################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7323 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.015 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _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 1H15N_HSQC 1 $sample_1 isotropic 7323 1 2 CBCA(CO)NH 1 $sample_1 isotropic 7323 1 3 HBHA(CBCACO)NH 1 $sample_1 isotropic 7323 1 4 HCCH-TOCSY 1 $sample_1 isotropic 7323 1 5 HNCACB 1 $sample_1 isotropic 7323 1 6 HN(CA)HA 1 $sample_1 isotropic 7323 1 7 15N_NOESYHSQC 1 $sample_1 isotropic 7323 1 8 13C_NOESYHSQC 1 $sample_1 isotropic 7323 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 2 2 GLU HA H 1 4.351 0.015 . 1 . . . . 2 GLU HA . 7323 1 2 . 1 1 2 2 GLU HB2 H 1 1.977 0.015 . 1 . . . . 2 GLU HB2 . 7323 1 3 . 1 1 2 2 GLU HB3 H 1 1.885 0.015 . 1 . . . . 2 GLU HB3 . 7323 1 4 . 1 1 2 2 GLU HG2 H 1 2.220 0.015 . 2 . . . . 2 GLU QG . 7323 1 5 . 1 1 2 2 GLU HG3 H 1 2.220 0.015 . 2 . . . . 2 GLU QG . 7323 1 6 . 1 1 2 2 GLU CA C 13 56.111 0.3 . 1 . . . . 2 GLU CA . 7323 1 7 . 1 1 2 2 GLU CB C 13 30.473 0.3 . 1 . . . . 2 GLU CB . 7323 1 8 . 1 1 2 2 GLU CG C 13 36.168 0.3 . 1 . . . . 2 GLU CG . 7323 1 9 . 1 1 3 3 LEU H H 1 8.489 0.015 . 1 . . . . 3 LEU HN . 7323 1 10 . 1 1 3 3 LEU HA H 1 4.298 0.015 . 1 . . . . 3 LEU HA . 7323 1 11 . 1 1 3 3 LEU HB2 H 1 1.563 0.015 . 1 . . . . 3 LEU HB2 . 7323 1 12 . 1 1 3 3 LEU HB3 H 1 1.423 0.015 . 1 . . . . 3 LEU HB3 . 7323 1 13 . 1 1 3 3 LEU HG H 1 1.560 0.015 . 1 . . . . 3 LEU HG . 7323 1 14 . 1 1 3 3 LEU HD11 H 1 0.891 0.015 . 2 . . . . 3 LEU QD1 . 7323 1 15 . 1 1 3 3 LEU HD12 H 1 0.891 0.015 . 2 . . . . 3 LEU QD1 . 7323 1 16 . 1 1 3 3 LEU HD13 H 1 0.891 0.015 . 2 . . . . 3 LEU QD1 . 7323 1 17 . 1 1 3 3 LEU HD21 H 1 0.822 0.015 . 2 . . . . 3 LEU QD2 . 7323 1 18 . 1 1 3 3 LEU HD22 H 1 0.822 0.015 . 2 . . . . 3 LEU QD2 . 7323 1 19 . 1 1 3 3 LEU HD23 H 1 0.822 0.015 . 2 . . . . 3 LEU QD2 . 7323 1 20 . 1 1 3 3 LEU CA C 13 54.834 0.3 . 1 . . . . 3 LEU CA . 7323 1 21 . 1 1 3 3 LEU CB C 13 42.153 0.3 . 1 . . . . 3 LEU CB . 7323 1 22 . 1 1 3 3 LEU CG C 13 27.050 0.3 . 1 . . . . 3 LEU CG . 7323 1 23 . 1 1 3 3 LEU CD1 C 13 24.909 0.3 . 1 . . . . 3 LEU CD1 . 7323 1 24 . 1 1 3 3 LEU CD2 C 13 23.490 0.3 . 1 . . . . 3 LEU CD2 . 7323 1 25 . 1 1 3 3 LEU N N 15 125.033 0.3 . 1 . . . . 3 LEU N . 7323 1 26 . 1 1 4 4 LYS H H 1 8.146 0.015 . 1 . . . . 4 LYS HN . 7323 1 27 . 1 1 4 4 LYS HA H 1 4.290 0.015 . 1 . . . . 4 LYS HA . 7323 1 28 . 1 1 4 4 LYS HB2 H 1 1.582 0.015 . 1 . . . . 4 LYS HB2 . 7323 1 29 . 1 1 4 4 LYS HB3 H 1 1.504 0.015 . 1 . . . . 4 LYS HB3 . 7323 1 30 . 1 1 4 4 LYS HG2 H 1 1.044 0.015 . 2 . . . . 4 LYS QG . 7323 1 31 . 1 1 4 4 LYS HG3 H 1 1.044 0.015 . 2 . . . . 4 LYS QG . 7323 1 32 . 1 1 4 4 LYS HD2 H 1 0.826 0.015 . 1 . . . . 4 LYS HD2 . 7323 1 33 . 1 1 4 4 LYS HD3 H 1 0.600 0.015 . 1 . . . . 4 LYS HD3 . 7323 1 34 . 1 1 4 4 LYS HE2 H 1 2.546 0.015 . 1 . . . . 4 LYS HE2 . 7323 1 35 . 1 1 4 4 LYS HE3 H 1 2.473 0.015 . 1 . . . . 4 LYS HE3 . 7323 1 36 . 1 1 4 4 LYS CA C 13 55.330 0.3 . 1 . . . . 4 LYS CA . 7323 1 37 . 1 1 4 4 LYS CB C 13 33.463 0.3 . 1 . . . . 4 LYS CB . 7323 1 38 . 1 1 4 4 LYS CG C 13 25.056 0.3 . 1 . . . . 4 LYS CG . 7323 1 39 . 1 1 4 4 LYS CD C 13 28.616 0.3 . 1 . . . . 4 LYS CD . 7323 1 40 . 1 1 4 4 LYS CE C 13 42.293 0.3 . 1 . . . . 4 LYS CE . 7323 1 41 . 1 1 4 4 LYS N N 15 122.100 0.3 . 1 . . . . 4 LYS N . 7323 1 42 . 1 1 5 5 HIS H H 1 8.815 0.015 . 1 . . . . 5 HIS HN . 7323 1 43 . 1 1 5 5 HIS HA H 1 4.563 0.015 . 1 . . . . 5 HIS HA . 7323 1 44 . 1 1 5 5 HIS HB2 H 1 3.297 0.015 . 1 . . . . 5 HIS HB2 . 7323 1 45 . 1 1 5 5 HIS HB3 H 1 3.208 0.015 . 1 . . . . 5 HIS HB3 . 7323 1 46 . 1 1 5 5 HIS HD2 H 1 7.230 0.015 . 1 . . . . 5 HIS HD2 . 7323 1 47 . 1 1 5 5 HIS HE1 H 1 8.266 0.015 . 1 . . . . 5 HIS HE1 . 7323 1 48 . 1 1 5 5 HIS CA C 13 58.112 0.3 . 1 . . . . 5 HIS CA . 7323 1 49 . 1 1 5 5 HIS CB C 13 30.473 0.3 . 1 . . . . 5 HIS CB . 7323 1 50 . 1 1 5 5 HIS CD2 C 13 120.114 0.3 . 1 . . . . 5 HIS CD2 . 7323 1 51 . 1 1 5 5 HIS CE1 C 13 137.228 0.3 . 1 . . . . 5 HIS CE1 . 7323 1 52 . 1 1 5 5 HIS N N 15 120.682 0.3 . 1 . . . . 5 HIS N . 7323 1 53 . 1 1 6 6 SER H H 1 8.612 0.015 . 1 . . . . 6 SER HN . 7323 1 54 . 1 1 6 6 SER HA H 1 4.835 0.015 . 1 . . . . 6 SER HA . 7323 1 55 . 1 1 6 6 SER HB2 H 1 3.875 0.015 . 1 . . . . 6 SER HB2 . 7323 1 56 . 1 1 6 6 SER HB3 H 1 3.700 0.015 . 1 . . . . 6 SER HB3 . 7323 1 57 . 1 1 6 6 SER CA C 13 56.410 0.3 . 1 . . . . 6 SER CA . 7323 1 58 . 1 1 6 6 SER CB C 13 65.957 0.3 . 1 . . . . 6 SER CB . 7323 1 59 . 1 1 6 6 SER N N 15 114.108 0.3 . 1 . . . . 6 SER N . 7323 1 60 . 1 1 7 7 ILE H H 1 9.400 0.015 . 1 . . . . 7 ILE HN . 7323 1 61 . 1 1 7 7 ILE HA H 1 3.957 0.015 . 1 . . . . 7 ILE HA . 7323 1 62 . 1 1 7 7 ILE HB H 1 1.522 0.015 . 1 . . . . 7 ILE HB . 7323 1 63 . 1 1 7 7 ILE HG12 H 1 0.885 0.015 . 1 . . . . 7 ILE HG12 . 7323 1 64 . 1 1 7 7 ILE HG13 H 1 0.794 0.015 . 1 . . . . 7 ILE HG13 . 7323 1 65 . 1 1 7 7 ILE HG21 H 1 0.429 0.015 . 1 . . . . 7 ILE QG2 . 7323 1 66 . 1 1 7 7 ILE HG22 H 1 0.429 0.015 . 1 . . . . 7 ILE QG2 . 7323 1 67 . 1 1 7 7 ILE HG23 H 1 0.429 0.015 . 1 . . . . 7 ILE QG2 . 7323 1 68 . 1 1 7 7 ILE HD11 H 1 -0.192 0.015 . 1 . . . . 7 ILE 1 . 7323 1 69 . 1 1 7 7 ILE HD12 H 1 -0.192 0.015 . 1 . . . . 7 ILE 1 . 7323 1 70 . 1 1 7 7 ILE HD13 H 1 -0.192 0.015 . 1 . . . . 7 ILE 1 . 7323 1 71 . 1 1 7 7 ILE CA C 13 65.099 0.3 . 1 . . . . 7 ILE CA . 7323 1 72 . 1 1 7 7 ILE CB C 13 37.150 0.3 . 1 . . . . 7 ILE CB . 7323 1 73 . 1 1 7 7 ILE CG1 C 13 30.331 0.3 . 1 . . . . 7 ILE CG1 . 7323 1 74 . 1 1 7 7 ILE CG2 C 13 15.224 0.3 . 1 . . . . 7 ILE CG2 . 7323 1 75 . 1 1 7 7 ILE CD1 C 13 13.511 0.3 . 1 . . . . 7 ILE CD1 . 7323 1 76 . 1 1 7 7 ILE N N 15 126.254 0.3 . 1 . . . . 7 ILE N . 7323 1 77 . 1 1 8 8 SER H H 1 7.535 0.015 . 1 . . . . 8 SER HN . 7323 1 78 . 1 1 8 8 SER HA H 1 4.740 0.015 . 1 . . . . 8 SER HA . 7323 1 79 . 1 1 8 8 SER HB2 H 1 3.941 0.015 . 1 . . . . 8 SER HB2 . 7323 1 80 . 1 1 8 8 SER HB3 H 1 3.814 0.015 . 1 . . . . 8 SER HB3 . 7323 1 81 . 1 1 8 8 SER CA C 13 59.291 0.3 . 1 . . . . 8 SER CA . 7323 1 82 . 1 1 8 8 SER CB C 13 63.160 0.3 . 1 . . . . 8 SER CB . 7323 1 83 . 1 1 8 8 SER N N 15 113.151 0.3 . 1 . . . . 8 SER N . 7323 1 84 . 1 1 9 9 ASP H H 1 7.948 0.015 . 1 . . . . 9 ASP HN . 7323 1 85 . 1 1 9 9 ASP HA H 1 4.778 0.015 . 1 . . . . 9 ASP HA . 7323 1 86 . 1 1 9 9 ASP HB2 H 1 2.841 0.015 . 2 . . . . 9 ASP QB . 7323 1 87 . 1 1 9 9 ASP HB3 H 1 2.841 0.015 . 2 . . . . 9 ASP QB . 7323 1 88 . 1 1 9 9 ASP CA C 13 55.258 0.3 . 1 . . . . 9 ASP CA . 7323 1 89 . 1 1 9 9 ASP CB C 13 42.321 0.3 . 1 . . . . 9 ASP CB . 7323 1 90 . 1 1 9 9 ASP N N 15 118.127 0.3 . 1 . . . . 9 ASP N . 7323 1 91 . 1 1 10 10 TYR H H 1 8.352 0.015 . 1 . . . . 10 TYR HN . 7323 1 92 . 1 1 10 10 TYR HA H 1 4.823 0.015 . 1 . . . . 10 TYR HA . 7323 1 93 . 1 1 10 10 TYR HB2 H 1 3.588 0.015 . 1 . . . . 10 TYR HB2 . 7323 1 94 . 1 1 10 10 TYR HB3 H 1 3.412 0.015 . 1 . . . . 10 TYR HB3 . 7323 1 95 . 1 1 10 10 TYR HD1 H 1 7.252 0.015 . 3 . . . . 10 TYR QD . 7323 1 96 . 1 1 10 10 TYR HD2 H 1 7.252 0.015 . 3 . . . . 10 TYR QD . 7323 1 97 . 1 1 10 10 TYR HE1 H 1 6.570 0.015 . 3 . . . . 10 TYR QE . 7323 1 98 . 1 1 10 10 TYR HE2 H 1 6.570 0.015 . 3 . . . . 10 TYR QE . 7323 1 99 . 1 1 10 10 TYR CA C 13 57.961 0.3 . 1 . . . . 10 TYR CA . 7323 1 100 . 1 1 10 10 TYR CB C 13 40.159 0.3 . 1 . . . . 10 TYR CB . 7323 1 101 . 1 1 10 10 TYR CD1 C 13 132.983 0.3 . 3 . . . . 10 TYR CD1 . 7323 1 102 . 1 1 10 10 TYR CD2 C 13 132.983 0.3 . 3 . . . . 10 TYR CD2 . 7323 1 103 . 1 1 10 10 TYR CE1 C 13 118.435 0.3 . 3 . . . . 10 TYR CE1 . 7323 1 104 . 1 1 10 10 TYR CE2 C 13 118.435 0.3 . 3 . . . . 10 TYR CE2 . 7323 1 105 . 1 1 10 10 TYR N N 15 121.210 0.3 . 1 . . . . 10 TYR N . 7323 1 106 . 1 1 11 11 THR H H 1 8.902 0.015 . 1 . . . . 11 THR HN . 7323 1 107 . 1 1 11 11 THR HA H 1 5.011 0.015 . 1 . . . . 11 THR HA . 7323 1 108 . 1 1 11 11 THR HB H 1 4.675 0.015 . 1 . . . . 11 THR HB . 7323 1 109 . 1 1 11 11 THR HG21 H 1 1.214 0.015 . 1 . . . . 11 THR QG2 . 7323 1 110 . 1 1 11 11 THR HG22 H 1 1.214 0.015 . 1 . . . . 11 THR QG2 . 7323 1 111 . 1 1 11 11 THR HG23 H 1 1.214 0.015 . 1 . . . . 11 THR QG2 . 7323 1 112 . 1 1 11 11 THR CA C 13 60.960 0.3 . 1 . . . . 11 THR CA . 7323 1 113 . 1 1 11 11 THR CB C 13 70.669 0.3 . 1 . . . . 11 THR CB . 7323 1 114 . 1 1 11 11 THR CG2 C 13 21.909 0.3 . 1 . . . . 11 THR CG2 . 7323 1 115 . 1 1 11 11 THR N N 15 112.523 0.3 . 1 . . . . 11 THR N . 7323 1 116 . 1 1 12 12 GLU H H 1 9.286 0.015 . 1 . . . . 12 GLU HN . 7323 1 117 . 1 1 12 12 GLU HA H 1 2.377 0.015 . 1 . . . . 12 GLU HA . 7323 1 118 . 1 1 12 12 GLU HB2 H 1 1.815 0.015 . 1 . . . . 12 GLU HB2 . 7323 1 119 . 1 1 12 12 GLU HB3 H 1 1.765 0.015 . 1 . . . . 12 GLU HB3 . 7323 1 120 . 1 1 12 12 GLU HG2 H 1 1.991 0.015 . 1 . . . . 12 GLU HG2 . 7323 1 121 . 1 1 12 12 GLU HG3 H 1 1.711 0.015 . 1 . . . . 12 GLU HG3 . 7323 1 122 . 1 1 12 12 GLU CA C 13 60.385 0.3 . 1 . . . . 12 GLU CA . 7323 1 123 . 1 1 12 12 GLU CB C 13 29.124 0.3 . 1 . . . . 12 GLU CB . 7323 1 124 . 1 1 12 12 GLU CG C 13 35.601 0.3 . 1 . . . . 12 GLU CG . 7323 1 125 . 1 1 12 12 GLU N N 15 124.494 0.3 . 1 . . . . 12 GLU N . 7323 1 126 . 1 1 13 13 ALA H H 1 8.348 0.015 . 1 . . . . 13 ALA HN . 7323 1 127 . 1 1 13 13 ALA HA H 1 4.095 0.015 . 1 . . . . 13 ALA HA . 7323 1 128 . 1 1 13 13 ALA HB1 H 1 1.410 0.015 . 1 . . . . 13 ALA QB . 7323 1 129 . 1 1 13 13 ALA HB2 H 1 1.410 0.015 . 1 . . . . 13 ALA QB . 7323 1 130 . 1 1 13 13 ALA HB3 H 1 1.410 0.015 . 1 . . . . 13 ALA QB . 7323 1 131 . 1 1 13 13 ALA CA C 13 55.117 0.3 . 1 . . . . 13 ALA CA . 7323 1 132 . 1 1 13 13 ALA CB C 13 18.360 0.3 . 1 . . . . 13 ALA CB . 7323 1 133 . 1 1 13 13 ALA N N 15 118.915 0.3 . 1 . . . . 13 ALA N . 7323 1 134 . 1 1 14 14 GLU H H 1 7.988 0.015 . 1 . . . . 14 GLU HN . 7323 1 135 . 1 1 14 14 GLU HA H 1 4.111 0.015 . 1 . . . . 14 GLU HA . 7323 1 136 . 1 1 14 14 GLU HB2 H 1 2.636 0.015 . 1 . . . . 14 GLU HB2 . 7323 1 137 . 1 1 14 14 GLU HB3 H 1 2.238 0.015 . 1 . . . . 14 GLU HB3 . 7323 1 138 . 1 1 14 14 GLU HG2 H 1 2.502 0.015 . 1 . . . . 14 GLU HG2 . 7323 1 139 . 1 1 14 14 GLU HG3 H 1 2.345 0.015 . 1 . . . . 14 GLU HG3 . 7323 1 140 . 1 1 14 14 GLU CA C 13 58.741 0.3 . 1 . . . . 14 GLU CA . 7323 1 141 . 1 1 14 14 GLU CB C 13 31.323 0.3 . 1 . . . . 14 GLU CB . 7323 1 142 . 1 1 14 14 GLU CG C 13 37.017 0.3 . 1 . . . . 14 GLU CG . 7323 1 143 . 1 1 14 14 GLU N N 15 118.961 0.3 . 1 . . . . 14 GLU N . 7323 1 144 . 1 1 15 15 PHE H H 1 8.984 0.015 . 1 . . . . 15 PHE HN . 7323 1 145 . 1 1 15 15 PHE HA H 1 4.144 0.015 . 1 . . . . 15 PHE HA . 7323 1 146 . 1 1 15 15 PHE HB2 H 1 2.944 0.015 . 1 . . . . 15 PHE HB2 . 7323 1 147 . 1 1 15 15 PHE HB3 H 1 2.724 0.015 . 1 . . . . 15 PHE HB3 . 7323 1 148 . 1 1 15 15 PHE HD1 H 1 6.708 0.015 . 3 . . . . 15 PHE QD . 7323 1 149 . 1 1 15 15 PHE HD2 H 1 6.708 0.015 . 3 . . . . 15 PHE QD . 7323 1 150 . 1 1 15 15 PHE HE1 H 1 6.970 0.015 . 3 . . . . 15 PHE QE . 7323 1 151 . 1 1 15 15 PHE HE2 H 1 6.970 0.015 . 3 . . . . 15 PHE QE . 7323 1 152 . 1 1 15 15 PHE HZ H 1 6.920 0.015 . 1 . . . . 15 PHE HZ . 7323 1 153 . 1 1 15 15 PHE CA C 13 62.241 0.3 . 1 . . . . 15 PHE CA . 7323 1 154 . 1 1 15 15 PHE CB C 13 40.301 0.3 . 1 . . . . 15 PHE CB . 7323 1 155 . 1 1 15 15 PHE CD1 C 13 132.160 0.3 . 3 . . . . 15 PHE CD1 . 7323 1 156 . 1 1 15 15 PHE CD2 C 13 132.160 0.3 . 3 . . . . 15 PHE CD2 . 7323 1 157 . 1 1 15 15 PHE CE1 C 13 130.558 0.3 . 3 . . . . 15 PHE CE1 . 7323 1 158 . 1 1 15 15 PHE CE2 C 13 130.558 0.3 . 3 . . . . 15 PHE CE2 . 7323 1 159 . 1 1 15 15 PHE CZ C 13 128.630 0.3 . 1 . . . . 15 PHE CZ . 7323 1 160 . 1 1 15 15 PHE N N 15 123.683 0.3 . 1 . . . . 15 PHE N . 7323 1 161 . 1 1 16 16 LEU H H 1 8.960 0.015 . 1 . . . . 16 LEU HN . 7323 1 162 . 1 1 16 16 LEU HA H 1 3.944 0.015 . 1 . . . . 16 LEU HA . 7323 1 163 . 1 1 16 16 LEU HB2 H 1 2.115 0.015 . 1 . . . . 16 LEU HB2 . 7323 1 164 . 1 1 16 16 LEU HB3 H 1 1.630 0.015 . 1 . . . . 16 LEU HB3 . 7323 1 165 . 1 1 16 16 LEU HG H 1 1.449 0.015 . 1 . . . . 16 LEU HG . 7323 1 166 . 1 1 16 16 LEU HD11 H 1 1.010 0.015 . 2 . . . . 16 LEU QD1 . 7323 1 167 . 1 1 16 16 LEU HD12 H 1 1.010 0.015 . 2 . . . . 16 LEU QD1 . 7323 1 168 . 1 1 16 16 LEU HD13 H 1 1.010 0.015 . 2 . . . . 16 LEU QD1 . 7323 1 169 . 1 1 16 16 LEU HD21 H 1 0.839 0.015 . 2 . . . . 16 LEU QD2 . 7323 1 170 . 1 1 16 16 LEU HD22 H 1 0.839 0.015 . 2 . . . . 16 LEU QD2 . 7323 1 171 . 1 1 16 16 LEU HD23 H 1 0.839 0.015 . 2 . . . . 16 LEU QD2 . 7323 1 172 . 1 1 16 16 LEU CA C 13 58.642 0.3 . 1 . . . . 16 LEU CA . 7323 1 173 . 1 1 16 16 LEU CB C 13 40.865 0.3 . 1 . . . . 16 LEU CB . 7323 1 174 . 1 1 16 16 LEU CG C 13 27.479 0.3 . 1 . . . . 16 LEU CG . 7323 1 175 . 1 1 16 16 LEU CD1 C 13 25.627 0.3 . 1 . . . . 16 LEU CD1 . 7323 1 176 . 1 1 16 16 LEU CD2 C 13 23.914 0.3 . 1 . . . . 16 LEU CD2 . 7323 1 177 . 1 1 16 16 LEU N N 15 120.732 0.3 . 1 . . . . 16 LEU N . 7323 1 178 . 1 1 17 17 GLU H H 1 7.670 0.015 . 1 . . . . 17 GLU HN . 7323 1 179 . 1 1 17 17 GLU HA H 1 3.923 0.015 . 1 . . . . 17 GLU HA . 7323 1 180 . 1 1 17 17 GLU HB2 H 1 2.174 0.015 . 2 . . . . 17 GLU QB . 7323 1 181 . 1 1 17 17 GLU HB3 H 1 2.174 0.015 . 2 . . . . 17 GLU QB . 7323 1 182 . 1 1 17 17 GLU HG2 H 1 2.405 0.015 . 2 . . . . 17 GLU QG . 7323 1 183 . 1 1 17 17 GLU HG3 H 1 2.405 0.015 . 2 . . . . 17 GLU QG . 7323 1 184 . 1 1 17 17 GLU CA C 13 59.462 0.3 . 1 . . . . 17 GLU CA . 7323 1 185 . 1 1 17 17 GLU CB C 13 29.105 0.3 . 1 . . . . 17 GLU CB . 7323 1 186 . 1 1 17 17 GLU CG C 13 35.938 0.3 . 1 . . . . 17 GLU CG . 7323 1 187 . 1 1 17 17 GLU N N 15 117.377 0.3 . 1 . . . . 17 GLU N . 7323 1 188 . 1 1 18 18 PHE H H 1 7.538 0.015 . 1 . . . . 18 PHE HN . 7323 1 189 . 1 1 18 18 PHE HA H 1 4.365 0.015 . 1 . . . . 18 PHE HA . 7323 1 190 . 1 1 18 18 PHE HB2 H 1 3.179 0.015 . 2 . . . . 18 PHE QB . 7323 1 191 . 1 1 18 18 PHE HB3 H 1 3.179 0.015 . 2 . . . . 18 PHE QB . 7323 1 192 . 1 1 18 18 PHE HD1 H 1 6.957 0.015 . 3 . . . . 18 PHE QD . 7323 1 193 . 1 1 18 18 PHE HD2 H 1 6.957 0.015 . 3 . . . . 18 PHE QD . 7323 1 194 . 1 1 18 18 PHE HE1 H 1 7.165 0.015 . 3 . . . . 18 PHE QE . 7323 1 195 . 1 1 18 18 PHE HE2 H 1 7.165 0.015 . 3 . . . . 18 PHE QE . 7323 1 196 . 1 1 18 18 PHE HZ H 1 6.936 0.015 . 1 . . . . 18 PHE HZ . 7323 1 197 . 1 1 18 18 PHE CA C 13 60.349 0.3 . 1 . . . . 18 PHE CA . 7323 1 198 . 1 1 18 18 PHE CB C 13 38.667 0.3 . 1 . . . . 18 PHE CB . 7323 1 199 . 1 1 18 18 PHE CD1 C 13 131.400 0.3 . 3 . . . . 18 PHE CD1 . 7323 1 200 . 1 1 18 18 PHE CD2 C 13 131.400 0.3 . 3 . . . . 18 PHE CD2 . 7323 1 201 . 1 1 18 18 PHE CE1 C 13 131.300 0.3 . 3 . . . . 18 PHE CE1 . 7323 1 202 . 1 1 18 18 PHE CE2 C 13 131.300 0.3 . 3 . . . . 18 PHE CE2 . 7323 1 203 . 1 1 18 18 PHE CZ C 13 129.630 0.3 . 1 . . . . 18 PHE CZ . 7323 1 204 . 1 1 18 18 PHE N N 15 122.175 0.3 . 1 . . . . 18 PHE N . 7323 1 205 . 1 1 19 19 VAL H H 1 8.237 0.015 . 1 . . . . 19 VAL HN . 7323 1 206 . 1 1 19 19 VAL HA H 1 3.000 0.015 . 1 . . . . 19 VAL HA . 7323 1 207 . 1 1 19 19 VAL HB H 1 1.940 0.015 . 1 . . . . 19 VAL HB . 7323 1 208 . 1 1 19 19 VAL HG11 H 1 0.682 0.015 . 2 . . . . 19 VAL QG1 . 7323 1 209 . 1 1 19 19 VAL HG12 H 1 0.682 0.015 . 2 . . . . 19 VAL QG1 . 7323 1 210 . 1 1 19 19 VAL HG13 H 1 0.682 0.015 . 2 . . . . 19 VAL QG1 . 7323 1 211 . 1 1 19 19 VAL HG21 H 1 0.786 0.015 . 2 . . . . 19 VAL QG2 . 7323 1 212 . 1 1 19 19 VAL HG22 H 1 0.786 0.015 . 2 . . . . 19 VAL QG2 . 7323 1 213 . 1 1 19 19 VAL HG23 H 1 0.786 0.015 . 2 . . . . 19 VAL QG2 . 7323 1 214 . 1 1 19 19 VAL CA C 13 66.786 0.3 . 1 . . . . 19 VAL CA . 7323 1 215 . 1 1 19 19 VAL CB C 13 31.577 0.3 . 1 . . . . 19 VAL CB . 7323 1 216 . 1 1 19 19 VAL CG1 C 13 25.078 0.3 . 1 . . . . 19 VAL CG1 . 7323 1 217 . 1 1 19 19 VAL CG2 C 13 23.204 0.3 . 1 . . . . 19 VAL CG2 . 7323 1 218 . 1 1 19 19 VAL N N 15 119.437 0.3 . 1 . . . . 19 VAL N . 7323 1 219 . 1 1 20 20 LYS H H 1 8.779 0.015 . 1 . . . . 20 LYS HN . 7323 1 220 . 1 1 20 20 LYS HA H 1 3.615 0.015 . 1 . . . . 20 LYS HA . 7323 1 221 . 1 1 20 20 LYS HB2 H 1 1.885 0.015 . 1 . . . . 20 LYS HB2 . 7323 1 222 . 1 1 20 20 LYS HB3 H 1 1.766 0.015 . 1 . . . . 20 LYS HB3 . 7323 1 223 . 1 1 20 20 LYS HG2 H 1 1.597 0.015 . 1 . . . . 20 LYS HG2 . 7323 1 224 . 1 1 20 20 LYS HG3 H 1 1.283 0.015 . 1 . . . . 20 LYS HG3 . 7323 1 225 . 1 1 20 20 LYS HD2 H 1 1.605 0.015 . 2 . . . . 20 LYS QD . 7323 1 226 . 1 1 20 20 LYS HD3 H 1 1.605 0.015 . 2 . . . . 20 LYS QD . 7323 1 227 . 1 1 20 20 LYS HE2 H 1 2.906 0.015 . 1 . . . . 20 LYS HE2 . 7323 1 228 . 1 1 20 20 LYS HE3 H 1 2.705 0.015 . 1 . . . . 20 LYS HE3 . 7323 1 229 . 1 1 20 20 LYS CA C 13 60.796 0.3 . 1 . . . . 20 LYS CA . 7323 1 230 . 1 1 20 20 LYS CB C 13 32.585 0.3 . 1 . . . . 20 LYS CB . 7323 1 231 . 1 1 20 20 LYS CG C 13 26.907 0.3 . 1 . . . . 20 LYS CG . 7323 1 232 . 1 1 20 20 LYS CD C 13 30.043 0.3 . 1 . . . . 20 LYS CD . 7323 1 233 . 1 1 20 20 LYS CE C 13 42.009 0.3 . 1 . . . . 20 LYS CE . 7323 1 234 . 1 1 20 20 LYS N N 15 119.905 0.3 . 1 . . . . 20 LYS N . 7323 1 235 . 1 1 21 21 LYS H H 1 7.555 0.015 . 1 . . . . 21 LYS HN . 7323 1 236 . 1 1 21 21 LYS HA H 1 3.842 0.015 . 1 . . . . 21 LYS HA . 7323 1 237 . 1 1 21 21 LYS HB2 H 1 1.923 0.015 . 2 . . . . 21 LYS QB . 7323 1 238 . 1 1 21 21 LYS HB3 H 1 1.923 0.015 . 2 . . . . 21 LYS QB . 7323 1 239 . 1 1 21 21 LYS HG2 H 1 1.300 0.015 . 2 . . . . 21 LYS QG . 7323 1 240 . 1 1 21 21 LYS HG3 H 1 1.300 0.015 . 2 . . . . 21 LYS QG . 7323 1 241 . 1 1 21 21 LYS HD2 H 1 1.692 0.015 . 2 . . . . 21 LYS QD . 7323 1 242 . 1 1 21 21 LYS HD3 H 1 1.692 0.015 . 2 . . . . 21 LYS QD . 7323 1 243 . 1 1 21 21 LYS HE2 H 1 2.994 0.015 . 2 . . . . 21 LYS QE . 7323 1 244 . 1 1 21 21 LYS HE3 H 1 2.994 0.015 . 2 . . . . 21 LYS QE . 7323 1 245 . 1 1 21 21 LYS CA C 13 59.534 0.3 . 1 . . . . 21 LYS CA . 7323 1 246 . 1 1 21 21 LYS CB C 13 32.178 0.3 . 1 . . . . 21 LYS CB . 7323 1 247 . 1 1 21 21 LYS CG C 13 25.197 0.3 . 1 . . . . 21 LYS CG . 7323 1 248 . 1 1 21 21 LYS CD C 13 29.614 0.3 . 1 . . . . 21 LYS CD . 7323 1 249 . 1 1 21 21 LYS CE C 13 42.153 0.3 . 1 . . . . 21 LYS CE . 7323 1 250 . 1 1 21 21 LYS N N 15 118.579 0.3 . 1 . . . . 21 LYS N . 7323 1 251 . 1 1 22 22 ILE H H 1 7.388 0.015 . 1 . . . . 22 ILE HN . 7323 1 252 . 1 1 22 22 ILE HA H 1 3.532 0.015 . 1 . . . . 22 ILE HA . 7323 1 253 . 1 1 22 22 ILE HB H 1 1.656 0.015 . 1 . . . . 22 ILE HB . 7323 1 254 . 1 1 22 22 ILE HG12 H 1 1.271 0.015 . 1 . . . . 22 ILE HG12 . 7323 1 255 . 1 1 22 22 ILE HG13 H 1 0.579 0.015 . 1 . . . . 22 ILE HG13 . 7323 1 256 . 1 1 22 22 ILE HG21 H 1 0.525 0.015 . 1 . . . . 22 ILE QG2 . 7323 1 257 . 1 1 22 22 ILE HG22 H 1 0.525 0.015 . 1 . . . . 22 ILE QG2 . 7323 1 258 . 1 1 22 22 ILE HG23 H 1 0.525 0.015 . 1 . . . . 22 ILE QG2 . 7323 1 259 . 1 1 22 22 ILE HD11 H 1 0.144 0.015 . 1 . . . . 22 ILE QD1 . 7323 1 260 . 1 1 22 22 ILE HD12 H 1 0.144 0.015 . 1 . . . . 22 ILE QD1 . 7323 1 261 . 1 1 22 22 ILE HD13 H 1 0.144 0.015 . 1 . . . . 22 ILE QD1 . 7323 1 262 . 1 1 22 22 ILE CA C 13 64.804 0.3 . 1 . . . . 22 ILE CA . 7323 1 263 . 1 1 22 22 ILE CB C 13 38.022 0.3 . 1 . . . . 22 ILE CB . 7323 1 264 . 1 1 22 22 ILE CG1 C 13 28.469 0.3 . 1 . . . . 22 ILE CG1 . 7323 1 265 . 1 1 22 22 ILE CG2 C 13 17.642 0.3 . 1 . . . . 22 ILE CG2 . 7323 1 266 . 1 1 22 22 ILE CD1 C 13 14.218 0.3 . 1 . . . . 22 ILE CD1 . 7323 1 267 . 1 1 22 22 ILE N N 15 118.523 0.3 . 1 . . . . 22 ILE N . 7323 1 268 . 1 1 23 23 CYS H H 1 7.946 0.015 . 1 . . . . 23 CYS HN . 7323 1 269 . 1 1 23 23 CYS HA H 1 3.943 0.015 . 1 . . . . 23 CYS HA . 7323 1 270 . 1 1 23 23 CYS HB2 H 1 2.889 0.015 . 1 . . . . 23 CYS HB2 . 7323 1 271 . 1 1 23 23 CYS HB3 H 1 2.623 0.015 . 1 . . . . 23 CYS HB3 . 7323 1 272 . 1 1 23 23 CYS CA C 13 62.416 0.3 . 1 . . . . 23 CYS CA . 7323 1 273 . 1 1 23 23 CYS CB C 13 27.115 0.3 . 1 . . . . 23 CYS CB . 7323 1 274 . 1 1 23 23 CYS N N 15 117.473 0.3 . 1 . . . . 23 CYS N . 7323 1 275 . 1 1 24 24 ARG H H 1 7.775 0.015 . 1 . . . . 24 ARG HN . 7323 1 276 . 1 1 24 24 ARG HA H 1 4.177 0.015 . 1 . . . . 24 ARG HA . 7323 1 277 . 1 1 24 24 ARG HB2 H 1 1.812 0.015 . 2 . . . . 24 ARG QB . 7323 1 278 . 1 1 24 24 ARG HB3 H 1 1.812 0.015 . 2 . . . . 24 ARG QB . 7323 1 279 . 1 1 24 24 ARG HG2 H 1 1.721 0.015 . 1 . . . . 24 ARG HG2 . 7323 1 280 . 1 1 24 24 ARG HG3 H 1 1.563 0.015 . 1 . . . . 24 ARG HG3 . 7323 1 281 . 1 1 24 24 ARG HD2 H 1 3.189 0.015 . 1 . . . . 24 ARG HD2 . 7323 1 282 . 1 1 24 24 ARG HD3 H 1 3.112 0.015 . 1 . . . . 24 ARG HD3 . 7323 1 283 . 1 1 24 24 ARG CA C 13 57.063 0.3 . 1 . . . . 24 ARG CA . 7323 1 284 . 1 1 24 24 ARG CB C 13 30.596 0.3 . 1 . . . . 24 ARG CB . 7323 1 285 . 1 1 24 24 ARG CG C 13 27.620 0.3 . 1 . . . . 24 ARG CG . 7323 1 286 . 1 1 24 24 ARG CD C 13 43.577 0.3 . 1 . . . . 24 ARG CD . 7323 1 287 . 1 1 24 24 ARG N N 15 119.016 0.3 . 1 . . . . 24 ARG N . 7323 1 288 . 1 1 25 25 ALA H H 1 7.723 0.015 . 1 . . . . 25 ALA HN . 7323 1 289 . 1 1 25 25 ALA HA H 1 4.170 0.015 . 1 . . . . 25 ALA HA . 7323 1 290 . 1 1 25 25 ALA HB1 H 1 1.365 0.015 . 1 . . . . 25 ALA QB . 7323 1 291 . 1 1 25 25 ALA HB2 H 1 1.365 0.015 . 1 . . . . 25 ALA QB . 7323 1 292 . 1 1 25 25 ALA HB3 H 1 1.365 0.015 . 1 . . . . 25 ALA QB . 7323 1 293 . 1 1 25 25 ALA CA C 13 53.123 0.3 . 1 . . . . 25 ALA CA . 7323 1 294 . 1 1 25 25 ALA CB C 13 18.075 0.3 . 1 . . . . 25 ALA CB . 7323 1 295 . 1 1 25 25 ALA N N 15 122.771 0.3 . 1 . . . . 25 ALA N . 7323 1 296 . 1 1 26 26 GLU H H 1 8.450 0.015 . 1 . . . . 26 GLU HN . 7323 1 297 . 1 1 26 26 GLU HA H 1 4.353 0.015 . 1 . . . . 26 GLU HA . 7323 1 298 . 1 1 26 26 GLU HB2 H 1 2.033 0.015 . 2 . . . . 26 GLU QB . 7323 1 299 . 1 1 26 26 GLU HB3 H 1 2.033 0.015 . 2 . . . . 26 GLU QB . 7323 1 300 . 1 1 26 26 GLU HG2 H 1 2.222 0.015 . 2 . . . . 26 GLU QG . 7323 1 301 . 1 1 26 26 GLU HG3 H 1 2.222 0.015 . 2 . . . . 26 GLU QG . 7323 1 302 . 1 1 26 26 GLU CA C 13 56.399 0.3 . 1 . . . . 26 GLU CA . 7323 1 303 . 1 1 26 26 GLU CB C 13 30.452 0.3 . 1 . . . . 26 GLU CB . 7323 1 304 . 1 1 26 26 GLU CG C 13 36.125 0.3 . 1 . . . . 26 GLU CG . 7323 1 305 . 1 1 26 26 GLU N N 15 118.768 0.3 . 1 . . . . 26 GLU N . 7323 1 306 . 1 1 27 27 GLY H H 1 8.782 0.015 . 1 . . . . 27 GLY HN . 7323 1 307 . 1 1 27 27 GLY HA2 H 1 3.862 0.015 . 2 . . . . 27 GLY QA . 7323 1 308 . 1 1 27 27 GLY HA3 H 1 3.862 0.015 . 2 . . . . 27 GLY QA . 7323 1 309 . 1 1 27 27 GLY CA C 13 45.526 0.3 . 1 . . . . 27 GLY CA . 7323 1 310 . 1 1 27 27 GLY N N 15 111.249 0.3 . 1 . . . . 27 GLY N . 7323 1 311 . 1 1 28 28 ALA H H 1 8.404 0.015 . 1 . . . . 28 ALA HN . 7323 1 312 . 1 1 28 28 ALA HA H 1 4.330 0.015 . 1 . . . . 28 ALA HA . 7323 1 313 . 1 1 28 28 ALA HB1 H 1 1.450 0.015 . 1 . . . . 28 ALA QB . 7323 1 314 . 1 1 28 28 ALA HB2 H 1 1.450 0.015 . 1 . . . . 28 ALA QB . 7323 1 315 . 1 1 28 28 ALA HB3 H 1 1.450 0.015 . 1 . . . . 28 ALA QB . 7323 1 316 . 1 1 28 28 ALA CA C 13 53.408 0.3 . 1 . . . . 28 ALA CA . 7323 1 317 . 1 1 28 28 ALA CB C 13 19.216 0.3 . 1 . . . . 28 ALA CB . 7323 1 318 . 1 1 28 28 ALA N N 15 124.575 0.3 . 1 . . . . 28 ALA N . 7323 1 319 . 1 1 29 29 THR H H 1 8.101 0.015 . 1 . . . . 29 THR HN . 7323 1 320 . 1 1 29 29 THR HA H 1 4.471 0.015 . 1 . . . . 29 THR HA . 7323 1 321 . 1 1 29 29 THR HB H 1 4.396 0.015 . 1 . . . . 29 THR HB . 7323 1 322 . 1 1 29 29 THR HG21 H 1 1.213 0.015 . 1 . . . . 29 THR QG2 . 7323 1 323 . 1 1 29 29 THR HG22 H 1 1.213 0.015 . 1 . . . . 29 THR QG2 . 7323 1 324 . 1 1 29 29 THR HG23 H 1 1.213 0.015 . 1 . . . . 29 THR QG2 . 7323 1 325 . 1 1 29 29 THR CA C 13 60.873 0.3 . 1 . . . . 29 THR CA . 7323 1 326 . 1 1 29 29 THR CB C 13 71.146 0.3 . 1 . . . . 29 THR CB . 7323 1 327 . 1 1 29 29 THR CG2 C 13 21.780 0.3 . 1 . . . . 29 THR CG2 . 7323 1 328 . 1 1 29 29 THR N N 15 109.930 0.3 . 1 . . . . 29 THR N . 7323 1 329 . 1 1 30 30 GLU H H 1 8.691 0.015 . 1 . . . . 30 GLU HN . 7323 1 330 . 1 1 30 30 GLU HA H 1 4.236 0.015 . 1 . . . . 30 GLU HA . 7323 1 331 . 1 1 30 30 GLU HB2 H 1 2.081 0.015 . 1 . . . . 30 GLU HB2 . 7323 1 332 . 1 1 30 30 GLU HB3 H 1 2.003 0.015 . 1 . . . . 30 GLU HB3 . 7323 1 333 . 1 1 30 30 GLU HG2 H 1 2.325 0.015 . 2 . . . . 30 GLU QG . 7323 1 334 . 1 1 30 30 GLU HG3 H 1 2.325 0.015 . 2 . . . . 30 GLU QG . 7323 1 335 . 1 1 30 30 GLU CA C 13 57.968 0.3 . 1 . . . . 30 GLU CA . 7323 1 336 . 1 1 30 30 GLU CB C 13 29.781 0.3 . 1 . . . . 30 GLU CB . 7323 1 337 . 1 1 30 30 GLU CG C 13 36.310 0.3 . 1 . . . . 30 GLU CG . 7323 1 338 . 1 1 30 30 GLU N N 15 122.115 0.3 . 1 . . . . 30 GLU N . 7323 1 339 . 1 1 31 31 GLU H H 1 8.399 0.015 . 1 . . . . 31 GLU HN . 7323 1 340 . 1 1 31 31 GLU HA H 1 4.201 0.015 . 1 . . . . 31 GLU HA . 7323 1 341 . 1 1 31 31 GLU HB2 H 1 2.004 0.015 . 2 . . . . 31 GLU QB . 7323 1 342 . 1 1 31 31 GLU HB3 H 1 2.004 0.015 . 2 . . . . 31 GLU QB . 7323 1 343 . 1 1 31 31 GLU HG2 H 1 2.290 0.015 . 2 . . . . 31 GLU QG . 7323 1 344 . 1 1 31 31 GLU HG3 H 1 2.290 0.015 . 2 . . . . 31 GLU QG . 7323 1 345 . 1 1 31 31 GLU CA C 13 58.111 0.3 . 1 . . . . 31 GLU CA . 7323 1 346 . 1 1 31 31 GLU CB C 13 29.690 0.3 . 1 . . . . 31 GLU CB . 7323 1 347 . 1 1 31 31 GLU CG C 13 36.176 0.3 . 1 . . . . 31 GLU CG . 7323 1 348 . 1 1 31 31 GLU N N 15 120.005 0.3 . 1 . . . . 31 GLU N . 7323 1 349 . 1 1 32 32 ASP H H 1 8.112 0.015 . 1 . . . . 32 ASP HN . 7323 1 350 . 1 1 32 32 ASP HA H 1 4.486 0.015 . 1 . . . . 32 ASP HA . 7323 1 351 . 1 1 32 32 ASP HB2 H 1 2.738 0.015 . 2 . . . . 32 ASP QB . 7323 1 352 . 1 1 32 32 ASP HB3 H 1 2.738 0.015 . 2 . . . . 32 ASP QB . 7323 1 353 . 1 1 32 32 ASP CA C 13 56.255 0.3 . 1 . . . . 32 ASP CA . 7323 1 354 . 1 1 32 32 ASP CB C 13 41.013 0.3 . 1 . . . . 32 ASP CB . 7323 1 355 . 1 1 32 32 ASP N N 15 119.828 0.3 . 1 . . . . 32 ASP N . 7323 1 356 . 1 1 33 33 ASP H H 1 7.908 0.015 . 1 . . . . 33 ASP HN . 7323 1 357 . 1 1 33 33 ASP HA H 1 4.566 0.015 . 1 . . . . 33 ASP HA . 7323 1 358 . 1 1 33 33 ASP HB2 H 1 2.714 0.015 . 2 . . . . 33 ASP QB . 7323 1 359 . 1 1 33 33 ASP HB3 H 1 2.714 0.015 . 2 . . . . 33 ASP QB . 7323 1 360 . 1 1 33 33 ASP CA C 13 56.258 0.3 . 1 . . . . 33 ASP CA . 7323 1 361 . 1 1 33 33 ASP CB C 13 40.585 0.3 . 1 . . . . 33 ASP CB . 7323 1 362 . 1 1 33 33 ASP N N 15 120.363 0.3 . 1 . . . . 33 ASP N . 7323 1 363 . 1 1 34 34 ASN H H 1 8.505 0.015 . 1 . . . . 34 ASN HN . 7323 1 364 . 1 1 34 34 ASN HA H 1 4.555 0.015 . 1 . . . . 34 ASN HA . 7323 1 365 . 1 1 34 34 ASN HB2 H 1 2.898 0.015 . 1 . . . . 34 ASN HB2 . 7323 1 366 . 1 1 34 34 ASN HB3 H 1 2.878 0.015 . 1 . . . . 34 ASN HB3 . 7323 1 367 . 1 1 34 34 ASN HD21 H 1 7.712 0.015 . 1 . . . . 34 ASN HD21 . 7323 1 368 . 1 1 34 34 ASN HD22 H 1 7.005 0.015 . 1 . . . . 34 ASN HD22 . 7323 1 369 . 1 1 34 34 ASN CA C 13 55.400 0.3 . 1 . . . . 34 ASN CA . 7323 1 370 . 1 1 34 34 ASN CB C 13 38.449 0.3 . 1 . . . . 34 ASN CB . 7323 1 371 . 1 1 34 34 ASN N N 15 119.121 0.3 . 1 . . . . 34 ASN N . 7323 1 372 . 1 1 34 34 ASN ND2 N 15 111.878 0.3 . 1 . . . . 34 ASN ND2 . 7323 1 373 . 1 1 35 35 LYS H H 1 8.199 0.015 . 1 . . . . 35 LYS HN . 7323 1 374 . 1 1 35 35 LYS HA H 1 4.040 0.015 . 1 . . . . 35 LYS HA . 7323 1 375 . 1 1 35 35 LYS HB2 H 1 2.017 0.015 . 1 . . . . 35 LYS HB2 . 7323 1 376 . 1 1 35 35 LYS HB3 H 1 1.957 0.015 . 1 . . . . 35 LYS HB3 . 7323 1 377 . 1 1 35 35 LYS HG2 H 1 1.663 0.015 . 1 . . . . 35 LYS HG2 . 7323 1 378 . 1 1 35 35 LYS HG3 H 1 1.496 0.015 . 1 . . . . 35 LYS HG3 . 7323 1 379 . 1 1 35 35 LYS HD2 H 1 1.766 0.015 . 2 . . . . 35 LYS QD . 7323 1 380 . 1 1 35 35 LYS HD3 H 1 1.766 0.015 . 2 . . . . 35 LYS QD . 7323 1 381 . 1 1 35 35 LYS HE2 H 1 3.030 0.015 . 2 . . . . 35 LYS QE . 7323 1 382 . 1 1 35 35 LYS HE3 H 1 3.030 0.015 . 2 . . . . 35 LYS QE . 7323 1 383 . 1 1 35 35 LYS CA C 13 59.841 0.3 . 1 . . . . 35 LYS CA . 7323 1 384 . 1 1 35 35 LYS CB C 13 32.564 0.3 . 1 . . . . 35 LYS CB . 7323 1 385 . 1 1 35 35 LYS CG C 13 25.374 0.3 . 1 . . . . 35 LYS CG . 7323 1 386 . 1 1 35 35 LYS CD C 13 29.555 0.3 . 1 . . . . 35 LYS CD . 7323 1 387 . 1 1 35 35 LYS CE C 13 42.128 0.3 . 1 . . . . 35 LYS CE . 7323 1 388 . 1 1 35 35 LYS N N 15 120.089 0.3 . 1 . . . . 35 LYS N . 7323 1 389 . 1 1 36 36 LEU H H 1 7.876 0.015 . 1 . . . . 36 LEU HN . 7323 1 390 . 1 1 36 36 LEU HA H 1 4.288 0.015 . 1 . . . . 36 LEU HA . 7323 1 391 . 1 1 36 36 LEU HB2 H 1 1.994 0.015 . 1 . . . . 36 LEU HB2 . 7323 1 392 . 1 1 36 36 LEU HB3 H 1 1.394 0.015 . 1 . . . . 36 LEU HB3 . 7323 1 393 . 1 1 36 36 LEU HG H 1 1.902 0.015 . 1 . . . . 36 LEU HG . 7323 1 394 . 1 1 36 36 LEU HD11 H 1 0.880 0.015 . 2 . . . . 36 LEU QD1 . 7323 1 395 . 1 1 36 36 LEU HD12 H 1 0.880 0.015 . 2 . . . . 36 LEU QD1 . 7323 1 396 . 1 1 36 36 LEU HD13 H 1 0.880 0.015 . 2 . . . . 36 LEU QD1 . 7323 1 397 . 1 1 36 36 LEU HD21 H 1 0.917 0.015 . 2 . . . . 36 LEU QD2 . 7323 1 398 . 1 1 36 36 LEU HD22 H 1 0.917 0.015 . 2 . . . . 36 LEU QD2 . 7323 1 399 . 1 1 36 36 LEU HD23 H 1 0.917 0.015 . 2 . . . . 36 LEU QD2 . 7323 1 400 . 1 1 36 36 LEU CA C 13 58.101 0.3 . 1 . . . . 36 LEU CA . 7323 1 401 . 1 1 36 36 LEU CB C 13 41.725 0.3 . 1 . . . . 36 LEU CB . 7323 1 402 . 1 1 36 36 LEU CG C 13 27.012 0.3 . 1 . . . . 36 LEU CG . 7323 1 403 . 1 1 36 36 LEU CD1 C 13 25.622 0.3 . 1 . . . . 36 LEU CD1 . 7323 1 404 . 1 1 36 36 LEU CD2 C 13 22.858 0.3 . 1 . . . . 36 LEU CD2 . 7323 1 405 . 1 1 36 36 LEU N N 15 119.062 0.3 . 1 . . . . 36 LEU N . 7323 1 406 . 1 1 37 37 VAL H H 1 7.914 0.015 . 1 . . . . 37 VAL HN . 7323 1 407 . 1 1 37 37 VAL HA H 1 3.522 0.015 . 1 . . . . 37 VAL HA . 7323 1 408 . 1 1 37 37 VAL HB H 1 2.250 0.015 . 1 . . . . 37 VAL HB . 7323 1 409 . 1 1 37 37 VAL HG11 H 1 1.078 0.015 . 2 . . . . 37 VAL QG1 . 7323 1 410 . 1 1 37 37 VAL HG12 H 1 1.078 0.015 . 2 . . . . 37 VAL QG1 . 7323 1 411 . 1 1 37 37 VAL HG13 H 1 1.078 0.015 . 2 . . . . 37 VAL QG1 . 7323 1 412 . 1 1 37 37 VAL HG21 H 1 1.046 0.015 . 2 . . . . 37 VAL QG2 . 7323 1 413 . 1 1 37 37 VAL HG22 H 1 1.046 0.015 . 2 . . . . 37 VAL QG2 . 7323 1 414 . 1 1 37 37 VAL HG23 H 1 1.046 0.015 . 2 . . . . 37 VAL QG2 . 7323 1 415 . 1 1 37 37 VAL CA C 13 67.319 0.3 . 1 . . . . 37 VAL CA . 7323 1 416 . 1 1 37 37 VAL CB C 13 31.532 0.3 . 1 . . . . 37 VAL CB . 7323 1 417 . 1 1 37 37 VAL CG1 C 13 23.795 0.3 . 1 . . . . 37 VAL CG1 . 7323 1 418 . 1 1 37 37 VAL CG2 C 13 22.410 0.3 . 1 . . . . 37 VAL CG2 . 7323 1 419 . 1 1 37 37 VAL N N 15 120.190 0.3 . 1 . . . . 37 VAL N . 7323 1 420 . 1 1 38 38 ARG H H 1 8.213 0.015 . 1 . . . . 38 ARG HN . 7323 1 421 . 1 1 38 38 ARG HA H 1 4.382 0.015 . 1 . . . . 38 ARG HA . 7323 1 422 . 1 1 38 38 ARG HB2 H 1 2.095 0.015 . 1 . . . . 38 ARG HB2 . 7323 1 423 . 1 1 38 38 ARG HB3 H 1 2.010 0.015 . 1 . . . . 38 ARG HB3 . 7323 1 424 . 1 1 38 38 ARG HG2 H 1 1.878 0.015 . 1 . . . . 38 ARG HG2 . 7323 1 425 . 1 1 38 38 ARG HG3 H 1 1.848 0.015 . 1 . . . . 38 ARG HG3 . 7323 1 426 . 1 1 38 38 ARG HD2 H 1 3.315 0.015 . 2 . . . . 38 ARG QD . 7323 1 427 . 1 1 38 38 ARG HD3 H 1 3.315 0.015 . 2 . . . . 38 ARG QD . 7323 1 428 . 1 1 38 38 ARG CA C 13 59.249 0.3 . 1 . . . . 38 ARG CA . 7323 1 429 . 1 1 38 38 ARG CB C 13 30.185 0.3 . 1 . . . . 38 ARG CB . 7323 1 430 . 1 1 38 38 ARG CG C 13 27.476 0.3 . 1 . . . . 38 ARG CG . 7323 1 431 . 1 1 38 38 ARG CD C 13 43.576 0.3 . 1 . . . . 38 ARG CD . 7323 1 432 . 1 1 38 38 ARG N N 15 119.437 0.3 . 1 . . . . 38 ARG N . 7323 1 433 . 1 1 39 39 GLU H H 1 7.976 0.015 . 1 . . . . 39 GLU HN . 7323 1 434 . 1 1 39 39 GLU HA H 1 4.710 0.015 . 1 . . . . 39 GLU HA . 7323 1 435 . 1 1 39 39 GLU HB2 H 1 2.368 0.015 . 2 . . . . 39 GLU QB . 7323 1 436 . 1 1 39 39 GLU HB3 H 1 2.368 0.015 . 2 . . . . 39 GLU QB . 7323 1 437 . 1 1 39 39 GLU HG2 H 1 2.536 0.015 . 1 . . . . 39 GLU HG2 . 7323 1 438 . 1 1 39 39 GLU HG3 H 1 2.378 0.015 . 1 . . . . 39 GLU HG3 . 7323 1 439 . 1 1 39 39 GLU CA C 13 58.461 0.3 . 1 . . . . 39 GLU CA . 7323 1 440 . 1 1 39 39 GLU CB C 13 29.094 0.3 . 1 . . . . 39 GLU CB . 7323 1 441 . 1 1 39 39 GLU CG C 13 34.748 0.3 . 1 . . . . 39 GLU CG . 7323 1 442 . 1 1 39 39 GLU N N 15 121.523 0.3 . 1 . . . . 39 GLU N . 7323 1 443 . 1 1 40 40 PHE H H 1 8.874 0.015 . 1 . . . . 40 PHE HN . 7323 1 444 . 1 1 40 40 PHE HA H 1 4.233 0.015 . 1 . . . . 40 PHE HA . 7323 1 445 . 1 1 40 40 PHE HB2 H 1 3.826 0.015 . 1 . . . . 40 PHE HB2 . 7323 1 446 . 1 1 40 40 PHE HB3 H 1 3.187 0.015 . 1 . . . . 40 PHE HB3 . 7323 1 447 . 1 1 40 40 PHE HD1 H 1 7.333 0.015 . 3 . . . . 40 PHE QD . 7323 1 448 . 1 1 40 40 PHE HD2 H 1 7.333 0.015 . 3 . . . . 40 PHE QD . 7323 1 449 . 1 1 40 40 PHE HE1 H 1 7.183 0.015 . 3 . . . . 40 PHE QE . 7323 1 450 . 1 1 40 40 PHE HE2 H 1 7.183 0.015 . 3 . . . . 40 PHE QE . 7323 1 451 . 1 1 40 40 PHE HZ H 1 6.859 0.015 . 1 . . . . 40 PHE HZ . 7323 1 452 . 1 1 40 40 PHE CA C 13 62.951 0.3 . 1 . . . . 40 PHE CA . 7323 1 453 . 1 1 40 40 PHE CB C 13 38.663 0.3 . 1 . . . . 40 PHE CB . 7323 1 454 . 1 1 40 40 PHE CD1 C 13 129.279 0.3 . 3 . . . . 40 PHE CD1 . 7323 1 455 . 1 1 40 40 PHE CD2 C 13 129.279 0.3 . 3 . . . . 40 PHE CD2 . 7323 1 456 . 1 1 40 40 PHE CE1 C 13 130.340 0.3 . 3 . . . . 40 PHE CE1 . 7323 1 457 . 1 1 40 40 PHE CE2 C 13 130.340 0.3 . 3 . . . . 40 PHE CE2 . 7323 1 458 . 1 1 40 40 PHE CZ C 13 131.900 0.3 . 1 . . . . 40 PHE CZ . 7323 1 459 . 1 1 40 40 PHE N N 15 121.972 0.3 . 1 . . . . 40 PHE N . 7323 1 460 . 1 1 41 41 GLU H H 1 8.667 0.015 . 1 . . . . 41 GLU HN . 7323 1 461 . 1 1 41 41 GLU HA H 1 3.688 0.015 . 1 . . . . 41 GLU HA . 7323 1 462 . 1 1 41 41 GLU HB2 H 1 2.536 0.015 . 1 . . . . 41 GLU HB2 . 7323 1 463 . 1 1 41 41 GLU HB3 H 1 2.118 0.015 . 1 . . . . 41 GLU HB3 . 7323 1 464 . 1 1 41 41 GLU HG2 H 1 2.921 0.015 . 1 . . . . 41 GLU HG2 . 7323 1 465 . 1 1 41 41 GLU HG3 H 1 2.056 0.015 . 1 . . . . 41 GLU HG3 . 7323 1 466 . 1 1 41 41 GLU CA C 13 60.533 0.3 . 1 . . . . 41 GLU CA . 7323 1 467 . 1 1 41 41 GLU CB C 13 29.616 0.3 . 1 . . . . 41 GLU CB . 7323 1 468 . 1 1 41 41 GLU CG C 13 37.537 0.3 . 1 . . . . 41 GLU CG . 7323 1 469 . 1 1 41 41 GLU N N 15 121.262 0.3 . 1 . . . . 41 GLU N . 7323 1 470 . 1 1 42 42 ARG H H 1 8.179 0.015 . 1 . . . . 42 ARG HN . 7323 1 471 . 1 1 42 42 ARG HA H 1 3.989 0.015 . 1 . . . . 42 ARG HA . 7323 1 472 . 1 1 42 42 ARG HB2 H 1 2.073 0.015 . 1 . . . . 42 ARG HB2 . 7323 1 473 . 1 1 42 42 ARG HB3 H 1 1.996 0.015 . 1 . . . . 42 ARG HB3 . 7323 1 474 . 1 1 42 42 ARG HG2 H 1 1.718 0.015 . 1 . . . . 42 ARG HG2 . 7323 1 475 . 1 1 42 42 ARG HG3 H 1 1.490 0.015 . 1 . . . . 42 ARG HG3 . 7323 1 476 . 1 1 42 42 ARG HD2 H 1 3.466 0.015 . 1 . . . . 42 ARG HD2 . 7323 1 477 . 1 1 42 42 ARG HD3 H 1 3.063 0.015 . 1 . . . . 42 ARG HD3 . 7323 1 478 . 1 1 42 42 ARG CA C 13 59.251 0.3 . 1 . . . . 42 ARG CA . 7323 1 479 . 1 1 42 42 ARG CB C 13 31.039 0.3 . 1 . . . . 42 ARG CB . 7323 1 480 . 1 1 42 42 ARG CG C 13 27.266 0.3 . 1 . . . . 42 ARG CG . 7323 1 481 . 1 1 42 42 ARG CD C 13 42.725 0.3 . 1 . . . . 42 ARG CD . 7323 1 482 . 1 1 42 42 ARG N N 15 121.371 0.3 . 1 . . . . 42 ARG N . 7323 1 483 . 1 1 43 43 LEU H H 1 8.828 0.015 . 1 . . . . 43 LEU HN . 7323 1 484 . 1 1 43 43 LEU HA H 1 4.026 0.015 . 1 . . . . 43 LEU HA . 7323 1 485 . 1 1 43 43 LEU HB2 H 1 1.896 0.015 . 1 . . . . 43 LEU HB2 . 7323 1 486 . 1 1 43 43 LEU HB3 H 1 0.974 0.015 . 1 . . . . 43 LEU HB3 . 7323 1 487 . 1 1 43 43 LEU HG H 1 1.803 0.015 . 1 . . . . 43 LEU HG . 7323 1 488 . 1 1 43 43 LEU HD11 H 1 0.706 0.015 . 2 . . . . 43 LEU QD1 . 7323 1 489 . 1 1 43 43 LEU HD12 H 1 0.706 0.015 . 2 . . . . 43 LEU QD1 . 7323 1 490 . 1 1 43 43 LEU HD13 H 1 0.706 0.015 . 2 . . . . 43 LEU QD1 . 7323 1 491 . 1 1 43 43 LEU HD21 H 1 0.715 0.015 . 2 . . . . 43 LEU QD2 . 7323 1 492 . 1 1 43 43 LEU HD22 H 1 0.715 0.015 . 2 . . . . 43 LEU QD2 . 7323 1 493 . 1 1 43 43 LEU HD23 H 1 0.715 0.015 . 2 . . . . 43 LEU QD2 . 7323 1 494 . 1 1 43 43 LEU CA C 13 56.682 0.3 . 1 . . . . 43 LEU CA . 7323 1 495 . 1 1 43 43 LEU CB C 13 44.733 0.3 . 1 . . . . 43 LEU CB . 7323 1 496 . 1 1 43 43 LEU CG C 13 27.260 0.3 . 1 . . . . 43 LEU CG . 7323 1 497 . 1 1 43 43 LEU CD1 C 13 26.718 0.3 . 1 . . . . 43 LEU CD1 . 7323 1 498 . 1 1 43 43 LEU CD2 C 13 23.061 0.3 . 1 . . . . 43 LEU CD2 . 7323 1 499 . 1 1 43 43 LEU N N 15 116.108 0.3 . 1 . . . . 43 LEU N . 7323 1 500 . 1 1 44 44 THR H H 1 7.762 0.015 . 1 . . . . 44 THR HN . 7323 1 501 . 1 1 44 44 THR HA H 1 3.549 0.015 . 1 . . . . 44 THR HA . 7323 1 502 . 1 1 44 44 THR HB H 1 3.772 0.015 . 1 . . . . 44 THR HB . 7323 1 503 . 1 1 44 44 THR HG21 H 1 0.726 0.015 . 1 . . . . 44 THR QG2 . 7323 1 504 . 1 1 44 44 THR HG22 H 1 0.726 0.015 . 1 . . . . 44 THR QG2 . 7323 1 505 . 1 1 44 44 THR HG23 H 1 0.726 0.015 . 1 . . . . 44 THR QG2 . 7323 1 506 . 1 1 44 44 THR CA C 13 65.336 0.3 . 1 . . . . 44 THR CA . 7323 1 507 . 1 1 44 44 THR CB C 13 69.979 0.3 . 1 . . . . 44 THR CB . 7323 1 508 . 1 1 44 44 THR CG2 C 13 22.521 0.3 . 1 . . . . 44 THR CG2 . 7323 1 509 . 1 1 44 44 THR N N 15 104.411 0.3 . 1 . . . . 44 THR N . 7323 1 510 . 1 1 45 45 GLU H H 1 7.307 0.015 . 1 . . . . 45 GLU HN . 7323 1 511 . 1 1 45 45 GLU HA H 1 3.845 0.015 . 1 . . . . 45 GLU HA . 7323 1 512 . 1 1 45 45 GLU HB2 H 1 2.457 0.015 . 1 . . . . 45 GLU HB2 . 7323 1 513 . 1 1 45 45 GLU HB3 H 1 2.379 0.015 . 1 . . . . 45 GLU HB3 . 7323 1 514 . 1 1 45 45 GLU HG2 H 1 2.224 0.015 . 1 . . . . 45 GLU HG2 . 7323 1 515 . 1 1 45 45 GLU HG3 H 1 2.130 0.015 . 1 . . . . 45 GLU HG3 . 7323 1 516 . 1 1 45 45 GLU CA C 13 57.539 0.3 . 1 . . . . 45 GLU CA . 7323 1 517 . 1 1 45 45 GLU CB C 13 28.902 0.3 . 1 . . . . 45 GLU CB . 7323 1 518 . 1 1 45 45 GLU CG C 13 37.729 0.3 . 1 . . . . 45 GLU CG . 7323 1 519 . 1 1 45 45 GLU N N 15 111.476 0.3 . 1 . . . . 45 GLU N . 7323 1 520 . 1 1 46 46 HIS H H 1 7.267 0.015 . 1 . . . . 46 HIS HN . 7323 1 521 . 1 1 46 46 HIS HA H 1 3.032 0.015 . 1 . . . . 46 HIS HA . 7323 1 522 . 1 1 46 46 HIS HB2 H 1 2.577 0.015 . 1 . . . . 46 HIS HB2 . 7323 1 523 . 1 1 46 46 HIS HB3 H 1 2.076 0.015 . 1 . . . . 46 HIS HB3 . 7323 1 524 . 1 1 46 46 HIS HD2 H 1 6.105 0.015 . 1 . . . . 46 HIS HD2 . 7323 1 525 . 1 1 46 46 HIS HE1 H 1 7.719 0.015 . 1 . . . . 46 HIS HE1 . 7323 1 526 . 1 1 46 46 HIS CA C 13 55.687 0.3 . 1 . . . . 46 HIS CA . 7323 1 527 . 1 1 46 46 HIS CB C 13 31.879 0.3 . 1 . . . . 46 HIS CB . 7323 1 528 . 1 1 46 46 HIS CD2 C 13 116.160 0.3 . 1 . . . . 46 HIS CD2 . 7323 1 529 . 1 1 46 46 HIS CE1 C 13 139.072 0.3 . 1 . . . . 46 HIS CE1 . 7323 1 530 . 1 1 46 46 HIS N N 15 119.787 0.3 . 1 . . . . 46 HIS N . 7323 1 531 . 1 1 47 47 PRO HA H 1 4.170 0.015 . 1 . . . . 47 PRO HA . 7323 1 532 . 1 1 47 47 PRO HB2 H 1 2.209 0.015 . 1 . . . . 47 PRO HB2 . 7323 1 533 . 1 1 47 47 PRO HB3 H 1 1.822 0.015 . 1 . . . . 47 PRO HB3 . 7323 1 534 . 1 1 47 47 PRO HG2 H 1 1.780 0.015 . 1 . . . . 47 PRO HG2 . 7323 1 535 . 1 1 47 47 PRO HG3 H 1 1.549 0.015 . 1 . . . . 47 PRO HG3 . 7323 1 536 . 1 1 47 47 PRO HD2 H 1 2.689 0.015 . 1 . . . . 47 PRO HD2 . 7323 1 537 . 1 1 47 47 PRO HD3 H 1 1.081 0.015 . 1 . . . . 47 PRO HD3 . 7323 1 538 . 1 1 47 47 PRO CA C 13 64.661 0.3 . 1 . . . . 47 PRO CA . 7323 1 539 . 1 1 47 47 PRO CB C 13 32.037 0.3 . 1 . . . . 47 PRO CB . 7323 1 540 . 1 1 47 47 PRO CG C 13 26.765 0.3 . 1 . . . . 47 PRO CG . 7323 1 541 . 1 1 47 47 PRO CD C 13 50.556 0.3 . 1 . . . . 47 PRO CD . 7323 1 542 . 1 1 48 48 ASP H H 1 10.771 0.015 . 1 . . . . 48 ASP HN . 7323 1 543 . 1 1 48 48 ASP HA H 1 4.736 0.015 . 1 . . . . 48 ASP HA . 7323 1 544 . 1 1 48 48 ASP HB2 H 1 2.664 0.015 . 1 . . . . 48 ASP HB2 . 7323 1 545 . 1 1 48 48 ASP HB3 H 1 2.562 0.015 . 1 . . . . 48 ASP HB3 . 7323 1 546 . 1 1 48 48 ASP CA C 13 55.267 0.3 . 1 . . . . 48 ASP CA . 7323 1 547 . 1 1 48 48 ASP CB C 13 40.872 0.3 . 1 . . . . 48 ASP CB . 7323 1 548 . 1 1 48 48 ASP N N 15 121.157 0.3 . 1 . . . . 48 ASP N . 7323 1 549 . 1 1 49 49 GLY H H 1 7.920 0.015 . 1 . . . . 49 GLY HN . 7323 1 550 . 1 1 49 49 GLY HA2 H 1 4.071 0.015 . 1 . . . . 49 GLY HA1 . 7323 1 551 . 1 1 49 49 GLY HA3 H 1 3.759 0.015 . 1 . . . . 49 GLY HA2 . 7323 1 552 . 1 1 49 49 GLY CA C 13 47.413 0.3 . 1 . . . . 49 GLY CA . 7323 1 553 . 1 1 49 49 GLY N N 15 107.223 0.3 . 1 . . . . 49 GLY N . 7323 1 554 . 1 1 50 50 SER H H 1 9.787 0.015 . 1 . . . . 50 SER HN . 7323 1 555 . 1 1 50 50 SER HA H 1 3.898 0.015 . 1 . . . . 50 SER HA . 7323 1 556 . 1 1 50 50 SER HB2 H 1 4.141 0.015 . 1 . . . . 50 SER HB2 . 7323 1 557 . 1 1 50 50 SER HB3 H 1 3.943 0.015 . 1 . . . . 50 SER HB3 . 7323 1 558 . 1 1 50 50 SER CA C 13 60.843 0.3 . 1 . . . . 50 SER CA . 7323 1 559 . 1 1 50 50 SER CB C 13 63.065 0.3 . 1 . . . . 50 SER CB . 7323 1 560 . 1 1 50 50 SER N N 15 120.446 0.3 . 1 . . . . 50 SER N . 7323 1 561 . 1 1 51 51 ASP H H 1 8.646 0.015 . 1 . . . . 51 ASP HN . 7323 1 562 . 1 1 51 51 ASP HA H 1 4.543 0.015 . 1 . . . . 51 ASP HA . 7323 1 563 . 1 1 51 51 ASP HB2 H 1 3.087 0.015 . 1 . . . . 51 ASP HB2 . 7323 1 564 . 1 1 51 51 ASP HB3 H 1 2.792 0.015 . 1 . . . . 51 ASP HB3 . 7323 1 565 . 1 1 51 51 ASP CA C 13 57.762 0.3 . 1 . . . . 51 ASP CA . 7323 1 566 . 1 1 51 51 ASP CB C 13 39.297 0.3 . 1 . . . . 51 ASP CB . 7323 1 567 . 1 1 51 51 ASP N N 15 126.008 0.3 . 1 . . . . 51 ASP N . 7323 1 568 . 1 1 52 52 LEU H H 1 7.449 0.015 . 1 . . . . 52 LEU HN . 7323 1 569 . 1 1 52 52 LEU HA H 1 3.778 0.015 . 1 . . . . 52 LEU HA . 7323 1 570 . 1 1 52 52 LEU HB2 H 1 1.639 0.015 . 1 . . . . 52 LEU HB2 . 7323 1 571 . 1 1 52 52 LEU HB3 H 1 1.262 0.015 . 1 . . . . 52 LEU HB3 . 7323 1 572 . 1 1 52 52 LEU HG H 1 1.495 0.015 . 1 . . . . 52 LEU HG . 7323 1 573 . 1 1 52 52 LEU HD11 H 1 0.331 0.015 . 2 . . . . 52 LEU QD1 . 7323 1 574 . 1 1 52 52 LEU HD12 H 1 0.331 0.015 . 2 . . . . 52 LEU QD1 . 7323 1 575 . 1 1 52 52 LEU HD13 H 1 0.331 0.015 . 2 . . . . 52 LEU QD1 . 7323 1 576 . 1 1 52 52 LEU HD21 H 1 0.437 0.015 . 2 . . . . 52 LEU QD2 . 7323 1 577 . 1 1 52 52 LEU HD22 H 1 0.437 0.015 . 2 . . . . 52 LEU QD2 . 7323 1 578 . 1 1 52 52 LEU HD23 H 1 0.437 0.015 . 2 . . . . 52 LEU QD2 . 7323 1 579 . 1 1 52 52 LEU CA C 13 57.539 0.3 . 1 . . . . 52 LEU CA . 7323 1 580 . 1 1 52 52 LEU CB C 13 43.292 0.3 . 1 . . . . 52 LEU CB . 7323 1 581 . 1 1 52 52 LEU CG C 13 27.403 0.3 . 1 . . . . 52 LEU CG . 7323 1 582 . 1 1 52 52 LEU CD1 C 13 25.341 0.3 . 1 . . . . 52 LEU CD1 . 7323 1 583 . 1 1 52 52 LEU CD2 C 13 23.487 0.3 . 1 . . . . 52 LEU CD2 . 7323 1 584 . 1 1 52 52 LEU N N 15 115.647 0.3 . 1 . . . . 52 LEU N . 7323 1 585 . 1 1 53 53 ILE H H 1 7.011 0.015 . 1 . . . . 53 ILE HN . 7323 1 586 . 1 1 53 53 ILE HA H 1 3.345 0.015 . 1 . . . . 53 ILE HA . 7323 1 587 . 1 1 53 53 ILE HB H 1 1.009 0.015 . 1 . . . . 53 ILE HB . 7323 1 588 . 1 1 53 53 ILE HG12 H 1 0.710 0.015 . 1 . . . . 53 ILE HG12 . 7323 1 589 . 1 1 53 53 ILE HG13 H 1 0.194 0.015 . 1 . . . . 53 ILE HG13 . 7323 1 590 . 1 1 53 53 ILE HG21 H 1 -0.068 0.015 . 1 . . . . 53 ILE 2 . 7323 1 591 . 1 1 53 53 ILE HG22 H 1 -0.068 0.015 . 1 . . . . 53 ILE 2 . 7323 1 592 . 1 1 53 53 ILE HG23 H 1 -0.068 0.015 . 1 . . . . 53 ILE 2 . 7323 1 593 . 1 1 53 53 ILE HD11 H 1 -0.228 0.015 . 1 . . . . 53 ILE 1 . 7323 1 594 . 1 1 53 53 ILE HD12 H 1 -0.228 0.015 . 1 . . . . 53 ILE 1 . 7323 1 595 . 1 1 53 53 ILE HD13 H 1 -0.228 0.015 . 1 . . . . 53 ILE 1 . 7323 1 596 . 1 1 53 53 ILE CA C 13 62.529 0.3 . 1 . . . . 53 ILE CA . 7323 1 597 . 1 1 53 53 ILE CB C 13 38.582 0.3 . 1 . . . . 53 ILE CB . 7323 1 598 . 1 1 53 53 ILE CG1 C 13 27.614 0.3 . 1 . . . . 53 ILE CG1 . 7323 1 599 . 1 1 53 53 ILE CG2 C 13 16.791 0.3 . 1 . . . . 53 ILE CG2 . 7323 1 600 . 1 1 53 53 ILE CD1 C 13 12.518 0.3 . 1 . . . . 53 ILE CD1 . 7323 1 601 . 1 1 53 53 ILE N N 15 113.512 0.3 . 1 . . . . 53 ILE N . 7323 1 602 . 1 1 54 54 TYR H H 1 6.985 0.015 . 1 . . . . 54 TYR HN . 7323 1 603 . 1 1 54 54 TYR HA H 1 4.135 0.015 . 1 . . . . 54 TYR HA . 7323 1 604 . 1 1 54 54 TYR HB2 H 1 2.624 0.015 . 1 . . . . 54 TYR HB2 . 7323 1 605 . 1 1 54 54 TYR HB3 H 1 2.339 0.015 . 1 . . . . 54 TYR HB3 . 7323 1 606 . 1 1 54 54 TYR HD1 H 1 7.057 0.015 . 3 . . . . 54 TYR QD . 7323 1 607 . 1 1 54 54 TYR HD2 H 1 7.057 0.015 . 3 . . . . 54 TYR QD . 7323 1 608 . 1 1 54 54 TYR HE1 H 1 6.654 0.015 . 3 . . . . 54 TYR QE . 7323 1 609 . 1 1 54 54 TYR HE2 H 1 6.654 0.015 . 3 . . . . 54 TYR QE . 7323 1 610 . 1 1 54 54 TYR CA C 13 59.677 0.3 . 1 . . . . 54 TYR CA . 7323 1 611 . 1 1 54 54 TYR CB C 13 39.763 0.3 . 1 . . . . 54 TYR CB . 7323 1 612 . 1 1 54 54 TYR CD1 C 13 132.800 0.3 . 3 . . . . 54 TYR CD1 . 7323 1 613 . 1 1 54 54 TYR CD2 C 13 132.800 0.3 . 3 . . . . 54 TYR CD2 . 7323 1 614 . 1 1 54 54 TYR CE1 C 13 117.902 0.3 . 3 . . . . 54 TYR CE1 . 7323 1 615 . 1 1 54 54 TYR CE2 C 13 117.902 0.3 . 3 . . . . 54 TYR CE2 . 7323 1 616 . 1 1 54 54 TYR N N 15 114.705 0.3 . 1 . . . . 54 TYR N . 7323 1 617 . 1 1 55 55 TYR H H 1 8.534 0.015 . 1 . . . . 55 TYR HN . 7323 1 618 . 1 1 55 55 TYR HA H 1 4.939 0.015 . 1 . . . . 55 TYR HA . 7323 1 619 . 1 1 55 55 TYR HB2 H 1 3.087 0.015 . 1 . . . . 55 TYR HB2 . 7323 1 620 . 1 1 55 55 TYR HB3 H 1 2.605 0.015 . 1 . . . . 55 TYR HB3 . 7323 1 621 . 1 1 55 55 TYR HD1 H 1 7.146 0.015 . 3 . . . . 55 TYR QD . 7323 1 622 . 1 1 55 55 TYR HD2 H 1 7.146 0.015 . 3 . . . . 55 TYR QD . 7323 1 623 . 1 1 55 55 TYR HE1 H 1 6.784 0.015 . 3 . . . . 55 TYR QE . 7323 1 624 . 1 1 55 55 TYR HE2 H 1 6.784 0.015 . 3 . . . . 55 TYR QE . 7323 1 625 . 1 1 55 55 TYR CA C 13 55.252 0.3 . 1 . . . . 55 TYR CA . 7323 1 626 . 1 1 55 55 TYR CB C 13 39.156 0.3 . 1 . . . . 55 TYR CB . 7323 1 627 . 1 1 55 55 TYR CD1 C 13 133.862 0.3 . 3 . . . . 55 TYR CD1 . 7323 1 628 . 1 1 55 55 TYR CD2 C 13 133.862 0.3 . 3 . . . . 55 TYR CD2 . 7323 1 629 . 1 1 55 55 TYR CE1 C 13 117.948 0.3 . 3 . . . . 55 TYR CE1 . 7323 1 630 . 1 1 55 55 TYR CE2 C 13 117.948 0.3 . 3 . . . . 55 TYR CE2 . 7323 1 631 . 1 1 55 55 TYR N N 15 117.695 0.3 . 1 . . . . 55 TYR N . 7323 1 632 . 1 1 56 56 PRO HA H 1 4.231 0.015 . 1 . . . . 56 PRO HA . 7323 1 633 . 1 1 56 56 PRO HB2 H 1 2.135 0.015 . 1 . . . . 56 PRO HB2 . 7323 1 634 . 1 1 56 56 PRO HB3 H 1 1.878 0.015 . 1 . . . . 56 PRO HB3 . 7323 1 635 . 1 1 56 56 PRO HG2 H 1 1.820 0.015 . 1 . . . . 56 PRO HG2 . 7323 1 636 . 1 1 56 56 PRO HG3 H 1 1.770 0.015 . 1 . . . . 56 PRO HG3 . 7323 1 637 . 1 1 56 56 PRO HD2 H 1 3.404 0.015 . 1 . . . . 56 PRO HD2 . 7323 1 638 . 1 1 56 56 PRO HD3 H 1 3.058 0.015 . 1 . . . . 56 PRO HD3 . 7323 1 639 . 1 1 56 56 PRO CA C 13 62.884 0.3 . 1 . . . . 56 PRO CA . 7323 1 640 . 1 1 56 56 PRO CB C 13 32.168 0.3 . 1 . . . . 56 PRO CB . 7323 1 641 . 1 1 56 56 PRO CG C 13 27.048 0.3 . 1 . . . . 56 PRO CG . 7323 1 642 . 1 1 56 56 PRO CD C 13 50.415 0.3 . 1 . . . . 56 PRO CD . 7323 1 643 . 1 1 57 57 ARG H H 1 8.626 0.015 . 1 . . . . 57 ARG HN . 7323 1 644 . 1 1 57 57 ARG HA H 1 4.278 0.015 . 1 . . . . 57 ARG HA . 7323 1 645 . 1 1 57 57 ARG HB2 H 1 1.947 0.015 . 1 . . . . 57 ARG HB2 . 7323 1 646 . 1 1 57 57 ARG HB3 H 1 1.821 0.015 . 1 . . . . 57 ARG HB3 . 7323 1 647 . 1 1 57 57 ARG HG2 H 1 1.737 0.015 . 2 . . . . 57 ARG QG . 7323 1 648 . 1 1 57 57 ARG HG3 H 1 1.737 0.015 . 2 . . . . 57 ARG QG . 7323 1 649 . 1 1 57 57 ARG HD2 H 1 3.267 0.015 . 2 . . . . 57 ARG QD . 7323 1 650 . 1 1 57 57 ARG HD3 H 1 3.267 0.015 . 2 . . . . 57 ARG QD . 7323 1 651 . 1 1 57 57 ARG CA C 13 56.256 0.3 . 1 . . . . 57 ARG CA . 7323 1 652 . 1 1 57 57 ARG CB C 13 32.067 0.3 . 1 . . . . 57 ARG CB . 7323 1 653 . 1 1 57 57 ARG CG C 13 28.333 0.3 . 1 . . . . 57 ARG CG . 7323 1 654 . 1 1 57 57 ARG CD C 13 43.578 0.3 . 1 . . . . 57 ARG CD . 7323 1 655 . 1 1 57 57 ARG N N 15 121.919 0.3 . 1 . . . . 57 ARG N . 7323 1 656 . 1 1 58 58 ASP H H 1 8.341 0.015 . 1 . . . . 58 ASP HN . 7323 1 657 . 1 1 58 58 ASP HA H 1 4.467 0.015 . 1 . . . . 58 ASP HA . 7323 1 658 . 1 1 58 58 ASP HB2 H 1 2.781 0.015 . 1 . . . . 58 ASP HB2 . 7323 1 659 . 1 1 58 58 ASP HB3 H 1 2.718 0.015 . 1 . . . . 58 ASP HB3 . 7323 1 660 . 1 1 58 58 ASP CA C 13 55.179 0.3 . 1 . . . . 58 ASP CA . 7323 1 661 . 1 1 58 58 ASP CB C 13 40.727 0.3 . 1 . . . . 58 ASP CB . 7323 1 662 . 1 1 58 58 ASP N N 15 118.558 0.3 . 1 . . . . 58 ASP N . 7323 1 663 . 1 1 59 59 ASP H H 1 8.204 0.015 . 1 . . . . 59 ASP HN . 7323 1 664 . 1 1 59 59 ASP HA H 1 4.505 0.015 . 1 . . . . 59 ASP HA . 7323 1 665 . 1 1 59 59 ASP HB2 H 1 2.913 0.015 . 1 . . . . 59 ASP HB2 . 7323 1 666 . 1 1 59 59 ASP HB3 H 1 2.609 0.015 . 1 . . . . 59 ASP HB3 . 7323 1 667 . 1 1 59 59 ASP CA C 13 53.693 0.3 . 1 . . . . 59 ASP CA . 7323 1 668 . 1 1 59 59 ASP CB C 13 39.806 0.3 . 1 . . . . 59 ASP CB . 7323 1 669 . 1 1 59 59 ASP N N 15 116.452 0.3 . 1 . . . . 59 ASP N . 7323 1 670 . 1 1 60 60 ARG H H 1 7.547 0.015 . 1 . . . . 60 ARG HN . 7323 1 671 . 1 1 60 60 ARG HA H 1 4.566 0.015 . 1 . . . . 60 ARG HA . 7323 1 672 . 1 1 60 60 ARG HB2 H 1 1.967 0.015 . 1 . . . . 60 ARG HB2 . 7323 1 673 . 1 1 60 60 ARG HB3 H 1 1.888 0.015 . 1 . . . . 60 ARG HB3 . 7323 1 674 . 1 1 60 60 ARG HG2 H 1 1.585 0.015 . 2 . . . . 60 ARG QG . 7323 1 675 . 1 1 60 60 ARG HG3 H 1 1.585 0.015 . 2 . . . . 60 ARG QG . 7323 1 676 . 1 1 60 60 ARG HD2 H 1 3.037 0.015 . 2 . . . . 60 ARG QD . 7323 1 677 . 1 1 60 60 ARG HD3 H 1 3.037 0.015 . 2 . . . . 60 ARG QD . 7323 1 678 . 1 1 60 60 ARG CA C 13 54.776 0.3 . 1 . . . . 60 ARG CA . 7323 1 679 . 1 1 60 60 ARG CB C 13 31.611 0.3 . 1 . . . . 60 ARG CB . 7323 1 680 . 1 1 60 60 ARG CG C 13 25.592 0.3 . 1 . . . . 60 ARG CG . 7323 1 681 . 1 1 60 60 ARG CD C 13 44.005 0.3 . 1 . . . . 60 ARG CD . 7323 1 682 . 1 1 60 60 ARG N N 15 116.648 0.3 . 1 . . . . 60 ARG N . 7323 1 683 . 1 1 61 61 GLU H H 1 8.658 0.015 . 1 . . . . 61 GLU HN . 7323 1 684 . 1 1 61 61 GLU HA H 1 4.095 0.015 . 1 . . . . 61 GLU HA . 7323 1 685 . 1 1 61 61 GLU HB2 H 1 1.940 0.015 . 2 . . . . 61 GLU QB . 7323 1 686 . 1 1 61 61 GLU HB3 H 1 1.940 0.015 . 2 . . . . 61 GLU QB . 7323 1 687 . 1 1 61 61 GLU HG2 H 1 2.256 0.015 . 1 . . . . 61 GLU HG2 . 7323 1 688 . 1 1 61 61 GLU HG3 H 1 2.122 0.015 . 1 . . . . 61 GLU HG3 . 7323 1 689 . 1 1 61 61 GLU CA C 13 57.397 0.3 . 1 . . . . 61 GLU CA . 7323 1 690 . 1 1 61 61 GLU CB C 13 31.038 0.3 . 1 . . . . 61 GLU CB . 7323 1 691 . 1 1 61 61 GLU CG C 13 36.877 0.3 . 1 . . . . 61 GLU CG . 7323 1 692 . 1 1 61 61 GLU N N 15 121.886 0.3 . 1 . . . . 61 GLU N . 7323 1 693 . 1 1 62 62 ASP H H 1 8.879 0.015 . 1 . . . . 62 ASP HN . 7323 1 694 . 1 1 62 62 ASP HA H 1 4.544 0.015 . 1 . . . . 62 ASP HA . 7323 1 695 . 1 1 62 62 ASP HB2 H 1 2.819 0.015 . 1 . . . . 62 ASP HB2 . 7323 1 696 . 1 1 62 62 ASP HB3 H 1 2.648 0.015 . 1 . . . . 62 ASP HB3 . 7323 1 697 . 1 1 62 62 ASP CA C 13 52.781 0.3 . 1 . . . . 62 ASP CA . 7323 1 698 . 1 1 62 62 ASP CB C 13 38.942 0.3 . 1 . . . . 62 ASP CB . 7323 1 699 . 1 1 62 62 ASP N N 15 126.357 0.3 . 1 . . . . 62 ASP N . 7323 1 700 . 1 1 63 63 SER H H 1 7.818 0.015 . 1 . . . . 63 SER HN . 7323 1 701 . 1 1 63 63 SER HA H 1 4.884 0.015 . 1 . . . . 63 SER HA . 7323 1 702 . 1 1 63 63 SER HB2 H 1 4.231 0.015 . 1 . . . . 63 SER HB2 . 7323 1 703 . 1 1 63 63 SER HB3 H 1 3.901 0.015 . 1 . . . . 63 SER HB3 . 7323 1 704 . 1 1 63 63 SER CA C 13 55.862 0.3 . 1 . . . . 63 SER CA . 7323 1 705 . 1 1 63 63 SER CB C 13 63.636 0.3 . 1 . . . . 63 SER CB . 7323 1 706 . 1 1 63 63 SER N N 15 117.582 0.3 . 1 . . . . 63 SER N . 7323 1 707 . 1 1 64 64 PRO HA H 1 4.097 0.015 . 1 . . . . 64 PRO HA . 7323 1 708 . 1 1 64 64 PRO HB2 H 1 1.954 0.015 . 1 . . . . 64 PRO HB2 . 7323 1 709 . 1 1 64 64 PRO HB3 H 1 1.809 0.015 . 1 . . . . 64 PRO HB3 . 7323 1 710 . 1 1 64 64 PRO HG2 H 1 2.244 0.015 . 1 . . . . 64 PRO HG2 . 7323 1 711 . 1 1 64 64 PRO HG3 H 1 1.964 0.015 . 1 . . . . 64 PRO HG3 . 7323 1 712 . 1 1 64 64 PRO HD2 H 1 3.873 0.015 . 2 . . . . 64 PRO QD . 7323 1 713 . 1 1 64 64 PRO HD3 H 1 3.873 0.015 . 2 . . . . 64 PRO QD . 7323 1 714 . 1 1 64 64 PRO CA C 13 65.798 0.3 . 1 . . . . 64 PRO CA . 7323 1 715 . 1 1 64 64 PRO CB C 13 32.572 0.3 . 1 . . . . 64 PRO CB . 7323 1 716 . 1 1 64 64 PRO CG C 13 28.291 0.3 . 1 . . . . 64 PRO CG . 7323 1 717 . 1 1 64 64 PRO CD C 13 49.987 0.3 . 1 . . . . 64 PRO CD . 7323 1 718 . 1 1 65 65 GLU H H 1 9.238 0.015 . 1 . . . . 65 GLU HN . 7323 1 719 . 1 1 65 65 GLU HA H 1 3.796 0.015 . 1 . . . . 65 GLU HA . 7323 1 720 . 1 1 65 65 GLU HB2 H 1 2.062 0.015 . 1 . . . . 65 GLU HB2 . 7323 1 721 . 1 1 65 65 GLU HB3 H 1 1.865 0.015 . 1 . . . . 65 GLU HB3 . 7323 1 722 . 1 1 65 65 GLU HG2 H 1 2.573 0.015 . 1 . . . . 65 GLU HG2 . 7323 1 723 . 1 1 65 65 GLU HG3 H 1 2.256 0.015 . 1 . . . . 65 GLU HG3 . 7323 1 724 . 1 1 65 65 GLU CA C 13 61.530 0.3 . 1 . . . . 65 GLU CA . 7323 1 725 . 1 1 65 65 GLU CB C 13 28.618 0.3 . 1 . . . . 65 GLU CB . 7323 1 726 . 1 1 65 65 GLU CG C 13 38.021 0.3 . 1 . . . . 65 GLU CG . 7323 1 727 . 1 1 65 65 GLU N N 15 117.213 0.3 . 1 . . . . 65 GLU N . 7323 1 728 . 1 1 66 66 GLY H H 1 8.722 0.015 . 1 . . . . 66 GLY HN . 7323 1 729 . 1 1 66 66 GLY HA2 H 1 4.298 0.015 . 1 . . . . 66 GLY HA1 . 7323 1 730 . 1 1 66 66 GLY HA3 H 1 3.864 0.015 . 1 . . . . 66 GLY HA2 . 7323 1 731 . 1 1 66 66 GLY CA C 13 46.802 0.3 . 1 . . . . 66 GLY CA . 7323 1 732 . 1 1 66 66 GLY N N 15 112.022 0.3 . 1 . . . . 66 GLY N . 7323 1 733 . 1 1 67 67 ILE H H 1 8.304 0.015 . 1 . . . . 67 ILE HN . 7323 1 734 . 1 1 67 67 ILE HA H 1 3.586 0.015 . 1 . . . . 67 ILE HA . 7323 1 735 . 1 1 67 67 ILE HB H 1 2.062 0.015 . 1 . . . . 67 ILE HB . 7323 1 736 . 1 1 67 67 ILE HG12 H 1 1.993 0.015 . 1 . . . . 67 ILE HG12 . 7323 1 737 . 1 1 67 67 ILE HG13 H 1 0.768 0.015 . 1 . . . . 67 ILE HG13 . 7323 1 738 . 1 1 67 67 ILE HG21 H 1 0.913 0.015 . 1 . . . . 67 ILE QG2 . 7323 1 739 . 1 1 67 67 ILE HG22 H 1 0.913 0.015 . 1 . . . . 67 ILE QG2 . 7323 1 740 . 1 1 67 67 ILE HG23 H 1 0.913 0.015 . 1 . . . . 67 ILE QG2 . 7323 1 741 . 1 1 67 67 ILE HD11 H 1 0.528 0.015 . 1 . . . . 67 ILE QD1 . 7323 1 742 . 1 1 67 67 ILE HD12 H 1 0.528 0.015 . 1 . . . . 67 ILE QD1 . 7323 1 743 . 1 1 67 67 ILE HD13 H 1 0.528 0.015 . 1 . . . . 67 ILE QD1 . 7323 1 744 . 1 1 67 67 ILE CA C 13 66.083 0.3 . 1 . . . . 67 ILE CA . 7323 1 745 . 1 1 67 67 ILE CB C 13 38.324 0.3 . 1 . . . . 67 ILE CB . 7323 1 746 . 1 1 67 67 ILE CG1 C 13 29.279 0.3 . 1 . . . . 67 ILE CG1 . 7323 1 747 . 1 1 67 67 ILE CG2 C 13 18.232 0.3 . 1 . . . . 67 ILE CG2 . 7323 1 748 . 1 1 67 67 ILE CD1 C 13 15.299 0.3 . 1 . . . . 67 ILE CD1 . 7323 1 749 . 1 1 67 67 ILE N N 15 124.198 0.3 . 1 . . . . 67 ILE N . 7323 1 750 . 1 1 68 68 VAL H H 1 8.309 0.015 . 1 . . . . 68 VAL HN . 7323 1 751 . 1 1 68 68 VAL HA H 1 3.669 0.015 . 1 . . . . 68 VAL HA . 7323 1 752 . 1 1 68 68 VAL HB H 1 2.276 0.015 . 1 . . . . 68 VAL HB . 7323 1 753 . 1 1 68 68 VAL HG11 H 1 1.260 0.015 . 2 . . . . 68 VAL QG1 . 7323 1 754 . 1 1 68 68 VAL HG12 H 1 1.260 0.015 . 2 . . . . 68 VAL QG1 . 7323 1 755 . 1 1 68 68 VAL HG13 H 1 1.260 0.015 . 2 . . . . 68 VAL QG1 . 7323 1 756 . 1 1 68 68 VAL HG21 H 1 1.202 0.015 . 2 . . . . 68 VAL QG2 . 7323 1 757 . 1 1 68 68 VAL HG22 H 1 1.202 0.015 . 2 . . . . 68 VAL QG2 . 7323 1 758 . 1 1 68 68 VAL HG23 H 1 1.202 0.015 . 2 . . . . 68 VAL QG2 . 7323 1 759 . 1 1 68 68 VAL CA C 13 68.501 0.3 . 1 . . . . 68 VAL CA . 7323 1 760 . 1 1 68 68 VAL CB C 13 31.469 0.3 . 1 . . . . 68 VAL CB . 7323 1 761 . 1 1 68 68 VAL CG1 C 13 25.481 0.3 . 1 . . . . 68 VAL CG1 . 7323 1 762 . 1 1 68 68 VAL CG2 C 13 22.166 0.3 . 1 . . . . 68 VAL CG2 . 7323 1 763 . 1 1 68 68 VAL N N 15 118.409 0.3 . 1 . . . . 68 VAL N . 7323 1 764 . 1 1 69 69 LYS H H 1 8.198 0.015 . 1 . . . . 69 LYS HN . 7323 1 765 . 1 1 69 69 LYS HA H 1 4.118 0.015 . 1 . . . . 69 LYS HA . 7323 1 766 . 1 1 69 69 LYS HB2 H 1 2.132 0.015 . 1 . . . . 69 LYS HB2 . 7323 1 767 . 1 1 69 69 LYS HB3 H 1 1.948 0.015 . 1 . . . . 69 LYS HB3 . 7323 1 768 . 1 1 69 69 LYS HG2 H 1 1.532 0.015 . 1 . . . . 69 LYS HG2 . 7323 1 769 . 1 1 69 69 LYS HG3 H 1 1.428 0.015 . 1 . . . . 69 LYS HG3 . 7323 1 770 . 1 1 69 69 LYS HD2 H 1 1.755 0.015 . 2 . . . . 69 LYS QD . 7323 1 771 . 1 1 69 69 LYS HD3 H 1 1.755 0.015 . 2 . . . . 69 LYS QD . 7323 1 772 . 1 1 69 69 LYS HE2 H 1 3.044 0.015 . 2 . . . . 69 LYS QE . 7323 1 773 . 1 1 69 69 LYS HE3 H 1 3.044 0.015 . 2 . . . . 69 LYS QE . 7323 1 774 . 1 1 69 69 LYS CA C 13 60.391 0.3 . 1 . . . . 69 LYS CA . 7323 1 775 . 1 1 69 69 LYS CB C 13 32.608 0.3 . 1 . . . . 69 LYS CB . 7323 1 776 . 1 1 69 69 LYS CG C 13 25.057 0.3 . 1 . . . . 69 LYS CG . 7323 1 777 . 1 1 69 69 LYS CD C 13 29.901 0.3 . 1 . . . . 69 LYS CD . 7323 1 778 . 1 1 69 69 LYS CE C 13 42.291 0.3 . 1 . . . . 69 LYS CE . 7323 1 779 . 1 1 69 69 LYS N N 15 120.169 0.3 . 1 . . . . 69 LYS N . 7323 1 780 . 1 1 70 70 GLU H H 1 7.898 0.015 . 1 . . . . 70 GLU HN . 7323 1 781 . 1 1 70 70 GLU HA H 1 4.269 0.015 . 1 . . . . 70 GLU HA . 7323 1 782 . 1 1 70 70 GLU HB2 H 1 2.143 0.015 . 2 . . . . 70 GLU QB . 7323 1 783 . 1 1 70 70 GLU HB3 H 1 2.143 0.015 . 2 . . . . 70 GLU QB . 7323 1 784 . 1 1 70 70 GLU HG2 H 1 2.384 0.015 . 1 . . . . 70 GLU HG2 . 7323 1 785 . 1 1 70 70 GLU HG3 H 1 2.230 0.015 . 1 . . . . 70 GLU HG3 . 7323 1 786 . 1 1 70 70 GLU CA C 13 59.967 0.3 . 1 . . . . 70 GLU CA . 7323 1 787 . 1 1 70 70 GLU CB C 13 28.333 0.3 . 1 . . . . 70 GLU CB . 7323 1 788 . 1 1 70 70 GLU CG C 13 35.874 0.3 . 1 . . . . 70 GLU CG . 7323 1 789 . 1 1 70 70 GLU N N 15 119.004 0.3 . 1 . . . . 70 GLU N . 7323 1 790 . 1 1 71 71 ILE H H 1 8.395 0.015 . 1 . . . . 71 ILE HN . 7323 1 791 . 1 1 71 71 ILE HA H 1 3.853 0.015 . 1 . . . . 71 ILE HA . 7323 1 792 . 1 1 71 71 ILE HB H 1 2.319 0.015 . 1 . . . . 71 ILE HB . 7323 1 793 . 1 1 71 71 ILE HG12 H 1 1.740 0.015 . 1 . . . . 71 ILE HG12 . 7323 1 794 . 1 1 71 71 ILE HG13 H 1 1.477 0.015 . 1 . . . . 71 ILE HG13 . 7323 1 795 . 1 1 71 71 ILE HG21 H 1 0.752 0.015 . 1 . . . . 71 ILE QG2 . 7323 1 796 . 1 1 71 71 ILE HG22 H 1 0.752 0.015 . 1 . . . . 71 ILE QG2 . 7323 1 797 . 1 1 71 71 ILE HG23 H 1 0.752 0.015 . 1 . . . . 71 ILE QG2 . 7323 1 798 . 1 1 71 71 ILE HD11 H 1 0.870 0.015 . 1 . . . . 71 ILE QD1 . 7323 1 799 . 1 1 71 71 ILE HD12 H 1 0.870 0.015 . 1 . . . . 71 ILE QD1 . 7323 1 800 . 1 1 71 71 ILE HD13 H 1 0.870 0.015 . 1 . . . . 71 ILE QD1 . 7323 1 801 . 1 1 71 71 ILE CA C 13 64.405 0.3 . 1 . . . . 71 ILE CA . 7323 1 802 . 1 1 71 71 ILE CB C 13 37.450 0.3 . 1 . . . . 71 ILE CB . 7323 1 803 . 1 1 71 71 ILE CG1 C 13 28.042 0.3 . 1 . . . . 71 ILE CG1 . 7323 1 804 . 1 1 71 71 ILE CG2 C 13 17.927 0.3 . 1 . . . . 71 ILE CG2 . 7323 1 805 . 1 1 71 71 ILE CD1 C 13 14.228 0.3 . 1 . . . . 71 ILE CD1 . 7323 1 806 . 1 1 71 71 ILE N N 15 118.060 0.3 . 1 . . . . 71 ILE N . 7323 1 807 . 1 1 72 72 LYS H H 1 9.190 0.015 . 1 . . . . 72 LYS HN . 7323 1 808 . 1 1 72 72 LYS HA H 1 3.902 0.015 . 1 . . . . 72 LYS HA . 7323 1 809 . 1 1 72 72 LYS HB2 H 1 2.217 0.015 . 1 . . . . 72 LYS HB2 . 7323 1 810 . 1 1 72 72 LYS HB3 H 1 2.102 0.015 . 1 . . . . 72 LYS HB3 . 7323 1 811 . 1 1 72 72 LYS HG2 H 1 1.671 0.015 . 1 . . . . 72 LYS HG2 . 7323 1 812 . 1 1 72 72 LYS HG3 H 1 1.546 0.015 . 1 . . . . 72 LYS HG3 . 7323 1 813 . 1 1 72 72 LYS HD2 H 1 1.845 0.015 . 2 . . . . 72 LYS QD . 7323 1 814 . 1 1 72 72 LYS HD3 H 1 1.845 0.015 . 2 . . . . 72 LYS QD . 7323 1 815 . 1 1 72 72 LYS HE2 H 1 3.103 0.015 . 2 . . . . 72 LYS QE . 7323 1 816 . 1 1 72 72 LYS HE3 H 1 3.103 0.015 . 2 . . . . 72 LYS QE . 7323 1 817 . 1 1 72 72 LYS CA C 13 59.829 0.3 . 1 . . . . 72 LYS CA . 7323 1 818 . 1 1 72 72 LYS CB C 13 34.031 0.3 . 1 . . . . 72 LYS CB . 7323 1 819 . 1 1 72 72 LYS CG C 13 25.194 0.3 . 1 . . . . 72 LYS CG . 7323 1 820 . 1 1 72 72 LYS CD C 13 30.542 0.3 . 1 . . . . 72 LYS CD . 7323 1 821 . 1 1 72 72 LYS CE C 13 42.153 0.3 . 1 . . . . 72 LYS CE . 7323 1 822 . 1 1 72 72 LYS N N 15 121.086 0.3 . 1 . . . . 72 LYS N . 7323 1 823 . 1 1 73 73 GLU H H 1 8.655 0.015 . 1 . . . . 73 GLU HN . 7323 1 824 . 1 1 73 73 GLU HA H 1 4.099 0.015 . 1 . . . . 73 GLU HA . 7323 1 825 . 1 1 73 73 GLU HB2 H 1 2.283 0.015 . 1 . . . . 73 GLU HB2 . 7323 1 826 . 1 1 73 73 GLU HB3 H 1 2.109 0.015 . 1 . . . . 73 GLU HB3 . 7323 1 827 . 1 1 73 73 GLU HG2 H 1 2.693 0.015 . 1 . . . . 73 GLU HG2 . 7323 1 828 . 1 1 73 73 GLU HG3 H 1 2.350 0.015 . 1 . . . . 73 GLU HG3 . 7323 1 829 . 1 1 73 73 GLU CA C 13 59.249 0.3 . 1 . . . . 73 GLU CA . 7323 1 830 . 1 1 73 73 GLU CB C 13 29.374 0.3 . 1 . . . . 73 GLU CB . 7323 1 831 . 1 1 73 73 GLU CG C 13 36.945 0.3 . 1 . . . . 73 GLU CG . 7323 1 832 . 1 1 73 73 GLU N N 15 118.676 0.3 . 1 . . . . 73 GLU N . 7323 1 833 . 1 1 74 74 TRP H H 1 8.975 0.015 . 1 . . . . 74 TRP HN . 7323 1 834 . 1 1 74 74 TRP HA H 1 4.194 0.015 . 1 . . . . 74 TRP HA . 7323 1 835 . 1 1 74 74 TRP HB2 H 1 3.725 0.015 . 1 . . . . 74 TRP HB2 . 7323 1 836 . 1 1 74 74 TRP HB3 H 1 3.467 0.015 . 1 . . . . 74 TRP HB3 . 7323 1 837 . 1 1 74 74 TRP HD1 H 1 7.219 0.015 . 1 . . . . 74 TRP HD1 . 7323 1 838 . 1 1 74 74 TRP HE1 H 1 10.110 0.015 . 1 . . . . 74 TRP HE1 . 7323 1 839 . 1 1 74 74 TRP HE3 H 1 7.309 0.015 . 1 . . . . 74 TRP HE3 . 7323 1 840 . 1 1 74 74 TRP HZ2 H 1 7.233 0.015 . 1 . . . . 74 TRP HZ2 . 7323 1 841 . 1 1 74 74 TRP HZ3 H 1 6.913 0.015 . 1 . . . . 74 TRP HZ3 . 7323 1 842 . 1 1 74 74 TRP HH2 H 1 7.010 0.015 . 1 . . . . 74 TRP HH2 . 7323 1 843 . 1 1 74 74 TRP CA C 13 63.099 0.3 . 1 . . . . 74 TRP CA . 7323 1 844 . 1 1 74 74 TRP CB C 13 29.189 0.3 . 1 . . . . 74 TRP CB . 7323 1 845 . 1 1 74 74 TRP CD1 C 13 126.950 0.3 . 1 . . . . 74 TRP CD1 . 7323 1 846 . 1 1 74 74 TRP CE3 C 13 118.785 0.3 . 1 . . . . 74 TRP CE3 . 7323 1 847 . 1 1 74 74 TRP CZ2 C 13 114.698 0.3 . 1 . . . . 74 TRP CZ2 . 7323 1 848 . 1 1 74 74 TRP CZ3 C 13 121.294 0.3 . 1 . . . . 74 TRP CZ3 . 7323 1 849 . 1 1 74 74 TRP CH2 C 13 124.285 0.3 . 1 . . . . 74 TRP CH2 . 7323 1 850 . 1 1 74 74 TRP N N 15 122.909 0.3 . 1 . . . . 74 TRP N . 7323 1 851 . 1 1 74 74 TRP NE1 N 15 129.600 0.3 . 1 . . . . 74 TRP NE1 . 7323 1 852 . 1 1 75 75 ARG H H 1 9.126 0.015 . 1 . . . . 75 ARG HN . 7323 1 853 . 1 1 75 75 ARG HA H 1 3.243 0.015 . 1 . . . . 75 ARG HA . 7323 1 854 . 1 1 75 75 ARG HB2 H 1 1.796 0.015 . 1 . . . . 75 ARG HB2 . 7323 1 855 . 1 1 75 75 ARG HB3 H 1 1.556 0.015 . 1 . . . . 75 ARG HB3 . 7323 1 856 . 1 1 75 75 ARG HG2 H 1 2.375 0.015 . 2 . . . . 75 ARG QG . 7323 1 857 . 1 1 75 75 ARG HG3 H 1 2.375 0.015 . 2 . . . . 75 ARG QG . 7323 1 858 . 1 1 75 75 ARG HD2 H 1 3.234 0.015 . 1 . . . . 75 ARG HD2 . 7323 1 859 . 1 1 75 75 ARG HD3 H 1 3.067 0.015 . 1 . . . . 75 ARG HD3 . 7323 1 860 . 1 1 75 75 ARG CA C 13 61.255 0.3 . 1 . . . . 75 ARG CA . 7323 1 861 . 1 1 75 75 ARG CB C 13 29.109 0.3 . 1 . . . . 75 ARG CB . 7323 1 862 . 1 1 75 75 ARG CG C 13 30.174 0.3 . 1 . . . . 75 ARG CG . 7323 1 863 . 1 1 75 75 ARG CD C 13 42.151 0.3 . 1 . . . . 75 ARG CD . 7323 1 864 . 1 1 75 75 ARG N N 15 118.844 0.3 . 1 . . . . 75 ARG N . 7323 1 865 . 1 1 76 76 ALA H H 1 7.538 0.015 . 1 . . . . 76 ALA HN . 7323 1 866 . 1 1 76 76 ALA HA H 1 4.163 0.015 . 1 . . . . 76 ALA HA . 7323 1 867 . 1 1 76 76 ALA HB1 H 1 1.458 0.015 . 1 . . . . 76 ALA QB . 7323 1 868 . 1 1 76 76 ALA HB2 H 1 1.458 0.015 . 1 . . . . 76 ALA QB . 7323 1 869 . 1 1 76 76 ALA HB3 H 1 1.458 0.015 . 1 . . . . 76 ALA QB . 7323 1 870 . 1 1 76 76 ALA CA C 13 55.116 0.3 . 1 . . . . 76 ALA CA . 7323 1 871 . 1 1 76 76 ALA CB C 13 18.072 0.3 . 1 . . . . 76 ALA CB . 7323 1 872 . 1 1 76 76 ALA N N 15 120.017 0.3 . 1 . . . . 76 ALA N . 7323 1 873 . 1 1 77 77 ALA H H 1 7.958 0.015 . 1 . . . . 77 ALA HN . 7323 1 874 . 1 1 77 77 ALA HA H 1 4.123 0.015 . 1 . . . . 77 ALA HA . 7323 1 875 . 1 1 77 77 ALA HB1 H 1 1.361 0.015 . 1 . . . . 77 ALA QB . 7323 1 876 . 1 1 77 77 ALA HB2 H 1 1.361 0.015 . 1 . . . . 77 ALA QB . 7323 1 877 . 1 1 77 77 ALA HB3 H 1 1.361 0.015 . 1 . . . . 77 ALA QB . 7323 1 878 . 1 1 77 77 ALA CA C 13 53.835 0.3 . 1 . . . . 77 ALA CA . 7323 1 879 . 1 1 77 77 ALA CB C 13 18.360 0.3 . 1 . . . . 77 ALA CB . 7323 1 880 . 1 1 77 77 ALA N N 15 120.251 0.3 . 1 . . . . 77 ALA N . 7323 1 881 . 1 1 78 78 ASN H H 1 7.061 0.015 . 1 . . . . 78 ASN HN . 7323 1 882 . 1 1 78 78 ASN HA H 1 4.500 0.015 . 1 . . . . 78 ASN HA . 7323 1 883 . 1 1 78 78 ASN HB2 H 1 2.239 0.015 . 1 . . . . 78 ASN HB2 . 7323 1 884 . 1 1 78 78 ASN HB3 H 1 1.184 0.015 . 1 . . . . 78 ASN HB3 . 7323 1 885 . 1 1 78 78 ASN CA C 13 53.252 0.3 . 1 . . . . 78 ASN CA . 7323 1 886 . 1 1 78 78 ASN CB C 13 38.877 0.3 . 1 . . . . 78 ASN CB . 7323 1 887 . 1 1 78 78 ASN N N 15 113.776 0.3 . 1 . . . . 78 ASN N . 7323 1 888 . 1 1 78 78 ASN ND2 N 15 115.730 0.3 . 1 . . . . 78 ASN ND2 . 7323 1 889 . 1 1 78 78 ASN HD21 H 1 6.518 0.015 . 2 . . . . 78 ASN QD2 . 7323 1 890 . 1 1 78 78 ASN HD22 H 1 6.518 0.015 . 2 . . . . 78 ASN QD2 . 7323 1 891 . 1 1 79 79 GLY H H 1 7.549 0.015 . 1 . . . . 79 GLY HN . 7323 1 892 . 1 1 79 79 GLY HA2 H 1 3.810 0.015 . 2 . . . . 79 GLY QA . 7323 1 893 . 1 1 79 79 GLY HA3 H 1 3.810 0.015 . 2 . . . . 79 GLY QA . 7323 1 894 . 1 1 79 79 GLY CA C 13 47.029 0.3 . 1 . . . . 79 GLY CA . 7323 1 895 . 1 1 79 79 GLY N N 15 107.705 0.3 . 1 . . . . 79 GLY N . 7323 1 896 . 1 1 80 80 LYS H H 1 8.016 0.015 . 1 . . . . 80 LYS HN . 7323 1 897 . 1 1 80 80 LYS HA H 1 4.528 0.015 . 1 . . . . 80 LYS HA . 7323 1 898 . 1 1 80 80 LYS HB2 H 1 1.920 0.015 . 1 . . . . 80 LYS HB2 . 7323 1 899 . 1 1 80 80 LYS HB3 H 1 1.368 0.015 . 1 . . . . 80 LYS HB3 . 7323 1 900 . 1 1 80 80 LYS HG2 H 1 1.222 0.015 . 1 . . . . 80 LYS HG2 . 7323 1 901 . 1 1 80 80 LYS HG3 H 1 1.099 0.015 . 1 . . . . 80 LYS HG3 . 7323 1 902 . 1 1 80 80 LYS HD2 H 1 1.622 0.015 . 1 . . . . 80 LYS HD2 . 7323 1 903 . 1 1 80 80 LYS HD3 H 1 1.463 0.015 . 1 . . . . 80 LYS HD3 . 7323 1 904 . 1 1 80 80 LYS HE2 H 1 3.116 0.015 . 1 . . . . 80 LYS HE2 . 7323 1 905 . 1 1 80 80 LYS HE3 H 1 2.845 0.015 . 1 . . . . 80 LYS HE3 . 7323 1 906 . 1 1 80 80 LYS CA C 13 53.969 0.3 . 1 . . . . 80 LYS CA . 7323 1 907 . 1 1 80 80 LYS CB C 13 33.598 0.3 . 1 . . . . 80 LYS CB . 7323 1 908 . 1 1 80 80 LYS CG C 13 25.201 0.3 . 1 . . . . 80 LYS CG . 7323 1 909 . 1 1 80 80 LYS CD C 13 28.915 0.3 . 1 . . . . 80 LYS CD . 7323 1 910 . 1 1 80 80 LYS CE C 13 42.580 0.3 . 1 . . . . 80 LYS CE . 7323 1 911 . 1 1 80 80 LYS N N 15 117.979 0.3 . 1 . . . . 80 LYS N . 7323 1 912 . 1 1 81 81 SER H H 1 8.667 0.015 . 1 . . . . 81 SER HN . 7323 1 913 . 1 1 81 81 SER HA H 1 4.081 0.015 . 1 . . . . 81 SER HA . 7323 1 914 . 1 1 81 81 SER HB2 H 1 3.951 0.015 . 1 . . . . 81 SER HB2 . 7323 1 915 . 1 1 81 81 SER HB3 H 1 3.895 0.015 . 1 . . . . 81 SER HB3 . 7323 1 916 . 1 1 81 81 SER CA C 13 58.840 0.3 . 1 . . . . 81 SER CA . 7323 1 917 . 1 1 81 81 SER CB C 13 63.872 0.3 . 1 . . . . 81 SER CB . 7323 1 918 . 1 1 81 81 SER N N 15 118.074 0.3 . 1 . . . . 81 SER N . 7323 1 919 . 1 1 82 82 GLY H H 1 8.341 0.015 . 1 . . . . 82 GLY HN . 7323 1 920 . 1 1 82 82 GLY HA2 H 1 4.234 0.015 . 1 . . . . 82 GLY HA1 . 7323 1 921 . 1 1 82 82 GLY HA3 H 1 3.546 0.015 . 1 . . . . 82 GLY HA2 . 7323 1 922 . 1 1 82 82 GLY CA C 13 43.194 0.3 . 1 . . . . 82 GLY CA . 7323 1 923 . 1 1 82 82 GLY N N 15 109.538 0.3 . 1 . . . . 82 GLY N . 7323 1 924 . 1 1 83 83 PHE H H 1 7.890 0.015 . 1 . . . . 83 PHE HN . 7323 1 925 . 1 1 83 83 PHE HA H 1 4.603 0.015 . 1 . . . . 83 PHE HA . 7323 1 926 . 1 1 83 83 PHE HB2 H 1 3.638 0.015 . 1 . . . . 83 PHE HB2 . 7323 1 927 . 1 1 83 83 PHE HB3 H 1 2.665 0.015 . 1 . . . . 83 PHE HB3 . 7323 1 928 . 1 1 83 83 PHE HD1 H 1 7.433 0.015 . 3 . . . . 83 PHE QD . 7323 1 929 . 1 1 83 83 PHE HD2 H 1 7.433 0.015 . 3 . . . . 83 PHE QD . 7323 1 930 . 1 1 83 83 PHE HE1 H 1 6.678 0.015 . 3 . . . . 83 PHE QE . 7323 1 931 . 1 1 83 83 PHE HE2 H 1 6.678 0.015 . 3 . . . . 83 PHE QE . 7323 1 932 . 1 1 83 83 PHE HZ H 1 6.758 0.015 . 1 . . . . 83 PHE HZ . 7323 1 933 . 1 1 83 83 PHE CA C 13 58.675 0.3 . 1 . . . . 83 PHE CA . 7323 1 934 . 1 1 83 83 PHE CB C 13 39.807 0.3 . 1 . . . . 83 PHE CB . 7323 1 935 . 1 1 83 83 PHE CD1 C 13 131.954 0.3 . 3 . . . . 83 PHE CD1 . 7323 1 936 . 1 1 83 83 PHE CD2 C 13 131.954 0.3 . 3 . . . . 83 PHE CD2 . 7323 1 937 . 1 1 83 83 PHE CE1 C 13 130.660 0.3 . 3 . . . . 83 PHE CE1 . 7323 1 938 . 1 1 83 83 PHE CE2 C 13 130.660 0.3 . 3 . . . . 83 PHE CE2 . 7323 1 939 . 1 1 83 83 PHE CZ C 13 127.648 0.3 . 1 . . . . 83 PHE CZ . 7323 1 940 . 1 1 83 83 PHE N N 15 116.353 0.3 . 1 . . . . 83 PHE N . 7323 1 941 . 1 1 84 84 LYS H H 1 8.545 0.015 . 1 . . . . 84 LYS HN . 7323 1 942 . 1 1 84 84 LYS HA H 1 4.177 0.015 . 1 . . . . 84 LYS HA . 7323 1 943 . 1 1 84 84 LYS HB2 H 1 1.885 0.015 . 1 . . . . 84 LYS HB2 . 7323 1 944 . 1 1 84 84 LYS HB3 H 1 1.425 0.015 . 1 . . . . 84 LYS HB3 . 7323 1 945 . 1 1 84 84 LYS HG2 H 1 1.429 0.015 . 2 . . . . 84 LYS QG . 7323 1 946 . 1 1 84 84 LYS HG3 H 1 1.429 0.015 . 2 . . . . 84 LYS QG . 7323 1 947 . 1 1 84 84 LYS HD2 H 1 1.656 0.015 . 2 . . . . 84 LYS QD . 7323 1 948 . 1 1 84 84 LYS HD3 H 1 1.656 0.015 . 2 . . . . 84 LYS QD . 7323 1 949 . 1 1 84 84 LYS HE2 H 1 2.948 0.015 . 2 . . . . 84 LYS QE . 7323 1 950 . 1 1 84 84 LYS HE3 H 1 2.948 0.015 . 2 . . . . 84 LYS QE . 7323 1 951 . 1 1 84 84 LYS CA C 13 57.198 0.3 . 1 . . . . 84 LYS CA . 7323 1 952 . 1 1 84 84 LYS CB C 13 32.607 0.3 . 1 . . . . 84 LYS CB . 7323 1 953 . 1 1 84 84 LYS CG C 13 24.546 0.3 . 1 . . . . 84 LYS CG . 7323 1 954 . 1 1 84 84 LYS CD C 13 29.899 0.3 . 1 . . . . 84 LYS CD . 7323 1 955 . 1 1 84 84 LYS CE C 13 42.153 0.3 . 1 . . . . 84 LYS CE . 7323 1 956 . 1 1 84 84 LYS N N 15 124.109 0.3 . 1 . . . . 84 LYS N . 7323 1 957 . 1 1 85 85 GLN H H 1 8.721 0.015 . 1 . . . . 85 GLN HN . 7323 1 958 . 1 1 85 85 GLN HA H 1 4.307 0.015 . 1 . . . . 85 GLN HA . 7323 1 959 . 1 1 85 85 GLN HB2 H 1 2.168 0.015 . 1 . . . . 85 GLN HB2 . 7323 1 960 . 1 1 85 85 GLN HB3 H 1 2.062 0.015 . 1 . . . . 85 GLN HB3 . 7323 1 961 . 1 1 85 85 GLN HG2 H 1 2.484 0.015 . 2 . . . . 85 GLN QG . 7323 1 962 . 1 1 85 85 GLN HG3 H 1 2.484 0.015 . 2 . . . . 85 GLN QG . 7323 1 963 . 1 1 85 85 GLN HE21 H 1 7.709 0.015 . 1 . . . . 85 GLN HE21 . 7323 1 964 . 1 1 85 85 GLN HE22 H 1 7.002 0.015 . 1 . . . . 85 GLN HE22 . 7323 1 965 . 1 1 85 85 GLN CA C 13 56.399 0.3 . 1 . . . . 85 GLN CA . 7323 1 966 . 1 1 85 85 GLN CB C 13 29.337 0.3 . 1 . . . . 85 GLN CB . 7323 1 967 . 1 1 85 85 GLN CG C 13 34.032 0.3 . 1 . . . . 85 GLN CG . 7323 1 968 . 1 1 85 85 GLN N N 15 125.401 0.3 . 1 . . . . 85 GLN N . 7323 1 969 . 1 1 85 85 GLN NE2 N 15 112.360 0.3 . 1 . . . . 85 GLN NE2 . 7323 1 970 . 1 1 86 86 GLY H H 1 8.077 0.015 . 1 . . . . 86 GLY HN . 7323 1 971 . 1 1 86 86 GLY HA2 H 1 3.810 0.015 . 2 . . . . 86 GLY QA . 7323 1 972 . 1 1 86 86 GLY HA3 H 1 3.810 0.015 . 2 . . . . 86 GLY QA . 7323 1 973 . 1 1 86 86 GLY CA C 13 46.071 0.3 . 1 . . . . 86 GLY CA . 7323 1 974 . 1 1 86 86 GLY N N 15 116.940 0.3 . 1 . . . . 86 GLY N . 7323 1 stop_ save_