################################### # 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 34981 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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' . . . 34981 1 2 '3D 1H-15N NOESY' . . . 34981 1 3 '3D 1H-15N TOCSY' . . . 34981 1 4 '2D 1H-13C HSQC' . . . 34981 1 5 '2D 1H-13C TROSY aromatic' . . . 34981 1 6 '3D 1H-13C NOESY aliphatic' . . . 34981 1 7 '3D 1H-13C NOESY aromatic' . . . 34981 1 8 '3D HNCACB' . . . 34981 1 9 '3D HNCO' . . . 34981 1 10 '3D HN(COC)C(H)' . . . 34981 1 11 '3D HN(COCC)H' . . . 34981 1 12 '3D HNHA' . . . 34981 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 1 1 GLY H H 1 7.812 0.000 . . . . . . A 1 GLY H2 . 34981 1 2 . 1 . 1 1 1 GLY N N 15 109.243 0.000 . 1 . . . . A 1 GLY N . 34981 1 3 . 1 . 1 2 2 ILE H H 1 7.778 0.000 . 1 . . . . A 2 ILE H . 34981 1 4 . 1 . 1 2 2 ILE HA H 1 4.120 0.002 . 1 . . . . A 2 ILE HA . 34981 1 5 . 1 . 1 2 2 ILE HB H 1 1.737 0.004 . 1 . . . . A 2 ILE HB . 34981 1 6 . 1 . 1 2 2 ILE HG12 H 1 1.349 0.002 . 2 . . . . A 2 ILE HG12 . 34981 1 7 . 1 . 1 2 2 ILE HG13 H 1 1.083 0.005 . 2 . . . . A 2 ILE HG13 . 34981 1 8 . 1 . 1 2 2 ILE HG21 H 1 0.795 0.002 . 1 . . . . A 2 ILE HG21 . 34981 1 9 . 1 . 1 2 2 ILE HG22 H 1 0.795 0.002 . 1 . . . . A 2 ILE HG22 . 34981 1 10 . 1 . 1 2 2 ILE HG23 H 1 0.795 0.002 . 1 . . . . A 2 ILE HG23 . 34981 1 11 . 1 . 1 2 2 ILE HD11 H 1 0.793 0.004 . 1 . . . . A 2 ILE HD11 . 34981 1 12 . 1 . 1 2 2 ILE HD12 H 1 0.793 0.004 . 1 . . . . A 2 ILE HD12 . 34981 1 13 . 1 . 1 2 2 ILE HD13 H 1 0.793 0.004 . 1 . . . . A 2 ILE HD13 . 34981 1 14 . 1 . 1 2 2 ILE CA C 13 60.714 0.081 . 1 . . . . A 2 ILE CA . 34981 1 15 . 1 . 1 2 2 ILE CB C 13 38.795 0.029 . 1 . . . . A 2 ILE CB . 34981 1 16 . 1 . 1 2 2 ILE CG1 C 13 26.923 0.024 . 1 . . . . A 2 ILE CG1 . 34981 1 17 . 1 . 1 2 2 ILE CG2 C 13 17.269 0.002 . 1 . . . . A 2 ILE CG2 . 34981 1 18 . 1 . 1 2 2 ILE CD1 C 13 13.040 0.059 . 1 . . . . A 2 ILE CD1 . 34981 1 19 . 1 . 1 2 2 ILE N N 15 119.371 0.000 . 1 . . . . A 2 ILE N . 34981 1 20 . 1 . 1 3 3 ASP H H 1 8.367 0.001 . 1 . . . . A 3 ASP H . 34981 1 21 . 1 . 1 3 3 ASP HA H 1 4.792 0.005 . 1 . . . . A 3 ASP HA . 34981 1 22 . 1 . 1 3 3 ASP HB2 H 1 2.656 0.002 . 2 . . . . A 3 ASP HB2 . 34981 1 23 . 1 . 1 3 3 ASP HB3 H 1 2.469 0.003 . 2 . . . . A 3 ASP HB3 . 34981 1 24 . 1 . 1 3 3 ASP CB C 13 41.033 0.012 . 1 . . . . A 3 ASP CB . 34981 1 25 . 1 . 1 3 3 ASP N N 15 126.186 0.012 . 1 . . . . A 3 ASP N . 34981 1 26 . 1 . 1 4 4 PRO HA H 1 4.245 0.004 . 1 . . . . A 4 PRO HA . 34981 1 27 . 1 . 1 4 4 PRO HB3 H 1 2.076 0.002 . 2 . . . . A 4 PRO HB3 . 34981 1 28 . 1 . 1 4 4 PRO HG2 H 1 1.561 0.008 . 2 . . . . A 4 PRO HG2 . 34981 1 29 . 1 . 1 4 4 PRO HG3 H 1 1.621 0.013 . 2 . . . . A 4 PRO HG3 . 34981 1 30 . 1 . 1 4 4 PRO HD2 H 1 3.666 0.001 . 2 . . . . A 4 PRO HD2 . 34981 1 31 . 1 . 1 4 4 PRO HD3 H 1 3.789 0.001 . 2 . . . . A 4 PRO HD3 . 34981 1 32 . 1 . 1 4 4 PRO CA C 13 63.296 0.033 . 1 . . . . A 4 PRO CA . 34981 1 33 . 1 . 1 4 4 PRO CB C 13 31.776 0.019 . 1 . . . . A 4 PRO CB . 34981 1 34 . 1 . 1 4 4 PRO CG C 13 26.504 0.009 . 1 . . . . A 4 PRO CG . 34981 1 35 . 1 . 1 4 4 PRO CD C 13 50.609 0.010 . 1 . . . . A 4 PRO CD . 34981 1 36 . 1 . 1 5 5 PHE H H 1 8.103 0.005 . 1 . . . . A 5 PHE H . 34981 1 37 . 1 . 1 5 5 PHE HA H 1 4.552 0.003 . 1 . . . . A 5 PHE HA . 34981 1 38 . 1 . 1 5 5 PHE HB2 H 1 2.993 0.003 . 2 . . . . A 5 PHE HB2 . 34981 1 39 . 1 . 1 5 5 PHE HB3 H 1 3.131 0.003 . 2 . . . . A 5 PHE HB3 . 34981 1 40 . 1 . 1 5 5 PHE HD1 H 1 7.220 0.004 . 3 . . . . A 5 PHE HD1 . 34981 1 41 . 1 . 1 5 5 PHE HD2 H 1 7.220 0.004 . 3 . . . . A 5 PHE HD2 . 34981 1 42 . 1 . 1 5 5 PHE HE1 H 1 7.229 0.000 . 3 . . . . A 5 PHE HE1 . 34981 1 43 . 1 . 1 5 5 PHE HE2 H 1 7.229 0.000 . 3 . . . . A 5 PHE HE2 . 34981 1 44 . 1 . 1 5 5 PHE HZ H 1 7.286 0.000 . 1 . . . . A 5 PHE HZ . 34981 1 45 . 1 . 1 5 5 PHE CA C 13 57.616 0.027 . 1 . . . . A 5 PHE CA . 34981 1 46 . 1 . 1 5 5 PHE CB C 13 38.812 0.043 . 1 . . . . A 5 PHE CB . 34981 1 47 . 1 . 1 5 5 PHE CD1 C 13 134.217 0.000 . 3 . . . . A 5 PHE CD1 . 34981 1 48 . 1 . 1 5 5 PHE CD2 C 13 134.217 0.000 . 3 . . . . A 5 PHE CD2 . 34981 1 49 . 1 . 1 5 5 PHE CE1 C 13 132.219 0.000 . 3 . . . . A 5 PHE CE1 . 34981 1 50 . 1 . 1 5 5 PHE CE2 C 13 132.219 0.000 . 3 . . . . A 5 PHE CE2 . 34981 1 51 . 1 . 1 5 5 PHE CZ C 13 133.876 0.000 . 1 . . . . A 5 PHE CZ . 34981 1 52 . 1 . 1 5 5 PHE N N 15 118.423 0.009 . 1 . . . . A 5 PHE N . 34981 1 53 . 1 . 1 6 6 THR H H 1 7.806 0.005 . 1 . . . . A 6 THR H . 34981 1 54 . 1 . 1 6 6 THR HA H 1 4.208 0.003 . 1 . . . . A 6 THR HA . 34981 1 55 . 1 . 1 6 6 THR HB H 1 4.038 0.006 . 1 . . . . A 6 THR HB . 34981 1 56 . 1 . 1 6 6 THR HG21 H 1 1.065 0.003 . 1 . . . . A 6 THR HG21 . 34981 1 57 . 1 . 1 6 6 THR HG22 H 1 1.065 0.003 . 1 . . . . A 6 THR HG22 . 34981 1 58 . 1 . 1 6 6 THR HG23 H 1 1.065 0.003 . 1 . . . . A 6 THR HG23 . 34981 1 59 . 1 . 1 6 6 THR CA C 13 61.716 0.028 . 1 . . . . A 6 THR CA . 34981 1 60 . 1 . 1 6 6 THR CB C 13 69.728 0.047 . 1 . . . . A 6 THR CB . 34981 1 61 . 1 . 1 6 6 THR CG2 C 13 21.417 0.046 . 1 . . . . A 6 THR CG2 . 34981 1 62 . 1 . 1 6 6 THR N N 15 115.708 0.035 . 1 . . . . A 6 THR N . 34981 1 63 . 1 . 1 7 7 ILE H H 1 7.872 0.008 . 1 . . . . A 7 ILE H . 34981 1 64 . 1 . 1 7 7 ILE HA H 1 3.947 0.003 . 1 . . . . A 7 ILE HA . 34981 1 65 . 1 . 1 7 7 ILE HB H 1 1.579 0.007 . 1 . . . . A 7 ILE HB . 34981 1 66 . 1 . 1 7 7 ILE HG12 H 1 1.403 0.005 . 2 . . . . A 7 ILE HG12 . 34981 1 67 . 1 . 1 7 7 ILE HG13 H 1 1.009 0.004 . 2 . . . . A 7 ILE HG13 . 34981 1 68 . 1 . 1 7 7 ILE HG21 H 1 0.633 0.005 . 1 . . . . A 7 ILE HG21 . 34981 1 69 . 1 . 1 7 7 ILE HG22 H 1 0.633 0.005 . 1 . . . . A 7 ILE HG22 . 34981 1 70 . 1 . 1 7 7 ILE HG23 H 1 0.633 0.005 . 1 . . . . A 7 ILE HG23 . 34981 1 71 . 1 . 1 7 7 ILE HD11 H 1 0.785 0.006 . 1 . . . . A 7 ILE HD11 . 34981 1 72 . 1 . 1 7 7 ILE HD12 H 1 0.785 0.006 . 1 . . . . A 7 ILE HD12 . 34981 1 73 . 1 . 1 7 7 ILE HD13 H 1 0.785 0.006 . 1 . . . . A 7 ILE HD13 . 34981 1 74 . 1 . 1 7 7 ILE CA C 13 60.274 0.059 . 1 . . . . A 7 ILE CA . 34981 1 75 . 1 . 1 7 7 ILE CB C 13 39.016 0.049 . 1 . . . . A 7 ILE CB . 34981 1 76 . 1 . 1 7 7 ILE CG1 C 13 27.254 0.022 . 1 . . . . A 7 ILE CG1 . 34981 1 77 . 1 . 1 7 7 ILE CG2 C 13 17.046 0.037 . 1 . . . . A 7 ILE CG2 . 34981 1 78 . 1 . 1 7 7 ILE CD1 C 13 12.888 0.032 . 1 . . . . A 7 ILE CD1 . 34981 1 79 . 1 . 1 7 7 ILE N N 15 124.929 0.028 . 1 . . . . A 7 ILE N . 34981 1 80 . 1 . 1 8 8 GLU H H 1 8.330 0.003 . 1 . . . . A 8 GLU H . 34981 1 81 . 1 . 1 8 8 GLU HA H 1 4.352 0.003 . 1 . . . . A 8 GLU HA . 34981 1 82 . 1 . 1 8 8 GLU HB2 H 1 1.779 0.001 . 2 . . . . A 8 GLU HB2 . 34981 1 83 . 1 . 1 8 8 GLU HG2 H 1 2.099 0.003 . 2 . . . . A 8 GLU HG2 . 34981 1 84 . 1 . 1 8 8 GLU CA C 13 53.973 0.023 . 1 . . . . A 8 GLU CA . 34981 1 85 . 1 . 1 8 8 GLU CB C 13 29.441 0.015 . 1 . . . . A 8 GLU CB . 34981 1 86 . 1 . 1 8 8 GLU CG C 13 35.339 0.010 . 1 . . . . A 8 GLU CG . 34981 1 87 . 1 . 1 8 8 GLU N N 15 127.859 0.015 . 1 . . . . A 8 GLU N . 34981 1 88 . 1 . 1 9 9 PRO HA H 1 4.722 0.015 . 1 . . . . A 9 PRO HA . 34981 1 89 . 1 . 1 9 9 PRO HB2 H 1 1.872 0.013 . 2 . . . . A 9 PRO HB2 . 34981 1 90 . 1 . 1 9 9 PRO HB3 H 1 2.113 0.008 . 2 . . . . A 9 PRO HB3 . 34981 1 91 . 1 . 1 9 9 PRO HG2 H 1 1.820 0.008 . 2 . . . . A 9 PRO HG2 . 34981 1 92 . 1 . 1 9 9 PRO HG3 H 1 2.134 0.003 . 2 . . . . A 9 PRO HG3 . 34981 1 93 . 1 . 1 9 9 PRO HD2 H 1 3.563 0.004 . 2 . . . . A 9 PRO HD2 . 34981 1 94 . 1 . 1 9 9 PRO HD3 H 1 3.877 0.010 . 2 . . . . A 9 PRO HD3 . 34981 1 95 . 1 . 1 9 9 PRO CA C 13 62.952 0.000 . 1 . . . . A 9 PRO CA . 34981 1 96 . 1 . 1 9 9 PRO CB C 13 31.966 0.061 . 1 . . . . A 9 PRO CB . 34981 1 97 . 1 . 1 9 9 PRO CG C 13 27.431 0.013 . 1 . . . . A 9 PRO CG . 34981 1 98 . 1 . 1 9 9 PRO CD C 13 51.084 0.022 . 1 . . . . A 9 PRO CD . 34981 1 99 . 1 . 1 10 10 ALA H H 1 6.927 0.003 . 1 . . . . A 10 ALA H . 34981 1 100 . 1 . 1 10 10 ALA HA H 1 3.961 0.003 . 1 . . . . A 10 ALA HA . 34981 1 101 . 1 . 1 10 10 ALA HB1 H 1 1.023 0.002 . 1 . . . . A 10 ALA HB1 . 34981 1 102 . 1 . 1 10 10 ALA HB2 H 1 1.023 0.002 . 1 . . . . A 10 ALA HB2 . 34981 1 103 . 1 . 1 10 10 ALA HB3 H 1 1.023 0.002 . 1 . . . . A 10 ALA HB3 . 34981 1 104 . 1 . 1 10 10 ALA CA C 13 51.551 0.035 . 1 . . . . A 10 ALA CA . 34981 1 105 . 1 . 1 10 10 ALA CB C 13 21.515 0.032 . 1 . . . . A 10 ALA CB . 34981 1 106 . 1 . 1 10 10 ALA N N 15 124.397 0.018 . 1 . . . . A 10 ALA N . 34981 1 107 . 1 . 1 11 11 TRP H H 1 8.615 0.003 . 1 . . . . A 11 TRP H . 34981 1 108 . 1 . 1 11 11 TRP HA H 1 4.591 0.007 . 1 . . . . A 11 TRP HA . 34981 1 109 . 1 . 1 11 11 TRP HB2 H 1 2.590 0.008 . 2 . . . . A 11 TRP HB2 . 34981 1 110 . 1 . 1 11 11 TRP HB3 H 1 2.341 0.003 . 2 . . . . A 11 TRP HB3 . 34981 1 111 . 1 . 1 11 11 TRP HD1 H 1 6.900 0.009 . 1 . . . . A 11 TRP HD1 . 34981 1 112 . 1 . 1 11 11 TRP HE1 H 1 8.649 0.004 . 1 . . . . A 11 TRP HE1 . 34981 1 113 . 1 . 1 11 11 TRP HE3 H 1 7.401 0.004 . 1 . . . . A 11 TRP HE3 . 34981 1 114 . 1 . 1 11 11 TRP HZ2 H 1 6.460 0.002 . 1 . . . . A 11 TRP HZ2 . 34981 1 115 . 1 . 1 11 11 TRP HZ3 H 1 5.945 0.004 . 1 . . . . A 11 TRP HZ3 . 34981 1 116 . 1 . 1 11 11 TRP HH2 H 1 6.645 0.006 . 1 . . . . A 11 TRP HH2 . 34981 1 117 . 1 . 1 11 11 TRP CA C 13 56.890 0.043 . 1 . . . . A 11 TRP CA . 34981 1 118 . 1 . 1 11 11 TRP CB C 13 27.258 0.011 . 1 . . . . A 11 TRP CB . 34981 1 119 . 1 . 1 11 11 TRP CD1 C 13 128.316 0.042 . 1 . . . . A 11 TRP CD1 . 34981 1 120 . 1 . 1 11 11 TRP CE3 C 13 121.493 0.046 . 1 . . . . A 11 TRP CE3 . 34981 1 121 . 1 . 1 11 11 TRP CZ2 C 13 117.040 0.078 . 1 . . . . A 11 TRP CZ2 . 34981 1 122 . 1 . 1 11 11 TRP CZ3 C 13 127.897 0.056 . 1 . . . . A 11 TRP CZ3 . 34981 1 123 . 1 . 1 11 11 TRP CH2 C 13 126.092 0.032 . 1 . . . . A 11 TRP CH2 . 34981 1 124 . 1 . 1 11 11 TRP N N 15 119.885 0.026 . 1 . . . . A 11 TRP N . 34981 1 125 . 1 . 1 11 11 TRP NE1 N 15 124.389 0.016 . 1 . . . . A 11 TRP NE1 . 34981 1 126 . 1 . 1 12 12 GLU H H 1 8.415 0.004 . 1 . . . . A 12 GLU H . 34981 1 127 . 1 . 1 12 12 GLU HA H 1 4.078 0.004 . 1 . . . . A 12 GLU HA . 34981 1 128 . 1 . 1 12 12 GLU HB2 H 1 1.577 0.005 . 2 . . . . A 12 GLU HB2 . 34981 1 129 . 1 . 1 12 12 GLU HB3 H 1 1.835 0.003 . 2 . . . . A 12 GLU HB3 . 34981 1 130 . 1 . 1 12 12 GLU HG2 H 1 1.939 0.003 . 2 . . . . A 12 GLU HG2 . 34981 1 131 . 1 . 1 12 12 GLU HG3 H 1 1.891 0.002 . 2 . . . . A 12 GLU HG3 . 34981 1 132 . 1 . 1 12 12 GLU CA C 13 57.260 0.054 . 1 . . . . A 12 GLU CA . 34981 1 133 . 1 . 1 12 12 GLU CB C 13 31.252 0.041 . 1 . . . . A 12 GLU CB . 34981 1 134 . 1 . 1 12 12 GLU CG C 13 36.280 0.051 . 1 . . . . A 12 GLU CG . 34981 1 135 . 1 . 1 12 12 GLU N N 15 127.024 0.033 . 1 . . . . A 12 GLU N . 34981 1 136 . 1 . 1 13 13 ARG H H 1 7.986 0.003 . 1 . . . . A 13 ARG H . 34981 1 137 . 1 . 1 13 13 ARG HA H 1 4.683 0.006 . 1 . . . . A 13 ARG HA . 34981 1 138 . 1 . 1 13 13 ARG HB2 H 1 1.851 0.004 . 2 . . . . A 13 ARG HB2 . 34981 1 139 . 1 . 1 13 13 ARG HG2 H 1 1.653 0.004 . 2 . . . . A 13 ARG HG2 . 34981 1 140 . 1 . 1 13 13 ARG HG3 H 1 1.609 0.001 . 2 . . . . A 13 ARG HG3 . 34981 1 141 . 1 . 1 13 13 ARG HD2 H 1 3.200 0.003 . 2 . . . . A 13 ARG HD2 . 34981 1 142 . 1 . 1 13 13 ARG CB C 13 32.449 0.081 . 1 . . . . A 13 ARG CB . 34981 1 143 . 1 . 1 13 13 ARG CG C 13 26.840 0.023 . 1 . . . . A 13 ARG CG . 34981 1 144 . 1 . 1 13 13 ARG CD C 13 43.076 0.056 . 1 . . . . A 13 ARG CD . 34981 1 145 . 1 . 1 13 13 ARG N N 15 116.552 0.026 . 1 . . . . A 13 ARG N . 34981 1 146 . 1 . 1 14 14 HIS H H 1 8.823 0.003 . 1 . . . . A 14 HIS H . 34981 1 147 . 1 . 1 14 14 HIS HA H 1 4.184 0.004 . 1 . . . . A 14 HIS HA . 34981 1 148 . 1 . 1 14 14 HIS HB2 H 1 3.255 0.004 . 2 . . . . A 14 HIS HB2 . 34981 1 149 . 1 . 1 14 14 HIS HB3 H 1 2.860 0.005 . 2 . . . . A 14 HIS HB3 . 34981 1 150 . 1 . 1 14 14 HIS HD2 H 1 6.986 0.002 . 1 . . . . A 14 HIS HD2 . 34981 1 151 . 1 . 1 14 14 HIS HE1 H 1 7.916 0.01 . 1 . . . . A 14 HIS HE1 . 34981 1 152 . 1 . 1 14 14 HIS CA C 13 56.745 0.055 . 1 . . . . A 14 HIS CA . 34981 1 153 . 1 . 1 14 14 HIS CB C 13 32.984 0.026 . 1 . . . . A 14 HIS CB . 34981 1 154 . 1 . 1 14 14 HIS CD2 C 13 119.670 0.047 . 1 . . . . A 14 HIS CD2 . 34981 1 155 . 1 . 1 14 14 HIS CE1 C 13 140.864 0.1 . 1 . . . . A 14 HIS CE1 . 34981 1 156 . 1 . 1 14 14 HIS N N 15 124.630 0.016 . 1 . . . . A 14 HIS N . 34981 1 157 . 1 . 1 15 15 LEU H H 1 7.916 0.007 . 1 . . . . A 15 LEU H . 34981 1 158 . 1 . 1 15 15 LEU HA H 1 4.137 0.004 . 1 . . . . A 15 LEU HA . 34981 1 159 . 1 . 1 15 15 LEU HB2 H 1 1.245 0.001 . 2 . . . . A 15 LEU HB2 . 34981 1 160 . 1 . 1 15 15 LEU HB3 H 1 1.246 0.003 . 2 . . . . A 15 LEU HB3 . 34981 1 161 . 1 . 1 15 15 LEU HD11 H 1 0.747 0.005 . 2 . . . . A 15 LEU HD11 . 34981 1 162 . 1 . 1 15 15 LEU HD12 H 1 0.747 0.005 . 2 . . . . A 15 LEU HD12 . 34981 1 163 . 1 . 1 15 15 LEU HD13 H 1 0.747 0.005 . 2 . . . . A 15 LEU HD13 . 34981 1 164 . 1 . 1 15 15 LEU HD21 H 1 0.935 0.003 . 2 . . . . A 15 LEU HD21 . 34981 1 165 . 1 . 1 15 15 LEU HD22 H 1 0.935 0.003 . 2 . . . . A 15 LEU HD22 . 34981 1 166 . 1 . 1 15 15 LEU HD23 H 1 0.935 0.003 . 2 . . . . A 15 LEU HD23 . 34981 1 167 . 1 . 1 15 15 LEU CA C 13 55.553 0.019 . 1 . . . . A 15 LEU CA . 34981 1 168 . 1 . 1 15 15 LEU CB C 13 44.232 0.031 . 1 . . . . A 15 LEU CB . 34981 1 169 . 1 . 1 15 15 LEU CD1 C 13 25.917 0.070 . 2 . . . . A 15 LEU CD1 . 34981 1 170 . 1 . 1 15 15 LEU CD2 C 13 23.654 0.049 . 2 . . . . A 15 LEU CD2 . 34981 1 171 . 1 . 1 15 15 LEU N N 15 121.101 0.019 . 1 . . . . A 15 LEU N . 34981 1 172 . 1 . 1 16 16 GLN H H 1 7.865 0.004 . 1 . . . . A 16 GLN H . 34981 1 173 . 1 . 1 16 16 GLN HA H 1 4.664 0.006 . 1 . . . . A 16 GLN HA . 34981 1 174 . 1 . 1 16 16 GLN HB2 H 1 1.867 0.005 . 2 . . . . A 16 GLN HB2 . 34981 1 175 . 1 . 1 16 16 GLN HB3 H 1 2.110 0.002 . 2 . . . . A 16 GLN HB3 . 34981 1 176 . 1 . 1 16 16 GLN HG2 H 1 2.397 0.011 . 2 . . . . A 16 GLN HG2 . 34981 1 177 . 1 . 1 16 16 GLN HG3 H 1 2.429 0.002 . 2 . . . . A 16 GLN HG3 . 34981 1 178 . 1 . 1 16 16 GLN HE21 H 1 7.459 0.000 . 2 . . . . A 16 GLN HE21 . 34981 1 179 . 1 . 1 16 16 GLN HE22 H 1 6.883 0.001 . 2 . . . . A 16 GLN HE22 . 34981 1 180 . 1 . 1 16 16 GLN CA C 13 53.309 0.000 . 1 . . . . A 16 GLN CA . 34981 1 181 . 1 . 1 16 16 GLN CB C 13 31.998 0.061 . 1 . . . . A 16 GLN CB . 34981 1 182 . 1 . 1 16 16 GLN CG C 13 33.718 0.034 . 1 . . . . A 16 GLN CG . 34981 1 183 . 1 . 1 16 16 GLN N N 15 118.660 0.013 . 1 . . . . A 16 GLN N . 34981 1 184 . 1 . 1 16 16 GLN NE2 N 15 113.158 0.018 . 1 . . . . A 16 GLN NE2 . 34981 1 185 . 1 . 1 17 17 ASP H H 1 8.354 0.006 . 1 . . . . A 17 ASP H . 34981 1 186 . 1 . 1 17 17 ASP HA H 1 4.786 0.005 . 1 . . . . A 17 ASP HA . 34981 1 187 . 1 . 1 17 17 ASP HB2 H 1 2.857 0.007 . 2 . . . . A 17 ASP HB2 . 34981 1 188 . 1 . 1 17 17 ASP HB3 H 1 2.471 0.002 . 2 . . . . A 17 ASP HB3 . 34981 1 189 . 1 . 1 17 17 ASP CB C 13 40.897 0.045 . 1 . . . . A 17 ASP CB . 34981 1 190 . 1 . 1 17 17 ASP N N 15 122.005 0.024 . 1 . . . . A 17 ASP N . 34981 1 191 . 1 . 1 18 18 VAL H H 1 8.598 0.004 . 1 . . . . A 18 VAL H . 34981 1 192 . 1 . 1 18 18 VAL HA H 1 4.415 0.003 . 1 . . . . A 18 VAL HA . 34981 1 193 . 1 . 1 18 18 VAL HB H 1 1.852 0.004 . 1 . . . . A 18 VAL HB . 34981 1 194 . 1 . 1 18 18 VAL HG11 H 1 0.918 0.003 . 2 . . . . A 18 VAL HG11 . 34981 1 195 . 1 . 1 18 18 VAL HG12 H 1 0.918 0.003 . 2 . . . . A 18 VAL HG12 . 34981 1 196 . 1 . 1 18 18 VAL HG13 H 1 0.918 0.003 . 2 . . . . A 18 VAL HG13 . 34981 1 197 . 1 . 1 18 18 VAL HG21 H 1 0.999 0.004 . 2 . . . . A 18 VAL HG21 . 34981 1 198 . 1 . 1 18 18 VAL HG22 H 1 0.999 0.004 . 2 . . . . A 18 VAL HG22 . 34981 1 199 . 1 . 1 18 18 VAL HG23 H 1 0.999 0.004 . 2 . . . . A 18 VAL HG23 . 34981 1 200 . 1 . 1 18 18 VAL CA C 13 61.075 0.024 . 1 . . . . A 18 VAL CA . 34981 1 201 . 1 . 1 18 18 VAL CB C 13 36.040 0.058 . 1 . . . . A 18 VAL CB . 34981 1 202 . 1 . 1 18 18 VAL CG1 C 13 21.340 0.015 . 2 . . . . A 18 VAL CG1 . 34981 1 203 . 1 . 1 18 18 VAL CG2 C 13 21.406 0.039 . 2 . . . . A 18 VAL CG2 . 34981 1 204 . 1 . 1 18 18 VAL N N 15 120.635 0.012 . 1 . . . . A 18 VAL N . 34981 1 205 . 1 . 1 19 19 THR H H 1 8.289 0.003 . 1 . . . . A 19 THR H . 34981 1 206 . 1 . 1 19 19 THR HA H 1 5.364 0.003 . 1 . . . . A 19 THR HA . 34981 1 207 . 1 . 1 19 19 THR HB H 1 3.834 0.003 . 1 . . . . A 19 THR HB . 34981 1 208 . 1 . 1 19 19 THR HG21 H 1 0.981 0.007 . 1 . . . . A 19 THR HG21 . 34981 1 209 . 1 . 1 19 19 THR HG22 H 1 0.981 0.007 . 1 . . . . A 19 THR HG22 . 34981 1 210 . 1 . 1 19 19 THR HG23 H 1 0.981 0.007 . 1 . . . . A 19 THR HG23 . 34981 1 211 . 1 . 1 19 19 THR CA C 13 60.832 0.021 . 1 . . . . A 19 THR CA . 34981 1 212 . 1 . 1 19 19 THR CB C 13 70.146 0.035 . 1 . . . . A 19 THR CB . 34981 1 213 . 1 . 1 19 19 THR CG2 C 13 21.191 0.071 . 1 . . . . A 19 THR CG2 . 34981 1 214 . 1 . 1 19 19 THR N N 15 123.625 0.009 . 1 . . . . A 19 THR N . 34981 1 215 . 1 . 1 20 20 LEU H H 1 8.581 0.006 . 1 . . . . A 20 LEU H . 34981 1 216 . 1 . 1 20 20 LEU HA H 1 4.776 0.002 . 1 . . . . A 20 LEU HA . 34981 1 217 . 1 . 1 20 20 LEU HB2 H 1 1.594 0.004 . 2 . . . . A 20 LEU HB2 . 34981 1 218 . 1 . 1 20 20 LEU HB3 H 1 1.414 0.003 . 2 . . . . A 20 LEU HB3 . 34981 1 219 . 1 . 1 20 20 LEU HG H 1 1.500 0.003 . 1 . . . . A 20 LEU HG . 34981 1 220 . 1 . 1 20 20 LEU HD11 H 1 0.797 0.002 . 2 . . . . A 20 LEU HD11 . 34981 1 221 . 1 . 1 20 20 LEU HD12 H 1 0.797 0.002 . 2 . . . . A 20 LEU HD12 . 34981 1 222 . 1 . 1 20 20 LEU HD13 H 1 0.797 0.002 . 2 . . . . A 20 LEU HD13 . 34981 1 223 . 1 . 1 20 20 LEU HD21 H 1 0.659 0.005 . 2 . . . . A 20 LEU HD21 . 34981 1 224 . 1 . 1 20 20 LEU HD22 H 1 0.659 0.005 . 2 . . . . A 20 LEU HD22 . 34981 1 225 . 1 . 1 20 20 LEU HD23 H 1 0.659 0.005 . 2 . . . . A 20 LEU HD23 . 34981 1 226 . 1 . 1 20 20 LEU CA C 13 53.057 0.024 . 1 . . . . A 20 LEU CA . 34981 1 227 . 1 . 1 20 20 LEU CB C 13 45.930 0.024 . 1 . . . . A 20 LEU CB . 34981 1 228 . 1 . 1 20 20 LEU CG C 13 26.777 0.004 . 1 . . . . A 20 LEU CG . 34981 1 229 . 1 . 1 20 20 LEU CD1 C 13 23.648 0.015 . 2 . . . . A 20 LEU CD1 . 34981 1 230 . 1 . 1 20 20 LEU CD2 C 13 26.689 0.046 . 2 . . . . A 20 LEU CD2 . 34981 1 231 . 1 . 1 20 20 LEU N N 15 127.102 0.017 . 1 . . . . A 20 LEU N . 34981 1 232 . 1 . 1 21 21 LYS H H 1 8.070 0.006 . 1 . . . . A 21 LYS H . 34981 1 233 . 1 . 1 21 21 LYS HA H 1 4.621 0.007 . 1 . . . . A 21 LYS HA . 34981 1 234 . 1 . 1 21 21 LYS HB2 H 1 1.742 0.006 . 2 . . . . A 21 LYS HB2 . 34981 1 235 . 1 . 1 21 21 LYS HB3 H 1 1.457 0.006 . 2 . . . . A 21 LYS HB3 . 34981 1 236 . 1 . 1 21 21 LYS HG2 H 1 1.365 0.009 . 2 . . . . A 21 LYS HG2 . 34981 1 237 . 1 . 1 21 21 LYS HG3 H 1 1.496 0.003 . 2 . . . . A 21 LYS HG3 . 34981 1 238 . 1 . 1 21 21 LYS HD2 H 1 1.663 0.006 . 2 . . . . A 21 LYS HD2 . 34981 1 239 . 1 . 1 21 21 LYS HD3 H 1 1.511 0.005 . 2 . . . . A 21 LYS HD3 . 34981 1 240 . 1 . 1 21 21 LYS HE2 H 1 2.958 0.000 . 2 . . . . A 21 LYS HE2 . 34981 1 241 . 1 . 1 21 21 LYS HE3 H 1 2.966 0.000 . 2 . . . . A 21 LYS HE3 . 34981 1 242 . 1 . 1 21 21 LYS CA C 13 54.588 0.043 . 1 . . . . A 21 LYS CA . 34981 1 243 . 1 . 1 21 21 LYS CB C 13 33.846 0.028 . 1 . . . . A 21 LYS CB . 34981 1 244 . 1 . 1 21 21 LYS CG C 13 24.964 0.057 . 1 . . . . A 21 LYS CG . 34981 1 245 . 1 . 1 21 21 LYS CD C 13 28.942 0.074 . 1 . . . . A 21 LYS CD . 34981 1 246 . 1 . 1 21 21 LYS CE C 13 41.941 0.020 . 1 . . . . A 21 LYS CE . 34981 1 247 . 1 . 1 21 21 LYS N N 15 118.543 0.014 . 1 . . . . A 21 LYS N . 34981 1 248 . 1 . 1 22 22 GLU H H 1 8.145 0.003 . 1 . . . . A 22 GLU H . 34981 1 249 . 1 . 1 22 22 GLU HA H 1 3.695 0.003 . 1 . . . . A 22 GLU HA . 34981 1 250 . 1 . 1 22 22 GLU HB2 H 1 1.889 0.010 . 2 . . . . A 22 GLU HB2 . 34981 1 251 . 1 . 1 22 22 GLU HB3 H 1 1.942 0.009 . 2 . . . . A 22 GLU HB3 . 34981 1 252 . 1 . 1 22 22 GLU HG2 H 1 2.401 0.004 . 2 . . . . A 22 GLU HG2 . 34981 1 253 . 1 . 1 22 22 GLU HG3 H 1 2.006 0.003 . 2 . . . . A 22 GLU HG3 . 34981 1 254 . 1 . 1 22 22 GLU CA C 13 58.137 0.050 . 1 . . . . A 22 GLU CA . 34981 1 255 . 1 . 1 22 22 GLU CB C 13 30.257 0.005 . 1 . . . . A 22 GLU CB . 34981 1 256 . 1 . 1 22 22 GLU CG C 13 37.855 0.037 . 1 . . . . A 22 GLU CG . 34981 1 257 . 1 . 1 22 22 GLU N N 15 118.500 0.028 . 1 . . . . A 22 GLU N . 34981 1 258 . 1 . 1 23 23 GLY H H 1 9.480 0.002 . 1 . . . . A 23 GLY H . 34981 1 259 . 1 . 1 23 23 GLY HA2 H 1 3.924 0.003 . 2 . . . . A 23 GLY HA2 . 34981 1 260 . 1 . 1 23 23 GLY HA3 H 1 4.316 0.001 . 2 . . . . A 23 GLY HA3 . 34981 1 261 . 1 . 1 23 23 GLY CA C 13 44.498 0.002 . 1 . . . . A 23 GLY CA . 34981 1 262 . 1 . 1 23 23 GLY N N 15 112.633 0.019 . 1 . . . . A 23 GLY N . 34981 1 263 . 1 . 1 24 24 GLN H H 1 7.587 0.001 . 1 . . . . A 24 GLN H . 34981 1 264 . 1 . 1 24 24 GLN HA H 1 4.397 0.001 . 1 . . . . A 24 GLN HA . 34981 1 265 . 1 . 1 24 24 GLN HB2 H 1 2.189 0.006 . 2 . . . . A 24 GLN HB2 . 34981 1 266 . 1 . 1 24 24 GLN HB3 H 1 2.111 0.003 . 2 . . . . A 24 GLN HB3 . 34981 1 267 . 1 . 1 24 24 GLN HG2 H 1 2.369 0.006 . 2 . . . . A 24 GLN HG2 . 34981 1 268 . 1 . 1 24 24 GLN HG3 H 1 2.291 0.000 . 2 . . . . A 24 GLN HG3 . 34981 1 269 . 1 . 1 24 24 GLN HE21 H 1 7.623 0.001 . 2 . . . . A 24 GLN HE21 . 34981 1 270 . 1 . 1 24 24 GLN HE22 H 1 6.793 0.001 . 2 . . . . A 24 GLN HE22 . 34981 1 271 . 1 . 1 24 24 GLN CA C 13 56.045 0.012 . 1 . . . . A 24 GLN CA . 34981 1 272 . 1 . 1 24 24 GLN CB C 13 30.282 0.023 . 1 . . . . A 24 GLN CB . 34981 1 273 . 1 . 1 24 24 GLN CG C 13 35.708 0.017 . 1 . . . . A 24 GLN CG . 34981 1 274 . 1 . 1 24 24 GLN N N 15 119.495 0.015 . 1 . . . . A 24 GLN N . 34981 1 275 . 1 . 1 24 24 GLN NE2 N 15 112.576 0.027 . 1 . . . . A 24 GLN NE2 . 34981 1 276 . 1 . 1 25 25 THR H H 1 8.465 0.003 . 1 . . . . A 25 THR H . 34981 1 277 . 1 . 1 25 25 THR HA H 1 4.800 0.006 . 1 . . . . A 25 THR HA . 34981 1 278 . 1 . 1 25 25 THR HB H 1 3.894 0.004 . 1 . . . . A 25 THR HB . 34981 1 279 . 1 . 1 25 25 THR HG21 H 1 0.885 0.001 . 1 . . . . A 25 THR HG21 . 34981 1 280 . 1 . 1 25 25 THR HG22 H 1 0.885 0.001 . 1 . . . . A 25 THR HG22 . 34981 1 281 . 1 . 1 25 25 THR HG23 H 1 0.885 0.001 . 1 . . . . A 25 THR HG23 . 34981 1 282 . 1 . 1 25 25 THR CA C 13 62.219 0.059 . 1 . . . . A 25 THR CA . 34981 1 283 . 1 . 1 25 25 THR CB C 13 70.001 0.019 . 1 . . . . A 25 THR CB . 34981 1 284 . 1 . 1 25 25 THR CG2 C 13 21.313 0.026 . 1 . . . . A 25 THR CG2 . 34981 1 285 . 1 . 1 25 25 THR N N 15 115.677 0.015 . 1 . . . . A 25 THR N . 34981 1 286 . 1 . 1 26 26 CYS H H 1 9.023 0.006 . 1 . . . . A 26 CYS H . 34981 1 287 . 1 . 1 26 26 CYS HA H 1 4.450 0.002 . 1 . . . . A 26 CYS HA . 34981 1 288 . 1 . 1 26 26 CYS HB2 H 1 2.581 0.006 . 2 . . . . A 26 CYS HB2 . 34981 1 289 . 1 . 1 26 26 CYS HB3 H 1 2.389 0.005 . 2 . . . . A 26 CYS HB3 . 34981 1 290 . 1 . 1 26 26 CYS CA C 13 56.674 0.025 . 1 . . . . A 26 CYS CA . 34981 1 291 . 1 . 1 26 26 CYS CB C 13 28.830 0.036 . 1 . . . . A 26 CYS CB . 34981 1 292 . 1 . 1 26 26 CYS N N 15 128.553 0.017 . 1 . . . . A 26 CYS N . 34981 1 293 . 1 . 1 27 27 THR H H 1 8.508 0.003 . 1 . . . . A 27 THR H . 34981 1 294 . 1 . 1 27 27 THR HA H 1 5.136 0.003 . 1 . . . . A 27 THR HA . 34981 1 295 . 1 . 1 27 27 THR HB H 1 3.766 0.002 . 1 . . . . A 27 THR HB . 34981 1 296 . 1 . 1 27 27 THR HG21 H 1 0.958 0.002 . 1 . . . . A 27 THR HG21 . 34981 1 297 . 1 . 1 27 27 THR HG22 H 1 0.958 0.002 . 1 . . . . A 27 THR HG22 . 34981 1 298 . 1 . 1 27 27 THR HG23 H 1 0.958 0.002 . 1 . . . . A 27 THR HG23 . 34981 1 299 . 1 . 1 27 27 THR CA C 13 61.338 0.046 . 1 . . . . A 27 THR CA . 34981 1 300 . 1 . 1 27 27 THR CB C 13 70.132 0.019 . 1 . . . . A 27 THR CB . 34981 1 301 . 1 . 1 27 27 THR CG2 C 13 21.206 0.023 . 1 . . . . A 27 THR CG2 . 34981 1 302 . 1 . 1 27 27 THR N N 15 125.064 0.014 . 1 . . . . A 27 THR N . 34981 1 303 . 1 . 1 28 28 MET H H 1 9.251 0.003 . 1 . . . . A 28 MET H . 34981 1 304 . 1 . 1 28 28 MET HA H 1 4.665 0.006 . 1 . . . . A 28 MET HA . 34981 1 305 . 1 . 1 28 28 MET HB2 H 1 1.692 0.007 . 2 . . . . A 28 MET HB2 . 34981 1 306 . 1 . 1 28 28 MET HB3 H 1 2.155 0.003 . 2 . . . . A 28 MET HB3 . 34981 1 307 . 1 . 1 28 28 MET HG2 H 1 2.344 0.005 . 2 . . . . A 28 MET HG2 . 34981 1 308 . 1 . 1 28 28 MET HG3 H 1 2.171 0.002 . 2 . . . . A 28 MET HG3 . 34981 1 309 . 1 . 1 28 28 MET HE1 H 1 1.729 0.001 . 1 . . . . A 28 MET HE1 . 34981 1 310 . 1 . 1 28 28 MET HE2 H 1 1.729 0.001 . 1 . . . . A 28 MET HE2 . 34981 1 311 . 1 . 1 28 28 MET HE3 H 1 1.729 0.001 . 1 . . . . A 28 MET HE3 . 34981 1 312 . 1 . 1 28 28 MET CB C 13 36.230 0.020 . 1 . . . . A 28 MET CB . 34981 1 313 . 1 . 1 28 28 MET CG C 13 33.213 0.018 . 1 . . . . A 28 MET CG . 34981 1 314 . 1 . 1 28 28 MET CE C 13 17.683 0.017 . 1 . . . . A 28 MET CE . 34981 1 315 . 1 . 1 28 28 MET N N 15 126.900 0.025 . 1 . . . . A 28 MET N . 34981 1 316 . 1 . 1 29 29 THR H H 1 7.926 0.002 . 1 . . . . A 29 THR H . 34981 1 317 . 1 . 1 29 29 THR HA H 1 5.849 0.002 . 1 . . . . A 29 THR HA . 34981 1 318 . 1 . 1 29 29 THR HB H 1 4.050 0.002 . 1 . . . . A 29 THR HB . 34981 1 319 . 1 . 1 29 29 THR HG21 H 1 1.066 0.003 . 1 . . . . A 29 THR HG21 . 34981 1 320 . 1 . 1 29 29 THR HG22 H 1 1.066 0.003 . 1 . . . . A 29 THR HG22 . 34981 1 321 . 1 . 1 29 29 THR HG23 H 1 1.066 0.003 . 1 . . . . A 29 THR HG23 . 34981 1 322 . 1 . 1 29 29 THR CA C 13 59.394 0.024 . 1 . . . . A 29 THR CA . 34981 1 323 . 1 . 1 29 29 THR CB C 13 72.235 0.044 . 1 . . . . A 29 THR CB . 34981 1 324 . 1 . 1 29 29 THR CG2 C 13 21.646 0.012 . 1 . . . . A 29 THR CG2 . 34981 1 325 . 1 . 1 29 29 THR N N 15 111.867 0.024 . 1 . . . . A 29 THR N . 34981 1 326 . 1 . 1 30 30 CYS H H 1 9.233 0.005 . 1 . . . . A 30 CYS H . 34981 1 327 . 1 . 1 30 30 CYS HA H 1 4.618 0.004 . 1 . . . . A 30 CYS HA . 34981 1 328 . 1 . 1 30 30 CYS HB2 H 1 2.818 0.010 . 2 . . . . A 30 CYS HB2 . 34981 1 329 . 1 . 1 30 30 CYS HB3 H 1 2.663 0.005 . 2 . . . . A 30 CYS HB3 . 34981 1 330 . 1 . 1 30 30 CYS CA C 13 55.528 0.052 . 1 . . . . A 30 CYS CA . 34981 1 331 . 1 . 1 30 30 CYS CB C 13 30.290 0.030 . 1 . . . . A 30 CYS CB . 34981 1 332 . 1 . 1 30 30 CYS N N 15 118.189 0.011 . 1 . . . . A 30 CYS N . 34981 1 333 . 1 . 1 31 31 GLN H H 1 9.097 0.003 . 1 . . . . A 31 GLN H . 34981 1 334 . 1 . 1 31 31 GLN HA H 1 5.802 0.005 . 1 . . . . A 31 GLN HA . 34981 1 335 . 1 . 1 31 31 GLN HB2 H 1 1.980 0.010 . 2 . . . . A 31 GLN HB2 . 34981 1 336 . 1 . 1 31 31 GLN HB3 H 1 1.945 0.001 . 2 . . . . A 31 GLN HB3 . 34981 1 337 . 1 . 1 31 31 GLN HG2 H 1 2.147 0.009 . 2 . . . . A 31 GLN HG2 . 34981 1 338 . 1 . 1 31 31 GLN HG3 H 1 2.287 0.004 . 2 . . . . A 31 GLN HG3 . 34981 1 339 . 1 . 1 31 31 GLN HE21 H 1 8.222 0.001 . 2 . . . . A 31 GLN HE21 . 34981 1 340 . 1 . 1 31 31 GLN HE22 H 1 6.908 0.001 . 2 . . . . A 31 GLN HE22 . 34981 1 341 . 1 . 1 31 31 GLN CA C 13 54.984 0.053 . 1 . . . . A 31 GLN CA . 34981 1 342 . 1 . 1 31 31 GLN CB C 13 34.201 0.000 . 1 . . . . A 31 GLN CB . 34981 1 343 . 1 . 1 31 31 GLN CG C 13 35.426 0.019 . 1 . . . . A 31 GLN CG . 34981 1 344 . 1 . 1 31 31 GLN N N 15 119.587 0.013 . 1 . . . . A 31 GLN N . 34981 1 345 . 1 . 1 31 31 GLN NE2 N 15 114.734 0.010 . 1 . . . . A 31 GLN NE2 . 34981 1 346 . 1 . 1 32 32 PHE H H 1 9.950 0.001 . 1 . . . . A 32 PHE H . 34981 1 347 . 1 . 1 32 32 PHE HA H 1 4.495 0.005 . 1 . . . . A 32 PHE HA . 34981 1 348 . 1 . 1 32 32 PHE HB2 H 1 2.638 0.006 . 2 . . . . A 32 PHE HB2 . 34981 1 349 . 1 . 1 32 32 PHE HB3 H 1 2.457 0.009 . 2 . . . . A 32 PHE HB3 . 34981 1 350 . 1 . 1 32 32 PHE HD1 H 1 5.759 0.013 . 3 . . . . A 32 PHE HD1 . 34981 1 351 . 1 . 1 32 32 PHE HD2 H 1 5.759 0.013 . 3 . . . . A 32 PHE HD2 . 34981 1 352 . 1 . 1 32 32 PHE HE1 H 1 6.150 0.006 . 3 . . . . A 32 PHE HE1 . 34981 1 353 . 1 . 1 32 32 PHE HE2 H 1 6.150 0.006 . 3 . . . . A 32 PHE HE2 . 34981 1 354 . 1 . 1 32 32 PHE HZ H 1 6.745 0.002 . 1 . . . . A 32 PHE HZ . 34981 1 355 . 1 . 1 32 32 PHE CA C 13 57.009 0.081 . 1 . . . . A 32 PHE CA . 34981 1 356 . 1 . 1 32 32 PHE CB C 13 40.922 0.001 . 1 . . . . A 32 PHE CB . 34981 1 357 . 1 . 1 32 32 PHE CD1 C 13 133.922 0.044 . 3 . . . . A 32 PHE CD1 . 34981 1 358 . 1 . 1 32 32 PHE CD2 C 13 133.922 0.044 . 3 . . . . A 32 PHE CD2 . 34981 1 359 . 1 . 1 32 32 PHE CE1 C 13 131.753 0.034 . 3 . . . . A 32 PHE CE1 . 34981 1 360 . 1 . 1 32 32 PHE CE2 C 13 131.753 0.034 . 3 . . . . A 32 PHE CE2 . 34981 1 361 . 1 . 1 32 32 PHE CZ C 13 132.177 0.069 . 1 . . . . A 32 PHE CZ . 34981 1 362 . 1 . 1 32 32 PHE N N 15 134.114 0.032 . 1 . . . . A 32 PHE N . 34981 1 363 . 1 . 1 33 33 SER H H 1 7.553 0.002 . 1 . . . . A 33 SER H . 34981 1 364 . 1 . 1 33 33 SER HA H 1 3.887 0.002 . 1 . . . . A 33 SER HA . 34981 1 365 . 1 . 1 33 33 SER HB2 H 1 3.648 0.005 . 2 . . . . A 33 SER HB2 . 34981 1 366 . 1 . 1 33 33 SER HB3 H 1 3.519 0.007 . 2 . . . . A 33 SER HB3 . 34981 1 367 . 1 . 1 33 33 SER CA C 13 59.663 0.034 . 1 . . . . A 33 SER CA . 34981 1 368 . 1 . 1 33 33 SER CB C 13 62.370 0.055 . 1 . . . . A 33 SER CB . 34981 1 369 . 1 . 1 33 33 SER N N 15 114.735 0.019 . 1 . . . . A 33 SER N . 34981 1 370 . 1 . 1 34 34 VAL H H 1 6.407 0.003 . 1 . . . . A 34 VAL H . 34981 1 371 . 1 . 1 34 34 VAL HA H 1 4.342 0.004 . 1 . . . . A 34 VAL HA . 34981 1 372 . 1 . 1 34 34 VAL HB H 1 1.823 0.003 . 1 . . . . A 34 VAL HB . 34981 1 373 . 1 . 1 34 34 VAL HG11 H 1 0.874 0.005 . 2 . . . . A 34 VAL HG11 . 34981 1 374 . 1 . 1 34 34 VAL HG12 H 1 0.874 0.005 . 2 . . . . A 34 VAL HG12 . 34981 1 375 . 1 . 1 34 34 VAL HG13 H 1 0.874 0.005 . 2 . . . . A 34 VAL HG13 . 34981 1 376 . 1 . 1 34 34 VAL HG21 H 1 0.677 0.003 . 2 . . . . A 34 VAL HG21 . 34981 1 377 . 1 . 1 34 34 VAL HG22 H 1 0.677 0.003 . 2 . . . . A 34 VAL HG22 . 34981 1 378 . 1 . 1 34 34 VAL HG23 H 1 0.677 0.003 . 2 . . . . A 34 VAL HG23 . 34981 1 379 . 1 . 1 34 34 VAL CA C 13 58.678 0.008 . 1 . . . . A 34 VAL CA . 34981 1 380 . 1 . 1 34 34 VAL CB C 13 34.221 0.038 . 1 . . . . A 34 VAL CB . 34981 1 381 . 1 . 1 34 34 VAL CG1 C 13 20.468 0.014 . 2 . . . . A 34 VAL CG1 . 34981 1 382 . 1 . 1 34 34 VAL CG2 C 13 20.287 0.020 . 2 . . . . A 34 VAL CG2 . 34981 1 383 . 1 . 1 34 34 VAL N N 15 121.894 0.021 . 1 . . . . A 34 VAL N . 34981 1 384 . 1 . 1 35 35 PRO HA H 1 3.689 0.002 . 1 . . . . A 35 PRO HA . 34981 1 385 . 1 . 1 35 35 PRO HB2 H 1 1.544 0.006 . 2 . . . . A 35 PRO HB2 . 34981 1 386 . 1 . 1 35 35 PRO HB3 H 1 1.148 0.005 . 2 . . . . A 35 PRO HB3 . 34981 1 387 . 1 . 1 35 35 PRO HG2 H 1 1.887 0.005 . 2 . . . . A 35 PRO HG2 . 34981 1 388 . 1 . 1 35 35 PRO HG3 H 1 1.588 0.002 . 2 . . . . A 35 PRO HG3 . 34981 1 389 . 1 . 1 35 35 PRO HD2 H 1 3.657 0.020 . 2 . . . . A 35 PRO HD2 . 34981 1 390 . 1 . 1 35 35 PRO HD3 H 1 3.596 0.003 . 2 . . . . A 35 PRO HD3 . 34981 1 391 . 1 . 1 35 35 PRO CA C 13 61.980 0.019 . 1 . . . . A 35 PRO CA . 34981 1 392 . 1 . 1 35 35 PRO CB C 13 32.051 0.075 . 1 . . . . A 35 PRO CB . 34981 1 393 . 1 . 1 35 35 PRO CG C 13 26.849 0.037 . 1 . . . . A 35 PRO CG . 34981 1 394 . 1 . 1 35 35 PRO CD C 13 50.928 0.041 . 1 . . . . A 35 PRO CD . 34981 1 395 . 1 . 1 36 36 ASN H H 1 8.327 0.005 . 1 . . . . A 36 ASN H . 34981 1 396 . 1 . 1 36 36 ASN HA H 1 4.040 0.004 . 1 . . . . A 36 ASN HA . 34981 1 397 . 1 . 1 36 36 ASN HB2 H 1 2.893 0.004 . 2 . . . . A 36 ASN HB2 . 34981 1 398 . 1 . 1 36 36 ASN HB3 H 1 2.764 0.004 . 2 . . . . A 36 ASN HB3 . 34981 1 399 . 1 . 1 36 36 ASN HD21 H 1 7.061 0.003 . 2 . . . . A 36 ASN HD21 . 34981 1 400 . 1 . 1 36 36 ASN HD22 H 1 7.655 0.010 . 2 . . . . A 36 ASN HD22 . 34981 1 401 . 1 . 1 36 36 ASN CA C 13 54.408 0.024 . 1 . . . . A 36 ASN CA . 34981 1 402 . 1 . 1 36 36 ASN CB C 13 36.875 0.036 . 1 . . . . A 36 ASN CB . 34981 1 403 . 1 . 1 36 36 ASN N N 15 112.573 0.015 . 1 . . . . A 36 ASN N . 34981 1 404 . 1 . 1 36 36 ASN ND2 N 15 114.601 0.026 . 1 . . . . A 36 ASN ND2 . 34981 1 405 . 1 . 1 37 37 VAL H H 1 7.380 0.002 . 1 . . . . A 37 VAL H . 34981 1 406 . 1 . 1 37 37 VAL HA H 1 4.442 0.002 . 1 . . . . A 37 VAL HA . 34981 1 407 . 1 . 1 37 37 VAL HB H 1 1.640 0.003 . 1 . . . . A 37 VAL HB . 34981 1 408 . 1 . 1 37 37 VAL HG11 H 1 0.488 0.003 . 2 . . . . A 37 VAL HG11 . 34981 1 409 . 1 . 1 37 37 VAL HG12 H 1 0.488 0.003 . 2 . . . . A 37 VAL HG12 . 34981 1 410 . 1 . 1 37 37 VAL HG13 H 1 0.488 0.003 . 2 . . . . A 37 VAL HG13 . 34981 1 411 . 1 . 1 37 37 VAL HG21 H 1 -0.053 0.002 . 2 . . . . A 37 VAL HG21 . 34981 1 412 . 1 . 1 37 37 VAL HG22 H 1 -0.053 0.002 . 2 . . . . A 37 VAL HG22 . 34981 1 413 . 1 . 1 37 37 VAL HG23 H 1 -0.053 0.002 . 2 . . . . A 37 VAL HG23 . 34981 1 414 . 1 . 1 37 37 VAL CA C 13 59.883 0.041 . 1 . . . . A 37 VAL CA . 34981 1 415 . 1 . 1 37 37 VAL CB C 13 32.758 0.067 . 1 . . . . A 37 VAL CB . 34981 1 416 . 1 . 1 37 37 VAL CG1 C 13 20.986 0.045 . 2 . . . . A 37 VAL CG1 . 34981 1 417 . 1 . 1 37 37 VAL CG2 C 13 17.728 0.045 . 2 . . . . A 37 VAL CG2 . 34981 1 418 . 1 . 1 37 37 VAL N N 15 110.686 0.022 . 1 . . . . A 37 VAL N . 34981 1 419 . 1 . 1 38 38 LYS H H 1 8.348 0.002 . 1 . . . . A 38 LYS H . 34981 1 420 . 1 . 1 38 38 LYS HA H 1 4.507 0.004 . 1 . . . . A 38 LYS HA . 34981 1 421 . 1 . 1 38 38 LYS HB2 H 1 1.793 0.036 . 2 . . . . A 38 LYS HB2 . 34981 1 422 . 1 . 1 38 38 LYS HB3 H 1 1.829 0.007 . 2 . . . . A 38 LYS HB3 . 34981 1 423 . 1 . 1 38 38 LYS HG2 H 1 1.499 0.002 . 2 . . . . A 38 LYS HG2 . 34981 1 424 . 1 . 1 38 38 LYS HG3 H 1 1.362 0.005 . 2 . . . . A 38 LYS HG3 . 34981 1 425 . 1 . 1 38 38 LYS HD2 H 1 1.628 0.004 . 2 . . . . A 38 LYS HD2 . 34981 1 426 . 1 . 1 38 38 LYS HD3 H 1 1.624 0.000 . 2 . . . . A 38 LYS HD3 . 34981 1 427 . 1 . 1 38 38 LYS HE2 H 1 2.955 0.002 . 2 . . . . A 38 LYS HE2 . 34981 1 428 . 1 . 1 38 38 LYS HE3 H 1 2.954 0.000 . 2 . . . . A 38 LYS HE3 . 34981 1 429 . 1 . 1 38 38 LYS CA C 13 55.479 0.003 . 1 . . . . A 38 LYS CA . 34981 1 430 . 1 . 1 38 38 LYS CB C 13 32.760 0.041 . 1 . . . . A 38 LYS CB . 34981 1 431 . 1 . 1 38 38 LYS CG C 13 24.733 0.005 . 1 . . . . A 38 LYS CG . 34981 1 432 . 1 . 1 38 38 LYS CD C 13 28.796 0.063 . 1 . . . . A 38 LYS CD . 34981 1 433 . 1 . 1 38 38 LYS CE C 13 41.783 0.012 . 1 . . . . A 38 LYS CE . 34981 1 434 . 1 . 1 38 38 LYS N N 15 120.426 0.025 . 1 . . . . A 38 LYS N . 34981 1 435 . 1 . 1 39 39 SER H H 1 8.108 0.009 . 1 . . . . A 39 SER H . 34981 1 436 . 1 . 1 39 39 SER HA H 1 4.979 0.004 . 1 . . . . A 39 SER HA . 34981 1 437 . 1 . 1 39 39 SER HB2 H 1 3.704 0.012 . 2 . . . . A 39 SER HB2 . 34981 1 438 . 1 . 1 39 39 SER HB3 H 1 3.193 0.003 . 2 . . . . A 39 SER HB3 . 34981 1 439 . 1 . 1 39 39 SER CA C 13 56.195 0.068 . 1 . . . . A 39 SER CA . 34981 1 440 . 1 . 1 39 39 SER CB C 13 65.497 0.042 . 1 . . . . A 39 SER CB . 34981 1 441 . 1 . 1 39 39 SER N N 15 118.484 0.059 . 1 . . . . A 39 SER N . 34981 1 442 . 1 . 1 40 40 GLU H H 1 8.621 0.003 . 1 . . . . A 40 GLU H . 34981 1 443 . 1 . 1 40 40 GLU HA H 1 4.637 0.004 . 1 . . . . A 40 GLU HA . 34981 1 444 . 1 . 1 40 40 GLU HB2 H 1 1.866 0.007 . 2 . . . . A 40 GLU HB2 . 34981 1 445 . 1 . 1 40 40 GLU HB3 H 1 1.829 0.001 . 2 . . . . A 40 GLU HB3 . 34981 1 446 . 1 . 1 40 40 GLU HG2 H 1 2.097 0.008 . 2 . . . . A 40 GLU HG2 . 34981 1 447 . 1 . 1 40 40 GLU HG3 H 1 2.060 0.005 . 2 . . . . A 40 GLU HG3 . 34981 1 448 . 1 . 1 40 40 GLU CA C 13 54.986 0.017 . 1 . . . . A 40 GLU CA . 34981 1 449 . 1 . 1 40 40 GLU CB C 13 34.518 0.029 . 1 . . . . A 40 GLU CB . 34981 1 450 . 1 . 1 40 40 GLU CG C 13 36.881 0.000 . 1 . . . . A 40 GLU CG . 34981 1 451 . 1 . 1 40 40 GLU N N 15 119.247 0.020 . 1 . . . . A 40 GLU N . 34981 1 452 . 1 . 1 41 41 TRP H H 1 8.759 0.006 . 1 . . . . A 41 TRP H . 34981 1 453 . 1 . 1 41 41 TRP HA H 1 5.744 0.005 . 1 . . . . A 41 TRP HA . 34981 1 454 . 1 . 1 41 41 TRP HB2 H 1 3.122 0.004 . 2 . . . . A 41 TRP HB2 . 34981 1 455 . 1 . 1 41 41 TRP HB3 H 1 2.868 0.004 . 2 . . . . A 41 TRP HB3 . 34981 1 456 . 1 . 1 41 41 TRP HD1 H 1 7.119 0.006 . 1 . . . . A 41 TRP HD1 . 34981 1 457 . 1 . 1 41 41 TRP HE1 H 1 10.513 0.005 . 1 . . . . A 41 TRP HE1 . 34981 1 458 . 1 . 1 41 41 TRP HE3 H 1 7.375 0.003 . 1 . . . . A 41 TRP HE3 . 34981 1 459 . 1 . 1 41 41 TRP HZ2 H 1 7.025 0.002 . 1 . . . . A 41 TRP HZ2 . 34981 1 460 . 1 . 1 41 41 TRP HZ3 H 1 6.726 0.004 . 1 . . . . A 41 TRP HZ3 . 34981 1 461 . 1 . 1 41 41 TRP HH2 H 1 6.755 0.002 . 1 . . . . A 41 TRP HH2 . 34981 1 462 . 1 . 1 41 41 TRP CA C 13 55.760 0.024 . 1 . . . . A 41 TRP CA . 34981 1 463 . 1 . 1 41 41 TRP CB C 13 31.463 0.084 . 1 . . . . A 41 TRP CB . 34981 1 464 . 1 . 1 41 41 TRP CD1 C 13 129.032 0.084 . 1 . . . . A 41 TRP CD1 . 34981 1 465 . 1 . 1 41 41 TRP CE3 C 13 122.405 0.101 . 1 . . . . A 41 TRP CE3 . 34981 1 466 . 1 . 1 41 41 TRP CZ2 C 13 117.734 0.114 . 1 . . . . A 41 TRP CZ2 . 34981 1 467 . 1 . 1 41 41 TRP CZ3 C 13 124.111 0.020 . 1 . . . . A 41 TRP CZ3 . 34981 1 468 . 1 . 1 41 41 TRP CH2 C 13 127.220 0.054 . 1 . . . . A 41 TRP CH2 . 34981 1 469 . 1 . 1 41 41 TRP N N 15 122.313 0.023 . 1 . . . . A 41 TRP N . 34981 1 470 . 1 . 1 41 41 TRP NE1 N 15 130.474 0.023 . 1 . . . . A 41 TRP NE1 . 34981 1 471 . 1 . 1 42 42 PHE H H 1 9.413 0.004 . 1 . . . . A 42 PHE H . 34981 1 472 . 1 . 1 42 42 PHE HA H 1 4.977 0.004 . 1 . . . . A 42 PHE HA . 34981 1 473 . 1 . 1 42 42 PHE HB2 H 1 2.703 0.003 . 2 . . . . A 42 PHE HB2 . 34981 1 474 . 1 . 1 42 42 PHE HB3 H 1 2.384 0.006 . 2 . . . . A 42 PHE HB3 . 34981 1 475 . 1 . 1 42 42 PHE HD1 H 1 6.698 0.008 . 3 . . . . A 42 PHE HD1 . 34981 1 476 . 1 . 1 42 42 PHE HD2 H 1 6.698 0.008 . 3 . . . . A 42 PHE HD2 . 34981 1 477 . 1 . 1 42 42 PHE HE1 H 1 7.089 0.007 . 3 . . . . A 42 PHE HE1 . 34981 1 478 . 1 . 1 42 42 PHE HE2 H 1 7.089 0.007 . 3 . . . . A 42 PHE HE2 . 34981 1 479 . 1 . 1 42 42 PHE HZ H 1 7.155 0.004 . 1 . . . . A 42 PHE HZ . 34981 1 480 . 1 . 1 42 42 PHE CA C 13 56.011 0.067 . 1 . . . . A 42 PHE CA . 34981 1 481 . 1 . 1 42 42 PHE CB C 13 43.451 0.039 . 1 . . . . A 42 PHE CB . 34981 1 482 . 1 . 1 42 42 PHE CD1 C 13 133.933 0.067 . 3 . . . . A 42 PHE CD1 . 34981 1 483 . 1 . 1 42 42 PHE CD2 C 13 133.933 0.067 . 3 . . . . A 42 PHE CD2 . 34981 1 484 . 1 . 1 42 42 PHE CE1 C 13 133.853 0.091 . 3 . . . . A 42 PHE CE1 . 34981 1 485 . 1 . 1 42 42 PHE CE2 C 13 133.853 0.091 . 3 . . . . A 42 PHE CE2 . 34981 1 486 . 1 . 1 42 42 PHE CZ C 13 132.208 0.001 . 1 . . . . A 42 PHE CZ . 34981 1 487 . 1 . 1 42 42 PHE N N 15 117.429 0.011 . 1 . . . . A 42 PHE N . 34981 1 488 . 1 . 1 43 43 ARG H H 1 8.798 0.006 . 1 . . . . A 43 ARG H . 34981 1 489 . 1 . 1 43 43 ARG HA H 1 4.648 0.008 . 1 . . . . A 43 ARG HA . 34981 1 490 . 1 . 1 43 43 ARG HB2 H 1 1.562 0.012 . 2 . . . . A 43 ARG HB2 . 34981 1 491 . 1 . 1 43 43 ARG HB3 H 1 1.150 0.008 . 2 . . . . A 43 ARG HB3 . 34981 1 492 . 1 . 1 43 43 ARG HG2 H 1 0.853 0.009 . 2 . . . . A 43 ARG HG2 . 34981 1 493 . 1 . 1 43 43 ARG HG3 H 1 0.649 0.005 . 2 . . . . A 43 ARG HG3 . 34981 1 494 . 1 . 1 43 43 ARG HD2 H 1 2.953 0.003 . 2 . . . . A 43 ARG HD2 . 34981 1 495 . 1 . 1 43 43 ARG HD3 H 1 3.108 0.004 . 2 . . . . A 43 ARG HD3 . 34981 1 496 . 1 . 1 43 43 ARG CA C 13 53.942 0.000 . 1 . . . . A 43 ARG CA . 34981 1 497 . 1 . 1 43 43 ARG CB C 13 32.282 0.010 . 1 . . . . A 43 ARG CB . 34981 1 498 . 1 . 1 43 43 ARG CG C 13 27.509 0.016 . 1 . . . . A 43 ARG CG . 34981 1 499 . 1 . 1 43 43 ARG CD C 13 43.306 0.066 . 1 . . . . A 43 ARG CD . 34981 1 500 . 1 . 1 43 43 ARG N N 15 119.189 0.013 . 1 . . . . A 43 ARG N . 34981 1 501 . 1 . 1 44 44 ASN H H 1 9.905 0.004 . 1 . . . . A 44 ASN H . 34981 1 502 . 1 . 1 44 44 ASN HA H 1 4.396 0.002 . 1 . . . . A 44 ASN HA . 34981 1 503 . 1 . 1 44 44 ASN HB2 H 1 3.035 0.003 . 2 . . . . A 44 ASN HB2 . 34981 1 504 . 1 . 1 44 44 ASN HB3 H 1 2.797 0.002 . 2 . . . . A 44 ASN HB3 . 34981 1 505 . 1 . 1 44 44 ASN HD21 H 1 7.024 0.005 . 2 . . . . A 44 ASN HD21 . 34981 1 506 . 1 . 1 44 44 ASN HD22 H 1 7.575 0.001 . 2 . . . . A 44 ASN HD22 . 34981 1 507 . 1 . 1 44 44 ASN CA C 13 53.828 0.020 . 1 . . . . A 44 ASN CA . 34981 1 508 . 1 . 1 44 44 ASN CB C 13 36.623 0.040 . 1 . . . . A 44 ASN CB . 34981 1 509 . 1 . 1 44 44 ASN N N 15 128.923 0.027 . 1 . . . . A 44 ASN N . 34981 1 510 . 1 . 1 44 44 ASN ND2 N 15 112.437 0.018 . 1 . . . . A 44 ASN ND2 . 34981 1 511 . 1 . 1 45 45 GLY H H 1 8.541 0.003 . 1 . . . . A 45 GLY H . 34981 1 512 . 1 . 1 45 45 GLY HA2 H 1 4.047 0.002 . 2 . . . . A 45 GLY HA2 . 34981 1 513 . 1 . 1 45 45 GLY HA3 H 1 3.477 0.005 . 2 . . . . A 45 GLY HA3 . 34981 1 514 . 1 . 1 45 45 GLY CA C 13 45.381 0.006 . 1 . . . . A 45 GLY CA . 34981 1 515 . 1 . 1 45 45 GLY N N 15 101.864 0.021 . 1 . . . . A 45 GLY N . 34981 1 516 . 1 . 1 46 46 ARG H H 1 7.933 0.006 . 1 . . . . A 46 ARG H . 34981 1 517 . 1 . 1 46 46 ARG HA H 1 4.823 0.003 . 1 . . . . A 46 ARG HA . 34981 1 518 . 1 . 1 46 46 ARG HB2 H 1 1.893 0.006 . 2 . . . . A 46 ARG HB2 . 34981 1 519 . 1 . 1 46 46 ARG HB3 H 1 1.815 0.003 . 2 . . . . A 46 ARG HB3 . 34981 1 520 . 1 . 1 46 46 ARG HG2 H 1 1.674 0.007 . 2 . . . . A 46 ARG HG2 . 34981 1 521 . 1 . 1 46 46 ARG HG3 H 1 1.633 0.000 . 2 . . . . A 46 ARG HG3 . 34981 1 522 . 1 . 1 46 46 ARG HD2 H 1 3.205 0.000 . 2 . . . . A 46 ARG HD2 . 34981 1 523 . 1 . 1 46 46 ARG HD3 H 1 3.205 0.002 . 2 . . . . A 46 ARG HD3 . 34981 1 524 . 1 . 1 46 46 ARG CA C 13 54.056 0.042 . 1 . . . . A 46 ARG CA . 34981 1 525 . 1 . 1 46 46 ARG CB C 13 31.953 0.000 . 1 . . . . A 46 ARG CB . 34981 1 526 . 1 . 1 46 46 ARG CG C 13 27.043 0.059 . 1 . . . . A 46 ARG CG . 34981 1 527 . 1 . 1 46 46 ARG CD C 13 43.111 0.002 . 1 . . . . A 46 ARG CD . 34981 1 528 . 1 . 1 46 46 ARG N N 15 121.347 0.021 . 1 . . . . A 46 ARG N . 34981 1 529 . 1 . 1 47 47 VAL H H 1 8.658 0.002 . 1 . . . . A 47 VAL H . 34981 1 530 . 1 . 1 47 47 VAL HA H 1 3.346 0.004 . 1 . . . . A 47 VAL HA . 34981 1 531 . 1 . 1 47 47 VAL HB H 1 1.759 0.005 . 1 . . . . A 47 VAL HB . 34981 1 532 . 1 . 1 47 47 VAL HG11 H 1 0.738 0.001 . 2 . . . . A 47 VAL HG11 . 34981 1 533 . 1 . 1 47 47 VAL HG12 H 1 0.738 0.001 . 2 . . . . A 47 VAL HG12 . 34981 1 534 . 1 . 1 47 47 VAL HG13 H 1 0.738 0.001 . 2 . . . . A 47 VAL HG13 . 34981 1 535 . 1 . 1 47 47 VAL HG21 H 1 0.690 0.001 . 2 . . . . A 47 VAL HG21 . 34981 1 536 . 1 . 1 47 47 VAL HG22 H 1 0.690 0.001 . 2 . . . . A 47 VAL HG22 . 34981 1 537 . 1 . 1 47 47 VAL HG23 H 1 0.690 0.001 . 2 . . . . A 47 VAL HG23 . 34981 1 538 . 1 . 1 47 47 VAL CA C 13 63.256 0.019 . 1 . . . . A 47 VAL CA . 34981 1 539 . 1 . 1 47 47 VAL CB C 13 31.853 0.057 . 1 . . . . A 47 VAL CB . 34981 1 540 . 1 . 1 47 47 VAL CG1 C 13 19.979 0.049 . 2 . . . . A 47 VAL CG1 . 34981 1 541 . 1 . 1 47 47 VAL CG2 C 13 21.961 0.036 . 2 . . . . A 47 VAL CG2 . 34981 1 542 . 1 . 1 47 47 VAL N N 15 125.834 0.018 . 1 . . . . A 47 VAL N . 34981 1 543 . 1 . 1 48 48 LEU H H 1 8.659 0.003 . 1 . . . . A 48 LEU H . 34981 1 544 . 1 . 1 48 48 LEU HA H 1 4.399 0.003 . 1 . . . . A 48 LEU HA . 34981 1 545 . 1 . 1 48 48 LEU HB2 H 1 1.447 0.003 . 2 . . . . A 48 LEU HB2 . 34981 1 546 . 1 . 1 48 48 LEU HB3 H 1 1.190 0.005 . 2 . . . . A 48 LEU HB3 . 34981 1 547 . 1 . 1 48 48 LEU HG H 1 1.326 0.004 . 1 . . . . A 48 LEU HG . 34981 1 548 . 1 . 1 48 48 LEU HD11 H 1 0.870 0.001 . 2 . . . . A 48 LEU HD11 . 34981 1 549 . 1 . 1 48 48 LEU HD12 H 1 0.870 0.001 . 2 . . . . A 48 LEU HD12 . 34981 1 550 . 1 . 1 48 48 LEU HD13 H 1 0.870 0.001 . 2 . . . . A 48 LEU HD13 . 34981 1 551 . 1 . 1 48 48 LEU HD21 H 1 0.792 0.003 . 2 . . . . A 48 LEU HD21 . 34981 1 552 . 1 . 1 48 48 LEU HD22 H 1 0.792 0.003 . 2 . . . . A 48 LEU HD22 . 34981 1 553 . 1 . 1 48 48 LEU HD23 H 1 0.792 0.003 . 2 . . . . A 48 LEU HD23 . 34981 1 554 . 1 . 1 48 48 LEU CA C 13 53.302 0.055 . 1 . . . . A 48 LEU CA . 34981 1 555 . 1 . 1 48 48 LEU CB C 13 43.122 0.022 . 1 . . . . A 48 LEU CB . 34981 1 556 . 1 . 1 48 48 LEU CG C 13 26.686 0.069 . 1 . . . . A 48 LEU CG . 34981 1 557 . 1 . 1 48 48 LEU CD1 C 13 24.691 0.013 . 2 . . . . A 48 LEU CD1 . 34981 1 558 . 1 . 1 48 48 LEU CD2 C 13 25.719 0.025 . 2 . . . . A 48 LEU CD2 . 34981 1 559 . 1 . 1 48 48 LEU N N 15 130.202 0.016 . 1 . . . . A 48 LEU N . 34981 1 560 . 1 . 1 49 49 LYS H H 1 8.330 0.002 . 1 . . . . A 49 LYS H . 34981 1 561 . 1 . 1 49 49 LYS HA H 1 4.633 0.005 . 1 . . . . A 49 LYS HA . 34981 1 562 . 1 . 1 49 49 LYS HB2 H 1 1.697 0.005 . 2 . . . . A 49 LYS HB2 . 34981 1 563 . 1 . 1 49 49 LYS HB3 H 1 1.626 0.003 . 2 . . . . A 49 LYS HB3 . 34981 1 564 . 1 . 1 49 49 LYS HG2 H 1 1.396 0.009 . 2 . . . . A 49 LYS HG2 . 34981 1 565 . 1 . 1 49 49 LYS HG3 H 1 1.272 0.003 . 2 . . . . A 49 LYS HG3 . 34981 1 566 . 1 . 1 49 49 LYS HD2 H 1 1.579 0.003 . 2 . . . . A 49 LYS HD2 . 34981 1 567 . 1 . 1 49 49 LYS HD3 H 1 1.521 0.000 . 2 . . . . A 49 LYS HD3 . 34981 1 568 . 1 . 1 49 49 LYS HE2 H 1 2.896 0.006 . 2 . . . . A 49 LYS HE2 . 34981 1 569 . 1 . 1 49 49 LYS HE3 H 1 2.897 0.003 . 2 . . . . A 49 LYS HE3 . 34981 1 570 . 1 . 1 49 49 LYS CA C 13 52.637 0.072 . 1 . . . . A 49 LYS CA . 34981 1 571 . 1 . 1 49 49 LYS CB C 13 32.356 0.003 . 1 . . . . A 49 LYS CB . 34981 1 572 . 1 . 1 49 49 LYS CG C 13 24.559 0.011 . 1 . . . . A 49 LYS CG . 34981 1 573 . 1 . 1 49 49 LYS CD C 13 28.908 0.012 . 1 . . . . A 49 LYS CD . 34981 1 574 . 1 . 1 49 49 LYS CE C 13 41.962 0.008 . 1 . . . . A 49 LYS CE . 34981 1 575 . 1 . 1 49 49 LYS N N 15 125.738 0.040 . 1 . . . . A 49 LYS N . 34981 1 576 . 1 . 1 50 50 PRO HA H 1 4.123 0.004 . 1 . . . . A 50 PRO HA . 34981 1 577 . 1 . 1 50 50 PRO HB2 H 1 2.120 0.005 . 2 . . . . A 50 PRO HB2 . 34981 1 578 . 1 . 1 50 50 PRO HB3 H 1 1.965 0.005 . 2 . . . . A 50 PRO HB3 . 34981 1 579 . 1 . 1 50 50 PRO HG2 H 1 1.961 0.001 . 2 . . . . A 50 PRO HG2 . 34981 1 580 . 1 . 1 50 50 PRO HG3 H 1 2.137 0.002 . 2 . . . . A 50 PRO HG3 . 34981 1 581 . 1 . 1 50 50 PRO HD2 H 1 3.718 0.010 . 2 . . . . A 50 PRO HD2 . 34981 1 582 . 1 . 1 50 50 PRO HD3 H 1 3.649 0.008 . 2 . . . . A 50 PRO HD3 . 34981 1 583 . 1 . 1 50 50 PRO CA C 13 62.926 0.057 . 1 . . . . A 50 PRO CA . 34981 1 584 . 1 . 1 50 50 PRO CB C 13 31.179 0.027 . 1 . . . . A 50 PRO CB . 34981 1 585 . 1 . 1 50 50 PRO CG C 13 27.805 0.027 . 1 . . . . A 50 PRO CG . 34981 1 586 . 1 . 1 50 50 PRO CD C 13 50.308 0.017 . 1 . . . . A 50 PRO CD . 34981 1 587 . 1 . 1 51 51 GLN H H 1 7.928 0.003 . 1 . . . . A 51 GLN H . 34981 1 588 . 1 . 1 51 51 GLN HA H 1 4.450 0.002 . 1 . . . . A 51 GLN HA . 34981 1 589 . 1 . 1 51 51 GLN HB2 H 1 2.039 0.017 . 2 . . . . A 51 GLN HB2 . 34981 1 590 . 1 . 1 51 51 GLN HB3 H 1 1.970 0.007 . 2 . . . . A 51 GLN HB3 . 34981 1 591 . 1 . 1 51 51 GLN HG2 H 1 2.155 0.003 . 2 . . . . A 51 GLN HG2 . 34981 1 592 . 1 . 1 51 51 GLN HG3 H 1 2.267 0.007 . 2 . . . . A 51 GLN HG3 . 34981 1 593 . 1 . 1 51 51 GLN HE21 H 1 7.516 0.001 . 2 . . . . A 51 GLN HE21 . 34981 1 594 . 1 . 1 51 51 GLN HE22 H 1 6.776 0.001 . 2 . . . . A 51 GLN HE22 . 34981 1 595 . 1 . 1 51 51 GLN CA C 13 55.005 0.057 . 1 . . . . A 51 GLN CA . 34981 1 596 . 1 . 1 51 51 GLN CB C 13 30.164 0.012 . 1 . . . . A 51 GLN CB . 34981 1 597 . 1 . 1 51 51 GLN CG C 13 32.604 0.007 . 1 . . . . A 51 GLN CG . 34981 1 598 . 1 . 1 51 51 GLN N N 15 121.949 0.017 . 1 . . . . A 51 GLN N . 34981 1 599 . 1 . 1 51 51 GLN NE2 N 15 111.747 0.058 . 1 . . . . A 51 GLN NE2 . 34981 1 600 . 1 . 1 52 52 GLY H H 1 8.606 0.01 . 1 . . . . A 52 GLY H . 34981 1 601 . 1 . 1 52 52 GLY HA2 H 1 3.927 0.002 . 2 . . . . A 52 GLY HA2 . 34981 1 602 . 1 . 1 52 52 GLY HA3 H 1 3.585 0.001 . 2 . . . . A 52 GLY HA3 . 34981 1 603 . 1 . 1 52 52 GLY CA C 13 47.280 0.018 . 1 . . . . A 52 GLY CA . 34981 1 604 . 1 . 1 53 53 ARG H H 1 8.710 0.001 . 1 . . . . A 53 ARG H . 34981 1 605 . 1 . 1 53 53 ARG HA H 1 4.100 0.004 . 1 . . . . A 53 ARG HA . 34981 1 606 . 1 . 1 53 53 ARG HB2 H 1 1.965 0.01 . 2 . . . . A 53 ARG HB2 . 34981 1 607 . 1 . 1 53 53 ARG HB3 H 1 2.125 0.01 . 2 . . . . A 53 ARG HB3 . 34981 1 608 . 1 . 1 53 53 ARG HG2 H 1 1.686 0.005 . 2 . . . . A 53 ARG HG2 . 34981 1 609 . 1 . 1 53 53 ARG HG3 H 1 1.539 0.002 . 2 . . . . A 53 ARG HG3 . 34981 1 610 . 1 . 1 53 53 ARG HD2 H 1 3.121 0.000 . 2 . . . . A 53 ARG HD2 . 34981 1 611 . 1 . 1 53 53 ARG HD3 H 1 3.124 0.007 . 2 . . . . A 53 ARG HD3 . 34981 1 612 . 1 . 1 53 53 ARG CA C 13 57.394 0.048 . 1 . . . . A 53 ARG CA . 34981 1 613 . 1 . 1 53 53 ARG CB C 13 30.287 0.017 . 1 . . . . A 53 ARG CB . 34981 1 614 . 1 . 1 53 53 ARG CG C 13 26.847 0.014 . 1 . . . . A 53 ARG CG . 34981 1 615 . 1 . 1 53 53 ARG CD C 13 43.133 0.005 . 1 . . . . A 53 ARG CD . 34981 1 616 . 1 . 1 53 53 ARG N N 15 126.055 0.000 . 1 . . . . A 53 ARG N . 34981 1 617 . 1 . 1 54 54 VAL H H 1 7.671 0.004 . 1 . . . . A 54 VAL H . 34981 1 618 . 1 . 1 54 54 VAL HA H 1 4.588 0.005 . 1 . . . . A 54 VAL HA . 34981 1 619 . 1 . 1 54 54 VAL HB H 1 2.049 0.004 . 1 . . . . A 54 VAL HB . 34981 1 620 . 1 . 1 54 54 VAL HG11 H 1 0.579 0.005 . 2 . . . . A 54 VAL HG11 . 34981 1 621 . 1 . 1 54 54 VAL HG12 H 1 0.579 0.005 . 2 . . . . A 54 VAL HG12 . 34981 1 622 . 1 . 1 54 54 VAL HG13 H 1 0.579 0.005 . 2 . . . . A 54 VAL HG13 . 34981 1 623 . 1 . 1 54 54 VAL HG21 H 1 0.896 0.002 . 2 . . . . A 54 VAL HG21 . 34981 1 624 . 1 . 1 54 54 VAL HG22 H 1 0.896 0.002 . 2 . . . . A 54 VAL HG22 . 34981 1 625 . 1 . 1 54 54 VAL HG23 H 1 0.896 0.002 . 2 . . . . A 54 VAL HG23 . 34981 1 626 . 1 . 1 54 54 VAL CA C 13 61.540 0.044 . 1 . . . . A 54 VAL CA . 34981 1 627 . 1 . 1 54 54 VAL CB C 13 33.493 0.043 . 1 . . . . A 54 VAL CB . 34981 1 628 . 1 . 1 54 54 VAL CG1 C 13 21.261 0.016 . 2 . . . . A 54 VAL CG1 . 34981 1 629 . 1 . 1 54 54 VAL CG2 C 13 21.524 0.021 . 2 . . . . A 54 VAL CG2 . 34981 1 630 . 1 . 1 54 54 VAL N N 15 120.800 0.034 . 1 . . . . A 54 VAL N . 34981 1 631 . 1 . 1 55 55 LYS H H 1 8.856 0.003 . 1 . . . . A 55 LYS H . 34981 1 632 . 1 . 1 55 55 LYS HA H 1 4.521 0.003 . 1 . . . . A 55 LYS HA . 34981 1 633 . 1 . 1 55 55 LYS HB2 H 1 1.602 0.002 . 2 . . . . A 55 LYS HB2 . 34981 1 634 . 1 . 1 55 55 LYS HB3 H 1 1.514 0.002 . 2 . . . . A 55 LYS HB3 . 34981 1 635 . 1 . 1 55 55 LYS HG2 H 1 1.288 0.005 . 2 . . . . A 55 LYS HG2 . 34981 1 636 . 1 . 1 55 55 LYS HG3 H 1 1.169 0.005 . 2 . . . . A 55 LYS HG3 . 34981 1 637 . 1 . 1 55 55 LYS HD2 H 1 1.468 0.005 . 2 . . . . A 55 LYS HD2 . 34981 1 638 . 1 . 1 55 55 LYS HD3 H 1 1.671 0.001 . 2 . . . . A 55 LYS HD3 . 34981 1 639 . 1 . 1 55 55 LYS HE2 H 1 2.776 0.004 . 2 . . . . A 55 LYS HE2 . 34981 1 640 . 1 . 1 55 55 LYS CA C 13 54.948 0.044 . 1 . . . . A 55 LYS CA . 34981 1 641 . 1 . 1 55 55 LYS CB C 13 36.336 0.014 . 1 . . . . A 55 LYS CB . 34981 1 642 . 1 . 1 55 55 LYS CG C 13 24.546 0.010 . 1 . . . . A 55 LYS CG . 34981 1 643 . 1 . 1 55 55 LYS CD C 13 29.234 0.007 . 1 . . . . A 55 LYS CD . 34981 1 644 . 1 . 1 55 55 LYS CE C 13 41.691 0.024 . 1 . . . . A 55 LYS CE . 34981 1 645 . 1 . 1 55 55 LYS N N 15 126.865 0.022 . 1 . . . . A 55 LYS N . 34981 1 646 . 1 . 1 56 56 THR H H 1 7.832 0.003 . 1 . . . . A 56 THR H . 34981 1 647 . 1 . 1 56 56 THR HA H 1 5.125 0.003 . 1 . . . . A 56 THR HA . 34981 1 648 . 1 . 1 56 56 THR HB H 1 4.089 0.002 . 1 . . . . A 56 THR HB . 34981 1 649 . 1 . 1 56 56 THR HG21 H 1 0.414 0.002 . 1 . . . . A 56 THR HG21 . 34981 1 650 . 1 . 1 56 56 THR HG22 H 1 0.414 0.002 . 1 . . . . A 56 THR HG22 . 34981 1 651 . 1 . 1 56 56 THR HG23 H 1 0.414 0.002 . 1 . . . . A 56 THR HG23 . 34981 1 652 . 1 . 1 56 56 THR CA C 13 58.275 0.051 . 1 . . . . A 56 THR CA . 34981 1 653 . 1 . 1 56 56 THR CB C 13 70.753 0.011 . 1 . . . . A 56 THR CB . 34981 1 654 . 1 . 1 56 56 THR CG2 C 13 21.606 0.047 . 1 . . . . A 56 THR CG2 . 34981 1 655 . 1 . 1 56 56 THR N N 15 112.440 0.012 . 1 . . . . A 56 THR N . 34981 1 656 . 1 . 1 57 57 GLU H H 1 8.835 0.002 . 1 . . . . A 57 GLU H . 34981 1 657 . 1 . 1 57 57 GLU HA H 1 4.744 0.004 . 1 . . . . A 57 GLU HA . 34981 1 658 . 1 . 1 57 57 GLU HB2 H 1 1.741 0.004 . 2 . . . . A 57 GLU HB2 . 34981 1 659 . 1 . 1 57 57 GLU HB3 H 1 1.944 0.003 . 2 . . . . A 57 GLU HB3 . 34981 1 660 . 1 . 1 57 57 GLU HG2 H 1 2.066 0.002 . 2 . . . . A 57 GLU HG2 . 34981 1 661 . 1 . 1 57 57 GLU HG3 H 1 1.911 0.003 . 2 . . . . A 57 GLU HG3 . 34981 1 662 . 1 . 1 57 57 GLU CB C 13 35.596 0.043 . 1 . . . . A 57 GLU CB . 34981 1 663 . 1 . 1 57 57 GLU CG C 13 36.877 0.011 . 1 . . . . A 57 GLU CG . 34981 1 664 . 1 . 1 57 57 GLU N N 15 119.689 0.022 . 1 . . . . A 57 GLU N . 34981 1 665 . 1 . 1 58 58 VAL H H 1 8.637 0.004 . 1 . . . . A 58 VAL H . 34981 1 666 . 1 . 1 58 58 VAL HA H 1 4.458 0.003 . 1 . . . . A 58 VAL HA . 34981 1 667 . 1 . 1 58 58 VAL HB H 1 1.708 0.005 . 1 . . . . A 58 VAL HB . 34981 1 668 . 1 . 1 58 58 VAL HG11 H 1 0.727 0.002 . 2 . . . . A 58 VAL HG11 . 34981 1 669 . 1 . 1 58 58 VAL HG12 H 1 0.727 0.002 . 2 . . . . A 58 VAL HG12 . 34981 1 670 . 1 . 1 58 58 VAL HG13 H 1 0.727 0.002 . 2 . . . . A 58 VAL HG13 . 34981 1 671 . 1 . 1 58 58 VAL HG21 H 1 0.451 0.004 . 2 . . . . A 58 VAL HG21 . 34981 1 672 . 1 . 1 58 58 VAL HG22 H 1 0.451 0.004 . 2 . . . . A 58 VAL HG22 . 34981 1 673 . 1 . 1 58 58 VAL HG23 H 1 0.451 0.004 . 2 . . . . A 58 VAL HG23 . 34981 1 674 . 1 . 1 58 58 VAL CA C 13 61.667 0.032 . 1 . . . . A 58 VAL CA . 34981 1 675 . 1 . 1 58 58 VAL CB C 13 33.779 0.037 . 1 . . . . A 58 VAL CB . 34981 1 676 . 1 . 1 58 58 VAL CG1 C 13 21.215 0.028 . 2 . . . . A 58 VAL CG1 . 34981 1 677 . 1 . 1 58 58 VAL CG2 C 13 19.438 0.016 . 2 . . . . A 58 VAL CG2 . 34981 1 678 . 1 . 1 58 58 VAL N N 15 124.920 0.025 . 1 . . . . A 58 VAL N . 34981 1 679 . 1 . 1 59 59 GLU H H 1 9.279 0.004 . 1 . . . . A 59 GLU H . 34981 1 680 . 1 . 1 59 59 GLU HA H 1 4.455 0.002 . 1 . . . . A 59 GLU HA . 34981 1 681 . 1 . 1 59 59 GLU HB2 H 1 1.716 0.002 . 2 . . . . A 59 GLU HB2 . 34981 1 682 . 1 . 1 59 59 GLU HB3 H 1 1.938 0.004 . 2 . . . . A 59 GLU HB3 . 34981 1 683 . 1 . 1 59 59 GLU HG2 H 1 2.023 0.003 . 2 . . . . A 59 GLU HG2 . 34981 1 684 . 1 . 1 59 59 GLU HG3 H 1 2.224 0.01 . 2 . . . . A 59 GLU HG3 . 34981 1 685 . 1 . 1 59 59 GLU CA C 13 54.420 0.050 . 1 . . . . A 59 GLU CA . 34981 1 686 . 1 . 1 59 59 GLU CB C 13 30.520 0.039 . 1 . . . . A 59 GLU CB . 34981 1 687 . 1 . 1 59 59 GLU CG C 13 35.895 0.015 . 1 . . . . A 59 GLU CG . 34981 1 688 . 1 . 1 59 59 GLU N N 15 130.074 0.020 . 1 . . . . A 59 GLU N . 34981 1 689 . 1 . 1 60 60 HIS H H 1 9.184 0.001 . 1 . . . . A 60 HIS H . 34981 1 690 . 1 . 1 60 60 HIS HA H 1 3.947 0.004 . 1 . . . . A 60 HIS HA . 34981 1 691 . 1 . 1 60 60 HIS HB2 H 1 3.662 0.002 . 2 . . . . A 60 HIS HB2 . 34981 1 692 . 1 . 1 60 60 HIS HB3 H 1 3.212 0.005 . 2 . . . . A 60 HIS HB3 . 34981 1 693 . 1 . 1 60 60 HIS HD2 H 1 7.087 0.004 . 1 . . . . A 60 HIS HD2 . 34981 1 694 . 1 . 1 60 60 HIS HE1 H 1 7.716 0.002 . 1 . . . . A 60 HIS HE1 . 34981 1 695 . 1 . 1 60 60 HIS CA C 13 60.252 0.023 . 1 . . . . A 60 HIS CA . 34981 1 696 . 1 . 1 60 60 HIS CB C 13 28.860 0.015 . 1 . . . . A 60 HIS CB . 34981 1 697 . 1 . 1 60 60 HIS CD2 C 13 122.355 0.026 . 1 . . . . A 60 HIS CD2 . 34981 1 698 . 1 . 1 60 60 HIS CE1 C 13 141.228 0.023 . 1 . . . . A 60 HIS CE1 . 34981 1 699 . 1 . 1 60 60 HIS N N 15 126.679 0.029 . 1 . . . . A 60 HIS N . 34981 1 700 . 1 . 1 61 61 LYS H H 1 8.936 0.003 . 1 . . . . A 61 LYS H . 34981 1 701 . 1 . 1 61 61 LYS HA H 1 4.195 0.005 . 1 . . . . A 61 LYS HA . 34981 1 702 . 1 . 1 61 61 LYS HB2 H 1 2.864 0.005 . 2 . . . . A 61 LYS HB2 . 34981 1 703 . 1 . 1 61 61 LYS HB3 H 1 1.663 0.008 . 2 . . . . A 61 LYS HB3 . 34981 1 704 . 1 . 1 61 61 LYS HG2 H 1 1.193 0.005 . 2 . . . . A 61 LYS HG2 . 34981 1 705 . 1 . 1 61 61 LYS HG3 H 1 0.802 0.005 . 2 . . . . A 61 LYS HG3 . 34981 1 706 . 1 . 1 61 61 LYS HD2 H 1 1.676 0.002 . 2 . . . . A 61 LYS HD2 . 34981 1 707 . 1 . 1 61 61 LYS HD3 H 1 1.902 0.01 . 2 . . . . A 61 LYS HD3 . 34981 1 708 . 1 . 1 61 61 LYS CA C 13 59.155 0.084 . 1 . . . . A 61 LYS CA . 34981 1 709 . 1 . 1 61 61 LYS CB C 13 33.092 0.044 . 1 . . . . A 61 LYS CB . 34981 1 710 . 1 . 1 61 61 LYS CG C 13 26.778 0.014 . 1 . . . . A 61 LYS CG . 34981 1 711 . 1 . 1 61 61 LYS CD C 13 29.235 0.022 . 1 . . . . A 61 LYS CD . 34981 1 712 . 1 . 1 61 61 LYS N N 15 127.469 0.020 . 1 . . . . A 61 LYS N . 34981 1 713 . 1 . 1 62 62 VAL H H 1 8.329 0.002 . 1 . . . . A 62 VAL H . 34981 1 714 . 1 . 1 62 62 VAL HA H 1 4.569 0.004 . 1 . . . . A 62 VAL HA . 34981 1 715 . 1 . 1 62 62 VAL HB H 1 2.242 0.004 . 1 . . . . A 62 VAL HB . 34981 1 716 . 1 . 1 62 62 VAL HG11 H 1 1.082 0.004 . 2 . . . . A 62 VAL HG11 . 34981 1 717 . 1 . 1 62 62 VAL HG12 H 1 1.082 0.004 . 2 . . . . A 62 VAL HG12 . 34981 1 718 . 1 . 1 62 62 VAL HG13 H 1 1.082 0.004 . 2 . . . . A 62 VAL HG13 . 34981 1 719 . 1 . 1 62 62 VAL HG21 H 1 0.972 0.003 . 2 . . . . A 62 VAL HG21 . 34981 1 720 . 1 . 1 62 62 VAL HG22 H 1 0.972 0.003 . 2 . . . . A 62 VAL HG22 . 34981 1 721 . 1 . 1 62 62 VAL HG23 H 1 0.972 0.003 . 2 . . . . A 62 VAL HG23 . 34981 1 722 . 1 . 1 62 62 VAL CA C 13 63.765 0.016 . 1 . . . . A 62 VAL CA . 34981 1 723 . 1 . 1 62 62 VAL CB C 13 32.633 0.035 . 1 . . . . A 62 VAL CB . 34981 1 724 . 1 . 1 62 62 VAL CG1 C 13 22.203 0.013 . 2 . . . . A 62 VAL CG1 . 34981 1 725 . 1 . 1 62 62 VAL CG2 C 13 21.285 0.071 . 2 . . . . A 62 VAL CG2 . 34981 1 726 . 1 . 1 62 62 VAL N N 15 122.174 0.020 . 1 . . . . A 62 VAL N . 34981 1 727 . 1 . 1 63 63 HIS H H 1 9.401 0.004 . 1 . . . . A 63 HIS H . 34981 1 728 . 1 . 1 63 63 HIS HA H 1 4.808 0.004 . 1 . . . . A 63 HIS HA . 34981 1 729 . 1 . 1 63 63 HIS HB2 H 1 3.787 0.003 . 2 . . . . A 63 HIS HB2 . 34981 1 730 . 1 . 1 63 63 HIS HB3 H 1 3.178 0.002 . 2 . . . . A 63 HIS HB3 . 34981 1 731 . 1 . 1 63 63 HIS HD1 H 1 8.065 0.003 . 1 . . . . A 63 HIS HD1 . 34981 1 732 . 1 . 1 63 63 HIS HD2 H 1 7.357 0.002 . 1 . . . . A 63 HIS HD2 . 34981 1 733 . 1 . 1 63 63 HIS HE1 H 1 7.466 0.007 . 1 . . . . A 63 HIS HE1 . 34981 1 734 . 1 . 1 63 63 HIS HE2 H 1 8.536 0.000 . 1 . . . . A 63 HIS HE2 . 34981 1 735 . 1 . 1 63 63 HIS CA C 13 56.569 0.045 . 1 . . . . A 63 HIS CA . 34981 1 736 . 1 . 1 63 63 HIS CB C 13 33.633 0.032 . 1 . . . . A 63 HIS CB . 34981 1 737 . 1 . 1 63 63 HIS CD2 C 13 119.273 0.028 . 1 . . . . A 63 HIS CD2 . 34981 1 738 . 1 . 1 63 63 HIS CE1 C 13 141.121 0.030 . 1 . . . . A 63 HIS CE1 . 34981 1 739 . 1 . 1 63 63 HIS N N 15 130.832 0.013 . 1 . . . . A 63 HIS N . 34981 1 740 . 1 . 1 63 63 HIS ND1 N 15 181.836 0.051 . 1 . . . . A 63 HIS ND1 . 34981 1 741 . 1 . 1 63 63 HIS NE2 N 15 182.346 0.000 . 1 . . . . A 63 HIS NE2 . 34981 1 742 . 1 . 1 64 64 LYS H H 1 8.682 0.002 . 1 . . . . A 64 LYS H . 34981 1 743 . 1 . 1 64 64 LYS HA H 1 5.392 0.003 . 1 . . . . A 64 LYS HA . 34981 1 744 . 1 . 1 64 64 LYS HB2 H 1 1.539 0.003 . 2 . . . . A 64 LYS HB2 . 34981 1 745 . 1 . 1 64 64 LYS HB3 H 1 1.416 0.008 . 2 . . . . A 64 LYS HB3 . 34981 1 746 . 1 . 1 64 64 LYS HG2 H 1 1.140 0.001 . 2 . . . . A 64 LYS HG2 . 34981 1 747 . 1 . 1 64 64 LYS HG3 H 1 1.117 0.002 . 2 . . . . A 64 LYS HG3 . 34981 1 748 . 1 . 1 64 64 LYS HD2 H 1 1.395 0.000 . 2 . . . . A 64 LYS HD2 . 34981 1 749 . 1 . 1 64 64 LYS HD3 H 1 1.393 0.001 . 2 . . . . A 64 LYS HD3 . 34981 1 750 . 1 . 1 64 64 LYS HE3 H 1 2.609 0.004 . 2 . . . . A 64 LYS HE3 . 34981 1 751 . 1 . 1 64 64 LYS CA C 13 54.560 0.040 . 1 . . . . A 64 LYS CA . 34981 1 752 . 1 . 1 64 64 LYS CB C 13 37.176 0.025 . 1 . . . . A 64 LYS CB . 34981 1 753 . 1 . 1 64 64 LYS CG C 13 24.378 0.017 . 1 . . . . A 64 LYS CG . 34981 1 754 . 1 . 1 64 64 LYS CD C 13 29.245 0.013 . 1 . . . . A 64 LYS CD . 34981 1 755 . 1 . 1 64 64 LYS CE C 13 41.353 0.022 . 1 . . . . A 64 LYS CE . 34981 1 756 . 1 . 1 64 64 LYS N N 15 122.712 0.021 . 1 . . . . A 64 LYS N . 34981 1 757 . 1 . 1 65 65 LEU H H 1 8.590 0.004 . 1 . . . . A 65 LEU H . 34981 1 758 . 1 . 1 65 65 LEU HA H 1 4.297 0.004 . 1 . . . . A 65 LEU HA . 34981 1 759 . 1 . 1 65 65 LEU HB2 H 1 0.619 0.004 . 2 . . . . A 65 LEU HB2 . 34981 1 760 . 1 . 1 65 65 LEU HB3 H 1 -1.007 0.008 . 2 . . . . A 65 LEU HB3 . 34981 1 761 . 1 . 1 65 65 LEU HG H 1 0.254 0.001 . 1 . . . . A 65 LEU HG . 34981 1 762 . 1 . 1 65 65 LEU HD11 H 1 0.416 0.005 . 2 . . . . A 65 LEU HD11 . 34981 1 763 . 1 . 1 65 65 LEU HD12 H 1 0.416 0.005 . 2 . . . . A 65 LEU HD12 . 34981 1 764 . 1 . 1 65 65 LEU HD13 H 1 0.416 0.005 . 2 . . . . A 65 LEU HD13 . 34981 1 765 . 1 . 1 65 65 LEU HD21 H 1 0.093 0.004 . 2 . . . . A 65 LEU HD21 . 34981 1 766 . 1 . 1 65 65 LEU HD22 H 1 0.093 0.004 . 2 . . . . A 65 LEU HD22 . 34981 1 767 . 1 . 1 65 65 LEU HD23 H 1 0.093 0.004 . 2 . . . . A 65 LEU HD23 . 34981 1 768 . 1 . 1 65 65 LEU CA C 13 52.925 0.037 . 1 . . . . A 65 LEU CA . 34981 1 769 . 1 . 1 65 65 LEU CB C 13 42.942 0.018 . 1 . . . . A 65 LEU CB . 34981 1 770 . 1 . 1 65 65 LEU CG C 13 27.239 0.098 . 1 . . . . A 65 LEU CG . 34981 1 771 . 1 . 1 65 65 LEU CD1 C 13 21.605 0.049 . 2 . . . . A 65 LEU CD1 . 34981 1 772 . 1 . 1 65 65 LEU CD2 C 13 24.338 0.045 . 2 . . . . A 65 LEU CD2 . 34981 1 773 . 1 . 1 65 65 LEU N N 15 130.464 0.018 . 1 . . . . A 65 LEU N . 34981 1 774 . 1 . 1 66 66 THR H H 1 8.696 0.005 . 1 . . . . A 66 THR H . 34981 1 775 . 1 . 1 66 66 THR HA H 1 5.264 0.008 . 1 . . . . A 66 THR HA . 34981 1 776 . 1 . 1 66 66 THR HB H 1 3.637 0.003 . 1 . . . . A 66 THR HB . 34981 1 777 . 1 . 1 66 66 THR HG21 H 1 0.898 0.004 . 1 . . . . A 66 THR HG21 . 34981 1 778 . 1 . 1 66 66 THR HG22 H 1 0.898 0.004 . 1 . . . . A 66 THR HG22 . 34981 1 779 . 1 . 1 66 66 THR HG23 H 1 0.898 0.004 . 1 . . . . A 66 THR HG23 . 34981 1 780 . 1 . 1 66 66 THR CA C 13 60.342 0.060 . 1 . . . . A 66 THR CA . 34981 1 781 . 1 . 1 66 66 THR CB C 13 70.637 0.020 . 1 . . . . A 66 THR CB . 34981 1 782 . 1 . 1 66 66 THR CG2 C 13 20.715 0.029 . 1 . . . . A 66 THR CG2 . 34981 1 783 . 1 . 1 66 66 THR N N 15 121.877 0.012 . 1 . . . . A 66 THR N . 34981 1 784 . 1 . 1 67 67 ILE H H 1 8.882 0.004 . 1 . . . . A 67 ILE H . 34981 1 785 . 1 . 1 67 67 ILE HA H 1 4.565 0.008 . 1 . . . . A 67 ILE HA . 34981 1 786 . 1 . 1 67 67 ILE HB H 1 1.284 0.006 . 1 . . . . A 67 ILE HB . 34981 1 787 . 1 . 1 67 67 ILE HG12 H 1 1.105 0.007 . 2 . . . . A 67 ILE HG12 . 34981 1 788 . 1 . 1 67 67 ILE HG13 H 1 0.656 0.007 . 2 . . . . A 67 ILE HG13 . 34981 1 789 . 1 . 1 67 67 ILE HG21 H 1 0.601 0.006 . 1 . . . . A 67 ILE HG21 . 34981 1 790 . 1 . 1 67 67 ILE HG22 H 1 0.601 0.006 . 1 . . . . A 67 ILE HG22 . 34981 1 791 . 1 . 1 67 67 ILE HG23 H 1 0.601 0.006 . 1 . . . . A 67 ILE HG23 . 34981 1 792 . 1 . 1 67 67 ILE HD11 H 1 0.495 0.008 . 1 . . . . A 67 ILE HD11 . 34981 1 793 . 1 . 1 67 67 ILE HD12 H 1 0.495 0.008 . 1 . . . . A 67 ILE HD12 . 34981 1 794 . 1 . 1 67 67 ILE HD13 H 1 0.495 0.008 . 1 . . . . A 67 ILE HD13 . 34981 1 795 . 1 . 1 67 67 ILE CA C 13 59.875 0.069 . 1 . . . . A 67 ILE CA . 34981 1 796 . 1 . 1 67 67 ILE CB C 13 40.504 0.035 . 1 . . . . A 67 ILE CB . 34981 1 797 . 1 . 1 67 67 ILE CG1 C 13 26.452 0.062 . 1 . . . . A 67 ILE CG1 . 34981 1 798 . 1 . 1 67 67 ILE CG2 C 13 17.826 0.069 . 1 . . . . A 67 ILE CG2 . 34981 1 799 . 1 . 1 67 67 ILE CD1 C 13 13.630 0.042 . 1 . . . . A 67 ILE CD1 . 34981 1 800 . 1 . 1 67 67 ILE N N 15 124.453 0.016 . 1 . . . . A 67 ILE N . 34981 1 801 . 1 . 1 68 68 ALA H H 1 8.460 0.004 . 1 . . . . A 68 ALA H . 34981 1 802 . 1 . 1 68 68 ALA HA H 1 4.339 0.002 . 1 . . . . A 68 ALA HA . 34981 1 803 . 1 . 1 68 68 ALA HB1 H 1 1.238 0.002 . 1 . . . . A 68 ALA HB1 . 34981 1 804 . 1 . 1 68 68 ALA HB2 H 1 1.238 0.002 . 1 . . . . A 68 ALA HB2 . 34981 1 805 . 1 . 1 68 68 ALA HB3 H 1 1.238 0.002 . 1 . . . . A 68 ALA HB3 . 34981 1 806 . 1 . 1 68 68 ALA CA C 13 51.433 0.037 . 1 . . . . A 68 ALA CA . 34981 1 807 . 1 . 1 68 68 ALA CB C 13 19.531 0.017 . 1 . . . . A 68 ALA CB . 34981 1 808 . 1 . 1 68 68 ALA N N 15 129.164 0.019 . 1 . . . . A 68 ALA N . 34981 1 809 . 1 . 1 69 69 ASP H H 1 7.811 0.003 . 1 . . . . A 69 ASP H . 34981 1 810 . 1 . 1 69 69 ASP HA H 1 3.806 0.007 . 1 . . . . A 69 ASP HA . 34981 1 811 . 1 . 1 69 69 ASP HB2 H 1 2.713 0.005 . 2 . . . . A 69 ASP HB2 . 34981 1 812 . 1 . 1 69 69 ASP HB3 H 1 2.235 0.005 . 2 . . . . A 69 ASP HB3 . 34981 1 813 . 1 . 1 69 69 ASP CA C 13 53.668 0.020 . 1 . . . . A 69 ASP CA . 34981 1 814 . 1 . 1 69 69 ASP CB C 13 39.670 0.035 . 1 . . . . A 69 ASP CB . 34981 1 815 . 1 . 1 69 69 ASP N N 15 118.585 0.008 . 1 . . . . A 69 ASP N . 34981 1 816 . 1 . 1 70 70 VAL H H 1 8.201 0.005 . 1 . . . . A 70 VAL H . 34981 1 817 . 1 . 1 70 70 VAL HA H 1 3.860 0.008 . 1 . . . . A 70 VAL HA . 34981 1 818 . 1 . 1 70 70 VAL HB H 1 2.006 0.004 . 1 . . . . A 70 VAL HB . 34981 1 819 . 1 . 1 70 70 VAL HG11 H 1 0.795 0.002 . 2 . . . . A 70 VAL HG11 . 34981 1 820 . 1 . 1 70 70 VAL HG12 H 1 0.795 0.002 . 2 . . . . A 70 VAL HG12 . 34981 1 821 . 1 . 1 70 70 VAL HG13 H 1 0.795 0.002 . 2 . . . . A 70 VAL HG13 . 34981 1 822 . 1 . 1 70 70 VAL HG21 H 1 0.858 0.001 . 2 . . . . A 70 VAL HG21 . 34981 1 823 . 1 . 1 70 70 VAL HG22 H 1 0.858 0.001 . 2 . . . . A 70 VAL HG22 . 34981 1 824 . 1 . 1 70 70 VAL HG23 H 1 0.858 0.001 . 2 . . . . A 70 VAL HG23 . 34981 1 825 . 1 . 1 70 70 VAL CA C 13 63.179 0.016 . 1 . . . . A 70 VAL CA . 34981 1 826 . 1 . 1 70 70 VAL CB C 13 32.910 0.006 . 1 . . . . A 70 VAL CB . 34981 1 827 . 1 . 1 70 70 VAL CG1 C 13 22.244 0.030 . 2 . . . . A 70 VAL CG1 . 34981 1 828 . 1 . 1 70 70 VAL CG2 C 13 21.319 0.056 . 2 . . . . A 70 VAL CG2 . 34981 1 829 . 1 . 1 70 70 VAL N N 15 112.799 0.008 . 1 . . . . A 70 VAL N . 34981 1 830 . 1 . 1 71 71 ARG H H 1 9.207 0.005 . 1 . . . . A 71 ARG H . 34981 1 831 . 1 . 1 71 71 ARG HA H 1 4.779 0.003 . 1 . . . . A 71 ARG HA . 34981 1 832 . 1 . 1 71 71 ARG HB2 H 1 1.637 0.008 . 2 . . . . A 71 ARG HB2 . 34981 1 833 . 1 . 1 71 71 ARG HB3 H 1 2.074 0.008 . 2 . . . . A 71 ARG HB3 . 34981 1 834 . 1 . 1 71 71 ARG HG2 H 1 1.689 0.01 . 2 . . . . A 71 ARG HG2 . 34981 1 835 . 1 . 1 71 71 ARG HG3 H 1 1.685 0.006 . 2 . . . . A 71 ARG HG3 . 34981 1 836 . 1 . 1 71 71 ARG HD2 H 1 3.164 0.008 . 2 . . . . A 71 ARG HD2 . 34981 1 837 . 1 . 1 71 71 ARG HE H 1 6.821 0.002 . 1 . . . . A 71 ARG HE . 34981 1 838 . 1 . 1 71 71 ARG CA C 13 53.315 0.043 . 1 . . . . A 71 ARG CA . 34981 1 839 . 1 . 1 71 71 ARG CB C 13 33.188 0.036 . 1 . . . . A 71 ARG CB . 34981 1 840 . 1 . 1 71 71 ARG CG C 13 25.840 0.042 . 1 . . . . A 71 ARG CG . 34981 1 841 . 1 . 1 71 71 ARG CD C 13 43.062 0.033 . 1 . . . . A 71 ARG CD . 34981 1 842 . 1 . 1 71 71 ARG N N 15 122.743 0.008 . 1 . . . . A 71 ARG N . 34981 1 843 . 1 . 1 71 71 ARG NE N 15 84.722 0.018 . 1 . . . . A 71 ARG NE . 34981 1 844 . 1 . 1 72 72 ALA H H 1 9.228 0.002 . 1 . . . . A 72 ALA H . 34981 1 845 . 1 . 1 72 72 ALA HA H 1 3.802 0.003 . 1 . . . . A 72 ALA HA . 34981 1 846 . 1 . 1 72 72 ALA HB1 H 1 1.354 0.002 . 1 . . . . A 72 ALA HB1 . 34981 1 847 . 1 . 1 72 72 ALA HB2 H 1 1.354 0.002 . 1 . . . . A 72 ALA HB2 . 34981 1 848 . 1 . 1 72 72 ALA HB3 H 1 1.354 0.002 . 1 . . . . A 72 ALA HB3 . 34981 1 849 . 1 . 1 72 72 ALA CA C 13 56.061 0.034 . 1 . . . . A 72 ALA CA . 34981 1 850 . 1 . 1 72 72 ALA CB C 13 17.750 0.061 . 1 . . . . A 72 ALA CB . 34981 1 851 . 1 . 1 72 72 ALA N N 15 124.411 0.021 . 1 . . . . A 72 ALA N . 34981 1 852 . 1 . 1 73 73 GLU H H 1 8.791 0.006 . 1 . . . . A 73 GLU H . 34981 1 853 . 1 . 1 73 73 GLU HA H 1 4.128 0.002 . 1 . . . . A 73 GLU HA . 34981 1 854 . 1 . 1 73 73 GLU HB2 H 1 1.983 0.004 . 2 . . . . A 73 GLU HB2 . 34981 1 855 . 1 . 1 73 73 GLU HB3 H 1 1.984 0.002 . 2 . . . . A 73 GLU HB3 . 34981 1 856 . 1 . 1 73 73 GLU HG2 H 1 2.128 0.008 . 2 . . . . A 73 GLU HG2 . 34981 1 857 . 1 . 1 73 73 GLU HG3 H 1 2.202 0.009 . 2 . . . . A 73 GLU HG3 . 34981 1 858 . 1 . 1 73 73 GLU CA C 13 58.382 0.035 . 1 . . . . A 73 GLU CA . 34981 1 859 . 1 . 1 73 73 GLU CB C 13 28.636 0.011 . 1 . . . . A 73 GLU CB . 34981 1 860 . 1 . 1 73 73 GLU CG C 13 36.317 0.144 . 1 . . . . A 73 GLU CG . 34981 1 861 . 1 . 1 73 73 GLU N N 15 114.578 0.006 . 1 . . . . A 73 GLU N . 34981 1 862 . 1 . 1 74 74 ASP H H 1 8.284 0.002 . 1 . . . . A 74 ASP H . 34981 1 863 . 1 . 1 74 74 ASP HA H 1 4.508 0.006 . 1 . . . . A 74 ASP HA . 34981 1 864 . 1 . 1 74 74 ASP HB2 H 1 2.815 0.005 . 2 . . . . A 74 ASP HB2 . 34981 1 865 . 1 . 1 74 74 ASP HB3 H 1 2.554 0.003 . 2 . . . . A 74 ASP HB3 . 34981 1 866 . 1 . 1 74 74 ASP CA C 13 55.295 0.060 . 1 . . . . A 74 ASP CA . 34981 1 867 . 1 . 1 74 74 ASP CB C 13 41.445 0.019 . 1 . . . . A 74 ASP CB . 34981 1 868 . 1 . 1 74 74 ASP N N 15 117.326 0.012 . 1 . . . . A 74 ASP N . 34981 1 869 . 1 . 1 75 75 GLN H H 1 7.640 0.004 . 1 . . . . A 75 GLN H . 34981 1 870 . 1 . 1 75 75 GLN HA H 1 4.045 0.003 . 1 . . . . A 75 GLN HA . 34981 1 871 . 1 . 1 75 75 GLN HB2 H 1 2.171 0.007 . 2 . . . . A 75 GLN HB2 . 34981 1 872 . 1 . 1 75 75 GLN HB3 H 1 2.328 0.009 . 2 . . . . A 75 GLN HB3 . 34981 1 873 . 1 . 1 75 75 GLN HG2 H 1 2.780 0.003 . 2 . . . . A 75 GLN HG2 . 34981 1 874 . 1 . 1 75 75 GLN HG3 H 1 2.354 0.002 . 2 . . . . A 75 GLN HG3 . 34981 1 875 . 1 . 1 75 75 GLN HE21 H 1 7.520 0.001 . 2 . . . . A 75 GLN HE21 . 34981 1 876 . 1 . 1 75 75 GLN HE22 H 1 6.930 0.004 . 2 . . . . A 75 GLN HE22 . 34981 1 877 . 1 . 1 75 75 GLN CA C 13 57.289 0.048 . 1 . . . . A 75 GLN CA . 34981 1 878 . 1 . 1 75 75 GLN CB C 13 30.050 0.055 . 1 . . . . A 75 GLN CB . 34981 1 879 . 1 . 1 75 75 GLN CG C 13 34.495 0.014 . 1 . . . . A 75 GLN CG . 34981 1 880 . 1 . 1 75 75 GLN N N 15 119.737 0.026 . 1 . . . . A 75 GLN N . 34981 1 881 . 1 . 1 75 75 GLN NE2 N 15 111.303 0.036 . 1 . . . . A 75 GLN NE2 . 34981 1 882 . 1 . 1 76 76 GLY H H 1 8.482 0.006 . 1 . . . . A 76 GLY H . 34981 1 883 . 1 . 1 76 76 GLY HA2 H 1 4.317 0.003 . 2 . . . . A 76 GLY HA2 . 34981 1 884 . 1 . 1 76 76 GLY HA3 H 1 4.032 0.007 . 2 . . . . A 76 GLY HA3 . 34981 1 885 . 1 . 1 76 76 GLY CA C 13 44.574 0.011 . 1 . . . . A 76 GLY CA . 34981 1 886 . 1 . 1 76 76 GLY N N 15 110.011 0.021 . 1 . . . . A 76 GLY N . 34981 1 887 . 1 . 1 77 77 GLN H H 1 8.214 0.002 . 1 . . . . A 77 GLN H . 34981 1 888 . 1 . 1 77 77 GLN HA H 1 4.745 0.007 . 1 . . . . A 77 GLN HA . 34981 1 889 . 1 . 1 77 77 GLN HB2 H 1 1.963 0.002 . 2 . . . . A 77 GLN HB2 . 34981 1 890 . 1 . 1 77 77 GLN HB3 H 1 1.964 0.003 . 2 . . . . A 77 GLN HB3 . 34981 1 891 . 1 . 1 77 77 GLN HG2 H 1 2.106 0.005 . 2 . . . . A 77 GLN HG2 . 34981 1 892 . 1 . 1 77 77 GLN HG3 H 1 1.916 0.001 . 2 . . . . A 77 GLN HG3 . 34981 1 893 . 1 . 1 77 77 GLN HE21 H 1 6.686 0.002 . 2 . . . . A 77 GLN HE21 . 34981 1 894 . 1 . 1 77 77 GLN HE22 H 1 7.389 0.005 . 2 . . . . A 77 GLN HE22 . 34981 1 895 . 1 . 1 77 77 GLN CA C 13 55.027 0.000 . 1 . . . . A 77 GLN CA . 34981 1 896 . 1 . 1 77 77 GLN CB C 13 30.037 0.000 . 1 . . . . A 77 GLN CB . 34981 1 897 . 1 . 1 77 77 GLN CG C 13 33.864 0.089 . 1 . . . . A 77 GLN CG . 34981 1 898 . 1 . 1 77 77 GLN N N 15 120.081 0.014 . 1 . . . . A 77 GLN N . 34981 1 899 . 1 . 1 77 77 GLN NE2 N 15 111.571 0.014 . 1 . . . . A 77 GLN NE2 . 34981 1 900 . 1 . 1 78 78 TYR H H 1 9.777 0.003 . 1 . . . . A 78 TYR H . 34981 1 901 . 1 . 1 78 78 TYR HA H 1 5.479 0.001 . 1 . . . . A 78 TYR HA . 34981 1 902 . 1 . 1 78 78 TYR HB2 H 1 2.815 0.003 . 2 . . . . A 78 TYR HB2 . 34981 1 903 . 1 . 1 78 78 TYR HB3 H 1 2.819 0.002 . 2 . . . . A 78 TYR HB3 . 34981 1 904 . 1 . 1 78 78 TYR HD1 H 1 6.992 0.006 . 3 . . . . A 78 TYR HD1 . 34981 1 905 . 1 . 1 78 78 TYR HD2 H 1 6.992 0.006 . 3 . . . . A 78 TYR HD2 . 34981 1 906 . 1 . 1 78 78 TYR HE1 H 1 6.617 0.008 . 3 . . . . A 78 TYR HE1 . 34981 1 907 . 1 . 1 78 78 TYR HE2 H 1 6.617 0.008 . 3 . . . . A 78 TYR HE2 . 34981 1 908 . 1 . 1 78 78 TYR HH H 1 9.898 0.003 . 1 . . . . A 78 TYR HH . 34981 1 909 . 1 . 1 78 78 TYR CA C 13 57.431 0.012 . 1 . . . . A 78 TYR CA . 34981 1 910 . 1 . 1 78 78 TYR CB C 13 41.422 0.032 . 1 . . . . A 78 TYR CB . 34981 1 911 . 1 . 1 78 78 TYR CD1 C 13 135.385 0.023 . 3 . . . . A 78 TYR CD1 . 34981 1 912 . 1 . 1 78 78 TYR CD2 C 13 135.385 0.023 . 3 . . . . A 78 TYR CD2 . 34981 1 913 . 1 . 1 78 78 TYR CE1 C 13 119.662 0.071 . 3 . . . . A 78 TYR CE1 . 34981 1 914 . 1 . 1 78 78 TYR CE2 C 13 119.662 0.071 . 3 . . . . A 78 TYR CE2 . 34981 1 915 . 1 . 1 78 78 TYR N N 15 130.977 0.015 . 1 . . . . A 78 TYR N . 34981 1 916 . 1 . 1 79 79 THR H H 1 8.847 0.002 . 1 . . . . A 79 THR H . 34981 1 917 . 1 . 1 79 79 THR HA H 1 5.262 0.004 . 1 . . . . A 79 THR HA . 34981 1 918 . 1 . 1 79 79 THR HB H 1 3.604 0.003 . 1 . . . . A 79 THR HB . 34981 1 919 . 1 . 1 79 79 THR HG21 H 1 0.865 0.005 . 1 . . . . A 79 THR HG21 . 34981 1 920 . 1 . 1 79 79 THR HG22 H 1 0.865 0.005 . 1 . . . . A 79 THR HG22 . 34981 1 921 . 1 . 1 79 79 THR HG23 H 1 0.865 0.005 . 1 . . . . A 79 THR HG23 . 34981 1 922 . 1 . 1 79 79 THR CA C 13 60.086 0.038 . 1 . . . . A 79 THR CA . 34981 1 923 . 1 . 1 79 79 THR CB C 13 73.087 0.032 . 1 . . . . A 79 THR CB . 34981 1 924 . 1 . 1 79 79 THR CG2 C 13 21.228 0.048 . 1 . . . . A 79 THR CG2 . 34981 1 925 . 1 . 1 79 79 THR N N 15 116.787 0.014 . 1 . . . . A 79 THR N . 34981 1 926 . 1 . 1 80 80 CYS H H 1 8.526 0.004 . 1 . . . . A 80 CYS H . 34981 1 927 . 1 . 1 80 80 CYS HA H 1 4.205 0.003 . 1 . . . . A 80 CYS HA . 34981 1 928 . 1 . 1 80 80 CYS HB2 H 1 1.095 0.004 . 2 . . . . A 80 CYS HB2 . 34981 1 929 . 1 . 1 80 80 CYS HB3 H 1 0.264 0.005 . 2 . . . . A 80 CYS HB3 . 34981 1 930 . 1 . 1 80 80 CYS HG H 1 -0.290 0.007 . 1 . . . . A 80 CYS HG . 34981 1 931 . 1 . 1 80 80 CYS CA C 13 57.869 0.059 . 1 . . . . A 80 CYS CA . 34981 1 932 . 1 . 1 80 80 CYS CB C 13 27.279 0.036 . 1 . . . . A 80 CYS CB . 34981 1 933 . 1 . 1 80 80 CYS N N 15 127.207 0.018 . 1 . . . . A 80 CYS N . 34981 1 934 . 1 . 1 81 81 LYS H H 1 9.054 0.002 . 1 . . . . A 81 LYS H . 34981 1 935 . 1 . 1 81 81 LYS HA H 1 5.372 0.007 . 1 . . . . A 81 LYS HA . 34981 1 936 . 1 . 1 81 81 LYS HB2 H 1 1.840 0.004 . 2 . . . . A 81 LYS HB2 . 34981 1 937 . 1 . 1 81 81 LYS HB3 H 1 1.309 0.010 . 2 . . . . A 81 LYS HB3 . 34981 1 938 . 1 . 1 81 81 LYS HG2 H 1 1.127 0.003 . 2 . . . . A 81 LYS HG2 . 34981 1 939 . 1 . 1 81 81 LYS HG3 H 1 1.021 0.006 . 2 . . . . A 81 LYS HG3 . 34981 1 940 . 1 . 1 81 81 LYS HD2 H 1 1.289 0.003 . 2 . . . . A 81 LYS HD2 . 34981 1 941 . 1 . 1 81 81 LYS HD3 H 1 1.438 0.003 . 2 . . . . A 81 LYS HD3 . 34981 1 942 . 1 . 1 81 81 LYS HE2 H 1 2.773 0.003 . 2 . . . . A 81 LYS HE2 . 34981 1 943 . 1 . 1 81 81 LYS HE3 H 1 2.424 0.002 . 2 . . . . A 81 LYS HE3 . 34981 1 944 . 1 . 1 81 81 LYS CA C 13 54.685 0.026 . 1 . . . . A 81 LYS CA . 34981 1 945 . 1 . 1 81 81 LYS CB C 13 38.535 0.025 . 1 . . . . A 81 LYS CB . 34981 1 946 . 1 . 1 81 81 LYS CG C 13 25.000 0.019 . 1 . . . . A 81 LYS CG . 34981 1 947 . 1 . 1 81 81 LYS CD C 13 29.878 0.053 . 1 . . . . A 81 LYS CD . 34981 1 948 . 1 . 1 81 81 LYS CE C 13 41.528 0.027 . 1 . . . . A 81 LYS CE . 34981 1 949 . 1 . 1 81 81 LYS N N 15 128.592 0.025 . 1 . . . . A 81 LYS N . 34981 1 950 . 1 . 1 82 82 HIS H H 1 8.532 0.006 . 1 . . . . A 82 HIS H . 34981 1 951 . 1 . 1 82 82 HIS HA H 1 4.551 0.002 . 1 . . . . A 82 HIS HA . 34981 1 952 . 1 . 1 82 82 HIS HB2 H 1 2.183 0.002 . 2 . . . . A 82 HIS HB2 . 34981 1 953 . 1 . 1 82 82 HIS HB3 H 1 1.829 0.005 . 2 . . . . A 82 HIS HB3 . 34981 1 954 . 1 . 1 82 82 HIS HD2 H 1 7.209 0.01 . 1 . . . . A 82 HIS HD2 . 34981 1 955 . 1 . 1 82 82 HIS HE1 H 1 7.865 0.005 . 1 . . . . A 82 HIS HE1 . 34981 1 956 . 1 . 1 82 82 HIS CA C 13 55.674 0.002 . 1 . . . . A 82 HIS CA . 34981 1 957 . 1 . 1 82 82 HIS CB C 13 30.127 0.043 . 1 . . . . A 82 HIS CB . 34981 1 958 . 1 . 1 82 82 HIS CD2 C 13 124.247 0.1 . 1 . . . . A 82 HIS CD2 . 34981 1 959 . 1 . 1 82 82 HIS CE1 C 13 140.488 0.026 . 1 . . . . A 82 HIS CE1 . 34981 1 960 . 1 . 1 82 82 HIS N N 15 124.051 0.024 . 1 . . . . A 82 HIS N . 34981 1 961 . 1 . 1 83 83 GLU H H 1 8.636 0.003 . 1 . . . . A 83 GLU H . 34981 1 962 . 1 . 1 83 83 GLU HA H 1 3.379 0.003 . 1 . . . . A 83 GLU HA . 34981 1 963 . 1 . 1 83 83 GLU HB2 H 1 1.860 0.001 . 2 . . . . A 83 GLU HB2 . 34981 1 964 . 1 . 1 83 83 GLU HB3 H 1 1.830 0.000 . 2 . . . . A 83 GLU HB3 . 34981 1 965 . 1 . 1 83 83 GLU HG2 H 1 1.659 0.003 . 2 . . . . A 83 GLU HG2 . 34981 1 966 . 1 . 1 83 83 GLU HG3 H 1 1.484 0.002 . 2 . . . . A 83 GLU HG3 . 34981 1 967 . 1 . 1 83 83 GLU CA C 13 58.020 0.011 . 1 . . . . A 83 GLU CA . 34981 1 968 . 1 . 1 83 83 GLU CB C 13 26.326 0.006 . 1 . . . . A 83 GLU CB . 34981 1 969 . 1 . 1 83 83 GLU CG C 13 35.550 0.028 . 1 . . . . A 83 GLU CG . 34981 1 970 . 1 . 1 83 83 GLU N N 15 124.437 0.041 . 1 . . . . A 83 GLU N . 34981 1 971 . 1 . 1 84 84 ASP H H 1 8.469 0.005 . 1 . . . . A 84 ASP H . 34981 1 972 . 1 . 1 84 84 ASP HA H 1 4.611 0.005 . 1 . . . . A 84 ASP HA . 34981 1 973 . 1 . 1 84 84 ASP HB2 H 1 2.688 0.020 . 2 . . . . A 84 ASP HB2 . 34981 1 974 . 1 . 1 84 84 ASP HB3 H 1 2.645 0.003 . 2 . . . . A 84 ASP HB3 . 34981 1 975 . 1 . 1 84 84 ASP CA C 13 54.157 0.040 . 1 . . . . A 84 ASP CA . 34981 1 976 . 1 . 1 84 84 ASP CB C 13 40.417 0.020 . 1 . . . . A 84 ASP CB . 34981 1 977 . 1 . 1 84 84 ASP N N 15 119.710 0.022 . 1 . . . . A 84 ASP N . 34981 1 978 . 1 . 1 85 85 LEU H H 1 8.479 0.004 . 1 . . . . A 85 LEU H . 34981 1 979 . 1 . 1 85 85 LEU HA H 1 4.725 0.001 . 1 . . . . A 85 LEU HA . 34981 1 980 . 1 . 1 85 85 LEU HB2 H 1 2.302 0.005 . 2 . . . . A 85 LEU HB2 . 34981 1 981 . 1 . 1 85 85 LEU HB3 H 1 1.511 0.003 . 2 . . . . A 85 LEU HB3 . 34981 1 982 . 1 . 1 85 85 LEU HG H 1 1.803 0.003 . 1 . . . . A 85 LEU HG . 34981 1 983 . 1 . 1 85 85 LEU HD11 H 1 0.934 0.005 . 2 . . . . A 85 LEU HD11 . 34981 1 984 . 1 . 1 85 85 LEU HD12 H 1 0.934 0.005 . 2 . . . . A 85 LEU HD12 . 34981 1 985 . 1 . 1 85 85 LEU HD13 H 1 0.934 0.005 . 2 . . . . A 85 LEU HD13 . 34981 1 986 . 1 . 1 85 85 LEU HD21 H 1 0.943 0.002 . 2 . . . . A 85 LEU HD21 . 34981 1 987 . 1 . 1 85 85 LEU HD22 H 1 0.943 0.002 . 2 . . . . A 85 LEU HD22 . 34981 1 988 . 1 . 1 85 85 LEU HD23 H 1 0.943 0.002 . 2 . . . . A 85 LEU HD23 . 34981 1 989 . 1 . 1 85 85 LEU CA C 13 54.510 0.000 . 1 . . . . A 85 LEU CA . 34981 1 990 . 1 . 1 85 85 LEU CB C 13 42.510 0.044 . 1 . . . . A 85 LEU CB . 34981 1 991 . 1 . 1 85 85 LEU CG C 13 26.463 0.045 . 1 . . . . A 85 LEU CG . 34981 1 992 . 1 . 1 85 85 LEU CD1 C 13 26.377 0.052 . 2 . . . . A 85 LEU CD1 . 34981 1 993 . 1 . 1 85 85 LEU CD2 C 13 23.672 0.004 . 2 . . . . A 85 LEU CD2 . 34981 1 994 . 1 . 1 85 85 LEU N N 15 122.399 0.023 . 1 . . . . A 85 LEU N . 34981 1 995 . 1 . 1 86 86 GLU H H 1 9.061 0.004 . 1 . . . . A 86 GLU H . 34981 1 996 . 1 . 1 86 86 GLU HA H 1 5.319 0.003 . 1 . . . . A 86 GLU HA . 34981 1 997 . 1 . 1 86 86 GLU HB2 H 1 1.741 0.010 . 2 . . . . A 86 GLU HB2 . 34981 1 998 . 1 . 1 86 86 GLU HB3 H 1 1.651 0.004 . 2 . . . . A 86 GLU HB3 . 34981 1 999 . 1 . 1 86 86 GLU HG2 H 1 1.982 0.003 . 2 . . . . A 86 GLU HG2 . 34981 1 1000 . 1 . 1 86 86 GLU HG3 H 1 1.820 0.002 . 2 . . . . A 86 GLU HG3 . 34981 1 1001 . 1 . 1 86 86 GLU CA C 13 54.599 0.019 . 1 . . . . A 86 GLU CA . 34981 1 1002 . 1 . 1 86 86 GLU CB C 13 33.997 0.027 . 1 . . . . A 86 GLU CB . 34981 1 1003 . 1 . 1 86 86 GLU CG C 13 35.721 0.024 . 1 . . . . A 86 GLU CG . 34981 1 1004 . 1 . 1 86 86 GLU N N 15 125.437 0.013 . 1 . . . . A 86 GLU N . 34981 1 1005 . 1 . 1 87 87 THR H H 1 8.041 0.004 . 1 . . . . A 87 THR H . 34981 1 1006 . 1 . 1 87 87 THR HA H 1 4.512 0.004 . 1 . . . . A 87 THR HA . 34981 1 1007 . 1 . 1 87 87 THR HB H 1 2.964 0.004 . 1 . . . . A 87 THR HB . 34981 1 1008 . 1 . 1 87 87 THR HG21 H 1 -0.251 0.008 . 1 . . . . A 87 THR HG21 . 34981 1 1009 . 1 . 1 87 87 THR HG22 H 1 -0.251 0.008 . 1 . . . . A 87 THR HG22 . 34981 1 1010 . 1 . 1 87 87 THR HG23 H 1 -0.251 0.008 . 1 . . . . A 87 THR HG23 . 34981 1 1011 . 1 . 1 87 87 THR CA C 13 59.752 0.016 . 1 . . . . A 87 THR CA . 34981 1 1012 . 1 . 1 87 87 THR CB C 13 69.043 0.047 . 1 . . . . A 87 THR CB . 34981 1 1013 . 1 . 1 87 87 THR CG2 C 13 18.432 0.044 . 1 . . . . A 87 THR CG2 . 34981 1 1014 . 1 . 1 87 87 THR N N 15 118.842 0.026 . 1 . . . . A 87 THR N . 34981 1 1015 . 1 . 1 88 88 SER H H 1 8.063 0.004 . 1 . . . . A 88 SER H . 34981 1 1016 . 1 . 1 88 88 SER HA H 1 5.869 0.003 . 1 . . . . A 88 SER HA . 34981 1 1017 . 1 . 1 88 88 SER HB2 H 1 3.546 0.002 . 2 . . . . A 88 SER HB2 . 34981 1 1018 . 1 . 1 88 88 SER HB3 H 1 3.408 0.004 . 2 . . . . A 88 SER HB3 . 34981 1 1019 . 1 . 1 88 88 SER CA C 13 57.350 0.053 . 1 . . . . A 88 SER CA . 34981 1 1020 . 1 . 1 88 88 SER CB C 13 67.109 0.048 . 1 . . . . A 88 SER CB . 34981 1 1021 . 1 . 1 88 88 SER N N 15 121.143 0.032 . 1 . . . . A 88 SER N . 34981 1 1022 . 1 . 1 89 89 ALA H H 1 9.168 0.003 . 1 . . . . A 89 ALA H . 34981 1 1023 . 1 . 1 89 89 ALA HA H 1 4.491 0.003 . 1 . . . . A 89 ALA HA . 34981 1 1024 . 1 . 1 89 89 ALA HB1 H 1 1.217 0.002 . 1 . . . . A 89 ALA HB1 . 34981 1 1025 . 1 . 1 89 89 ALA HB2 H 1 1.217 0.002 . 1 . . . . A 89 ALA HB2 . 34981 1 1026 . 1 . 1 89 89 ALA HB3 H 1 1.217 0.002 . 1 . . . . A 89 ALA HB3 . 34981 1 1027 . 1 . 1 89 89 ALA CA C 13 51.901 0.024 . 1 . . . . A 89 ALA CA . 34981 1 1028 . 1 . 1 89 89 ALA CB C 13 23.069 0.051 . 1 . . . . A 89 ALA CB . 34981 1 1029 . 1 . 1 89 89 ALA N N 15 123.825 0.021 . 1 . . . . A 89 ALA N . 34981 1 1030 . 1 . 1 90 90 GLU H H 1 8.958 0.008 . 1 . . . . A 90 GLU H . 34981 1 1031 . 1 . 1 90 90 GLU HA H 1 4.961 0.004 . 1 . . . . A 90 GLU HA . 34981 1 1032 . 1 . 1 90 90 GLU HB2 H 1 1.726 0.011 . 2 . . . . A 90 GLU HB2 . 34981 1 1033 . 1 . 1 90 90 GLU HB3 H 1 1.766 0.001 . 2 . . . . A 90 GLU HB3 . 34981 1 1034 . 1 . 1 90 90 GLU HG2 H 1 2.135 0.002 . 2 . . . . A 90 GLU HG2 . 34981 1 1035 . 1 . 1 90 90 GLU HG3 H 1 1.977 0.005 . 2 . . . . A 90 GLU HG3 . 34981 1 1036 . 1 . 1 90 90 GLU CA C 13 55.143 0.014 . 1 . . . . A 90 GLU CA . 34981 1 1037 . 1 . 1 90 90 GLU CB C 13 32.041 0.022 . 1 . . . . A 90 GLU CB . 34981 1 1038 . 1 . 1 90 90 GLU CG C 13 36.076 0.009 . 1 . . . . A 90 GLU CG . 34981 1 1039 . 1 . 1 90 90 GLU N N 15 119.361 0.015 . 1 . . . . A 90 GLU N . 34981 1 1040 . 1 . 1 91 91 LEU H H 1 9.017 0.008 . 1 . . . . A 91 LEU H . 34981 1 1041 . 1 . 1 91 91 LEU HA H 1 5.215 0.002 . 1 . . . . A 91 LEU HA . 34981 1 1042 . 1 . 1 91 91 LEU HB2 H 1 2.136 0.005 . 2 . . . . A 91 LEU HB2 . 34981 1 1043 . 1 . 1 91 91 LEU HB3 H 1 1.209 0.005 . 2 . . . . A 91 LEU HB3 . 34981 1 1044 . 1 . 1 91 91 LEU HG H 1 1.214 0.003 . 1 . . . . A 91 LEU HG . 34981 1 1045 . 1 . 1 91 91 LEU HD11 H 1 0.743 0.004 . 2 . . . . A 91 LEU HD11 . 34981 1 1046 . 1 . 1 91 91 LEU HD12 H 1 0.743 0.004 . 2 . . . . A 91 LEU HD12 . 34981 1 1047 . 1 . 1 91 91 LEU HD13 H 1 0.743 0.004 . 2 . . . . A 91 LEU HD13 . 34981 1 1048 . 1 . 1 91 91 LEU HD21 H 1 0.612 0.004 . 2 . . . . A 91 LEU HD21 . 34981 1 1049 . 1 . 1 91 91 LEU HD22 H 1 0.612 0.004 . 2 . . . . A 91 LEU HD22 . 34981 1 1050 . 1 . 1 91 91 LEU HD23 H 1 0.612 0.004 . 2 . . . . A 91 LEU HD23 . 34981 1 1051 . 1 . 1 91 91 LEU CA C 13 53.767 0.048 . 1 . . . . A 91 LEU CA . 34981 1 1052 . 1 . 1 91 91 LEU CB C 13 44.158 0.048 . 1 . . . . A 91 LEU CB . 34981 1 1053 . 1 . 1 91 91 LEU CG C 13 28.385 0.034 . 1 . . . . A 91 LEU CG . 34981 1 1054 . 1 . 1 91 91 LEU CD1 C 13 24.808 0.024 . 2 . . . . A 91 LEU CD1 . 34981 1 1055 . 1 . 1 91 91 LEU CD2 C 13 25.072 0.018 . 2 . . . . A 91 LEU CD2 . 34981 1 1056 . 1 . 1 91 91 LEU N N 15 126.109 0.011 . 1 . . . . A 91 LEU N . 34981 1 1057 . 1 . 1 92 92 ARG H H 1 9.035 0.005 . 1 . . . . A 92 ARG H . 34981 1 1058 . 1 . 1 92 92 ARG HA H 1 4.718 0.010 . 1 . . . . A 92 ARG HA . 34981 1 1059 . 1 . 1 92 92 ARG HB2 H 1 1.835 0.004 . 2 . . . . A 92 ARG HB2 . 34981 1 1060 . 1 . 1 92 92 ARG HB3 H 1 1.828 0.000 . 2 . . . . A 92 ARG HB3 . 34981 1 1061 . 1 . 1 92 92 ARG HG2 H 1 1.512 0.006 . 2 . . . . A 92 ARG HG2 . 34981 1 1062 . 1 . 1 92 92 ARG HG3 H 1 1.480 0.000 . 2 . . . . A 92 ARG HG3 . 34981 1 1063 . 1 . 1 92 92 ARG HD2 H 1 3.066 0.014 . 2 . . . . A 92 ARG HD2 . 34981 1 1064 . 1 . 1 92 92 ARG HD3 H 1 3.061 0.006 . 2 . . . . A 92 ARG HD3 . 34981 1 1065 . 1 . 1 92 92 ARG HE H 1 7.125 0.003 . 1 . . . . A 92 ARG HE . 34981 1 1066 . 1 . 1 92 92 ARG CA C 13 54.830 0.000 . 1 . . . . A 92 ARG CA . 34981 1 1067 . 1 . 1 92 92 ARG CB C 13 32.686 0.035 . 1 . . . . A 92 ARG CB . 34981 1 1068 . 1 . 1 92 92 ARG CG C 13 28.125 0.007 . 1 . . . . A 92 ARG CG . 34981 1 1069 . 1 . 1 92 92 ARG CD C 13 43.089 0.004 . 1 . . . . A 92 ARG CD . 34981 1 1070 . 1 . 1 92 92 ARG N N 15 128.276 0.035 . 1 . . . . A 92 ARG N . 34981 1 1071 . 1 . 1 92 92 ARG NE N 15 85.091 0.012 . 1 . . . . A 92 ARG NE . 34981 1 1072 . 1 . 1 93 93 ILE H H 1 8.326 0.006 . 1 . . . . A 93 ILE H . 34981 1 1073 . 1 . 1 93 93 ILE HA H 1 4.996 0.003 . 1 . . . . A 93 ILE HA . 34981 1 1074 . 1 . 1 93 93 ILE HB H 1 1.653 0.004 . 1 . . . . A 93 ILE HB . 34981 1 1075 . 1 . 1 93 93 ILE HG12 H 1 1.265 0.002 . 2 . . . . A 93 ILE HG12 . 34981 1 1076 . 1 . 1 93 93 ILE HG13 H 1 0.989 0.002 . 2 . . . . A 93 ILE HG13 . 34981 1 1077 . 1 . 1 93 93 ILE HG21 H 1 0.594 0.005 . 1 . . . . A 93 ILE HG21 . 34981 1 1078 . 1 . 1 93 93 ILE HG22 H 1 0.594 0.005 . 1 . . . . A 93 ILE HG22 . 34981 1 1079 . 1 . 1 93 93 ILE HG23 H 1 0.594 0.005 . 1 . . . . A 93 ILE HG23 . 34981 1 1080 . 1 . 1 93 93 ILE HD11 H 1 0.512 0.009 . 1 . . . . A 93 ILE HD11 . 34981 1 1081 . 1 . 1 93 93 ILE HD12 H 1 0.512 0.009 . 1 . . . . A 93 ILE HD12 . 34981 1 1082 . 1 . 1 93 93 ILE HD13 H 1 0.512 0.009 . 1 . . . . A 93 ILE HD13 . 34981 1 1083 . 1 . 1 93 93 ILE CA C 13 57.336 0.029 . 1 . . . . A 93 ILE CA . 34981 1 1084 . 1 . 1 93 93 ILE CB C 13 38.634 0.037 . 1 . . . . A 93 ILE CB . 34981 1 1085 . 1 . 1 93 93 ILE CG1 C 13 27.151 0.001 . 1 . . . . A 93 ILE CG1 . 34981 1 1086 . 1 . 1 93 93 ILE CG2 C 13 17.722 0.045 . 1 . . . . A 93 ILE CG2 . 34981 1 1087 . 1 . 1 93 93 ILE CD1 C 13 12.186 0.026 . 1 . . . . A 93 ILE CD1 . 34981 1 1088 . 1 . 1 93 93 ILE N N 15 121.813 0.019 . 1 . . . . A 93 ILE N . 34981 1 1089 . 1 . 1 94 94 GLU H H 1 8.706 0.004 . 1 . . . . A 94 GLU H . 34981 1 1090 . 1 . 1 94 94 GLU HA H 1 4.357 0.003 . 1 . . . . A 94 GLU HA . 34981 1 1091 . 1 . 1 94 94 GLU HB2 H 1 1.684 0.006 . 2 . . . . A 94 GLU HB2 . 34981 1 1092 . 1 . 1 94 94 GLU HB3 H 1 1.854 0.007 . 2 . . . . A 94 GLU HB3 . 34981 1 1093 . 1 . 1 94 94 GLU HG2 H 1 2.024 0.002 . 2 . . . . A 94 GLU HG2 . 34981 1 1094 . 1 . 1 94 94 GLU HG3 H 1 2.025 0.002 . 2 . . . . A 94 GLU HG3 . 34981 1 1095 . 1 . 1 94 94 GLU CA C 13 54.773 0.032 . 1 . . . . A 94 GLU CA . 34981 1 1096 . 1 . 1 94 94 GLU CB C 13 31.405 0.016 . 1 . . . . A 94 GLU CB . 34981 1 1097 . 1 . 1 94 94 GLU CG C 13 35.903 0.004 . 1 . . . . A 94 GLU CG . 34981 1 1098 . 1 . 1 94 94 GLU N N 15 127.762 0.020 . 1 . . . . A 94 GLU N . 34981 1 1099 . 1 . 1 95 95 LYS H H 1 8.493 0.003 . 1 . . . . A 95 LYS H . 34981 1 1100 . 1 . 1 95 95 LYS HA H 1 4.188 0.003 . 1 . . . . A 95 LYS HA . 34981 1 1101 . 1 . 1 95 95 LYS HB2 H 1 1.798 0.010 . 2 . . . . A 95 LYS HB2 . 34981 1 1102 . 1 . 1 95 95 LYS HB3 H 1 1.705 0.002 . 2 . . . . A 95 LYS HB3 . 34981 1 1103 . 1 . 1 95 95 LYS HG2 H 1 1.444 0.009 . 2 . . . . A 95 LYS HG2 . 34981 1 1104 . 1 . 1 95 95 LYS HG3 H 1 1.446 0.009 . 2 . . . . A 95 LYS HG3 . 34981 1 1105 . 1 . 1 95 95 LYS HD2 H 1 1.669 0.004 . 2 . . . . A 95 LYS HD2 . 34981 1 1106 . 1 . 1 95 95 LYS HD3 H 1 1.669 0.004 . 2 . . . . A 95 LYS HD3 . 34981 1 1107 . 1 . 1 95 95 LYS HE2 H 1 2.932 0.006 . 2 . . . . A 95 LYS HE2 . 34981 1 1108 . 1 . 1 95 95 LYS HE3 H 1 2.931 0.006 . 2 . . . . A 95 LYS HE3 . 34981 1 1109 . 1 . 1 95 95 LYS CA C 13 56.453 0.046 . 1 . . . . A 95 LYS CA . 34981 1 1110 . 1 . 1 95 95 LYS CB C 13 33.010 0.021 . 1 . . . . A 95 LYS CB . 34981 1 1111 . 1 . 1 95 95 LYS CG C 13 24.470 0.085 . 1 . . . . A 95 LYS CG . 34981 1 1112 . 1 . 1 95 95 LYS CD C 13 28.864 0.026 . 1 . . . . A 95 LYS CD . 34981 1 1113 . 1 . 1 95 95 LYS CE C 13 41.934 0.001 . 1 . . . . A 95 LYS CE . 34981 1 1114 . 1 . 1 95 95 LYS N N 15 123.580 0.016 . 1 . . . . A 95 LYS N . 34981 1 1115 . 1 . 1 96 96 GLY H H 1 8.645 0.002 . 1 . . . . A 96 GLY H . 34981 1 1116 . 1 . 1 96 96 GLY HA2 H 1 4.015 0.005 . 2 . . . . A 96 GLY HA2 . 34981 1 1117 . 1 . 1 96 96 GLY HA3 H 1 3.823 0.003 . 2 . . . . A 96 GLY HA3 . 34981 1 1118 . 1 . 1 96 96 GLY CA C 13 44.876 0.023 . 1 . . . . A 96 GLY CA . 34981 1 1119 . 1 . 1 96 96 GLY N N 15 110.323 0.013 . 1 . . . . A 96 GLY N . 34981 1 1120 . 1 . 1 97 97 GLU H H 1 8.338 0.003 . 1 . . . . A 97 GLU H . 34981 1 1121 . 1 . 1 97 97 GLU HA H 1 4.230 0.006 . 1 . . . . A 97 GLU HA . 34981 1 1122 . 1 . 1 97 97 GLU HB2 H 1 1.829 0.005 . 2 . . . . A 97 GLU HB2 . 34981 1 1123 . 1 . 1 97 97 GLU HB3 H 1 1.954 0.005 . 2 . . . . A 97 GLU HB3 . 34981 1 1124 . 1 . 1 97 97 GLU HG2 H 1 2.181 0.003 . 2 . . . . A 97 GLU HG2 . 34981 1 1125 . 1 . 1 97 97 GLU HG3 H 1 2.123 0.001 . 2 . . . . A 97 GLU HG3 . 34981 1 1126 . 1 . 1 97 97 GLU CA C 13 56.053 0.008 . 1 . . . . A 97 GLU CA . 34981 1 1127 . 1 . 1 97 97 GLU CB C 13 30.292 0.031 . 1 . . . . A 97 GLU CB . 34981 1 1128 . 1 . 1 97 97 GLU CG C 13 35.819 0.003 . 1 . . . . A 97 GLU CG . 34981 1 1129 . 1 . 1 97 97 GLU N N 15 120.751 0.032 . 1 . . . . A 97 GLU N . 34981 1 1130 . 1 . 1 98 98 LEU H H 1 8.327 0.000 . 1 . . . . A 98 LEU H . 34981 1 1131 . 1 . 1 98 98 LEU HA H 1 4.269 0.004 . 1 . . . . A 98 LEU HA . 34981 1 1132 . 1 . 1 98 98 LEU HB2 H 1 1.561 0.002 . 2 . . . . A 98 LEU HB2 . 34981 1 1133 . 1 . 1 98 98 LEU HB3 H 1 1.520 0.004 . 2 . . . . A 98 LEU HB3 . 34981 1 1134 . 1 . 1 98 98 LEU HG H 1 1.546 0.004 . 1 . . . . A 98 LEU HG . 34981 1 1135 . 1 . 1 98 98 LEU HD11 H 1 0.821 0.029 . 2 . . . . A 98 LEU HD11 . 34981 1 1136 . 1 . 1 98 98 LEU HD12 H 1 0.821 0.029 . 2 . . . . A 98 LEU HD12 . 34981 1 1137 . 1 . 1 98 98 LEU HD13 H 1 0.821 0.029 . 2 . . . . A 98 LEU HD13 . 34981 1 1138 . 1 . 1 98 98 LEU HD21 H 1 0.803 0.012 . 2 . . . . A 98 LEU HD21 . 34981 1 1139 . 1 . 1 98 98 LEU HD22 H 1 0.803 0.012 . 2 . . . . A 98 LEU HD22 . 34981 1 1140 . 1 . 1 98 98 LEU HD23 H 1 0.803 0.012 . 2 . . . . A 98 LEU HD23 . 34981 1 1141 . 1 . 1 98 98 LEU CA C 13 55.084 0.005 . 1 . . . . A 98 LEU CA . 34981 1 1142 . 1 . 1 98 98 LEU CB C 13 42.046 0.010 . 1 . . . . A 98 LEU CB . 34981 1 1143 . 1 . 1 98 98 LEU CG C 13 26.905 0.061 . 1 . . . . A 98 LEU CG . 34981 1 1144 . 1 . 1 98 98 LEU CD1 C 13 24.657 0.132 . 2 . . . . A 98 LEU CD1 . 34981 1 1145 . 1 . 1 98 98 LEU CD2 C 13 23.420 0.066 . 2 . . . . A 98 LEU CD2 . 34981 1 1146 . 1 . 1 98 98 LEU N N 15 123.885 0.012 . 1 . . . . A 98 LEU N . 34981 1 1147 . 1 . 1 99 99 ARG H H 1 8.382 0.002 . 1 . . . . A 99 ARG H . 34981 1 1148 . 1 . 1 99 99 ARG HA H 1 4.328 0.017 . 1 . . . . A 99 ARG HA . 34981 1 1149 . 1 . 1 99 99 ARG HB2 H 1 1.699 0.002 . 2 . . . . A 99 ARG HB2 . 34981 1 1150 . 1 . 1 99 99 ARG HB3 H 1 1.801 0.001 . 2 . . . . A 99 ARG HB3 . 34981 1 1151 . 1 . 1 99 99 ARG HG2 H 1 1.557 0.006 . 2 . . . . A 99 ARG HG2 . 34981 1 1152 . 1 . 1 99 99 ARG HG3 H 1 1.633 0.002 . 2 . . . . A 99 ARG HG3 . 34981 1 1153 . 1 . 1 99 99 ARG HD2 H 1 3.188 0.006 . 2 . . . . A 99 ARG HD2 . 34981 1 1154 . 1 . 1 99 99 ARG HD3 H 1 3.189 0.006 . 2 . . . . A 99 ARG HD3 . 34981 1 1155 . 1 . 1 99 99 ARG CA C 13 55.611 0.010 . 1 . . . . A 99 ARG CA . 34981 1 1156 . 1 . 1 99 99 ARG CB C 13 30.646 0.010 . 1 . . . . A 99 ARG CB . 34981 1 1157 . 1 . 1 99 99 ARG CG C 13 26.648 0.025 . 1 . . . . A 99 ARG CG . 34981 1 1158 . 1 . 1 99 99 ARG CD C 13 43.105 0.000 . 1 . . . . A 99 ARG CD . 34981 1 1159 . 1 . 1 99 99 ARG N N 15 122.749 0.022 . 1 . . . . A 99 ARG N . 34981 1 1160 . 1 . 1 100 100 SER H H 1 8.327 0.002 . 1 . . . . A 100 SER H . 34981 1 1161 . 1 . 1 100 100 SER HA H 1 4.392 0.002 . 1 . . . . A 100 SER HA . 34981 1 1162 . 1 . 1 100 100 SER HB2 H 1 3.808 0.011 . 2 . . . . A 100 SER HB2 . 34981 1 1163 . 1 . 1 100 100 SER HB3 H 1 3.811 0.012 . 2 . . . . A 100 SER HB3 . 34981 1 1164 . 1 . 1 100 100 SER CA C 13 58.239 0.039 . 1 . . . . A 100 SER CA . 34981 1 1165 . 1 . 1 100 100 SER CB C 13 63.633 0.006 . 1 . . . . A 100 SER CB . 34981 1 1166 . 1 . 1 100 100 SER N N 15 117.324 0.043 . 1 . . . . A 100 SER N . 34981 1 1167 . 1 . 1 101 101 GLY H H 1 8.468 0.014 . 1 . . . . A 101 GLY H . 34981 1 1168 . 1 . 1 101 101 GLY HA2 H 1 3.929 0.000 . 2 . . . . A 101 GLY HA2 . 34981 1 1169 . 1 . 1 101 101 GLY HA3 H 1 3.929 0.000 . 2 . . . . A 101 GLY HA3 . 34981 1 1170 . 1 . 1 101 101 GLY CA C 13 45.299 0.036 . 1 . . . . A 101 GLY CA . 34981 1 1171 . 1 . 1 101 101 GLY N N 15 111.520 0.1 . 1 . . . . A 101 GLY N . 34981 1 1172 . 1 . 1 102 102 CYS H H 1 7.817 0.01 . 1 . . . . A 102 CYS H . 34981 1 1173 . 1 . 1 102 102 CYS HA H 1 4.327 0.003 . 1 . . . . A 102 CYS HA . 34981 1 1174 . 1 . 1 102 102 CYS HB2 H 1 2.856 0.000 . 2 . . . . A 102 CYS HB2 . 34981 1 1175 . 1 . 1 102 102 CYS HB3 H 1 2.856 0.000 . 2 . . . . A 102 CYS HB3 . 34981 1 1176 . 1 . 1 102 102 CYS CA C 13 59.301 0.000 . 1 . . . . A 102 CYS CA . 34981 1 1177 . 1 . 1 102 102 CYS CB C 13 28.936 0.007 . 1 . . . . A 102 CYS CB . 34981 1 1178 . 1 . 1 102 102 CYS N N 15 122.784 0.002 . 1 . . . . A 102 CYS N . 34981 1 stop_ save_