21 H 1 1.012 0.003 . . . . . A 18 THR HG21 . 18844 1 185 . 1 1 18 18 THR HG22 H 1 1.012 0.003 . . . . . A 18 THR HG22 . 18844 1 186 . 1 1 18 18 THR HG23 H 1 1.012 0.003 . . . . . A 18 THR HG23 . 18844 1 187 . 1 1 18 18 THR CA C 13 61.772 0.063 . . . . . A 18 THR CA . 18844 1 188 . 1 1 18 18 THR CB C 13 69.121 0.048 . . . . . A 18 THR CB . 18844 1 189 . 1 1 18 18 THR CG2 C 13 22.475 0.012 . . . . . A 18 THR CG2 . 18844 1 190 . 1 1 18 18 THR N N 15 107.517 0.048 . . . . . A 18 THR N . 18844 1 191 . 1 1 19 19 LEU H H 1 8.388 0.002 . . . . . A 19 LEU H . 18844 1 192 . 1 1 19 19 LEU HA H 1 4.583 0.006 . . . . . A 19 LEU HA . 18844 1 193 . 1 1 19 19 LEU HB2 H 1 1.579 0.005 . . . . . A 19 LEU HB2 . 18844 1 194 . 1 1 19 19 LEU HB3 H 1 1.273 0.008 . . . . . A 19 LEU HB3 . 18844 1 195 . 1 1 19 19 LEU HG H 1 1.189 0.004 . . . . . A 19 LEU HG . 18844 1 196 . 1 1 19 19 LEU HD11 H 1 0.569 0.011 . . . . . A 19 LEU HD11 . 18844 1 197 . 1 1 19 19 LEU HD12 H 1 0.569 0.011 . . . . . A 19 LEU HD12 . 18844 1 198 . 1 1 19 19 LEU HD13 H 1 0.569 0.011 . . . . . A 19 LEU HD13 . 18844 1 199 . 1 1 19 19 LEU HD21 H 1 0.555 0.006 . . . . . A 19 LEU HD21 . 18844 1 200 . 1 1 19 19 LEU HD22 H 1 0.555 0.006 . . . . . A 19 LEU HD22 . 18844 1 201 . 1 1 19 19 LEU HD23 H 1 0.555 0.006 . . . . . A 19 LEU HD23 . 18844 1 202 . 1 1 19 19 LEU CA C 13 54.180 0.022 . . . . . A 19 LEU CA . 18844 1 203 . 1 1 19 19 LEU CB C 13 42.711 0.025 . . . . . A 19 LEU CB . 18844 1 204 . 1 1 19 19 LEU CG C 13 27.283 0.010 . . . . . A 19 LEU CG . 18844 1 205 . 1 1 19 19 LEU CD1 C 13 27.131 0.050 . . . . . A 19 LEU CD1 . 18844 1 206 . 1 1 19 19 LEU CD2 C 13 23.389 0.019 . . . . . A 19 LEU CD2 . 18844 1 207 . 1 1 19 19 LEU N N 15 123.019 0.024 . . . . . A 19 LEU N . 18844 1 208 . 1 1 20 20 SER H H 1 9.714 0.003 . . . . . A 20 SER H . 18844 1 209 . 1 1 20 20 SER HA H 1 4.863 0.004 . . . . . A 20 SER HA . 18844 1 210 . 1 1 20 20 SER HB2 H 1 3.793 0.008 . . . . . A 20 SER HB2 . 18844 1 211 . 1 1 20 20 SER HB3 H 1 3.624 0.006 . . . . . A 20 SER HB3 . 18844 1 212 . 1 1 20 20 SER CA C 13 56.832 0.024 . . . . . A 20 SER CA . 18844 1 213 . 1 1 20 20 SER CB C 13 67.845 0.036 . . . . . A 20 SER CB . 18844 1 214 . 1 1 20 20 SER N N 15 117.870 0.034 . . . . . A 20 SER N . 18844 1 215 . 1 1 21 21 GLU H H 1 8.491 0.005 . . . . . A 21 GLU H . 18844 1 216 . 1 1 21 21 GLU HA H 1 3.740 0.009 . . . . . A 21 GLU HA . 18844 1 217 . 1 1 21 21 GLU HB2 H 1 1.940 0.005 . . . . . A 21 GLU HB2 . 18844 1 218 . 1 1 21 21 GLU HB3 H 1 1.940 0.005 . . . . . A 21 GLU HB3 . 18844 1 219 . 1 1 21 21 GLU HG2 H 1 2.355 0.004 . . . . . A 21 GLU HG2 . 18844 1 220 . 1 1 21 21 GLU HG3 H 1 2.046 0.005 . . . . . A 21 GLU HG3 . 18844 1 221 . 1 1 21 21 GLU CA C 13 59.134 0.011 . . . . . A 21 GLU CA . 18844 1 222 . 1 1 21 21 GLU CB C 13 30.854 0.016 . . . . . A 21 GLU CB . 18844 1 223 . 1 1 21 21 GLU CG C 13 37.949 0.019 . . . . . A 21 GLU CG . 18844 1 224 . 1 1 21 21 GLU N N 15 116.130 0.069 . . . . . A 21 GLU N . 18844 1 225 . 1 1 22 22 ASP H H 1 7.936 0.002 . . . . . A 22 ASP H . 18844 1 226 . 1 1 22 22 ASP HA H 1 4.650 0.004 . . . . . A 22 ASP HA . 18844 1 227 . 1 1 22 22 ASP HB2 H 1 2.713 0.008 . . . . . A 22 ASP HB2 . 18844 1 228 . 1 1 22 22 ASP HB3 H 1 2.282 0.007 . . . . . A 22 ASP HB3 . 18844 1 229 . 1 1 22 22 ASP CA C 13 55.156 0.042 . . . . . A 22 ASP CA . 18844 1 230 . 1 1 22 22 ASP CB C 13 42.579 0.039 . . . . . A 22 ASP CB . 18844 1 231 . 1 1 22 22 ASP N N 15 115.741 0.024 . . . . . A 22 ASP N . 18844 1 232 . 1 1 23 23 ASP H H 1 7.313 0.003 . . . . . A 23 ASP H . 18844 1 233 . 1 1 23 23 ASP HA H 1 4.841 0.002 . . . . . A 23 ASP HA . 18844 1 234 . 1 1 23 23 ASP HB2 H 1 2.832 0.006 . . . . . A 23 ASP HB2 . 18844 1 235 . 1 1 23 23 ASP HB3 H 1 2.832 0.006 . . . . . A 23 ASP HB3 . 18844 1 236 . 1 1 23 23 ASP CA C 13 55.223 0.045 . . . . . A 23 ASP CA . 18844 1 237 . 1 1 23 23 ASP CB C 13 42.782 0.065 . . . . . A 23 ASP CB . 18844 1 238 . 1 1 23 23 ASP N N 15 119.945 0.027 . . . . . A 23 ASP N . 18844 1 239 . 1 1 24 24 THR H H 1 9.630 0.004 . . . . . A 24 THR H . 18844 1 240 . 1 1 24 24 THR HA H 1 5.328 0.005 . . . . . A 24 THR HA . 18844 1 241 . 1 1 24 24 THR HB H 1 4.574 0.009 . . . . . A 24 THR HB . 18844 1 242 . 1 1 24 24 THR HG21 H 1 1.065 0.003 . . . . . A 24 THR HG21 . 18844 1 243 . 1 1 24 24 THR HG22 H 1 1.065 0.003 . . . . . A 24 THR HG22 . 18844 1 244 . 1 1 24 24 THR HG23 H 1 1.065 0.003 . . . . . A 24 THR HG23 . 18844 1 245 . 1 1 24 24 THR CA C 13 60.989 0.037 . . . . . A 24 THR CA . 18844 1 246 . 1 1 24 24 THR CB C 13 74.287 0.090 . . . . . A 24 THR CB . 18844 1 247 . 1 1 24 24 THR CG2 C 13 22.168 0.011 . . . . . A 24 THR CG2 . 18844 1 248 . 1 1 24 24 THR N N 15 107.918 0.049 . . . . . A 24 THR N . 18844 1 249 . 1 1 25 25 VAL H H 1 8.260 0.003 . . . . . A 25 VAL H . 18844 1 250 . 1 1 25 25 VAL HA H 1 3.334 0.003 . . . . . A 25 VAL HA . 18844 1 251 . 1 1 25 25 VAL HB H 1 2.268 0.007 . . . . . A 25 VAL HB . 18844 1 252 . 1 1 25 25 VAL HG11 H 1 0.812 0.003 . . . . . A 25 VAL HG11 . 18844 1 253 . 1 1 25 25 VAL HG12 H 1 0.812 0.003 . . . . . A 25 VAL HG12 . 18844 1 254 . 1 1 25 25 VAL HG13 H 1 0.812 0.003 . . . . . A 25 VAL HG13 . 18844 1 255 . 1 1 25 25 VAL HG21 H 1 0.741 0.005 . . . . . A 25 VAL HG21 . 18844 1 256 . 1 1 25 25 VAL HG22 H 1 0.741 0.005 . . . . . A 25 VAL HG22 . 18844 1 257 . 1 1 25 25 VAL HG23 H 1 0.741 0.005 . . . . . A 25 VAL HG23 . 18844 1 258 . 1 1 25 25 VAL CA C 13 67.626 0.021 . . . . . A 25 VAL CA . 18844 1 259 . 1 1 25 25 VAL CB C 13 32.149 0.068 . . . . . A 25 VAL CB . 18844 1 260 . 1 1 25 25 VAL CG1 C 13 24.442 0.044 . . . . . A 25 VAL CG1 . 18844 1 261 . 1 1 25 25 VAL CG2 C 13 21.711 0.033 . . . . . A 25 VAL CG2 . 18844 1 262 . 1 1 25 25 VAL N N 15 120.192 0.050 . . . . . A 25 VAL N . 18844 1 263 . 1 1 26 26 LEU H H 1 8.523 0.003 . . . . . A 26 LEU H . 18844 1 264 . 1 1 26 26 LEU HA H 1 3.872 0.006 . . . . . A 26 LEU HA . 18844 1 265 . 1 1 26 26 LEU HB2 H 1 1.727 0.004 . . . . . A 26 LEU HB2 . 18844 1 266 . 1 1 26 26 LEU HB3 H 1 1.208 0.004 . . . . . A 26 LEU HB3 . 18844 1 267 . 1 1 26 26 LEU HG H 1 1.459 0.006 . . . . . A 26 LEU HG . 18844 1 268 . 1 1 26 26 LEU HD11 H 1 0.779 0.006 . . . . . A 26 LEU HD11 . 18844 1 269 . 1 1 26 26 LEU HD12 H 1 0.779 0.006 . . . . . A 26 LEU HD12 . 18844 1 270 . 1 1 26 26 LEU HD13 H 1 0.779 0.006 . . . . . A 26 LEU HD13 . 18844 1 271 . 1 1 26 26 LEU HD21 H 1 0.804 0.005 . . . . . A 26 LEU HD21 . 18844 1 272 . 1 1 26 26 LEU HD22 H 1 0.804 0.005 . . . . . A 26 LEU HD22 . 18844 1 273 . 1 1 26 26 LEU HD23 H 1 0.804 0.005 . . . . . A 26 LEU HD23 . 18844 1 274 . 1 1 26 26 LEU CA C 13 58.592 0.019 . . . . . A 26 LEU CA . 18844 1 275 . 1 1 26 26 LEU CB C 13 41.716 0.039 . . . . . A 26 LEU CB . 18844 1 276 . 1 1 26 26 LEU CG C 13 27.024 0.027 . . . . . A 26 LEU CG . 18844 1 277 . 1 1 26 26 LEU CD1 C 13 25.810 0.010 . . . . . A 26 LEU CD1 . 18844 1 278 . 1 1 26 26 LEU CD2 C 13 22.569 0.036 . . . . . A 26 LEU CD2 . 18844 1 279 . 1 1 26 26 LEU N N 15 119.941 0.049 . . . . . A 26 LEU N . 18844 1 280 . 1 1 27 27 ASP H H 1 7.581 0.005 . . . . . A 27 ASP H . 18844 1 281 . 1 1 27 27 ASP HA H 1 4.273 0.003 . . . . . A 27 ASP HA . 18844 1 282 . 1 1 27 27 ASP HB2 H 1 3.127 0.007 . . . . . A 27 ASP HB2 . 18844 1 283 . 1 1 27 27 ASP HB3 H 1 2.514 0.003 . . . . . A 27 ASP HB3 . 18844 1 284 . 1 1 27 27 ASP CA C 13 58.663 0.036 . . . . . A 27 ASP CA . 18844 1 285 . 1 1 27 27 ASP CB C 13 40.931 0.029 . . . . . A 27 ASP CB . 18844 1 286 . 1 1 27 27 ASP N N 15 118.322 0.028 . . . . . A 27 ASP N . 18844 1 287 . 1 1 28 28 LEU H H 1 7.837 0.005 . . . . . A 28 LEU H . 18844 1 288 . 1 1 28 28 LEU HA H 1 4.083 0.005 . . . . . A 28 LEU HA . 18844 1 289 . 1 1 28 28 LEU HB2 H 1 2.377 0.004 . . . . . A 28 LEU HB2 . 18844 1 290 . 1 1 28 28 LEU HB3 H 1 1.203 0.005 . . . . . A 28 LEU HB3 . 18844 1 291 . 1 1 28 28 LEU HG H 1 1.432 0.003 . . . . . A 28 LEU HG . 18844 1 292 . 1 1 28 28 LEU HD11 H 1 0.808 0.004 . . . . . A 28 LEU HD11 . 18844 1 293 . 1 1 28 28 LEU HD12 H 1 0.808 0.004 . . . . . A 28 LEU HD12 . 18844 1 294 . 1 1 28 28 LEU HD13 H 1 0.808 0.004 . . . . . A 28 LEU HD13 . 18844 1 295 . 1 1 28 28 LEU HD21 H 1 0.682 0.003 . . . . . A 28 LEU HD21 . 18844 1 296 . 1 1 28 28 LEU HD22 H 1 0.682 0.003 . . . . . A 28 LEU HD22 . 18844 1 297 . 1 1 28 28 LEU HD23 H 1 0.682 0.003 . . . . . A 28 LEU HD23 . 18844 1 298 . 1 1 28 28 LEU CA C 13 58.772 0.024 . . . . . A 28 LEU CA . 18844 1 299 . 1 1 28 28 LEU CB C 13 41.225 0.033 . . . . . A 28 LEU CB . 18844 1 300 . 1 1 28 28 LEU CG C 13 27.837 0.006 . . . . . A 28 LEU CG . 18844 1 301 . 1 1 28 28 LEU CD1 C 13 23.700 0.000 . . . . . A 28 LEU CD1 . 18844 1 302 . 1 1 28 28 LEU CD2 C 13 26.705 0.005 . . . . . A 28 LEU CD2 . 18844 1 303 . 1 1 28 28 LEU N N 15 122.021 0.038 . . . . . A 28 LEU N . 18844 1 304 . 1 1 29 29 LYS H H 1 8.467 0.004 . . . . . A 29 LYS H . 18844 1 305 . 1 1 29 29 LYS HA H 1 4.520 0.005 . . . . . A 29 LYS HA . 18844 1 306 . 1 1 29 29 LYS HB2 H 1 1.909 0.003 . . . . . A 29 LYS HB2 . 18844 1 307 . 1 1 29 29 LYS HB3 H 1 1.358 0.005 . . . . . A 29 LYS HB3 . 18844 1 308 . 1 1 29 29 LYS HG2 H 1 1.501 0.004 . . . . . A 29 LYS HG2 . 18844 1 309 . 1 1 29 29 LYS HG3 H 1 1.501 0.004 . . . . . A 29 LYS HG3 . 18844 1 310 . 1 1 29 29 LYS HD2 H 1 1.578 0.002 . . . . . A 29 LYS HD2 . 18844 1 311 . 1 1 29 29 LYS HD3 H 1 1.412 0.006 . . . . . A 29 LYS HD3 . 18844 1 312 . 1 1 29 29 LYS HE2 H 1 2.627 0.007 . . . . . A 29 LYS HE2 . 18844 1 313 . 1 1 29 29 LYS HE3 H 1 2.565 0.002 . . . . . A 29 LYS HE3 . 18844 1 314 . 1 1 29 29 LYS CA C 13 59.787 0.021 . . . . . A 29 LYS CA . 18844 1 315 . 1 1 29 29 LYS CB C 13 34.297 0.048 . . . . . A 29 LYS CB . 18844 1 316 . 1 1 29 29 LYS CG C 13 26.295 0.005 . . . . . A 29 LYS CG . 18844 1 317 . 1 1 29 29 LYS CD C 13 30.301 0.030 . . . . . A 29 LYS CD . 18844 1 318 . 1 1 29 29 LYS N N 15 119.086 0.048 . . . . . A 29 LYS N . 18844 1 319 . 1 1 30 30 GLN H H 1 9.049 0.005 . . . . . A 30 GLN H . 18844 1 320 . 1 1 30 30 GLN HA H 1 3.932 0.003 . . . . . A 30 GLN HA . 18844 1 321 . 1 1 30 30 GLN HB2 H 1 2.130 0.006 . . . . . A 30 GLN HB2 . 18844 1 322 . 1 1 30 30 GLN HB3 H 1 2.049 0.005 . . . . . A 30 GLN HB3 . 18844 1 323 . 1 1 30 30 GLN HG2 H 1 2.477 0.005 . . . . . A 30 GLN HG2 . 18844 1 324 . 1 1 30 30 GLN HG3 H 1 2.297 0.005 . . . . . A 30 GLN HG3 . 18844 1 325 . 1 1 30 30 GLN CA C 13 59.663 0.025 . . . . . A 30 GLN CA . 18844 1 326 . 1 1 30 30 GLN CB C 13 27.806 0.034 . . . . . A 30 GLN CB . 18844 1 327 . 1 1 30 30 GLN CG C 13 33.829 0.029 . . . . . A 30 GLN CG . 18844 1 328 . 1 1 30 30 GLN N N 15 119.268 0.026 . . . . . A 30 GLN N . 18844 1 329 . 1 1 31 31 PHE H H 1 8.039 0.003 . . . . . A 31 PHE H . 18844 1 330 . 1 1 31 31 PHE HA H 1 4.218 0.004 . . . . . A 31 PHE HA . 18844 1 331 . 1 1 31 31 PHE HB2 H 1 3.158 0.009 . . . . . A 31 PHE HB2 . 18844 1 332 . 1 1 31 31 PHE HB3 H 1 3.158 0.009 . . . . . A 31 PHE HB3 . 18844 1 333 . 1 1 31 31 PHE HD1 H 1 7.020 0.006 . . . . . A 31 PHE HD1 . 18844 1 334 . 1 1 31 31 PHE CA C 13 61.967 0.022 . . . . . A 31 PHE CA . 18844 1 335 . 1 1 31 31 PHE CB C 13 39.374 0.050 . . . . . A 31 PHE CB . 18844 1 336 . 1 1 31 31 PHE N N 15 121.690 0.036 . . . . . A 31 PHE N . 18844 1 337 . 1 1 32 32 LEU H H 1 8.776 0.004 . . . . . A 32 LEU H . 18844 1 338 . 1 1 32 32 LEU HA H 1 3.637 0.004 . . . . . A 32 LEU HA . 18844 1 339 . 1 1 32 32 LEU HB2 H 1 2.181 0.005 . . . . . A 32 LEU HB2 . 18844 1 340 . 1 1 32 32 LEU HB3 H 1 0.745 0.009 . . . . . A 32 LEU HB3 . 18844 1 341 . 1 1 32 32 LEU HG H 1 1.826 0.007 . . . . . A 32 LEU HG . 18844 1 342 . 1 1 32 32 LEU HD11 H 1 0.754 0.007 . . . . . A 32 LEU HD11 . 18844 1 343 . 1 1 32 32 LEU HD12 H 1 0.754 0.007 . . . . . A 32 LEU HD12 . 18844 1 344 . 1 1 32 32 LEU HD13 H 1 0.754 0.007 . . . . . A 32 LEU HD13 . 18844 1 345 . 1 1 32 32 LEU HD21 H 1 0.545 0.006 . . . . . A 32 LEU HD21 . 18844 1 346 . 1 1 32 32 LEU HD22 H 1 0.545 0.006 . . . . . A 32 LEU HD22 . 18844 1 347 . 1 1 32 32 LEU HD23 H 1 0.545 0.006 . . . . . A 32 LEU HD23 . 18844 1 348 . 1 1 32 32 LEU CA C 13 57.708 0.048 . . . . . A 32 LEU CA . 18844 1 349 . 1 1 32 32 LEU CB C 13 41.270 0.036 . . . . . A 32 LEU CB . 18844 1 350 . 1 1 32 32 LEU CG C 13 27.568 0.048 . . . . . A 32 LEU CG . 18844 1 351 . 1 1 32 32 LEU CD1 C 13 26.420 0.001 . . . . . A 32 LEU CD1 . 18844 1 352 . 1 1 32 32 LEU CD2 C 13 22.100 0.022 . . . . . A 32 LEU CD2 . 18844 1 353 . 1 1 32 32 LEU N N 15 118.232 0.039 . . . . . A 32 LEU N . 18844 1 354 . 1 1 33 33 LYS H H 1 8.237 0.003 . . . . . A 33 LYS H . 18844 1 355 . 1 1 33 33 LYS HA H 1 3.802 0.008 . . . . . A 33 LYS HA . 18844 1 356 . 1 1 33 33 LYS HB2 H 1 2.010 0.005 . . . . . A 33 LYS HB2 . 18844 1 357 . 1 1 33 33 LYS HB3 H 1 1.675 0.006 . . . . . A 33 LYS HB3 . 18844 1 358 . 1 1 33 33 LYS HG2 H 1 1.203 0.003 . . . . . A 33 LYS HG2 . 18844 1 359 . 1 1 33 33 LYS HG3 H 1 0.983 0.007 . . . . . A 33 LYS HG3 . 18844 1 360 . 1 1 33 33 LYS HD2 H 1 1.497 0.009 . . . . . A 33 LYS HD2 . 18844 1 361 . 1 1 33 33 LYS HD3 H 1 1.373 0.005 . . . . . A 33 LYS HD3 . 18844 1 362 . 1 1 33 33 LYS HE2 H 1 2.735 0.002 . . . . . A 33 LYS HE2 . 18844 1 363 . 1 1 33 33 LYS CA C 13 60.116 0.021 . . . . . A 33 LYS CA . 18844 1 364 . 1 1 33 33 LYS CB C 13 31.701 0.033 . . . . . A 33 LYS CB . 18844 1 365 . 1 1 33 33 LYS CG C 13 24.887 0.050 . . . . . A 33 LYS CG . 18844 1 366 . 1 1 33 33 LYS CD C 13 29.513 0.035 . . . . . A 33 LYS CD . 18844 1 367 . 1 1 33 33 LYS N N 15 125.920 0.019 . . . . . A 33 LYS N . 18844 1 368 . 1 1 34 34 THR H H 1 7.281 0.004 . . . . . A 34 THR H . 18844 1 369 . 1 1 34 34 THR HA H 1 3.773 0.007 . . . . . A 34 THR HA . 18844 1 370 . 1 1 34 34 THR HB H 1 4.027 0.006 . . . . . A 34 THR HB . 18844 1 371 . 1 1 34 34 THR HG21 H 1 1.101 0.002 . . . . . A 34 THR HG21 . 18844 1 372 . 1 1 34 34 THR HG22 H 1 1.101 0.002 . . . . . A 34 THR HG22 . 18844 1 373 . 1 1 34 34 THR HG23 H 1 1.101 0.002 . . . . . A 34 THR HG23 . 18844 1 374 . 1 1 34 34 THR CA C 13 65.749 0.048 . . . . . A 34 THR CA . 18844 1 375 . 1 1 34 34 THR CB C 13 68.620 0.083 . . . . . A 34 THR CB . 18844 1 376 . 1 1 34 34 THR CG2 C 13 22.068 0.013 . . . . . A 34 THR CG2 . 18844 1 377 . 1 1 34 34 THR N N 15 114.544 0.028 . . . . . A 34 THR N . 18844 1 378 . 1 1 35 35 LEU H H 1 6.752 0.004 . . . . . A 35 LEU H . 18844 1 379 . 1 1 35 35 LEU HA H 1 4.018 0.003 . . . . . A 35 LEU HA . 18844 1 380 . 1 1 35 35 LEU HB2 H 1 1.118 0.006 . . . . . A 35 LEU HB2 . 18844 1 381 . 1 1 35 35 LEU HB3 H 1 1.045 0.004 . . . . . A 35 LEU HB3 . 18844 1 382 . 1 1 35 35 LEU HG H 1 1.172 0.003 . . . . . A 35 LEU HG . 18844 1 383 . 1 1 35 35 LEU HD11 H 1 0.614 0.007 . . . . . A 35 LEU HD11 . 18844 1 384 . 1 1 35 35 LEU HD12 H 1 0.614 0.007 . . . . . A 35 LEU HD12 . 18844 1 385 . 1 1 35 35 LEU HD13 H 1 0.614 0.007 . . . . . A 35 LEU HD13 . 18844 1 386 . 1 1 35 35 LEU HD21 H 1 0.620 0.006 . . . . . A 35 LEU HD21 . 18844 1 387 . 1 1 35 35 LEU HD22 H 1 0.620 0.006 . . . . . A 35 LEU HD22 . 18844 1 388 . 1 1 35 35 LEU HD23 H 1 0.620 0.006 . . . . . A 35 LEU HD23 . 18844 1 389 . 1 1 35 35 LEU CA C 13 57.015 0.028 . . . . . A 35 LEU CA . 18844 1 390 . 1 1 35 35 LEU CB C 13 44.003 0.029 . . . . . A 35 LEU CB . 18844 1 391 . 1 1 35 35 LEU CG C 13 26.566 0.079 . . . . . A 35 LEU CG . 18844 1 392 . 1 1 35 35 LEU CD1 C 13 25.790 0.001 . . . . . A 35 LEU CD1 . 18844 1 393 . 1 1 35 35 LEU CD2 C 13 22.495 0.050 . . . . . A 35 LEU CD2 . 18844 1 394 . 1 1 35 35 LEU N N 15 117.590 0.043 . . . . . A 35 LEU N . 18844 1 395 . 1 1 36 36 THR H H 1 7.675 0.004 . . . . . A 36 THR H . 18844 1 396 . 1 1 36 36 THR HA H 1 3.967 0.002 . . . . . A 36 THR HA . 18844 1 397 . 1 1 36 36 THR HB H 1 2.435 0.006 . . . . . A 36 THR HB . 18844 1 398 . 1 1 36 36 THR HG21 H 1 0.126 0.002 . . . . . A 36 THR HG21 . 18844 1 399 . 1 1 36 36 THR HG22 H 1 0.126 0.002 . . . . . A 36 THR HG22 . 18844 1 400 . 1 1 36 36 THR HG23 H 1 0.126 0.002 . . . . . A 36 THR HG23 . 18844 1 401 . 1 1 36 36 THR CA C 13 62.756 0.032 . . . . . A 36 THR CA . 18844 1 402 . 1 1 36 36 THR CB C 13 72.343 0.058 . . . . . A 36 THR CB . 18844 1 403 . 1 1 36 36 THR CG2 C 13 20.417 0.011 . . . . . A 36 THR CG2 . 18844 1 404 . 1 1 36 36 THR N N 15 104.865 0.048 . . . . . A 36 THR N . 18844 1 405 . 1 1 37 37 GLY H H 1 7.971 0.005 . . . . . A 37 GLY H . 18844 1 406 . 1 1 37 37 GLY HA2 H 1 4.039 0.008 . . . . . A 37 GLY HA2 . 18844 1 407 . 1 1 37 37 GLY HA3 H 1 3.532 0.005 . . . . . A 37 GLY HA3 . 18844 1 408 . 1 1 37 37 GLY CA C 13 45.559 0.016 . . . . . A 37 GLY CA . 18844 1 409 . 1 1 37 37 GLY N N 15 109.795 0.042 . . . . . A 37 GLY N . 18844 1 410 . 1 1 38 38 VAL H H 1 7.533 0.005 . . . . . A 38 VAL H . 18844 1 411 . 1 1 38 38 VAL HA H 1 3.638 0.005 . . . . . A 38 VAL HA . 18844 1 412 . 1 1 38 38 VAL HB H 1 1.175 0.004 . . . . . A 38 VAL HB . 18844 1 413 . 1 1 38 38 VAL HG11 H 1 0.598 0.003 . . . . . A 38 VAL HG11 . 18844 1 414 . 1 1 38 38 VAL HG12 H 1 0.598 0.003 . . . . . A 38 VAL HG12 . 18844 1 415 . 1 1 38 38 VAL HG13 H 1 0.598 0.003 . . . . . A 38 VAL HG13 . 18844 1 416 . 1 1 38 38 VAL HG21 H 1 0.041 0.004 . . . . . A 38 VAL HG21 . 18844 1 417 . 1 1 38 38 VAL HG22 H 1 0.041 0.004 . . . . . A 38 VAL HG22 . 18844 1 418 . 1 1 38 38 VAL HG23 H 1 0.041 0.004 . . . . . A 38 VAL HG23 . 18844 1 419 . 1 1 38 38 VAL CA C 13 62.437 0.022 . . . . . A 38 VAL CA . 18844 1 420 . 1 1 38 38 VAL CB C 13 31.390 0.063 . . . . . A 38 VAL CB . 18844 1 421 . 1 1 38 38 VAL CG1 C 13 22.264 0.027 . . . . . A 38 VAL CG1 . 18844 1 422 . 1 1 38 38 VAL CG2 C 13 22.061 0.012 . . . . . A 38 VAL CG2 . 18844 1 423 . 1 1 38 38 VAL N N 15 122.557 0.046 . . . . . A 38 VAL N . 18844 1 424 . 1 1 39 39 LEU H H 1 8.634 0.009 . . . . . A 39 LEU H . 18844 1 425 . 1 1 39 39 LEU HA H 1 3.994 0.004 . . . . . A 39 LEU HA . 18844 1 426 . 1 1 39 39 LEU HB2 H 1 1.588 0.007 . . . . . A 39 LEU HB2 . 18844 1 427 . 1 1 39 39 LEU HB3 H 1 1.322 0.006 . . . . . A 39 LEU HB3 . 18844 1 428 . 1 1 39 39 LEU HG H 1 1.748 0.003 . . . . . A 39 LEU HG . 18844 1 429 . 1 1 39 39 LEU HD11 H 1 0.844 0.006 . . . . . A 39 LEU HD11 . 18844 1 430 . 1 1 39 39 LEU HD12 H 1 0.844 0.006 . . . . . A 39 LEU HD12 . 18844 1 431 . 1 1 39 39 LEU HD13 H 1 0.844 0.006 . . . . . A 39 LEU HD13 . 18844 1 432 . 1 1 39 39 LEU HD21 H 1 0.800 0.005 . . . . . A 39 LEU HD21 . 18844 1 433 . 1 1 39 39 LEU HD22 H 1 0.800 0.005 . . . . . A 39 LEU HD22 . 18844 1 434 . 1 1 39 39 LEU HD23 H 1 0.800 0.005 . . . . . A 39 LEU HD23 . 18844 1 435 . 1 1 39 39 LEU CA C 13 54.437 0.020 . . . . . A 39 LEU CA . 18844 1 436 . 1 1 39 39 LEU CB C 13 40.557 0.038 . . . . . A 39 LEU CB . 18844 1 437 . 1 1 39 39 LEU CG C 13 27.462 0.007 . . . . . A 39 LEU CG . 18844 1 438 . 1 1 39 39 LEU CD1 C 13 25.515 0.065 . . . . . A 39 LEU CD1 . 18844 1 439 . 1 1 39 39 LEU CD2 C 13 22.806 0.018 . . . . . A 39 LEU CD2 . 18844 1 440 . 1 1 39 39 LEU N N 15 127.828 0.019 . . . . . A 39 LEU N . 18844 1 441 . 1 1 40 40 PRO HA H 1 3.839 0.005 . . . . . A 40 PRO HA . 18844 1 442 . 1 1 40 40 PRO HB2 H 1 1.863 0.004 . . . . . A 40 PRO HB2 . 18844 1 443 . 1 1 40 40 PRO HB3 H 1 1.863 0.004 . . . . . A 40 PRO HB3 . 18844 1 444 . 1 1 40 40 PRO HG2 H 1 2.155 0.002 . . . . . A 40 PRO HG2 . 18844 1 445 . 1 1 40 40 PRO HG3 H 1 1.500 0.003 . . . . . A 40 PRO HG3 . 18844 1 446 . 1 1 40 40 PRO HD2 H 1 3.519 0.007 . . . . . A 40 PRO HD2 . 18844 1 447 . 1 1 40 40 PRO HD3 H 1 3.519 0.007 . . . . . A 40 PRO HD3 . 18844 1 448 . 1 1 40 40 PRO CA C 13 66.989 0.069 . . . . . A 40 PRO CA . 18844 1 449 . 1 1 40 40 PRO CB C 13 32.322 0.039 . . . . . A 40 PRO CB . 18844 1 450 . 1 1 40 40 PRO CG C 13 27.880 0.023 . . . . . A 40 PRO CG . 18844 1 451 . 1 1 40 40 PRO CD C 13 50.532 0.001 . . . . . A 40 PRO CD . 18844 1 452 . 1 1 41 41 GLU H H 1 9.746 0.005 . . . . . A 41 GLU H . 18844 1 453 . 1 1 41 41 GLU HA H 1 4.071 0.006 . . . . . A 41 GLU HA . 18844 1 454 . 1 1 41 41 GLU HB2 H 1 1.967 0.003 . . . . . A 41 GLU HB2 . 18844 1 455 . 1 1 41 41 GLU HB3 H 1 1.967 0.003 . . . . . A 41 GLU HB3 . 18844 1 456 . 1 1 41 41 GLU HG2 H 1 2.205 0.003 . . . . . A 41 GLU HG2 . 18844 1 457 . 1 1 41 41 GLU HG3 H 1 2.205 0.003 . . . . . A 41 GLU HG3 . 18844 1 458 . 1 1 41 41 GLU CA C 13 58.938 0.020 . . . . . A 41 GLU CA . 18844 1 459 . 1 1 41 41 GLU CB C 13 28.824 0.033 . . . . . A 41 GLU CB . 18844 1 460 . 1 1 41 41 GLU CG C 13 36.788 0.039 . . . . . A 41 GLU CG . 18844 1 461 . 1 1 41 41 GLU N N 15 114.752 0.039 . . . . . A 41 GLU N . 18844 1 462 . 1 1 42 42 ARG H H 1 7.938 0.005 . . . . . A 42 ARG H . 18844 1 463 . 1 1 42 42 ARG HA H 1 4.315 0.005 . . . . . A 42 ARG HA . 18844 1 464 . 1 1 42 42 ARG HB2 H 1 2.132 0.005 . . . . . A 42 ARG HB2 . 18844 1 465 . 1 1 42 42 ARG HB3 H 1 1.731 0.007 . . . . . A 42 ARG HB3 . 18844 1 466 . 1 1 42 42 ARG HG2 H 1 1.620 0.004 . . . . . A 42 ARG HG2 . 18844 1 467 . 1 1 42 42 ARG HG3 H 1 1.433 0.007 . . . . . A 42 ARG HG3 . 18844 1 468 . 1 1 42 42 ARG HD2 H 1 3.192 0.005 . . . . . A 42 ARG HD2 . 18844 1 469 . 1 1 42 42 ARG HD3 H 1 3.192 0.005 . . . . . A 42 ARG HD3 . 18844 1 470 . 1 1 42 42 ARG CA C 13 55.448 0.037 . . . . . A 42 ARG CA . 18844 1 471 . 1 1 42 42 ARG CB C 13 31.105 0.039 . . . . . A 42 ARG CB . 18844 1 472 . 1 1 42 42 ARG CG C 13 28.081 0.032 . . . . . A 42 ARG CG . 18844 1 473 . 1 1 42 42 ARG N N 15 118.145 0.044 . . . . . A 42 ARG N . 18844 1 474 . 1 1 43 43 GLN H H 1 7.034 0.004 . . . . . A 43 GLN H . 18844 1 475 . 1 1 43 43 GLN HA H 1 4.251 0.005 . . . . . A 43 GLN HA . 18844 1 476 . 1 1 43 43 GLN HB2 H 1 1.642 0.009 . . . . . A 43 GLN HB2 . 18844 1 477 . 1 1 43 43 GLN HB3 H 1 1.642 0.009 . . . . . A 43 GLN HB3 . 18844 1 478 . 1 1 43 43 GLN HG2 H 1 2.260 0.002 . . . . . A 43 GLN HG2 . 18844 1 479 . 1 1 43 43 GLN HG3 H 1 1.846 0.005 . . . . . A 43 GLN HG3 . 18844 1 480 . 1 1 43 43 GLN CA C 13 56.537 0.035 . . . . . A 43 GLN CA . 18844 1 481 . 1 1 43 43 GLN CB C 13 30.992 0.043 . . . . . A 43 GLN CB . 18844 1 482 . 1 1 43 43 GLN CG C 13 33.714 0.015 . . . . . A 43 GLN CG . 18844 1 483 . 1 1 43 43 GLN N N 15 118.250 0.034 . . . . . A 43 GLN N . 18844 1 484 . 1 1 44 44 LYS H H 1 8.806 0.003 . . . . . A 44 LYS H . 18844 1 485 . 1 1 44 44 LYS HA H 1 4.464 0.006 . . . . . A 44 LYS HA . 18844 1 486 . 1 1 44 44 LYS HB2 H 1 1.672 0.008 . . . . . A 44 LYS HB2 . 18844 1 487 . 1 1 44 44 LYS HB3 H 1 1.672 0.008 . . . . . A 44 LYS HB3 . 18844 1 488 . 1 1 44 44 LYS HG2 H 1 1.351 0.005 . . . . . A 44 LYS HG2 . 18844 1 489 . 1 1 44 44 LYS HG3 H 1 1.205 0.004 . . . . . A 44 LYS HG3 . 18844 1 490 . 1 1 44 44 LYS HD2 H 1 1.626 0.010 . . . . . A 44 LYS HD2 . 18844 1 491 . 1 1 44 44 LYS HD3 H 1 1.626 0.010 . . . . . A 44 LYS HD3 . 18844 1 492 . 1 1 44 44 LYS HE2 H 1 2.868 0.001 . . . . . A 44 LYS HE2 . 18844 1 493 . 1 1 44 44 LYS CA C 13 55.552 0.052 . . . . . A 44 LYS CA . 18844 1 494 . 1 1 44 44 LYS CB C 13 34.325 0.056 . . . . . A 44 LYS CB . 18844 1 495 . 1 1 44 44 LYS CG C 13 25.132 0.025 . . . . . A 44 LYS CG . 18844 1 496 . 1 1 44 44 LYS CD C 13 29.805 0.017 . . . . . A 44 LYS CD . 18844 1 497 . 1 1 44 44 LYS N N 15 122.693 0.033 . . . . . A 44 LYS N . 18844 1 498 . 1 1 45 45 LEU H H 1 8.704 0.002 . . . . . A 45 LEU H . 18844 1 499 . 1 1 45 45 LEU HA H 1 4.943 0.005 . . . . . A 45 LEU HA . 18844 1 500 . 1 1 45 45 LEU HB2 H 1 1.810 0.006 . . . . . A 45 LEU HB2 . 18844 1 501 . 1 1 45 45 LEU HB3 H 1 1.040 0.006 . . . . . A 45 LEU HB3 . 18844 1 502 . 1 1 45 45 LEU HG H 1 1.444 0.004 . . . . . A 45 LEU HG . 18844 1 503 . 1 1 45 45 LEU HD11 H 1 0.743 0.005 . . . . . A 45 LEU HD11 . 18844 1 504 . 1 1 45 45 LEU HD12 H 1 0.743 0.005 . . . . . A 45 LEU HD12 . 18844 1 505 . 1 1 45 45 LEU HD13 H 1 0.743 0.005 . . . . . A 45 LEU HD13 . 18844 1 506 . 1 1 45 45 LEU HD21 H 1 0.655 0.003 . . . . . A 45 LEU HD21 . 18844 1 507 . 1 1 45 45 LEU HD22 H 1 0.655 0.003 . . . . . A 45 LEU HD22 . 18844 1 508 . 1 1 45 45 LEU HD23 H 1 0.655 0.003 . . . . . A 45 LEU HD23 . 18844 1 509 . 1 1 45 45 LEU CA C 13 53.542 0.021 . . . . . A 45 LEU CA . 18844 1 510 . 1 1 45 45 LEU CB C 13 41.821 0.034 . . . . . A 45 LEU CB . 18844 1 511 . 1 1 45 45 LEU CD1 C 13 26.893 0.019 . . . . . A 45 LEU CD1 . 18844 1 512 . 1 1 45 45 LEU CD2 C 13 23.357 0.031 . . . . . A 45 LEU CD2 . 18844 1 513 . 1 1 45 45 LEU N N 15 124.806 0.062 . . . . . A 45 LEU N . 18844 1 514 . 1 1 46 46 LEU H H 1 8.751 0.004 . . . . . A 46 LEU H . 18844 1 515 . 1 1 46 46 LEU HA H 1 4.358 0.006 . . . . . A 46 LEU HA . 18844 1 516 . 1 1 46 46 LEU HB2 H 1 1.710 0.003 . . . . . A 46 LEU HB2 . 18844 1 517 . 1 1 46 46 LEU HB3 H 1 1.552 0.004 . . . . . A 46 LEU HB3 . 18844 1 518 . 1 1 46 46 LEU HG H 1 1.573 0.004 . . . . . A 46 LEU HG . 18844 1 519 . 1 1 46 46 LEU HD11 H 1 0.859 0.004 . . . . . A 46 LEU HD11 . 18844 1 520 . 1 1 46 46 LEU HD12 H 1 0.859 0.004 . . . . . A 46 LEU HD12 . 18844 1 521 . 1 1 46 46 LEU HD13 H 1 0.859 0.004 . . . . . A 46 LEU HD13 . 18844 1 522 . 1 1 46 46 LEU HD21 H 1 0.791 0.005 . . . . . A 46 LEU HD21 . 18844 1 523 . 1 1 46 46 LEU HD22 H 1 0.791 0.005 . . . . . A 46 LEU HD22 . 18844 1 524 . 1 1 46 46 LEU HD23 H 1 0.791 0.005 . . . . . A 46 LEU HD23 . 18844 1 525 . 1 1 46 46 LEU CA C 13 55.759 0.047 . . . . . A 46 LEU CA . 18844 1 526 . 1 1 46 46 LEU CB C 13 42.526 0.040 . . . . . A 46 LEU CB . 18844 1 527 . 1 1 46 46 LEU CG C 13 27.850 0.001 . . . . . A 46 LEU CG . 18844 1 528 . 1 1 46 46 LEU CD1 C 13 25.437 0.024 . . . . . A 46 LEU CD1 . 18844 1 529 . 1 1 46 46 LEU CD2 C 13 23.705 0.014 . . . . . A 46 LEU CD2 . 18844 1 530 . 1 1 46 46 LEU N N 15 124.709 0.038 . . . . . A 46 LEU N . 18844 1 531 . 1 1 47 47 GLY H H 1 8.300 0.003 . . . . . A 47 GLY H . 18844 1 532 . 1 1 47 47 GLY HA2 H 1 4.167 0.003 . . . . . A 47 GLY HA2 . 18844 1 533 . 1 1 47 47 GLY HA3 H 1 3.651 0.006 . . . . . A 47 GLY HA3 . 18844 1 534 . 1 1 47 47 GLY CA C 13 45.560 0.097 . . . . . A 47 GLY CA . 18844 1 535 . 1 1 47 47 GLY N N 15 109.276 0.036 . . . . . A 47 GLY N . 18844 1 536 . 1 1 48 48 LEU H H 1 7.581 0.002 . . . . . A 48 LEU H . 18844 1 537 . 1 1 48 48 LEU HA H 1 4.590 0.006 . . . . . A 48 LEU HA . 18844 1 538 . 1 1 48 48 LEU HB2 H 1 1.791 0.004 . . . . . A 48 LEU HB2 . 18844 1 539 . 1 1 48 48 LEU HB3 H 1 1.222 0.009 . . . . . A 48 LEU HB3 . 18844 1 540 . 1 1 48 48 LEU HG H 1 1.424 0.007 . . . . . A 48 LEU HG . 18844 1 541 . 1 1 48 48 LEU HD11 H 1 0.731 0.002 . . . . . A 48 LEU HD11 . 18844 1 542 . 1 1 48 48 LEU HD12 H 1 0.731 0.002 . . . . . A 48 LEU HD12 . 18844 1 543 . 1 1 48 48 LEU HD13 H 1 0.731 0.002 . . . . . A 48 LEU HD13 . 18844 1 544 . 1 1 48 48 LEU HD21 H 1 0.743 0.006 . . . . . A 48 LEU HD21 . 18844 1 545 . 1 1 48 48 LEU HD22 H 1 0.743 0.006 . . . . . A 48 LEU HD22 . 18844 1 546 . 1 1 48 48 LEU HD23 H 1 0.743 0.006 . . . . . A 48 LEU HD23 . 18844 1 547 . 1 1 48 48 LEU CA C 13 53.945 0.045 . . . . . A 48 LEU CA . 18844 1 548 . 1 1 48 48 LEU CB C 13 41.414 0.046 . . . . . A 48 LEU CB . 18844 1 549 . 1 1 48 48 LEU CG C 13 26.780 0.050 . . . . . A 48 LEU CG . 18844 1 550 . 1 1 48 48 LEU CD1 C 13 26.385 0.024 . . . . . A 48 LEU CD1 . 18844 1 551 . 1 1 48 48 LEU CD2 C 13 24.095 0.083 . . . . . A 48 LEU CD2 . 18844 1 552 . 1 1 48 48 LEU N N 15 119.707 0.035 . . . . . A 48 LEU N . 18844 1 553 . 1 1 49 49 LYS H H 1 8.606 0.008 . . . . . A 49 LYS H . 18844 1 554 . 1 1 49 49 LYS HA H 1 4.852 0.004 . . . . . A 49 LYS HA . 18844 1 555 . 1 1 49 49 LYS HB2 H 1 1.543 0.005 . . . . . A 49 LYS HB2 . 18844 1 556 . 1 1 49 49 LYS HB3 H 1 1.318 0.006 . . . . . A 49 LYS HB3 . 18844 1 557 . 1 1 49 49 LYS HG2 H 1 1.117 0.004 . . . . . A 49 LYS HG2 . 18844 1 558 . 1 1 49 49 LYS HG3 H 1 0.929 0.006 . . . . . A 49 LYS HG3 . 18844 1 559 . 1 1 49 49 LYS HD2 H 1 1.373 0.004 . . . . . A 49 LYS HD2 . 18844 1 560 . 1 1 49 49 LYS HD3 H 1 1.373 0.004 . . . . . A 49 LYS HD3 . 18844 1 561 . 1 1 49 49 LYS HE2 H 1 2.761 0.002 . . . . . A 49 LYS HE2 . 18844 1 562 . 1 1 49 49 LYS CA C 13 55.663 0.045 . . . . . A 49 LYS CA . 18844 1 563 . 1 1 49 49 LYS CB C 13 37.581 0.035 . . . . . A 49 LYS CB . 18844 1 564 . 1 1 49 49 LYS CG C 13 25.451 0.005 . . . . . A 49 LYS CG . 18844 1 565 . 1 1 49 49 LYS CD C 13 29.855 0.017 . . . . . A 49 LYS CD . 18844 1 566 . 1 1 49 49 LYS N N 15 124.527 0.045 . . . . . A 49 LYS N . 18844 1 567 . 1 1 50 50 VAL H H 1 8.799 0.003 . . . . . A 50 VAL H . 18844 1 568 . 1 1 50 50 VAL HA H 1 4.113 0.005 . . . . . A 50 VAL HA . 18844 1 569 . 1 1 50 50 VAL HB H 1 1.882 0.005 . . . . . A 50 VAL HB . 18844 1 570 . 1 1 50 50 VAL HG21 H 1 0.862 0.004 . . . . . A 50 VAL HG21 . 18844 1 571 . 1 1 50 50 VAL HG22 H 1 0.862 0.004 . . . . . A 50 VAL HG22 . 18844 1 572 . 1 1 50 50 VAL HG23 H 1 0.862 0.004 . . . . . A 50 VAL HG23 . 18844 1 573 . 1 1 50 50 VAL CA C 13 61.865 0.038 . . . . . A 50 VAL CA . 18844 1 574 . 1 1 50 50 VAL CB C 13 34.734 0.063 . . . . . A 50 VAL CB . 18844 1 575 . 1 1 50 50 VAL CG2 C 13 21.316 0.009 . . . . . A 50 VAL CG2 . 18844 1 576 . 1 1 50 50 VAL N N 15 119.184 0.036 . . . . . A 50 VAL N . 18844 1 577 . 1 1 51 51 LYS H H 1 9.451 0.009 . . . . . A 51 LYS H . 18844 1 578 . 1 1 51 51 LYS HA H 1 3.824 0.005 . . . . . A 51 LYS HA . 18844 1 579 . 1 1 51 51 LYS HB2 H 1 1.932 0.006 . . . . . A 51 LYS HB2 . 18844 1 580 . 1 1 51 51 LYS HB3 H 1 1.748 0.005 . . . . . A 51 LYS HB3 . 18844 1 581 . 1 1 51 51 LYS HG2 H 1 1.373 0.002 . . . . . A 51 LYS HG2 . 18844 1 582 . 1 1 51 51 LYS HG3 H 1 1.373 0.002 . . . . . A 51 LYS HG3 . 18844 1 583 . 1 1 51 51 LYS HD2 H 1 1.642 0.002 . . . . . A 51 LYS HD2 . 18844 1 584 . 1 1 51 51 LYS HD3 H 1 1.642 0.002 . . . . . A 51 LYS HD3 . 18844 1 585 . 1 1 51 51 LYS HE2 H 1 2.907 0.005 . . . . . A 51 LYS HE2 . 18844 1 586 . 1 1 51 51 LYS CA C 13 57.407 0.044 . . . . . A 51 LYS CA . 18844 1 587 . 1 1 51 51 LYS CB C 13 30.655 0.022 . . . . . A 51 LYS CB . 18844 1 588 . 1 1 51 51 LYS CG C 13 25.703 0.023 . . . . . A 51 LYS CG . 18844 1 589 . 1 1 51 51 LYS CD C 13 29.363 0.035 . . . . . A 51 LYS CD . 18844 1 590 . 1 1 51 51 LYS N N 15 127.069 0.143 . . . . . A 51 LYS N . 18844 1 591 . 1 1 52 52 GLY H H 1 8.512 0.009 . . . . . A 52 GLY H . 18844 1 592 . 1 1 52 52 GLY HA2 H 1 4.096 0.006 . . . . . A 52 GLY HA2 . 18844 1 593 . 1 1 52 52 GLY HA3 H 1 3.498 0.006 . . . . . A 52 GLY HA3 . 18844 1 594 . 1 1 52 52 GLY CA C 13 45.810 0.011 . . . . . A 52 GLY CA . 18844 1 595 . 1 1 52 52 GLY N N 15 102.671 0.051 . . . . . A 52 GLY N . 18844 1 596 . 1 1 53 53 LYS H H 1 7.781 0.004 . . . . . A 53 LYS H . 18844 1 597 . 1 1 53 53 LYS HA H 1 4.829 0.005 . . . . . A 53 LYS HA . 18844 1 598 . 1 1 53 53 LYS HB2 H 1 1.808 0.005 . . . . . A 53 LYS HB2 . 18844 1 599 . 1 1 53 53 LYS HB3 H 1 1.654 0.004 . . . . . A 53 LYS HB3 . 18844 1 600 . 1 1 53 53 LYS HG2 H 1 1.415 0.007 . . . . . A 53 LYS HG2 . 18844 1 601 . 1 1 53 53 LYS HG3 H 1 1.364 0.004 . . . . . A 53 LYS HG3 . 18844 1 602 . 1 1 53 53 LYS HD2 H 1 1.643 0.004 . . . . . A 53 LYS HD2 . 18844 1 603 . 1 1 53 53 LYS HD3 H 1 1.643 0.004 . . . . . A 53 LYS HD3 . 18844 1 604 . 1 1 53 53 LYS HE2 H 1 2.944 0.002 . . . . . A 53 LYS HE2 . 18844 1 605 . 1 1 53 53 LYS CA C 13 53.616 0.014 . . . . . A 53 LYS CA . 18844 1 606 . 1 1 53 53 LYS CB C 13 33.940 0.020 . . . . . A 53 LYS CB . 18844 1 607 . 1 1 53 53 LYS CG C 13 24.975 0.035 . . . . . A 53 LYS CG . 18844 1 608 . 1 1 53 53 LYS CD C 13 29.251 0.024 . . . . . A 53 LYS CD . 18844 1 609 . 1 1 53 53 LYS N N 15 121.307 0.026 . . . . . A 53 LYS N . 18844 1 610 . 1 1 54 54 PRO HA H 1 4.376 0.004 . . . . . A 54 PRO HA . 18844 1 611 . 1 1 54 54 PRO HB2 H 1 1.799 0.006 . . . . . A 54 PRO HB2 . 18844 1 612 . 1 1 54 54 PRO HB3 H 1 2.329 0.006 . . . . . A 54 PRO HB3 . 18844 1 613 . 1 1 54 54 PRO HG2 H 1 2.111 0.006 . . . . . A 54 PRO HG2 . 18844 1 614 . 1 1 54 54 PRO HG3 H 1 1.911 0.002 . . . . . A 54 PRO HG3 . 18844 1 615 . 1 1 54 54 PRO HD2 H 1 3.831 0.004 . . . . . A 54 PRO HD2 . 18844 1 616 . 1 1 54 54 PRO HD3 H 1 3.540 0.006 . . . . . A 54 PRO HD3 . 18844 1 617 . 1 1 54 54 PRO CA C 13 63.817 0.017 . . . . . A 54 PRO CA . 18844 1 618 . 1 1 54 54 PRO CB C 13 32.151 0.031 . . . . . A 54 PRO CB . 18844 1 619 . 1 1 54 54 PRO CG C 13 28.450 0.030 . . . . . A 54 PRO CG . 18844 1 620 . 1 1 54 54 PRO CD C 13 50.874 0.016 . . . . . A 54 PRO CD . 18844 1 621 . 1 1 55 55 ALA H H 1 8.114 0.003 . . . . . A 55 ALA H . 18844 1 622 . 1 1 55 55 ALA HA H 1 4.138 0.004 . . . . . A 55 ALA HA . 18844 1 623 . 1 1 55 55 ALA HB1 H 1 1.107 0.004 . . . . . A 55 ALA HB1 . 18844 1 624 . 1 1 55 55 ALA HB2 H 1 1.107 0.004 . . . . . A 55 ALA HB2 . 18844 1 625 . 1 1 55 55 ALA HB3 H 1 1.107 0.004 . . . . . A 55 ALA HB3 . 18844 1 626 . 1 1 55 55 ALA CA C 13 52.664 0.031 . . . . . A 55 ALA CA . 18844 1 627 . 1 1 55 55 ALA CB C 13 20.044 0.023 . . . . . A 55 ALA CB . 18844 1 628 . 1 1 55 55 ALA N N 15 125.654 0.028 . . . . . A 55 ALA N . 18844 1 629 . 1 1 56 56 GLU H H 1 8.179 0.004 . . . . . A 56 GLU H . 18844 1 630 . 1 1 56 56 GLU HA H 1 4.215 0.005 . . . . . A 56 GLU HA . 18844 1 631 . 1 1 56 56 GLU HB2 H 1 2.264 0.008 . . . . . A 56 GLU HB2 . 18844 1 632 . 1 1 56 56 GLU HB3 H 1 1.911 0.005 . . . . . A 56 GLU HB3 . 18844 1 633 . 1 1 56 56 GLU HG2 H 1 2.372 0.003 . . . . . A 56 GLU HG2 . 18844 1 634 . 1 1 56 56 GLU HG3 H 1 2.288 0.005 . . . . . A 56 GLU HG3 . 18844 1 635 . 1 1 56 56 GLU CA C 13 56.089 0.020 . . . . . A 56 GLU CA . 18844 1 636 . 1 1 56 56 GLU CB C 13 31.086 0.024 . . . . . A 56 GLU CB . 18844 1 637 . 1 1 56 56 GLU CG C 13 36.809 0.010 . . . . . A 56 GLU CG . 18844 1 638 . 1 1 56 56 GLU N N 15 122.313 0.037 . . . . . A 56 GLU N . 18844 1 639 . 1 1 57 57 ASN H H 1 8.504 0.003 . . . . . A 57 ASN H . 18844 1 640 . 1 1 57 57 ASN HA H 1 4.229 0.004 . . . . . A 57 ASN HA . 18844 1 641 . 1 1 57 57 ASN HB2 H 1 2.792 0.005 . . . . . A 57 ASN HB2 . 18844 1 642 . 1 1 57 57 ASN HB3 H 1 2.631 0.010 . . . . . A 57 ASN HB3 . 18844 1 643 . 1 1 57 57 ASN CA C 13 55.199 0.021 . . . . . A 57 ASN CA . 18844 1 644 . 1 1 57 57 ASN CB C 13 39.227 0.021 . . . . . A 57 ASN CB . 18844 1 645 . 1 1 57 57 ASN N N 15 115.140 0.048 . . . . . A 57 ASN N . 18844 1 646 . 1 1 58 58 ASP H H 1 8.198 0.005 . . . . . A 58 ASP H . 18844 1 647 . 1 1 58 58 ASP HA H 1 4.488 0.004 . . . . . A 58 ASP HA . 18844 1 648 . 1 1 58 58 ASP HB2 H 1 2.741 0.003 . . . . . A 58 ASP HB2 . 18844 1 649 . 1 1 58 58 ASP HB3 H 1 2.522 0.003 . . . . . A 58 ASP HB3 . 18844 1 650 . 1 1 58 58 ASP CA C 13 53.608 0.047 . . . . . A 58 ASP CA . 18844 1 651 . 1 1 58 58 ASP CB C 13 40.304 0.060 . . . . . A 58 ASP CB . 18844 1 652 . 1 1 58 58 ASP N N 15 112.832 0.035 . . . . . A 58 ASP N . 18844 1 653 . 1 1 59 59 VAL H H 1 7.353 0.003 . . . . . A 59 VAL H . 18844 1 654 . 1 1 59 59 VAL HA H 1 3.593 0.009 . . . . . A 59 VAL HA . 18844 1 655 . 1 1 59 59 VAL HB H 1 2.024 0.005 . . . . . A 59 VAL HB . 18844 1 656 . 1 1 59 59 VAL HG11 H 1 0.975 0.002 . . . . . A 59 VAL HG11 . 18844 1 657 . 1 1 59 59 VAL HG12 H 1 0.975 0.002 . . . . . A 59 VAL HG12 . 18844 1 658 . 1 1 59 59 VAL HG13 H 1 0.975 0.002 . . . . . A 59 VAL HG13 . 18844 1 659 . 1 1 59 59 VAL HG21 H 1 0.866 0.005 . . . . . A 59 VAL HG21 . 18844 1 660 . 1 1 59 59 VAL HG22 H 1 0.866 0.005 . . . . . A 59 VAL HG22 . 18844 1 661 . 1 1 59 59 VAL HG23 H 1 0.866 0.005 . . . . . A 59 VAL HG23 . 18844 1 662 . 1 1 59 59 VAL CA C 13 63.840 0.017 . . . . . A 59 VAL CA . 18844 1 663 . 1 1 59 59 VAL CB C 13 32.322 0.084 . . . . . A 59 VAL CB . 18844 1 664 . 1 1 59 59 VAL CG1 C 13 24.794 0.008 . . . . . A 59 VAL CG1 . 18844 1 665 . 1 1 59 59 VAL CG2 C 13 21.657 0.009 . . . . . A 59 VAL CG2 . 18844 1 666 . 1 1 59 59 VAL N N 15 122.073 0.032 . . . . . A 59 VAL N . 18844 1 667 . 1 1 60 60 LYS H H 1 8.339 0.003 . . . . . A 60 LYS H . 18844 1 668 . 1 1 60 60 LYS HA H 1 4.447 0.006 . . . . . A 60 LYS HA . 18844 1 669 . 1 1 60 60 LYS HB2 H 1 2.066 0.006 . . . . . A 60 LYS HB2 . 18844 1 670 . 1 1 60 60 LYS HB3 H 1 1.694 0.005 . . . . . A 60 LYS HB3 . 18844 1 671 . 1 1 60 60 LYS HG2 H 1 1.540 0.010 . . . . . A 60 LYS HG2 . 18844 1 672 . 1 1 60 60 LYS HG3 H 1 1.317 0.008 . . . . . A 60 LYS HG3 . 18844 1 673 . 1 1 60 60 LYS HD2 H 1 1.626 0.007 . . . . . A 60 LYS HD2 . 18844 1 674 . 1 1 60 60 LYS HD3 H 1 1.626 0.007 . . . . . A 60 LYS HD3 . 18844 1 675 . 1 1 60 60 LYS HE2 H 1 2.962 0.004 . . . . . A 60 LYS HE2 . 18844 1 676 . 1 1 60 60 LYS CA C 13 56.185 0.028 . . . . . A 60 LYS CA . 18844 1 677 . 1 1 60 60 LYS CB C 13 33.105 0.043 . . . . . A 60 LYS CB . 18844 1 678 . 1 1 60 60 LYS CG C 13 26.283 0.017 . . . . . A 60 LYS CG . 18844 1 679 . 1 1 60 60 LYS CD C 13 29.890 0.000 . . . . . A 60 LYS CD . 18844 1 680 . 1 1 60 60 LYS N N 15 125.064 0.027 . . . . . A 60 LYS N . 18844 1 681 . 1 1 61 61 LEU H H 1 9.423 0.006 . . . . . A 61 LEU H . 18844 1 682 . 1 1 61 61 LEU HA H 1 3.776 0.007 . . . . . A 61 LEU HA . 18844 1 683 . 1 1 61 61 LEU HB2 H 1 1.754 0.006 . . . . . A 61 LEU HB2 . 18844 1 684 . 1 1 61 61 LEU HB3 H 1 1.044 0.004 . . . . . A 61 LEU HB3 . 18844 1 685 . 1 1 61 61 LEU HG H 1 1.392 0.006 . . . . . A 61 LEU HG . 18844 1 686 . 1 1 61 61 LEU HD11 H 1 0.683 0.004 . . . . . A 61 LEU HD11 . 18844 1 687 . 1 1 61 61 LEU HD12 H 1 0.683 0.004 . . . . . A 61 LEU HD12 . 18844 1 688 . 1 1 61 61 LEU HD13 H 1 0.683 0.004 . . . . . A 61 LEU HD13 . 18844 1 689 . 1 1 61 61 LEU HD21 H 1 0.509 0.005 . . . . . A 61 LEU HD21 . 18844 1 690 . 1 1 61 61 LEU HD22 H 1 0.509 0.005 . . . . . A 61 LEU HD22 . 18844 1 691 . 1 1 61 61 LEU HD23 H 1 0.509 0.005 . . . . . A 61 LEU HD23 . 18844 1 692 . 1 1 61 61 LEU CA C 13 57.987 0.018 . . . . . A 61 LEU CA . 18844 1 693 . 1 1 61 61 LEU CB C 13 40.832 0.040 . . . . . A 61 LEU CB . 18844 1 694 . 1 1 61 61 LEU CG C 13 27.807 0.014 . . . . . A 61 LEU CG . 18844 1 695 . 1 1 61 61 LEU CD1 C 13 26.090 0.001 . . . . . A 61 LEU CD1 . 18844 1 696 . 1 1 61 61 LEU CD2 C 13 22.557 0.015 . . . . . A 61 LEU CD2 . 18844 1 697 . 1 1 61 61 LEU N N 15 121.612 0.031 . . . . . A 61 LEU N . 18844 1 698 . 1 1 62 62 GLY H H 1 9.107 0.009 . . . . . A 62 GLY H . 18844 1 699 . 1 1 62 62 GLY HA2 H 1 3.994 0.005 . . . . . A 62 GLY HA2 . 18844 1 700 . 1 1 62 62 GLY HA3 H 1 3.865 0.005 . . . . . A 62 GLY HA3 . 18844 1 701 . 1 1 62 62 GLY CA C 13 46.772 0.026 . . . . . A 62 GLY CA . 18844 1 702 . 1 1 62 62 GLY N N 15 104.008 0.036 . . . . . A 62 GLY N . 18844 1 703 . 1 1 63 63 ALA H H 1 7.755 0.008 . . . . . A 63 ALA H . 18844 1 704 . 1 1 63 63 ALA HA H 1 4.273 0.006 . . . . . A 63 ALA HA . 18844 1 705 . 1 1 63 63 ALA HB1 H 1 1.471 0.006 . . . . . A 63 ALA HB1 . 18844 1 706 . 1 1 63 63 ALA HB2 H 1 1.471 0.006 . . . . . A 63 ALA HB2 . 18844 1 707 . 1 1 63 63 ALA HB3 H 1 1.471 0.006 . . . . . A 63 ALA HB3 . 18844 1 708 . 1 1 63 63 ALA CA C 13 53.421 0.034 . . . . . A 63 ALA CA . 18844 1 709 . 1 1 63 63 ALA CB C 13 18.816 0.019 . . . . . A 63 ALA CB . 18844 1 710 . 1 1 63 63 ALA N N 15 122.025 0.031 . . . . . A 63 ALA N . 18844 1 711 . 1 1 64 64 LEU H H 1 7.214 0.006 . . . . . A 64 LEU H . 18844 1 712 . 1 1 64 64 LEU HA H 1 4.068 0.006 . . . . . A 64 LEU HA . 18844 1 713 . 1 1 64 64 LEU HB2 H 1 1.492 0.004 . . . . . A 64 LEU HB2 . 18844 1 714 . 1 1 64 64 LEU HB3 H 1 1.862 0.005 . . . . . A 64 LEU HB3 . 18844 1 715 . 1 1 64 64 LEU HG H 1 1.646 0.006 . . . . . A 64 LEU HG . 18844 1 716 . 1 1 64 64 LEU HD11 H 1 0.744 0.003 . . . . . A 64 LEU HD11 . 18844 1 717 . 1 1 64 64 LEU HD12 H 1 0.744 0.003 . . . . . A 64 LEU HD12 . 18844 1 718 . 1 1 64 64 LEU HD13 H 1 0.744 0.003 . . . . . A 64 LEU HD13 . 18844 1 719 . 1 1 64 64 LEU HD21 H 1 0.594 0.005 . . . . . A 64 LEU HD21 . 18844 1 720 . 1 1 64 64 LEU HD22 H 1 0.594 0.005 . . . . . A 64 LEU HD22 . 18844 1 721 . 1 1 64 64 LEU HD23 H 1 0.594 0.005 . . . . . A 64 LEU HD23 . 18844 1 722 . 1 1 64 64 LEU CA C 13 55.567 0.021 . . . . . A 64 LEU CA . 18844 1 723 . 1 1 64 64 LEU CB C 13 42.136 0.048 . . . . . A 64 LEU CB . 18844 1 724 . 1 1 64 64 LEU CG C 13 26.740 0.001 . . . . . A 64 LEU CG . 18844 1 725 . 1 1 64 64 LEU CD1 C 13 27.496 0.014 . . . . . A 64 LEU CD1 . 18844 1 726 . 1 1 64 64 LEU CD2 C 13 23.924 0.035 . . . . . A 64 LEU CD2 . 18844 1 727 . 1 1 64 64 LEU N N 15 115.454 0.049 . . . . . A 64 LEU N . 18844 1 728 . 1 1 65 65 LYS H H 1 7.642 0.009 . . . . . A 65 LYS H . 18844 1 729 . 1 1 65 65 LYS HA H 1 3.838 0.004 . . . . . A 65 LYS HA . 18844 1 730 . 1 1 65 65 LYS HB2 H 1 1.917 0.007 . . . . . A 65 LYS HB2 . 18844 1 731 . 1 1 65 65 LYS HB3 H 1 1.745 0.003 . . . . . A 65 LYS HB3 . 18844 1 732 . 1 1 65 65 LYS HG2 H 1 1.320 0.005 . . . . . A 65 LYS HG2 . 18844 1 733 . 1 1 65 65 LYS HG3 H 1 1.248 0.015 . . . . . A 65 LYS HG3 . 18844 1 734 . 1 1 65 65 LYS HD2 H 1 1.637 0.005 . . . . . A 65 LYS HD2 . 18844 1 735 . 1 1 65 65 LYS HD3 H 1 1.596 0.002 . . . . . A 65 LYS HD3 . 18844 1 736 . 1 1 65 65 LYS HE2 H 1 2.927 0.005 . . . . . A 65 LYS HE2 . 18844 1 737 . 1 1 65 65 LYS CA C 13 56.737 0.048 . . . . . A 65 LYS CA . 18844 1 738 . 1 1 65 65 LYS CB C 13 29.307 0.027 . . . . . A 65 LYS CB . 18844 1 739 . 1 1 65 65 LYS CG C 13 25.112 0.009 . . . . . A 65 LYS CG . 18844 1 740 . 1 1 65 65 LYS CD C 13 29.560 0.010 . . . . . A 65 LYS CD . 18844 1 741 . 1 1 65 65 LYS N N 15 114.830 0.075 . . . . . A 65 LYS N . 18844 1 742 . 1 1 66 66 LEU H H 1 8.516 0.007 . . . . . A 66 LEU H . 18844 1 743 . 1 1 66 66 LEU HA H 1 4.163 0.004 . . . . . A 66 LEU HA . 18844 1 744 . 1 1 66 66 LEU HB2 H 1 1.580 0.006 . . . . . A 66 LEU HB2 . 18844 1 745 . 1 1 66 66 LEU HB3 H 1 1.229 0.005 . . . . . A 66 LEU HB3 . 18844 1 746 . 1 1 66 66 LEU HG H 1 1.517 0.004 . . . . . A 66 LEU HG . 18844 1 747 . 1 1 66 66 LEU HD11 H 1 0.729 0.003 . . . . . A 66 LEU HD11 . 18844 1 748 . 1 1 66 66 LEU HD12 H 1 0.729 0.003 . . . . . A 66 LEU HD12 . 18844 1 749 . 1 1 66 66 LEU HD13 H 1 0.729 0.003 . . . . . A 66 LEU HD13 . 18844 1 750 . 1 1 66 66 LEU HD21 H 1 0.748 0.009 . . . . . A 66 LEU HD21 . 18844 1 751 . 1 1 66 66 LEU HD22 H 1 0.748 0.009 . . . . . A 66 LEU HD22 . 18844 1 752 . 1 1 66 66 LEU HD23 H 1 0.748 0.009 . . . . . A 66 LEU HD23 . 18844 1 753 . 1 1 66 66 LEU CA C 13 54.847 0.027 . . . . . A 66 LEU CA . 18844 1 754 . 1 1 66 66 LEU CB C 13 42.712 0.033 . . . . . A 66 LEU CB . 18844 1 755 . 1 1 66 66 LEU CG C 13 26.925 0.019 . . . . . A 66 LEU CG . 18844 1 756 . 1 1 66 66 LEU CD1 C 13 25.611 0.020 . . . . . A 66 LEU CD1 . 18844 1 757 . 1 1 66 66 LEU CD2 C 13 23.347 0.058 . . . . . A 66 LEU CD2 . 18844 1 758 . 1 1 66 66 LEU N N 15 119.305 0.023 . . . . . A 66 LEU N . 18844 1 759 . 1 1 67 67 LYS H H 1 7.955 0.008 . . . . . A 67 LYS H . 18844 1 760 . 1 1 67 67 LYS HA H 1 4.497 0.006 . . . . . A 67 LYS HA . 18844 1 761 . 1 1 67 67 LYS HB2 H 1 1.720 0.008 . . . . . A 67 LYS HB2 . 18844 1 762 . 1 1 67 67 LYS HB3 H 1 1.537 0.004 . . . . . A 67 LYS HB3 . 18844 1 763 . 1 1 67 67 LYS HG2 H 1 1.522 0.002 . . . . . A 67 LYS HG2 . 18844 1 764 . 1 1 67 67 LYS HG3 H 1 1.426 0.002 . . . . . A 67 LYS HG3 . 18844 1 765 . 1 1 67 67 LYS HE2 H 1 2.936 0.002 . . . . . A 67 LYS HE2 . 18844 1 766 . 1 1 67 67 LYS CA C 13 54.152 0.026 . . . . . A 67 LYS CA . 18844 1 767 . 1 1 67 67 LYS CB C 13 31.999 0.009 . . . . . A 67 LYS CB . 18844 1 768 . 1 1 67 67 LYS CG C 13 25.343 0.013 . . . . . A 67 LYS CG . 18844 1 769 . 1 1 67 67 LYS N N 15 121.480 0.057 . . . . . A 67 LYS N . 18844 1 770 . 1 1 68 68 PRO HA H 1 4.169 0.004 . . . . . A 68 PRO HA . 18844 1 771 . 1 1 68 68 PRO HB2 H 1 1.796 0.005 . . . . . A 68 PRO HB2 . 18844 1 772 . 1 1 68 68 PRO HB3 H 1 2.184 0.004 . . . . . A 68 PRO HB3 . 18844 1 773 . 1 1 68 68 PRO HG2 H 1 2.075 0.005 . . . . . A 68 PRO HG2 . 18844 1 774 . 1 1 68 68 PRO HG3 H 1 1.956 0.002 . . . . . A 68 PRO HG3 . 18844 1 775 . 1 1 68 68 PRO HD2 H 1 3.774 0.004 . . . . . A 68 PRO HD2 . 18844 1 776 . 1 1 68 68 PRO HD3 H 1 3.544 0.011 . . . . . A 68 PRO HD3 . 18844 1 777 . 1 1 68 68 PRO CA C 13 64.389 0.040 . . . . . A 68 PRO CA . 18844 1 778 . 1 1 68 68 PRO CB C 13 32.214 0.030 . . . . . A 68 PRO CB . 18844 1 779 . 1 1 68 68 PRO CG C 13 28.240 0.000 . . . . . A 68 PRO CG . 18844 1 780 . 1 1 68 68 PRO CD C 13 50.767 0.019 . . . . . A 68 PRO CD . 18844 1 781 . 1 1 69 69 ASN H H 1 8.966 0.010 . . . . . A 69 ASN H . 18844 1 782 . 1 1 69 69 ASN HA H 1 3.962 0.009 . . . . . A 69 ASN HA . 18844 1 783 . 1 1 69 69 ASN HB2 H 1 2.869 0.003 . . . . . A 69 ASN HB2 . 18844 1 784 . 1 1 69 69 ASN HB3 H 1 2.791 0.004 . . . . . A 69 ASN HB3 . 18844 1 785 . 1 1 69 69 ASN CA C 13 55.021 0.039 . . . . . A 69 ASN CA . 18844 1 786 . 1 1 69 69 ASN CB C 13 37.047 0.032 . . . . . A 69 ASN CB . 18844 1 787 . 1 1 69 69 ASN N N 15 115.414 0.020 . . . . . A 69 ASN N . 18844 1 788 . 1 1 70 70 THR H H 1 7.712 0.004 . . . . . A 70 THR H . 18844 1 789 . 1 1 70 70 THR HA H 1 3.949 0.006 . . . . . A 70 THR HA . 18844 1 790 . 1 1 70 70 THR HB H 1 3.988 0.005 . . . . . A 70 THR HB . 18844 1 791 . 1 1 70 70 THR HG21 H 1 1.141 0.004 . . . . . A 70 THR HG21 . 18844 1 792 . 1 1 70 70 THR HG22 H 1 1.141 0.004 . . . . . A 70 THR HG22 . 18844 1 793 . 1 1 70 70 THR HG23 H 1 1.141 0.004 . . . . . A 70 THR HG23 . 18844 1 794 . 1 1 70 70 THR CA C 13 65.247 0.042 . . . . . A 70 THR CA . 18844 1 795 . 1 1 70 70 THR CB C 13 70.132 0.091 . . . . . A 70 THR CB . 18844 1 796 . 1 1 70 70 THR CG2 C 13 21.760 0.001 . . . . . A 70 THR CG2 . 18844 1 797 . 1 1 70 70 THR N N 15 115.426 0.034 . . . . . A 70 THR N . 18844 1 798 . 1 1 71 71 LYS H H 1 8.284 0.007 . . . . . A 71 LYS H . 18844 1 799 . 1 1 71 71 LYS HA H 1 5.179 0.007 . . . . . A 71 LYS HA . 18844 1 800 . 1 1 71 71 LYS HB2 H 1 1.670 0.004 . . . . . A 71 LYS HB2 . 18844 1 801 . 1 1 71 71 LYS HB3 H 1 1.398 0.007 . . . . . A 71 LYS HB3 . 18844 1 802 . 1 1 71 71 LYS HG2 H 1 1.358 0.005 . . . . . A 71 LYS HG2 . 18844 1 803 . 1 1 71 71 LYS HG3 H 1 1.080 0.004 . . . . . A 71 LYS HG3 . 18844 1 804 . 1 1 71 71 LYS HD2 H 1 1.514 0.003 . . . . . A 71 LYS HD2 . 18844 1 805 . 1 1 71 71 LYS HD3 H 1 1.450 0.002 . . . . . A 71 LYS HD3 . 18844 1 806 . 1 1 71 71 LYS HE2 H 1 2.744 0.002 . . . . . A 71 LYS HE2 . 18844 1 807 . 1 1 71 71 LYS CA C 13 55.340 0.025 . . . . . A 71 LYS CA . 18844 1 808 . 1 1 71 71 LYS CB C 13 33.729 0.065 . . . . . A 71 LYS CB . 18844 1 809 . 1 1 71 71 LYS CG C 13 25.792 0.010 . . . . . A 71 LYS CG . 18844 1 810 . 1 1 71 71 LYS CD C 13 30.205 0.016 . . . . . A 71 LYS CD . 18844 1 811 . 1 1 71 71 LYS N N 15 124.603 0.036 . . . . . A 71 LYS N . 18844 1 812 . 1 1 72 72 ILE H H 1 9.142 0.006 . . . . . A 72 ILE H . 18844 1 813 . 1 1 72 72 ILE HA H 1 4.511 0.007 . . . . . A 72 ILE HA . 18844 1 814 . 1 1 72 72 ILE HB H 1 1.957 0.005 . . . . . A 72 ILE HB . 18844 1 815 . 1 1 72 72 ILE HG12 H 1 1.325 0.005 . . . . . A 72 ILE HG12 . 18844 1 816 . 1 1 72 72 ILE HG13 H 1 1.060 0.006 . . . . . A 72 ILE HG13 . 18844 1 817 . 1 1 72 72 ILE HG21 H 1 0.780 0.002 . . . . . A 72 ILE HG21 . 18844 1 818 . 1 1 72 72 ILE HG22 H 1 0.780 0.002 . . . . . A 72 ILE HG22 . 18844 1 819 . 1 1 72 72 ILE HG23 H 1 0.780 0.002 . . . . . A 72 ILE HG23 . 18844 1 820 . 1 1 72 72 ILE HD11 H 1 0.699 0.009 . . . . . A 72 ILE HD11 . 18844 1 821 . 1 1 72 72 ILE HD12 H 1 0.699 0.009 . . . . . A 72 ILE HD12 . 18844 1 822 . 1 1 72 72 ILE HD13 H 1 0.699 0.009 . . . . . A 72 ILE HD13 . 18844 1 823 . 1 1 72 72 ILE CA C 13 59.636 0.028 . . . . . A 72 ILE CA . 18844 1 824 . 1 1 72 72 ILE CB C 13 40.827 0.044 . . . . . A 72 ILE CB . 18844 1 825 . 1 1 72 72 ILE CG1 C 13 27.209 0.023 . . . . . A 72 ILE CG1 . 18844 1 826 . 1 1 72 72 ILE CG2 C 13 17.952 0.012 . . . . . A 72 ILE CG2 . 18844 1 827 . 1 1 72 72 ILE CD1 C 13 14.373 0.021 . . . . . A 72 ILE CD1 . 18844 1 828 . 1 1 72 72 ILE N N 15 123.505 0.061 . . . . . A 72 ILE N . 18844 1 829 . 1 1 73 73 MET H H 1 8.556 0.006 . . . . . A 73 MET H . 18844 1 830 . 1 1 73 73 MET HA H 1 5.122 0.004 . . . . . A 73 MET HA . 18844 1 831 . 1 1 73 73 MET HB2 H 1 2.009 0.006 . . . . . A 73 MET HB2 . 18844 1 832 . 1 1 73 73 MET HB3 H 1 2.009 0.006 . . . . . A 73 MET HB3 . 18844 1 833 . 1 1 73 73 MET HG2 H 1 2.584 0.003 . . . . . A 73 MET HG2 . 18844 1 834 . 1 1 73 73 MET HG3 H 1 2.487 0.002 . . . . . A 73 MET HG3 . 18844 1 835 . 1 1 73 73 MET CA C 13 54.949 0.049 . . . . . A 73 MET CA . 18844 1 836 . 1 1 73 73 MET CB C 13 35.143 0.039 . . . . . A 73 MET CB . 18844 1 837 . 1 1 73 73 MET CG C 13 32.963 0.000 . . . . . A 73 MET CG . 18844 1 838 . 1 1 73 73 MET N N 15 123.090 0.039 . . . . . A 73 MET N . 18844 1 839 . 1 1 74 74 MET H H 1 8.924 0.005 . . . . . A 74 MET H . 18844 1 840 . 1 1 74 74 MET HA H 1 5.288 0.010 . . . . . A 74 MET HA . 18844 1 841 . 1 1 74 74 MET HB2 H 1 1.908 0.006 . . . . . A 74 MET HB2 . 18844 1 842 . 1 1 74 74 MET HB3 H 1 1.532 0.006 . . . . . A 74 MET HB3 . 18844 1 843 . 1 1 74 74 MET HG2 H 1 2.260 0.002 . . . . . A 74 MET HG2 . 18844 1 844 . 1 1 74 74 MET HG3 H 1 2.087 0.007 . . . . . A 74 MET HG3 . 18844 1 845 . 1 1 74 74 MET CA C 13 54.862 0.046 . . . . . A 74 MET CA . 18844 1 846 . 1 1 74 74 MET CB C 13 36.294 0.029 . . . . . A 74 MET CB . 18844 1 847 . 1 1 74 74 MET CG C 13 33.265 0.025 . . . . . A 74 MET CG . 18844 1 848 . 1 1 74 74 MET N N 15 124.481 0.047 . . . . . A 74 MET N . 18844 1 849 . 1 1 75 75 MET H H 1 9.112 0.003 . . . . . A 75 MET H . 18844 1 850 . 1 1 75 75 MET HA H 1 5.093 0.006 . . . . . A 75 MET HA . 18844 1 851 . 1 1 75 75 MET HB2 H 1 2.180 0.009 . . . . . A 75 MET HB2 . 18844 1 852 . 1 1 75 75 MET HB3 H 1 1.934 0.004 . . . . . A 75 MET HB3 . 18844 1 853 . 1 1 75 75 MET HG2 H 1 2.583 0.001 . . . . . A 75 MET HG2 . 18844 1 854 . 1 1 75 75 MET HG3 H 1 2.512 0.002 . . . . . A 75 MET HG3 . 18844 1 855 . 1 1 75 75 MET CA C 13 54.265 0.062 . . . . . A 75 MET CA . 18844 1 856 . 1 1 75 75 MET CB C 13 35.566 0.039 . . . . . A 75 MET CB . 18844 1 857 . 1 1 75 75 MET CG C 13 32.629 0.002 . . . . . A 75 MET CG . 18844 1 858 . 1 1 75 75 MET N N 15 123.963 0.043 . . . . . A 75 MET N . 18844 1 859 . 1 1 76 76 GLY H H 1 8.711 0.004 . . . . . A 76 GLY H . 18844 1 860 . 1 1 76 76 GLY HA2 H 1 4.233 0.009 . . . . . A 76 GLY HA2 . 18844 1 861 . 1 1 76 76 GLY HA3 H 1 4.233 0.009 . . . . . A 76 GLY HA3 . 18844 1 862 . 1 1 76 76 GLY CA C 13 45.901 0.014 . . . . . A 76 GLY CA . 18844 1 863 . 1 1 76 76 GLY N N 15 109.773 0.024 . . . . . A 76 GLY N . 18844 1 864 . 1 1 77 77 THR H H 1 8.280 0.006 . . . . . A 77 THR H . 18844 1 865 . 1 1 77 77 THR HA H 1 4.787 0.003 . . . . . A 77 THR HA . 18844 1 866 . 1 1 77 77 THR HB H 1 4.207 0.004 . . . . . A 77 THR HB . 18844 1 867 . 1 1 77 77 THR HG21 H 1 1.207 0.003 . . . . . A 77 THR HG21 . 18844 1 868 . 1 1 77 77 THR HG22 H 1 1.207 0.003 . . . . . A 77 THR HG22 . 18844 1 869 . 1 1 77 77 THR HG23 H 1 1.207 0.003 . . . . . A 77 THR HG23 . 18844 1 870 . 1 1 77 77 THR CA C 13 60.728 0.022 . . . . . A 77 THR CA . 18844 1 871 . 1 1 77 77 THR CB C 13 71.481 0.067 . . . . . A 77 THR CB . 18844 1 872 . 1 1 77 77 THR CG2 C 13 22.167 0.005 . . . . . A 77 THR CG2 . 18844 1 873 . 1 1 77 77 THR N N 15 113.345 0.091 . . . . . A 77 THR N . 18844 1 874 . 1 1 78 78 ARG H H 1 8.852 0.004 . . . . . A 78 ARG H . 18844 1 875 . 1 1 78 78 ARG HA H 1 4.148 0.007 . . . . . A 78 ARG HA . 18844 1 876 . 1 1 78 78 ARG HB2 H 1 1.864 0.002 . . . . . A 78 ARG HB2 . 18844 1 877 . 1 1 78 78 ARG HB3 H 1 1.755 0.004 . . . . . A 78 ARG HB3 . 18844 1 878 . 1 1 78 78 ARG HG2 H 1 1.629 0.002 . . . . . A 78 ARG HG2 . 18844 1 879 . 1 1 78 78 ARG HG3 H 1 1.555 0.003 . . . . . A 78 ARG HG3 . 18844 1 880 . 1 1 78 78 ARG HD2 H 1 3.263 0.004 . . . . . A 78 ARG HD2 . 18844 1 881 . 1 1 78 78 ARG HD3 H 1 3.263 0.004 . . . . . A 78 ARG HD3 . 18844 1 882 . 1 1 78 78 ARG CA C 13 56.881 0.022 . . . . . A 78 ARG CA . 18844 1 883 . 1 1 78 78 ARG CB C 13 31.607 0.039 . . . . . A 78 ARG CB . 18844 1 884 . 1 1 78 78 ARG CG C 13 27.820 0.047 . . . . . A 78 ARG CG . 18844 1 885 . 1 1 78 78 ARG N N 15 122.844 0.066 . . . . . A 78 ARG N . 18844 1 886 . 1 1 79 79 GLU H H 1 8.300 0.003 . . . . . A 79 GLU H . 18844 1 887 . 1 1 79 79 GLU HA H 1 4.206 0.005 . . . . . A 79 GLU HA . 18844 1 888 . 1 1 79 79 GLU HB2 H 1 2.027 0.004 . . . . . A 79 GLU HB2 . 18844 1 889 . 1 1 79 79 GLU HB3 H 1 1.869 0.004 . . . . . A 79 GLU HB3 . 18844 1 890 . 1 1 79 79 GLU HG2 H 1 2.209 0.002 . . . . . A 79 GLU HG2 . 18844 1 891 . 1 1 79 79 GLU HG3 H 1 2.209 0.002 . . . . . A 79 GLU HG3 . 18844 1 892 . 1 1 79 79 GLU CA C 13 57.007 0.051 . . . . . A 79 GLU CA . 18844 1 893 . 1 1 79 79 GLU CB C 13 30.764 0.048 . . . . . A 79 GLU CB . 18844 1 894 . 1 1 79 79 GLU CG C 13 30.878 0.018 . . . . . A 79 GLU CG . 18844 1 895 . 1 1 79 79 GLU N N 15 122.181 0.073 . . . . . A 79 GLU N . 18844 1 896 . 1 1 80 80 GLU H H 1 8.015 0.005 . . . . . A 80 GLU H . 18844 1 897 . 1 1 80 80 GLU HA H 1 4.049 0.002 . . . . . A 80 GLU HA . 18844 1 898 . 1 1 80 80 GLU CA C 13 58.328 0.000 . . . . . A 80 GLU CA . 18844 1 899 . 1 1 80 80 GLU CB C 13 31.287 0.000 . . . . . A 80 GLU CB . 18844 1 900 . 1 1 80 80 GLU N N 15 126.965 0.071 . . . . . A 80 GLU N . 18844 1 stop_ save_