################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 11080 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' 1 $sample_1 isotropic 11080 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.861 0.02 . 2 . . . . 1 GLY QA . 11080 1 2 . 1 1 1 1 GLY HA3 H 1 3.861 0.02 . 2 . . . . 1 GLY QA . 11080 1 3 . 1 1 1 1 GLY CA C 13 44.141 0.2 . 1 . . . . 1 GLY CA . 11080 1 4 . 1 1 2 2 PRO HA H 1 4.470 0.02 . 1 . . . . 2 PRO HA . 11080 1 5 . 1 1 2 2 PRO HB2 H 1 2.311 0.02 . 2 . . . . 2 PRO QB . 11080 1 6 . 1 1 2 2 PRO HB3 H 1 2.311 0.02 . 2 . . . . 2 PRO QB . 11080 1 7 . 1 1 2 2 PRO HD2 H 1 3.566 0.02 . 2 . . . . 2 PRO QD . 11080 1 8 . 1 1 2 2 PRO HD3 H 1 3.566 0.02 . 2 . . . . 2 PRO QD . 11080 1 9 . 1 1 2 2 PRO HG2 H 1 2.009 0.02 . 2 . . . . 2 PRO QG . 11080 1 10 . 1 1 2 2 PRO HG3 H 1 2.009 0.02 . 2 . . . . 2 PRO QG . 11080 1 11 . 1 1 2 2 PRO CA C 13 63.246 0.2 . 1 . . . . 2 PRO CA . 11080 1 12 . 1 1 2 2 PRO CB C 13 32.388 0.2 . 1 . . . . 2 PRO CB . 11080 1 13 . 1 1 2 2 PRO CD C 13 49.759 0.2 . 1 . . . . 2 PRO CD . 11080 1 14 . 1 1 2 2 PRO CG C 13 27.288 0.2 . 1 . . . . 2 PRO CG . 11080 1 15 . 1 1 3 3 MET HA H 1 4.476 0.02 . 1 . . . . 3 MET HA . 11080 1 16 . 1 1 3 3 MET HB2 H 1 2.116 0.02 . 2 . . . . 3 MET HB2 . 11080 1 17 . 1 1 3 3 MET HB3 H 1 2.055 0.02 . 2 . . . . 3 MET HB3 . 11080 1 18 . 1 1 3 3 MET HG2 H 1 2.647 0.02 . 2 . . . . 3 MET HG2 . 11080 1 19 . 1 1 3 3 MET HG3 H 1 2.579 0.02 . 2 . . . . 3 MET HG3 . 11080 1 20 . 1 1 3 3 MET CA C 13 56.002 0.2 . 1 . . . . 3 MET CA . 11080 1 21 . 1 1 3 3 MET CB C 13 32.025 0.2 . 1 . . . . 3 MET CB . 11080 1 22 . 1 1 3 3 MET CG C 13 32.242 0.2 . 1 . . . . 3 MET CG . 11080 1 23 . 1 1 4 4 GLY HA2 H 1 4.003 0.02 . 2 . . . . 4 GLY QA . 11080 1 24 . 1 1 4 4 GLY HA3 H 1 4.003 0.02 . 2 . . . . 4 GLY QA . 11080 1 25 . 1 1 4 4 GLY CA C 13 45.433 0.2 . 1 . . . . 4 GLY CA . 11080 1 26 . 1 1 5 5 SER HA H 1 4.427 0.02 . 1 . . . . 5 SER HA . 11080 1 27 . 1 1 5 5 SER HB2 H 1 3.906 0.02 . 2 . . . . 5 SER HB2 . 11080 1 28 . 1 1 5 5 SER HB3 H 1 3.846 0.02 . 2 . . . . 5 SER HB3 . 11080 1 29 . 1 1 5 5 SER CA C 13 58.631 0.2 . 1 . . . . 5 SER CA . 11080 1 30 . 1 1 5 5 SER CB C 13 64.117 0.2 . 1 . . . . 5 SER CB . 11080 1 31 . 1 1 7 7 ALA HA H 1 4.425 0.02 . 1 . . . . 7 ALA HA . 11080 1 32 . 1 1 7 7 ALA HB1 H 1 1.431 0.02 . 1 . . . . 7 ALA QB . 11080 1 33 . 1 1 7 7 ALA HB2 H 1 1.431 0.02 . 1 . . . . 7 ALA QB . 11080 1 34 . 1 1 7 7 ALA HB3 H 1 1.431 0.02 . 1 . . . . 7 ALA QB . 11080 1 35 . 1 1 7 7 ALA CA C 13 52.645 0.2 . 1 . . . . 7 ALA CA . 11080 1 36 . 1 1 7 7 ALA CB C 13 19.616 0.2 . 1 . . . . 7 ALA CB . 11080 1 37 . 1 1 8 8 ASP H H 1 8.353 0.02 . 1 . . . . 8 ASP H . 11080 1 38 . 1 1 8 8 ASP HA H 1 4.621 0.02 . 1 . . . . 8 ASP HA . 11080 1 39 . 1 1 8 8 ASP HB2 H 1 2.682 0.02 . 2 . . . . 8 ASP HB2 . 11080 1 40 . 1 1 8 8 ASP HB3 H 1 2.770 0.02 . 2 . . . . 8 ASP HB3 . 11080 1 41 . 1 1 8 8 ASP CA C 13 55.170 0.2 . 1 . . . . 8 ASP CA . 11080 1 42 . 1 1 8 8 ASP CB C 13 41.375 0.2 . 1 . . . . 8 ASP CB . 11080 1 43 . 1 1 8 8 ASP N N 15 119.103 0.2 . 1 . . . . 8 ASP N . 11080 1 44 . 1 1 9 9 LYS H H 1 7.858 0.02 . 1 . . . . 9 LYS H . 11080 1 45 . 1 1 9 9 LYS HA H 1 4.966 0.02 . 1 . . . . 9 LYS HA . 11080 1 46 . 1 1 9 9 LYS HB2 H 1 1.638 0.02 . 2 . . . . 9 LYS HB2 . 11080 1 47 . 1 1 9 9 LYS HB3 H 1 1.527 0.02 . 2 . . . . 9 LYS HB3 . 11080 1 48 . 1 1 9 9 LYS HD2 H 1 1.463 0.02 . 2 . . . . 9 LYS HD2 . 11080 1 49 . 1 1 9 9 LYS HD3 H 1 1.445 0.02 . 2 . . . . 9 LYS HD3 . 11080 1 50 . 1 1 9 9 LYS HE2 H 1 2.859 0.02 . 2 . . . . 9 LYS HE2 . 11080 1 51 . 1 1 9 9 LYS HE3 H 1 2.843 0.02 . 2 . . . . 9 LYS HE3 . 11080 1 52 . 1 1 9 9 LYS HG2 H 1 1.421 0.02 . 2 . . . . 9 LYS HG2 . 11080 1 53 . 1 1 9 9 LYS HG3 H 1 1.179 0.02 . 2 . . . . 9 LYS HG3 . 11080 1 54 . 1 1 9 9 LYS CA C 13 55.367 0.2 . 1 . . . . 9 LYS CA . 11080 1 55 . 1 1 9 9 LYS CB C 13 36.080 0.2 . 1 . . . . 9 LYS CB . 11080 1 56 . 1 1 9 9 LYS CD C 13 29.741 0.2 . 1 . . . . 9 LYS CD . 11080 1 57 . 1 1 9 9 LYS CE C 13 42.269 0.2 . 1 . . . . 9 LYS CE . 11080 1 58 . 1 1 9 9 LYS CG C 13 25.173 0.2 . 1 . . . . 9 LYS CG . 11080 1 59 . 1 1 9 9 LYS N N 15 117.781 0.2 . 1 . . . . 9 LYS N . 11080 1 60 . 1 1 10 10 ILE H H 1 8.254 0.02 . 1 . . . . 10 ILE H . 11080 1 61 . 1 1 10 10 ILE HA H 1 4.514 0.02 . 1 . . . . 10 ILE HA . 11080 1 62 . 1 1 10 10 ILE HB H 1 1.222 0.02 . 1 . . . . 10 ILE HB . 11080 1 63 . 1 1 10 10 ILE HD11 H 1 -0.519 0.02 . 1 . . . . 10 ILE QD1 . 11080 1 64 . 1 1 10 10 ILE HD12 H 1 -0.519 0.02 . 1 . . . . 10 ILE QD1 . 11080 1 65 . 1 1 10 10 ILE HD13 H 1 -0.519 0.02 . 1 . . . . 10 ILE QD1 . 11080 1 66 . 1 1 10 10 ILE HG12 H 1 0.031 0.02 . 2 . . . . 10 ILE HG12 . 11080 1 67 . 1 1 10 10 ILE HG13 H 1 -0.064 0.02 . 2 . . . . 10 ILE HG13 . 11080 1 68 . 1 1 10 10 ILE HG21 H 1 0.501 0.02 . 1 . . . . 10 ILE QG2 . 11080 1 69 . 1 1 10 10 ILE HG22 H 1 0.501 0.02 . 1 . . . . 10 ILE QG2 . 11080 1 70 . 1 1 10 10 ILE HG23 H 1 0.501 0.02 . 1 . . . . 10 ILE QG2 . 11080 1 71 . 1 1 10 10 ILE CA C 13 59.560 0.2 . 1 . . . . 10 ILE CA . 11080 1 72 . 1 1 10 10 ILE CB C 13 42.395 0.2 . 1 . . . . 10 ILE CB . 11080 1 73 . 1 1 10 10 ILE CD1 C 13 14.078 0.2 . 1 . . . . 10 ILE CD1 . 11080 1 74 . 1 1 10 10 ILE CG1 C 13 23.836 0.2 . 1 . . . . 10 ILE CG1 . 11080 1 75 . 1 1 10 10 ILE CG2 C 13 17.232 0.2 . 1 . . . . 10 ILE CG2 . 11080 1 76 . 1 1 10 10 ILE N N 15 114.675 0.2 . 1 . . . . 10 ILE N . 11080 1 77 . 1 1 11 11 LYS H H 1 7.974 0.02 . 1 . . . . 11 LYS H . 11080 1 78 . 1 1 11 11 LYS HA H 1 4.791 0.02 . 1 . . . . 11 LYS HA . 11080 1 79 . 1 1 11 11 LYS HB2 H 1 0.690 0.02 . 2 . . . . 11 LYS HB2 . 11080 1 80 . 1 1 11 11 LYS HB3 H 1 -0.245 0.02 . 2 . . . . 11 LYS HB3 . 11080 1 81 . 1 1 11 11 LYS HD2 H 1 1.268 0.02 . 2 . . . . 11 LYS HD2 . 11080 1 82 . 1 1 11 11 LYS HD3 H 1 1.108 0.02 . 2 . . . . 11 LYS HD3 . 11080 1 83 . 1 1 11 11 LYS HE2 H 1 2.580 0.02 . 2 . . . . 11 LYS HE2 . 11080 1 84 . 1 1 11 11 LYS HE3 H 1 2.597 0.02 . 2 . . . . 11 LYS HE3 . 11080 1 85 . 1 1 11 11 LYS HG2 H 1 0.501 0.02 . 2 . . . . 11 LYS HG2 . 11080 1 86 . 1 1 11 11 LYS HG3 H 1 0.765 0.02 . 2 . . . . 11 LYS HG3 . 11080 1 87 . 1 1 11 11 LYS CA C 13 53.911 0.2 . 1 . . . . 11 LYS CA . 11080 1 88 . 1 1 11 11 LYS CB C 13 33.603 0.2 . 1 . . . . 11 LYS CB . 11080 1 89 . 1 1 11 11 LYS CD C 13 29.588 0.2 . 1 . . . . 11 LYS CD . 11080 1 90 . 1 1 11 11 LYS CE C 13 42.037 0.2 . 1 . . . . 11 LYS CE . 11080 1 91 . 1 1 11 11 LYS CG C 13 24.945 0.2 . 1 . . . . 11 LYS CG . 11080 1 92 . 1 1 11 11 LYS N N 15 121.626 0.2 . 1 . . . . 11 LYS N . 11080 1 93 . 1 1 12 12 CYS H H 1 7.256 0.02 . 1 . . . . 12 CYS H . 11080 1 94 . 1 1 12 12 CYS HA H 1 5.638 0.02 . 1 . . . . 12 CYS HA . 11080 1 95 . 1 1 12 12 CYS HB2 H 1 3.033 0.02 . 2 . . . . 12 CYS HB2 . 11080 1 96 . 1 1 12 12 CYS HB3 H 1 2.870 0.02 . 2 . . . . 12 CYS HB3 . 11080 1 97 . 1 1 12 12 CYS CA C 13 56.658 0.2 . 1 . . . . 12 CYS CA . 11080 1 98 . 1 1 12 12 CYS CB C 13 33.625 0.2 . 1 . . . . 12 CYS CB . 11080 1 99 . 1 1 12 12 CYS N N 15 118.054 0.2 . 1 . . . . 12 CYS N . 11080 1 100 . 1 1 13 13 SER H H 1 9.186 0.02 . 1 . . . . 13 SER H . 11080 1 101 . 1 1 13 13 SER HA H 1 5.625 0.02 . 1 . . . . 13 SER HA . 11080 1 102 . 1 1 13 13 SER HB2 H 1 3.887 0.02 . 2 . . . . 13 SER HB2 . 11080 1 103 . 1 1 13 13 SER HB3 H 1 3.315 0.02 . 2 . . . . 13 SER HB3 . 11080 1 104 . 1 1 13 13 SER CA C 13 56.017 0.2 . 1 . . . . 13 SER CA . 11080 1 105 . 1 1 13 13 SER CB C 13 66.920 0.2 . 1 . . . . 13 SER CB . 11080 1 106 . 1 1 13 13 SER N N 15 117.042 0.2 . 1 . . . . 13 SER N . 11080 1 107 . 1 1 14 14 HIS H H 1 9.902 0.02 . 1 . . . . 14 HIS H . 11080 1 108 . 1 1 14 14 HIS HA H 1 6.410 0.02 . 1 . . . . 14 HIS HA . 11080 1 109 . 1 1 14 14 HIS HB2 H 1 3.378 0.02 . 2 . . . . 14 HIS QB . 11080 1 110 . 1 1 14 14 HIS HB3 H 1 3.378 0.02 . 2 . . . . 14 HIS QB . 11080 1 111 . 1 1 14 14 HIS HD2 H 1 7.153 0.02 . 1 . . . . 14 HIS HD2 . 11080 1 112 . 1 1 14 14 HIS CA C 13 54.594 0.2 . 1 . . . . 14 HIS CA . 11080 1 113 . 1 1 14 14 HIS CB C 13 37.623 0.2 . 1 . . . . 14 HIS CB . 11080 1 114 . 1 1 14 14 HIS CD2 C 13 116.895 0.2 . 1 . . . . 14 HIS CD2 . 11080 1 115 . 1 1 14 14 HIS N N 15 119.162 0.2 . 1 . . . . 14 HIS N . 11080 1 116 . 1 1 15 15 ILE H H 1 8.913 0.02 . 1 . . . . 15 ILE H . 11080 1 117 . 1 1 15 15 ILE HA H 1 3.437 0.02 . 1 . . . . 15 ILE HA . 11080 1 118 . 1 1 15 15 ILE HB H 1 1.302 0.02 . 1 . . . . 15 ILE HB . 11080 1 119 . 1 1 15 15 ILE HD11 H 1 -0.091 0.02 . 1 . . . . 15 ILE QD1 . 11080 1 120 . 1 1 15 15 ILE HD12 H 1 -0.091 0.02 . 1 . . . . 15 ILE QD1 . 11080 1 121 . 1 1 15 15 ILE HD13 H 1 -0.091 0.02 . 1 . . . . 15 ILE QD1 . 11080 1 122 . 1 1 15 15 ILE HG12 H 1 0.173 0.02 . 2 . . . . 15 ILE HG12 . 11080 1 123 . 1 1 15 15 ILE HG13 H 1 1.280 0.02 . 2 . . . . 15 ILE HG13 . 11080 1 124 . 1 1 15 15 ILE HG21 H 1 0.528 0.02 . 1 . . . . 15 ILE QG2 . 11080 1 125 . 1 1 15 15 ILE HG22 H 1 0.528 0.02 . 1 . . . . 15 ILE QG2 . 11080 1 126 . 1 1 15 15 ILE HG23 H 1 0.528 0.02 . 1 . . . . 15 ILE QG2 . 11080 1 127 . 1 1 15 15 ILE CA C 13 61.876 0.2 . 1 . . . . 15 ILE CA . 11080 1 128 . 1 1 15 15 ILE CB C 13 41.793 0.2 . 1 . . . . 15 ILE CB . 11080 1 129 . 1 1 15 15 ILE CD1 C 13 14.139 0.2 . 1 . . . . 15 ILE CD1 . 11080 1 130 . 1 1 15 15 ILE CG1 C 13 28.896 0.2 . 1 . . . . 15 ILE CG1 . 11080 1 131 . 1 1 15 15 ILE CG2 C 13 17.503 0.2 . 1 . . . . 15 ILE CG2 . 11080 1 132 . 1 1 15 15 ILE N N 15 121.809 0.2 . 1 . . . . 15 ILE N . 11080 1 133 . 1 1 16 16 LEU H H 1 7.632 0.02 . 1 . . . . 16 LEU H . 11080 1 134 . 1 1 16 16 LEU HA H 1 5.018 0.02 . 1 . . . . 16 LEU HA . 11080 1 135 . 1 1 16 16 LEU HB2 H 1 0.674 0.02 . 2 . . . . 16 LEU HB2 . 11080 1 136 . 1 1 16 16 LEU HB3 H 1 1.319 0.02 . 2 . . . . 16 LEU HB3 . 11080 1 137 . 1 1 16 16 LEU HD11 H 1 -0.138 0.02 . 1 . . . . 16 LEU QD1 . 11080 1 138 . 1 1 16 16 LEU HD12 H 1 -0.138 0.02 . 1 . . . . 16 LEU QD1 . 11080 1 139 . 1 1 16 16 LEU HD13 H 1 -0.138 0.02 . 1 . . . . 16 LEU QD1 . 11080 1 140 . 1 1 16 16 LEU HD21 H 1 -0.138 0.02 . 1 . . . . 16 LEU QD2 . 11080 1 141 . 1 1 16 16 LEU HD22 H 1 -0.138 0.02 . 1 . . . . 16 LEU QD2 . 11080 1 142 . 1 1 16 16 LEU HD23 H 1 -0.138 0.02 . 1 . . . . 16 LEU QD2 . 11080 1 143 . 1 1 16 16 LEU HG H 1 1.021 0.02 . 1 . . . . 16 LEU HG . 11080 1 144 . 1 1 16 16 LEU CA C 13 52.663 0.2 . 1 . . . . 16 LEU CA . 11080 1 145 . 1 1 16 16 LEU CB C 13 45.016 0.2 . 1 . . . . 16 LEU CB . 11080 1 146 . 1 1 16 16 LEU CD1 C 13 19.593 0.2 . 2 . . . . 16 LEU CD1 . 11080 1 147 . 1 1 16 16 LEU CD2 C 13 19.712 0.2 . 2 . . . . 16 LEU CD2 . 11080 1 148 . 1 1 16 16 LEU CG C 13 26.793 0.2 . 1 . . . . 16 LEU CG . 11080 1 149 . 1 1 16 16 LEU N N 15 129.008 0.2 . 1 . . . . 16 LEU N . 11080 1 150 . 1 1 17 17 VAL H H 1 9.025 0.02 . 1 . . . . 17 VAL H . 11080 1 151 . 1 1 17 17 VAL HA H 1 4.959 0.02 . 1 . . . . 17 VAL HA . 11080 1 152 . 1 1 17 17 VAL HB H 1 2.530 0.02 . 1 . . . . 17 VAL HB . 11080 1 153 . 1 1 17 17 VAL HG11 H 1 0.688 0.02 . 1 . . . . 17 VAL QG1 . 11080 1 154 . 1 1 17 17 VAL HG12 H 1 0.688 0.02 . 1 . . . . 17 VAL QG1 . 11080 1 155 . 1 1 17 17 VAL HG13 H 1 0.688 0.02 . 1 . . . . 17 VAL QG1 . 11080 1 156 . 1 1 17 17 VAL HG21 H 1 0.762 0.02 . 1 . . . . 17 VAL QG2 . 11080 1 157 . 1 1 17 17 VAL HG22 H 1 0.762 0.02 . 1 . . . . 17 VAL QG2 . 11080 1 158 . 1 1 17 17 VAL HG23 H 1 0.762 0.02 . 1 . . . . 17 VAL QG2 . 11080 1 159 . 1 1 17 17 VAL CA C 13 58.841 0.2 . 1 . . . . 17 VAL CA . 11080 1 160 . 1 1 17 17 VAL CB C 13 34.789 0.2 . 1 . . . . 17 VAL CB . 11080 1 161 . 1 1 17 17 VAL CG1 C 13 22.373 0.2 . 2 . . . . 17 VAL CG1 . 11080 1 162 . 1 1 17 17 VAL CG2 C 13 18.892 0.2 . 2 . . . . 17 VAL CG2 . 11080 1 163 . 1 1 17 17 VAL N N 15 117.991 0.2 . 1 . . . . 17 VAL N . 11080 1 164 . 1 1 18 18 LYS H H 1 8.781 0.02 . 1 . . . . 18 LYS H . 11080 1 165 . 1 1 18 18 LYS HA H 1 4.401 0.02 . 1 . . . . 18 LYS HA . 11080 1 166 . 1 1 18 18 LYS HB2 H 1 2.014 0.02 . 2 . . . . 18 LYS HB2 . 11080 1 167 . 1 1 18 18 LYS HB3 H 1 1.985 0.02 . 2 . . . . 18 LYS HB3 . 11080 1 168 . 1 1 18 18 LYS HD2 H 1 1.797 0.02 . 2 . . . . 18 LYS HD2 . 11080 1 169 . 1 1 18 18 LYS HD3 H 1 1.647 0.02 . 2 . . . . 18 LYS HD3 . 11080 1 170 . 1 1 18 18 LYS HE2 H 1 3.065 0.02 . 2 . . . . 18 LYS HE2 . 11080 1 171 . 1 1 18 18 LYS HE3 H 1 3.019 0.02 . 2 . . . . 18 LYS HE3 . 11080 1 172 . 1 1 18 18 LYS HG2 H 1 1.532 0.02 . 2 . . . . 18 LYS HG2 . 11080 1 173 . 1 1 18 18 LYS HG3 H 1 1.682 0.02 . 2 . . . . 18 LYS HG3 . 11080 1 174 . 1 1 18 18 LYS CA C 13 59.373 0.2 . 1 . . . . 18 LYS CA . 11080 1 175 . 1 1 18 18 LYS CB C 13 34.310 0.2 . 1 . . . . 18 LYS CB . 11080 1 176 . 1 1 18 18 LYS CD C 13 28.767 0.2 . 1 . . . . 18 LYS CD . 11080 1 177 . 1 1 18 18 LYS CE C 13 42.270 0.2 . 1 . . . . 18 LYS CE . 11080 1 178 . 1 1 18 18 LYS CG C 13 25.644 0.2 . 1 . . . . 18 LYS CG . 11080 1 179 . 1 1 18 18 LYS N N 15 119.296 0.2 . 1 . . . . 18 LYS N . 11080 1 180 . 1 1 19 19 LYS H H 1 8.023 0.02 . 1 . . . . 19 LYS H . 11080 1 181 . 1 1 19 19 LYS HA H 1 4.835 0.02 . 1 . . . . 19 LYS HA . 11080 1 182 . 1 1 19 19 LYS HB2 H 1 1.560 0.02 . 2 . . . . 19 LYS HB2 . 11080 1 183 . 1 1 19 19 LYS HB3 H 1 2.055 0.02 . 2 . . . . 19 LYS HB3 . 11080 1 184 . 1 1 19 19 LYS HD2 H 1 1.664 0.02 . 2 . . . . 19 LYS HD2 . 11080 1 185 . 1 1 19 19 LYS HD3 H 1 1.745 0.02 . 2 . . . . 19 LYS HD3 . 11080 1 186 . 1 1 19 19 LYS HE2 H 1 3.019 0.02 . 2 . . . . 19 LYS HE2 . 11080 1 187 . 1 1 19 19 LYS HE3 H 1 3.007 0.02 . 2 . . . . 19 LYS HE3 . 11080 1 188 . 1 1 19 19 LYS HG2 H 1 1.447 0.02 . 2 . . . . 19 LYS HG2 . 11080 1 189 . 1 1 19 19 LYS HG3 H 1 1.430 0.02 . 2 . . . . 19 LYS HG3 . 11080 1 190 . 1 1 19 19 LYS CA C 13 54.725 0.2 . 1 . . . . 19 LYS CA . 11080 1 191 . 1 1 19 19 LYS CB C 13 35.804 0.2 . 1 . . . . 19 LYS CB . 11080 1 192 . 1 1 19 19 LYS CD C 13 29.293 0.2 . 1 . . . . 19 LYS CD . 11080 1 193 . 1 1 19 19 LYS CE C 13 42.206 0.2 . 1 . . . . 19 LYS CE . 11080 1 194 . 1 1 19 19 LYS CG C 13 25.125 0.2 . 1 . . . . 19 LYS CG . 11080 1 195 . 1 1 19 19 LYS N N 15 114.107 0.2 . 1 . . . . 19 LYS N . 11080 1 196 . 1 1 20 20 GLN H H 1 8.795 0.02 . 1 . . . . 20 GLN H . 11080 1 197 . 1 1 20 20 GLN HA H 1 4.854 0.02 . 1 . . . . 20 GLN HA . 11080 1 198 . 1 1 20 20 GLN HB2 H 1 1.519 0.02 . 2 . . . . 20 GLN HB2 . 11080 1 199 . 1 1 20 20 GLN HB3 H 1 1.787 0.02 . 2 . . . . 20 GLN HB3 . 11080 1 200 . 1 1 20 20 GLN HE21 H 1 6.851 0.02 . 2 . . . . 20 GLN HE21 . 11080 1 201 . 1 1 20 20 GLN HE22 H 1 7.458 0.02 . 2 . . . . 20 GLN HE22 . 11080 1 202 . 1 1 20 20 GLN HG2 H 1 1.894 0.02 . 2 . . . . 20 GLN HG2 . 11080 1 203 . 1 1 20 20 GLN HG3 H 1 1.990 0.02 . 2 . . . . 20 GLN HG3 . 11080 1 204 . 1 1 20 20 GLN CA C 13 59.435 0.2 . 1 . . . . 20 GLN CA . 11080 1 205 . 1 1 20 20 GLN CB C 13 27.969 0.2 . 1 . . . . 20 GLN CB . 11080 1 206 . 1 1 20 20 GLN CG C 13 33.246 0.2 . 1 . . . . 20 GLN CG . 11080 1 207 . 1 1 20 20 GLN N N 15 125.662 0.2 . 1 . . . . 20 GLN N . 11080 1 208 . 1 1 20 20 GLN NE2 N 15 110.455 0.2 . 1 . . . . 20 GLN NE2 . 11080 1 209 . 1 1 21 21 GLY HA2 H 1 3.670 0.02 . 2 . . . . 21 GLY HA2 . 11080 1 210 . 1 1 21 21 GLY HA3 H 1 3.890 0.02 . 2 . . . . 21 GLY HA3 . 11080 1 211 . 1 1 21 21 GLY CA C 13 46.997 0.2 . 1 . . . . 21 GLY CA . 11080 1 212 . 1 1 22 22 GLU H H 1 6.765 0.02 . 1 . . . . 22 GLU H . 11080 1 213 . 1 1 22 22 GLU HA H 1 4.115 0.02 . 1 . . . . 22 GLU HA . 11080 1 214 . 1 1 22 22 GLU HB2 H 1 2.541 0.02 . 2 . . . . 22 GLU HB2 . 11080 1 215 . 1 1 22 22 GLU HB3 H 1 1.873 0.02 . 2 . . . . 22 GLU HB3 . 11080 1 216 . 1 1 22 22 GLU HG2 H 1 2.305 0.02 . 2 . . . . 22 GLU HG2 . 11080 1 217 . 1 1 22 22 GLU HG3 H 1 2.279 0.02 . 2 . . . . 22 GLU HG3 . 11080 1 218 . 1 1 22 22 GLU CA C 13 58.122 0.2 . 1 . . . . 22 GLU CA . 11080 1 219 . 1 1 22 22 GLU CB C 13 29.716 0.2 . 1 . . . . 22 GLU CB . 11080 1 220 . 1 1 22 22 GLU CG C 13 37.242 0.2 . 1 . . . . 22 GLU CG . 11080 1 221 . 1 1 22 22 GLU N N 15 119.712 0.2 . 1 . . . . 22 GLU N . 11080 1 222 . 1 1 23 23 ALA H H 1 7.461 0.02 . 1 . . . . 23 ALA H . 11080 1 223 . 1 1 23 23 ALA HA H 1 3.768 0.02 . 1 . . . . 23 ALA HA . 11080 1 224 . 1 1 23 23 ALA HB1 H 1 1.204 0.02 . 1 . . . . 23 ALA QB . 11080 1 225 . 1 1 23 23 ALA HB2 H 1 1.204 0.02 . 1 . . . . 23 ALA QB . 11080 1 226 . 1 1 23 23 ALA HB3 H 1 1.204 0.02 . 1 . . . . 23 ALA QB . 11080 1 227 . 1 1 23 23 ALA CA C 13 54.905 0.2 . 1 . . . . 23 ALA CA . 11080 1 228 . 1 1 23 23 ALA CB C 13 17.803 0.2 . 1 . . . . 23 ALA CB . 11080 1 229 . 1 1 23 23 ALA N N 15 124.106 0.2 . 1 . . . . 23 ALA N . 11080 1 230 . 1 1 24 24 LEU H H 1 7.989 0.02 . 1 . . . . 24 LEU H . 11080 1 231 . 1 1 24 24 LEU HA H 1 4.179 0.02 . 1 . . . . 24 LEU HA . 11080 1 232 . 1 1 24 24 LEU HB2 H 1 1.614 0.02 . 2 . . . . 24 LEU HB2 . 11080 1 233 . 1 1 24 24 LEU HB3 H 1 1.764 0.02 . 2 . . . . 24 LEU HB3 . 11080 1 234 . 1 1 24 24 LEU HD11 H 1 0.889 0.02 . 1 . . . . 24 LEU QD1 . 11080 1 235 . 1 1 24 24 LEU HD12 H 1 0.889 0.02 . 1 . . . . 24 LEU QD1 . 11080 1 236 . 1 1 24 24 LEU HD13 H 1 0.889 0.02 . 1 . . . . 24 LEU QD1 . 11080 1 237 . 1 1 24 24 LEU HD21 H 1 0.895 0.02 . 1 . . . . 24 LEU QD2 . 11080 1 238 . 1 1 24 24 LEU HD22 H 1 0.895 0.02 . 1 . . . . 24 LEU QD2 . 11080 1 239 . 1 1 24 24 LEU HD23 H 1 0.895 0.02 . 1 . . . . 24 LEU QD2 . 11080 1 240 . 1 1 24 24 LEU HG H 1 1.672 0.02 . 1 . . . . 24 LEU HG . 11080 1 241 . 1 1 24 24 LEU CA C 13 57.837 0.2 . 1 . . . . 24 LEU CA . 11080 1 242 . 1 1 24 24 LEU CB C 13 41.204 0.2 . 1 . . . . 24 LEU CB . 11080 1 243 . 1 1 24 24 LEU CD1 C 13 25.196 0.2 . 2 . . . . 24 LEU CD1 . 11080 1 244 . 1 1 24 24 LEU CD2 C 13 23.202 0.2 . 2 . . . . 24 LEU CD2 . 11080 1 245 . 1 1 24 24 LEU CG C 13 27.336 0.2 . 1 . . . . 24 LEU CG . 11080 1 246 . 1 1 24 24 LEU N N 15 118.772 0.2 . 1 . . . . 24 LEU N . 11080 1 247 . 1 1 25 25 ALA H H 1 7.472 0.02 . 1 . . . . 25 ALA H . 11080 1 248 . 1 1 25 25 ALA HA H 1 4.196 0.02 . 1 . . . . 25 ALA HA . 11080 1 249 . 1 1 25 25 ALA HB1 H 1 1.477 0.02 . 1 . . . . 25 ALA QB . 11080 1 250 . 1 1 25 25 ALA HB2 H 1 1.477 0.02 . 1 . . . . 25 ALA QB . 11080 1 251 . 1 1 25 25 ALA HB3 H 1 1.477 0.02 . 1 . . . . 25 ALA QB . 11080 1 252 . 1 1 25 25 ALA CA C 13 55.196 0.2 . 1 . . . . 25 ALA CA . 11080 1 253 . 1 1 25 25 ALA CB C 13 17.897 0.2 . 1 . . . . 25 ALA CB . 11080 1 254 . 1 1 25 25 ALA N N 15 121.590 0.2 . 1 . . . . 25 ALA N . 11080 1 255 . 1 1 26 26 VAL H H 1 7.633 0.02 . 1 . . . . 26 VAL H . 11080 1 256 . 1 1 26 26 VAL HA H 1 3.270 0.02 . 1 . . . . 26 VAL HA . 11080 1 257 . 1 1 26 26 VAL HB H 1 2.389 0.02 . 1 . . . . 26 VAL HB . 11080 1 258 . 1 1 26 26 VAL HG11 H 1 0.943 0.02 . 1 . . . . 26 VAL QG1 . 11080 1 259 . 1 1 26 26 VAL HG12 H 1 0.943 0.02 . 1 . . . . 26 VAL QG1 . 11080 1 260 . 1 1 26 26 VAL HG13 H 1 0.943 0.02 . 1 . . . . 26 VAL QG1 . 11080 1 261 . 1 1 26 26 VAL HG21 H 1 0.704 0.02 . 1 . . . . 26 VAL QG2 . 11080 1 262 . 1 1 26 26 VAL HG22 H 1 0.704 0.02 . 1 . . . . 26 VAL QG2 . 11080 1 263 . 1 1 26 26 VAL HG23 H 1 0.704 0.02 . 1 . . . . 26 VAL QG2 . 11080 1 264 . 1 1 26 26 VAL CA C 13 67.307 0.2 . 1 . . . . 26 VAL CA . 11080 1 265 . 1 1 26 26 VAL CB C 13 31.412 0.2 . 1 . . . . 26 VAL CB . 11080 1 266 . 1 1 26 26 VAL CG1 C 13 24.496 0.2 . 2 . . . . 26 VAL CG1 . 11080 1 267 . 1 1 26 26 VAL CG2 C 13 22.701 0.2 . 2 . . . . 26 VAL CG2 . 11080 1 268 . 1 1 26 26 VAL N N 15 118.603 0.2 . 1 . . . . 26 VAL N . 11080 1 269 . 1 1 27 27 GLN H H 1 8.000 0.02 . 1 . . . . 27 GLN H . 11080 1 270 . 1 1 27 27 GLN HA H 1 3.956 0.02 . 1 . . . . 27 GLN HA . 11080 1 271 . 1 1 27 27 GLN HB2 H 1 2.294 0.02 . 2 . . . . 27 GLN HB2 . 11080 1 272 . 1 1 27 27 GLN HB3 H 1 2.316 0.02 . 2 . . . . 27 GLN HB3 . 11080 1 273 . 1 1 27 27 GLN HE21 H 1 7.071 0.02 . 2 . . . . 27 GLN HE21 . 11080 1 274 . 1 1 27 27 GLN HE22 H 1 7.693 0.02 . 2 . . . . 27 GLN HE22 . 11080 1 275 . 1 1 27 27 GLN HG2 H 1 2.514 0.02 . 2 . . . . 27 GLN HG2 . 11080 1 276 . 1 1 27 27 GLN HG3 H 1 2.238 0.02 . 2 . . . . 27 GLN HG3 . 11080 1 277 . 1 1 27 27 GLN CA C 13 60.299 0.2 . 1 . . . . 27 GLN CA . 11080 1 278 . 1 1 27 27 GLN CB C 13 29.820 0.2 . 1 . . . . 27 GLN CB . 11080 1 279 . 1 1 27 27 GLN CG C 13 34.510 0.2 . 1 . . . . 27 GLN CG . 11080 1 280 . 1 1 27 27 GLN N N 15 117.799 0.2 . 1 . . . . 27 GLN N . 11080 1 281 . 1 1 27 27 GLN NE2 N 15 111.362 0.2 . 1 . . . . 27 GLN NE2 . 11080 1 282 . 1 1 28 28 GLU H H 1 8.107 0.02 . 1 . . . . 28 GLU H . 11080 1 283 . 1 1 28 28 GLU HA H 1 4.017 0.02 . 1 . . . . 28 GLU HA . 11080 1 284 . 1 1 28 28 GLU HB2 H 1 2.131 0.02 . 2 . . . . 28 GLU HB2 . 11080 1 285 . 1 1 28 28 GLU HB3 H 1 2.178 0.02 . 2 . . . . 28 GLU HB3 . 11080 1 286 . 1 1 28 28 GLU HG2 H 1 2.333 0.02 . 2 . . . . 28 GLU HG2 . 11080 1 287 . 1 1 28 28 GLU HG3 H 1 2.396 0.02 . 2 . . . . 28 GLU HG3 . 11080 1 288 . 1 1 28 28 GLU CA C 13 59.575 0.2 . 1 . . . . 28 GLU CA . 11080 1 289 . 1 1 28 28 GLU CB C 13 29.610 0.2 . 1 . . . . 28 GLU CB . 11080 1 290 . 1 1 28 28 GLU CG C 13 36.183 0.2 . 1 . . . . 28 GLU CG . 11080 1 291 . 1 1 28 28 GLU N N 15 118.775 0.2 . 1 . . . . 28 GLU N . 11080 1 292 . 1 1 29 29 ARG H H 1 8.084 0.02 . 1 . . . . 29 ARG H . 11080 1 293 . 1 1 29 29 ARG HA H 1 4.126 0.02 . 1 . . . . 29 ARG HA . 11080 1 294 . 1 1 29 29 ARG HB2 H 1 1.669 0.02 . 2 . . . . 29 ARG HB2 . 11080 1 295 . 1 1 29 29 ARG HB3 H 1 1.980 0.02 . 2 . . . . 29 ARG HB3 . 11080 1 296 . 1 1 29 29 ARG HD2 H 1 3.270 0.02 . 2 . . . . 29 ARG HD2 . 11080 1 297 . 1 1 29 29 ARG HD3 H 1 3.297 0.02 . 2 . . . . 29 ARG HD3 . 11080 1 298 . 1 1 29 29 ARG HG2 H 1 2.128 0.02 . 2 . . . . 29 ARG HG2 . 11080 1 299 . 1 1 29 29 ARG HG3 H 1 2.151 0.02 . 2 . . . . 29 ARG HG3 . 11080 1 300 . 1 1 29 29 ARG CA C 13 60.074 0.2 . 1 . . . . 29 ARG CA . 11080 1 301 . 1 1 29 29 ARG CB C 13 31.381 0.2 . 1 . . . . 29 ARG CB . 11080 1 302 . 1 1 29 29 ARG CD C 13 43.939 0.2 . 1 . . . . 29 ARG CD . 11080 1 303 . 1 1 29 29 ARG CG C 13 27.580 0.2 . 1 . . . . 29 ARG CG . 11080 1 304 . 1 1 29 29 ARG N N 15 121.360 0.2 . 1 . . . . 29 ARG N . 11080 1 305 . 1 1 30 30 LEU H H 1 8.379 0.02 . 1 . . . . 30 LEU H . 11080 1 306 . 1 1 30 30 LEU HA H 1 4.335 0.02 . 1 . . . . 30 LEU HA . 11080 1 307 . 1 1 30 30 LEU HB2 H 1 2.076 0.02 . 2 . . . . 30 LEU HB2 . 11080 1 308 . 1 1 30 30 LEU HB3 H 1 1.525 0.02 . 2 . . . . 30 LEU HB3 . 11080 1 309 . 1 1 30 30 LEU HD11 H 1 0.941 0.02 . 1 . . . . 30 LEU QD1 . 11080 1 310 . 1 1 30 30 LEU HD12 H 1 0.941 0.02 . 1 . . . . 30 LEU QD1 . 11080 1 311 . 1 1 30 30 LEU HD13 H 1 0.941 0.02 . 1 . . . . 30 LEU QD1 . 11080 1 312 . 1 1 30 30 LEU HD21 H 1 0.589 0.02 . 1 . . . . 30 LEU QD2 . 11080 1 313 . 1 1 30 30 LEU HD22 H 1 0.589 0.02 . 1 . . . . 30 LEU QD2 . 11080 1 314 . 1 1 30 30 LEU HD23 H 1 0.589 0.02 . 1 . . . . 30 LEU QD2 . 11080 1 315 . 1 1 30 30 LEU HG H 1 0.940 0.02 . 1 . . . . 30 LEU HG . 11080 1 316 . 1 1 30 30 LEU CA C 13 57.672 0.2 . 1 . . . . 30 LEU CA . 11080 1 317 . 1 1 30 30 LEU CB C 13 41.740 0.2 . 1 . . . . 30 LEU CB . 11080 1 318 . 1 1 30 30 LEU CD1 C 13 24.044 0.2 . 2 . . . . 30 LEU CD1 . 11080 1 319 . 1 1 30 30 LEU CD2 C 13 26.852 0.2 . 2 . . . . 30 LEU CD2 . 11080 1 320 . 1 1 30 30 LEU CG C 13 27.992 0.2 . 1 . . . . 30 LEU CG . 11080 1 321 . 1 1 30 30 LEU N N 15 120.289 0.2 . 1 . . . . 30 LEU N . 11080 1 322 . 1 1 31 31 LYS H H 1 8.280 0.02 . 1 . . . . 31 LYS H . 11080 1 323 . 1 1 31 31 LYS HA H 1 4.053 0.02 . 1 . . . . 31 LYS HA . 11080 1 324 . 1 1 31 31 LYS HB2 H 1 1.951 0.02 . 2 . . . . 31 LYS HB2 . 11080 1 325 . 1 1 31 31 LYS HB3 H 1 1.982 0.02 . 2 . . . . 31 LYS HB3 . 11080 1 326 . 1 1 31 31 LYS HD2 H 1 1.686 0.02 . 2 . . . . 31 LYS HD2 . 11080 1 327 . 1 1 31 31 LYS HD3 H 1 1.704 0.02 . 2 . . . . 31 LYS HD3 . 11080 1 328 . 1 1 31 31 LYS HE2 H 1 3.022 0.02 . 2 . . . . 31 LYS HE2 . 11080 1 329 . 1 1 31 31 LYS HE3 H 1 2.957 0.02 . 2 . . . . 31 LYS HE3 . 11080 1 330 . 1 1 31 31 LYS HG2 H 1 1.504 0.02 . 2 . . . . 31 LYS HG2 . 11080 1 331 . 1 1 31 31 LYS HG3 H 1 1.681 0.02 . 2 . . . . 31 LYS HG3 . 11080 1 332 . 1 1 31 31 LYS CA C 13 59.429 0.2 . 1 . . . . 31 LYS CA . 11080 1 333 . 1 1 31 31 LYS CB C 13 32.319 0.2 . 1 . . . . 31 LYS CB . 11080 1 334 . 1 1 31 31 LYS CD C 13 29.278 0.2 . 1 . . . . 31 LYS CD . 11080 1 335 . 1 1 31 31 LYS CE C 13 42.315 0.2 . 1 . . . . 31 LYS CE . 11080 1 336 . 1 1 31 31 LYS CG C 13 25.770 0.2 . 1 . . . . 31 LYS CG . 11080 1 337 . 1 1 31 31 LYS N N 15 122.554 0.2 . 1 . . . . 31 LYS N . 11080 1 338 . 1 1 32 32 ALA H H 1 7.557 0.02 . 1 . . . . 32 ALA H . 11080 1 339 . 1 1 32 32 ALA HA H 1 4.378 0.02 . 1 . . . . 32 ALA HA . 11080 1 340 . 1 1 32 32 ALA HB1 H 1 1.618 0.02 . 1 . . . . 32 ALA QB . 11080 1 341 . 1 1 32 32 ALA HB2 H 1 1.618 0.02 . 1 . . . . 32 ALA QB . 11080 1 342 . 1 1 32 32 ALA HB3 H 1 1.618 0.02 . 1 . . . . 32 ALA QB . 11080 1 343 . 1 1 32 32 ALA CA C 13 52.576 0.2 . 1 . . . . 32 ALA CA . 11080 1 344 . 1 1 32 32 ALA CB C 13 18.821 0.2 . 1 . . . . 32 ALA CB . 11080 1 345 . 1 1 32 32 ALA N N 15 119.271 0.2 . 1 . . . . 32 ALA N . 11080 1 346 . 1 1 33 33 GLY H H 1 7.758 0.02 . 1 . . . . 33 GLY H . 11080 1 347 . 1 1 33 33 GLY HA2 H 1 4.431 0.02 . 2 . . . . 33 GLY HA2 . 11080 1 348 . 1 1 33 33 GLY HA3 H 1 3.667 0.02 . 2 . . . . 33 GLY HA3 . 11080 1 349 . 1 1 33 33 GLY CA C 13 44.745 0.2 . 1 . . . . 33 GLY CA . 11080 1 350 . 1 1 33 33 GLY N N 15 105.104 0.2 . 1 . . . . 33 GLY N . 11080 1 351 . 1 1 34 34 GLU H H 1 7.871 0.02 . 1 . . . . 34 GLU H . 11080 1 352 . 1 1 34 34 GLU HA H 1 4.279 0.02 . 1 . . . . 34 GLU HA . 11080 1 353 . 1 1 34 34 GLU HB2 H 1 1.652 0.02 . 2 . . . . 34 GLU HB2 . 11080 1 354 . 1 1 34 34 GLU HB3 H 1 1.917 0.02 . 2 . . . . 34 GLU HB3 . 11080 1 355 . 1 1 34 34 GLU HG2 H 1 2.411 0.02 . 2 . . . . 34 GLU HG2 . 11080 1 356 . 1 1 34 34 GLU HG3 H 1 2.144 0.02 . 2 . . . . 34 GLU HG3 . 11080 1 357 . 1 1 34 34 GLU CA C 13 58.172 0.2 . 1 . . . . 34 GLU CA . 11080 1 358 . 1 1 34 34 GLU CB C 13 30.736 0.2 . 1 . . . . 34 GLU CB . 11080 1 359 . 1 1 34 34 GLU CG C 13 38.486 0.2 . 1 . . . . 34 GLU CG . 11080 1 360 . 1 1 34 34 GLU N N 15 121.024 0.2 . 1 . . . . 34 GLU N . 11080 1 361 . 1 1 35 35 LYS H H 1 8.776 0.02 . 1 . . . . 35 LYS H . 11080 1 362 . 1 1 35 35 LYS HA H 1 4.265 0.02 . 1 . . . . 35 LYS HA . 11080 1 363 . 1 1 35 35 LYS HB2 H 1 1.812 0.02 . 2 . . . . 35 LYS HB2 . 11080 1 364 . 1 1 35 35 LYS HB3 H 1 2.038 0.02 . 2 . . . . 35 LYS HB3 . 11080 1 365 . 1 1 35 35 LYS HD2 H 1 1.588 0.02 . 2 . . . . 35 LYS HD2 . 11080 1 366 . 1 1 35 35 LYS HD3 H 1 1.552 0.02 . 2 . . . . 35 LYS HD3 . 11080 1 367 . 1 1 35 35 LYS HE2 H 1 3.064 0.02 . 2 . . . . 35 LYS HE2 . 11080 1 368 . 1 1 35 35 LYS HE3 H 1 3.084 0.02 . 2 . . . . 35 LYS HE3 . 11080 1 369 . 1 1 35 35 LYS HG2 H 1 1.716 0.02 . 2 . . . . 35 LYS HG2 . 11080 1 370 . 1 1 35 35 LYS HG3 H 1 1.586 0.02 . 2 . . . . 35 LYS HG3 . 11080 1 371 . 1 1 35 35 LYS CA C 13 56.317 0.2 . 1 . . . . 35 LYS CA . 11080 1 372 . 1 1 35 35 LYS CB C 13 33.062 0.2 . 1 . . . . 35 LYS CB . 11080 1 373 . 1 1 35 35 LYS CD C 13 28.634 0.2 . 1 . . . . 35 LYS CD . 11080 1 374 . 1 1 35 35 LYS CE C 13 42.583 0.2 . 1 . . . . 35 LYS CE . 11080 1 375 . 1 1 35 35 LYS CG C 13 25.319 0.2 . 1 . . . . 35 LYS CG . 11080 1 376 . 1 1 35 35 LYS N N 15 121.214 0.2 . 1 . . . . 35 LYS N . 11080 1 377 . 1 1 36 36 PHE H H 1 8.972 0.02 . 1 . . . . 36 PHE H . 11080 1 378 . 1 1 36 36 PHE HA H 1 3.643 0.02 . 1 . . . . 36 PHE HA . 11080 1 379 . 1 1 36 36 PHE HB2 H 1 3.232 0.02 . 2 . . . . 36 PHE HB2 . 11080 1 380 . 1 1 36 36 PHE HB3 H 1 3.083 0.02 . 2 . . . . 36 PHE HB3 . 11080 1 381 . 1 1 36 36 PHE HD1 H 1 7.043 0.02 . 3 . . . . 36 PHE QD . 11080 1 382 . 1 1 36 36 PHE HD2 H 1 7.043 0.02 . 3 . . . . 36 PHE QD . 11080 1 383 . 1 1 36 36 PHE CA C 13 62.830 0.2 . 1 . . . . 36 PHE CA . 11080 1 384 . 1 1 36 36 PHE CB C 13 40.295 0.2 . 1 . . . . 36 PHE CB . 11080 1 385 . 1 1 36 36 PHE CD1 C 13 131.899 0.2 . 3 . . . . 36 PHE CD1 . 11080 1 386 . 1 1 36 36 PHE CD2 C 13 131.898 0.2 . 3 . . . . 36 PHE CD2 . 11080 1 387 . 1 1 36 36 PHE N N 15 125.726 0.2 . 1 . . . . 36 PHE N . 11080 1 388 . 1 1 37 37 GLY H H 1 9.123 0.02 . 1 . . . . 37 GLY H . 11080 1 389 . 1 1 37 37 GLY HA2 H 1 3.801 0.02 . 2 . . . . 37 GLY HA2 . 11080 1 390 . 1 1 37 37 GLY HA3 H 1 3.957 0.02 . 2 . . . . 37 GLY HA3 . 11080 1 391 . 1 1 37 37 GLY CA C 13 47.345 0.2 . 1 . . . . 37 GLY CA . 11080 1 392 . 1 1 37 37 GLY N N 15 103.959 0.2 . 1 . . . . 37 GLY N . 11080 1 393 . 1 1 38 38 LYS H H 1 6.683 0.02 . 1 . . . . 38 LYS H . 11080 1 394 . 1 1 38 38 LYS HA H 1 4.058 0.02 . 1 . . . . 38 LYS HA . 11080 1 395 . 1 1 38 38 LYS HB2 H 1 1.905 0.02 . 2 . . . . 38 LYS HB2 . 11080 1 396 . 1 1 38 38 LYS HB3 H 1 1.995 0.02 . 2 . . . . 38 LYS HB3 . 11080 1 397 . 1 1 38 38 LYS HD2 H 1 1.766 0.02 . 2 . . . . 38 LYS HD2 . 11080 1 398 . 1 1 38 38 LYS HD3 H 1 1.690 0.02 . 2 . . . . 38 LYS HD3 . 11080 1 399 . 1 1 38 38 LYS HE2 H 1 2.967 0.02 . 2 . . . . 38 LYS HE2 . 11080 1 400 . 1 1 38 38 LYS HE3 H 1 2.943 0.02 . 2 . . . . 38 LYS HE3 . 11080 1 401 . 1 1 38 38 LYS HG2 H 1 1.361 0.02 . 2 . . . . 38 LYS HG2 . 11080 1 402 . 1 1 38 38 LYS HG3 H 1 1.594 0.02 . 2 . . . . 38 LYS HG3 . 11080 1 403 . 1 1 38 38 LYS CA C 13 59.029 0.2 . 1 . . . . 38 LYS CA . 11080 1 404 . 1 1 38 38 LYS CB C 13 32.655 0.2 . 1 . . . . 38 LYS CB . 11080 1 405 . 1 1 38 38 LYS CD C 13 29.522 0.2 . 1 . . . . 38 LYS CD . 11080 1 406 . 1 1 38 38 LYS CE C 13 42.257 0.2 . 1 . . . . 38 LYS CE . 11080 1 407 . 1 1 38 38 LYS CG C 13 25.219 0.2 . 1 . . . . 38 LYS CG . 11080 1 408 . 1 1 38 38 LYS N N 15 120.432 0.2 . 1 . . . . 38 LYS N . 11080 1 409 . 1 1 39 39 LEU H H 1 7.754 0.02 . 1 . . . . 39 LEU H . 11080 1 410 . 1 1 39 39 LEU HA H 1 3.907 0.02 . 1 . . . . 39 LEU HA . 11080 1 411 . 1 1 39 39 LEU HB2 H 1 1.620 0.02 . 2 . . . . 39 LEU HB2 . 11080 1 412 . 1 1 39 39 LEU HB3 H 1 0.988 0.02 . 2 . . . . 39 LEU HB3 . 11080 1 413 . 1 1 39 39 LEU HD11 H 1 -0.082 0.02 . 1 . . . . 39 LEU QD1 . 11080 1 414 . 1 1 39 39 LEU HD12 H 1 -0.082 0.02 . 1 . . . . 39 LEU QD1 . 11080 1 415 . 1 1 39 39 LEU HD13 H 1 -0.082 0.02 . 1 . . . . 39 LEU QD1 . 11080 1 416 . 1 1 39 39 LEU HD21 H 1 0.600 0.02 . 1 . . . . 39 LEU QD2 . 11080 1 417 . 1 1 39 39 LEU HD22 H 1 0.600 0.02 . 1 . . . . 39 LEU QD2 . 11080 1 418 . 1 1 39 39 LEU HD23 H 1 0.600 0.02 . 1 . . . . 39 LEU QD2 . 11080 1 419 . 1 1 39 39 LEU HG H 1 1.552 0.02 . 1 . . . . 39 LEU HG . 11080 1 420 . 1 1 39 39 LEU CA C 13 57.614 0.2 . 1 . . . . 39 LEU CA . 11080 1 421 . 1 1 39 39 LEU CB C 13 41.744 0.2 . 1 . . . . 39 LEU CB . 11080 1 422 . 1 1 39 39 LEU CD1 C 13 14.288 0.2 . 2 . . . . 39 LEU CD1 . 11080 1 423 . 1 1 39 39 LEU CD2 C 13 23.376 0.2 . 2 . . . . 39 LEU CD2 . 11080 1 424 . 1 1 39 39 LEU CG C 13 26.819 0.2 . 1 . . . . 39 LEU CG . 11080 1 425 . 1 1 39 39 LEU N N 15 119.598 0.2 . 1 . . . . 39 LEU N . 11080 1 426 . 1 1 40 40 ALA H H 1 8.437 0.02 . 1 . . . . 40 ALA H . 11080 1 427 . 1 1 40 40 ALA HA H 1 3.772 0.02 . 1 . . . . 40 ALA HA . 11080 1 428 . 1 1 40 40 ALA HB1 H 1 1.294 0.02 . 1 . . . . 40 ALA QB . 11080 1 429 . 1 1 40 40 ALA HB2 H 1 1.294 0.02 . 1 . . . . 40 ALA QB . 11080 1 430 . 1 1 40 40 ALA HB3 H 1 1.294 0.02 . 1 . . . . 40 ALA QB . 11080 1 431 . 1 1 40 40 ALA CA C 13 55.875 0.2 . 1 . . . . 40 ALA CA . 11080 1 432 . 1 1 40 40 ALA CB C 13 17.185 0.2 . 1 . . . . 40 ALA CB . 11080 1 433 . 1 1 40 40 ALA N N 15 121.385 0.2 . 1 . . . . 40 ALA N . 11080 1 434 . 1 1 41 41 LYS H H 1 7.681 0.02 . 1 . . . . 41 LYS H . 11080 1 435 . 1 1 41 41 LYS HA H 1 3.922 0.02 . 1 . . . . 41 LYS HA . 11080 1 436 . 1 1 41 41 LYS HB2 H 1 1.914 0.02 . 2 . . . . 41 LYS HB2 . 11080 1 437 . 1 1 41 41 LYS HB3 H 1 2.007 0.02 . 2 . . . . 41 LYS HB3 . 11080 1 438 . 1 1 41 41 LYS HD2 H 1 1.771 0.02 . 2 . . . . 41 LYS HD2 . 11080 1 439 . 1 1 41 41 LYS HD3 H 1 1.743 0.02 . 2 . . . . 41 LYS HD3 . 11080 1 440 . 1 1 41 41 LYS HE2 H 1 3.032 0.02 . 2 . . . . 41 LYS HE2 . 11080 1 441 . 1 1 41 41 LYS HE3 H 1 2.997 0.02 . 2 . . . . 41 LYS HE3 . 11080 1 442 . 1 1 41 41 LYS HG2 H 1 1.585 0.02 . 2 . . . . 41 LYS HG2 . 11080 1 443 . 1 1 41 41 LYS HG3 H 1 1.513 0.02 . 2 . . . . 41 LYS HG3 . 11080 1 444 . 1 1 41 41 LYS CA C 13 59.759 0.2 . 1 . . . . 41 LYS CA . 11080 1 445 . 1 1 41 41 LYS CB C 13 32.611 0.2 . 1 . . . . 41 LYS CB . 11080 1 446 . 1 1 41 41 LYS CD C 13 29.641 0.2 . 1 . . . . 41 LYS CD . 11080 1 447 . 1 1 41 41 LYS CE C 13 42.159 0.2 . 1 . . . . 41 LYS CE . 11080 1 448 . 1 1 41 41 LYS CG C 13 25.618 0.2 . 1 . . . . 41 LYS CG . 11080 1 449 . 1 1 41 41 LYS N N 15 116.991 0.2 . 1 . . . . 41 LYS N . 11080 1 450 . 1 1 42 42 GLU H H 1 7.796 0.02 . 1 . . . . 42 GLU H . 11080 1 451 . 1 1 42 42 GLU HA H 1 4.028 0.02 . 1 . . . . 42 GLU HA . 11080 1 452 . 1 1 42 42 GLU HB2 H 1 2.105 0.02 . 2 . . . . 42 GLU HB2 . 11080 1 453 . 1 1 42 42 GLU HB3 H 1 1.947 0.02 . 2 . . . . 42 GLU HB3 . 11080 1 454 . 1 1 42 42 GLU HG2 H 1 2.027 0.02 . 2 . . . . 42 GLU HG2 . 11080 1 455 . 1 1 42 42 GLU HG3 H 1 2.397 0.02 . 2 . . . . 42 GLU HG3 . 11080 1 456 . 1 1 42 42 GLU CA C 13 59.060 0.2 . 1 . . . . 42 GLU CA . 11080 1 457 . 1 1 42 42 GLU CB C 13 31.495 0.2 . 1 . . . . 42 GLU CB . 11080 1 458 . 1 1 42 42 GLU CG C 13 36.084 0.2 . 1 . . . . 42 GLU CG . 11080 1 459 . 1 1 42 42 GLU N N 15 117.121 0.2 . 1 . . . . 42 GLU N . 11080 1 460 . 1 1 43 43 LEU H H 1 8.305 0.02 . 1 . . . . 43 LEU H . 11080 1 461 . 1 1 43 43 LEU HA H 1 4.539 0.02 . 1 . . . . 43 LEU HA . 11080 1 462 . 1 1 43 43 LEU HB2 H 1 1.262 0.02 . 2 . . . . 43 LEU HB2 . 11080 1 463 . 1 1 43 43 LEU HB3 H 1 1.590 0.02 . 2 . . . . 43 LEU HB3 . 11080 1 464 . 1 1 43 43 LEU HD11 H 1 0.677 0.02 . 1 . . . . 43 LEU QD1 . 11080 1 465 . 1 1 43 43 LEU HD12 H 1 0.677 0.02 . 1 . . . . 43 LEU QD1 . 11080 1 466 . 1 1 43 43 LEU HD13 H 1 0.677 0.02 . 1 . . . . 43 LEU QD1 . 11080 1 467 . 1 1 43 43 LEU HD21 H 1 0.797 0.02 . 1 . . . . 43 LEU QD2 . 11080 1 468 . 1 1 43 43 LEU HD22 H 1 0.797 0.02 . 1 . . . . 43 LEU QD2 . 11080 1 469 . 1 1 43 43 LEU HD23 H 1 0.797 0.02 . 1 . . . . 43 LEU QD2 . 11080 1 470 . 1 1 43 43 LEU HG H 1 1.549 0.02 . 1 . . . . 43 LEU HG . 11080 1 471 . 1 1 43 43 LEU CA C 13 55.177 0.2 . 1 . . . . 43 LEU CA . 11080 1 472 . 1 1 43 43 LEU CB C 13 45.062 0.2 . 1 . . . . 43 LEU CB . 11080 1 473 . 1 1 43 43 LEU CD1 C 13 23.333 0.2 . 2 . . . . 43 LEU CD1 . 11080 1 474 . 1 1 43 43 LEU CD2 C 13 26.610 0.2 . 2 . . . . 43 LEU CD2 . 11080 1 475 . 1 1 43 43 LEU CG C 13 26.774 0.2 . 1 . . . . 43 LEU CG . 11080 1 476 . 1 1 43 43 LEU N N 15 112.754 0.2 . 1 . . . . 43 LEU N . 11080 1 477 . 1 1 44 44 SER H H 1 8.255 0.02 . 1 . . . . 44 SER H . 11080 1 478 . 1 1 44 44 SER HA H 1 4.707 0.02 . 1 . . . . 44 SER HA . 11080 1 479 . 1 1 44 44 SER HB2 H 1 3.767 0.02 . 2 . . . . 44 SER HB2 . 11080 1 480 . 1 1 44 44 SER HB3 H 1 4.209 0.02 . 2 . . . . 44 SER HB3 . 11080 1 481 . 1 1 44 44 SER CA C 13 57.490 0.2 . 1 . . . . 44 SER CA . 11080 1 482 . 1 1 44 44 SER CB C 13 65.461 0.2 . 1 . . . . 44 SER CB . 11080 1 483 . 1 1 44 44 SER N N 15 110.514 0.2 . 1 . . . . 44 SER N . 11080 1 484 . 1 1 45 45 ILE H H 1 9.238 0.02 . 1 . . . . 45 ILE H . 11080 1 485 . 1 1 45 45 ILE HA H 1 4.419 0.02 . 1 . . . . 45 ILE HA . 11080 1 486 . 1 1 45 45 ILE HB H 1 2.281 0.02 . 1 . . . . 45 ILE HB . 11080 1 487 . 1 1 45 45 ILE HD11 H 1 0.814 0.02 . 1 . . . . 45 ILE QD1 . 11080 1 488 . 1 1 45 45 ILE HD12 H 1 0.814 0.02 . 1 . . . . 45 ILE QD1 . 11080 1 489 . 1 1 45 45 ILE HD13 H 1 0.814 0.02 . 1 . . . . 45 ILE QD1 . 11080 1 490 . 1 1 45 45 ILE HG12 H 1 1.026 0.02 . 2 . . . . 45 ILE HG12 . 11080 1 491 . 1 1 45 45 ILE HG13 H 1 0.967 0.02 . 2 . . . . 45 ILE HG13 . 11080 1 492 . 1 1 45 45 ILE HG21 H 1 1.068 0.02 . 1 . . . . 45 ILE QG2 . 11080 1 493 . 1 1 45 45 ILE HG22 H 1 1.068 0.02 . 1 . . . . 45 ILE QG2 . 11080 1 494 . 1 1 45 45 ILE HG23 H 1 1.068 0.02 . 1 . . . . 45 ILE QG2 . 11080 1 495 . 1 1 45 45 ILE CA C 13 61.859 0.2 . 1 . . . . 45 ILE CA . 11080 1 496 . 1 1 45 45 ILE CB C 13 37.129 0.2 . 1 . . . . 45 ILE CB . 11080 1 497 . 1 1 45 45 ILE CD1 C 13 13.747 0.2 . 1 . . . . 45 ILE CD1 . 11080 1 498 . 1 1 45 45 ILE CG1 C 13 25.450 0.2 . 1 . . . . 45 ILE CG1 . 11080 1 499 . 1 1 45 45 ILE CG2 C 13 17.237 0.2 . 1 . . . . 45 ILE CG2 . 11080 1 500 . 1 1 45 45 ILE N N 15 120.438 0.2 . 1 . . . . 45 ILE N . 11080 1 501 . 1 1 46 46 ASP H H 1 7.488 0.02 . 1 . . . . 46 ASP H . 11080 1 502 . 1 1 46 46 ASP HA H 1 4.378 0.02 . 1 . . . . 46 ASP HA . 11080 1 503 . 1 1 46 46 ASP HB2 H 1 2.419 0.02 . 2 . . . . 46 ASP HB2 . 11080 1 504 . 1 1 46 46 ASP HB3 H 1 2.597 0.02 . 2 . . . . 46 ASP HB3 . 11080 1 505 . 1 1 46 46 ASP CA C 13 52.752 0.2 . 1 . . . . 46 ASP CA . 11080 1 506 . 1 1 46 46 ASP CB C 13 40.416 0.2 . 1 . . . . 46 ASP CB . 11080 1 507 . 1 1 46 46 ASP N N 15 120.068 0.2 . 1 . . . . 46 ASP N . 11080 1 508 . 1 1 47 47 GLY H H 1 8.562 0.02 . 1 . . . . 47 GLY H . 11080 1 509 . 1 1 47 47 GLY HA2 H 1 3.918 0.02 . 2 . . . . 47 GLY QA . 11080 1 510 . 1 1 47 47 GLY HA3 H 1 3.918 0.02 . 2 . . . . 47 GLY QA . 11080 1 511 . 1 1 47 47 GLY CA C 13 47.318 0.2 . 1 . . . . 47 GLY CA . 11080 1 512 . 1 1 47 47 GLY N N 15 114.910 0.2 . 1 . . . . 47 GLY N . 11080 1 513 . 1 1 48 48 GLY H H 1 8.328 0.02 . 1 . . . . 48 GLY H . 11080 1 514 . 1 1 48 48 GLY HA2 H 1 3.924 0.02 . 2 . . . . 48 GLY QA . 11080 1 515 . 1 1 48 48 GLY HA3 H 1 3.924 0.02 . 2 . . . . 48 GLY QA . 11080 1 516 . 1 1 48 48 GLY CA C 13 46.626 0.2 . 1 . . . . 48 GLY CA . 11080 1 517 . 1 1 48 48 GLY N N 15 106.725 0.2 . 1 . . . . 48 GLY N . 11080 1 518 . 1 1 49 49 SER H H 1 7.255 0.02 . 1 . . . . 49 SER H . 11080 1 519 . 1 1 49 49 SER HA H 1 4.560 0.02 . 1 . . . . 49 SER HA . 11080 1 520 . 1 1 49 49 SER HB2 H 1 3.774 0.02 . 2 . . . . 49 SER HB2 . 11080 1 521 . 1 1 49 49 SER HB3 H 1 3.710 0.02 . 2 . . . . 49 SER HB3 . 11080 1 522 . 1 1 49 49 SER CA C 13 59.559 0.2 . 1 . . . . 49 SER CA . 11080 1 523 . 1 1 49 49 SER CB C 13 65.469 0.2 . 1 . . . . 49 SER CB . 11080 1 524 . 1 1 49 49 SER N N 15 110.646 0.2 . 1 . . . . 49 SER N . 11080 1 525 . 1 1 50 50 ALA H H 1 8.571 0.02 . 1 . . . . 50 ALA H . 11080 1 526 . 1 1 50 50 ALA HA H 1 3.826 0.02 . 1 . . . . 50 ALA HA . 11080 1 527 . 1 1 50 50 ALA HB1 H 1 1.457 0.02 . 1 . . . . 50 ALA QB . 11080 1 528 . 1 1 50 50 ALA HB2 H 1 1.457 0.02 . 1 . . . . 50 ALA QB . 11080 1 529 . 1 1 50 50 ALA HB3 H 1 1.457 0.02 . 1 . . . . 50 ALA QB . 11080 1 530 . 1 1 50 50 ALA CA C 13 56.870 0.2 . 1 . . . . 50 ALA CA . 11080 1 531 . 1 1 50 50 ALA CB C 13 19.385 0.2 . 1 . . . . 50 ALA CB . 11080 1 532 . 1 1 50 50 ALA N N 15 130.821 0.2 . 1 . . . . 50 ALA N . 11080 1 533 . 1 1 51 51 LYS H H 1 7.761 0.02 . 1 . . . . 51 LYS H . 11080 1 534 . 1 1 51 51 LYS HA H 1 4.237 0.02 . 1 . . . . 51 LYS HA . 11080 1 535 . 1 1 51 51 LYS HB2 H 1 2.007 0.02 . 2 . . . . 51 LYS HB2 . 11080 1 536 . 1 1 51 51 LYS HB3 H 1 1.890 0.02 . 2 . . . . 51 LYS HB3 . 11080 1 537 . 1 1 51 51 LYS HD2 H 1 1.680 0.02 . 2 . . . . 51 LYS HD2 . 11080 1 538 . 1 1 51 51 LYS HD3 H 1 1.762 0.02 . 2 . . . . 51 LYS HD3 . 11080 1 539 . 1 1 51 51 LYS HE2 H 1 3.021 0.02 . 2 . . . . 51 LYS HE2 . 11080 1 540 . 1 1 51 51 LYS HE3 H 1 3.054 0.02 . 2 . . . . 51 LYS HE3 . 11080 1 541 . 1 1 51 51 LYS HG2 H 1 1.532 0.02 . 2 . . . . 51 LYS HG2 . 11080 1 542 . 1 1 51 51 LYS HG3 H 1 1.557 0.02 . 2 . . . . 51 LYS HG3 . 11080 1 543 . 1 1 51 51 LYS CA C 13 57.587 0.2 . 1 . . . . 51 LYS CA . 11080 1 544 . 1 1 51 51 LYS CB C 13 32.118 0.2 . 1 . . . . 51 LYS CB . 11080 1 545 . 1 1 51 51 LYS CD C 13 29.265 0.2 . 1 . . . . 51 LYS CD . 11080 1 546 . 1 1 51 51 LYS CE C 13 42.466 0.2 . 1 . . . . 51 LYS CE . 11080 1 547 . 1 1 51 51 LYS CG C 13 25.155 0.2 . 1 . . . . 51 LYS CG . 11080 1 548 . 1 1 51 51 LYS N N 15 110.700 0.2 . 1 . . . . 51 LYS N . 11080 1 549 . 1 1 52 52 ARG H H 1 7.650 0.02 . 1 . . . . 52 ARG H . 11080 1 550 . 1 1 52 52 ARG HA H 1 4.787 0.02 . 1 . . . . 52 ARG HA . 11080 1 551 . 1 1 52 52 ARG HB2 H 1 2.126 0.02 . 2 . . . . 52 ARG HB2 . 11080 1 552 . 1 1 52 52 ARG HB3 H 1 1.837 0.02 . 2 . . . . 52 ARG HB3 . 11080 1 553 . 1 1 52 52 ARG HD2 H 1 3.303 0.02 . 2 . . . . 52 ARG HD2 . 11080 1 554 . 1 1 52 52 ARG HD3 H 1 3.275 0.02 . 2 . . . . 52 ARG HD3 . 11080 1 555 . 1 1 52 52 ARG HG2 H 1 1.604 0.02 . 2 . . . . 52 ARG HG2 . 11080 1 556 . 1 1 52 52 ARG HG3 H 1 1.705 0.02 . 2 . . . . 52 ARG HG3 . 11080 1 557 . 1 1 52 52 ARG CA C 13 54.202 0.2 . 1 . . . . 52 ARG CA . 11080 1 558 . 1 1 52 52 ARG CB C 13 29.504 0.2 . 1 . . . . 52 ARG CB . 11080 1 559 . 1 1 52 52 ARG CD C 13 43.769 0.2 . 1 . . . . 52 ARG CD . 11080 1 560 . 1 1 52 52 ARG CG C 13 27.358 0.2 . 1 . . . . 52 ARG CG . 11080 1 561 . 1 1 52 52 ARG N N 15 120.280 0.2 . 1 . . . . 52 ARG N . 11080 1 562 . 1 1 53 53 ASP H H 1 8.157 0.02 . 1 . . . . 53 ASP H . 11080 1 563 . 1 1 53 53 ASP HA H 1 4.401 0.02 . 1 . . . . 53 ASP HA . 11080 1 564 . 1 1 53 53 ASP HB2 H 1 3.032 0.02 . 2 . . . . 53 ASP HB2 . 11080 1 565 . 1 1 53 53 ASP HB3 H 1 2.988 0.02 . 2 . . . . 53 ASP HB3 . 11080 1 566 . 1 1 53 53 ASP CA C 13 56.347 0.2 . 1 . . . . 53 ASP CA . 11080 1 567 . 1 1 53 53 ASP CB C 13 38.622 0.2 . 1 . . . . 53 ASP CB . 11080 1 568 . 1 1 53 53 ASP N N 15 117.809 0.2 . 1 . . . . 53 ASP N . 11080 1 569 . 1 1 54 54 GLY H H 1 8.279 0.02 . 1 . . . . 54 GLY H . 11080 1 570 . 1 1 54 54 GLY HA2 H 1 3.742 0.02 . 2 . . . . 54 GLY HA2 . 11080 1 571 . 1 1 54 54 GLY HA3 H 1 4.437 0.02 . 2 . . . . 54 GLY HA3 . 11080 1 572 . 1 1 54 54 GLY CA C 13 45.628 0.2 . 1 . . . . 54 GLY CA . 11080 1 573 . 1 1 54 54 GLY N N 15 104.041 0.2 . 1 . . . . 54 GLY N . 11080 1 574 . 1 1 55 55 SER H H 1 7.524 0.02 . 1 . . . . 55 SER H . 11080 1 575 . 1 1 55 55 SER HA H 1 4.578 0.02 . 1 . . . . 55 SER HA . 11080 1 576 . 1 1 55 55 SER HB2 H 1 3.988 0.02 . 2 . . . . 55 SER HB2 . 11080 1 577 . 1 1 55 55 SER HB3 H 1 3.942 0.02 . 2 . . . . 55 SER HB3 . 11080 1 578 . 1 1 55 55 SER CA C 13 59.851 0.2 . 1 . . . . 55 SER CA . 11080 1 579 . 1 1 55 55 SER CB C 13 64.102 0.2 . 1 . . . . 55 SER CB . 11080 1 580 . 1 1 55 55 SER N N 15 113.436 0.2 . 1 . . . . 55 SER N . 11080 1 581 . 1 1 56 56 LEU H H 1 8.818 0.02 . 1 . . . . 56 LEU H . 11080 1 582 . 1 1 56 56 LEU HA H 1 4.491 0.02 . 1 . . . . 56 LEU HA . 11080 1 583 . 1 1 56 56 LEU HB2 H 1 1.784 0.02 . 2 . . . . 56 LEU HB2 . 11080 1 584 . 1 1 56 56 LEU HB3 H 1 1.462 0.02 . 2 . . . . 56 LEU HB3 . 11080 1 585 . 1 1 56 56 LEU HD11 H 1 0.178 0.02 . 1 . . . . 56 LEU QD1 . 11080 1 586 . 1 1 56 56 LEU HD12 H 1 0.178 0.02 . 1 . . . . 56 LEU QD1 . 11080 1 587 . 1 1 56 56 LEU HD13 H 1 0.178 0.02 . 1 . . . . 56 LEU QD1 . 11080 1 588 . 1 1 56 56 LEU HD21 H 1 0.591 0.02 . 1 . . . . 56 LEU QD2 . 11080 1 589 . 1 1 56 56 LEU HD22 H 1 0.591 0.02 . 1 . . . . 56 LEU QD2 . 11080 1 590 . 1 1 56 56 LEU HD23 H 1 0.591 0.02 . 1 . . . . 56 LEU QD2 . 11080 1 591 . 1 1 56 56 LEU HG H 1 1.675 0.02 . 1 . . . . 56 LEU HG . 11080 1 592 . 1 1 56 56 LEU CA C 13 54.138 0.2 . 1 . . . . 56 LEU CA . 11080 1 593 . 1 1 56 56 LEU CB C 13 43.260 0.2 . 1 . . . . 56 LEU CB . 11080 1 594 . 1 1 56 56 LEU CD1 C 13 26.619 0.2 . 2 . . . . 56 LEU CD1 . 11080 1 595 . 1 1 56 56 LEU CD2 C 13 22.649 0.2 . 2 . . . . 56 LEU CD2 . 11080 1 596 . 1 1 56 56 LEU CG C 13 26.619 0.2 . 1 . . . . 56 LEU CG . 11080 1 597 . 1 1 56 56 LEU N N 15 126.328 0.2 . 1 . . . . 56 LEU N . 11080 1 598 . 1 1 57 57 GLY H H 1 8.072 0.02 . 1 . . . . 57 GLY H . 11080 1 599 . 1 1 57 57 GLY HA2 H 1 4.226 0.02 . 2 . . . . 57 GLY HA2 . 11080 1 600 . 1 1 57 57 GLY HA3 H 1 3.550 0.02 . 2 . . . . 57 GLY HA3 . 11080 1 601 . 1 1 57 57 GLY CA C 13 45.195 0.2 . 1 . . . . 57 GLY CA . 11080 1 602 . 1 1 57 57 GLY N N 15 107.077 0.2 . 1 . . . . 57 GLY N . 11080 1 603 . 1 1 58 58 TYR H H 1 8.348 0.02 . 1 . . . . 58 TYR H . 11080 1 604 . 1 1 58 58 TYR HA H 1 5.191 0.02 . 1 . . . . 58 TYR HA . 11080 1 605 . 1 1 58 58 TYR HB2 H 1 2.500 0.02 . 2 . . . . 58 TYR HB2 . 11080 1 606 . 1 1 58 58 TYR HB3 H 1 2.827 0.02 . 2 . . . . 58 TYR HB3 . 11080 1 607 . 1 1 58 58 TYR HD1 H 1 6.789 0.02 . 3 . . . . 58 TYR QD . 11080 1 608 . 1 1 58 58 TYR HD2 H 1 6.789 0.02 . 3 . . . . 58 TYR QD . 11080 1 609 . 1 1 58 58 TYR HE1 H 1 6.690 0.02 . 3 . . . . 58 TYR QE . 11080 1 610 . 1 1 58 58 TYR HE2 H 1 6.690 0.02 . 3 . . . . 58 TYR QE . 11080 1 611 . 1 1 58 58 TYR CA C 13 57.850 0.2 . 1 . . . . 58 TYR CA . 11080 1 612 . 1 1 58 58 TYR CB C 13 40.674 0.2 . 1 . . . . 58 TYR CB . 11080 1 613 . 1 1 58 58 TYR CD1 C 13 132.752 0.2 . 3 . . . . 58 TYR CD1 . 11080 1 614 . 1 1 58 58 TYR CD2 C 13 132.752 0.2 . 3 . . . . 58 TYR CD2 . 11080 1 615 . 1 1 58 58 TYR CE1 C 13 118.250 0.2 . 3 . . . . 58 TYR CE1 . 11080 1 616 . 1 1 58 58 TYR CE2 C 13 118.250 0.2 . 3 . . . . 58 TYR CE2 . 11080 1 617 . 1 1 58 58 TYR N N 15 115.734 0.2 . 1 . . . . 58 TYR N . 11080 1 618 . 1 1 59 59 PHE H H 1 9.136 0.02 . 1 . . . . 59 PHE H . 11080 1 619 . 1 1 59 59 PHE HA H 1 5.037 0.02 . 1 . . . . 59 PHE HA . 11080 1 620 . 1 1 59 59 PHE HB2 H 1 3.159 0.02 . 2 . . . . 59 PHE HB2 . 11080 1 621 . 1 1 59 59 PHE HB3 H 1 3.262 0.02 . 2 . . . . 59 PHE HB3 . 11080 1 622 . 1 1 59 59 PHE HD1 H 1 7.292 0.02 . 3 . . . . 59 PHE QD . 11080 1 623 . 1 1 59 59 PHE HD2 H 1 7.292 0.02 . 3 . . . . 59 PHE QD . 11080 1 624 . 1 1 59 59 PHE CA C 13 56.315 0.2 . 1 . . . . 59 PHE CA . 11080 1 625 . 1 1 59 59 PHE CB C 13 41.590 0.2 . 1 . . . . 59 PHE CB . 11080 1 626 . 1 1 59 59 PHE CD1 C 13 134.150 0.2 . 3 . . . . 59 PHE CD1 . 11080 1 627 . 1 1 59 59 PHE CD2 C 13 134.145 0.2 . 3 . . . . 59 PHE CD2 . 11080 1 628 . 1 1 59 59 PHE CE1 C 13 130.889 0.2 . 3 . . . . 59 PHE CE1 . 11080 1 629 . 1 1 59 59 PHE CZ C 13 129.852 0.2 . 1 . . . . 59 PHE CZ . 11080 1 630 . 1 1 59 59 PHE N N 15 118.174 0.2 . 1 . . . . 59 PHE N . 11080 1 631 . 1 1 60 60 GLY H H 1 8.594 0.02 . 1 . . . . 60 GLY H . 11080 1 632 . 1 1 60 60 GLY HA2 H 1 5.275 0.02 . 2 . . . . 60 GLY HA2 . 11080 1 633 . 1 1 60 60 GLY HA3 H 1 3.939 0.02 . 2 . . . . 60 GLY HA3 . 11080 1 634 . 1 1 60 60 GLY CA C 13 43.161 0.2 . 1 . . . . 60 GLY CA . 11080 1 635 . 1 1 60 60 GLY N N 15 106.839 0.2 . 1 . . . . 60 GLY N . 11080 1 636 . 1 1 61 61 ARG H H 1 8.833 0.02 . 1 . . . . 61 ARG H . 11080 1 637 . 1 1 61 61 ARG HA H 1 4.003 0.02 . 1 . . . . 61 ARG HA . 11080 1 638 . 1 1 61 61 ARG HB2 H 1 1.635 0.02 . 2 . . . . 61 ARG HB2 . 11080 1 639 . 1 1 61 61 ARG HB3 H 1 1.572 0.02 . 2 . . . . 61 ARG HB3 . 11080 1 640 . 1 1 61 61 ARG HD2 H 1 2.588 0.02 . 2 . . . . 61 ARG HD2 . 11080 1 641 . 1 1 61 61 ARG HD3 H 1 2.766 0.02 . 2 . . . . 61 ARG HD3 . 11080 1 642 . 1 1 61 61 ARG HG2 H 1 1.203 0.02 . 2 . . . . 61 ARG HG2 . 11080 1 643 . 1 1 61 61 ARG HG3 H 1 0.722 0.02 . 2 . . . . 61 ARG HG3 . 11080 1 644 . 1 1 61 61 ARG CA C 13 57.419 0.2 . 1 . . . . 61 ARG CA . 11080 1 645 . 1 1 61 61 ARG CB C 13 30.298 0.2 . 1 . . . . 61 ARG CB . 11080 1 646 . 1 1 61 61 ARG CD C 13 43.054 0.2 . 1 . . . . 61 ARG CD . 11080 1 647 . 1 1 61 61 ARG CG C 13 28.444 0.2 . 1 . . . . 61 ARG CG . 11080 1 648 . 1 1 61 61 ARG N N 15 119.161 0.2 . 1 . . . . 61 ARG N . 11080 1 649 . 1 1 62 62 GLY H H 1 10.418 0.02 . 1 . . . . 62 GLY H . 11080 1 650 . 1 1 62 62 GLY HA2 H 1 3.803 0.02 . 2 . . . . 62 GLY HA2 . 11080 1 651 . 1 1 62 62 GLY HA3 H 1 4.307 0.02 . 2 . . . . 62 GLY HA3 . 11080 1 652 . 1 1 62 62 GLY CA C 13 45.501 0.2 . 1 . . . . 62 GLY CA . 11080 1 653 . 1 1 62 62 GLY N N 15 112.714 0.2 . 1 . . . . 62 GLY N . 11080 1 654 . 1 1 63 63 LYS H H 1 7.706 0.02 . 1 . . . . 63 LYS H . 11080 1 655 . 1 1 63 63 LYS HA H 1 4.386 0.02 . 1 . . . . 63 LYS HA . 11080 1 656 . 1 1 63 63 LYS HB2 H 1 1.857 0.02 . 2 . . . . 63 LYS HB2 . 11080 1 657 . 1 1 63 63 LYS HB3 H 1 2.008 0.02 . 2 . . . . 63 LYS HB3 . 11080 1 658 . 1 1 63 63 LYS HD2 H 1 1.411 0.02 . 2 . . . . 63 LYS HD2 . 11080 1 659 . 1 1 63 63 LYS HD3 H 1 1.432 0.02 . 2 . . . . 63 LYS HD3 . 11080 1 660 . 1 1 63 63 LYS HE2 H 1 3.254 0.02 . 2 . . . . 63 LYS HE2 . 11080 1 661 . 1 1 63 63 LYS HE3 H 1 3.280 0.02 . 2 . . . . 63 LYS HE3 . 11080 1 662 . 1 1 63 63 LYS HG2 H 1 1.365 0.02 . 2 . . . . 63 LYS HG2 . 11080 1 663 . 1 1 63 63 LYS HG3 H 1 1.383 0.02 . 2 . . . . 63 LYS HG3 . 11080 1 664 . 1 1 63 63 LYS CA C 13 57.120 0.2 . 1 . . . . 63 LYS CA . 11080 1 665 . 1 1 63 63 LYS CB C 13 34.862 0.2 . 1 . . . . 63 LYS CB . 11080 1 666 . 1 1 63 63 LYS CD C 13 24.646 0.2 . 1 . . . . 63 LYS CD . 11080 1 667 . 1 1 63 63 LYS CE C 13 41.642 0.2 . 1 . . . . 63 LYS CE . 11080 1 668 . 1 1 63 63 LYS CG C 13 20.546 0.2 . 1 . . . . 63 LYS CG . 11080 1 669 . 1 1 63 63 LYS N N 15 120.687 0.2 . 1 . . . . 63 LYS N . 11080 1 670 . 1 1 64 64 MET H H 1 9.046 0.02 . 1 . . . . 64 MET H . 11080 1 671 . 1 1 64 64 MET HA H 1 4.608 0.02 . 1 . . . . 64 MET HA . 11080 1 672 . 1 1 64 64 MET HB2 H 1 1.825 0.02 . 2 . . . . 64 MET HB2 . 11080 1 673 . 1 1 64 64 MET HB3 H 1 1.464 0.02 . 2 . . . . 64 MET HB3 . 11080 1 674 . 1 1 64 64 MET HE1 H 1 0.907 0.02 . 1 . . . . 64 MET QE . 11080 1 675 . 1 1 64 64 MET HE2 H 1 0.907 0.02 . 1 . . . . 64 MET QE . 11080 1 676 . 1 1 64 64 MET HE3 H 1 0.907 0.02 . 1 . . . . 64 MET QE . 11080 1 677 . 1 1 64 64 MET HG2 H 1 1.761 0.02 . 2 . . . . 64 MET HG2 . 11080 1 678 . 1 1 64 64 MET HG3 H 1 1.838 0.02 . 2 . . . . 64 MET HG3 . 11080 1 679 . 1 1 64 64 MET CA C 13 51.959 0.2 . 1 . . . . 64 MET CA . 11080 1 680 . 1 1 64 64 MET CB C 13 33.012 0.2 . 1 . . . . 64 MET CB . 11080 1 681 . 1 1 64 64 MET CE C 13 17.057 0.2 . 1 . . . . 64 MET CE . 11080 1 682 . 1 1 64 64 MET CG C 13 33.255 0.2 . 1 . . . . 64 MET CG . 11080 1 683 . 1 1 64 64 MET N N 15 117.704 0.2 . 1 . . . . 64 MET N . 11080 1 684 . 1 1 65 65 VAL H H 1 8.043 0.02 . 1 . . . . 65 VAL H . 11080 1 685 . 1 1 65 65 VAL HA H 1 4.213 0.02 . 1 . . . . 65 VAL HA . 11080 1 686 . 1 1 65 65 VAL HB H 1 2.531 0.02 . 1 . . . . 65 VAL HB . 11080 1 687 . 1 1 65 65 VAL HG11 H 1 1.252 0.02 . 1 . . . . 65 VAL QG1 . 11080 1 688 . 1 1 65 65 VAL HG12 H 1 1.252 0.02 . 1 . . . . 65 VAL QG1 . 11080 1 689 . 1 1 65 65 VAL HG13 H 1 1.252 0.02 . 1 . . . . 65 VAL QG1 . 11080 1 690 . 1 1 65 65 VAL HG21 H 1 1.198 0.02 . 1 . . . . 65 VAL QG2 . 11080 1 691 . 1 1 65 65 VAL HG22 H 1 1.198 0.02 . 1 . . . . 65 VAL QG2 . 11080 1 692 . 1 1 65 65 VAL HG23 H 1 1.198 0.02 . 1 . . . . 65 VAL QG2 . 11080 1 693 . 1 1 65 65 VAL CA C 13 62.340 0.2 . 1 . . . . 65 VAL CA . 11080 1 694 . 1 1 65 65 VAL CB C 13 32.801 0.2 . 1 . . . . 65 VAL CB . 11080 1 695 . 1 1 65 65 VAL CG1 C 13 22.883 0.2 . 2 . . . . 65 VAL CG1 . 11080 1 696 . 1 1 65 65 VAL CG2 C 13 19.280 0.2 . 2 . . . . 65 VAL CG2 . 11080 1 697 . 1 1 65 65 VAL N N 15 113.540 0.2 . 1 . . . . 65 VAL N . 11080 1 698 . 1 1 66 66 LYS H H 1 8.877 0.02 . 1 . . . . 66 LYS H . 11080 1 699 . 1 1 66 66 LYS HA H 1 4.203 0.02 . 1 . . . . 66 LYS HA . 11080 1 700 . 1 1 66 66 LYS HB2 H 1 1.931 0.02 . 2 . . . . 66 LYS HB2 . 11080 1 701 . 1 1 66 66 LYS HB3 H 1 2.011 0.02 . 2 . . . . 66 LYS HB3 . 11080 1 702 . 1 1 66 66 LYS HD2 H 1 1.760 0.02 . 2 . . . . 66 LYS HD2 . 11080 1 703 . 1 1 66 66 LYS HD3 H 1 1.775 0.02 . 2 . . . . 66 LYS HD3 . 11080 1 704 . 1 1 66 66 LYS HE2 H 1 3.002 0.02 . 2 . . . . 66 LYS HE2 . 11080 1 705 . 1 1 66 66 LYS HE3 H 1 3.042 0.02 . 2 . . . . 66 LYS HE3 . 11080 1 706 . 1 1 66 66 LYS HG2 H 1 1.425 0.02 . 2 . . . . 66 LYS HG2 . 11080 1 707 . 1 1 66 66 LYS HG3 H 1 1.443 0.02 . 2 . . . . 66 LYS HG3 . 11080 1 708 . 1 1 66 66 LYS CA C 13 61.422 0.2 . 1 . . . . 66 LYS CA . 11080 1 709 . 1 1 66 66 LYS CB C 13 30.433 0.2 . 1 . . . . 66 LYS CB . 11080 1 710 . 1 1 66 66 LYS CD C 13 29.177 0.2 . 1 . . . . 66 LYS CD . 11080 1 711 . 1 1 66 66 LYS CE C 13 42.223 0.2 . 1 . . . . 66 LYS CE . 11080 1 712 . 1 1 66 66 LYS CG C 13 24.835 0.2 . 1 . . . . 66 LYS CG . 11080 1 713 . 1 1 66 66 LYS N N 15 124.592 0.2 . 1 . . . . 66 LYS N . 11080 1 714 . 1 1 67 67 PRO HA H 1 4.451 0.02 . 1 . . . . 67 PRO HA . 11080 1 715 . 1 1 67 67 PRO HB2 H 1 2.416 0.02 . 2 . . . . 67 PRO HB2 . 11080 1 716 . 1 1 67 67 PRO HB3 H 1 1.679 0.02 . 2 . . . . 67 PRO HB3 . 11080 1 717 . 1 1 67 67 PRO HD2 H 1 3.857 0.02 . 2 . . . . 67 PRO HD2 . 11080 1 718 . 1 1 67 67 PRO HD3 H 1 3.786 0.02 . 2 . . . . 67 PRO HD3 . 11080 1 719 . 1 1 67 67 PRO HG2 H 1 2.033 0.02 . 2 . . . . 67 PRO HG2 . 11080 1 720 . 1 1 67 67 PRO HG3 H 1 2.260 0.02 . 2 . . . . 67 PRO HG3 . 11080 1 721 . 1 1 67 67 PRO CA C 13 66.049 0.2 . 1 . . . . 67 PRO CA . 11080 1 722 . 1 1 67 67 PRO CB C 13 31.251 0.2 . 1 . . . . 67 PRO CB . 11080 1 723 . 1 1 67 67 PRO CD C 13 49.534 0.2 . 1 . . . . 67 PRO CD . 11080 1 724 . 1 1 67 67 PRO CG C 13 29.342 0.2 . 1 . . . . 67 PRO CG . 11080 1 725 . 1 1 68 68 PHE H H 1 6.997 0.02 . 1 . . . . 68 PHE H . 11080 1 726 . 1 1 68 68 PHE HA H 1 3.687 0.02 . 1 . . . . 68 PHE HA . 11080 1 727 . 1 1 68 68 PHE HB2 H 1 2.118 0.02 . 2 . . . . 68 PHE HB2 . 11080 1 728 . 1 1 68 68 PHE HB3 H 1 3.456 0.02 . 2 . . . . 68 PHE HB3 . 11080 1 729 . 1 1 68 68 PHE HD1 H 1 6.011 0.02 . 3 . . . . 68 PHE QD . 11080 1 730 . 1 1 68 68 PHE HD2 H 1 6.011 0.02 . 3 . . . . 68 PHE QD . 11080 1 731 . 1 1 68 68 PHE CA C 13 60.756 0.2 . 1 . . . . 68 PHE CA . 11080 1 732 . 1 1 68 68 PHE CB C 13 40.182 0.2 . 1 . . . . 68 PHE CB . 11080 1 733 . 1 1 68 68 PHE CD1 C 13 130.122 0.2 . 3 . . . . 68 PHE CD1 . 11080 1 734 . 1 1 68 68 PHE CD2 C 13 130.121 0.2 . 3 . . . . 68 PHE CD2 . 11080 1 735 . 1 1 68 68 PHE CE2 C 13 130.530 0.2 . 3 . . . . 68 PHE CE2 . 11080 1 736 . 1 1 68 68 PHE CZ C 13 128.362 0.2 . 1 . . . . 68 PHE CZ . 11080 1 737 . 1 1 68 68 PHE N N 15 115.149 0.2 . 1 . . . . 68 PHE N . 11080 1 738 . 1 1 69 69 GLU H H 1 8.562 0.02 . 1 . . . . 69 GLU H . 11080 1 739 . 1 1 69 69 GLU HA H 1 3.996 0.02 . 1 . . . . 69 GLU HA . 11080 1 740 . 1 1 69 69 GLU HB2 H 1 2.316 0.02 . 2 . . . . 69 GLU HB2 . 11080 1 741 . 1 1 69 69 GLU HB3 H 1 2.281 0.02 . 2 . . . . 69 GLU HB3 . 11080 1 742 . 1 1 69 69 GLU HG2 H 1 2.260 0.02 . 2 . . . . 69 GLU HG2 . 11080 1 743 . 1 1 69 69 GLU HG3 H 1 2.556 0.02 . 2 . . . . 69 GLU HG3 . 11080 1 744 . 1 1 69 69 GLU CA C 13 60.964 0.2 . 1 . . . . 69 GLU CA . 11080 1 745 . 1 1 69 69 GLU CB C 13 30.925 0.2 . 1 . . . . 69 GLU CB . 11080 1 746 . 1 1 69 69 GLU CG C 13 37.944 0.2 . 1 . . . . 69 GLU CG . 11080 1 747 . 1 1 69 69 GLU N N 15 119.933 0.2 . 1 . . . . 69 GLU N . 11080 1 748 . 1 1 70 70 ASP H H 1 9.074 0.02 . 1 . . . . 70 ASP H . 11080 1 749 . 1 1 70 70 ASP HA H 1 4.385 0.02 . 1 . . . . 70 ASP HA . 11080 1 750 . 1 1 70 70 ASP HB2 H 1 2.584 0.02 . 2 . . . . 70 ASP HB2 . 11080 1 751 . 1 1 70 70 ASP HB3 H 1 2.634 0.02 . 2 . . . . 70 ASP HB3 . 11080 1 752 . 1 1 70 70 ASP CA C 13 57.173 0.2 . 1 . . . . 70 ASP CA . 11080 1 753 . 1 1 70 70 ASP CB C 13 40.188 0.2 . 1 . . . . 70 ASP CB . 11080 1 754 . 1 1 70 70 ASP N N 15 116.956 0.2 . 1 . . . . 70 ASP N . 11080 1 755 . 1 1 71 71 ALA H H 1 6.888 0.02 . 1 . . . . 71 ALA H . 11080 1 756 . 1 1 71 71 ALA HA H 1 4.172 0.02 . 1 . . . . 71 ALA HA . 11080 1 757 . 1 1 71 71 ALA HB1 H 1 1.373 0.02 . 1 . . . . 71 ALA QB . 11080 1 758 . 1 1 71 71 ALA HB2 H 1 1.373 0.02 . 1 . . . . 71 ALA QB . 11080 1 759 . 1 1 71 71 ALA HB3 H 1 1.373 0.02 . 1 . . . . 71 ALA QB . 11080 1 760 . 1 1 71 71 ALA CA C 13 54.315 0.2 . 1 . . . . 71 ALA CA . 11080 1 761 . 1 1 71 71 ALA CB C 13 20.502 0.2 . 1 . . . . 71 ALA CB . 11080 1 762 . 1 1 71 71 ALA N N 15 117.745 0.2 . 1 . . . . 71 ALA N . 11080 1 763 . 1 1 72 72 ALA H H 1 8.860 0.02 . 1 . . . . 72 ALA H . 11080 1 764 . 1 1 72 72 ALA HA H 1 3.746 0.02 . 1 . . . . 72 ALA HA . 11080 1 765 . 1 1 72 72 ALA HB1 H 1 1.400 0.02 . 1 . . . . 72 ALA QB . 11080 1 766 . 1 1 72 72 ALA HB2 H 1 1.400 0.02 . 1 . . . . 72 ALA QB . 11080 1 767 . 1 1 72 72 ALA HB3 H 1 1.400 0.02 . 1 . . . . 72 ALA QB . 11080 1 768 . 1 1 72 72 ALA CA C 13 55.393 0.2 . 1 . . . . 72 ALA CA . 11080 1 769 . 1 1 72 72 ALA CB C 13 19.084 0.2 . 1 . . . . 72 ALA CB . 11080 1 770 . 1 1 72 72 ALA N N 15 120.783 0.2 . 1 . . . . 72 ALA N . 11080 1 771 . 1 1 73 73 PHE H H 1 8.275 0.02 . 1 . . . . 73 PHE H . 11080 1 772 . 1 1 73 73 PHE HA H 1 4.021 0.02 . 1 . . . . 73 PHE HA . 11080 1 773 . 1 1 73 73 PHE HB2 H 1 3.279 0.02 . 2 . . . . 73 PHE HB2 . 11080 1 774 . 1 1 73 73 PHE HB3 H 1 3.057 0.02 . 2 . . . . 73 PHE HB3 . 11080 1 775 . 1 1 73 73 PHE HD1 H 1 7.647 0.02 . 3 . . . . 73 PHE QD . 11080 1 776 . 1 1 73 73 PHE HD2 H 1 7.647 0.02 . 3 . . . . 73 PHE QD . 11080 1 777 . 1 1 73 73 PHE HE1 H 1 7.657 0.02 . 3 . . . . 73 PHE QE . 11080 1 778 . 1 1 73 73 PHE HE2 H 1 7.657 0.02 . 3 . . . . 73 PHE QE . 11080 1 779 . 1 1 73 73 PHE HZ H 1 7.758 0.02 . 1 . . . . 73 PHE HZ . 11080 1 780 . 1 1 73 73 PHE CA C 13 61.566 0.2 . 1 . . . . 73 PHE CA . 11080 1 781 . 1 1 73 73 PHE CB C 13 38.327 0.2 . 1 . . . . 73 PHE CB . 11080 1 782 . 1 1 73 73 PHE CD1 C 13 131.885 0.2 . 3 . . . . 73 PHE CD1 . 11080 1 783 . 1 1 73 73 PHE CD2 C 13 131.884 0.2 . 3 . . . . 73 PHE CD2 . 11080 1 784 . 1 1 73 73 PHE CE1 C 13 136.916 0.2 . 3 . . . . 73 PHE CE1 . 11080 1 785 . 1 1 73 73 PHE CE2 C 13 136.916 0.2 . 3 . . . . 73 PHE CE2 . 11080 1 786 . 1 1 73 73 PHE CZ C 13 136.232 0.2 . 1 . . . . 73 PHE CZ . 11080 1 787 . 1 1 73 73 PHE N N 15 110.353 0.2 . 1 . . . . 73 PHE N . 11080 1 788 . 1 1 74 74 ARG H H 1 7.047 0.02 . 1 . . . . 74 ARG H . 11080 1 789 . 1 1 74 74 ARG HA H 1 4.474 0.02 . 1 . . . . 74 ARG HA . 11080 1 790 . 1 1 74 74 ARG HB2 H 1 2.026 0.02 . 2 . . . . 74 ARG HB2 . 11080 1 791 . 1 1 74 74 ARG HB3 H 1 1.819 0.02 . 2 . . . . 74 ARG HB3 . 11080 1 792 . 1 1 74 74 ARG HD2 H 1 3.239 0.02 . 2 . . . . 74 ARG HD2 . 11080 1 793 . 1 1 74 74 ARG HD3 H 1 3.256 0.02 . 2 . . . . 74 ARG HD3 . 11080 1 794 . 1 1 74 74 ARG HG2 H 1 1.886 0.02 . 2 . . . . 74 ARG HG2 . 11080 1 795 . 1 1 74 74 ARG HG3 H 1 1.731 0.02 . 2 . . . . 74 ARG HG3 . 11080 1 796 . 1 1 74 74 ARG CA C 13 56.367 0.2 . 1 . . . . 74 ARG CA . 11080 1 797 . 1 1 74 74 ARG CB C 13 31.700 0.2 . 1 . . . . 74 ARG CB . 11080 1 798 . 1 1 74 74 ARG CD C 13 43.804 0.2 . 1 . . . . 74 ARG CD . 11080 1 799 . 1 1 74 74 ARG CG C 13 27.850 0.2 . 1 . . . . 74 ARG CG . 11080 1 800 . 1 1 74 74 ARG N N 15 116.189 0.2 . 1 . . . . 74 ARG N . 11080 1 801 . 1 1 75 75 LEU H H 1 7.033 0.02 . 1 . . . . 75 LEU H . 11080 1 802 . 1 1 75 75 LEU HA H 1 4.279 0.02 . 1 . . . . 75 LEU HA . 11080 1 803 . 1 1 75 75 LEU HB2 H 1 1.746 0.02 . 2 . . . . 75 LEU HB2 . 11080 1 804 . 1 1 75 75 LEU HB3 H 1 1.485 0.02 . 2 . . . . 75 LEU HB3 . 11080 1 805 . 1 1 75 75 LEU HD11 H 1 0.561 0.02 . 1 . . . . 75 LEU QD1 . 11080 1 806 . 1 1 75 75 LEU HD12 H 1 0.561 0.02 . 1 . . . . 75 LEU QD1 . 11080 1 807 . 1 1 75 75 LEU HD13 H 1 0.561 0.02 . 1 . . . . 75 LEU QD1 . 11080 1 808 . 1 1 75 75 LEU HD21 H 1 0.562 0.02 . 1 . . . . 75 LEU QD2 . 11080 1 809 . 1 1 75 75 LEU HD22 H 1 0.562 0.02 . 1 . . . . 75 LEU QD2 . 11080 1 810 . 1 1 75 75 LEU HD23 H 1 0.562 0.02 . 1 . . . . 75 LEU QD2 . 11080 1 811 . 1 1 75 75 LEU HG H 1 2.059 0.02 . 1 . . . . 75 LEU HG . 11080 1 812 . 1 1 75 75 LEU CA C 13 55.001 0.2 . 1 . . . . 75 LEU CA . 11080 1 813 . 1 1 75 75 LEU CB C 13 43.145 0.2 . 1 . . . . 75 LEU CB . 11080 1 814 . 1 1 75 75 LEU CD1 C 13 21.836 0.2 . 2 . . . . 75 LEU CD1 . 11080 1 815 . 1 1 75 75 LEU CD2 C 13 21.989 0.2 . 2 . . . . 75 LEU CD2 . 11080 1 816 . 1 1 75 75 LEU CG C 13 25.811 0.2 . 1 . . . . 75 LEU CG . 11080 1 817 . 1 1 75 75 LEU N N 15 119.425 0.2 . 1 . . . . 75 LEU N . 11080 1 818 . 1 1 76 76 GLN H H 1 9.087 0.02 . 1 . . . . 76 GLN H . 11080 1 819 . 1 1 76 76 GLN HA H 1 4.407 0.02 . 1 . . . . 76 GLN HA . 11080 1 820 . 1 1 76 76 GLN HB2 H 1 2.197 0.02 . 2 . . . . 76 GLN HB2 . 11080 1 821 . 1 1 76 76 GLN HB3 H 1 1.775 0.02 . 2 . . . . 76 GLN HB3 . 11080 1 822 . 1 1 76 76 GLN HE21 H 1 7.628 0.02 . 2 . . . . 76 GLN HE21 . 11080 1 823 . 1 1 76 76 GLN HE22 H 1 6.922 0.02 . 2 . . . . 76 GLN HE22 . 11080 1 824 . 1 1 76 76 GLN HG2 H 1 2.469 0.02 . 2 . . . . 76 GLN HG2 . 11080 1 825 . 1 1 76 76 GLN HG3 H 1 2.524 0.02 . 2 . . . . 76 GLN HG3 . 11080 1 826 . 1 1 76 76 GLN CA C 13 54.459 0.2 . 1 . . . . 76 GLN CA . 11080 1 827 . 1 1 76 76 GLN CB C 13 29.620 0.2 . 1 . . . . 76 GLN CB . 11080 1 828 . 1 1 76 76 GLN CG C 13 34.059 0.2 . 1 . . . . 76 GLN CG . 11080 1 829 . 1 1 76 76 GLN N N 15 121.205 0.2 . 1 . . . . 76 GLN N . 11080 1 830 . 1 1 76 76 GLN NE2 N 15 113.574 0.2 . 1 . . . . 76 GLN NE2 . 11080 1 831 . 1 1 77 77 VAL H H 1 8.901 0.02 . 1 . . . . 77 VAL H . 11080 1 832 . 1 1 77 77 VAL HA H 1 4.403 0.02 . 1 . . . . 77 VAL HA . 11080 1 833 . 1 1 77 77 VAL HB H 1 2.889 0.02 . 1 . . . . 77 VAL HB . 11080 1 834 . 1 1 77 77 VAL HG11 H 1 0.765 0.02 . 1 . . . . 77 VAL QG1 . 11080 1 835 . 1 1 77 77 VAL HG12 H 1 0.765 0.02 . 1 . . . . 77 VAL QG1 . 11080 1 836 . 1 1 77 77 VAL HG13 H 1 0.765 0.02 . 1 . . . . 77 VAL QG1 . 11080 1 837 . 1 1 77 77 VAL HG21 H 1 0.809 0.02 . 1 . . . . 77 VAL QG2 . 11080 1 838 . 1 1 77 77 VAL HG22 H 1 0.809 0.02 . 1 . . . . 77 VAL QG2 . 11080 1 839 . 1 1 77 77 VAL HG23 H 1 0.809 0.02 . 1 . . . . 77 VAL QG2 . 11080 1 840 . 1 1 77 77 VAL CA C 13 67.583 0.2 . 1 . . . . 77 VAL CA . 11080 1 841 . 1 1 77 77 VAL CB C 13 28.616 0.2 . 1 . . . . 77 VAL CB . 11080 1 842 . 1 1 77 77 VAL CG1 C 13 26.541 0.2 . 2 . . . . 77 VAL CG1 . 11080 1 843 . 1 1 77 77 VAL CG2 C 13 22.421 0.2 . 2 . . . . 77 VAL CG2 . 11080 1 844 . 1 1 77 77 VAL N N 15 121.809 0.2 . 1 . . . . 77 VAL N . 11080 1 845 . 1 1 78 78 GLY H H 1 9.049 0.02 . 1 . . . . 78 GLY H . 11080 1 846 . 1 1 78 78 GLY HA2 H 1 4.371 0.02 . 2 . . . . 78 GLY HA2 . 11080 1 847 . 1 1 78 78 GLY HA3 H 1 3.561 0.02 . 2 . . . . 78 GLY HA3 . 11080 1 848 . 1 1 78 78 GLY CA C 13 45.133 0.2 . 1 . . . . 78 GLY CA . 11080 1 849 . 1 1 78 78 GLY N N 15 117.559 0.2 . 1 . . . . 78 GLY N . 11080 1 850 . 1 1 79 79 GLU H H 1 8.093 0.02 . 1 . . . . 79 GLU H . 11080 1 851 . 1 1 79 79 GLU HA H 1 4.267 0.02 . 1 . . . . 79 GLU HA . 11080 1 852 . 1 1 79 79 GLU HB2 H 1 2.169 0.02 . 2 . . . . 79 GLU HB2 . 11080 1 853 . 1 1 79 79 GLU HB3 H 1 1.966 0.02 . 2 . . . . 79 GLU HB3 . 11080 1 854 . 1 1 79 79 GLU HG2 H 1 2.335 0.02 . 2 . . . . 79 GLU HG2 . 11080 1 855 . 1 1 79 79 GLU HG3 H 1 2.172 0.02 . 2 . . . . 79 GLU HG3 . 11080 1 856 . 1 1 79 79 GLU CA C 13 56.547 0.2 . 1 . . . . 79 GLU CA . 11080 1 857 . 1 1 79 79 GLU CB C 13 32.290 0.2 . 1 . . . . 79 GLU CB . 11080 1 858 . 1 1 79 79 GLU CG C 13 37.025 0.2 . 1 . . . . 79 GLU CG . 11080 1 859 . 1 1 79 79 GLU N N 15 122.304 0.2 . 1 . . . . 79 GLU N . 11080 1 860 . 1 1 80 80 VAL H H 1 8.133 0.02 . 1 . . . . 80 VAL H . 11080 1 861 . 1 1 80 80 VAL HA H 1 5.046 0.02 . 1 . . . . 80 VAL HA . 11080 1 862 . 1 1 80 80 VAL HB H 1 1.906 0.02 . 1 . . . . 80 VAL HB . 11080 1 863 . 1 1 80 80 VAL HG11 H 1 1.147 0.02 . 1 . . . . 80 VAL QG1 . 11080 1 864 . 1 1 80 80 VAL HG12 H 1 1.147 0.02 . 1 . . . . 80 VAL QG1 . 11080 1 865 . 1 1 80 80 VAL HG13 H 1 1.147 0.02 . 1 . . . . 80 VAL QG1 . 11080 1 866 . 1 1 80 80 VAL HG21 H 1 0.951 0.02 . 1 . . . . 80 VAL QG2 . 11080 1 867 . 1 1 80 80 VAL HG22 H 1 0.951 0.02 . 1 . . . . 80 VAL QG2 . 11080 1 868 . 1 1 80 80 VAL HG23 H 1 0.951 0.02 . 1 . . . . 80 VAL QG2 . 11080 1 869 . 1 1 80 80 VAL CA C 13 60.322 0.2 . 1 . . . . 80 VAL CA . 11080 1 870 . 1 1 80 80 VAL CB C 13 33.557 0.2 . 1 . . . . 80 VAL CB . 11080 1 871 . 1 1 80 80 VAL CG1 C 13 22.577 0.2 . 2 . . . . 80 VAL CG1 . 11080 1 872 . 1 1 80 80 VAL CG2 C 13 21.978 0.2 . 2 . . . . 80 VAL CG2 . 11080 1 873 . 1 1 80 80 VAL N N 15 122.253 0.2 . 1 . . . . 80 VAL N . 11080 1 874 . 1 1 81 81 SER H H 1 9.927 0.02 . 1 . . . . 81 SER H . 11080 1 875 . 1 1 81 81 SER HA H 1 4.346 0.02 . 1 . . . . 81 SER HA . 11080 1 876 . 1 1 81 81 SER HB2 H 1 4.512 0.02 . 2 . . . . 81 SER HB2 . 11080 1 877 . 1 1 81 81 SER HB3 H 1 3.757 0.02 . 2 . . . . 81 SER HB3 . 11080 1 878 . 1 1 81 81 SER CA C 13 59.316 0.2 . 1 . . . . 81 SER CA . 11080 1 879 . 1 1 81 81 SER CB C 13 65.988 0.2 . 1 . . . . 81 SER CB . 11080 1 880 . 1 1 81 81 SER N N 15 125.484 0.2 . 1 . . . . 81 SER N . 11080 1 881 . 1 1 82 82 GLU H H 1 7.986 0.02 . 1 . . . . 82 GLU H . 11080 1 882 . 1 1 82 82 GLU HA H 1 4.623 0.02 . 1 . . . . 82 GLU HA . 11080 1 883 . 1 1 82 82 GLU HB2 H 1 2.252 0.02 . 2 . . . . 82 GLU HB2 . 11080 1 884 . 1 1 82 82 GLU HB3 H 1 1.853 0.02 . 2 . . . . 82 GLU HB3 . 11080 1 885 . 1 1 82 82 GLU HG2 H 1 2.447 0.02 . 2 . . . . 82 GLU HG2 . 11080 1 886 . 1 1 82 82 GLU HG3 H 1 2.380 0.02 . 2 . . . . 82 GLU HG3 . 11080 1 887 . 1 1 82 82 GLU CA C 13 55.651 0.2 . 1 . . . . 82 GLU CA . 11080 1 888 . 1 1 82 82 GLU CB C 13 28.330 0.2 . 1 . . . . 82 GLU CB . 11080 1 889 . 1 1 82 82 GLU CG C 13 36.349 0.2 . 1 . . . . 82 GLU CG . 11080 1 890 . 1 1 82 82 GLU N N 15 116.381 0.2 . 1 . . . . 82 GLU N . 11080 1 891 . 1 1 83 83 PRO HA H 1 4.733 0.02 . 1 . . . . 83 PRO HA . 11080 1 892 . 1 1 83 83 PRO HB2 H 1 2.098 0.02 . 2 . . . . 83 PRO HB2 . 11080 1 893 . 1 1 83 83 PRO HB3 H 1 1.887 0.02 . 2 . . . . 83 PRO HB3 . 11080 1 894 . 1 1 83 83 PRO HD2 H 1 3.644 0.02 . 2 . . . . 83 PRO HD2 . 11080 1 895 . 1 1 83 83 PRO HD3 H 1 3.862 0.02 . 2 . . . . 83 PRO HD3 . 11080 1 896 . 1 1 83 83 PRO HG2 H 1 2.039 0.02 . 2 . . . . 83 PRO HG2 . 11080 1 897 . 1 1 83 83 PRO HG3 H 1 1.469 0.02 . 2 . . . . 83 PRO HG3 . 11080 1 898 . 1 1 83 83 PRO CA C 13 63.682 0.2 . 1 . . . . 83 PRO CA . 11080 1 899 . 1 1 83 83 PRO CB C 13 31.442 0.2 . 1 . . . . 83 PRO CB . 11080 1 900 . 1 1 83 83 PRO CD C 13 50.079 0.2 . 1 . . . . 83 PRO CD . 11080 1 901 . 1 1 83 83 PRO CG C 13 28.966 0.2 . 1 . . . . 83 PRO CG . 11080 1 902 . 1 1 84 84 VAL H H 1 9.630 0.02 . 1 . . . . 84 VAL H . 11080 1 903 . 1 1 84 84 VAL HA H 1 4.361 0.02 . 1 . . . . 84 VAL HA . 11080 1 904 . 1 1 84 84 VAL HB H 1 1.993 0.02 . 1 . . . . 84 VAL HB . 11080 1 905 . 1 1 84 84 VAL HG11 H 1 0.786 0.02 . 1 . . . . 84 VAL QG1 . 11080 1 906 . 1 1 84 84 VAL HG12 H 1 0.786 0.02 . 1 . . . . 84 VAL QG1 . 11080 1 907 . 1 1 84 84 VAL HG13 H 1 0.786 0.02 . 1 . . . . 84 VAL QG1 . 11080 1 908 . 1 1 84 84 VAL HG21 H 1 0.993 0.02 . 1 . . . . 84 VAL QG2 . 11080 1 909 . 1 1 84 84 VAL HG22 H 1 0.993 0.02 . 1 . . . . 84 VAL QG2 . 11080 1 910 . 1 1 84 84 VAL HG23 H 1 0.993 0.02 . 1 . . . . 84 VAL QG2 . 11080 1 911 . 1 1 84 84 VAL CA C 13 61.251 0.2 . 1 . . . . 84 VAL CA . 11080 1 912 . 1 1 84 84 VAL CB C 13 35.610 0.2 . 1 . . . . 84 VAL CB . 11080 1 913 . 1 1 84 84 VAL CG1 C 13 20.888 0.2 . 2 . . . . 84 VAL CG1 . 11080 1 914 . 1 1 84 84 VAL CG2 C 13 20.645 0.2 . 2 . . . . 84 VAL CG2 . 11080 1 915 . 1 1 84 84 VAL N N 15 127.594 0.2 . 1 . . . . 84 VAL N . 11080 1 916 . 1 1 85 85 LYS H H 1 8.827 0.02 . 1 . . . . 85 LYS H . 11080 1 917 . 1 1 85 85 LYS HA H 1 4.280 0.02 . 1 . . . . 85 LYS HA . 11080 1 918 . 1 1 85 85 LYS HB2 H 1 1.717 0.02 . 2 . . . . 85 LYS HB2 . 11080 1 919 . 1 1 85 85 LYS HB3 H 1 1.424 0.02 . 2 . . . . 85 LYS HB3 . 11080 1 920 . 1 1 85 85 LYS HD2 H 1 1.231 0.02 . 2 . . . . 85 LYS HD2 . 11080 1 921 . 1 1 85 85 LYS HD3 H 1 1.571 0.02 . 2 . . . . 85 LYS HD3 . 11080 1 922 . 1 1 85 85 LYS HE2 H 1 2.867 0.02 . 2 . . . . 85 LYS HE2 . 11080 1 923 . 1 1 85 85 LYS HE3 H 1 2.924 0.02 . 2 . . . . 85 LYS HE3 . 11080 1 924 . 1 1 85 85 LYS HG2 H 1 0.695 0.02 . 2 . . . . 85 LYS HG2 . 11080 1 925 . 1 1 85 85 LYS HG3 H 1 1.067 0.02 . 2 . . . . 85 LYS HG3 . 11080 1 926 . 1 1 85 85 LYS CA C 13 56.161 0.2 . 1 . . . . 85 LYS CA . 11080 1 927 . 1 1 85 85 LYS CB C 13 33.684 0.2 . 1 . . . . 85 LYS CB . 11080 1 928 . 1 1 85 85 LYS CD C 13 28.939 0.2 . 1 . . . . 85 LYS CD . 11080 1 929 . 1 1 85 85 LYS CE C 13 42.561 0.2 . 1 . . . . 85 LYS CE . 11080 1 930 . 1 1 85 85 LYS CG C 13 24.974 0.2 . 1 . . . . 85 LYS CG . 11080 1 931 . 1 1 85 85 LYS N N 15 130.184 0.2 . 1 . . . . 85 LYS N . 11080 1 932 . 1 1 86 86 SER H H 1 9.594 0.02 . 1 . . . . 86 SER H . 11080 1 933 . 1 1 86 86 SER HA H 1 4.925 0.02 . 1 . . . . 86 SER HA . 11080 1 934 . 1 1 86 86 SER HB2 H 1 4.599 0.02 . 2 . . . . 86 SER HB2 . 11080 1 935 . 1 1 86 86 SER HB3 H 1 3.815 0.02 . 2 . . . . 86 SER HB3 . 11080 1 936 . 1 1 86 86 SER CA C 13 56.939 0.2 . 1 . . . . 86 SER CA . 11080 1 937 . 1 1 86 86 SER CB C 13 67.836 0.2 . 1 . . . . 86 SER CB . 11080 1 938 . 1 1 86 86 SER N N 15 125.071 0.2 . 1 . . . . 86 SER N . 11080 1 939 . 1 1 87 87 GLU H H 1 9.615 0.02 . 1 . . . . 87 GLU H . 11080 1 940 . 1 1 87 87 GLU HA H 1 4.120 0.02 . 1 . . . . 87 GLU HA . 11080 1 941 . 1 1 87 87 GLU HB2 H 1 1.863 0.02 . 2 . . . . 87 GLU HB2 . 11080 1 942 . 1 1 87 87 GLU HB3 H 1 1.766 0.02 . 2 . . . . 87 GLU HB3 . 11080 1 943 . 1 1 87 87 GLU HG2 H 1 1.527 0.02 . 2 . . . . 87 GLU HG2 . 11080 1 944 . 1 1 87 87 GLU HG3 H 1 1.196 0.02 . 2 . . . . 87 GLU HG3 . 11080 1 945 . 1 1 87 87 GLU CA C 13 58.085 0.2 . 1 . . . . 87 GLU CA . 11080 1 946 . 1 1 87 87 GLU CB C 13 29.380 0.2 . 1 . . . . 87 GLU CB . 11080 1 947 . 1 1 87 87 GLU CG C 13 35.378 0.2 . 1 . . . . 87 GLU CG . 11080 1 948 . 1 1 87 87 GLU N N 15 118.510 0.2 . 1 . . . . 87 GLU N . 11080 1 949 . 1 1 88 88 PHE H H 1 8.817 0.02 . 1 . . . . 88 PHE H . 11080 1 950 . 1 1 88 88 PHE HA H 1 4.539 0.02 . 1 . . . . 88 PHE HA . 11080 1 951 . 1 1 88 88 PHE HB2 H 1 3.325 0.02 . 2 . . . . 88 PHE HB2 . 11080 1 952 . 1 1 88 88 PHE HB3 H 1 2.627 0.02 . 2 . . . . 88 PHE HB3 . 11080 1 953 . 1 1 88 88 PHE HD1 H 1 7.402 0.02 . 3 . . . . 88 PHE QD . 11080 1 954 . 1 1 88 88 PHE HD2 H 1 7.402 0.02 . 3 . . . . 88 PHE QD . 11080 1 955 . 1 1 88 88 PHE HE1 H 1 7.268 0.02 . 3 . . . . 88 PHE QE . 11080 1 956 . 1 1 88 88 PHE HE2 H 1 7.268 0.02 . 3 . . . . 88 PHE QE . 11080 1 957 . 1 1 88 88 PHE CA C 13 58.501 0.2 . 1 . . . . 88 PHE CA . 11080 1 958 . 1 1 88 88 PHE CB C 13 40.159 0.2 . 1 . . . . 88 PHE CB . 11080 1 959 . 1 1 88 88 PHE CD1 C 13 130.544 0.2 . 3 . . . . 88 PHE CD1 . 11080 1 960 . 1 1 88 88 PHE CD2 C 13 130.544 0.2 . 3 . . . . 88 PHE CD2 . 11080 1 961 . 1 1 88 88 PHE CE1 C 13 130.196 0.2 . 3 . . . . 88 PHE CE1 . 11080 1 962 . 1 1 88 88 PHE CE2 C 13 130.196 0.2 . 3 . . . . 88 PHE CE2 . 11080 1 963 . 1 1 88 88 PHE N N 15 118.385 0.2 . 1 . . . . 88 PHE N . 11080 1 964 . 1 1 89 89 GLY H H 1 7.405 0.02 . 1 . . . . 89 GLY H . 11080 1 965 . 1 1 89 89 GLY HA2 H 1 3.696 0.02 . 2 . . . . 89 GLY HA2 . 11080 1 966 . 1 1 89 89 GLY HA3 H 1 4.438 0.02 . 2 . . . . 89 GLY HA3 . 11080 1 967 . 1 1 89 89 GLY CA C 13 45.088 0.2 . 1 . . . . 89 GLY CA . 11080 1 968 . 1 1 89 89 GLY N N 15 107.269 0.2 . 1 . . . . 89 GLY N . 11080 1 969 . 1 1 90 90 TYR H H 1 9.119 0.02 . 1 . . . . 90 TYR H . 11080 1 970 . 1 1 90 90 TYR HA H 1 5.080 0.02 . 1 . . . . 90 TYR HA . 11080 1 971 . 1 1 90 90 TYR HB2 H 1 2.583 0.02 . 2 . . . . 90 TYR HB2 . 11080 1 972 . 1 1 90 90 TYR HB3 H 1 2.214 0.02 . 2 . . . . 90 TYR HB3 . 11080 1 973 . 1 1 90 90 TYR HD1 H 1 6.706 0.02 . 3 . . . . 90 TYR QD . 11080 1 974 . 1 1 90 90 TYR HD2 H 1 6.706 0.02 . 3 . . . . 90 TYR QD . 11080 1 975 . 1 1 90 90 TYR HE1 H 1 6.875 0.02 . 3 . . . . 90 TYR QE . 11080 1 976 . 1 1 90 90 TYR HE2 H 1 6.875 0.02 . 3 . . . . 90 TYR QE . 11080 1 977 . 1 1 90 90 TYR CA C 13 57.336 0.2 . 1 . . . . 90 TYR CA . 11080 1 978 . 1 1 90 90 TYR CB C 13 41.829 0.2 . 1 . . . . 90 TYR CB . 11080 1 979 . 1 1 90 90 TYR CD1 C 13 132.244 0.2 . 3 . . . . 90 TYR CD1 . 11080 1 980 . 1 1 90 90 TYR CD2 C 13 132.244 0.2 . 3 . . . . 90 TYR CD2 . 11080 1 981 . 1 1 90 90 TYR CE1 C 13 118.136 0.2 . 3 . . . . 90 TYR CE1 . 11080 1 982 . 1 1 90 90 TYR CE2 C 13 118.136 0.2 . 3 . . . . 90 TYR CE2 . 11080 1 983 . 1 1 90 90 TYR N N 15 119.181 0.2 . 1 . . . . 90 TYR N . 11080 1 984 . 1 1 91 91 HIS H H 1 9.879 0.02 . 1 . . . . 91 HIS H . 11080 1 985 . 1 1 91 91 HIS HA H 1 5.557 0.02 . 1 . . . . 91 HIS HA . 11080 1 986 . 1 1 91 91 HIS HB2 H 1 3.214 0.02 . 2 . . . . 91 HIS HB2 . 11080 1 987 . 1 1 91 91 HIS HB3 H 1 3.038 0.02 . 2 . . . . 91 HIS HB3 . 11080 1 988 . 1 1 91 91 HIS HD1 H 1 10.021 0.02 . 1 . . . . 91 HIS HD1 . 11080 1 989 . 1 1 91 91 HIS HD2 H 1 7.242 0.02 . 1 . . . . 91 HIS HD2 . 11080 1 990 . 1 1 91 91 HIS HE1 H 1 6.603 0.02 . 1 . . . . 91 HIS HE1 . 11080 1 991 . 1 1 91 91 HIS CA C 13 54.446 0.2 . 1 . . . . 91 HIS CA . 11080 1 992 . 1 1 91 91 HIS CB C 13 31.297 0.2 . 1 . . . . 91 HIS CB . 11080 1 993 . 1 1 91 91 HIS CD2 C 13 130.824 0.2 . 1 . . . . 91 HIS CD2 . 11080 1 994 . 1 1 91 91 HIS CE1 C 13 129.158 0.2 . 1 . . . . 91 HIS CE1 . 11080 1 995 . 1 1 91 91 HIS N N 15 120.399 0.2 . 1 . . . . 91 HIS N . 11080 1 996 . 1 1 92 92 VAL H H 1 9.102 0.02 . 1 . . . . 92 VAL H . 11080 1 997 . 1 1 92 92 VAL HA H 1 3.987 0.02 . 1 . . . . 92 VAL HA . 11080 1 998 . 1 1 92 92 VAL HB H 1 1.855 0.02 . 1 . . . . 92 VAL HB . 11080 1 999 . 1 1 92 92 VAL HG11 H 1 0.747 0.02 . 1 . . . . 92 VAL QG1 . 11080 1 1000 . 1 1 92 92 VAL HG12 H 1 0.747 0.02 . 1 . . . . 92 VAL QG1 . 11080 1 1001 . 1 1 92 92 VAL HG13 H 1 0.747 0.02 . 1 . . . . 92 VAL QG1 . 11080 1 1002 . 1 1 92 92 VAL HG21 H 1 0.810 0.02 . 1 . . . . 92 VAL QG2 . 11080 1 1003 . 1 1 92 92 VAL HG22 H 1 0.810 0.02 . 1 . . . . 92 VAL QG2 . 11080 1 1004 . 1 1 92 92 VAL HG23 H 1 0.810 0.02 . 1 . . . . 92 VAL QG2 . 11080 1 1005 . 1 1 92 92 VAL CA C 13 63.928 0.2 . 1 . . . . 92 VAL CA . 11080 1 1006 . 1 1 92 92 VAL CB C 13 33.222 0.2 . 1 . . . . 92 VAL CB . 11080 1 1007 . 1 1 92 92 VAL CG1 C 13 20.770 0.2 . 2 . . . . 92 VAL CG1 . 11080 1 1008 . 1 1 92 92 VAL CG2 C 13 21.531 0.2 . 2 . . . . 92 VAL CG2 . 11080 1 1009 . 1 1 92 92 VAL N N 15 122.606 0.2 . 1 . . . . 92 VAL N . 11080 1 1010 . 1 1 93 93 ILE H H 1 8.623 0.02 . 1 . . . . 93 ILE H . 11080 1 1011 . 1 1 93 93 ILE HA H 1 4.779 0.02 . 1 . . . . 93 ILE HA . 11080 1 1012 . 1 1 93 93 ILE HB H 1 1.362 0.02 . 1 . . . . 93 ILE HB . 11080 1 1013 . 1 1 93 93 ILE HD11 H 1 -0.100 0.02 . 1 . . . . 93 ILE QD1 . 11080 1 1014 . 1 1 93 93 ILE HD12 H 1 -0.100 0.02 . 1 . . . . 93 ILE QD1 . 11080 1 1015 . 1 1 93 93 ILE HD13 H 1 -0.100 0.02 . 1 . . . . 93 ILE QD1 . 11080 1 1016 . 1 1 93 93 ILE HG12 H 1 0.545 0.02 . 2 . . . . 93 ILE HG12 . 11080 1 1017 . 1 1 93 93 ILE HG13 H 1 1.481 0.02 . 2 . . . . 93 ILE HG13 . 11080 1 1018 . 1 1 93 93 ILE HG21 H 1 0.643 0.02 . 1 . . . . 93 ILE QG2 . 11080 1 1019 . 1 1 93 93 ILE HG22 H 1 0.643 0.02 . 1 . . . . 93 ILE QG2 . 11080 1 1020 . 1 1 93 93 ILE HG23 H 1 0.643 0.02 . 1 . . . . 93 ILE QG2 . 11080 1 1021 . 1 1 93 93 ILE CA C 13 60.936 0.2 . 1 . . . . 93 ILE CA . 11080 1 1022 . 1 1 93 93 ILE CB C 13 41.772 0.2 . 1 . . . . 93 ILE CB . 11080 1 1023 . 1 1 93 93 ILE CD1 C 13 13.981 0.2 . 1 . . . . 93 ILE CD1 . 11080 1 1024 . 1 1 93 93 ILE CG1 C 13 27.862 0.2 . 1 . . . . 93 ILE CG1 . 11080 1 1025 . 1 1 93 93 ILE CG2 C 13 17.878 0.2 . 1 . . . . 93 ILE CG2 . 11080 1 1026 . 1 1 93 93 ILE N N 15 128.087 0.2 . 1 . . . . 93 ILE N . 11080 1 1027 . 1 1 94 94 LYS H H 1 8.881 0.02 . 1 . . . . 94 LYS H . 11080 1 1028 . 1 1 94 94 LYS HA H 1 5.311 0.02 . 1 . . . . 94 LYS HA . 11080 1 1029 . 1 1 94 94 LYS HB2 H 1 0.604 0.02 . 2 . . . . 94 LYS HB2 . 11080 1 1030 . 1 1 94 94 LYS HB3 H 1 0.719 0.02 . 2 . . . . 94 LYS HB3 . 11080 1 1031 . 1 1 94 94 LYS HD2 H 1 0.931 0.02 . 2 . . . . 94 LYS HD2 . 11080 1 1032 . 1 1 94 94 LYS HD3 H 1 1.115 0.02 . 2 . . . . 94 LYS HD3 . 11080 1 1033 . 1 1 94 94 LYS HE2 H 1 2.628 0.02 . 2 . . . . 94 LYS HE2 . 11080 1 1034 . 1 1 94 94 LYS HE3 H 1 2.656 0.02 . 2 . . . . 94 LYS HE3 . 11080 1 1035 . 1 1 94 94 LYS HG2 H 1 0.838 0.02 . 2 . . . . 94 LYS HG2 . 11080 1 1036 . 1 1 94 94 LYS HG3 H 1 0.613 0.02 . 2 . . . . 94 LYS HG3 . 11080 1 1037 . 1 1 94 94 LYS CA C 13 54.233 0.2 . 1 . . . . 94 LYS CA . 11080 1 1038 . 1 1 94 94 LYS CB C 13 36.488 0.2 . 1 . . . . 94 LYS CB . 11080 1 1039 . 1 1 94 94 LYS CD C 13 30.125 0.2 . 1 . . . . 94 LYS CD . 11080 1 1040 . 1 1 94 94 LYS CE C 13 42.276 0.2 . 1 . . . . 94 LYS CE . 11080 1 1041 . 1 1 94 94 LYS CG C 13 25.369 0.2 . 1 . . . . 94 LYS CG . 11080 1 1042 . 1 1 94 94 LYS N N 15 125.877 0.2 . 1 . . . . 94 LYS N . 11080 1 1043 . 1 1 95 95 ARG H H 1 7.955 0.02 . 1 . . . . 95 ARG H . 11080 1 1044 . 1 1 95 95 ARG HA H 1 5.023 0.02 . 1 . . . . 95 ARG HA . 11080 1 1045 . 1 1 95 95 ARG HB2 H 1 2.123 0.02 . 2 . . . . 95 ARG HB2 . 11080 1 1046 . 1 1 95 95 ARG HB3 H 1 1.507 0.02 . 2 . . . . 95 ARG HB3 . 11080 1 1047 . 1 1 95 95 ARG HD2 H 1 3.250 0.02 . 2 . . . . 95 ARG HD2 . 11080 1 1048 . 1 1 95 95 ARG HD3 H 1 3.174 0.02 . 2 . . . . 95 ARG HD3 . 11080 1 1049 . 1 1 95 95 ARG HG2 H 1 1.877 0.02 . 2 . . . . 95 ARG HG2 . 11080 1 1050 . 1 1 95 95 ARG HG3 H 1 1.728 0.02 . 2 . . . . 95 ARG HG3 . 11080 1 1051 . 1 1 95 95 ARG CA C 13 56.014 0.2 . 1 . . . . 95 ARG CA . 11080 1 1052 . 1 1 95 95 ARG CB C 13 29.757 0.2 . 1 . . . . 95 ARG CB . 11080 1 1053 . 1 1 95 95 ARG CD C 13 43.592 0.2 . 1 . . . . 95 ARG CD . 11080 1 1054 . 1 1 95 95 ARG CG C 13 28.044 0.2 . 1 . . . . 95 ARG CG . 11080 1 1055 . 1 1 95 95 ARG N N 15 126.274 0.2 . 1 . . . . 95 ARG N . 11080 1 1056 . 1 1 96 96 LEU H H 1 9.017 0.02 . 1 . . . . 96 LEU H . 11080 1 1057 . 1 1 96 96 LEU HA H 1 4.587 0.02 . 1 . . . . 96 LEU HA . 11080 1 1058 . 1 1 96 96 LEU HB2 H 1 1.689 0.02 . 2 . . . . 96 LEU HB2 . 11080 1 1059 . 1 1 96 96 LEU HB3 H 1 1.082 0.02 . 2 . . . . 96 LEU HB3 . 11080 1 1060 . 1 1 96 96 LEU HD11 H 1 0.771 0.02 . 1 . . . . 96 LEU QD1 . 11080 1 1061 . 1 1 96 96 LEU HD12 H 1 0.771 0.02 . 1 . . . . 96 LEU QD1 . 11080 1 1062 . 1 1 96 96 LEU HD13 H 1 0.771 0.02 . 1 . . . . 96 LEU QD1 . 11080 1 1063 . 1 1 96 96 LEU HD21 H 1 0.722 0.02 . 1 . . . . 96 LEU QD2 . 11080 1 1064 . 1 1 96 96 LEU HD22 H 1 0.722 0.02 . 1 . . . . 96 LEU QD2 . 11080 1 1065 . 1 1 96 96 LEU HD23 H 1 0.722 0.02 . 1 . . . . 96 LEU QD2 . 11080 1 1066 . 1 1 96 96 LEU HG H 1 1.472 0.02 . 1 . . . . 96 LEU HG . 11080 1 1067 . 1 1 96 96 LEU CA C 13 54.521 0.2 . 1 . . . . 96 LEU CA . 11080 1 1068 . 1 1 96 96 LEU CB C 13 44.384 0.2 . 1 . . . . 96 LEU CB . 11080 1 1069 . 1 1 96 96 LEU CD1 C 13 24.900 0.2 . 2 . . . . 96 LEU CD1 . 11080 1 1070 . 1 1 96 96 LEU CD2 C 13 23.403 0.2 . 2 . . . . 96 LEU CD2 . 11080 1 1071 . 1 1 96 96 LEU CG C 13 28.318 0.2 . 1 . . . . 96 LEU CG . 11080 1 1072 . 1 1 96 96 LEU N N 15 129.551 0.2 . 1 . . . . 96 LEU N . 11080 1 1073 . 1 1 97 97 GLY H H 1 7.956 0.02 . 1 . . . . 97 GLY H . 11080 1 1074 . 1 1 97 97 GLY HA2 H 1 3.939 0.02 . 2 . . . . 97 GLY HA2 . 11080 1 1075 . 1 1 97 97 GLY HA3 H 1 3.595 0.02 . 2 . . . . 97 GLY HA3 . 11080 1 1076 . 1 1 97 97 GLY CA C 13 47.197 0.2 . 1 . . . . 97 GLY CA . 11080 1 1077 . 1 1 97 97 GLY N N 15 114.322 0.2 . 1 . . . . 97 GLY N . 11080 1 stop_ save_