################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34864 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 34864 1 2 '2D 1H-13C HSQC' . . . 34864 1 3 '3D HNCACB' . . . 34864 1 4 '3D HN(COCA)CB' . . . 34864 1 5 '3D 1H-13C NOESY' . . . 34864 1 6 '3D 1H-15N NOESY' . . . 34864 1 7 '3D 1H-15N TOCSY' . . . 34864 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 SER HA H 1 4.268 0.005 . . . . . . A 2 SER HA . 34864 1 2 . 1 . 1 2 2 SER HB2 H 1 3.611 0.019 . . . . . . A 2 SER HB2 . 34864 1 3 . 1 . 1 2 2 SER HB3 H 1 3.677 0.016 . . . . . . A 2 SER HB3 . 34864 1 4 . 1 . 1 2 2 SER CA C 13 55.852 0.069 . . . . . . A 2 SER CA . 34864 1 5 . 1 . 1 2 2 SER CB C 13 61.525 0.024 . . . . . . A 2 SER CB . 34864 1 6 . 1 . 1 3 3 MET H H 1 8.378 0.003 . . . . . . A 3 MET H . 34864 1 7 . 1 . 1 3 3 MET HA H 1 4.366 0.003 . . . . . . A 3 MET HA . 34864 1 8 . 1 . 1 3 3 MET HB2 H 1 1.926 0.005 . . . . . . A 3 MET HB2 . 34864 1 9 . 1 . 1 3 3 MET HG2 H 1 2.483 0.009 . . . . . . A 3 MET HG2 . 34864 1 10 . 1 . 1 3 3 MET HG3 H 1 2.498 0.010 . . . . . . A 3 MET HG3 . 34864 1 11 . 1 . 1 3 3 MET CA C 13 53.379 0.057 . . . . . . A 3 MET CA . 34864 1 12 . 1 . 1 3 3 MET CB C 13 31.959 0.042 . . . . . . A 3 MET CB . 34864 1 13 . 1 . 1 3 3 MET CG C 13 29.204 0.048 . . . . . . A 3 MET CG . 34864 1 14 . 1 . 1 3 3 MET N N 15 123.359 0.027 . . . . . . A 3 MET N . 34864 1 15 . 1 . 1 4 4 LYS H H 1 8.738 0.004 . . . . . . A 4 LYS H . 34864 1 16 . 1 . 1 4 4 LYS HA H 1 4.530 0.006 . . . . . . A 4 LYS HA . 34864 1 17 . 1 . 1 4 4 LYS HB2 H 1 1.669 0.007 . . . . . . A 4 LYS HB2 . 34864 1 18 . 1 . 1 4 4 LYS HB3 H 1 2.102 0.005 . . . . . . A 4 LYS HB3 . 34864 1 19 . 1 . 1 4 4 LYS HG2 H 1 1.471 0.006 . . . . . . A 4 LYS HG2 . 34864 1 20 . 1 . 1 4 4 LYS HG3 H 1 1.566 0.013 . . . . . . A 4 LYS HG3 . 34864 1 21 . 1 . 1 4 4 LYS HE2 H 1 2.968 0.009 . . . . . . A 4 LYS HE2 . 34864 1 22 . 1 . 1 4 4 LYS CA C 13 53.183 0.036 . . . . . . A 4 LYS CA . 34864 1 23 . 1 . 1 4 4 LYS CB C 13 30.552 0.039 . . . . . . A 4 LYS CB . 34864 1 24 . 1 . 1 4 4 LYS CG C 13 22.512 0.058 . . . . . . A 4 LYS CG . 34864 1 25 . 1 . 1 4 4 LYS N N 15 124.941 0.033 . . . . . . A 4 LYS N . 34864 1 26 . 1 . 1 5 5 LYS H H 1 9.131 0.002 . . . . . . A 5 LYS H . 34864 1 27 . 1 . 1 5 5 LYS HA H 1 3.722 0.012 . . . . . . A 5 LYS HA . 34864 1 28 . 1 . 1 5 5 LYS HB2 H 1 1.838 0.006 . . . . . . A 5 LYS HB2 . 34864 1 29 . 1 . 1 5 5 LYS HB3 H 1 1.754 0.012 . . . . . . A 5 LYS HB3 . 34864 1 30 . 1 . 1 5 5 LYS HG2 H 1 1.382 0.021 . . . . . . A 5 LYS HG2 . 34864 1 31 . 1 . 1 5 5 LYS HG3 H 1 1.277 0.016 . . . . . . A 5 LYS HG3 . 34864 1 32 . 1 . 1 5 5 LYS HD2 H 1 1.656 0.011 . . . . . . A 5 LYS HD2 . 34864 1 33 . 1 . 1 5 5 LYS CA C 13 58.370 0.045 . . . . . . A 5 LYS CA . 34864 1 34 . 1 . 1 5 5 LYS CB C 13 29.367 0.014 . . . . . . A 5 LYS CB . 34864 1 35 . 1 . 1 5 5 LYS N N 15 124.368 0.013 . . . . . . A 5 LYS N . 34864 1 36 . 1 . 1 6 6 GLU H H 1 9.364 0.003 . . . . . . A 6 GLU H . 34864 1 37 . 1 . 1 6 6 GLU HA H 1 3.879 0.009 . . . . . . A 6 GLU HA . 34864 1 38 . 1 . 1 6 6 GLU HB2 H 1 1.970 0.009 . . . . . . A 6 GLU HB2 . 34864 1 39 . 1 . 1 6 6 GLU HB3 H 1 1.832 0.004 . . . . . . A 6 GLU HB3 . 34864 1 40 . 1 . 1 6 6 GLU HG2 H 1 2.312 0.019 . . . . . . A 6 GLU HG2 . 34864 1 41 . 1 . 1 6 6 GLU HG3 H 1 2.239 0.001 . . . . . . A 6 GLU HG3 . 34864 1 42 . 1 . 1 6 6 GLU CA C 13 57.548 0.008 . . . . . . A 6 GLU CA . 34864 1 43 . 1 . 1 6 6 GLU CB C 13 26.088 0.039 . . . . . . A 6 GLU CB . 34864 1 44 . 1 . 1 6 6 GLU CG C 13 34.013 0.013 . . . . . . A 6 GLU CG . 34864 1 45 . 1 . 1 6 6 GLU N N 15 116.651 0.018 . . . . . . A 6 GLU N . 34864 1 46 . 1 . 1 7 7 GLU H H 1 6.969 0.003 . . . . . . A 7 GLU H . 34864 1 47 . 1 . 1 7 7 GLU HA H 1 4.134 0.005 . . . . . . A 7 GLU HA . 34864 1 48 . 1 . 1 7 7 GLU HB2 H 1 2.000 0.010 . . . . . . A 7 GLU HB2 . 34864 1 49 . 1 . 1 7 7 GLU HB3 H 1 2.235 0.005 . . . . . . A 7 GLU HB3 . 34864 1 50 . 1 . 1 7 7 GLU HG2 H 1 2.484 0.004 . . . . . . A 7 GLU HG2 . 34864 1 51 . 1 . 1 7 7 GLU CA C 13 55.816 0.028 . . . . . . A 7 GLU CA . 34864 1 52 . 1 . 1 7 7 GLU CB C 13 27.210 0.042 . . . . . . A 7 GLU CB . 34864 1 53 . 1 . 1 7 7 GLU N N 15 118.805 0.029 . . . . . . A 7 GLU N . 34864 1 54 . 1 . 1 8 8 LEU H H 1 7.710 0.004 . . . . . . A 8 LEU H . 34864 1 55 . 1 . 1 8 8 LEU HA H 1 3.971 0.005 . . . . . . A 8 LEU HA . 34864 1 56 . 1 . 1 8 8 LEU HB2 H 1 1.837 0.007 . . . . . . A 8 LEU HB2 . 34864 1 57 . 1 . 1 8 8 LEU HB3 H 1 1.583 0.004 . . . . . . A 8 LEU HB3 . 34864 1 58 . 1 . 1 8 8 LEU HG H 1 1.488 0.001 . . . . . . A 8 LEU HG . 34864 1 59 . 1 . 1 8 8 LEU HD11 H 1 0.830 0.008 . . . . . . A 8 LEU HD11 . 34864 1 60 . 1 . 1 8 8 LEU HD12 H 1 0.830 0.008 . . . . . . A 8 LEU HD12 . 34864 1 61 . 1 . 1 8 8 LEU HD13 H 1 0.830 0.008 . . . . . . A 8 LEU HD13 . 34864 1 62 . 1 . 1 8 8 LEU HD21 H 1 0.726 0.011 . . . . . . A 8 LEU HD21 . 34864 1 63 . 1 . 1 8 8 LEU HD22 H 1 0.726 0.011 . . . . . . A 8 LEU HD22 . 34864 1 64 . 1 . 1 8 8 LEU HD23 H 1 0.726 0.011 . . . . . . A 8 LEU HD23 . 34864 1 65 . 1 . 1 8 8 LEU CA C 13 55.770 0.035 . . . . . . A 8 LEU CA . 34864 1 66 . 1 . 1 8 8 LEU CB C 13 38.659 0.059 . . . . . . A 8 LEU CB . 34864 1 67 . 1 . 1 8 8 LEU N N 15 121.104 0.026 . . . . . . A 8 LEU N . 34864 1 68 . 1 . 1 9 9 ILE H H 1 8.336 0.005 . . . . . . A 9 ILE H . 34864 1 69 . 1 . 1 9 9 ILE HA H 1 3.337 0.003 . . . . . . A 9 ILE HA . 34864 1 70 . 1 . 1 9 9 ILE HB H 1 1.822 0.003 . . . . . . A 9 ILE HB . 34864 1 71 . 1 . 1 9 9 ILE HG12 H 1 0.892 0.012 . . . . . . A 9 ILE HG12 . 34864 1 72 . 1 . 1 9 9 ILE HG13 H 1 1.195 0.000 . . . . . . A 9 ILE HG13 . 34864 1 73 . 1 . 1 9 9 ILE HG21 H 1 0.813 0.017 . . . . . . A 9 ILE HG21 . 34864 1 74 . 1 . 1 9 9 ILE HG22 H 1 0.813 0.017 . . . . . . A 9 ILE HG22 . 34864 1 75 . 1 . 1 9 9 ILE HG23 H 1 0.813 0.017 . . . . . . A 9 ILE HG23 . 34864 1 76 . 1 . 1 9 9 ILE HD11 H 1 0.695 0.005 . . . . . . A 9 ILE HD11 . 34864 1 77 . 1 . 1 9 9 ILE HD12 H 1 0.695 0.005 . . . . . . A 9 ILE HD12 . 34864 1 78 . 1 . 1 9 9 ILE HD13 H 1 0.695 0.005 . . . . . . A 9 ILE HD13 . 34864 1 79 . 1 . 1 9 9 ILE CA C 13 64.190 0.016 . . . . . . A 9 ILE CA . 34864 1 80 . 1 . 1 9 9 ILE CB C 13 35.489 0.053 . . . . . . A 9 ILE CB . 34864 1 81 . 1 . 1 9 9 ILE N N 15 118.309 0.043 . . . . . . A 9 ILE N . 34864 1 82 . 1 . 1 10 10 ASP H H 1 7.784 0.005 . . . . . . A 10 ASP H . 34864 1 83 . 1 . 1 10 10 ASP HA H 1 4.355 0.012 . . . . . . A 10 ASP HA . 34864 1 84 . 1 . 1 10 10 ASP HB2 H 1 2.625 0.004 . . . . . . A 10 ASP HB2 . 34864 1 85 . 1 . 1 10 10 ASP HB3 H 1 2.773 0.004 . . . . . . A 10 ASP HB3 . 34864 1 86 . 1 . 1 10 10 ASP CA C 13 55.407 0.026 . . . . . . A 10 ASP CA . 34864 1 87 . 1 . 1 10 10 ASP CB C 13 38.017 0.056 . . . . . . A 10 ASP CB . 34864 1 88 . 1 . 1 10 10 ASP N N 15 118.979 0.078 . . . . . . A 10 ASP N . 34864 1 89 . 1 . 1 11 11 LYS H H 1 8.063 0.004 . . . . . . A 11 LYS H . 34864 1 90 . 1 . 1 11 11 LYS HA H 1 4.054 0.016 . . . . . . A 11 LYS HA . 34864 1 91 . 1 . 1 11 11 LYS HB2 H 1 1.977 0.010 . . . . . . A 11 LYS HB2 . 34864 1 92 . 1 . 1 11 11 LYS HB3 H 1 1.754 0.016 . . . . . . A 11 LYS HB3 . 34864 1 93 . 1 . 1 11 11 LYS HG2 H 1 1.484 0.000 . . . . . . A 11 LYS HG2 . 34864 1 94 . 1 . 1 11 11 LYS HG3 H 1 1.484 0.000 . . . . . . A 11 LYS HG3 . 34864 1 95 . 1 . 1 11 11 LYS HD2 H 1 1.504 0.019 . . . . . . A 11 LYS HD2 . 34864 1 96 . 1 . 1 11 11 LYS HD3 H 1 1.730 0.000 . . . . . . A 11 LYS HD3 . 34864 1 97 . 1 . 1 11 11 LYS CA C 13 57.264 0.042 . . . . . . A 11 LYS CA . 34864 1 98 . 1 . 1 11 11 LYS CB C 13 30.309 0.061 . . . . . . A 11 LYS CB . 34864 1 99 . 1 . 1 11 11 LYS N N 15 120.211 0.055 . . . . . . A 11 LYS N . 34864 1 100 . 1 . 1 12 12 ILE H H 1 8.248 0.003 . . . . . . A 12 ILE H . 34864 1 101 . 1 . 1 12 12 ILE HA H 1 3.606 0.005 . . . . . . A 12 ILE HA . 34864 1 102 . 1 . 1 12 12 ILE HB H 1 1.771 0.010 . . . . . . A 12 ILE HB . 34864 1 103 . 1 . 1 12 12 ILE HG12 H 1 0.975 0.002 . . . . . . A 12 ILE HG12 . 34864 1 104 . 1 . 1 12 12 ILE HG13 H 1 1.488 0.006 . . . . . . A 12 ILE HG13 . 34864 1 105 . 1 . 1 12 12 ILE HG21 H 1 0.837 0.005 . . . . . . A 12 ILE HG21 . 34864 1 106 . 1 . 1 12 12 ILE HG22 H 1 0.837 0.005 . . . . . . A 12 ILE HG22 . 34864 1 107 . 1 . 1 12 12 ILE HG23 H 1 0.837 0.005 . . . . . . A 12 ILE HG23 . 34864 1 108 . 1 . 1 12 12 ILE HD11 H 1 0.671 0.010 . . . . . . A 12 ILE HD11 . 34864 1 109 . 1 . 1 12 12 ILE HD12 H 1 0.671 0.010 . . . . . . A 12 ILE HD12 . 34864 1 110 . 1 . 1 12 12 ILE HD13 H 1 0.671 0.010 . . . . . . A 12 ILE HD13 . 34864 1 111 . 1 . 1 12 12 ILE CA C 13 62.982 0.041 . . . . . . A 12 ILE CA . 34864 1 112 . 1 . 1 12 12 ILE CB C 13 34.629 0.032 . . . . . . A 12 ILE CB . 34864 1 113 . 1 . 1 12 12 ILE CG1 C 13 26.322 0.000 . . . . . . A 12 ILE CG1 . 34864 1 114 . 1 . 1 12 12 ILE CD1 C 13 10.308 0.070 . . . . . . A 12 ILE CD1 . 34864 1 115 . 1 . 1 12 12 ILE N N 15 121.355 0.022 . . . . . . A 12 ILE N . 34864 1 116 . 1 . 1 13 13 LYS H H 1 8.935 0.003 . . . . . . A 13 LYS H . 34864 1 117 . 1 . 1 13 13 LYS HA H 1 3.832 0.005 . . . . . . A 13 LYS HA . 34864 1 118 . 1 . 1 13 13 LYS HB2 H 1 1.968 0.008 . . . . . . A 13 LYS HB2 . 34864 1 119 . 1 . 1 13 13 LYS HB3 H 1 1.763 0.008 . . . . . . A 13 LYS HB3 . 34864 1 120 . 1 . 1 13 13 LYS HG2 H 1 1.363 0.000 . . . . . . A 13 LYS HG2 . 34864 1 121 . 1 . 1 13 13 LYS HG3 H 1 1.472 0.000 . . . . . . A 13 LYS HG3 . 34864 1 122 . 1 . 1 13 13 LYS HD2 H 1 1.654 0.001 . . . . . . A 13 LYS HD2 . 34864 1 123 . 1 . 1 13 13 LYS HD3 H 1 1.759 0.000 . . . . . . A 13 LYS HD3 . 34864 1 124 . 1 . 1 13 13 LYS CA C 13 58.186 0.081 . . . . . . A 13 LYS CA . 34864 1 125 . 1 . 1 13 13 LYS CB C 13 30.220 0.017 . . . . . . A 13 LYS CB . 34864 1 126 . 1 . 1 13 13 LYS N N 15 120.666 0.024 . . . . . . A 13 LYS N . 34864 1 127 . 1 . 1 14 14 ALA H H 1 8.145 0.002 . . . . . . A 14 ALA H . 34864 1 128 . 1 . 1 14 14 ALA HA H 1 3.999 0.015 . . . . . . A 14 ALA HA . 34864 1 129 . 1 . 1 14 14 ALA HB1 H 1 1.475 0.004 . . . . . . A 14 ALA HB1 . 34864 1 130 . 1 . 1 14 14 ALA HB2 H 1 1.475 0.004 . . . . . . A 14 ALA HB2 . 34864 1 131 . 1 . 1 14 14 ALA HB3 H 1 1.475 0.004 . . . . . . A 14 ALA HB3 . 34864 1 132 . 1 . 1 14 14 ALA CA C 13 52.741 0.059 . . . . . . A 14 ALA CA . 34864 1 133 . 1 . 1 14 14 ALA CB C 13 15.239 0.023 . . . . . . A 14 ALA CB . 34864 1 134 . 1 . 1 14 14 ALA N N 15 122.000 0.040 . . . . . . A 14 ALA N . 34864 1 135 . 1 . 1 15 15 ASN H H 1 7.799 0.006 . . . . . . A 15 ASN H . 34864 1 136 . 1 . 1 15 15 ASN HA H 1 4.476 0.003 . . . . . . A 15 ASN HA . 34864 1 137 . 1 . 1 15 15 ASN HB2 H 1 3.026 0.008 . . . . . . A 15 ASN HB2 . 34864 1 138 . 1 . 1 15 15 ASN HB3 H 1 2.644 0.015 . . . . . . A 15 ASN HB3 . 34864 1 139 . 1 . 1 15 15 ASN HD21 H 1 7.703 0.002 . . . . . . A 15 ASN HD21 . 34864 1 140 . 1 . 1 15 15 ASN HD22 H 1 5.975 0.005 . . . . . . A 15 ASN HD22 . 34864 1 141 . 1 . 1 15 15 ASN CA C 13 53.135 0.051 . . . . . . A 15 ASN CA . 34864 1 142 . 1 . 1 15 15 ASN CB C 13 35.338 0.021 . . . . . . A 15 ASN CB . 34864 1 143 . 1 . 1 15 15 ASN N N 15 119.259 0.075 . . . . . . A 15 ASN N . 34864 1 144 . 1 . 1 15 15 ASN ND2 N 15 106.392 0.014 . . . . . . A 15 ASN ND2 . 34864 1 145 . 1 . 1 16 16 ASN H H 1 8.523 0.002 . . . . . . A 16 ASN H . 34864 1 146 . 1 . 1 16 16 ASN HA H 1 4.393 0.008 . . . . . . A 16 ASN HA . 34864 1 147 . 1 . 1 16 16 ASN HB2 H 1 2.984 0.010 . . . . . . A 16 ASN HB2 . 34864 1 148 . 1 . 1 16 16 ASN HB3 H 1 2.692 0.005 . . . . . . A 16 ASN HB3 . 34864 1 149 . 1 . 1 16 16 ASN HD21 H 1 7.156 0.003 . . . . . . A 16 ASN HD21 . 34864 1 150 . 1 . 1 16 16 ASN HD22 H 1 5.684 0.006 . . . . . . A 16 ASN HD22 . 34864 1 151 . 1 . 1 16 16 ASN CA C 13 52.943 0.032 . . . . . . A 16 ASN CA . 34864 1 152 . 1 . 1 16 16 ASN CB C 13 34.653 0.054 . . . . . . A 16 ASN CB . 34864 1 153 . 1 . 1 16 16 ASN N N 15 120.556 0.023 . . . . . . A 16 ASN N . 34864 1 154 . 1 . 1 16 16 ASN ND2 N 15 107.478 0.022 . . . . . . A 16 ASN ND2 . 34864 1 155 . 1 . 1 17 17 ARG H H 1 8.183 0.004 . . . . . . A 17 ARG H . 34864 1 156 . 1 . 1 17 17 ARG HA H 1 4.070 0.006 . . . . . . A 17 ARG HA . 34864 1 157 . 1 . 1 17 17 ARG HB2 H 1 1.958 0.016 . . . . . . A 17 ARG HB2 . 34864 1 158 . 1 . 1 17 17 ARG HB3 H 1 1.891 0.012 . . . . . . A 17 ARG HB3 . 34864 1 159 . 1 . 1 17 17 ARG HG2 H 1 1.535 0.000 . . . . . . A 17 ARG HG2 . 34864 1 160 . 1 . 1 17 17 ARG HD2 H 1 2.991 0.007 . . . . . . A 17 ARG HD2 . 34864 1 161 . 1 . 1 17 17 ARG HD3 H 1 2.637 0.002 . . . . . . A 17 ARG HD3 . 34864 1 162 . 1 . 1 17 17 ARG HE H 1 7.150 0.000 . . . . . . A 17 ARG HE . 34864 1 163 . 1 . 1 17 17 ARG CA C 13 57.317 0.011 . . . . . . A 17 ARG CA . 34864 1 164 . 1 . 1 17 17 ARG CB C 13 27.363 0.014 . . . . . . A 17 ARG CB . 34864 1 165 . 1 . 1 17 17 ARG CD C 13 41.304 0.018 . . . . . . A 17 ARG CD . 34864 1 166 . 1 . 1 17 17 ARG N N 15 120.967 0.020 . . . . . . A 17 ARG N . 34864 1 167 . 1 . 1 18 18 LEU H H 1 7.667 0.002 . . . . . . A 18 LEU H . 34864 1 168 . 1 . 1 18 18 LEU HA H 1 4.132 0.002 . . . . . . A 18 LEU HA . 34864 1 169 . 1 . 1 18 18 LEU HB2 H 1 1.993 0.005 . . . . . . A 18 LEU HB2 . 34864 1 170 . 1 . 1 18 18 LEU HB3 H 1 1.493 0.005 . . . . . . A 18 LEU HB3 . 34864 1 171 . 1 . 1 18 18 LEU HG H 1 1.311 0.000 . . . . . . A 18 LEU HG . 34864 1 172 . 1 . 1 18 18 LEU HD11 H 1 0.854 0.013 . . . . . . A 18 LEU HD11 . 34864 1 173 . 1 . 1 18 18 LEU HD12 H 1 0.854 0.013 . . . . . . A 18 LEU HD12 . 34864 1 174 . 1 . 1 18 18 LEU HD13 H 1 0.854 0.013 . . . . . . A 18 LEU HD13 . 34864 1 175 . 1 . 1 18 18 LEU HD21 H 1 1.045 0.007 . . . . . . A 18 LEU HD21 . 34864 1 176 . 1 . 1 18 18 LEU HD22 H 1 1.045 0.007 . . . . . . A 18 LEU HD22 . 34864 1 177 . 1 . 1 18 18 LEU HD23 H 1 1.045 0.007 . . . . . . A 18 LEU HD23 . 34864 1 178 . 1 . 1 18 18 LEU CA C 13 55.362 0.060 . . . . . . A 18 LEU CA . 34864 1 179 . 1 . 1 18 18 LEU CB C 13 38.960 0.018 . . . . . . A 18 LEU CB . 34864 1 180 . 1 . 1 18 18 LEU N N 15 121.594 0.010 . . . . . . A 18 LEU N . 34864 1 181 . 1 . 1 19 19 LEU H H 1 8.143 0.002 . . . . . . A 19 LEU H . 34864 1 182 . 1 . 1 19 19 LEU HA H 1 3.947 0.006 . . . . . . A 19 LEU HA . 34864 1 183 . 1 . 1 19 19 LEU HB2 H 1 1.924 0.014 . . . . . . A 19 LEU HB2 . 34864 1 184 . 1 . 1 19 19 LEU HB3 H 1 1.295 0.004 . . . . . . A 19 LEU HB3 . 34864 1 185 . 1 . 1 19 19 LEU HD11 H 1 0.816 0.005 . . . . . . A 19 LEU HD11 . 34864 1 186 . 1 . 1 19 19 LEU HD12 H 1 0.816 0.005 . . . . . . A 19 LEU HD12 . 34864 1 187 . 1 . 1 19 19 LEU HD13 H 1 0.816 0.005 . . . . . . A 19 LEU HD13 . 34864 1 188 . 1 . 1 19 19 LEU HD21 H 1 1.049 0.000 . . . . . . A 19 LEU HD21 . 34864 1 189 . 1 . 1 19 19 LEU HD22 H 1 1.049 0.000 . . . . . . A 19 LEU HD22 . 34864 1 190 . 1 . 1 19 19 LEU HD23 H 1 1.049 0.000 . . . . . . A 19 LEU HD23 . 34864 1 191 . 1 . 1 19 19 LEU CA C 13 55.249 0.029 . . . . . . A 19 LEU CA . 34864 1 192 . 1 . 1 19 19 LEU CB C 13 38.283 0.052 . . . . . . A 19 LEU CB . 34864 1 193 . 1 . 1 19 19 LEU N N 15 118.574 0.060 . . . . . . A 19 LEU N . 34864 1 194 . 1 . 1 20 20 ASN H H 1 8.375 0.002 . . . . . . A 20 ASN H . 34864 1 195 . 1 . 1 20 20 ASN HA H 1 4.370 0.006 . . . . . . A 20 ASN HA . 34864 1 196 . 1 . 1 20 20 ASN HB2 H 1 2.779 0.004 . . . . . . A 20 ASN HB2 . 34864 1 197 . 1 . 1 20 20 ASN HB3 H 1 3.093 0.008 . . . . . . A 20 ASN HB3 . 34864 1 198 . 1 . 1 20 20 ASN HD21 H 1 7.611 0.002 . . . . . . A 20 ASN HD21 . 34864 1 199 . 1 . 1 20 20 ASN HD22 H 1 6.745 0.003 . . . . . . A 20 ASN HD22 . 34864 1 200 . 1 . 1 20 20 ASN CA C 13 53.358 0.011 . . . . . . A 20 ASN CA . 34864 1 201 . 1 . 1 20 20 ASN CB C 13 35.556 0.000 . . . . . . A 20 ASN CB . 34864 1 202 . 1 . 1 20 20 ASN N N 15 116.940 0.011 . . . . . . A 20 ASN N . 34864 1 203 . 1 . 1 20 20 ASN ND2 N 15 112.082 0.032 . . . . . . A 20 ASN ND2 . 34864 1 204 . 1 . 1 21 21 ALA H H 1 7.901 0.006 . . . . . . A 21 ALA H . 34864 1 205 . 1 . 1 21 21 ALA HA H 1 4.157 0.008 . . . . . . A 21 ALA HA . 34864 1 206 . 1 . 1 21 21 ALA HB1 H 1 1.550 0.004 . . . . . . A 21 ALA HB1 . 34864 1 207 . 1 . 1 21 21 ALA HB2 H 1 1.550 0.004 . . . . . . A 21 ALA HB2 . 34864 1 208 . 1 . 1 21 21 ALA HB3 H 1 1.550 0.004 . . . . . . A 21 ALA HB3 . 34864 1 209 . 1 . 1 21 21 ALA CA C 13 52.653 0.069 . . . . . . A 21 ALA CA . 34864 1 210 . 1 . 1 21 21 ALA CB C 13 15.140 0.029 . . . . . . A 21 ALA CB . 34864 1 211 . 1 . 1 21 21 ALA N N 15 122.156 0.014 . . . . . . A 21 ALA N . 34864 1 212 . 1 . 1 22 22 VAL H H 1 7.739 0.006 . . . . . . A 22 VAL H . 34864 1 213 . 1 . 1 22 22 VAL HA H 1 3.944 0.003 . . . . . . A 22 VAL HA . 34864 1 214 . 1 . 1 22 22 VAL HB H 1 2.344 0.010 . . . . . . A 22 VAL HB . 34864 1 215 . 1 . 1 22 22 VAL HG11 H 1 0.946 0.014 . . . . . . A 22 VAL HG11 . 34864 1 216 . 1 . 1 22 22 VAL HG12 H 1 0.946 0.014 . . . . . . A 22 VAL HG12 . 34864 1 217 . 1 . 1 22 22 VAL HG13 H 1 0.946 0.014 . . . . . . A 22 VAL HG13 . 34864 1 218 . 1 . 1 22 22 VAL HG21 H 1 1.069 0.004 . . . . . . A 22 VAL HG21 . 34864 1 219 . 1 . 1 22 22 VAL HG22 H 1 1.069 0.004 . . . . . . A 22 VAL HG22 . 34864 1 220 . 1 . 1 22 22 VAL HG23 H 1 1.069 0.004 . . . . . . A 22 VAL HG23 . 34864 1 221 . 1 . 1 22 22 VAL CA C 13 63.733 0.069 . . . . . . A 22 VAL CA . 34864 1 222 . 1 . 1 22 22 VAL CB C 13 28.973 0.028 . . . . . . A 22 VAL CB . 34864 1 223 . 1 . 1 22 22 VAL CG1 C 13 18.875 0.011 . . . . . . A 22 VAL CG1 . 34864 1 224 . 1 . 1 22 22 VAL CG2 C 13 20.225 0.011 . . . . . . A 22 VAL CG2 . 34864 1 225 . 1 . 1 22 22 VAL N N 15 118.939 0.052 . . . . . . A 22 VAL N . 34864 1 226 . 1 . 1 23 23 VAL H H 1 7.643 0.007 . . . . . . A 23 VAL H . 34864 1 227 . 1 . 1 23 23 VAL HA H 1 3.368 0.004 . . . . . . A 23 VAL HA . 34864 1 228 . 1 . 1 23 23 VAL HB H 1 2.135 0.007 . . . . . . A 23 VAL HB . 34864 1 229 . 1 . 1 23 23 VAL HG11 H 1 0.905 0.008 . . . . . . A 23 VAL HG11 . 34864 1 230 . 1 . 1 23 23 VAL HG12 H 1 0.905 0.008 . . . . . . A 23 VAL HG12 . 34864 1 231 . 1 . 1 23 23 VAL HG13 H 1 0.905 0.008 . . . . . . A 23 VAL HG13 . 34864 1 232 . 1 . 1 23 23 VAL HG21 H 1 1.039 0.004 . . . . . . A 23 VAL HG21 . 34864 1 233 . 1 . 1 23 23 VAL HG22 H 1 1.039 0.004 . . . . . . A 23 VAL HG22 . 34864 1 234 . 1 . 1 23 23 VAL HG23 H 1 1.039 0.004 . . . . . . A 23 VAL HG23 . 34864 1 235 . 1 . 1 23 23 VAL CA C 13 64.677 0.078 . . . . . . A 23 VAL CA . 34864 1 236 . 1 . 1 23 23 VAL CB C 13 28.950 0.037 . . . . . . A 23 VAL CB . 34864 1 237 . 1 . 1 23 23 VAL CG1 C 13 19.436 0.022 . . . . . . A 23 VAL CG1 . 34864 1 238 . 1 . 1 23 23 VAL CG2 C 13 21.242 0.076 . . . . . . A 23 VAL CG2 . 34864 1 239 . 1 . 1 23 23 VAL N N 15 119.035 0.024 . . . . . . A 23 VAL N . 34864 1 240 . 1 . 1 24 24 GLN H H 1 8.230 0.004 . . . . . . A 24 GLN H . 34864 1 241 . 1 . 1 24 24 GLN HA H 1 4.036 0.011 . . . . . . A 24 GLN HA . 34864 1 242 . 1 . 1 24 24 GLN HB2 H 1 2.119 0.004 . . . . . . A 24 GLN HB2 . 34864 1 243 . 1 . 1 24 24 GLN HB3 H 1 2.397 0.011 . . . . . . A 24 GLN HB3 . 34864 1 244 . 1 . 1 24 24 GLN HE21 H 1 6.824 0.006 . . . . . . A 24 GLN HE21 . 34864 1 245 . 1 . 1 24 24 GLN HE22 H 1 7.311 0.002 . . . . . . A 24 GLN HE22 . 34864 1 246 . 1 . 1 24 24 GLN CA C 13 56.313 0.000 . . . . . . A 24 GLN CA . 34864 1 247 . 1 . 1 24 24 GLN CB C 13 25.620 0.031 . . . . . . A 24 GLN CB . 34864 1 248 . 1 . 1 24 24 GLN N N 15 116.862 0.025 . . . . . . A 24 GLN N . 34864 1 249 . 1 . 1 24 24 GLN NE2 N 15 111.872 0.005 . . . . . . A 24 GLN NE2 . 34864 1 250 . 1 . 1 25 25 GLU H H 1 8.005 0.003 . . . . . . A 25 GLU H . 34864 1 251 . 1 . 1 25 25 GLU HA H 1 4.018 0.011 . . . . . . A 25 GLU HA . 34864 1 252 . 1 . 1 25 25 GLU HB2 H 1 2.399 0.010 . . . . . . A 25 GLU HB2 . 34864 1 253 . 1 . 1 25 25 GLU HG2 H 1 2.585 0.000 . . . . . . A 25 GLU HG2 . 34864 1 254 . 1 . 1 25 25 GLU HG3 H 1 2.445 0.000 . . . . . . A 25 GLU HG3 . 34864 1 255 . 1 . 1 25 25 GLU CA C 13 57.395 0.000 . . . . . . A 25 GLU CA . 34864 1 256 . 1 . 1 25 25 GLU CB C 13 26.839 0.031 . . . . . . A 25 GLU CB . 34864 1 257 . 1 . 1 25 25 GLU N N 15 118.323 0.050 . . . . . . A 25 GLU N . 34864 1 258 . 1 . 1 26 26 MET H H 1 8.469 0.003 . . . . . . A 26 MET H . 34864 1 259 . 1 . 1 26 26 MET HA H 1 4.117 0.007 . . . . . . A 26 MET HA . 34864 1 260 . 1 . 1 26 26 MET HB2 H 1 2.032 0.007 . . . . . . A 26 MET HB2 . 34864 1 261 . 1 . 1 26 26 MET HB3 H 1 1.507 0.009 . . . . . . A 26 MET HB3 . 34864 1 262 . 1 . 1 26 26 MET HG2 H 1 2.410 0.005 . . . . . . A 26 MET HG2 . 34864 1 263 . 1 . 1 26 26 MET HG3 H 1 2.594 0.000 . . . . . . A 26 MET HG3 . 34864 1 264 . 1 . 1 26 26 MET CA C 13 57.523 0.023 . . . . . . A 26 MET CA . 34864 1 265 . 1 . 1 26 26 MET CB C 13 29.936 0.034 . . . . . . A 26 MET CB . 34864 1 266 . 1 . 1 26 26 MET N N 15 120.188 0.041 . . . . . . A 26 MET N . 34864 1 267 . 1 . 1 27 27 TYR H H 1 7.969 0.002 . . . . . . A 27 TYR H . 34864 1 268 . 1 . 1 27 27 TYR HA H 1 4.036 0.004 . . . . . . A 27 TYR HA . 34864 1 269 . 1 . 1 27 27 TYR HB2 H 1 3.031 0.014 . . . . . . A 27 TYR HB2 . 34864 1 270 . 1 . 1 27 27 TYR HB3 H 1 2.907 0.004 . . . . . . A 27 TYR HB3 . 34864 1 271 . 1 . 1 27 27 TYR HD1 H 1 7.093 0.003 . . . . . . A 27 TYR HD1 . 34864 1 272 . 1 . 1 27 27 TYR HD2 H 1 7.093 0.003 . . . . . . A 27 TYR HD2 . 34864 1 273 . 1 . 1 27 27 TYR HE1 H 1 6.639 0.007 . . . . . . A 27 TYR HE1 . 34864 1 274 . 1 . 1 27 27 TYR HE2 H 1 6.639 0.007 . . . . . . A 27 TYR HE2 . 34864 1 275 . 1 . 1 27 27 TYR CA C 13 59.002 0.082 . . . . . . A 27 TYR CA . 34864 1 276 . 1 . 1 27 27 TYR CB C 13 35.293 0.022 . . . . . . A 27 TYR CB . 34864 1 277 . 1 . 1 27 27 TYR N N 15 115.357 0.024 . . . . . . A 27 TYR N . 34864 1 278 . 1 . 1 28 28 LEU H H 1 7.318 0.004 . . . . . . A 28 LEU H . 34864 1 279 . 1 . 1 28 28 LEU HA H 1 4.379 0.011 . . . . . . A 28 LEU HA . 34864 1 280 . 1 . 1 28 28 LEU HB2 H 1 1.727 0.022 . . . . . . A 28 LEU HB2 . 34864 1 281 . 1 . 1 28 28 LEU HB3 H 1 1.669 0.000 . . . . . . A 28 LEU HB3 . 34864 1 282 . 1 . 1 28 28 LEU HG H 1 1.511 0.002 . . . . . . A 28 LEU HG . 34864 1 283 . 1 . 1 28 28 LEU HD11 H 1 0.863 0.004 . . . . . . A 28 LEU HD11 . 34864 1 284 . 1 . 1 28 28 LEU HD12 H 1 0.863 0.004 . . . . . . A 28 LEU HD12 . 34864 1 285 . 1 . 1 28 28 LEU HD13 H 1 0.863 0.004 . . . . . . A 28 LEU HD13 . 34864 1 286 . 1 . 1 28 28 LEU CA C 13 52.034 0.096 . . . . . . A 28 LEU CA . 34864 1 287 . 1 . 1 28 28 LEU CB C 13 40.120 0.060 . . . . . . A 28 LEU CB . 34864 1 288 . 1 . 1 28 28 LEU N N 15 118.553 0.012 . . . . . . A 28 LEU N . 34864 1 289 . 1 . 1 29 29 ASP H H 1 7.287 0.002 . . . . . . A 29 ASP H . 34864 1 290 . 1 . 1 29 29 ASP HA H 1 4.502 0.002 . . . . . . A 29 ASP HA . 34864 1 291 . 1 . 1 29 29 ASP HB2 H 1 3.318 0.002 . . . . . . A 29 ASP HB2 . 34864 1 292 . 1 . 1 29 29 ASP HB3 H 1 2.800 0.015 . . . . . . A 29 ASP HB3 . 34864 1 293 . 1 . 1 29 29 ASP CA C 13 51.113 0.065 . . . . . . A 29 ASP CA . 34864 1 294 . 1 . 1 29 29 ASP CB C 13 37.918 0.037 . . . . . . A 29 ASP CB . 34864 1 295 . 1 . 1 29 29 ASP N N 15 120.731 0.036 . . . . . . A 29 ASP N . 34864 1 296 . 1 . 1 30 30 ASN H H 1 8.591 0.002 . . . . . . A 30 ASN H . 34864 1 297 . 1 . 1 30 30 ASN HA H 1 4.619 0.008 . . . . . . A 30 ASN HA . 34864 1 298 . 1 . 1 30 30 ASN HB2 H 1 2.842 0.006 . . . . . . A 30 ASN HB2 . 34864 1 299 . 1 . 1 30 30 ASN HD21 H 1 7.560 0.002 . . . . . . A 30 ASN HD21 . 34864 1 300 . 1 . 1 30 30 ASN HD22 H 1 6.883 0.002 . . . . . . A 30 ASN HD22 . 34864 1 301 . 1 . 1 30 30 ASN CA C 13 51.713 0.091 . . . . . . A 30 ASN CA . 34864 1 302 . 1 . 1 30 30 ASN CB C 13 35.668 0.004 . . . . . . A 30 ASN CB . 34864 1 303 . 1 . 1 30 30 ASN N N 15 124.083 0.030 . . . . . . A 30 ASN N . 34864 1 304 . 1 . 1 30 30 ASN ND2 N 15 112.973 0.023 . . . . . . A 30 ASN ND2 . 34864 1 305 . 1 . 1 31 31 SER H H 1 8.936 0.004 . . . . . . A 31 SER H . 34864 1 306 . 1 . 1 31 31 SER HA H 1 4.390 0.002 . . . . . . A 31 SER HA . 34864 1 307 . 1 . 1 31 31 SER HB2 H 1 4.027 0.002 . . . . . . A 31 SER HB2 . 34864 1 308 . 1 . 1 31 31 SER HB3 H 1 3.867 0.004 . . . . . . A 31 SER HB3 . 34864 1 309 . 1 . 1 31 31 SER CA C 13 57.286 0.042 . . . . . . A 31 SER CA . 34864 1 310 . 1 . 1 31 31 SER CB C 13 61.043 0.046 . . . . . . A 31 SER CB . 34864 1 311 . 1 . 1 31 31 SER N N 15 116.457 0.004 . . . . . . A 31 SER N . 34864 1 312 . 1 . 1 32 32 LEU H H 1 7.083 0.002 . . . . . . A 32 LEU H . 34864 1 313 . 1 . 1 32 32 LEU HA H 1 4.496 0.005 . . . . . . A 32 LEU HA . 34864 1 314 . 1 . 1 32 32 LEU HB2 H 1 1.728 0.008 . . . . . . A 32 LEU HB2 . 34864 1 315 . 1 . 1 32 32 LEU HB3 H 1 1.310 0.002 . . . . . . A 32 LEU HB3 . 34864 1 316 . 1 . 1 32 32 LEU HG H 1 1.637 0.011 . . . . . . A 32 LEU HG . 34864 1 317 . 1 . 1 32 32 LEU HD11 H 1 0.835 0.015 . . . . . . A 32 LEU HD11 . 34864 1 318 . 1 . 1 32 32 LEU HD12 H 1 0.835 0.015 . . . . . . A 32 LEU HD12 . 34864 1 319 . 1 . 1 32 32 LEU HD13 H 1 0.835 0.015 . . . . . . A 32 LEU HD13 . 34864 1 320 . 1 . 1 32 32 LEU CA C 13 51.069 0.057 . . . . . . A 32 LEU CA . 34864 1 321 . 1 . 1 32 32 LEU CB C 13 41.486 0.030 . . . . . . A 32 LEU CB . 34864 1 322 . 1 . 1 32 32 LEU N N 15 121.938 0.009 . . . . . . A 32 LEU N . 34864 1 323 . 1 . 1 33 33 ASP H H 1 8.595 0.001 . . . . . . A 33 ASP H . 34864 1 324 . 1 . 1 33 33 ASP HA H 1 4.494 0.004 . . . . . . A 33 ASP HA . 34864 1 325 . 1 . 1 33 33 ASP HB2 H 1 2.818 0.008 . . . . . . A 33 ASP HB2 . 34864 1 326 . 1 . 1 33 33 ASP HB3 H 1 2.700 0.005 . . . . . . A 33 ASP HB3 . 34864 1 327 . 1 . 1 33 33 ASP CA C 13 51.505 0.004 . . . . . . A 33 ASP CA . 34864 1 328 . 1 . 1 33 33 ASP CB C 13 39.531 0.026 . . . . . . A 33 ASP CB . 34864 1 329 . 1 . 1 33 33 ASP N N 15 123.584 0.052 . . . . . . A 33 ASP N . 34864 1 330 . 1 . 1 34 34 ILE H H 1 8.364 0.003 . . . . . . A 34 ILE H . 34864 1 331 . 1 . 1 34 34 ILE HA H 1 3.638 0.011 . . . . . . A 34 ILE HA . 34864 1 332 . 1 . 1 34 34 ILE HB H 1 1.789 0.008 . . . . . . A 34 ILE HB . 34864 1 333 . 1 . 1 34 34 ILE HG12 H 1 1.528 0.013 . . . . . . A 34 ILE HG12 . 34864 1 334 . 1 . 1 34 34 ILE HG13 H 1 1.368 0.000 . . . . . . A 34 ILE HG13 . 34864 1 335 . 1 . 1 34 34 ILE HG21 H 1 1.216 0.021 . . . . . . A 34 ILE HG21 . 34864 1 336 . 1 . 1 34 34 ILE HG22 H 1 1.216 0.021 . . . . . . A 34 ILE HG22 . 34864 1 337 . 1 . 1 34 34 ILE HG23 H 1 1.216 0.021 . . . . . . A 34 ILE HG23 . 34864 1 338 . 1 . 1 34 34 ILE HD11 H 1 0.888 0.014 . . . . . . A 34 ILE HD11 . 34864 1 339 . 1 . 1 34 34 ILE HD12 H 1 0.888 0.014 . . . . . . A 34 ILE HD12 . 34864 1 340 . 1 . 1 34 34 ILE HD13 H 1 0.888 0.014 . . . . . . A 34 ILE HD13 . 34864 1 341 . 1 . 1 34 34 ILE CA C 13 62.220 0.068 . . . . . . A 34 ILE CA . 34864 1 342 . 1 . 1 34 34 ILE CB C 13 35.315 0.054 . . . . . . A 34 ILE CB . 34864 1 343 . 1 . 1 34 34 ILE N N 15 123.865 0.022 . . . . . . A 34 ILE N . 34864 1 344 . 1 . 1 35 35 LYS H H 1 8.159 0.006 . . . . . . A 35 LYS H . 34864 1 345 . 1 . 1 35 35 LYS HA H 1 4.089 0.015 . . . . . . A 35 LYS HA . 34864 1 346 . 1 . 1 35 35 LYS HB2 H 1 1.765 0.008 . . . . . . A 35 LYS HB2 . 34864 1 347 . 1 . 1 35 35 LYS HB3 H 1 1.835 0.008 . . . . . . A 35 LYS HB3 . 34864 1 348 . 1 . 1 35 35 LYS HG2 H 1 1.341 0.000 . . . . . . A 35 LYS HG2 . 34864 1 349 . 1 . 1 35 35 LYS HG3 H 1 1.475 0.004 . . . . . . A 35 LYS HG3 . 34864 1 350 . 1 . 1 35 35 LYS HD2 H 1 1.613 0.000 . . . . . . A 35 LYS HD2 . 34864 1 351 . 1 . 1 35 35 LYS CA C 13 56.824 0.000 . . . . . . A 35 LYS CA . 34864 1 352 . 1 . 1 35 35 LYS CB C 13 29.136 0.017 . . . . . . A 35 LYS CB . 34864 1 353 . 1 . 1 35 35 LYS N N 15 119.630 0.054 . . . . . . A 35 LYS N . 34864 1 354 . 1 . 1 36 36 THR H H 1 7.727 0.003 . . . . . . A 36 THR H . 34864 1 355 . 1 . 1 36 36 THR HA H 1 3.844 0.010 . . . . . . A 36 THR HA . 34864 1 356 . 1 . 1 36 36 THR HB H 1 4.119 0.004 . . . . . . A 36 THR HB . 34864 1 357 . 1 . 1 36 36 THR HG21 H 1 1.317 0.005 . . . . . . A 36 THR HG21 . 34864 1 358 . 1 . 1 36 36 THR HG22 H 1 1.317 0.005 . . . . . . A 36 THR HG22 . 34864 1 359 . 1 . 1 36 36 THR HG23 H 1 1.317 0.005 . . . . . . A 36 THR HG23 . 34864 1 360 . 1 . 1 36 36 THR CA C 13 63.639 0.029 . . . . . . A 36 THR CA . 34864 1 361 . 1 . 1 36 36 THR CB C 13 65.645 0.010 . . . . . . A 36 THR CB . 34864 1 362 . 1 . 1 36 36 THR CG2 C 13 20.177 0.009 . . . . . . A 36 THR CG2 . 34864 1 363 . 1 . 1 36 36 THR N N 15 118.123 0.051 . . . . . . A 36 THR N . 34864 1 364 . 1 . 1 37 37 ARG H H 1 8.444 0.011 . . . . . . A 37 ARG H . 34864 1 365 . 1 . 1 37 37 ARG HA H 1 3.706 0.009 . . . . . . A 37 ARG HA . 34864 1 366 . 1 . 1 37 37 ARG HB2 H 1 1.766 0.009 . . . . . . A 37 ARG HB2 . 34864 1 367 . 1 . 1 37 37 ARG HB3 H 1 1.346 0.000 . . . . . . A 37 ARG HB3 . 34864 1 368 . 1 . 1 37 37 ARG HG2 H 1 1.299 0.017 . . . . . . A 37 ARG HG2 . 34864 1 369 . 1 . 1 37 37 ARG HG3 H 1 1.422 0.006 . . . . . . A 37 ARG HG3 . 34864 1 370 . 1 . 1 37 37 ARG HD2 H 1 2.994 0.009 . . . . . . A 37 ARG HD2 . 34864 1 371 . 1 . 1 37 37 ARG HD3 H 1 2.794 0.017 . . . . . . A 37 ARG HD3 . 34864 1 372 . 1 . 1 37 37 ARG HE H 1 6.649 0.002 . . . . . . A 37 ARG HE . 34864 1 373 . 1 . 1 37 37 ARG CA C 13 57.454 0.043 . . . . . . A 37 ARG CA . 34864 1 374 . 1 . 1 37 37 ARG CB C 13 27.873 0.036 . . . . . . A 37 ARG CB . 34864 1 375 . 1 . 1 37 37 ARG CG C 13 23.713 0.022 . . . . . . A 37 ARG CG . 34864 1 376 . 1 . 1 37 37 ARG N N 15 120.726 0.132 . . . . . . A 37 ARG N . 34864 1 377 . 1 . 1 37 37 ARG NE N 15 118.803 0.015 . . . . . . A 37 ARG NE . 34864 1 378 . 1 . 1 38 38 ASP H H 1 8.204 0.004 . . . . . . A 38 ASP H . 34864 1 379 . 1 . 1 38 38 ASP HA H 1 4.353 0.003 . . . . . . A 38 ASP HA . 34864 1 380 . 1 . 1 38 38 ASP HB2 H 1 2.723 0.014 . . . . . . A 38 ASP HB2 . 34864 1 381 . 1 . 1 38 38 ASP HB3 H 1 2.633 0.005 . . . . . . A 38 ASP HB3 . 34864 1 382 . 1 . 1 38 38 ASP CA C 13 54.717 0.009 . . . . . . A 38 ASP CA . 34864 1 383 . 1 . 1 38 38 ASP CB C 13 37.733 0.023 . . . . . . A 38 ASP CB . 34864 1 384 . 1 . 1 38 38 ASP N N 15 116.740 0.052 . . . . . . A 38 ASP N . 34864 1 385 . 1 . 1 39 39 TYR H H 1 7.737 0.004 . . . . . . A 39 TYR H . 34864 1 386 . 1 . 1 39 39 TYR HA H 1 4.109 0.004 . . . . . . A 39 TYR HA . 34864 1 387 . 1 . 1 39 39 TYR HB2 H 1 2.809 0.017 . . . . . . A 39 TYR HB2 . 34864 1 388 . 1 . 1 39 39 TYR HB3 H 1 3.026 0.008 . . . . . . A 39 TYR HB3 . 34864 1 389 . 1 . 1 39 39 TYR HD1 H 1 6.996 0.002 . . . . . . A 39 TYR HD1 . 34864 1 390 . 1 . 1 39 39 TYR HD2 H 1 6.996 0.002 . . . . . . A 39 TYR HD2 . 34864 1 391 . 1 . 1 39 39 TYR HE1 H 1 6.824 0.000 . . . . . . A 39 TYR HE1 . 34864 1 392 . 1 . 1 39 39 TYR HE2 H 1 6.824 0.000 . . . . . . A 39 TYR HE2 . 34864 1 393 . 1 . 1 39 39 TYR CA C 13 58.927 0.039 . . . . . . A 39 TYR CA . 34864 1 394 . 1 . 1 39 39 TYR CB C 13 35.308 0.030 . . . . . . A 39 TYR CB . 34864 1 395 . 1 . 1 39 39 TYR N N 15 121.601 0.022 . . . . . . A 39 TYR N . 34864 1 396 . 1 . 1 40 40 TYR H H 1 8.110 0.005 . . . . . . A 40 TYR H . 34864 1 397 . 1 . 1 40 40 TYR HA H 1 3.963 0.018 . . . . . . A 40 TYR HA . 34864 1 398 . 1 . 1 40 40 TYR HB2 H 1 2.760 0.018 . . . . . . A 40 TYR HB2 . 34864 1 399 . 1 . 1 40 40 TYR HB3 H 1 2.626 0.011 . . . . . . A 40 TYR HB3 . 34864 1 400 . 1 . 1 40 40 TYR HD1 H 1 6.563 0.005 . . . . . . A 40 TYR HD1 . 34864 1 401 . 1 . 1 40 40 TYR HD2 H 1 6.563 0.005 . . . . . . A 40 TYR HD2 . 34864 1 402 . 1 . 1 40 40 TYR HE1 H 1 6.344 0.002 . . . . . . A 40 TYR HE1 . 34864 1 403 . 1 . 1 40 40 TYR HE2 H 1 6.344 0.002 . . . . . . A 40 TYR HE2 . 34864 1 404 . 1 . 1 40 40 TYR CA C 13 59.720 0.077 . . . . . . A 40 TYR CA . 34864 1 405 . 1 . 1 40 40 TYR CB C 13 35.369 0.033 . . . . . . A 40 TYR CB . 34864 1 406 . 1 . 1 40 40 TYR N N 15 118.067 0.112 . . . . . . A 40 TYR N . 34864 1 407 . 1 . 1 41 41 ALA H H 1 9.018 0.002 . . . . . . A 41 ALA H . 34864 1 408 . 1 . 1 41 41 ALA HA H 1 3.879 0.001 . . . . . . A 41 ALA HA . 34864 1 409 . 1 . 1 41 41 ALA HB1 H 1 1.338 0.007 . . . . . . A 41 ALA HB1 . 34864 1 410 . 1 . 1 41 41 ALA HB2 H 1 1.338 0.007 . . . . . . A 41 ALA HB2 . 34864 1 411 . 1 . 1 41 41 ALA HB3 H 1 1.338 0.007 . . . . . . A 41 ALA HB3 . 34864 1 412 . 1 . 1 41 41 ALA CA C 13 53.232 0.051 . . . . . . A 41 ALA CA . 34864 1 413 . 1 . 1 41 41 ALA CB C 13 16.009 0.016 . . . . . . A 41 ALA CB . 34864 1 414 . 1 . 1 41 41 ALA N N 15 120.292 0.024 . . . . . . A 41 ALA N . 34864 1 415 . 1 . 1 42 42 SER H H 1 8.174 0.002 . . . . . . A 42 SER H . 34864 1 416 . 1 . 1 42 42 SER HA H 1 4.114 0.004 . . . . . . A 42 SER HA . 34864 1 417 . 1 . 1 42 42 SER HB2 H 1 3.930 0.007 . . . . . . A 42 SER HB2 . 34864 1 418 . 1 . 1 42 42 SER CA C 13 59.578 0.056 . . . . . . A 42 SER CA . 34864 1 419 . 1 . 1 42 42 SER N N 15 114.823 0.054 . . . . . . A 42 SER N . 34864 1 420 . 1 . 1 43 43 ASN H H 1 7.259 0.004 . . . . . . A 43 ASN H . 34864 1 421 . 1 . 1 43 43 ASN HA H 1 4.417 0.003 . . . . . . A 43 ASN HA . 34864 1 422 . 1 . 1 43 43 ASN HB2 H 1 2.365 0.007 . . . . . . A 43 ASN HB2 . 34864 1 423 . 1 . 1 43 43 ASN HB3 H 1 2.545 0.005 . . . . . . A 43 ASN HB3 . 34864 1 424 . 1 . 1 43 43 ASN HD21 H 1 6.771 0.012 . . . . . . A 43 ASN HD21 . 34864 1 425 . 1 . 1 43 43 ASN HD22 H 1 7.357 0.000 . . . . . . A 43 ASN HD22 . 34864 1 426 . 1 . 1 43 43 ASN CA C 13 53.843 0.032 . . . . . . A 43 ASN CA . 34864 1 427 . 1 . 1 43 43 ASN CB C 13 35.875 0.040 . . . . . . A 43 ASN CB . 34864 1 428 . 1 . 1 43 43 ASN N N 15 121.458 0.031 . . . . . . A 43 ASN N . 34864 1 429 . 1 . 1 43 43 ASN ND2 N 15 111.534 0.046 . . . . . . A 43 ASN ND2 . 34864 1 430 . 1 . 1 44 44 ILE H H 1 8.291 0.002 . . . . . . A 44 ILE H . 34864 1 431 . 1 . 1 44 44 ILE HA H 1 3.493 0.005 . . . . . . A 44 ILE HA . 34864 1 432 . 1 . 1 44 44 ILE HB H 1 1.727 0.012 . . . . . . A 44 ILE HB . 34864 1 433 . 1 . 1 44 44 ILE HG12 H 1 1.039 0.009 . . . . . . A 44 ILE HG12 . 34864 1 434 . 1 . 1 44 44 ILE HG13 H 1 1.328 0.002 . . . . . . A 44 ILE HG13 . 34864 1 435 . 1 . 1 44 44 ILE HG21 H 1 0.811 0.003 . . . . . . A 44 ILE HG21 . 34864 1 436 . 1 . 1 44 44 ILE HG22 H 1 0.811 0.003 . . . . . . A 44 ILE HG22 . 34864 1 437 . 1 . 1 44 44 ILE HG23 H 1 0.811 0.003 . . . . . . A 44 ILE HG23 . 34864 1 438 . 1 . 1 44 44 ILE HD11 H 1 0.652 0.008 . . . . . . A 44 ILE HD11 . 34864 1 439 . 1 . 1 44 44 ILE HD12 H 1 0.652 0.008 . . . . . . A 44 ILE HD12 . 34864 1 440 . 1 . 1 44 44 ILE HD13 H 1 0.652 0.008 . . . . . . A 44 ILE HD13 . 34864 1 441 . 1 . 1 44 44 ILE CA C 13 63.023 0.077 . . . . . . A 44 ILE CA . 34864 1 442 . 1 . 1 44 44 ILE CB C 13 34.929 0.022 . . . . . . A 44 ILE CB . 34864 1 443 . 1 . 1 44 44 ILE CG2 C 13 17.638 0.087 . . . . . . A 44 ILE CG2 . 34864 1 444 . 1 . 1 44 44 ILE CD1 C 13 10.791 0.058 . . . . . . A 44 ILE CD1 . 34864 1 445 . 1 . 1 44 44 ILE N N 15 120.064 0.074 . . . . . . A 44 ILE N . 34864 1 446 . 1 . 1 45 45 THR H H 1 8.690 0.003 . . . . . . A 45 THR H . 34864 1 447 . 1 . 1 45 45 THR HA H 1 3.779 0.008 . . . . . . A 45 THR HA . 34864 1 448 . 1 . 1 45 45 THR HB H 1 4.332 0.002 . . . . . . A 45 THR HB . 34864 1 449 . 1 . 1 45 45 THR HG21 H 1 1.165 0.002 . . . . . . A 45 THR HG21 . 34864 1 450 . 1 . 1 45 45 THR HG22 H 1 1.165 0.002 . . . . . . A 45 THR HG22 . 34864 1 451 . 1 . 1 45 45 THR HG23 H 1 1.165 0.002 . . . . . . A 45 THR HG23 . 34864 1 452 . 1 . 1 45 45 THR CA C 13 64.897 0.055 . . . . . . A 45 THR CA . 34864 1 453 . 1 . 1 45 45 THR CB C 13 65.578 0.010 . . . . . . A 45 THR CB . 34864 1 454 . 1 . 1 45 45 THR CG2 C 13 18.794 0.008 . . . . . . A 45 THR CG2 . 34864 1 455 . 1 . 1 45 45 THR N N 15 118.404 0.018 . . . . . . A 45 THR N . 34864 1 456 . 1 . 1 46 46 SER H H 1 7.799 0.004 . . . . . . A 46 SER H . 34864 1 457 . 1 . 1 46 46 SER HA H 1 4.217 0.005 . . . . . . A 46 SER HA . 34864 1 458 . 1 . 1 46 46 SER HB2 H 1 3.918 0.030 . . . . . . A 46 SER HB2 . 34864 1 459 . 1 . 1 46 46 SER HB3 H 1 3.974 0.002 . . . . . . A 46 SER HB3 . 34864 1 460 . 1 . 1 46 46 SER CA C 13 59.887 0.056 . . . . . . A 46 SER CA . 34864 1 461 . 1 . 1 46 46 SER N N 15 117.343 0.025 . . . . . . A 46 SER N . 34864 1 462 . 1 . 1 47 47 VAL H H 1 7.234 0.004 . . . . . . A 47 VAL H . 34864 1 463 . 1 . 1 47 47 VAL HA H 1 3.625 0.005 . . . . . . A 47 VAL HA . 34864 1 464 . 1 . 1 47 47 VAL HB H 1 2.240 0.006 . . . . . . A 47 VAL HB . 34864 1 465 . 1 . 1 47 47 VAL HG11 H 1 0.843 0.013 . . . . . . A 47 VAL HG11 . 34864 1 466 . 1 . 1 47 47 VAL HG12 H 1 0.843 0.013 . . . . . . A 47 VAL HG12 . 34864 1 467 . 1 . 1 47 47 VAL HG13 H 1 0.843 0.013 . . . . . . A 47 VAL HG13 . 34864 1 468 . 1 . 1 47 47 VAL HG21 H 1 1.044 0.007 . . . . . . A 47 VAL HG21 . 34864 1 469 . 1 . 1 47 47 VAL HG22 H 1 1.044 0.007 . . . . . . A 47 VAL HG22 . 34864 1 470 . 1 . 1 47 47 VAL HG23 H 1 1.044 0.007 . . . . . . A 47 VAL HG23 . 34864 1 471 . 1 . 1 47 47 VAL CA C 13 63.682 0.073 . . . . . . A 47 VAL CA . 34864 1 472 . 1 . 1 47 47 VAL CB C 13 28.529 0.050 . . . . . . A 47 VAL CB . 34864 1 473 . 1 . 1 47 47 VAL CG2 C 13 19.167 0.027 . . . . . . A 47 VAL CG2 . 34864 1 474 . 1 . 1 47 47 VAL N N 15 121.607 0.063 . . . . . . A 47 VAL N . 34864 1 475 . 1 . 1 48 48 ARG H H 1 8.071 0.003 . . . . . . A 48 ARG H . 34864 1 476 . 1 . 1 48 48 ARG HA H 1 3.962 0.005 . . . . . . A 48 ARG HA . 34864 1 477 . 1 . 1 48 48 ARG HB2 H 1 2.172 0.011 . . . . . . A 48 ARG HB2 . 34864 1 478 . 1 . 1 48 48 ARG HB3 H 1 1.655 0.007 . . . . . . A 48 ARG HB3 . 34864 1 479 . 1 . 1 48 48 ARG HG2 H 1 1.518 0.005 . . . . . . A 48 ARG HG2 . 34864 1 480 . 1 . 1 48 48 ARG HG3 H 1 1.657 0.005 . . . . . . A 48 ARG HG3 . 34864 1 481 . 1 . 1 48 48 ARG HD2 H 1 3.039 0.008 . . . . . . A 48 ARG HD2 . 34864 1 482 . 1 . 1 48 48 ARG HD3 H 1 3.119 0.000 . . . . . . A 48 ARG HD3 . 34864 1 483 . 1 . 1 48 48 ARG CA C 13 57.482 0.014 . . . . . . A 48 ARG CA . 34864 1 484 . 1 . 1 48 48 ARG CB C 13 25.830 0.007 . . . . . . A 48 ARG CB . 34864 1 485 . 1 . 1 48 48 ARG N N 15 124.467 0.032 . . . . . . A 48 ARG N . 34864 1 486 . 1 . 1 49 49 GLN H H 1 8.985 0.003 . . . . . . A 49 GLN H . 34864 1 487 . 1 . 1 49 49 GLN HA H 1 4.084 0.004 . . . . . . A 49 GLN HA . 34864 1 488 . 1 . 1 49 49 GLN HB2 H 1 2.035 0.013 . . . . . . A 49 GLN HB2 . 34864 1 489 . 1 . 1 49 49 GLN HB3 H 1 2.237 0.010 . . . . . . A 49 GLN HB3 . 34864 1 490 . 1 . 1 49 49 GLN HG2 H 1 2.377 0.003 . . . . . . A 49 GLN HG2 . 34864 1 491 . 1 . 1 49 49 GLN HG3 H 1 2.469 0.013 . . . . . . A 49 GLN HG3 . 34864 1 492 . 1 . 1 49 49 GLN HE21 H 1 7.293 0.002 . . . . . . A 49 GLN HE21 . 34864 1 493 . 1 . 1 49 49 GLN HE22 H 1 6.772 0.002 . . . . . . A 49 GLN HE22 . 34864 1 494 . 1 . 1 49 49 GLN CA C 13 56.628 0.004 . . . . . . A 49 GLN CA . 34864 1 495 . 1 . 1 49 49 GLN CB C 13 25.372 0.023 . . . . . . A 49 GLN CB . 34864 1 496 . 1 . 1 49 49 GLN N N 15 119.792 0.068 . . . . . . A 49 GLN N . 34864 1 497 . 1 . 1 49 49 GLN NE2 N 15 111.052 0.025 . . . . . . A 49 GLN NE2 . 34864 1 498 . 1 . 1 50 50 ASN H H 1 8.087 0.005 . . . . . . A 50 ASN H . 34864 1 499 . 1 . 1 50 50 ASN HA H 1 4.445 0.012 . . . . . . A 50 ASN HA . 34864 1 500 . 1 . 1 50 50 ASN HB2 H 1 3.145 0.018 . . . . . . A 50 ASN HB2 . 34864 1 501 . 1 . 1 50 50 ASN HB3 H 1 2.853 0.004 . . . . . . A 50 ASN HB3 . 34864 1 502 . 1 . 1 50 50 ASN HD21 H 1 7.459 0.002 . . . . . . A 50 ASN HD21 . 34864 1 503 . 1 . 1 50 50 ASN HD22 H 1 6.788 0.003 . . . . . . A 50 ASN HD22 . 34864 1 504 . 1 . 1 50 50 ASN CA C 13 53.509 0.030 . . . . . . A 50 ASN CA . 34864 1 505 . 1 . 1 50 50 ASN CB C 13 35.398 0.028 . . . . . . A 50 ASN CB . 34864 1 506 . 1 . 1 50 50 ASN N N 15 120.050 0.009 . . . . . . A 50 ASN N . 34864 1 507 . 1 . 1 50 50 ASN ND2 N 15 109.497 0.028 . . . . . . A 50 ASN ND2 . 34864 1 508 . 1 . 1 51 51 GLY H H 1 8.197 0.002 . . . . . . A 51 GLY H . 34864 1 509 . 1 . 1 51 51 GLY HA2 H 1 3.659 0.014 . . . . . . A 51 GLY HA2 . 34864 1 510 . 1 . 1 51 51 GLY HA3 H 1 4.081 0.007 . . . . . . A 51 GLY HA3 . 34864 1 511 . 1 . 1 51 51 GLY CA C 13 44.795 0.026 . . . . . . A 51 GLY CA . 34864 1 512 . 1 . 1 51 51 GLY N N 15 108.641 0.042 . . . . . . A 51 GLY N . 34864 1 513 . 1 . 1 52 52 ASP H H 1 8.411 0.004 . . . . . . A 52 ASP H . 34864 1 514 . 1 . 1 52 52 ASP HA H 1 4.404 0.015 . . . . . . A 52 ASP HA . 34864 1 515 . 1 . 1 52 52 ASP HB2 H 1 2.868 0.003 . . . . . . A 52 ASP HB2 . 34864 1 516 . 1 . 1 52 52 ASP HB3 H 1 2.568 0.015 . . . . . . A 52 ASP HB3 . 34864 1 517 . 1 . 1 52 52 ASP CA C 13 55.156 0.020 . . . . . . A 52 ASP CA . 34864 1 518 . 1 . 1 52 52 ASP CB C 13 37.529 0.068 . . . . . . A 52 ASP CB . 34864 1 519 . 1 . 1 52 52 ASP N N 15 122.825 0.020 . . . . . . A 52 ASP N . 34864 1 520 . 1 . 1 53 53 GLN H H 1 7.899 0.009 . . . . . . A 53 GLN H . 34864 1 521 . 1 . 1 53 53 GLN HA H 1 4.073 0.003 . . . . . . A 53 GLN HA . 34864 1 522 . 1 . 1 53 53 GLN HB2 H 1 2.203 0.004 . . . . . . A 53 GLN HB2 . 34864 1 523 . 1 . 1 53 53 GLN HB3 H 1 2.336 0.014 . . . . . . A 53 GLN HB3 . 34864 1 524 . 1 . 1 53 53 GLN HG2 H 1 2.526 0.005 . . . . . . A 53 GLN HG2 . 34864 1 525 . 1 . 1 53 53 GLN HG3 H 1 2.864 0.001 . . . . . . A 53 GLN HG3 . 34864 1 526 . 1 . 1 53 53 GLN CA C 13 56.347 0.004 . . . . . . A 53 GLN CA . 34864 1 527 . 1 . 1 53 53 GLN CB C 13 25.610 0.081 . . . . . . A 53 GLN CB . 34864 1 528 . 1 . 1 53 53 GLN N N 15 120.424 0.093 . . . . . . A 53 GLN N . 34864 1 529 . 1 . 1 54 54 ILE H H 1 7.704 0.004 . . . . . . A 54 ILE H . 34864 1 530 . 1 . 1 54 54 ILE HA H 1 3.478 0.010 . . . . . . A 54 ILE HA . 34864 1 531 . 1 . 1 54 54 ILE HB H 1 2.071 0.011 . . . . . . A 54 ILE HB . 34864 1 532 . 1 . 1 54 54 ILE HG12 H 1 1.503 0.002 . . . . . . A 54 ILE HG12 . 34864 1 533 . 1 . 1 54 54 ILE HG13 H 1 1.574 0.000 . . . . . . A 54 ILE HG13 . 34864 1 534 . 1 . 1 54 54 ILE HG21 H 1 0.852 0.000 . . . . . . A 54 ILE HG21 . 34864 1 535 . 1 . 1 54 54 ILE HG22 H 1 0.852 0.000 . . . . . . A 54 ILE HG22 . 34864 1 536 . 1 . 1 54 54 ILE HG23 H 1 0.852 0.000 . . . . . . A 54 ILE HG23 . 34864 1 537 . 1 . 1 54 54 ILE HD11 H 1 0.720 0.001 . . . . . . A 54 ILE HD11 . 34864 1 538 . 1 . 1 54 54 ILE HD12 H 1 0.720 0.001 . . . . . . A 54 ILE HD12 . 34864 1 539 . 1 . 1 54 54 ILE HD13 H 1 0.720 0.001 . . . . . . A 54 ILE HD13 . 34864 1 540 . 1 . 1 54 54 ILE CA C 13 63.435 0.046 . . . . . . A 54 ILE CA . 34864 1 541 . 1 . 1 54 54 ILE CB C 13 35.521 0.062 . . . . . . A 54 ILE CB . 34864 1 542 . 1 . 1 54 54 ILE N N 15 119.759 0.037 . . . . . . A 54 ILE N . 34864 1 543 . 1 . 1 55 55 ILE H H 1 7.903 0.002 . . . . . . A 55 ILE H . 34864 1 544 . 1 . 1 55 55 ILE HA H 1 3.347 0.007 . . . . . . A 55 ILE HA . 34864 1 545 . 1 . 1 55 55 ILE HB H 1 1.962 0.008 . . . . . . A 55 ILE HB . 34864 1 546 . 1 . 1 55 55 ILE HG12 H 1 0.941 0.000 . . . . . . A 55 ILE HG12 . 34864 1 547 . 1 . 1 55 55 ILE HG21 H 1 0.861 0.014 . . . . . . A 55 ILE HG21 . 34864 1 548 . 1 . 1 55 55 ILE HG22 H 1 0.861 0.014 . . . . . . A 55 ILE HG22 . 34864 1 549 . 1 . 1 55 55 ILE HG23 H 1 0.861 0.014 . . . . . . A 55 ILE HG23 . 34864 1 550 . 1 . 1 55 55 ILE HD11 H 1 0.719 0.022 . . . . . . A 55 ILE HD11 . 34864 1 551 . 1 . 1 55 55 ILE HD12 H 1 0.719 0.022 . . . . . . A 55 ILE HD12 . 34864 1 552 . 1 . 1 55 55 ILE HD13 H 1 0.719 0.022 . . . . . . A 55 ILE HD13 . 34864 1 553 . 1 . 1 55 55 ILE CA C 13 63.606 0.089 . . . . . . A 55 ILE CA . 34864 1 554 . 1 . 1 55 55 ILE CB C 13 35.126 0.055 . . . . . . A 55 ILE CB . 34864 1 555 . 1 . 1 55 55 ILE N N 15 118.339 0.015 . . . . . . A 55 ILE N . 34864 1 556 . 1 . 1 56 56 GLN H H 1 7.734 0.003 . . . . . . A 56 GLN H . 34864 1 557 . 1 . 1 56 56 GLN HA H 1 4.015 0.007 . . . . . . A 56 GLN HA . 34864 1 558 . 1 . 1 56 56 GLN HB2 H 1 2.101 0.006 . . . . . . A 56 GLN HB2 . 34864 1 559 . 1 . 1 56 56 GLN HB3 H 1 1.963 0.002 . . . . . . A 56 GLN HB3 . 34864 1 560 . 1 . 1 56 56 GLN HG2 H 1 2.292 0.019 . . . . . . A 56 GLN HG2 . 34864 1 561 . 1 . 1 56 56 GLN HG3 H 1 2.403 0.000 . . . . . . A 56 GLN HG3 . 34864 1 562 . 1 . 1 56 56 GLN HE21 H 1 7.531 0.001 . . . . . . A 56 GLN HE21 . 34864 1 563 . 1 . 1 56 56 GLN HE22 H 1 6.679 0.002 . . . . . . A 56 GLN HE22 . 34864 1 564 . 1 . 1 56 56 GLN CA C 13 56.754 0.104 . . . . . . A 56 GLN CA . 34864 1 565 . 1 . 1 56 56 GLN CB C 13 25.506 0.017 . . . . . . A 56 GLN CB . 34864 1 566 . 1 . 1 56 56 GLN N N 15 117.895 0.085 . . . . . . A 56 GLN N . 34864 1 567 . 1 . 1 56 56 GLN NE2 N 15 111.759 0.002 . . . . . . A 56 GLN NE2 . 34864 1 568 . 1 . 1 57 57 ILE H H 1 7.742 0.006 . . . . . . A 57 ILE H . 34864 1 569 . 1 . 1 57 57 ILE HA H 1 3.790 0.014 . . . . . . A 57 ILE HA . 34864 1 570 . 1 . 1 57 57 ILE HB H 1 1.829 0.012 . . . . . . A 57 ILE HB . 34864 1 571 . 1 . 1 57 57 ILE HG12 H 1 1.122 0.014 . . . . . . A 57 ILE HG12 . 34864 1 572 . 1 . 1 57 57 ILE HG21 H 1 0.903 0.006 . . . . . . A 57 ILE HG21 . 34864 1 573 . 1 . 1 57 57 ILE HG22 H 1 0.903 0.006 . . . . . . A 57 ILE HG22 . 34864 1 574 . 1 . 1 57 57 ILE HG23 H 1 0.903 0.006 . . . . . . A 57 ILE HG23 . 34864 1 575 . 1 . 1 57 57 ILE HD11 H 1 0.780 0.014 . . . . . . A 57 ILE HD11 . 34864 1 576 . 1 . 1 57 57 ILE HD12 H 1 0.780 0.014 . . . . . . A 57 ILE HD12 . 34864 1 577 . 1 . 1 57 57 ILE HD13 H 1 0.780 0.014 . . . . . . A 57 ILE HD13 . 34864 1 578 . 1 . 1 57 57 ILE CA C 13 62.068 0.076 . . . . . . A 57 ILE CA . 34864 1 579 . 1 . 1 57 57 ILE CB C 13 35.530 0.095 . . . . . . A 57 ILE CB . 34864 1 580 . 1 . 1 57 57 ILE CG1 C 13 26.058 0.018 . . . . . . A 57 ILE CG1 . 34864 1 581 . 1 . 1 57 57 ILE CD1 C 13 10.840 0.029 . . . . . . A 57 ILE CD1 . 34864 1 582 . 1 . 1 57 57 ILE N N 15 118.702 0.039 . . . . . . A 57 ILE N . 34864 1 583 . 1 . 1 58 58 LEU H H 1 8.283 0.003 . . . . . . A 58 LEU H . 34864 1 584 . 1 . 1 58 58 LEU HA H 1 3.875 0.013 . . . . . . A 58 LEU HA . 34864 1 585 . 1 . 1 58 58 LEU HB2 H 1 1.149 0.002 . . . . . . A 58 LEU HB2 . 34864 1 586 . 1 . 1 58 58 LEU HB3 H 1 1.927 0.004 . . . . . . A 58 LEU HB3 . 34864 1 587 . 1 . 1 58 58 LEU HD11 H 1 0.765 0.009 . . . . . . A 58 LEU HD11 . 34864 1 588 . 1 . 1 58 58 LEU HD12 H 1 0.765 0.009 . . . . . . A 58 LEU HD12 . 34864 1 589 . 1 . 1 58 58 LEU HD13 H 1 0.765 0.009 . . . . . . A 58 LEU HD13 . 34864 1 590 . 1 . 1 58 58 LEU HD21 H 1 0.906 0.023 . . . . . . A 58 LEU HD21 . 34864 1 591 . 1 . 1 58 58 LEU HD22 H 1 0.906 0.023 . . . . . . A 58 LEU HD22 . 34864 1 592 . 1 . 1 58 58 LEU HD23 H 1 0.906 0.023 . . . . . . A 58 LEU HD23 . 34864 1 593 . 1 . 1 58 58 LEU CA C 13 55.184 0.022 . . . . . . A 58 LEU CA . 34864 1 594 . 1 . 1 58 58 LEU CB C 13 39.876 0.037 . . . . . . A 58 LEU CB . 34864 1 595 . 1 . 1 58 58 LEU N N 15 119.865 0.068 . . . . . . A 58 LEU N . 34864 1 596 . 1 . 1 59 59 ASP H H 1 8.545 0.002 . . . . . . A 59 ASP H . 34864 1 597 . 1 . 1 59 59 ASP HA H 1 4.376 0.007 . . . . . . A 59 ASP HA . 34864 1 598 . 1 . 1 59 59 ASP HB2 H 1 2.650 0.005 . . . . . . A 59 ASP HB2 . 34864 1 599 . 1 . 1 59 59 ASP HB3 H 1 2.200 0.000 . . . . . . A 59 ASP HB3 . 34864 1 600 . 1 . 1 59 59 ASP CA C 13 53.741 0.037 . . . . . . A 59 ASP CA . 34864 1 601 . 1 . 1 59 59 ASP CB C 13 39.150 0.022 . . . . . . A 59 ASP CB . 34864 1 602 . 1 . 1 59 59 ASP N N 15 118.415 0.034 . . . . . . A 59 ASP N . 34864 1 603 . 1 . 1 60 60 GLU H H 1 7.996 0.002 . . . . . . A 60 GLU H . 34864 1 604 . 1 . 1 60 60 GLU HA H 1 4.137 0.002 . . . . . . A 60 GLU HA . 34864 1 605 . 1 . 1 60 60 GLU HB2 H 1 2.049 0.020 . . . . . . A 60 GLU HB2 . 34864 1 606 . 1 . 1 60 60 GLU HB3 H 1 1.985 0.000 . . . . . . A 60 GLU HB3 . 34864 1 607 . 1 . 1 60 60 GLU HG2 H 1 2.429 0.011 . . . . . . A 60 GLU HG2 . 34864 1 608 . 1 . 1 60 60 GLU CA C 13 55.560 0.033 . . . . . . A 60 GLU CA . 34864 1 609 . 1 . 1 60 60 GLU CB C 13 28.068 0.090 . . . . . . A 60 GLU CB . 34864 1 610 . 1 . 1 60 60 GLU N N 15 117.526 0.076 . . . . . . A 60 GLU N . 34864 1 611 . 1 . 1 61 61 GLU H H 1 8.545 0.001 . . . . . . A 61 GLU H . 34864 1 612 . 1 . 1 61 61 GLU HA H 1 4.397 0.003 . . . . . . A 61 GLU HA . 34864 1 613 . 1 . 1 61 61 GLU HB2 H 1 2.008 0.006 . . . . . . A 61 GLU HB2 . 34864 1 614 . 1 . 1 61 61 GLU HB3 H 1 2.197 0.026 . . . . . . A 61 GLU HB3 . 34864 1 615 . 1 . 1 61 61 GLU HG2 H 1 2.415 0.000 . . . . . . A 61 GLU HG2 . 34864 1 616 . 1 . 1 61 61 GLU CA C 13 54.154 0.009 . . . . . . A 61 GLU CA . 34864 1 617 . 1 . 1 61 61 GLU CB C 13 28.349 0.011 . . . . . . A 61 GLU CB . 34864 1 618 . 1 . 1 61 61 GLU N N 15 117.754 0.136 . . . . . . A 61 GLU N . 34864 1 619 . 1 . 1 62 62 GLY H H 1 8.088 0.002 . . . . . . A 62 GLY H . 34864 1 620 . 1 . 1 62 62 GLY HA2 H 1 4.118 0.004 . . . . . . A 62 GLY HA2 . 34864 1 621 . 1 . 1 62 62 GLY HA3 H 1 3.869 0.005 . . . . . . A 62 GLY HA3 . 34864 1 622 . 1 . 1 62 62 GLY CA C 13 42.452 0.026 . . . . . . A 62 GLY CA . 34864 1 623 . 1 . 1 62 62 GLY N N 15 108.802 0.019 . . . . . . A 62 GLY N . 34864 1 624 . 1 . 1 63 63 ILE H H 1 8.114 0.005 . . . . . . A 63 ILE H . 34864 1 625 . 1 . 1 63 63 ILE HA H 1 4.630 0.004 . . . . . . A 63 ILE HA . 34864 1 626 . 1 . 1 63 63 ILE HB H 1 1.649 0.002 . . . . . . A 63 ILE HB . 34864 1 627 . 1 . 1 63 63 ILE HG12 H 1 1.002 0.011 . . . . . . A 63 ILE HG12 . 34864 1 628 . 1 . 1 63 63 ILE HG13 H 1 1.407 0.005 . . . . . . A 63 ILE HG13 . 34864 1 629 . 1 . 1 63 63 ILE HG21 H 1 0.806 0.014 . . . . . . A 63 ILE HG21 . 34864 1 630 . 1 . 1 63 63 ILE HG22 H 1 0.806 0.014 . . . . . . A 63 ILE HG22 . 34864 1 631 . 1 . 1 63 63 ILE HG23 H 1 0.806 0.014 . . . . . . A 63 ILE HG23 . 34864 1 632 . 1 . 1 63 63 ILE HD11 H 1 0.734 0.015 . . . . . . A 63 ILE HD11 . 34864 1 633 . 1 . 1 63 63 ILE HD12 H 1 0.734 0.015 . . . . . . A 63 ILE HD12 . 34864 1 634 . 1 . 1 63 63 ILE HD13 H 1 0.734 0.015 . . . . . . A 63 ILE HD13 . 34864 1 635 . 1 . 1 63 63 ILE CA C 13 56.589 0.035 . . . . . . A 63 ILE CA . 34864 1 636 . 1 . 1 63 63 ILE CB C 13 37.498 0.070 . . . . . . A 63 ILE CB . 34864 1 637 . 1 . 1 63 63 ILE CG1 C 13 25.069 0.040 . . . . . . A 63 ILE CG1 . 34864 1 638 . 1 . 1 63 63 ILE N N 15 117.765 0.055 . . . . . . A 63 ILE N . 34864 1 639 . 1 . 1 64 64 ALA H H 1 8.372 0.002 . . . . . . A 64 ALA H . 34864 1 640 . 1 . 1 64 64 ALA HA H 1 4.368 0.004 . . . . . . A 64 ALA HA . 34864 1 641 . 1 . 1 64 64 ALA HB1 H 1 1.264 0.002 . . . . . . A 64 ALA HB1 . 34864 1 642 . 1 . 1 64 64 ALA HB2 H 1 1.264 0.002 . . . . . . A 64 ALA HB2 . 34864 1 643 . 1 . 1 64 64 ALA HB3 H 1 1.264 0.002 . . . . . . A 64 ALA HB3 . 34864 1 644 . 1 . 1 64 64 ALA CA C 13 49.121 0.023 . . . . . . A 64 ALA CA . 34864 1 645 . 1 . 1 64 64 ALA CB C 13 17.430 0.014 . . . . . . A 64 ALA CB . 34864 1 646 . 1 . 1 64 64 ALA N N 15 129.832 0.035 . . . . . . A 64 ALA N . 34864 1 647 . 1 . 1 65 65 GLU H H 1 8.041 0.005 . . . . . . A 65 GLU H . 34864 1 648 . 1 . 1 65 65 GLU HA H 1 4.037 0.001 . . . . . . A 65 GLU HA . 34864 1 649 . 1 . 1 65 65 GLU HB2 H 1 1.886 0.021 . . . . . . A 65 GLU HB2 . 34864 1 650 . 1 . 1 65 65 GLU HB3 H 1 2.000 0.000 . . . . . . A 65 GLU HB3 . 34864 1 651 . 1 . 1 65 65 GLU HG2 H 1 2.203 0.000 . . . . . . A 65 GLU HG2 . 34864 1 652 . 1 . 1 65 65 GLU CA C 13 55.745 0.050 . . . . . . A 65 GLU CA . 34864 1 653 . 1 . 1 65 65 GLU CB C 13 28.331 0.021 . . . . . . A 65 GLU CB . 34864 1 654 . 1 . 1 65 65 GLU N N 15 125.760 0.026 . . . . . . A 65 GLU N . 34864 1 stop_ save_