################################### # 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_hr9151a.str _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode hr9151a.str _Assigned_chem_shift_list.Entry_ID 19314 _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 $DSS _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.4 _Assigned_chem_shift_list.Chem_shift_15N_err 0.4 _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' . . . 19314 1 2 '2D 1H-13C CT HSQC aliphatic' . . . 19314 1 3 '3D HNCO' . . . 19314 1 4 '3D CBCA(CO)NH' . . . 19314 1 5 '3D HNCACB' . . . 19314 1 6 '2D 1H-13C CT HSQC aromatic' . . . 19314 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 19314 1 8 '3D (H)CCH-TOCSY' . . . 19314 1 9 '3D HBHA(CO)NH' . . . 19314 1 10 '3D HN(CA)CO' . . . 19314 1 11 '2D 1H-15N HSQC_wide' . . . 19314 1 12 '3D (H)CCH-COSYali' . . . 19314 1 13 '3D (H)CCH-COSYaro' . . . 19314 1 14 '2D 1H-13C HSQC methyl' . . . 19314 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 10 10 HIS HA H 1 4.624 0.02 . 1 . . . . 10 HIS HA . 19314 1 2 . 1 1 10 10 HIS HB2 H 1 3.102 0.02 . 1 . . . . 10 HIS HB2 . 19314 1 3 . 1 1 10 10 HIS HB3 H 1 3.102 0.02 . 1 . . . . 10 HIS HB3 . 19314 1 4 . 1 1 10 10 HIS CA C 13 56.220 0.4 . 1 . . . . 10 HIS CA . 19314 1 5 . 1 1 10 10 HIS CB C 13 30.929 0.4 . 1 . . . . 10 HIS CB . 19314 1 6 . 1 1 10 10 HIS N N 15 119.305 0.4 . 1 . . . . 10 HIS N . 19314 1 7 . 1 1 11 11 MET H H 1 8.242 0.02 . 1 . . . . 11 MET H . 19314 1 8 . 1 1 11 11 MET HA H 1 4.720 0.02 . 1 . . . . 11 MET HA . 19314 1 9 . 1 1 11 11 MET HB2 H 1 2.037 0.02 . 2 . . . . 11 MET HB2 . 19314 1 10 . 1 1 11 11 MET HB3 H 1 1.916 0.02 . 2 . . . . 11 MET HB3 . 19314 1 11 . 1 1 11 11 MET HG2 H 1 2.502 0.02 . 2 . . . . 11 MET HG2 . 19314 1 12 . 1 1 11 11 MET HG3 H 1 2.428 0.02 . 2 . . . . 11 MET HG3 . 19314 1 13 . 1 1 11 11 MET HE1 H 1 2.056 0.02 . 1 . . . . 11 MET HE . 19314 1 14 . 1 1 11 11 MET HE2 H 1 2.056 0.02 . 1 . . . . 11 MET HE . 19314 1 15 . 1 1 11 11 MET HE3 H 1 2.056 0.02 . 1 . . . . 11 MET HE . 19314 1 16 . 1 1 11 11 MET CA C 13 53.340 0.4 . 1 . . . . 11 MET CA . 19314 1 17 . 1 1 11 11 MET CB C 13 32.044 0.4 . 1 . . . . 11 MET CB . 19314 1 18 . 1 1 11 11 MET CG C 13 31.785 0.4 . 1 . . . . 11 MET CG . 19314 1 19 . 1 1 11 11 MET CE C 13 16.945 0.4 . 1 . . . . 11 MET CE . 19314 1 20 . 1 1 11 11 MET N N 15 122.753 0.4 . 1 . . . . 11 MET N . 19314 1 21 . 1 1 13 13 LYS HA H 1 4.265 0.02 . 1 . . . . 13 LYS HA . 19314 1 22 . 1 1 13 13 LYS HB2 H 1 1.863 0.02 . 2 . . . . 13 LYS HB2 . 19314 1 23 . 1 1 13 13 LYS HB3 H 1 1.820 0.02 . 2 . . . . 13 LYS HB3 . 19314 1 24 . 1 1 13 13 LYS HG2 H 1 1.490 0.02 . 2 . . . . 13 LYS HG2 . 19314 1 25 . 1 1 13 13 LYS HG3 H 1 1.458 0.02 . 2 . . . . 13 LYS HG3 . 19314 1 26 . 1 1 13 13 LYS HD2 H 1 1.685 0.02 . 1 . . . . 13 LYS HD2 . 19314 1 27 . 1 1 13 13 LYS HD3 H 1 1.685 0.02 . 1 . . . . 13 LYS HD3 . 19314 1 28 . 1 1 13 13 LYS HE2 H 1 2.979 0.02 . 1 . . . . 13 LYS HE2 . 19314 1 29 . 1 1 13 13 LYS HE3 H 1 2.979 0.02 . 1 . . . . 13 LYS HE3 . 19314 1 30 . 1 1 13 13 LYS CA C 13 57.029 0.4 . 1 . . . . 13 LYS CA . 19314 1 31 . 1 1 13 13 LYS CB C 13 32.710 0.4 . 1 . . . . 13 LYS CB . 19314 1 32 . 1 1 13 13 LYS CG C 13 24.741 0.4 . 1 . . . . 13 LYS CG . 19314 1 33 . 1 1 13 13 LYS CD C 13 28.982 0.4 . 1 . . . . 13 LYS CD . 19314 1 34 . 1 1 13 13 LYS CE C 13 41.942 0.4 . 1 . . . . 13 LYS CE . 19314 1 35 . 1 1 14 14 ALA H H 1 8.455 0.02 . 1 . . . . 14 ALA H . 19314 1 36 . 1 1 14 14 ALA HA H 1 4.357 0.02 . 1 . . . . 14 ALA HA . 19314 1 37 . 1 1 14 14 ALA HB1 H 1 1.484 0.02 . 1 . . . . 14 ALA HB . 19314 1 38 . 1 1 14 14 ALA HB2 H 1 1.484 0.02 . 1 . . . . 14 ALA HB . 19314 1 39 . 1 1 14 14 ALA HB3 H 1 1.484 0.02 . 1 . . . . 14 ALA HB . 19314 1 40 . 1 1 14 14 ALA CA C 13 53.641 0.4 . 1 . . . . 14 ALA CA . 19314 1 41 . 1 1 14 14 ALA CB C 13 18.406 0.4 . 1 . . . . 14 ALA CB . 19314 1 42 . 1 1 14 14 ALA N N 15 123.879 0.4 . 1 . . . . 14 ALA N . 19314 1 43 . 1 1 15 15 THR H H 1 8.017 0.02 . 1 . . . . 15 THR H . 19314 1 44 . 1 1 15 15 THR HA H 1 4.193 0.02 . 1 . . . . 15 THR HA . 19314 1 45 . 1 1 15 15 THR HB H 1 4.361 0.02 . 1 . . . . 15 THR HB . 19314 1 46 . 1 1 15 15 THR HG21 H 1 1.245 0.02 . 1 . . . . 15 THR HG2 . 19314 1 47 . 1 1 15 15 THR HG22 H 1 1.245 0.02 . 1 . . . . 15 THR HG2 . 19314 1 48 . 1 1 15 15 THR HG23 H 1 1.245 0.02 . 1 . . . . 15 THR HG2 . 19314 1 49 . 1 1 15 15 THR C C 13 175.172 0.4 . 1 . . . . 15 THR C . 19314 1 50 . 1 1 15 15 THR CA C 13 63.894 0.4 . 1 . . . . 15 THR CA . 19314 1 51 . 1 1 15 15 THR CB C 13 68.904 0.4 . 1 . . . . 15 THR CB . 19314 1 52 . 1 1 15 15 THR CG2 C 13 22.101 0.4 . 1 . . . . 15 THR CG2 . 19314 1 53 . 1 1 15 15 THR N N 15 113.403 0.4 . 1 . . . . 15 THR N . 19314 1 54 . 1 1 16 16 ALA H H 1 8.147 0.02 . 1 . . . . 16 ALA H . 19314 1 55 . 1 1 16 16 ALA HA H 1 4.163 0.02 . 1 . . . . 16 ALA HA . 19314 1 56 . 1 1 16 16 ALA HB1 H 1 1.488 0.02 . 1 . . . . 16 ALA HB . 19314 1 57 . 1 1 16 16 ALA HB2 H 1 1.488 0.02 . 1 . . . . 16 ALA HB . 19314 1 58 . 1 1 16 16 ALA HB3 H 1 1.488 0.02 . 1 . . . . 16 ALA HB . 19314 1 59 . 1 1 16 16 ALA C C 13 180.320 0.4 . 1 . . . . 16 ALA C . 19314 1 60 . 1 1 16 16 ALA CA C 13 54.792 0.4 . 1 . . . . 16 ALA CA . 19314 1 61 . 1 1 16 16 ALA CB C 13 18.161 0.4 . 1 . . . . 16 ALA CB . 19314 1 62 . 1 1 16 16 ALA N N 15 124.884 0.4 . 1 . . . . 16 ALA N . 19314 1 63 . 1 1 17 17 GLN H H 1 8.360 0.02 . 1 . . . . 17 GLN H . 19314 1 64 . 1 1 17 17 GLN HA H 1 4.189 0.02 . 1 . . . . 17 GLN HA . 19314 1 65 . 1 1 17 17 GLN HB2 H 1 2.175 0.02 . 2 . . . . 17 GLN HB2 . 19314 1 66 . 1 1 17 17 GLN HB3 H 1 2.098 0.02 . 2 . . . . 17 GLN HB3 . 19314 1 67 . 1 1 17 17 GLN HG2 H 1 2.522 0.02 . 2 . . . . 17 GLN HG2 . 19314 1 68 . 1 1 17 17 GLN HG3 H 1 2.392 0.02 . 2 . . . . 17 GLN HG3 . 19314 1 69 . 1 1 17 17 GLN HE21 H 1 7.674 0.02 . 2 . . . . 17 GLN HE21 . 19314 1 70 . 1 1 17 17 GLN HE22 H 1 7.005 0.02 . 2 . . . . 17 GLN HE22 . 19314 1 71 . 1 1 17 17 GLN C C 13 177.935 0.4 . 1 . . . . 17 GLN C . 19314 1 72 . 1 1 17 17 GLN CA C 13 58.504 0.4 . 1 . . . . 17 GLN CA . 19314 1 73 . 1 1 17 17 GLN CB C 13 28.428 0.4 . 1 . . . . 17 GLN CB . 19314 1 74 . 1 1 17 17 GLN CG C 13 34.327 0.4 . 1 . . . . 17 GLN CG . 19314 1 75 . 1 1 17 17 GLN N N 15 117.607 0.4 . 1 . . . . 17 GLN N . 19314 1 76 . 1 1 17 17 GLN NE2 N 15 112.573 0.4 . 1 . . . . 17 GLN NE2 . 19314 1 77 . 1 1 18 18 MET H H 1 8.121 0.02 . 1 . . . . 18 MET H . 19314 1 78 . 1 1 18 18 MET HA H 1 4.015 0.02 . 1 . . . . 18 MET HA . 19314 1 79 . 1 1 18 18 MET HB2 H 1 2.210 0.02 . 1 . . . . 18 MET HB2 . 19314 1 80 . 1 1 18 18 MET HB3 H 1 2.210 0.02 . 1 . . . . 18 MET HB3 . 19314 1 81 . 1 1 18 18 MET HG2 H 1 2.645 0.02 . 2 . . . . 18 MET HG2 . 19314 1 82 . 1 1 18 18 MET HG3 H 1 2.265 0.02 . 2 . . . . 18 MET HG3 . 19314 1 83 . 1 1 18 18 MET HE1 H 1 2.110 0.02 . 1 . . . . 18 MET HE . 19314 1 84 . 1 1 18 18 MET HE2 H 1 2.110 0.02 . 1 . . . . 18 MET HE . 19314 1 85 . 1 1 18 18 MET HE3 H 1 2.110 0.02 . 1 . . . . 18 MET HE . 19314 1 86 . 1 1 18 18 MET C C 13 178.313 0.4 . 1 . . . . 18 MET C . 19314 1 87 . 1 1 18 18 MET CA C 13 59.394 0.4 . 1 . . . . 18 MET CA . 19314 1 88 . 1 1 18 18 MET CB C 13 32.814 0.4 . 1 . . . . 18 MET CB . 19314 1 89 . 1 1 18 18 MET CG C 13 30.946 0.4 . 1 . . . . 18 MET CG . 19314 1 90 . 1 1 18 18 MET CE C 13 16.515 0.4 . 1 . . . . 18 MET CE . 19314 1 91 . 1 1 18 18 MET N N 15 120.897 0.4 . 1 . . . . 18 MET N . 19314 1 92 . 1 1 19 19 GLU H H 1 8.526 0.02 . 1 . . . . 19 GLU H . 19314 1 93 . 1 1 19 19 GLU HA H 1 3.806 0.02 . 1 . . . . 19 GLU HA . 19314 1 94 . 1 1 19 19 GLU HB2 H 1 1.932 0.02 . 1 . . . . 19 GLU HB2 . 19314 1 95 . 1 1 19 19 GLU HB3 H 1 1.932 0.02 . 1 . . . . 19 GLU HB3 . 19314 1 96 . 1 1 19 19 GLU HG2 H 1 2.656 0.02 . 2 . . . . 19 GLU HG2 . 19314 1 97 . 1 1 19 19 GLU HG3 H 1 2.222 0.02 . 2 . . . . 19 GLU HG3 . 19314 1 98 . 1 1 19 19 GLU C C 13 178.544 0.4 . 1 . . . . 19 GLU C . 19314 1 99 . 1 1 19 19 GLU CA C 13 60.193 0.4 . 1 . . . . 19 GLU CA . 19314 1 100 . 1 1 19 19 GLU CB C 13 29.073 0.4 . 1 . . . . 19 GLU CB . 19314 1 101 . 1 1 19 19 GLU CG C 13 36.598 0.4 . 1 . . . . 19 GLU CG . 19314 1 102 . 1 1 19 19 GLU N N 15 117.750 0.4 . 1 . . . . 19 GLU N . 19314 1 103 . 1 1 20 20 GLU H H 1 7.976 0.02 . 1 . . . . 20 GLU H . 19314 1 104 . 1 1 20 20 GLU HA H 1 3.970 0.02 . 1 . . . . 20 GLU HA . 19314 1 105 . 1 1 20 20 GLU HB2 H 1 2.174 0.02 . 1 . . . . 20 GLU HB2 . 19314 1 106 . 1 1 20 20 GLU HB3 H 1 2.174 0.02 . 1 . . . . 20 GLU HB3 . 19314 1 107 . 1 1 20 20 GLU HG2 H 1 2.393 0.02 . 2 . . . . 20 GLU HG2 . 19314 1 108 . 1 1 20 20 GLU HG3 H 1 2.280 0.02 . 2 . . . . 20 GLU HG3 . 19314 1 109 . 1 1 20 20 GLU C C 13 178.755 0.4 . 1 . . . . 20 GLU C . 19314 1 110 . 1 1 20 20 GLU CA C 13 59.508 0.4 . 1 . . . . 20 GLU CA . 19314 1 111 . 1 1 20 20 GLU CB C 13 29.253 0.4 . 1 . . . . 20 GLU CB . 19314 1 112 . 1 1 20 20 GLU CG C 13 35.901 0.4 . 1 . . . . 20 GLU CG . 19314 1 113 . 1 1 20 20 GLU N N 15 119.352 0.4 . 1 . . . . 20 GLU N . 19314 1 114 . 1 1 21 21 LYS H H 1 8.038 0.02 . 1 . . . . 21 LYS H . 19314 1 115 . 1 1 21 21 LYS HA H 1 4.222 0.02 . 1 . . . . 21 LYS HA . 19314 1 116 . 1 1 21 21 LYS HB2 H 1 2.120 0.02 . 2 . . . . 21 LYS HB2 . 19314 1 117 . 1 1 21 21 LYS HB3 H 1 1.750 0.02 . 2 . . . . 21 LYS HB3 . 19314 1 118 . 1 1 21 21 LYS HG2 H 1 1.592 0.02 . 1 . . . . 21 LYS HG2 . 19314 1 119 . 1 1 21 21 LYS HG3 H 1 1.592 0.02 . 1 . . . . 21 LYS HG3 . 19314 1 120 . 1 1 21 21 LYS HD2 H 1 1.763 0.02 . 1 . . . . 21 LYS HD2 . 19314 1 121 . 1 1 21 21 LYS HD3 H 1 1.763 0.02 . 1 . . . . 21 LYS HD3 . 19314 1 122 . 1 1 21 21 LYS HE2 H 1 2.978 0.02 . 1 . . . . 21 LYS HE2 . 19314 1 123 . 1 1 21 21 LYS HE3 H 1 2.978 0.02 . 1 . . . . 21 LYS HE3 . 19314 1 124 . 1 1 21 21 LYS C C 13 181.212 0.4 . 1 . . . . 21 LYS C . 19314 1 125 . 1 1 21 21 LYS CA C 13 59.186 0.4 . 1 . . . . 21 LYS CA . 19314 1 126 . 1 1 21 21 LYS CB C 13 33.541 0.4 . 1 . . . . 21 LYS CB . 19314 1 127 . 1 1 21 21 LYS CG C 13 25.619 0.4 . 1 . . . . 21 LYS CG . 19314 1 128 . 1 1 21 21 LYS CD C 13 29.317 0.4 . 1 . . . . 21 LYS CD . 19314 1 129 . 1 1 21 21 LYS CE C 13 42.025 0.4 . 1 . . . . 21 LYS CE . 19314 1 130 . 1 1 21 21 LYS N N 15 117.785 0.4 . 1 . . . . 21 LYS N . 19314 1 131 . 1 1 22 22 LEU H H 1 8.889 0.02 . 1 . . . . 22 LEU H . 19314 1 132 . 1 1 22 22 LEU HA H 1 4.137 0.02 . 1 . . . . 22 LEU HA . 19314 1 133 . 1 1 22 22 LEU HB2 H 1 1.375 0.02 . 1 . . . . 22 LEU HB2 . 19314 1 134 . 1 1 22 22 LEU HB3 H 1 1.375 0.02 . 1 . . . . 22 LEU HB3 . 19314 1 135 . 1 1 22 22 LEU HG H 1 1.832 0.02 . 1 . . . . 22 LEU HG . 19314 1 136 . 1 1 22 22 LEU HD11 H 1 0.889 0.02 . 1 . . . . 22 LEU HD1 . 19314 1 137 . 1 1 22 22 LEU HD12 H 1 0.889 0.02 . 1 . . . . 22 LEU HD1 . 19314 1 138 . 1 1 22 22 LEU HD13 H 1 0.889 0.02 . 1 . . . . 22 LEU HD1 . 19314 1 139 . 1 1 22 22 LEU HD21 H 1 0.807 0.02 . 1 . . . . 22 LEU HD2 . 19314 1 140 . 1 1 22 22 LEU HD22 H 1 0.807 0.02 . 1 . . . . 22 LEU HD2 . 19314 1 141 . 1 1 22 22 LEU HD23 H 1 0.807 0.02 . 1 . . . . 22 LEU HD2 . 19314 1 142 . 1 1 22 22 LEU C C 13 179.292 0.4 . 1 . . . . 22 LEU C . 19314 1 143 . 1 1 22 22 LEU CA C 13 57.978 0.4 . 1 . . . . 22 LEU CA . 19314 1 144 . 1 1 22 22 LEU CB C 13 43.036 0.4 . 1 . . . . 22 LEU CB . 19314 1 145 . 1 1 22 22 LEU CG C 13 26.979 0.4 . 1 . . . . 22 LEU CG . 19314 1 146 . 1 1 22 22 LEU CD1 C 13 26.102 0.4 . 1 . . . . 22 LEU CD1 . 19314 1 147 . 1 1 22 22 LEU CD2 C 13 23.070 0.4 . 1 . . . . 22 LEU CD2 . 19314 1 148 . 1 1 22 22 LEU N N 15 121.972 0.4 . 1 . . . . 22 LEU N . 19314 1 149 . 1 1 23 23 ARG H H 1 8.649 0.02 . 1 . . . . 23 ARG H . 19314 1 150 . 1 1 23 23 ARG HA H 1 3.948 0.02 . 1 . . . . 23 ARG HA . 19314 1 151 . 1 1 23 23 ARG HB2 H 1 2.019 0.02 . 1 . . . . 23 ARG HB2 . 19314 1 152 . 1 1 23 23 ARG HB3 H 1 2.019 0.02 . 1 . . . . 23 ARG HB3 . 19314 1 153 . 1 1 23 23 ARG HG2 H 1 1.895 0.02 . 1 . . . . 23 ARG HG2 . 19314 1 154 . 1 1 23 23 ARG HG3 H 1 1.895 0.02 . 1 . . . . 23 ARG HG3 . 19314 1 155 . 1 1 23 23 ARG HD2 H 1 3.209 0.02 . 1 . . . . 23 ARG HD2 . 19314 1 156 . 1 1 23 23 ARG HD3 H 1 3.209 0.02 . 1 . . . . 23 ARG HD3 . 19314 1 157 . 1 1 23 23 ARG C C 13 178.821 0.4 . 1 . . . . 23 ARG C . 19314 1 158 . 1 1 23 23 ARG CA C 13 60.030 0.4 . 1 . . . . 23 ARG CA . 19314 1 159 . 1 1 23 23 ARG CB C 13 29.696 0.4 . 1 . . . . 23 ARG CB . 19314 1 160 . 1 1 23 23 ARG CG C 13 28.193 0.4 . 1 . . . . 23 ARG CG . 19314 1 161 . 1 1 23 23 ARG CD C 13 43.208 0.4 . 1 . . . . 23 ARG CD . 19314 1 162 . 1 1 23 23 ARG N N 15 122.828 0.4 . 1 . . . . 23 ARG N . 19314 1 163 . 1 1 24 24 ASP H H 1 8.322 0.02 . 1 . . . . 24 ASP H . 19314 1 164 . 1 1 24 24 ASP HA H 1 4.379 0.02 . 1 . . . . 24 ASP HA . 19314 1 165 . 1 1 24 24 ASP HB2 H 1 2.724 0.02 . 2 . . . . 24 ASP HB2 . 19314 1 166 . 1 1 24 24 ASP HB3 H 1 2.829 0.02 . 2 . . . . 24 ASP HB3 . 19314 1 167 . 1 1 24 24 ASP C C 13 178.157 0.4 . 1 . . . . 24 ASP C . 19314 1 168 . 1 1 24 24 ASP CA C 13 57.301 0.4 . 1 . . . . 24 ASP CA . 19314 1 169 . 1 1 24 24 ASP CB C 13 40.267 0.4 . 1 . . . . 24 ASP CB . 19314 1 170 . 1 1 24 24 ASP N N 15 119.701 0.4 . 1 . . . . 24 ASP N . 19314 1 171 . 1 1 25 25 PHE H H 1 8.401 0.02 . 1 . . . . 25 PHE H . 19314 1 172 . 1 1 25 25 PHE HA H 1 4.323 0.02 . 1 . . . . 25 PHE HA . 19314 1 173 . 1 1 25 25 PHE HB2 H 1 3.456 0.02 . 2 . . . . 25 PHE HB2 . 19314 1 174 . 1 1 25 25 PHE HB3 H 1 3.344 0.02 . 2 . . . . 25 PHE HB3 . 19314 1 175 . 1 1 25 25 PHE HD1 H 1 7.253 0.02 . 1 . . . . 25 PHE HD1 . 19314 1 176 . 1 1 25 25 PHE HD2 H 1 7.253 0.02 . 1 . . . . 25 PHE HD2 . 19314 1 177 . 1 1 25 25 PHE HE1 H 1 7.124 0.02 . 1 . . . . 25 PHE HE1 . 19314 1 178 . 1 1 25 25 PHE HE2 H 1 7.124 0.02 . 1 . . . . 25 PHE HE2 . 19314 1 179 . 1 1 25 25 PHE HZ H 1 7.212 0.02 . 1 . . . . 25 PHE HZ . 19314 1 180 . 1 1 25 25 PHE C C 13 176.430 0.4 . 1 . . . . 25 PHE C . 19314 1 181 . 1 1 25 25 PHE CA C 13 61.304 0.4 . 1 . . . . 25 PHE CA . 19314 1 182 . 1 1 25 25 PHE CB C 13 40.141 0.4 . 1 . . . . 25 PHE CB . 19314 1 183 . 1 1 25 25 PHE CD1 C 13 131.476 0.4 . 1 . . . . 25 PHE CD1 . 19314 1 184 . 1 1 25 25 PHE CD2 C 13 131.476 0.4 . 1 . . . . 25 PHE CD2 . 19314 1 185 . 1 1 25 25 PHE CE1 C 13 132.340 0.4 . 1 . . . . 25 PHE CE1 . 19314 1 186 . 1 1 25 25 PHE CE2 C 13 132.340 0.4 . 1 . . . . 25 PHE CE2 . 19314 1 187 . 1 1 25 25 PHE CZ C 13 130.749 0.4 . 1 . . . . 25 PHE CZ . 19314 1 188 . 1 1 25 25 PHE N N 15 122.005 0.4 . 1 . . . . 25 PHE N . 19314 1 189 . 1 1 26 26 THR H H 1 8.478 0.02 . 1 . . . . 26 THR H . 19314 1 190 . 1 1 26 26 THR HA H 1 3.850 0.02 . 1 . . . . 26 THR HA . 19314 1 191 . 1 1 26 26 THR HB H 1 4.245 0.02 . 1 . . . . 26 THR HB . 19314 1 192 . 1 1 26 26 THR HG1 H 1 4.758 0.02 . 1 . . . . 26 THR HG1 . 19314 1 193 . 1 1 26 26 THR HG21 H 1 1.472 0.02 . 1 . . . . 26 THR HG2 . 19314 1 194 . 1 1 26 26 THR HG22 H 1 1.472 0.02 . 1 . . . . 26 THR HG2 . 19314 1 195 . 1 1 26 26 THR HG23 H 1 1.472 0.02 . 1 . . . . 26 THR HG2 . 19314 1 196 . 1 1 26 26 THR C C 13 175.828 0.4 . 1 . . . . 26 THR C . 19314 1 197 . 1 1 26 26 THR CA C 13 65.624 0.4 . 1 . . . . 26 THR CA . 19314 1 198 . 1 1 26 26 THR CB C 13 68.479 0.4 . 1 . . . . 26 THR CB . 19314 1 199 . 1 1 26 26 THR CG2 C 13 23.453 0.4 . 1 . . . . 26 THR CG2 . 19314 1 200 . 1 1 26 26 THR N N 15 109.582 0.4 . 1 . . . . 26 THR N . 19314 1 201 . 1 1 27 27 ARG H H 1 7.765 0.02 . 1 . . . . 27 ARG H . 19314 1 202 . 1 1 27 27 ARG HA H 1 4.130 0.02 . 1 . . . . 27 ARG HA . 19314 1 203 . 1 1 27 27 ARG HB2 H 1 1.902 0.02 . 1 . . . . 27 ARG HB2 . 19314 1 204 . 1 1 27 27 ARG HB3 H 1 1.902 0.02 . 1 . . . . 27 ARG HB3 . 19314 1 205 . 1 1 27 27 ARG HG2 H 1 1.741 0.02 . 2 . . . . 27 ARG HG2 . 19314 1 206 . 1 1 27 27 ARG HG3 H 1 1.606 0.02 . 2 . . . . 27 ARG HG3 . 19314 1 207 . 1 1 27 27 ARG HD2 H 1 3.213 0.02 . 1 . . . . 27 ARG HD2 . 19314 1 208 . 1 1 27 27 ARG HD3 H 1 3.213 0.02 . 1 . . . . 27 ARG HD3 . 19314 1 209 . 1 1 27 27 ARG C C 13 178.433 0.4 . 1 . . . . 27 ARG C . 19314 1 210 . 1 1 27 27 ARG CA C 13 58.214 0.4 . 1 . . . . 27 ARG CA . 19314 1 211 . 1 1 27 27 ARG CB C 13 30.113 0.4 . 1 . . . . 27 ARG CB . 19314 1 212 . 1 1 27 27 ARG CG C 13 27.022 0.4 . 1 . . . . 27 ARG CG . 19314 1 213 . 1 1 27 27 ARG CD C 13 43.105 0.4 . 1 . . . . 27 ARG CD . 19314 1 214 . 1 1 27 27 ARG N N 15 119.629 0.4 . 1 . . . . 27 ARG N . 19314 1 215 . 1 1 28 28 ALA H H 1 7.819 0.02 . 1 . . . . 28 ALA H . 19314 1 216 . 1 1 28 28 ALA HA H 1 3.865 0.02 . 1 . . . . 28 ALA HA . 19314 1 217 . 1 1 28 28 ALA HB1 H 1 0.651 0.02 . 1 . . . . 28 ALA HB . 19314 1 218 . 1 1 28 28 ALA HB2 H 1 0.651 0.02 . 1 . . . . 28 ALA HB . 19314 1 219 . 1 1 28 28 ALA HB3 H 1 0.651 0.02 . 1 . . . . 28 ALA HB . 19314 1 220 . 1 1 28 28 ALA C C 13 179.416 0.4 . 1 . . . . 28 ALA C . 19314 1 221 . 1 1 28 28 ALA CA C 13 54.036 0.4 . 1 . . . . 28 ALA CA . 19314 1 222 . 1 1 28 28 ALA CB C 13 17.734 0.4 . 1 . . . . 28 ALA CB . 19314 1 223 . 1 1 28 28 ALA N N 15 119.042 0.4 . 1 . . . . 28 ALA N . 19314 1 224 . 1 1 29 29 TYR H H 1 7.191 0.02 . 1 . . . . 29 TYR H . 19314 1 225 . 1 1 29 29 TYR HA H 1 4.117 0.02 . 1 . . . . 29 TYR HA . 19314 1 226 . 1 1 29 29 TYR HB2 H 1 3.135 0.02 . 1 . . . . 29 TYR HB2 . 19314 1 227 . 1 1 29 29 TYR HB3 H 1 3.135 0.02 . 1 . . . . 29 TYR HB3 . 19314 1 228 . 1 1 29 29 TYR HD1 H 1 6.551 0.02 . 1 . . . . 29 TYR HD1 . 19314 1 229 . 1 1 29 29 TYR HD2 H 1 6.551 0.02 . 1 . . . . 29 TYR HD2 . 19314 1 230 . 1 1 29 29 TYR HE1 H 1 6.698 0.02 . 1 . . . . 29 TYR HE1 . 19314 1 231 . 1 1 29 29 TYR HE2 H 1 6.698 0.02 . 1 . . . . 29 TYR HE2 . 19314 1 232 . 1 1 29 29 TYR C C 13 174.622 0.4 . 1 . . . . 29 TYR C . 19314 1 233 . 1 1 29 29 TYR CA C 13 56.311 0.4 . 1 . . . . 29 TYR CA . 19314 1 234 . 1 1 29 29 TYR CB C 13 39.212 0.4 . 1 . . . . 29 TYR CB . 19314 1 235 . 1 1 29 29 TYR CD1 C 13 133.590 0.4 . 1 . . . . 29 TYR CD1 . 19314 1 236 . 1 1 29 29 TYR CD2 C 13 133.590 0.4 . 1 . . . . 29 TYR CD2 . 19314 1 237 . 1 1 29 29 TYR CE1 C 13 117.049 0.4 . 1 . . . . 29 TYR CE1 . 19314 1 238 . 1 1 29 29 TYR CE2 C 13 117.049 0.4 . 1 . . . . 29 TYR CE2 . 19314 1 239 . 1 1 29 29 TYR N N 15 110.392 0.4 . 1 . . . . 29 TYR N . 19314 1 240 . 1 1 30 30 GLU H H 1 7.487 0.02 . 1 . . . . 30 GLU H . 19314 1 241 . 1 1 30 30 GLU HA H 1 4.357 0.02 . 1 . . . . 30 GLU HA . 19314 1 242 . 1 1 30 30 GLU HB2 H 1 2.281 0.02 . 1 . . . . 30 GLU HB2 . 19314 1 243 . 1 1 30 30 GLU HB3 H 1 2.281 0.02 . 1 . . . . 30 GLU HB3 . 19314 1 244 . 1 1 30 30 GLU HG2 H 1 2.516 0.02 . 2 . . . . 30 GLU HG2 . 19314 1 245 . 1 1 30 30 GLU HG3 H 1 2.135 0.02 . 2 . . . . 30 GLU HG3 . 19314 1 246 . 1 1 30 30 GLU CA C 13 54.973 0.4 . 1 . . . . 30 GLU CA . 19314 1 247 . 1 1 30 30 GLU CB C 13 27.404 0.4 . 1 . . . . 30 GLU CB . 19314 1 248 . 1 1 30 30 GLU CG C 13 34.661 0.4 . 1 . . . . 30 GLU CG . 19314 1 249 . 1 1 30 30 GLU N N 15 120.854 0.4 . 1 . . . . 30 GLU N . 19314 1 250 . 1 1 31 31 PRO HA H 1 4.390 0.02 . 1 . . . . 31 PRO HA . 19314 1 251 . 1 1 31 31 PRO HB2 H 1 2.287 0.02 . 2 . . . . 31 PRO HB2 . 19314 1 252 . 1 1 31 31 PRO HB3 H 1 1.879 0.02 . 2 . . . . 31 PRO HB3 . 19314 1 253 . 1 1 31 31 PRO HG2 H 1 2.029 0.02 . 1 . . . . 31 PRO HG2 . 19314 1 254 . 1 1 31 31 PRO HG3 H 1 2.029 0.02 . 1 . . . . 31 PRO HG3 . 19314 1 255 . 1 1 31 31 PRO HD2 H 1 3.699 0.02 . 2 . . . . 31 PRO HD2 . 19314 1 256 . 1 1 31 31 PRO HD3 H 1 3.414 0.02 . 2 . . . . 31 PRO HD3 . 19314 1 257 . 1 1 31 31 PRO CA C 13 63.515 0.4 . 1 . . . . 31 PRO CA . 19314 1 258 . 1 1 31 31 PRO CB C 13 31.905 0.4 . 1 . . . . 31 PRO CB . 19314 1 259 . 1 1 31 31 PRO CG C 13 27.362 0.4 . 1 . . . . 31 PRO CG . 19314 1 260 . 1 1 31 31 PRO CD C 13 50.275 0.4 . 1 . . . . 31 PRO CD . 19314 1 261 . 1 1 32 32 ASP H H 1 8.776 0.02 . 1 . . . . 32 ASP H . 19314 1 262 . 1 1 32 32 ASP HA H 1 4.579 0.02 . 1 . . . . 32 ASP HA . 19314 1 263 . 1 1 32 32 ASP HB2 H 1 2.759 0.02 . 2 . . . . 32 ASP HB2 . 19314 1 264 . 1 1 32 32 ASP HB3 H 1 2.651 0.02 . 2 . . . . 32 ASP HB3 . 19314 1 265 . 1 1 32 32 ASP C C 13 177.288 0.4 . 1 . . . . 32 ASP C . 19314 1 266 . 1 1 32 32 ASP CA C 13 55.743 0.4 . 1 . . . . 32 ASP CA . 19314 1 267 . 1 1 32 32 ASP CB C 13 40.510 0.4 . 1 . . . . 32 ASP CB . 19314 1 268 . 1 1 32 32 ASP N N 15 115.549 0.4 . 1 . . . . 32 ASP N . 19314 1 269 . 1 1 33 33 SER H H 1 8.450 0.02 . 1 . . . . 33 SER H . 19314 1 270 . 1 1 33 33 SER HA H 1 4.520 0.02 . 1 . . . . 33 SER HA . 19314 1 271 . 1 1 33 33 SER HB2 H 1 3.976 0.02 . 2 . . . . 33 SER HB2 . 19314 1 272 . 1 1 33 33 SER HB3 H 1 3.857 0.02 . 2 . . . . 33 SER HB3 . 19314 1 273 . 1 1 33 33 SER C C 13 173.798 0.4 . 1 . . . . 33 SER C . 19314 1 274 . 1 1 33 33 SER CA C 13 59.163 0.4 . 1 . . . . 33 SER CA . 19314 1 275 . 1 1 33 33 SER CB C 13 64.521 0.4 . 1 . . . . 33 SER CB . 19314 1 276 . 1 1 33 33 SER N N 15 115.211 0.4 . 1 . . . . 33 SER N . 19314 1 277 . 1 1 34 34 VAL H H 1 7.405 0.02 . 1 . . . . 34 VAL H . 19314 1 278 . 1 1 34 34 VAL HA H 1 4.536 0.02 . 1 . . . . 34 VAL HA . 19314 1 279 . 1 1 34 34 VAL HB H 1 2.179 0.02 . 1 . . . . 34 VAL HB . 19314 1 280 . 1 1 34 34 VAL HG11 H 1 1.027 0.02 . 1 . . . . 34 VAL HG1 . 19314 1 281 . 1 1 34 34 VAL HG12 H 1 1.027 0.02 . 1 . . . . 34 VAL HG1 . 19314 1 282 . 1 1 34 34 VAL HG13 H 1 1.027 0.02 . 1 . . . . 34 VAL HG1 . 19314 1 283 . 1 1 34 34 VAL HG21 H 1 0.914 0.02 . 1 . . . . 34 VAL HG2 . 19314 1 284 . 1 1 34 34 VAL HG22 H 1 0.914 0.02 . 1 . . . . 34 VAL HG2 . 19314 1 285 . 1 1 34 34 VAL HG23 H 1 0.914 0.02 . 1 . . . . 34 VAL HG2 . 19314 1 286 . 1 1 34 34 VAL C C 13 174.965 0.4 . 1 . . . . 34 VAL C . 19314 1 287 . 1 1 34 34 VAL CA C 13 59.457 0.4 . 1 . . . . 34 VAL CA . 19314 1 288 . 1 1 34 34 VAL CB C 13 34.614 0.4 . 1 . . . . 34 VAL CB . 19314 1 289 . 1 1 34 34 VAL CG1 C 13 22.297 0.4 . 1 . . . . 34 VAL CG1 . 19314 1 290 . 1 1 34 34 VAL CG2 C 13 19.631 0.4 . 1 . . . . 34 VAL CG2 . 19314 1 291 . 1 1 34 34 VAL N N 15 115.417 0.4 . 1 . . . . 34 VAL N . 19314 1 292 . 1 1 35 35 LEU H H 1 7.959 0.02 . 1 . . . . 35 LEU H . 19314 1 293 . 1 1 35 35 LEU HA H 1 4.439 0.02 . 1 . . . . 35 LEU HA . 19314 1 294 . 1 1 35 35 LEU HB2 H 1 1.467 0.02 . 1 . . . . 35 LEU HB2 . 19314 1 295 . 1 1 35 35 LEU HB3 H 1 1.467 0.02 . 1 . . . . 35 LEU HB3 . 19314 1 296 . 1 1 35 35 LEU HG H 1 1.651 0.02 . 1 . . . . 35 LEU HG . 19314 1 297 . 1 1 35 35 LEU HD11 H 1 0.904 0.02 . 1 . . . . 35 LEU HD1 . 19314 1 298 . 1 1 35 35 LEU HD12 H 1 0.904 0.02 . 1 . . . . 35 LEU HD1 . 19314 1 299 . 1 1 35 35 LEU HD13 H 1 0.904 0.02 . 1 . . . . 35 LEU HD1 . 19314 1 300 . 1 1 35 35 LEU HD21 H 1 0.870 0.02 . 1 . . . . 35 LEU HD2 . 19314 1 301 . 1 1 35 35 LEU HD22 H 1 0.870 0.02 . 1 . . . . 35 LEU HD2 . 19314 1 302 . 1 1 35 35 LEU HD23 H 1 0.870 0.02 . 1 . . . . 35 LEU HD2 . 19314 1 303 . 1 1 35 35 LEU CA C 13 53.381 0.4 . 1 . . . . 35 LEU CA . 19314 1 304 . 1 1 35 35 LEU CB C 13 40.941 0.4 . 1 . . . . 35 LEU CB . 19314 1 305 . 1 1 35 35 LEU CG C 13 26.615 0.4 . 1 . . . . 35 LEU CG . 19314 1 306 . 1 1 35 35 LEU CD1 C 13 25.067 0.4 . 1 . . . . 35 LEU CD1 . 19314 1 307 . 1 1 35 35 LEU CD2 C 13 23.446 0.4 . 1 . . . . 35 LEU CD2 . 19314 1 308 . 1 1 35 35 LEU N N 15 123.375 0.4 . 1 . . . . 35 LEU N . 19314 1 309 . 1 1 36 36 PRO HA H 1 4.488 0.02 . 1 . . . . 36 PRO HA . 19314 1 310 . 1 1 36 36 PRO HB2 H 1 2.294 0.02 . 2 . . . . 36 PRO HB2 . 19314 1 311 . 1 1 36 36 PRO HB3 H 1 1.837 0.02 . 2 . . . . 36 PRO HB3 . 19314 1 312 . 1 1 36 36 PRO HG2 H 1 2.029 0.02 . 1 . . . . 36 PRO HG2 . 19314 1 313 . 1 1 36 36 PRO HG3 H 1 2.029 0.02 . 1 . . . . 36 PRO HG3 . 19314 1 314 . 1 1 36 36 PRO HD2 H 1 3.821 0.02 . 2 . . . . 36 PRO HD2 . 19314 1 315 . 1 1 36 36 PRO HD3 H 1 3.574 0.02 . 2 . . . . 36 PRO HD3 . 19314 1 316 . 1 1 36 36 PRO C C 13 177.096 0.4 . 1 . . . . 36 PRO C . 19314 1 317 . 1 1 36 36 PRO CA C 13 62.625 0.4 . 1 . . . . 36 PRO CA . 19314 1 318 . 1 1 36 36 PRO CB C 13 31.972 0.4 . 1 . . . . 36 PRO CB . 19314 1 319 . 1 1 36 36 PRO CG C 13 27.290 0.4 . 1 . . . . 36 PRO CG . 19314 1 320 . 1 1 36 36 PRO CD C 13 50.295 0.4 . 1 . . . . 36 PRO CD . 19314 1 321 . 1 1 37 37 LEU H H 1 8.445 0.02 . 1 . . . . 37 LEU H . 19314 1 322 . 1 1 37 37 LEU HA H 1 4.271 0.02 . 1 . . . . 37 LEU HA . 19314 1 323 . 1 1 37 37 LEU HB2 H 1 1.549 0.02 . 1 . . . . 37 LEU HB2 . 19314 1 324 . 1 1 37 37 LEU HB3 H 1 1.549 0.02 . 1 . . . . 37 LEU HB3 . 19314 1 325 . 1 1 37 37 LEU HG H 1 1.808 0.02 . 1 . . . . 37 LEU HG . 19314 1 326 . 1 1 37 37 LEU HD11 H 1 0.890 0.02 . 1 . . . . 37 LEU HD1 . 19314 1 327 . 1 1 37 37 LEU HD12 H 1 0.890 0.02 . 1 . . . . 37 LEU HD1 . 19314 1 328 . 1 1 37 37 LEU HD13 H 1 0.890 0.02 . 1 . . . . 37 LEU HD1 . 19314 1 329 . 1 1 37 37 LEU HD21 H 1 0.718 0.02 . 1 . . . . 37 LEU HD2 . 19314 1 330 . 1 1 37 37 LEU HD22 H 1 0.718 0.02 . 1 . . . . 37 LEU HD2 . 19314 1 331 . 1 1 37 37 LEU HD23 H 1 0.718 0.02 . 1 . . . . 37 LEU HD2 . 19314 1 332 . 1 1 37 37 LEU C C 13 179.278 0.4 . 1 . . . . 37 LEU C . 19314 1 333 . 1 1 37 37 LEU CA C 13 54.601 0.4 . 1 . . . . 37 LEU CA . 19314 1 334 . 1 1 37 37 LEU CB C 13 41.009 0.4 . 1 . . . . 37 LEU CB . 19314 1 335 . 1 1 37 37 LEU CG C 13 27.520 0.4 . 1 . . . . 37 LEU CG . 19314 1 336 . 1 1 37 37 LEU CD1 C 13 26.198 0.4 . 1 . . . . 37 LEU CD1 . 19314 1 337 . 1 1 37 37 LEU CD2 C 13 23.286 0.4 . 1 . . . . 37 LEU CD2 . 19314 1 338 . 1 1 37 37 LEU N N 15 123.795 0.4 . 1 . . . . 37 LEU N . 19314 1 339 . 1 1 38 38 ALA H H 1 8.063 0.02 . 1 . . . . 38 ALA H . 19314 1 340 . 1 1 38 38 ALA N N 15 124.879 0.4 . 1 . . . . 38 ALA N . 19314 1 341 . 1 1 40 40 GLY H H 1 8.501 0.02 . 1 . . . . 40 GLY H . 19314 1 342 . 1 1 40 40 GLY HA2 H 1 3.939 0.02 . 1 . . . . 40 GLY HA2 . 19314 1 343 . 1 1 40 40 GLY HA3 H 1 3.939 0.02 . 1 . . . . 40 GLY HA3 . 19314 1 344 . 1 1 40 40 GLY C C 13 177.071 0.4 . 1 . . . . 40 GLY C . 19314 1 345 . 1 1 40 40 GLY CA C 13 47.194 0.4 . 1 . . . . 40 GLY CA . 19314 1 346 . 1 1 40 40 GLY N N 15 109.692 0.4 . 1 . . . . 40 GLY N . 19314 1 347 . 1 1 41 41 VAL H H 1 7.972 0.02 . 1 . . . . 41 VAL H . 19314 1 348 . 1 1 41 41 VAL HA H 1 3.953 0.02 . 1 . . . . 41 VAL HA . 19314 1 349 . 1 1 41 41 VAL HB H 1 2.063 0.02 . 1 . . . . 41 VAL HB . 19314 1 350 . 1 1 41 41 VAL HG11 H 1 1.001 0.02 . 1 . . . . 41 VAL HG1 . 19314 1 351 . 1 1 41 41 VAL HG12 H 1 1.001 0.02 . 1 . . . . 41 VAL HG1 . 19314 1 352 . 1 1 41 41 VAL HG13 H 1 1.001 0.02 . 1 . . . . 41 VAL HG1 . 19314 1 353 . 1 1 41 41 VAL HG21 H 1 1.030 0.02 . 1 . . . . 41 VAL HG2 . 19314 1 354 . 1 1 41 41 VAL HG22 H 1 1.030 0.02 . 1 . . . . 41 VAL HG2 . 19314 1 355 . 1 1 41 41 VAL HG23 H 1 1.030 0.02 . 1 . . . . 41 VAL HG2 . 19314 1 356 . 1 1 41 41 VAL C C 13 178.432 0.4 . 1 . . . . 41 VAL C . 19314 1 357 . 1 1 41 41 VAL CA C 13 66.040 0.4 . 1 . . . . 41 VAL CA . 19314 1 358 . 1 1 41 41 VAL CB C 13 31.680 0.4 . 1 . . . . 41 VAL CB . 19314 1 359 . 1 1 41 41 VAL CG1 C 13 20.777 0.4 . 1 . . . . 41 VAL CG1 . 19314 1 360 . 1 1 41 41 VAL CG2 C 13 22.020 0.4 . 1 . . . . 41 VAL CG2 . 19314 1 361 . 1 1 41 41 VAL N N 15 123.473 0.4 . 1 . . . . 41 VAL N . 19314 1 362 . 1 1 42 42 LEU H H 1 8.449 0.02 . 1 . . . . 42 LEU H . 19314 1 363 . 1 1 42 42 LEU HA H 1 4.145 0.02 . 1 . . . . 42 LEU HA . 19314 1 364 . 1 1 42 42 LEU HB2 H 1 1.973 0.02 . 2 . . . . 42 LEU HB2 . 19314 1 365 . 1 1 42 42 LEU HB3 H 1 1.481 0.02 . 2 . . . . 42 LEU HB3 . 19314 1 366 . 1 1 42 42 LEU HG H 1 1.959 0.02 . 1 . . . . 42 LEU HG . 19314 1 367 . 1 1 42 42 LEU HD11 H 1 1.102 0.02 . 1 . . . . 42 LEU HD1 . 19314 1 368 . 1 1 42 42 LEU HD12 H 1 1.102 0.02 . 1 . . . . 42 LEU HD1 . 19314 1 369 . 1 1 42 42 LEU HD13 H 1 1.102 0.02 . 1 . . . . 42 LEU HD1 . 19314 1 370 . 1 1 42 42 LEU HD21 H 1 0.977 0.02 . 1 . . . . 42 LEU HD2 . 19314 1 371 . 1 1 42 42 LEU HD22 H 1 0.977 0.02 . 1 . . . . 42 LEU HD2 . 19314 1 372 . 1 1 42 42 LEU HD23 H 1 0.977 0.02 . 1 . . . . 42 LEU HD2 . 19314 1 373 . 1 1 42 42 LEU C C 13 178.883 0.4 . 1 . . . . 42 LEU C . 19314 1 374 . 1 1 42 42 LEU CA C 13 57.749 0.4 . 1 . . . . 42 LEU CA . 19314 1 375 . 1 1 42 42 LEU CB C 13 40.871 0.4 . 1 . . . . 42 LEU CB . 19314 1 376 . 1 1 42 42 LEU CG C 13 26.593 0.4 . 1 . . . . 42 LEU CG . 19314 1 377 . 1 1 42 42 LEU CD1 C 13 27.879 0.4 . 1 . . . . 42 LEU CD1 . 19314 1 378 . 1 1 42 42 LEU CD2 C 13 22.741 0.4 . 1 . . . . 42 LEU CD2 . 19314 1 379 . 1 1 42 42 LEU N N 15 119.328 0.4 . 1 . . . . 42 LEU N . 19314 1 380 . 1 1 43 43 SER H H 1 8.921 0.02 . 1 . . . . 43 SER H . 19314 1 381 . 1 1 43 43 SER HA H 1 4.402 0.02 . 1 . . . . 43 SER HA . 19314 1 382 . 1 1 43 43 SER HB2 H 1 3.895 0.02 . 2 . . . . 43 SER HB2 . 19314 1 383 . 1 1 43 43 SER HB3 H 1 4.078 0.02 . 2 . . . . 43 SER HB3 . 19314 1 384 . 1 1 43 43 SER C C 13 177.162 0.4 . 1 . . . . 43 SER C . 19314 1 385 . 1 1 43 43 SER CA C 13 61.507 0.4 . 1 . . . . 43 SER CA . 19314 1 386 . 1 1 43 43 SER CB C 13 62.801 0.4 . 1 . . . . 43 SER CB . 19314 1 387 . 1 1 43 43 SER N N 15 112.921 0.4 . 1 . . . . 43 SER N . 19314 1 388 . 1 1 44 44 PHE H H 1 7.841 0.02 . 1 . . . . 44 PHE H . 19314 1 389 . 1 1 44 44 PHE HA H 1 4.494 0.02 . 1 . . . . 44 PHE HA . 19314 1 390 . 1 1 44 44 PHE HB2 H 1 3.530 0.02 . 2 . . . . 44 PHE HB2 . 19314 1 391 . 1 1 44 44 PHE HB3 H 1 3.370 0.02 . 2 . . . . 44 PHE HB3 . 19314 1 392 . 1 1 44 44 PHE HD1 H 1 7.319 0.02 . 1 . . . . 44 PHE HD1 . 19314 1 393 . 1 1 44 44 PHE HD2 H 1 7.319 0.02 . 1 . . . . 44 PHE HD2 . 19314 1 394 . 1 1 44 44 PHE C C 13 177.955 0.4 . 1 . . . . 44 PHE C . 19314 1 395 . 1 1 44 44 PHE CA C 13 60.899 0.4 . 1 . . . . 44 PHE CA . 19314 1 396 . 1 1 44 44 PHE CB C 13 38.482 0.4 . 1 . . . . 44 PHE CB . 19314 1 397 . 1 1 44 44 PHE CD1 C 13 131.775 0.4 . 1 . . . . 44 PHE CD1 . 19314 1 398 . 1 1 44 44 PHE CD2 C 13 131.775 0.4 . 1 . . . . 44 PHE CD2 . 19314 1 399 . 1 1 44 44 PHE N N 15 122.641 0.4 . 1 . . . . 44 PHE N . 19314 1 400 . 1 1 45 45 ILE H H 1 8.674 0.02 . 1 . . . . 45 ILE H . 19314 1 401 . 1 1 45 45 ILE HA H 1 3.525 0.02 . 1 . . . . 45 ILE HA . 19314 1 402 . 1 1 45 45 ILE HB H 1 2.001 0.02 . 1 . . . . 45 ILE HB . 19314 1 403 . 1 1 45 45 ILE HG12 H 1 2.233 0.02 . 2 . . . . 45 ILE HG12 . 19314 1 404 . 1 1 45 45 ILE HG13 H 1 1.198 0.02 . 2 . . . . 45 ILE HG13 . 19314 1 405 . 1 1 45 45 ILE HG21 H 1 0.892 0.02 . 1 . . . . 45 ILE HG2 . 19314 1 406 . 1 1 45 45 ILE HG22 H 1 0.892 0.02 . 1 . . . . 45 ILE HG2 . 19314 1 407 . 1 1 45 45 ILE HG23 H 1 0.892 0.02 . 1 . . . . 45 ILE HG2 . 19314 1 408 . 1 1 45 45 ILE HD11 H 1 0.900 0.02 . 1 . . . . 45 ILE HD1 . 19314 1 409 . 1 1 45 45 ILE HD12 H 1 0.900 0.02 . 1 . . . . 45 ILE HD1 . 19314 1 410 . 1 1 45 45 ILE HD13 H 1 0.900 0.02 . 1 . . . . 45 ILE HD1 . 19314 1 411 . 1 1 45 45 ILE C C 13 177.166 0.4 . 1 . . . . 45 ILE C . 19314 1 412 . 1 1 45 45 ILE CA C 13 66.465 0.4 . 1 . . . . 45 ILE CA . 19314 1 413 . 1 1 45 45 ILE CB C 13 38.558 0.4 . 1 . . . . 45 ILE CB . 19314 1 414 . 1 1 45 45 ILE CG1 C 13 29.015 0.4 . 1 . . . . 45 ILE CG1 . 19314 1 415 . 1 1 45 45 ILE CG2 C 13 17.822 0.4 . 1 . . . . 45 ILE CG2 . 19314 1 416 . 1 1 45 45 ILE CD1 C 13 14.612 0.4 . 1 . . . . 45 ILE CD1 . 19314 1 417 . 1 1 45 45 ILE N N 15 121.438 0.4 . 1 . . . . 45 ILE N . 19314 1 418 . 1 1 46 46 HIS H H 1 8.923 0.02 . 1 . . . . 46 HIS H . 19314 1 419 . 1 1 46 46 HIS HA H 1 4.268 0.02 . 1 . . . . 46 HIS HA . 19314 1 420 . 1 1 46 46 HIS HB2 H 1 3.240 0.02 . 2 . . . . 46 HIS HB2 . 19314 1 421 . 1 1 46 46 HIS HB3 H 1 3.928 0.02 . 2 . . . . 46 HIS HB3 . 19314 1 422 . 1 1 46 46 HIS HE1 H 1 7.598 0.02 . 1 . . . . 46 HIS HE1 . 19314 1 423 . 1 1 46 46 HIS C C 13 176.820 0.4 . 1 . . . . 46 HIS C . 19314 1 424 . 1 1 46 46 HIS CA C 13 58.449 0.4 . 1 . . . . 46 HIS CA . 19314 1 425 . 1 1 46 46 HIS CB C 13 32.810 0.4 . 1 . . . . 46 HIS CB . 19314 1 426 . 1 1 46 46 HIS CE1 C 13 137.387 0.4 . 1 . . . . 46 HIS CE1 . 19314 1 427 . 1 1 46 46 HIS N N 15 119.825 0.4 . 1 . . . . 46 HIS N . 19314 1 428 . 1 1 47 47 HIS H H 1 8.232 0.02 . 1 . . . . 47 HIS H . 19314 1 429 . 1 1 47 47 HIS HA H 1 3.752 0.02 . 1 . . . . 47 HIS HA . 19314 1 430 . 1 1 47 47 HIS HB2 H 1 3.214 0.02 . 1 . . . . 47 HIS HB2 . 19314 1 431 . 1 1 47 47 HIS HB3 H 1 3.214 0.02 . 1 . . . . 47 HIS HB3 . 19314 1 432 . 1 1 47 47 HIS C C 13 178.190 0.4 . 1 . . . . 47 HIS C . 19314 1 433 . 1 1 47 47 HIS CA C 13 60.756 0.4 . 1 . . . . 47 HIS CA . 19314 1 434 . 1 1 47 47 HIS CB C 13 29.665 0.4 . 1 . . . . 47 HIS CB . 19314 1 435 . 1 1 47 47 HIS N N 15 116.358 0.4 . 1 . . . . 47 HIS N . 19314 1 436 . 1 1 48 48 GLN H H 1 8.443 0.02 . 1 . . . . 48 GLN H . 19314 1 437 . 1 1 48 48 GLN HA H 1 3.890 0.02 . 1 . . . . 48 GLN HA . 19314 1 438 . 1 1 48 48 GLN HB2 H 1 1.904 0.02 . 1 . . . . 48 GLN HB2 . 19314 1 439 . 1 1 48 48 GLN HB3 H 1 1.904 0.02 . 1 . . . . 48 GLN HB3 . 19314 1 440 . 1 1 48 48 GLN HG2 H 1 1.947 0.02 . 2 . . . . 48 GLN HG2 . 19314 1 441 . 1 1 48 48 GLN HG3 H 1 1.911 0.02 . 2 . . . . 48 GLN HG3 . 19314 1 442 . 1 1 48 48 GLN HE21 H 1 6.866 0.02 . 2 . . . . 48 GLN HE21 . 19314 1 443 . 1 1 48 48 GLN HE22 H 1 6.502 0.02 . 2 . . . . 48 GLN HE22 . 19314 1 444 . 1 1 48 48 GLN C C 13 178.515 0.4 . 1 . . . . 48 GLN C . 19314 1 445 . 1 1 48 48 GLN CA C 13 58.789 0.4 . 1 . . . . 48 GLN CA . 19314 1 446 . 1 1 48 48 GLN CB C 13 29.287 0.4 . 1 . . . . 48 GLN CB . 19314 1 447 . 1 1 48 48 GLN CG C 13 34.367 0.4 . 1 . . . . 48 GLN CG . 19314 1 448 . 1 1 48 48 GLN N N 15 119.152 0.4 . 1 . . . . 48 GLN N . 19314 1 449 . 1 1 48 48 GLN NE2 N 15 112.022 0.4 . 1 . . . . 48 GLN NE2 . 19314 1 450 . 1 1 49 49 ILE H H 1 8.788 0.02 . 1 . . . . 49 ILE H . 19314 1 451 . 1 1 49 49 ILE HA H 1 3.487 0.02 . 1 . . . . 49 ILE HA . 19314 1 452 . 1 1 49 49 ILE HB H 1 2.126 0.02 . 1 . . . . 49 ILE HB . 19314 1 453 . 1 1 49 49 ILE HG12 H 1 1.952 0.02 . 2 . . . . 49 ILE HG12 . 19314 1 454 . 1 1 49 49 ILE HG13 H 1 0.933 0.02 . 2 . . . . 49 ILE HG13 . 19314 1 455 . 1 1 49 49 ILE HG21 H 1 0.980 0.02 . 1 . . . . 49 ILE HG2 . 19314 1 456 . 1 1 49 49 ILE HG22 H 1 0.980 0.02 . 1 . . . . 49 ILE HG2 . 19314 1 457 . 1 1 49 49 ILE HG23 H 1 0.980 0.02 . 1 . . . . 49 ILE HG2 . 19314 1 458 . 1 1 49 49 ILE HD11 H 1 0.826 0.02 . 1 . . . . 49 ILE HD1 . 19314 1 459 . 1 1 49 49 ILE HD12 H 1 0.826 0.02 . 1 . . . . 49 ILE HD1 . 19314 1 460 . 1 1 49 49 ILE HD13 H 1 0.826 0.02 . 1 . . . . 49 ILE HD1 . 19314 1 461 . 1 1 49 49 ILE C C 13 177.429 0.4 . 1 . . . . 49 ILE C . 19314 1 462 . 1 1 49 49 ILE CA C 13 65.556 0.4 . 1 . . . . 49 ILE CA . 19314 1 463 . 1 1 49 49 ILE CB C 13 37.700 0.4 . 1 . . . . 49 ILE CB . 19314 1 464 . 1 1 49 49 ILE CG1 C 13 29.239 0.4 . 1 . . . . 49 ILE CG1 . 19314 1 465 . 1 1 49 49 ILE CG2 C 13 17.991 0.4 . 1 . . . . 49 ILE CG2 . 19314 1 466 . 1 1 49 49 ILE CD1 C 13 17.222 0.4 . 1 . . . . 49 ILE CD1 . 19314 1 467 . 1 1 49 49 ILE N N 15 119.692 0.4 . 1 . . . . 49 ILE N . 19314 1 468 . 1 1 50 50 ILE H H 1 7.654 0.02 . 1 . . . . 50 ILE H . 19314 1 469 . 1 1 50 50 ILE HA H 1 3.934 0.02 . 1 . . . . 50 ILE HA . 19314 1 470 . 1 1 50 50 ILE HB H 1 2.269 0.02 . 1 . . . . 50 ILE HB . 19314 1 471 . 1 1 50 50 ILE HG12 H 1 2.037 0.02 . 2 . . . . 50 ILE HG12 . 19314 1 472 . 1 1 50 50 ILE HG13 H 1 1.339 0.02 . 2 . . . . 50 ILE HG13 . 19314 1 473 . 1 1 50 50 ILE HG21 H 1 0.952 0.02 . 1 . . . . 50 ILE HG2 . 19314 1 474 . 1 1 50 50 ILE HG22 H 1 0.952 0.02 . 1 . . . . 50 ILE HG2 . 19314 1 475 . 1 1 50 50 ILE HG23 H 1 0.952 0.02 . 1 . . . . 50 ILE HG2 . 19314 1 476 . 1 1 50 50 ILE HD11 H 1 0.680 0.02 . 1 . . . . 50 ILE HD1 . 19314 1 477 . 1 1 50 50 ILE HD12 H 1 0.680 0.02 . 1 . . . . 50 ILE HD1 . 19314 1 478 . 1 1 50 50 ILE HD13 H 1 0.680 0.02 . 1 . . . . 50 ILE HD1 . 19314 1 479 . 1 1 50 50 ILE C C 13 178.080 0.4 . 1 . . . . 50 ILE C . 19314 1 480 . 1 1 50 50 ILE CA C 13 61.941 0.4 . 1 . . . . 50 ILE CA . 19314 1 481 . 1 1 50 50 ILE CB C 13 34.261 0.4 . 1 . . . . 50 ILE CB . 19314 1 482 . 1 1 50 50 ILE CG1 C 13 27.105 0.4 . 1 . . . . 50 ILE CG1 . 19314 1 483 . 1 1 50 50 ILE CG2 C 13 17.210 0.4 . 1 . . . . 50 ILE CG2 . 19314 1 484 . 1 1 50 50 ILE CD1 C 13 8.937 0.4 . 1 . . . . 50 ILE CD1 . 19314 1 485 . 1 1 50 50 ILE N N 15 118.036 0.4 . 1 . . . . 50 ILE N . 19314 1 486 . 1 1 51 51 GLU H H 1 8.212 0.02 . 1 . . . . 51 GLU H . 19314 1 487 . 1 1 51 51 GLU HA H 1 4.069 0.02 . 1 . . . . 51 GLU HA . 19314 1 488 . 1 1 51 51 GLU HB2 H 1 2.089 0.02 . 1 . . . . 51 GLU HB2 . 19314 1 489 . 1 1 51 51 GLU HB3 H 1 2.089 0.02 . 1 . . . . 51 GLU HB3 . 19314 1 490 . 1 1 51 51 GLU HG2 H 1 2.270 0.02 . 2 . . . . 51 GLU HG2 . 19314 1 491 . 1 1 51 51 GLU HG3 H 1 2.223 0.02 . 2 . . . . 51 GLU HG3 . 19314 1 492 . 1 1 51 51 GLU C C 13 179.960 0.4 . 1 . . . . 51 GLU C . 19314 1 493 . 1 1 51 51 GLU CA C 13 59.383 0.4 . 1 . . . . 51 GLU CA . 19314 1 494 . 1 1 51 51 GLU CB C 13 28.852 0.4 . 1 . . . . 51 GLU CB . 19314 1 495 . 1 1 51 51 GLU CG C 13 35.937 0.4 . 1 . . . . 51 GLU CG . 19314 1 496 . 1 1 51 51 GLU N N 15 120.185 0.4 . 1 . . . . 51 GLU N . 19314 1 497 . 1 1 52 52 LEU H H 1 8.554 0.02 . 1 . . . . 52 LEU H . 19314 1 498 . 1 1 52 52 LEU HA H 1 4.127 0.02 . 1 . . . . 52 LEU HA . 19314 1 499 . 1 1 52 52 LEU HB2 H 1 1.288 0.02 . 2 . . . . 52 LEU HB2 . 19314 1 500 . 1 1 52 52 LEU HB3 H 1 2.034 0.02 . 2 . . . . 52 LEU HB3 . 19314 1 501 . 1 1 52 52 LEU HG H 1 1.910 0.02 . 1 . . . . 52 LEU HG . 19314 1 502 . 1 1 52 52 LEU HD11 H 1 0.714 0.02 . 1 . . . . 52 LEU HD1 . 19314 1 503 . 1 1 52 52 LEU HD12 H 1 0.714 0.02 . 1 . . . . 52 LEU HD1 . 19314 1 504 . 1 1 52 52 LEU HD13 H 1 0.714 0.02 . 1 . . . . 52 LEU HD1 . 19314 1 505 . 1 1 52 52 LEU HD21 H 1 0.864 0.02 . 1 . . . . 52 LEU HD2 . 19314 1 506 . 1 1 52 52 LEU HD22 H 1 0.864 0.02 . 1 . . . . 52 LEU HD2 . 19314 1 507 . 1 1 52 52 LEU HD23 H 1 0.864 0.02 . 1 . . . . 52 LEU HD2 . 19314 1 508 . 1 1 52 52 LEU C C 13 179.673 0.4 . 1 . . . . 52 LEU C . 19314 1 509 . 1 1 52 52 LEU CA C 13 57.834 0.4 . 1 . . . . 52 LEU CA . 19314 1 510 . 1 1 52 52 LEU CB C 13 40.970 0.4 . 1 . . . . 52 LEU CB . 19314 1 511 . 1 1 52 52 LEU CG C 13 26.995 0.4 . 1 . . . . 52 LEU CG . 19314 1 512 . 1 1 52 52 LEU CD1 C 13 25.810 0.4 . 1 . . . . 52 LEU CD1 . 19314 1 513 . 1 1 52 52 LEU CD2 C 13 22.122 0.4 . 1 . . . . 52 LEU CD2 . 19314 1 514 . 1 1 52 52 LEU N N 15 121.518 0.4 . 1 . . . . 52 LEU N . 19314 1 515 . 1 1 53 53 ALA H H 1 8.282 0.02 . 1 . . . . 53 ALA H . 19314 1 516 . 1 1 53 53 ALA HA H 1 3.942 0.02 . 1 . . . . 53 ALA HA . 19314 1 517 . 1 1 53 53 ALA HB1 H 1 1.646 0.02 . 1 . . . . 53 ALA HB . 19314 1 518 . 1 1 53 53 ALA HB2 H 1 1.646 0.02 . 1 . . . . 53 ALA HB . 19314 1 519 . 1 1 53 53 ALA HB3 H 1 1.646 0.02 . 1 . . . . 53 ALA HB . 19314 1 520 . 1 1 53 53 ALA C C 13 179.347 0.4 . 1 . . . . 53 ALA C . 19314 1 521 . 1 1 53 53 ALA CA C 13 55.480 0.4 . 1 . . . . 53 ALA CA . 19314 1 522 . 1 1 53 53 ALA CB C 13 18.978 0.4 . 1 . . . . 53 ALA CB . 19314 1 523 . 1 1 53 53 ALA N N 15 122.249 0.4 . 1 . . . . 53 ALA N . 19314 1 524 . 1 1 54 54 ARG H H 1 8.686 0.02 . 1 . . . . 54 ARG H . 19314 1 525 . 1 1 54 54 ARG HA H 1 3.924 0.02 . 1 . . . . 54 ARG HA . 19314 1 526 . 1 1 54 54 ARG HB2 H 1 2.017 0.02 . 1 . . . . 54 ARG HB2 . 19314 1 527 . 1 1 54 54 ARG HB3 H 1 2.017 0.02 . 1 . . . . 54 ARG HB3 . 19314 1 528 . 1 1 54 54 ARG HG2 H 1 1.896 0.02 . 2 . . . . 54 ARG HG2 . 19314 1 529 . 1 1 54 54 ARG HG3 H 1 1.518 0.02 . 2 . . . . 54 ARG HG3 . 19314 1 530 . 1 1 54 54 ARG HD2 H 1 3.266 0.02 . 1 . . . . 54 ARG HD2 . 19314 1 531 . 1 1 54 54 ARG HD3 H 1 3.266 0.02 . 1 . . . . 54 ARG HD3 . 19314 1 532 . 1 1 54 54 ARG C C 13 177.350 0.4 . 1 . . . . 54 ARG C . 19314 1 533 . 1 1 54 54 ARG CA C 13 60.031 0.4 . 1 . . . . 54 ARG CA . 19314 1 534 . 1 1 54 54 ARG CB C 13 30.125 0.4 . 1 . . . . 54 ARG CB . 19314 1 535 . 1 1 54 54 ARG CG C 13 28.004 0.4 . 1 . . . . 54 ARG CG . 19314 1 536 . 1 1 54 54 ARG CD C 13 43.136 0.4 . 1 . . . . 54 ARG CD . 19314 1 537 . 1 1 54 54 ARG N N 15 117.448 0.4 . 1 . . . . 54 ARG N . 19314 1 538 . 1 1 55 55 ASP H H 1 8.517 0.02 . 1 . . . . 55 ASP H . 19314 1 539 . 1 1 55 55 ASP HA H 1 4.372 0.02 . 1 . . . . 55 ASP HA . 19314 1 540 . 1 1 55 55 ASP HB2 H 1 2.874 0.02 . 1 . . . . 55 ASP HB2 . 19314 1 541 . 1 1 55 55 ASP HB3 H 1 2.874 0.02 . 1 . . . . 55 ASP HB3 . 19314 1 542 . 1 1 55 55 ASP C C 13 176.782 0.4 . 1 . . . . 55 ASP C . 19314 1 543 . 1 1 55 55 ASP CA C 13 57.586 0.4 . 1 . . . . 55 ASP CA . 19314 1 544 . 1 1 55 55 ASP CB C 13 42.003 0.4 . 1 . . . . 55 ASP CB . 19314 1 545 . 1 1 55 55 ASP N N 15 121.167 0.4 . 1 . . . . 55 ASP N . 19314 1 546 . 1 1 56 56 CYS H H 1 8.351 0.02 . 1 . . . . 56 CYS H . 19314 1 547 . 1 1 56 56 CYS HA H 1 4.113 0.02 . 1 . . . . 56 CYS HA . 19314 1 548 . 1 1 56 56 CYS HB2 H 1 3.166 0.02 . 2 . . . . 56 CYS HB2 . 19314 1 549 . 1 1 56 56 CYS HB3 H 1 3.125 0.02 . 2 . . . . 56 CYS HB3 . 19314 1 550 . 1 1 56 56 CYS C C 13 176.424 0.4 . 1 . . . . 56 CYS C . 19314 1 551 . 1 1 56 56 CYS CA C 13 62.310 0.4 . 1 . . . . 56 CYS CA . 19314 1 552 . 1 1 56 56 CYS CB C 13 25.865 0.4 . 1 . . . . 56 CYS CB . 19314 1 553 . 1 1 56 56 CYS N N 15 120.225 0.4 . 1 . . . . 56 CYS N . 19314 1 554 . 1 1 57 57 LEU H H 1 8.100 0.02 . 1 . . . . 57 LEU H . 19314 1 555 . 1 1 57 57 LEU HA H 1 3.959 0.02 . 1 . . . . 57 LEU HA . 19314 1 556 . 1 1 57 57 LEU HB2 H 1 1.633 0.02 . 2 . . . . 57 LEU HB2 . 19314 1 557 . 1 1 57 57 LEU HB3 H 1 2.129 0.02 . 2 . . . . 57 LEU HB3 . 19314 1 558 . 1 1 57 57 LEU HG H 1 1.627 0.02 . 1 . . . . 57 LEU HG . 19314 1 559 . 1 1 57 57 LEU HD11 H 1 1.048 0.02 . 1 . . . . 57 LEU HD1 . 19314 1 560 . 1 1 57 57 LEU HD12 H 1 1.048 0.02 . 1 . . . . 57 LEU HD1 . 19314 1 561 . 1 1 57 57 LEU HD13 H 1 1.048 0.02 . 1 . . . . 57 LEU HD1 . 19314 1 562 . 1 1 57 57 LEU HD21 H 1 0.952 0.02 . 1 . . . . 57 LEU HD2 . 19314 1 563 . 1 1 57 57 LEU HD22 H 1 0.952 0.02 . 1 . . . . 57 LEU HD2 . 19314 1 564 . 1 1 57 57 LEU HD23 H 1 0.952 0.02 . 1 . . . . 57 LEU HD2 . 19314 1 565 . 1 1 57 57 LEU C C 13 178.068 0.4 . 1 . . . . 57 LEU C . 19314 1 566 . 1 1 57 57 LEU CA C 13 58.383 0.4 . 1 . . . . 57 LEU CA . 19314 1 567 . 1 1 57 57 LEU CB C 13 41.645 0.4 . 1 . . . . 57 LEU CB . 19314 1 568 . 1 1 57 57 LEU CG C 13 27.128 0.4 . 1 . . . . 57 LEU CG . 19314 1 569 . 1 1 57 57 LEU CD1 C 13 23.583 0.4 . 1 . . . . 57 LEU CD1 . 19314 1 570 . 1 1 57 57 LEU CD2 C 13 25.681 0.4 . 1 . . . . 57 LEU CD2 . 19314 1 571 . 1 1 57 57 LEU N N 15 120.137 0.4 . 1 . . . . 57 LEU N . 19314 1 572 . 1 1 58 58 THR H H 1 8.270 0.02 . 1 . . . . 58 THR H . 19314 1 573 . 1 1 58 58 THR HA H 1 3.755 0.02 . 1 . . . . 58 THR HA . 19314 1 574 . 1 1 58 58 THR HB H 1 4.310 0.02 . 1 . . . . 58 THR HB . 19314 1 575 . 1 1 58 58 THR HG21 H 1 1.214 0.02 . 1 . . . . 58 THR HG2 . 19314 1 576 . 1 1 58 58 THR HG22 H 1 1.214 0.02 . 1 . . . . 58 THR HG2 . 19314 1 577 . 1 1 58 58 THR HG23 H 1 1.214 0.02 . 1 . . . . 58 THR HG2 . 19314 1 578 . 1 1 58 58 THR C C 13 176.042 0.4 . 1 . . . . 58 THR C . 19314 1 579 . 1 1 58 58 THR CA C 13 66.492 0.4 . 1 . . . . 58 THR CA . 19314 1 580 . 1 1 58 58 THR CB C 13 68.481 0.4 . 1 . . . . 58 THR CB . 19314 1 581 . 1 1 58 58 THR CG2 C 13 21.854 0.4 . 1 . . . . 58 THR CG2 . 19314 1 582 . 1 1 58 58 THR N N 15 116.478 0.4 . 1 . . . . 58 THR N . 19314 1 583 . 1 1 59 59 LYS H H 1 8.575 0.02 . 1 . . . . 59 LYS H . 19314 1 584 . 1 1 59 59 LYS HA H 1 3.777 0.02 . 1 . . . . 59 LYS HA . 19314 1 585 . 1 1 59 59 LYS HB2 H 1 1.583 0.02 . 2 . . . . 59 LYS HB2 . 19314 1 586 . 1 1 59 59 LYS HB3 H 1 0.996 0.02 . 2 . . . . 59 LYS HB3 . 19314 1 587 . 1 1 59 59 LYS HG2 H 1 1.232 0.02 . 2 . . . . 59 LYS HG2 . 19314 1 588 . 1 1 59 59 LYS HG3 H 1 1.025 0.02 . 2 . . . . 59 LYS HG3 . 19314 1 589 . 1 1 59 59 LYS HD2 H 1 1.048 0.02 . 1 . . . . 59 LYS HD2 . 19314 1 590 . 1 1 59 59 LYS HD3 H 1 1.048 0.02 . 1 . . . . 59 LYS HD3 . 19314 1 591 . 1 1 59 59 LYS HE2 H 1 2.849 0.02 . 2 . . . . 59 LYS HE2 . 19314 1 592 . 1 1 59 59 LYS HE3 H 1 2.767 0.02 . 2 . . . . 59 LYS HE3 . 19314 1 593 . 1 1 59 59 LYS C C 13 179.018 0.4 . 1 . . . . 59 LYS C . 19314 1 594 . 1 1 59 59 LYS CA C 13 59.438 0.4 . 1 . . . . 59 LYS CA . 19314 1 595 . 1 1 59 59 LYS CB C 13 32.037 0.4 . 1 . . . . 59 LYS CB . 19314 1 596 . 1 1 59 59 LYS CG C 13 26.115 0.4 . 1 . . . . 59 LYS CG . 19314 1 597 . 1 1 59 59 LYS CD C 13 28.144 0.4 . 1 . . . . 59 LYS CD . 19314 1 598 . 1 1 59 59 LYS CE C 13 42.162 0.4 . 1 . . . . 59 LYS CE . 19314 1 599 . 1 1 59 59 LYS N N 15 120.541 0.4 . 1 . . . . 59 LYS N . 19314 1 600 . 1 1 60 60 SER H H 1 8.393 0.02 . 1 . . . . 60 SER H . 19314 1 601 . 1 1 60 60 SER HA H 1 4.037 0.02 . 1 . . . . 60 SER HA . 19314 1 602 . 1 1 60 60 SER HB2 H 1 4.143 0.02 . 1 . . . . 60 SER HB2 . 19314 1 603 . 1 1 60 60 SER HB3 H 1 4.143 0.02 . 1 . . . . 60 SER HB3 . 19314 1 604 . 1 1 60 60 SER HG H 1 3.814 0.02 . 1 . . . . 60 SER HG . 19314 1 605 . 1 1 60 60 SER C C 13 178.741 0.4 . 1 . . . . 60 SER C . 19314 1 606 . 1 1 60 60 SER CA C 13 61.673 0.4 . 1 . . . . 60 SER CA . 19314 1 607 . 1 1 60 60 SER CB C 13 62.947 0.4 . 1 . . . . 60 SER CB . 19314 1 608 . 1 1 60 60 SER N N 15 114.162 0.4 . 1 . . . . 60 SER N . 19314 1 609 . 1 1 61 61 ARG H H 1 8.267 0.02 . 1 . . . . 61 ARG H . 19314 1 610 . 1 1 61 61 ARG HA H 1 4.046 0.02 . 1 . . . . 61 ARG HA . 19314 1 611 . 1 1 61 61 ARG HB2 H 1 1.953 0.02 . 1 . . . . 61 ARG HB2 . 19314 1 612 . 1 1 61 61 ARG HB3 H 1 1.953 0.02 . 1 . . . . 61 ARG HB3 . 19314 1 613 . 1 1 61 61 ARG HG2 H 1 1.825 0.02 . 2 . . . . 61 ARG HG2 . 19314 1 614 . 1 1 61 61 ARG HG3 H 1 1.644 0.02 . 2 . . . . 61 ARG HG3 . 19314 1 615 . 1 1 61 61 ARG HD2 H 1 3.185 0.02 . 2 . . . . 61 ARG HD2 . 19314 1 616 . 1 1 61 61 ARG HD3 H 1 3.079 0.02 . 2 . . . . 61 ARG HD3 . 19314 1 617 . 1 1 61 61 ARG C C 13 178.559 0.4 . 1 . . . . 61 ARG C . 19314 1 618 . 1 1 61 61 ARG CA C 13 58.820 0.4 . 1 . . . . 61 ARG CA . 19314 1 619 . 1 1 61 61 ARG CB C 13 29.716 0.4 . 1 . . . . 61 ARG CB . 19314 1 620 . 1 1 61 61 ARG CG C 13 26.589 0.4 . 1 . . . . 61 ARG CG . 19314 1 621 . 1 1 61 61 ARG CD C 13 43.317 0.4 . 1 . . . . 61 ARG CD . 19314 1 622 . 1 1 61 61 ARG N N 15 121.639 0.4 . 1 . . . . 61 ARG N . 19314 1 623 . 1 1 62 62 ASP H H 1 8.003 0.02 . 1 . . . . 62 ASP H . 19314 1 624 . 1 1 62 62 ASP HA H 1 4.686 0.02 . 1 . . . . 62 ASP HA . 19314 1 625 . 1 1 62 62 ASP HB2 H 1 2.544 0.02 . 2 . . . . 62 ASP HB2 . 19314 1 626 . 1 1 62 62 ASP HB3 H 1 2.783 0.02 . 2 . . . . 62 ASP HB3 . 19314 1 627 . 1 1 62 62 ASP C C 13 176.478 0.4 . 1 . . . . 62 ASP C . 19314 1 628 . 1 1 62 62 ASP CA C 13 54.435 0.4 . 1 . . . . 62 ASP CA . 19314 1 629 . 1 1 62 62 ASP CB C 13 40.882 0.4 . 1 . . . . 62 ASP CB . 19314 1 630 . 1 1 62 62 ASP N N 15 116.627 0.4 . 1 . . . . 62 ASP N . 19314 1 631 . 1 1 63 63 GLY H H 1 7.879 0.02 . 1 . . . . 63 GLY H . 19314 1 632 . 1 1 63 63 GLY HA2 H 1 4.023 0.02 . 2 . . . . 63 GLY HA2 . 19314 1 633 . 1 1 63 63 GLY HA3 H 1 3.975 0.02 . 2 . . . . 63 GLY HA3 . 19314 1 634 . 1 1 63 63 GLY C C 13 175.829 0.4 . 1 . . . . 63 GLY C . 19314 1 635 . 1 1 63 63 GLY CA C 13 46.735 0.4 . 1 . . . . 63 GLY CA . 19314 1 636 . 1 1 63 63 GLY N N 15 109.533 0.4 . 1 . . . . 63 GLY N . 19314 1 637 . 1 1 64 64 LEU H H 1 8.346 0.02 . 1 . . . . 64 LEU H . 19314 1 638 . 1 1 64 64 LEU HA H 1 4.452 0.02 . 1 . . . . 64 LEU HA . 19314 1 639 . 1 1 64 64 LEU HB2 H 1 1.306 0.02 . 2 . . . . 64 LEU HB2 . 19314 1 640 . 1 1 64 64 LEU HB3 H 1 1.648 0.02 . 2 . . . . 64 LEU HB3 . 19314 1 641 . 1 1 64 64 LEU HG H 1 1.375 0.02 . 1 . . . . 64 LEU HG . 19314 1 642 . 1 1 64 64 LEU HD11 H 1 0.902 0.02 . 1 . . . . 64 LEU HD1 . 19314 1 643 . 1 1 64 64 LEU HD12 H 1 0.902 0.02 . 1 . . . . 64 LEU HD1 . 19314 1 644 . 1 1 64 64 LEU HD13 H 1 0.902 0.02 . 1 . . . . 64 LEU HD1 . 19314 1 645 . 1 1 64 64 LEU HD21 H 1 0.787 0.02 . 1 . . . . 64 LEU HD2 . 19314 1 646 . 1 1 64 64 LEU HD22 H 1 0.787 0.02 . 1 . . . . 64 LEU HD2 . 19314 1 647 . 1 1 64 64 LEU HD23 H 1 0.787 0.02 . 1 . . . . 64 LEU HD2 . 19314 1 648 . 1 1 64 64 LEU C C 13 176.711 0.4 . 1 . . . . 64 LEU C . 19314 1 649 . 1 1 64 64 LEU CA C 13 53.693 0.4 . 1 . . . . 64 LEU CA . 19314 1 650 . 1 1 64 64 LEU CB C 13 43.264 0.4 . 1 . . . . 64 LEU CB . 19314 1 651 . 1 1 64 64 LEU CG C 13 25.974 0.4 . 1 . . . . 64 LEU CG . 19314 1 652 . 1 1 64 64 LEU CD1 C 13 25.518 0.4 . 1 . . . . 64 LEU CD1 . 19314 1 653 . 1 1 64 64 LEU CD2 C 13 22.078 0.4 . 1 . . . . 64 LEU CD2 . 19314 1 654 . 1 1 64 64 LEU N N 15 118.282 0.4 . 1 . . . . 64 LEU N . 19314 1 655 . 1 1 65 65 ILE H H 1 7.727 0.02 . 1 . . . . 65 ILE H . 19314 1 656 . 1 1 65 65 ILE HA H 1 3.549 0.02 . 1 . . . . 65 ILE HA . 19314 1 657 . 1 1 65 65 ILE HB H 1 1.772 0.02 . 1 . . . . 65 ILE HB . 19314 1 658 . 1 1 65 65 ILE HG12 H 1 1.235 0.02 . 2 . . . . 65 ILE HG12 . 19314 1 659 . 1 1 65 65 ILE HG13 H 1 0.868 0.02 . 2 . . . . 65 ILE HG13 . 19314 1 660 . 1 1 65 65 ILE HG21 H 1 0.608 0.02 . 1 . . . . 65 ILE HG2 . 19314 1 661 . 1 1 65 65 ILE HG22 H 1 0.608 0.02 . 1 . . . . 65 ILE HG2 . 19314 1 662 . 1 1 65 65 ILE HG23 H 1 0.608 0.02 . 1 . . . . 65 ILE HG2 . 19314 1 663 . 1 1 65 65 ILE HD11 H 1 0.658 0.02 . 1 . . . . 65 ILE HD1 . 19314 1 664 . 1 1 65 65 ILE HD12 H 1 0.658 0.02 . 1 . . . . 65 ILE HD1 . 19314 1 665 . 1 1 65 65 ILE HD13 H 1 0.658 0.02 . 1 . . . . 65 ILE HD1 . 19314 1 666 . 1 1 65 65 ILE C C 13 175.266 0.4 . 1 . . . . 65 ILE C . 19314 1 667 . 1 1 65 65 ILE CA C 13 62.039 0.4 . 1 . . . . 65 ILE CA . 19314 1 668 . 1 1 65 65 ILE CB C 13 36.582 0.4 . 1 . . . . 65 ILE CB . 19314 1 669 . 1 1 65 65 ILE CG1 C 13 27.882 0.4 . 1 . . . . 65 ILE CG1 . 19314 1 670 . 1 1 65 65 ILE CG2 C 13 17.975 0.4 . 1 . . . . 65 ILE CG2 . 19314 1 671 . 1 1 65 65 ILE CD1 C 13 12.899 0.4 . 1 . . . . 65 ILE CD1 . 19314 1 672 . 1 1 65 65 ILE N N 15 120.157 0.4 . 1 . . . . 65 ILE N . 19314 1 673 . 1 1 66 66 THR H H 1 6.767 0.02 . 1 . . . . 66 THR H . 19314 1 674 . 1 1 66 66 THR HA H 1 4.932 0.02 . 1 . . . . 66 THR HA . 19314 1 675 . 1 1 66 66 THR HB H 1 4.714 0.02 . 1 . . . . 66 THR HB . 19314 1 676 . 1 1 66 66 THR HG21 H 1 1.214 0.02 . 1 . . . . 66 THR HG2 . 19314 1 677 . 1 1 66 66 THR HG22 H 1 1.214 0.02 . 1 . . . . 66 THR HG2 . 19314 1 678 . 1 1 66 66 THR HG23 H 1 1.214 0.02 . 1 . . . . 66 THR HG2 . 19314 1 679 . 1 1 66 66 THR CA C 13 59.138 0.4 . 1 . . . . 66 THR CA . 19314 1 680 . 1 1 66 66 THR CB C 13 72.447 0.4 . 1 . . . . 66 THR CB . 19314 1 681 . 1 1 66 66 THR CG2 C 13 21.370 0.4 . 1 . . . . 66 THR CG2 . 19314 1 682 . 1 1 66 66 THR N N 15 115.818 0.4 . 1 . . . . 66 THR N . 19314 1 683 . 1 1 67 67 THR HA H 1 4.089 0.02 . 1 . . . . 67 THR HA . 19314 1 684 . 1 1 67 67 THR HB H 1 4.227 0.02 . 1 . . . . 67 THR HB . 19314 1 685 . 1 1 67 67 THR HG21 H 1 1.293 0.02 . 1 . . . . 67 THR HG2 . 19314 1 686 . 1 1 67 67 THR HG22 H 1 1.293 0.02 . 1 . . . . 67 THR HG2 . 19314 1 687 . 1 1 67 67 THR HG23 H 1 1.293 0.02 . 1 . . . . 67 THR HG2 . 19314 1 688 . 1 1 67 67 THR C C 13 176.590 0.4 . 1 . . . . 67 THR C . 19314 1 689 . 1 1 67 67 THR CA C 13 66.384 0.4 . 1 . . . . 67 THR CA . 19314 1 690 . 1 1 67 67 THR CB C 13 68.392 0.4 . 1 . . . . 67 THR CB . 19314 1 691 . 1 1 67 67 THR CG2 C 13 22.446 0.4 . 1 . . . . 67 THR CG2 . 19314 1 692 . 1 1 68 68 VAL H H 1 7.703 0.02 . 1 . . . . 68 VAL H . 19314 1 693 . 1 1 68 68 VAL HA H 1 3.937 0.02 . 1 . . . . 68 VAL HA . 19314 1 694 . 1 1 68 68 VAL HB H 1 2.058 0.02 . 1 . . . . 68 VAL HB . 19314 1 695 . 1 1 68 68 VAL HG11 H 1 0.973 0.02 . 1 . . . . 68 VAL HG1 . 19314 1 696 . 1 1 68 68 VAL HG12 H 1 0.973 0.02 . 1 . . . . 68 VAL HG1 . 19314 1 697 . 1 1 68 68 VAL HG13 H 1 0.973 0.02 . 1 . . . . 68 VAL HG1 . 19314 1 698 . 1 1 68 68 VAL HG21 H 1 1.041 0.02 . 1 . . . . 68 VAL HG2 . 19314 1 699 . 1 1 68 68 VAL HG22 H 1 1.041 0.02 . 1 . . . . 68 VAL HG2 . 19314 1 700 . 1 1 68 68 VAL HG23 H 1 1.041 0.02 . 1 . . . . 68 VAL HG2 . 19314 1 701 . 1 1 68 68 VAL C C 13 177.125 0.4 . 1 . . . . 68 VAL C . 19314 1 702 . 1 1 68 68 VAL CA C 13 65.315 0.4 . 1 . . . . 68 VAL CA . 19314 1 703 . 1 1 68 68 VAL CB C 13 31.768 0.4 . 1 . . . . 68 VAL CB . 19314 1 704 . 1 1 68 68 VAL CG1 C 13 20.687 0.4 . 1 . . . . 68 VAL CG1 . 19314 1 705 . 1 1 68 68 VAL CG2 C 13 21.920 0.4 . 1 . . . . 68 VAL CG2 . 19314 1 706 . 1 1 68 68 VAL N N 15 119.126 0.4 . 1 . . . . 68 VAL N . 19314 1 707 . 1 1 69 69 TYR H H 1 7.849 0.02 . 1 . . . . 69 TYR H . 19314 1 708 . 1 1 69 69 TYR HA H 1 4.203 0.02 . 1 . . . . 69 TYR HA . 19314 1 709 . 1 1 69 69 TYR HB2 H 1 3.241 0.02 . 2 . . . . 69 TYR HB2 . 19314 1 710 . 1 1 69 69 TYR HB3 H 1 2.883 0.02 . 2 . . . . 69 TYR HB3 . 19314 1 711 . 1 1 69 69 TYR HD1 H 1 6.724 0.02 . 1 . . . . 69 TYR HD1 . 19314 1 712 . 1 1 69 69 TYR HD2 H 1 6.724 0.02 . 1 . . . . 69 TYR HD2 . 19314 1 713 . 1 1 69 69 TYR HE1 H 1 6.701 0.02 . 1 . . . . 69 TYR HE1 . 19314 1 714 . 1 1 69 69 TYR HE2 H 1 6.701 0.02 . 1 . . . . 69 TYR HE2 . 19314 1 715 . 1 1 69 69 TYR C C 13 177.860 0.4 . 1 . . . . 69 TYR C . 19314 1 716 . 1 1 69 69 TYR CA C 13 61.348 0.4 . 1 . . . . 69 TYR CA . 19314 1 717 . 1 1 69 69 TYR CB C 13 38.058 0.4 . 1 . . . . 69 TYR CB . 19314 1 718 . 1 1 69 69 TYR CD1 C 13 132.804 0.4 . 1 . . . . 69 TYR CD1 . 19314 1 719 . 1 1 69 69 TYR CD2 C 13 132.804 0.4 . 1 . . . . 69 TYR CD2 . 19314 1 720 . 1 1 69 69 TYR CE1 C 13 117.974 0.4 . 1 . . . . 69 TYR CE1 . 19314 1 721 . 1 1 69 69 TYR CE2 C 13 117.974 0.4 . 1 . . . . 69 TYR CE2 . 19314 1 722 . 1 1 69 69 TYR N N 15 122.155 0.4 . 1 . . . . 69 TYR N . 19314 1 723 . 1 1 70 70 PHE H H 1 7.989 0.02 . 1 . . . . 70 PHE H . 19314 1 724 . 1 1 70 70 PHE HA H 1 4.180 0.02 . 1 . . . . 70 PHE HA . 19314 1 725 . 1 1 70 70 PHE HB2 H 1 3.105 0.02 . 1 . . . . 70 PHE HB2 . 19314 1 726 . 1 1 70 70 PHE HB3 H 1 3.105 0.02 . 1 . . . . 70 PHE HB3 . 19314 1 727 . 1 1 70 70 PHE HD1 H 1 7.203 0.02 . 1 . . . . 70 PHE HD1 . 19314 1 728 . 1 1 70 70 PHE HD2 H 1 7.203 0.02 . 1 . . . . 70 PHE HD2 . 19314 1 729 . 1 1 70 70 PHE HE1 H 1 7.272 0.02 . 1 . . . . 70 PHE HE1 . 19314 1 730 . 1 1 70 70 PHE HE2 H 1 7.272 0.02 . 1 . . . . 70 PHE HE2 . 19314 1 731 . 1 1 70 70 PHE HZ H 1 7.143 0.02 . 1 . . . . 70 PHE HZ . 19314 1 732 . 1 1 70 70 PHE C C 13 178.290 0.4 . 1 . . . . 70 PHE C . 19314 1 733 . 1 1 70 70 PHE CA C 13 61.323 0.4 . 1 . . . . 70 PHE CA . 19314 1 734 . 1 1 70 70 PHE CB C 13 38.571 0.4 . 1 . . . . 70 PHE CB . 19314 1 735 . 1 1 70 70 PHE CD1 C 13 130.749 0.4 . 1 . . . . 70 PHE CD1 . 19314 1 736 . 1 1 70 70 PHE CD2 C 13 130.749 0.4 . 1 . . . . 70 PHE CD2 . 19314 1 737 . 1 1 70 70 PHE CE1 C 13 131.319 0.4 . 1 . . . . 70 PHE CE1 . 19314 1 738 . 1 1 70 70 PHE CE2 C 13 131.319 0.4 . 1 . . . . 70 PHE CE2 . 19314 1 739 . 1 1 70 70 PHE CZ C 13 129.460 0.4 . 1 . . . . 70 PHE CZ . 19314 1 740 . 1 1 70 70 PHE N N 15 117.021 0.4 . 1 . . . . 70 PHE N . 19314 1 741 . 1 1 71 71 TYR H H 1 8.130 0.02 . 1 . . . . 71 TYR H . 19314 1 742 . 1 1 71 71 TYR HA H 1 4.270 0.02 . 1 . . . . 71 TYR HA . 19314 1 743 . 1 1 71 71 TYR HB2 H 1 3.200 0.02 . 1 . . . . 71 TYR HB2 . 19314 1 744 . 1 1 71 71 TYR HB3 H 1 3.200 0.02 . 1 . . . . 71 TYR HB3 . 19314 1 745 . 1 1 71 71 TYR HD1 H 1 7.138 0.02 . 1 . . . . 71 TYR HD1 . 19314 1 746 . 1 1 71 71 TYR HD2 H 1 7.138 0.02 . 1 . . . . 71 TYR HD2 . 19314 1 747 . 1 1 71 71 TYR HE1 H 1 6.796 0.02 . 1 . . . . 71 TYR HE1 . 19314 1 748 . 1 1 71 71 TYR HE2 H 1 6.796 0.02 . 1 . . . . 71 TYR HE2 . 19314 1 749 . 1 1 71 71 TYR C C 13 178.437 0.4 . 1 . . . . 71 TYR C . 19314 1 750 . 1 1 71 71 TYR CA C 13 60.904 0.4 . 1 . . . . 71 TYR CA . 19314 1 751 . 1 1 71 71 TYR CB C 13 37.400 0.4 . 1 . . . . 71 TYR CB . 19314 1 752 . 1 1 71 71 TYR CD1 C 13 132.705 0.4 . 1 . . . . 71 TYR CD1 . 19314 1 753 . 1 1 71 71 TYR CD2 C 13 132.705 0.4 . 1 . . . . 71 TYR CD2 . 19314 1 754 . 1 1 71 71 TYR CE1 C 13 118.070 0.4 . 1 . . . . 71 TYR CE1 . 19314 1 755 . 1 1 71 71 TYR CE2 C 13 118.070 0.4 . 1 . . . . 71 TYR CE2 . 19314 1 756 . 1 1 71 71 TYR N N 15 120.333 0.4 . 1 . . . . 71 TYR N . 19314 1 757 . 1 1 72 72 GLU H H 1 8.318 0.02 . 1 . . . . 72 GLU H . 19314 1 758 . 1 1 72 72 GLU HA H 1 3.931 0.02 . 1 . . . . 72 GLU HA . 19314 1 759 . 1 1 72 72 GLU HB2 H 1 2.091 0.02 . 2 . . . . 72 GLU HB2 . 19314 1 760 . 1 1 72 72 GLU HB3 H 1 1.936 0.02 . 2 . . . . 72 GLU HB3 . 19314 1 761 . 1 1 72 72 GLU HG2 H 1 2.551 0.02 . 2 . . . . 72 GLU HG2 . 19314 1 762 . 1 1 72 72 GLU HG3 H 1 2.211 0.02 . 2 . . . . 72 GLU HG3 . 19314 1 763 . 1 1 72 72 GLU C C 13 178.871 0.4 . 1 . . . . 72 GLU C . 19314 1 764 . 1 1 72 72 GLU CA C 13 59.159 0.4 . 1 . . . . 72 GLU CA . 19314 1 765 . 1 1 72 72 GLU CB C 13 28.953 0.4 . 1 . . . . 72 GLU CB . 19314 1 766 . 1 1 72 72 GLU CG C 13 36.634 0.4 . 1 . . . . 72 GLU CG . 19314 1 767 . 1 1 72 72 GLU N N 15 120.863 0.4 . 1 . . . . 72 GLU N . 19314 1 768 . 1 1 73 73 LEU H H 1 8.350 0.02 . 1 . . . . 73 LEU H . 19314 1 769 . 1 1 73 73 LEU HA H 1 4.049 0.02 . 1 . . . . 73 LEU HA . 19314 1 770 . 1 1 73 73 LEU HB2 H 1 1.130 0.02 . 2 . . . . 73 LEU HB2 . 19314 1 771 . 1 1 73 73 LEU HB3 H 1 1.684 0.02 . 2 . . . . 73 LEU HB3 . 19314 1 772 . 1 1 73 73 LEU HG H 1 1.339 0.02 . 1 . . . . 73 LEU HG . 19314 1 773 . 1 1 73 73 LEU HD11 H 1 0.922 0.02 . 1 . . . . 73 LEU HD1 . 19314 1 774 . 1 1 73 73 LEU HD12 H 1 0.922 0.02 . 1 . . . . 73 LEU HD1 . 19314 1 775 . 1 1 73 73 LEU HD13 H 1 0.922 0.02 . 1 . . . . 73 LEU HD1 . 19314 1 776 . 1 1 73 73 LEU HD21 H 1 0.951 0.02 . 1 . . . . 73 LEU HD2 . 19314 1 777 . 1 1 73 73 LEU HD22 H 1 0.951 0.02 . 1 . . . . 73 LEU HD2 . 19314 1 778 . 1 1 73 73 LEU HD23 H 1 0.951 0.02 . 1 . . . . 73 LEU HD2 . 19314 1 779 . 1 1 73 73 LEU C C 13 178.407 0.4 . 1 . . . . 73 LEU C . 19314 1 780 . 1 1 73 73 LEU CA C 13 57.784 0.4 . 1 . . . . 73 LEU CA . 19314 1 781 . 1 1 73 73 LEU CB C 13 41.066 0.4 . 1 . . . . 73 LEU CB . 19314 1 782 . 1 1 73 73 LEU CG C 13 27.147 0.4 . 1 . . . . 73 LEU CG . 19314 1 783 . 1 1 73 73 LEU CD1 C 13 24.374 0.4 . 1 . . . . 73 LEU CD1 . 19314 1 784 . 1 1 73 73 LEU CD2 C 13 26.822 0.4 . 1 . . . . 73 LEU CD2 . 19314 1 785 . 1 1 73 73 LEU N N 15 122.259 0.4 . 1 . . . . 73 LEU N . 19314 1 786 . 1 1 74 74 GLN H H 1 8.179 0.02 . 1 . . . . 74 GLN H . 19314 1 787 . 1 1 74 74 GLN HA H 1 3.654 0.02 . 1 . . . . 74 GLN HA . 19314 1 788 . 1 1 74 74 GLN HB2 H 1 2.026 0.02 . 1 . . . . 74 GLN HB2 . 19314 1 789 . 1 1 74 74 GLN HB3 H 1 2.026 0.02 . 1 . . . . 74 GLN HB3 . 19314 1 790 . 1 1 74 74 GLN HG2 H 1 2.252 0.02 . 2 . . . . 74 GLN HG2 . 19314 1 791 . 1 1 74 74 GLN HG3 H 1 2.107 0.02 . 2 . . . . 74 GLN HG3 . 19314 1 792 . 1 1 74 74 GLN HE21 H 1 7.425 0.02 . 2 . . . . 74 GLN HE21 . 19314 1 793 . 1 1 74 74 GLN HE22 H 1 6.738 0.02 . 2 . . . . 74 GLN HE22 . 19314 1 794 . 1 1 74 74 GLN C C 13 177.704 0.4 . 1 . . . . 74 GLN C . 19314 1 795 . 1 1 74 74 GLN CA C 13 59.884 0.4 . 1 . . . . 74 GLN CA . 19314 1 796 . 1 1 74 74 GLN CB C 13 27.562 0.4 . 1 . . . . 74 GLN CB . 19314 1 797 . 1 1 74 74 GLN CG C 13 33.531 0.4 . 1 . . . . 74 GLN CG . 19314 1 798 . 1 1 74 74 GLN N N 15 118.256 0.4 . 1 . . . . 74 GLN N . 19314 1 799 . 1 1 74 74 GLN NE2 N 15 110.792 0.4 . 1 . . . . 74 GLN NE2 . 19314 1 800 . 1 1 75 75 GLU H H 1 7.953 0.02 . 1 . . . . 75 GLU H . 19314 1 801 . 1 1 75 75 GLU HA H 1 3.964 0.02 . 1 . . . . 75 GLU HA . 19314 1 802 . 1 1 75 75 GLU HB2 H 1 1.995 0.02 . 1 . . . . 75 GLU HB2 . 19314 1 803 . 1 1 75 75 GLU HB3 H 1 1.995 0.02 . 1 . . . . 75 GLU HB3 . 19314 1 804 . 1 1 75 75 GLU HG2 H 1 2.241 0.02 . 2 . . . . 75 GLU HG2 . 19314 1 805 . 1 1 75 75 GLU HG3 H 1 2.060 0.02 . 2 . . . . 75 GLU HG3 . 19314 1 806 . 1 1 75 75 GLU C C 13 179.379 0.4 . 1 . . . . 75 GLU C . 19314 1 807 . 1 1 75 75 GLU CA C 13 59.346 0.4 . 1 . . . . 75 GLU CA . 19314 1 808 . 1 1 75 75 GLU CB C 13 29.340 0.4 . 1 . . . . 75 GLU CB . 19314 1 809 . 1 1 75 75 GLU CG C 13 36.337 0.4 . 1 . . . . 75 GLU CG . 19314 1 810 . 1 1 75 75 GLU N N 15 118.569 0.4 . 1 . . . . 75 GLU N . 19314 1 811 . 1 1 76 76 ASN H H 1 8.388 0.02 . 1 . . . . 76 ASN H . 19314 1 812 . 1 1 76 76 ASN HA H 1 4.479 0.02 . 1 . . . . 76 ASN HA . 19314 1 813 . 1 1 76 76 ASN HB2 H 1 2.946 0.02 . 2 . . . . 76 ASN HB2 . 19314 1 814 . 1 1 76 76 ASN HB3 H 1 2.734 0.02 . 2 . . . . 76 ASN HB3 . 19314 1 815 . 1 1 76 76 ASN HD21 H 1 7.158 0.02 . 2 . . . . 76 ASN HD21 . 19314 1 816 . 1 1 76 76 ASN HD22 H 1 7.080 0.02 . 2 . . . . 76 ASN HD22 . 19314 1 817 . 1 1 76 76 ASN C C 13 178.489 0.4 . 1 . . . . 76 ASN C . 19314 1 818 . 1 1 76 76 ASN CA C 13 55.595 0.4 . 1 . . . . 76 ASN CA . 19314 1 819 . 1 1 76 76 ASN CB C 13 38.242 0.4 . 1 . . . . 76 ASN CB . 19314 1 820 . 1 1 76 76 ASN N N 15 119.198 0.4 . 1 . . . . 76 ASN N . 19314 1 821 . 1 1 76 76 ASN ND2 N 15 111.196 0.4 . 1 . . . . 76 ASN ND2 . 19314 1 822 . 1 1 77 77 LEU H H 1 8.563 0.02 . 1 . . . . 77 LEU H . 19314 1 823 . 1 1 77 77 LEU HA H 1 3.954 0.02 . 1 . . . . 77 LEU HA . 19314 1 824 . 1 1 77 77 LEU HB2 H 1 2.031 0.02 . 2 . . . . 77 LEU HB2 . 19314 1 825 . 1 1 77 77 LEU HB3 H 1 1.282 0.02 . 2 . . . . 77 LEU HB3 . 19314 1 826 . 1 1 77 77 LEU HG H 1 1.856 0.02 . 1 . . . . 77 LEU HG . 19314 1 827 . 1 1 77 77 LEU HD11 H 1 0.714 0.02 . 1 . . . . 77 LEU HD1 . 19314 1 828 . 1 1 77 77 LEU HD12 H 1 0.714 0.02 . 1 . . . . 77 LEU HD1 . 19314 1 829 . 1 1 77 77 LEU HD13 H 1 0.714 0.02 . 1 . . . . 77 LEU HD1 . 19314 1 830 . 1 1 77 77 LEU HD21 H 1 0.873 0.02 . 1 . . . . 77 LEU HD2 . 19314 1 831 . 1 1 77 77 LEU HD22 H 1 0.873 0.02 . 1 . . . . 77 LEU HD2 . 19314 1 832 . 1 1 77 77 LEU HD23 H 1 0.873 0.02 . 1 . . . . 77 LEU HD2 . 19314 1 833 . 1 1 77 77 LEU C C 13 178.087 0.4 . 1 . . . . 77 LEU C . 19314 1 834 . 1 1 77 77 LEU CA C 13 57.891 0.4 . 1 . . . . 77 LEU CA . 19314 1 835 . 1 1 77 77 LEU CB C 13 40.991 0.4 . 1 . . . . 77 LEU CB . 19314 1 836 . 1 1 77 77 LEU CG C 13 26.903 0.4 . 1 . . . . 77 LEU CG . 19314 1 837 . 1 1 77 77 LEU CD1 C 13 25.804 0.4 . 1 . . . . 77 LEU CD1 . 19314 1 838 . 1 1 77 77 LEU CD2 C 13 24.041 0.4 . 1 . . . . 77 LEU CD2 . 19314 1 839 . 1 1 77 77 LEU N N 15 120.441 0.4 . 1 . . . . 77 LEU N . 19314 1 840 . 1 1 78 78 GLU H H 1 8.412 0.02 . 1 . . . . 78 GLU H . 19314 1 841 . 1 1 78 78 GLU HA H 1 3.917 0.02 . 1 . . . . 78 GLU HA . 19314 1 842 . 1 1 78 78 GLU HB2 H 1 1.998 0.02 . 2 . . . . 78 GLU HB2 . 19314 1 843 . 1 1 78 78 GLU HB3 H 1 2.130 0.02 . 2 . . . . 78 GLU HB3 . 19314 1 844 . 1 1 78 78 GLU HG2 H 1 2.504 0.02 . 2 . . . . 78 GLU HG2 . 19314 1 845 . 1 1 78 78 GLU HG3 H 1 2.196 0.02 . 2 . . . . 78 GLU HG3 . 19314 1 846 . 1 1 78 78 GLU C C 13 179.593 0.4 . 1 . . . . 78 GLU C . 19314 1 847 . 1 1 78 78 GLU CA C 13 59.633 0.4 . 1 . . . . 78 GLU CA . 19314 1 848 . 1 1 78 78 GLU CB C 13 29.003 0.4 . 1 . . . . 78 GLU CB . 19314 1 849 . 1 1 78 78 GLU CG C 13 36.859 0.4 . 1 . . . . 78 GLU CG . 19314 1 850 . 1 1 78 78 GLU N N 15 118.468 0.4 . 1 . . . . 78 GLU N . 19314 1 851 . 1 1 79 79 LYS H H 1 7.805 0.02 . 1 . . . . 79 LYS H . 19314 1 852 . 1 1 79 79 LYS HA H 1 4.110 0.02 . 1 . . . . 79 LYS HA . 19314 1 853 . 1 1 79 79 LYS HB2 H 1 2.075 0.02 . 2 . . . . 79 LYS HB2 . 19314 1 854 . 1 1 79 79 LYS HB3 H 1 1.965 0.02 . 2 . . . . 79 LYS HB3 . 19314 1 855 . 1 1 79 79 LYS HG2 H 1 1.568 0.02 . 2 . . . . 79 LYS HG2 . 19314 1 856 . 1 1 79 79 LYS HG3 H 1 1.484 0.02 . 2 . . . . 79 LYS HG3 . 19314 1 857 . 1 1 79 79 LYS HD2 H 1 1.753 0.02 . 2 . . . . 79 LYS HD2 . 19314 1 858 . 1 1 79 79 LYS HD3 H 1 1.653 0.02 . 2 . . . . 79 LYS HD3 . 19314 1 859 . 1 1 79 79 LYS HE2 H 1 2.987 0.02 . 1 . . . . 79 LYS HE2 . 19314 1 860 . 1 1 79 79 LYS HE3 H 1 2.987 0.02 . 1 . . . . 79 LYS HE3 . 19314 1 861 . 1 1 79 79 LYS C C 13 178.411 0.4 . 1 . . . . 79 LYS C . 19314 1 862 . 1 1 79 79 LYS CA C 13 59.226 0.4 . 1 . . . . 79 LYS CA . 19314 1 863 . 1 1 79 79 LYS CB C 13 31.805 0.4 . 1 . . . . 79 LYS CB . 19314 1 864 . 1 1 79 79 LYS CG C 13 25.021 0.4 . 1 . . . . 79 LYS CG . 19314 1 865 . 1 1 79 79 LYS CD C 13 28.734 0.4 . 1 . . . . 79 LYS CD . 19314 1 866 . 1 1 79 79 LYS CE C 13 42.109 0.4 . 1 . . . . 79 LYS CE . 19314 1 867 . 1 1 79 79 LYS N N 15 121.251 0.4 . 1 . . . . 79 LYS N . 19314 1 868 . 1 1 80 80 LEU H H 1 7.853 0.02 . 1 . . . . 80 LEU H . 19314 1 869 . 1 1 80 80 LEU HA H 1 4.104 0.02 . 1 . . . . 80 LEU HA . 19314 1 870 . 1 1 80 80 LEU HB2 H 1 1.271 0.02 . 2 . . . . 80 LEU HB2 . 19314 1 871 . 1 1 80 80 LEU HB3 H 1 2.035 0.02 . 2 . . . . 80 LEU HB3 . 19314 1 872 . 1 1 80 80 LEU HG H 1 1.916 0.02 . 1 . . . . 80 LEU HG . 19314 1 873 . 1 1 80 80 LEU HD11 H 1 0.753 0.02 . 1 . . . . 80 LEU HD1 . 19314 1 874 . 1 1 80 80 LEU HD12 H 1 0.753 0.02 . 1 . . . . 80 LEU HD1 . 19314 1 875 . 1 1 80 80 LEU HD13 H 1 0.753 0.02 . 1 . . . . 80 LEU HD1 . 19314 1 876 . 1 1 80 80 LEU HD21 H 1 0.944 0.02 . 1 . . . . 80 LEU HD2 . 19314 1 877 . 1 1 80 80 LEU HD22 H 1 0.944 0.02 . 1 . . . . 80 LEU HD2 . 19314 1 878 . 1 1 80 80 LEU HD23 H 1 0.944 0.02 . 1 . . . . 80 LEU HD2 . 19314 1 879 . 1 1 80 80 LEU C C 13 178.933 0.4 . 1 . . . . 80 LEU C . 19314 1 880 . 1 1 80 80 LEU CA C 13 57.779 0.4 . 1 . . . . 80 LEU CA . 19314 1 881 . 1 1 80 80 LEU CB C 13 41.010 0.4 . 1 . . . . 80 LEU CB . 19314 1 882 . 1 1 80 80 LEU CG C 13 26.684 0.4 . 1 . . . . 80 LEU CG . 19314 1 883 . 1 1 80 80 LEU CD1 C 13 26.479 0.4 . 1 . . . . 80 LEU CD1 . 19314 1 884 . 1 1 80 80 LEU CD2 C 13 22.558 0.4 . 1 . . . . 80 LEU CD2 . 19314 1 885 . 1 1 80 80 LEU N N 15 119.584 0.4 . 1 . . . . 80 LEU N . 19314 1 886 . 1 1 81 81 LEU H H 1 8.102 0.02 . 1 . . . . 81 LEU H . 19314 1 887 . 1 1 81 81 LEU HA H 1 3.736 0.02 . 1 . . . . 81 LEU HA . 19314 1 888 . 1 1 81 81 LEU HB2 H 1 1.950 0.02 . 2 . . . . 81 LEU HB2 . 19314 1 889 . 1 1 81 81 LEU HB3 H 1 1.632 0.02 . 2 . . . . 81 LEU HB3 . 19314 1 890 . 1 1 81 81 LEU HG H 1 1.619 0.02 . 1 . . . . 81 LEU HG . 19314 1 891 . 1 1 81 81 LEU HD11 H 1 0.816 0.02 . 1 . . . . 81 LEU HD1 . 19314 1 892 . 1 1 81 81 LEU HD12 H 1 0.816 0.02 . 1 . . . . 81 LEU HD1 . 19314 1 893 . 1 1 81 81 LEU HD13 H 1 0.816 0.02 . 1 . . . . 81 LEU HD1 . 19314 1 894 . 1 1 81 81 LEU HD21 H 1 0.905 0.02 . 1 . . . . 81 LEU HD2 . 19314 1 895 . 1 1 81 81 LEU HD22 H 1 0.905 0.02 . 1 . . . . 81 LEU HD2 . 19314 1 896 . 1 1 81 81 LEU HD23 H 1 0.905 0.02 . 1 . . . . 81 LEU HD2 . 19314 1 897 . 1 1 81 81 LEU C C 13 177.499 0.4 . 1 . . . . 81 LEU C . 19314 1 898 . 1 1 81 81 LEU CA C 13 57.841 0.4 . 1 . . . . 81 LEU CA . 19314 1 899 . 1 1 81 81 LEU CB C 13 41.598 0.4 . 1 . . . . 81 LEU CB . 19314 1 900 . 1 1 81 81 LEU CG C 13 26.926 0.4 . 1 . . . . 81 LEU CG . 19314 1 901 . 1 1 81 81 LEU CD1 C 13 24.552 0.4 . 1 . . . . 81 LEU CD1 . 19314 1 902 . 1 1 81 81 LEU CD2 C 13 25.198 0.4 . 1 . . . . 81 LEU CD2 . 19314 1 903 . 1 1 81 81 LEU N N 15 118.437 0.4 . 1 . . . . 81 LEU N . 19314 1 904 . 1 1 82 82 GLN H H 1 7.493 0.02 . 1 . . . . 82 GLN H . 19314 1 905 . 1 1 82 82 GLN HA H 1 4.047 0.02 . 1 . . . . 82 GLN HA . 19314 1 906 . 1 1 82 82 GLN HB2 H 1 2.266 0.02 . 1 . . . . 82 GLN HB2 . 19314 1 907 . 1 1 82 82 GLN HB3 H 1 2.266 0.02 . 1 . . . . 82 GLN HB3 . 19314 1 908 . 1 1 82 82 GLN HG2 H 1 2.540 0.02 . 1 . . . . 82 GLN HG2 . 19314 1 909 . 1 1 82 82 GLN HG3 H 1 2.540 0.02 . 1 . . . . 82 GLN HG3 . 19314 1 910 . 1 1 82 82 GLN HE21 H 1 7.860 0.02 . 2 . . . . 82 GLN HE21 . 19314 1 911 . 1 1 82 82 GLN HE22 H 1 6.930 0.02 . 2 . . . . 82 GLN HE22 . 19314 1 912 . 1 1 82 82 GLN C C 13 179.243 0.4 . 1 . . . . 82 GLN C . 19314 1 913 . 1 1 82 82 GLN CA C 13 58.598 0.4 . 1 . . . . 82 GLN CA . 19314 1 914 . 1 1 82 82 GLN CB C 13 27.775 0.4 . 1 . . . . 82 GLN CB . 19314 1 915 . 1 1 82 82 GLN CG C 13 33.594 0.4 . 1 . . . . 82 GLN CG . 19314 1 916 . 1 1 82 82 GLN N N 15 116.386 0.4 . 1 . . . . 82 GLN N . 19314 1 917 . 1 1 82 82 GLN NE2 N 15 113.037 0.4 . 1 . . . . 82 GLN NE2 . 19314 1 918 . 1 1 83 83 ASP H H 1 8.395 0.02 . 1 . . . . 83 ASP H . 19314 1 919 . 1 1 83 83 ASP HA H 1 4.271 0.02 . 1 . . . . 83 ASP HA . 19314 1 920 . 1 1 83 83 ASP HB2 H 1 2.954 0.02 . 2 . . . . 83 ASP HB2 . 19314 1 921 . 1 1 83 83 ASP HB3 H 1 2.475 0.02 . 2 . . . . 83 ASP HB3 . 19314 1 922 . 1 1 83 83 ASP C C 13 179.617 0.4 . 1 . . . . 83 ASP C . 19314 1 923 . 1 1 83 83 ASP CA C 13 57.153 0.4 . 1 . . . . 83 ASP CA . 19314 1 924 . 1 1 83 83 ASP CB C 13 39.954 0.4 . 1 . . . . 83 ASP CB . 19314 1 925 . 1 1 83 83 ASP N N 15 119.830 0.4 . 1 . . . . 83 ASP N . 19314 1 926 . 1 1 84 84 ALA H H 1 8.294 0.02 . 1 . . . . 84 ALA H . 19314 1 927 . 1 1 84 84 ALA HA H 1 3.840 0.02 . 1 . . . . 84 ALA HA . 19314 1 928 . 1 1 84 84 ALA HB1 H 1 1.307 0.02 . 1 . . . . 84 ALA HB . 19314 1 929 . 1 1 84 84 ALA HB2 H 1 1.307 0.02 . 1 . . . . 84 ALA HB . 19314 1 930 . 1 1 84 84 ALA HB3 H 1 1.307 0.02 . 1 . . . . 84 ALA HB . 19314 1 931 . 1 1 84 84 ALA C C 13 178.833 0.4 . 1 . . . . 84 ALA C . 19314 1 932 . 1 1 84 84 ALA CA C 13 54.807 0.4 . 1 . . . . 84 ALA CA . 19314 1 933 . 1 1 84 84 ALA CB C 13 17.778 0.4 . 1 . . . . 84 ALA CB . 19314 1 934 . 1 1 84 84 ALA N N 15 123.278 0.4 . 1 . . . . 84 ALA N . 19314 1 935 . 1 1 85 85 TYR H H 1 7.935 0.02 . 1 . . . . 85 TYR H . 19314 1 936 . 1 1 85 85 TYR HA H 1 4.407 0.02 . 1 . . . . 85 TYR HA . 19314 1 937 . 1 1 85 85 TYR HB2 H 1 3.235 0.02 . 2 . . . . 85 TYR HB2 . 19314 1 938 . 1 1 85 85 TYR HB3 H 1 3.060 0.02 . 2 . . . . 85 TYR HB3 . 19314 1 939 . 1 1 85 85 TYR HD1 H 1 7.132 0.02 . 1 . . . . 85 TYR HD1 . 19314 1 940 . 1 1 85 85 TYR HD2 H 1 7.132 0.02 . 1 . . . . 85 TYR HD2 . 19314 1 941 . 1 1 85 85 TYR HE1 H 1 6.768 0.02 . 1 . . . . 85 TYR HE1 . 19314 1 942 . 1 1 85 85 TYR HE2 H 1 6.768 0.02 . 1 . . . . 85 TYR HE2 . 19314 1 943 . 1 1 85 85 TYR C C 13 177.759 0.4 . 1 . . . . 85 TYR C . 19314 1 944 . 1 1 85 85 TYR CA C 13 59.266 0.4 . 1 . . . . 85 TYR CA . 19314 1 945 . 1 1 85 85 TYR CB C 13 37.740 0.4 . 1 . . . . 85 TYR CB . 19314 1 946 . 1 1 85 85 TYR CD1 C 13 132.477 0.4 . 1 . . . . 85 TYR CD1 . 19314 1 947 . 1 1 85 85 TYR CD2 C 13 132.477 0.4 . 1 . . . . 85 TYR CD2 . 19314 1 948 . 1 1 85 85 TYR CE1 C 13 117.843 0.4 . 1 . . . . 85 TYR CE1 . 19314 1 949 . 1 1 85 85 TYR CE2 C 13 117.843 0.4 . 1 . . . . 85 TYR CE2 . 19314 1 950 . 1 1 85 85 TYR N N 15 114.067 0.4 . 1 . . . . 85 TYR N . 19314 1 951 . 1 1 86 86 GLU H H 1 7.385 0.02 . 1 . . . . 86 GLU H . 19314 1 952 . 1 1 86 86 GLU HA H 1 4.269 0.02 . 1 . . . . 86 GLU HA . 19314 1 953 . 1 1 86 86 GLU HB2 H 1 2.267 0.02 . 2 . . . . 86 GLU HB2 . 19314 1 954 . 1 1 86 86 GLU HB3 H 1 2.091 0.02 . 2 . . . . 86 GLU HB3 . 19314 1 955 . 1 1 86 86 GLU HG2 H 1 2.665 0.02 . 2 . . . . 86 GLU HG2 . 19314 1 956 . 1 1 86 86 GLU HG3 H 1 2.388 0.02 . 2 . . . . 86 GLU HG3 . 19314 1 957 . 1 1 86 86 GLU C C 13 177.560 0.4 . 1 . . . . 86 GLU C . 19314 1 958 . 1 1 86 86 GLU CA C 13 57.171 0.4 . 1 . . . . 86 GLU CA . 19314 1 959 . 1 1 86 86 GLU CB C 13 29.921 0.4 . 1 . . . . 86 GLU CB . 19314 1 960 . 1 1 86 86 GLU CG C 13 36.332 0.4 . 1 . . . . 86 GLU CG . 19314 1 961 . 1 1 86 86 GLU N N 15 115.784 0.4 . 1 . . . . 86 GLU N . 19314 1 962 . 1 1 87 87 ARG H H 1 7.758 0.02 . 1 . . . . 87 ARG H . 19314 1 963 . 1 1 87 87 ARG HA H 1 4.526 0.02 . 1 . . . . 87 ARG HA . 19314 1 964 . 1 1 87 87 ARG HD2 H 1 3.125 0.02 . 1 . . . . 87 ARG HD2 . 19314 1 965 . 1 1 87 87 ARG HD3 H 1 3.125 0.02 . 1 . . . . 87 ARG HD3 . 19314 1 966 . 1 1 87 87 ARG CA C 13 53.033 0.4 . 1 . . . . 87 ARG CA . 19314 1 967 . 1 1 87 87 ARG CD C 13 43.362 0.4 . 1 . . . . 87 ARG CD . 19314 1 968 . 1 1 87 87 ARG N N 15 117.373 0.4 . 1 . . . . 87 ARG N . 19314 1 969 . 1 1 88 88 SER HA H 1 4.369 0.02 . 1 . . . . 88 SER HA . 19314 1 970 . 1 1 88 88 SER HB2 H 1 3.840 0.02 . 2 . . . . 88 SER HB2 . 19314 1 971 . 1 1 88 88 SER HB3 H 1 3.788 0.02 . 2 . . . . 88 SER HB3 . 19314 1 972 . 1 1 88 88 SER C C 13 174.254 0.4 . 1 . . . . 88 SER C . 19314 1 973 . 1 1 88 88 SER CA C 13 58.551 0.4 . 1 . . . . 88 SER CA . 19314 1 974 . 1 1 88 88 SER CB C 13 63.500 0.4 . 1 . . . . 88 SER CB . 19314 1 975 . 1 1 88 88 SER N N 15 114.246 0.4 . 1 . . . . 88 SER N . 19314 1 976 . 1 1 89 89 GLU H H 1 8.417 0.02 . 1 . . . . 89 GLU H . 19314 1 977 . 1 1 89 89 GLU C C 13 175.195 0.4 . 1 . . . . 89 GLU C . 19314 1 978 . 1 1 89 89 GLU CA C 13 59.462 0.4 . 1 . . . . 89 GLU CA . 19314 1 979 . 1 1 89 89 GLU N N 15 121.712 0.4 . 1 . . . . 89 GLU N . 19314 1 980 . 1 1 91 91 LEU HA H 1 4.279 0.02 . 1 . . . . 91 LEU HA . 19314 1 981 . 1 1 91 91 LEU HB2 H 1 1.877 0.02 . 2 . . . . 91 LEU HB2 . 19314 1 982 . 1 1 91 91 LEU HB3 H 1 1.626 0.02 . 2 . . . . 91 LEU HB3 . 19314 1 983 . 1 1 91 91 LEU HG H 1 1.798 0.02 . 1 . . . . 91 LEU HG . 19314 1 984 . 1 1 91 91 LEU HD11 H 1 0.973 0.02 . 1 . . . . 91 LEU HD1 . 19314 1 985 . 1 1 91 91 LEU HD12 H 1 0.973 0.02 . 1 . . . . 91 LEU HD1 . 19314 1 986 . 1 1 91 91 LEU HD13 H 1 0.973 0.02 . 1 . . . . 91 LEU HD1 . 19314 1 987 . 1 1 91 91 LEU HD21 H 1 0.928 0.02 . 1 . . . . 91 LEU HD2 . 19314 1 988 . 1 1 91 91 LEU HD22 H 1 0.928 0.02 . 1 . . . . 91 LEU HD2 . 19314 1 989 . 1 1 91 91 LEU HD23 H 1 0.928 0.02 . 1 . . . . 91 LEU HD2 . 19314 1 990 . 1 1 91 91 LEU CA C 13 57.756 0.4 . 1 . . . . 91 LEU CA . 19314 1 991 . 1 1 91 91 LEU CB C 13 41.236 0.4 . 1 . . . . 91 LEU CB . 19314 1 992 . 1 1 91 91 LEU CG C 13 27.034 0.4 . 1 . . . . 91 LEU CG . 19314 1 993 . 1 1 91 91 LEU CD1 C 13 24.931 0.4 . 1 . . . . 91 LEU CD1 . 19314 1 994 . 1 1 91 91 LEU CD2 C 13 22.962 0.4 . 1 . . . . 91 LEU CD2 . 19314 1 995 . 1 1 92 92 GLU HA H 1 3.920 0.02 . 1 . . . . 92 GLU HA . 19314 1 996 . 1 1 92 92 GLU HB2 H 1 2.152 0.02 . 2 . . . . 92 GLU HB2 . 19314 1 997 . 1 1 92 92 GLU HB3 H 1 2.007 0.02 . 2 . . . . 92 GLU HB3 . 19314 1 998 . 1 1 92 92 GLU HG2 H 1 2.495 0.02 . 2 . . . . 92 GLU HG2 . 19314 1 999 . 1 1 92 92 GLU HG3 H 1 2.195 0.02 . 2 . . . . 92 GLU HG3 . 19314 1 1000 . 1 1 92 92 GLU CA C 13 59.679 0.4 . 1 . . . . 92 GLU CA . 19314 1 1001 . 1 1 92 92 GLU CB C 13 28.728 0.4 . 1 . . . . 92 GLU CB . 19314 1 1002 . 1 1 92 92 GLU CG C 13 36.707 0.4 . 1 . . . . 92 GLU CG . 19314 1 1003 . 1 1 93 93 VAL HA H 1 3.466 0.02 . 1 . . . . 93 VAL HA . 19314 1 1004 . 1 1 93 93 VAL HB H 1 2.195 0.02 . 1 . . . . 93 VAL HB . 19314 1 1005 . 1 1 93 93 VAL HG11 H 1 0.900 0.02 . 1 . . . . 93 VAL HG1 . 19314 1 1006 . 1 1 93 93 VAL HG12 H 1 0.900 0.02 . 1 . . . . 93 VAL HG1 . 19314 1 1007 . 1 1 93 93 VAL HG13 H 1 0.900 0.02 . 1 . . . . 93 VAL HG1 . 19314 1 1008 . 1 1 93 93 VAL HG21 H 1 1.062 0.02 . 1 . . . . 93 VAL HG2 . 19314 1 1009 . 1 1 93 93 VAL HG22 H 1 1.062 0.02 . 1 . . . . 93 VAL HG2 . 19314 1 1010 . 1 1 93 93 VAL HG23 H 1 1.062 0.02 . 1 . . . . 93 VAL HG2 . 19314 1 1011 . 1 1 93 93 VAL C C 13 179.062 0.4 . 1 . . . . 93 VAL C . 19314 1 1012 . 1 1 93 93 VAL CA C 13 66.891 0.4 . 1 . . . . 93 VAL CA . 19314 1 1013 . 1 1 93 93 VAL CB C 13 32.086 0.4 . 1 . . . . 93 VAL CB . 19314 1 1014 . 1 1 93 93 VAL CG1 C 13 21.565 0.4 . 1 . . . . 93 VAL CG1 . 19314 1 1015 . 1 1 93 93 VAL CG2 C 13 24.161 0.4 . 1 . . . . 93 VAL CG2 . 19314 1 1016 . 1 1 94 94 ALA H H 1 7.914 0.02 . 1 . . . . 94 ALA H . 19314 1 1017 . 1 1 94 94 ALA HA H 1 4.101 0.02 . 1 . . . . 94 ALA HA . 19314 1 1018 . 1 1 94 94 ALA HB1 H 1 1.553 0.02 . 1 . . . . 94 ALA HB . 19314 1 1019 . 1 1 94 94 ALA HB2 H 1 1.553 0.02 . 1 . . . . 94 ALA HB . 19314 1 1020 . 1 1 94 94 ALA HB3 H 1 1.553 0.02 . 1 . . . . 94 ALA HB . 19314 1 1021 . 1 1 94 94 ALA C C 13 178.897 0.4 . 1 . . . . 94 ALA C . 19314 1 1022 . 1 1 94 94 ALA CA C 13 55.250 0.4 . 1 . . . . 94 ALA CA . 19314 1 1023 . 1 1 94 94 ALA CB C 13 17.562 0.4 . 1 . . . . 94 ALA CB . 19314 1 1024 . 1 1 94 94 ALA N N 15 123.741 0.4 . 1 . . . . 94 ALA N . 19314 1 1025 . 1 1 95 95 PHE H H 1 7.678 0.02 . 1 . . . . 95 PHE H . 19314 1 1026 . 1 1 95 95 PHE HA H 1 4.271 0.02 . 1 . . . . 95 PHE HA . 19314 1 1027 . 1 1 95 95 PHE HB2 H 1 3.366 0.02 . 2 . . . . 95 PHE HB2 . 19314 1 1028 . 1 1 95 95 PHE HB3 H 1 3.156 0.02 . 2 . . . . 95 PHE HB3 . 19314 1 1029 . 1 1 95 95 PHE HD1 H 1 7.129 0.02 . 1 . . . . 95 PHE HD1 . 19314 1 1030 . 1 1 95 95 PHE HD2 H 1 7.129 0.02 . 1 . . . . 95 PHE HD2 . 19314 1 1031 . 1 1 95 95 PHE HE1 H 1 6.744 0.02 . 1 . . . . 95 PHE HE1 . 19314 1 1032 . 1 1 95 95 PHE HE2 H 1 6.744 0.02 . 1 . . . . 95 PHE HE2 . 19314 1 1033 . 1 1 95 95 PHE HZ H 1 6.974 0.02 . 1 . . . . 95 PHE HZ . 19314 1 1034 . 1 1 95 95 PHE C C 13 177.037 0.4 . 1 . . . . 95 PHE C . 19314 1 1035 . 1 1 95 95 PHE CA C 13 60.924 0.4 . 1 . . . . 95 PHE CA . 19314 1 1036 . 1 1 95 95 PHE CB C 13 38.793 0.4 . 1 . . . . 95 PHE CB . 19314 1 1037 . 1 1 95 95 PHE CD1 C 13 132.192 0.4 . 1 . . . . 95 PHE CD1 . 19314 1 1038 . 1 1 95 95 PHE CD2 C 13 132.192 0.4 . 1 . . . . 95 PHE CD2 . 19314 1 1039 . 1 1 95 95 PHE CE1 C 13 130.402 0.4 . 1 . . . . 95 PHE CE1 . 19314 1 1040 . 1 1 95 95 PHE CE2 C 13 130.406 0.4 . 1 . . . . 95 PHE CE2 . 19314 1 1041 . 1 1 95 95 PHE CZ C 13 129.298 0.4 . 1 . . . . 95 PHE CZ . 19314 1 1042 . 1 1 95 95 PHE N N 15 118.009 0.4 . 1 . . . . 95 PHE N . 19314 1 1043 . 1 1 96 96 VAL H H 1 7.990 0.02 . 1 . . . . 96 VAL H . 19314 1 1044 . 1 1 96 96 VAL HA H 1 3.180 0.02 . 1 . . . . 96 VAL HA . 19314 1 1045 . 1 1 96 96 VAL HB H 1 2.049 0.02 . 1 . . . . 96 VAL HB . 19314 1 1046 . 1 1 96 96 VAL HG11 H 1 0.852 0.02 . 1 . . . . 96 VAL HG1 . 19314 1 1047 . 1 1 96 96 VAL HG12 H 1 0.852 0.02 . 1 . . . . 96 VAL HG1 . 19314 1 1048 . 1 1 96 96 VAL HG13 H 1 0.852 0.02 . 1 . . . . 96 VAL HG1 . 19314 1 1049 . 1 1 96 96 VAL HG21 H 1 1.190 0.02 . 1 . . . . 96 VAL HG2 . 19314 1 1050 . 1 1 96 96 VAL HG22 H 1 1.190 0.02 . 1 . . . . 96 VAL HG2 . 19314 1 1051 . 1 1 96 96 VAL HG23 H 1 1.190 0.02 . 1 . . . . 96 VAL HG2 . 19314 1 1052 . 1 1 96 96 VAL C C 13 178.249 0.4 . 1 . . . . 96 VAL C . 19314 1 1053 . 1 1 96 96 VAL CA C 13 66.817 0.4 . 1 . . . . 96 VAL CA . 19314 1 1054 . 1 1 96 96 VAL CB C 13 31.712 0.4 . 1 . . . . 96 VAL CB . 19314 1 1055 . 1 1 96 96 VAL CG1 C 13 22.634 0.4 . 1 . . . . 96 VAL CG1 . 19314 1 1056 . 1 1 96 96 VAL CG2 C 13 24.606 0.4 . 1 . . . . 96 VAL CG2 . 19314 1 1057 . 1 1 96 96 VAL N N 15 116.806 0.4 . 1 . . . . 96 VAL N . 19314 1 1058 . 1 1 97 97 THR H H 1 8.621 0.02 . 1 . . . . 97 THR H . 19314 1 1059 . 1 1 97 97 THR HA H 1 3.679 0.02 . 1 . . . . 97 THR HA . 19314 1 1060 . 1 1 97 97 THR HB H 1 4.022 0.02 . 1 . . . . 97 THR HB . 19314 1 1061 . 1 1 97 97 THR HG21 H 1 0.948 0.02 . 1 . . . . 97 THR HG2 . 19314 1 1062 . 1 1 97 97 THR HG22 H 1 0.948 0.02 . 1 . . . . 97 THR HG2 . 19314 1 1063 . 1 1 97 97 THR HG23 H 1 0.948 0.02 . 1 . . . . 97 THR HG2 . 19314 1 1064 . 1 1 97 97 THR C C 13 176.965 0.4 . 1 . . . . 97 THR C . 19314 1 1065 . 1 1 97 97 THR CA C 13 66.215 0.4 . 1 . . . . 97 THR CA . 19314 1 1066 . 1 1 97 97 THR CB C 13 68.557 0.4 . 1 . . . . 97 THR CB . 19314 1 1067 . 1 1 97 97 THR CG2 C 13 21.863 0.4 . 1 . . . . 97 THR CG2 . 19314 1 1068 . 1 1 97 97 THR N N 15 112.405 0.4 . 1 . . . . 97 THR N . 19314 1 1069 . 1 1 98 98 GLN H H 1 7.822 0.02 . 1 . . . . 98 GLN H . 19314 1 1070 . 1 1 98 98 GLN HA H 1 3.977 0.02 . 1 . . . . 98 GLN HA . 19314 1 1071 . 1 1 98 98 GLN HB2 H 1 2.210 0.02 . 2 . . . . 98 GLN HB2 . 19314 1 1072 . 1 1 98 98 GLN HB3 H 1 1.973 0.02 . 2 . . . . 98 GLN HB3 . 19314 1 1073 . 1 1 98 98 GLN HG2 H 1 2.528 0.02 . 2 . . . . 98 GLN HG2 . 19314 1 1074 . 1 1 98 98 GLN HG3 H 1 2.363 0.02 . 2 . . . . 98 GLN HG3 . 19314 1 1075 . 1 1 98 98 GLN HE21 H 1 7.317 0.02 . 2 . . . . 98 GLN HE21 . 19314 1 1076 . 1 1 98 98 GLN HE22 H 1 6.827 0.02 . 2 . . . . 98 GLN HE22 . 19314 1 1077 . 1 1 98 98 GLN C C 13 178.268 0.4 . 1 . . . . 98 GLN C . 19314 1 1078 . 1 1 98 98 GLN CA C 13 58.607 0.4 . 1 . . . . 98 GLN CA . 19314 1 1079 . 1 1 98 98 GLN CB C 13 27.684 0.4 . 1 . . . . 98 GLN CB . 19314 1 1080 . 1 1 98 98 GLN CG C 13 34.006 0.4 . 1 . . . . 98 GLN CG . 19314 1 1081 . 1 1 98 98 GLN N N 15 120.324 0.4 . 1 . . . . 98 GLN N . 19314 1 1082 . 1 1 98 98 GLN NE2 N 15 111.438 0.4 . 1 . . . . 98 GLN NE2 . 19314 1 1083 . 1 1 99 99 LEU H H 1 7.429 0.02 . 1 . . . . 99 LEU H . 19314 1 1084 . 1 1 99 99 LEU HA H 1 3.699 0.02 . 1 . . . . 99 LEU HA . 19314 1 1085 . 1 1 99 99 LEU HB2 H 1 1.347 0.02 . 2 . . . . 99 LEU HB2 . 19314 1 1086 . 1 1 99 99 LEU HB3 H 1 1.731 0.02 . 2 . . . . 99 LEU HB3 . 19314 1 1087 . 1 1 99 99 LEU HG H 1 1.152 0.02 . 1 . . . . 99 LEU HG . 19314 1 1088 . 1 1 99 99 LEU HD11 H 1 0.162 0.02 . 1 . . . . 99 LEU HD1 . 19314 1 1089 . 1 1 99 99 LEU HD12 H 1 0.162 0.02 . 1 . . . . 99 LEU HD1 . 19314 1 1090 . 1 1 99 99 LEU HD13 H 1 0.162 0.02 . 1 . . . . 99 LEU HD1 . 19314 1 1091 . 1 1 99 99 LEU HD21 H 1 -0.031 0.02 . 1 . . . . 99 LEU HD2 . 19314 1 1092 . 1 1 99 99 LEU HD22 H 1 -0.031 0.02 . 1 . . . . 99 LEU HD2 . 19314 1 1093 . 1 1 99 99 LEU HD23 H 1 -0.031 0.02 . 1 . . . . 99 LEU HD2 . 19314 1 1094 . 1 1 99 99 LEU C C 13 178.744 0.4 . 1 . . . . 99 LEU C . 19314 1 1095 . 1 1 99 99 LEU CA C 13 58.110 0.4 . 1 . . . . 99 LEU CA . 19314 1 1096 . 1 1 99 99 LEU CB C 13 41.911 0.4 . 1 . . . . 99 LEU CB . 19314 1 1097 . 1 1 99 99 LEU CG C 13 25.806 0.4 . 1 . . . . 99 LEU CG . 19314 1 1098 . 1 1 99 99 LEU CD1 C 13 26.039 0.4 . 1 . . . . 99 LEU CD1 . 19314 1 1099 . 1 1 99 99 LEU CD2 C 13 23.320 0.4 . 1 . . . . 99 LEU CD2 . 19314 1 1100 . 1 1 99 99 LEU N N 15 119.769 0.4 . 1 . . . . 99 LEU N . 19314 1 1101 . 1 1 100 100 VAL H H 1 7.771 0.02 . 1 . . . . 100 VAL H . 19314 1 1102 . 1 1 100 100 VAL HA H 1 3.344 0.02 . 1 . . . . 100 VAL HA . 19314 1 1103 . 1 1 100 100 VAL HB H 1 2.138 0.02 . 1 . . . . 100 VAL HB . 19314 1 1104 . 1 1 100 100 VAL HG11 H 1 0.927 0.02 . 2 . . . . 100 VAL HG1 . 19314 1 1105 . 1 1 100 100 VAL HG12 H 1 0.927 0.02 . 2 . . . . 100 VAL HG1 . 19314 1 1106 . 1 1 100 100 VAL HG13 H 1 0.927 0.02 . 2 . . . . 100 VAL HG1 . 19314 1 1107 . 1 1 100 100 VAL HG21 H 1 0.939 0.02 . 2 . . . . 100 VAL HG2 . 19314 1 1108 . 1 1 100 100 VAL HG22 H 1 0.939 0.02 . 2 . . . . 100 VAL HG2 . 19314 1 1109 . 1 1 100 100 VAL HG23 H 1 0.939 0.02 . 2 . . . . 100 VAL HG2 . 19314 1 1110 . 1 1 100 100 VAL C C 13 177.627 0.4 . 1 . . . . 100 VAL C . 19314 1 1111 . 1 1 100 100 VAL CA C 13 67.439 0.4 . 1 . . . . 100 VAL CA . 19314 1 1112 . 1 1 100 100 VAL CB C 13 31.196 0.4 . 1 . . . . 100 VAL CB . 19314 1 1113 . 1 1 100 100 VAL CG1 C 13 22.744 0.4 . 1 . . . . 100 VAL CG1 . 19314 1 1114 . 1 1 100 100 VAL CG2 C 13 22.665 0.4 . 1 . . . . 100 VAL CG2 . 19314 1 1115 . 1 1 100 100 VAL N N 15 117.087 0.4 . 1 . . . . 100 VAL N . 19314 1 1116 . 1 1 101 101 LYS H H 1 8.036 0.02 . 1 . . . . 101 LYS H . 19314 1 1117 . 1 1 101 101 LYS HA H 1 3.881 0.02 . 1 . . . . 101 LYS HA . 19314 1 1118 . 1 1 101 101 LYS HB2 H 1 1.837 0.02 . 1 . . . . 101 LYS HB2 . 19314 1 1119 . 1 1 101 101 LYS HB3 H 1 1.837 0.02 . 1 . . . . 101 LYS HB3 . 19314 1 1120 . 1 1 101 101 LYS HG2 H 1 1.640 0.02 . 2 . . . . 101 LYS HG2 . 19314 1 1121 . 1 1 101 101 LYS HG3 H 1 1.411 0.02 . 2 . . . . 101 LYS HG3 . 19314 1 1122 . 1 1 101 101 LYS HD2 H 1 1.635 0.02 . 1 . . . . 101 LYS HD2 . 19314 1 1123 . 1 1 101 101 LYS HD3 H 1 1.635 0.02 . 1 . . . . 101 LYS HD3 . 19314 1 1124 . 1 1 101 101 LYS HE2 H 1 2.900 0.02 . 1 . . . . 101 LYS HE2 . 19314 1 1125 . 1 1 101 101 LYS HE3 H 1 2.900 0.02 . 1 . . . . 101 LYS HE3 . 19314 1 1126 . 1 1 101 101 LYS C C 13 179.624 0.4 . 1 . . . . 101 LYS C . 19314 1 1127 . 1 1 101 101 LYS CA C 13 60.025 0.4 . 1 . . . . 101 LYS CA . 19314 1 1128 . 1 1 101 101 LYS CB C 13 32.035 0.4 . 1 . . . . 101 LYS CB . 19314 1 1129 . 1 1 101 101 LYS CG C 13 25.963 0.4 . 1 . . . . 101 LYS CG . 19314 1 1130 . 1 1 101 101 LYS CD C 13 29.247 0.4 . 1 . . . . 101 LYS CD . 19314 1 1131 . 1 1 101 101 LYS CE C 13 42.082 0.4 . 1 . . . . 101 LYS CE . 19314 1 1132 . 1 1 101 101 LYS N N 15 117.223 0.4 . 1 . . . . 101 LYS N . 19314 1 1133 . 1 1 102 102 LYS H H 1 8.314 0.02 . 1 . . . . 102 LYS H . 19314 1 1134 . 1 1 102 102 LYS HA H 1 3.948 0.02 . 1 . . . . 102 LYS HA . 19314 1 1135 . 1 1 102 102 LYS HB2 H 1 1.977 0.02 . 2 . . . . 102 LYS HB2 . 19314 1 1136 . 1 1 102 102 LYS HB3 H 1 2.116 0.02 . 2 . . . . 102 LYS HB3 . 19314 1 1137 . 1 1 102 102 LYS HG2 H 1 1.747 0.02 . 2 . . . . 102 LYS HG2 . 19314 1 1138 . 1 1 102 102 LYS HG3 H 1 1.525 0.02 . 2 . . . . 102 LYS HG3 . 19314 1 1139 . 1 1 102 102 LYS HD2 H 1 1.851 0.02 . 2 . . . . 102 LYS HD2 . 19314 1 1140 . 1 1 102 102 LYS HD3 H 1 1.518 0.02 . 2 . . . . 102 LYS HD3 . 19314 1 1141 . 1 1 102 102 LYS HE2 H 1 2.972 0.02 . 1 . . . . 102 LYS HE2 . 19314 1 1142 . 1 1 102 102 LYS HE3 H 1 2.972 0.02 . 1 . . . . 102 LYS HE3 . 19314 1 1143 . 1 1 102 102 LYS C C 13 179.195 0.4 . 1 . . . . 102 LYS C . 19314 1 1144 . 1 1 102 102 LYS CA C 13 59.546 0.4 . 1 . . . . 102 LYS CA . 19314 1 1145 . 1 1 102 102 LYS CB C 13 33.067 0.4 . 1 . . . . 102 LYS CB . 19314 1 1146 . 1 1 102 102 LYS CG C 13 26.311 0.4 . 1 . . . . 102 LYS CG . 19314 1 1147 . 1 1 102 102 LYS CD C 13 29.663 0.4 . 1 . . . . 102 LYS CD . 19314 1 1148 . 1 1 102 102 LYS CE C 13 42.170 0.4 . 1 . . . . 102 LYS CE . 19314 1 1149 . 1 1 102 102 LYS N N 15 118.063 0.4 . 1 . . . . 102 LYS N . 19314 1 1150 . 1 1 103 103 LEU H H 1 8.000 0.02 . 1 . . . . 103 LEU H . 19314 1 1151 . 1 1 103 103 LEU HA H 1 3.654 0.02 . 1 . . . . 103 LEU HA . 19314 1 1152 . 1 1 103 103 LEU HB2 H 1 1.731 0.02 . 2 . . . . 103 LEU HB2 . 19314 1 1153 . 1 1 103 103 LEU HB3 H 1 1.070 0.02 . 2 . . . . 103 LEU HB3 . 19314 1 1154 . 1 1 103 103 LEU HG H 1 1.286 0.02 . 1 . . . . 103 LEU HG . 19314 1 1155 . 1 1 103 103 LEU HD11 H 1 0.350 0.02 . 1 . . . . 103 LEU HD1 . 19314 1 1156 . 1 1 103 103 LEU HD12 H 1 0.350 0.02 . 1 . . . . 103 LEU HD1 . 19314 1 1157 . 1 1 103 103 LEU HD13 H 1 0.350 0.02 . 1 . . . . 103 LEU HD1 . 19314 1 1158 . 1 1 103 103 LEU HD21 H 1 0.748 0.02 . 1 . . . . 103 LEU HD2 . 19314 1 1159 . 1 1 103 103 LEU HD22 H 1 0.748 0.02 . 1 . . . . 103 LEU HD2 . 19314 1 1160 . 1 1 103 103 LEU HD23 H 1 0.748 0.02 . 1 . . . . 103 LEU HD2 . 19314 1 1161 . 1 1 103 103 LEU C C 13 178.101 0.4 . 1 . . . . 103 LEU C . 19314 1 1162 . 1 1 103 103 LEU CA C 13 57.150 0.4 . 1 . . . . 103 LEU CA . 19314 1 1163 . 1 1 103 103 LEU CB C 13 40.298 0.4 . 1 . . . . 103 LEU CB . 19314 1 1164 . 1 1 103 103 LEU CG C 13 26.263 0.4 . 1 . . . . 103 LEU CG . 19314 1 1165 . 1 1 103 103 LEU CD1 C 13 22.991 0.4 . 1 . . . . 103 LEU CD1 . 19314 1 1166 . 1 1 103 103 LEU CD2 C 13 26.954 0.4 . 1 . . . . 103 LEU CD2 . 19314 1 1167 . 1 1 103 103 LEU N N 15 121.879 0.4 . 1 . . . . 103 LEU N . 19314 1 1168 . 1 1 104 104 LEU H H 1 8.501 0.02 . 1 . . . . 104 LEU H . 19314 1 1169 . 1 1 104 104 LEU HA H 1 3.837 0.02 . 1 . . . . 104 LEU HA . 19314 1 1170 . 1 1 104 104 LEU HB2 H 1 1.950 0.02 . 2 . . . . 104 LEU HB2 . 19314 1 1171 . 1 1 104 104 LEU HB3 H 1 1.628 0.02 . 2 . . . . 104 LEU HB3 . 19314 1 1172 . 1 1 104 104 LEU HG H 1 1.687 0.02 . 1 . . . . 104 LEU HG . 19314 1 1173 . 1 1 104 104 LEU HD11 H 1 0.797 0.02 . 1 . . . . 104 LEU HD1 . 19314 1 1174 . 1 1 104 104 LEU HD12 H 1 0.797 0.02 . 1 . . . . 104 LEU HD1 . 19314 1 1175 . 1 1 104 104 LEU HD13 H 1 0.797 0.02 . 1 . . . . 104 LEU HD1 . 19314 1 1176 . 1 1 104 104 LEU HD21 H 1 0.869 0.02 . 1 . . . . 104 LEU HD2 . 19314 1 1177 . 1 1 104 104 LEU HD22 H 1 0.869 0.02 . 1 . . . . 104 LEU HD2 . 19314 1 1178 . 1 1 104 104 LEU HD23 H 1 0.869 0.02 . 1 . . . . 104 LEU HD2 . 19314 1 1179 . 1 1 104 104 LEU C C 13 179.880 0.4 . 1 . . . . 104 LEU C . 19314 1 1180 . 1 1 104 104 LEU CA C 13 57.707 0.4 . 1 . . . . 104 LEU CA . 19314 1 1181 . 1 1 104 104 LEU CB C 13 41.419 0.4 . 1 . . . . 104 LEU CB . 19314 1 1182 . 1 1 104 104 LEU CG C 13 27.124 0.4 . 1 . . . . 104 LEU CG . 19314 1 1183 . 1 1 104 104 LEU CD1 C 13 25.835 0.4 . 1 . . . . 104 LEU CD1 . 19314 1 1184 . 1 1 104 104 LEU CD2 C 13 23.872 0.4 . 1 . . . . 104 LEU CD2 . 19314 1 1185 . 1 1 104 104 LEU N N 15 118.111 0.4 . 1 . . . . 104 LEU N . 19314 1 1186 . 1 1 105 105 ILE H H 1 7.584 0.02 . 1 . . . . 105 ILE H . 19314 1 1187 . 1 1 105 105 ILE HA H 1 3.684 0.02 . 1 . . . . 105 ILE HA . 19314 1 1188 . 1 1 105 105 ILE HB H 1 1.959 0.02 . 1 . . . . 105 ILE HB . 19314 1 1189 . 1 1 105 105 ILE HG12 H 1 1.719 0.02 . 2 . . . . 105 ILE HG12 . 19314 1 1190 . 1 1 105 105 ILE HG13 H 1 1.149 0.02 . 2 . . . . 105 ILE HG13 . 19314 1 1191 . 1 1 105 105 ILE HG21 H 1 0.889 0.02 . 1 . . . . 105 ILE HG2 . 19314 1 1192 . 1 1 105 105 ILE HG22 H 1 0.889 0.02 . 1 . . . . 105 ILE HG2 . 19314 1 1193 . 1 1 105 105 ILE HG23 H 1 0.889 0.02 . 1 . . . . 105 ILE HG2 . 19314 1 1194 . 1 1 105 105 ILE HD11 H 1 0.838 0.02 . 1 . . . . 105 ILE HD1 . 19314 1 1195 . 1 1 105 105 ILE HD12 H 1 0.838 0.02 . 1 . . . . 105 ILE HD1 . 19314 1 1196 . 1 1 105 105 ILE HD13 H 1 0.838 0.02 . 1 . . . . 105 ILE HD1 . 19314 1 1197 . 1 1 105 105 ILE C C 13 179.130 0.4 . 1 . . . . 105 ILE C . 19314 1 1198 . 1 1 105 105 ILE CA C 13 64.408 0.4 . 1 . . . . 105 ILE CA . 19314 1 1199 . 1 1 105 105 ILE CB C 13 37.855 0.4 . 1 . . . . 105 ILE CB . 19314 1 1200 . 1 1 105 105 ILE CG1 C 13 29.317 0.4 . 1 . . . . 105 ILE CG1 . 19314 1 1201 . 1 1 105 105 ILE CG2 C 13 17.230 0.4 . 1 . . . . 105 ILE CG2 . 19314 1 1202 . 1 1 105 105 ILE CD1 C 13 12.940 0.4 . 1 . . . . 105 ILE CD1 . 19314 1 1203 . 1 1 105 105 ILE N N 15 119.230 0.4 . 1 . . . . 105 ILE N . 19314 1 1204 . 1 1 106 106 ILE H H 1 7.619 0.02 . 1 . . . . 106 ILE H . 19314 1 1205 . 1 1 106 106 ILE HA H 1 3.569 0.02 . 1 . . . . 106 ILE HA . 19314 1 1206 . 1 1 106 106 ILE HB H 1 1.989 0.02 . 1 . . . . 106 ILE HB . 19314 1 1207 . 1 1 106 106 ILE HG12 H 1 1.931 0.02 . 2 . . . . 106 ILE HG12 . 19314 1 1208 . 1 1 106 106 ILE HG13 H 1 0.908 0.02 . 2 . . . . 106 ILE HG13 . 19314 1 1209 . 1 1 106 106 ILE HG21 H 1 0.814 0.02 . 1 . . . . 106 ILE HG2 . 19314 1 1210 . 1 1 106 106 ILE HG22 H 1 0.814 0.02 . 1 . . . . 106 ILE HG2 . 19314 1 1211 . 1 1 106 106 ILE HG23 H 1 0.814 0.02 . 1 . . . . 106 ILE HG2 . 19314 1 1212 . 1 1 106 106 ILE HD11 H 1 0.684 0.02 . 1 . . . . 106 ILE HD1 . 19314 1 1213 . 1 1 106 106 ILE HD12 H 1 0.684 0.02 . 1 . . . . 106 ILE HD1 . 19314 1 1214 . 1 1 106 106 ILE HD13 H 1 0.684 0.02 . 1 . . . . 106 ILE HD1 . 19314 1 1215 . 1 1 106 106 ILE C C 13 177.927 0.4 . 1 . . . . 106 ILE C . 19314 1 1216 . 1 1 106 106 ILE CA C 13 65.846 0.4 . 1 . . . . 106 ILE CA . 19314 1 1217 . 1 1 106 106 ILE CB C 13 38.102 0.4 . 1 . . . . 106 ILE CB . 19314 1 1218 . 1 1 106 106 ILE CG1 C 13 29.342 0.4 . 1 . . . . 106 ILE CG1 . 19314 1 1219 . 1 1 106 106 ILE CG2 C 13 17.958 0.4 . 1 . . . . 106 ILE CG2 . 19314 1 1220 . 1 1 106 106 ILE CD1 C 13 13.817 0.4 . 1 . . . . 106 ILE CD1 . 19314 1 1221 . 1 1 106 106 ILE N N 15 121.553 0.4 . 1 . . . . 106 ILE N . 19314 1 1222 . 1 1 107 107 ILE H H 1 7.591 0.02 . 1 . . . . 107 ILE H . 19314 1 1223 . 1 1 107 107 ILE HA H 1 4.276 0.02 . 1 . . . . 107 ILE HA . 19314 1 1224 . 1 1 107 107 ILE HB H 1 2.156 0.02 . 1 . . . . 107 ILE HB . 19314 1 1225 . 1 1 107 107 ILE HG12 H 1 1.412 0.02 . 2 . . . . 107 ILE HG12 . 19314 1 1226 . 1 1 107 107 ILE HG13 H 1 1.357 0.02 . 2 . . . . 107 ILE HG13 . 19314 1 1227 . 1 1 107 107 ILE HG21 H 1 0.978 0.02 . 1 . . . . 107 ILE HG2 . 19314 1 1228 . 1 1 107 107 ILE HG22 H 1 0.978 0.02 . 1 . . . . 107 ILE HG2 . 19314 1 1229 . 1 1 107 107 ILE HG23 H 1 0.978 0.02 . 1 . . . . 107 ILE HG2 . 19314 1 1230 . 1 1 107 107 ILE HD11 H 1 0.753 0.02 . 1 . . . . 107 ILE HD1 . 19314 1 1231 . 1 1 107 107 ILE HD12 H 1 0.753 0.02 . 1 . . . . 107 ILE HD1 . 19314 1 1232 . 1 1 107 107 ILE HD13 H 1 0.753 0.02 . 1 . . . . 107 ILE HD1 . 19314 1 1233 . 1 1 107 107 ILE C C 13 175.242 0.4 . 1 . . . . 107 ILE C . 19314 1 1234 . 1 1 107 107 ILE CA C 13 62.024 0.4 . 1 . . . . 107 ILE CA . 19314 1 1235 . 1 1 107 107 ILE CB C 13 37.958 0.4 . 1 . . . . 107 ILE CB . 19314 1 1236 . 1 1 107 107 ILE CG1 C 13 25.820 0.4 . 1 . . . . 107 ILE CG1 . 19314 1 1237 . 1 1 107 107 ILE CG2 C 13 18.282 0.4 . 1 . . . . 107 ILE CG2 . 19314 1 1238 . 1 1 107 107 ILE CD1 C 13 14.798 0.4 . 1 . . . . 107 ILE CD1 . 19314 1 1239 . 1 1 107 107 ILE N N 15 108.796 0.4 . 1 . . . . 107 ILE N . 19314 1 1240 . 1 1 108 108 SER H H 1 7.454 0.02 . 1 . . . . 108 SER H . 19314 1 1241 . 1 1 108 108 SER HA H 1 4.262 0.02 . 1 . . . . 108 SER HA . 19314 1 1242 . 1 1 108 108 SER HB2 H 1 3.894 0.02 . 1 . . . . 108 SER HB2 . 19314 1 1243 . 1 1 108 108 SER HB3 H 1 3.894 0.02 . 1 . . . . 108 SER HB3 . 19314 1 1244 . 1 1 108 108 SER C C 13 174.094 0.4 . 1 . . . . 108 SER C . 19314 1 1245 . 1 1 108 108 SER CA C 13 58.968 0.4 . 1 . . . . 108 SER CA . 19314 1 1246 . 1 1 108 108 SER CB C 13 63.578 0.4 . 1 . . . . 108 SER CB . 19314 1 1247 . 1 1 108 108 SER N N 15 115.825 0.4 . 1 . . . . 108 SER N . 19314 1 1248 . 1 1 109 109 ARG H H 1 8.219 0.02 . 1 . . . . 109 ARG H . 19314 1 1249 . 1 1 109 109 ARG HA H 1 4.470 0.02 . 1 . . . . 109 ARG HA . 19314 1 1250 . 1 1 109 109 ARG HB2 H 1 1.767 0.02 . 2 . . . . 109 ARG HB2 . 19314 1 1251 . 1 1 109 109 ARG HB3 H 1 1.635 0.02 . 2 . . . . 109 ARG HB3 . 19314 1 1252 . 1 1 109 109 ARG HG2 H 1 1.519 0.02 . 1 . . . . 109 ARG HG2 . 19314 1 1253 . 1 1 109 109 ARG HG3 H 1 1.519 0.02 . 1 . . . . 109 ARG HG3 . 19314 1 1254 . 1 1 109 109 ARG HD2 H 1 3.001 0.02 . 1 . . . . 109 ARG HD2 . 19314 1 1255 . 1 1 109 109 ARG HD3 H 1 3.001 0.02 . 1 . . . . 109 ARG HD3 . 19314 1 1256 . 1 1 109 109 ARG C C 13 173.697 0.4 . 1 . . . . 109 ARG C . 19314 1 1257 . 1 1 109 109 ARG CA C 13 53.916 0.4 . 1 . . . . 109 ARG CA . 19314 1 1258 . 1 1 109 109 ARG CB C 13 29.669 0.4 . 1 . . . . 109 ARG CB . 19314 1 1259 . 1 1 109 109 ARG CG C 13 26.304 0.4 . 1 . . . . 109 ARG CG . 19314 1 1260 . 1 1 109 109 ARG CD C 13 42.960 0.4 . 1 . . . . 109 ARG CD . 19314 1 1261 . 1 1 109 109 ARG N N 15 122.646 0.4 . 1 . . . . 109 ARG N . 19314 1 1262 . 1 1 110 110 PRO HA H 1 4.350 0.02 . 1 . . . . 110 PRO HA . 19314 1 1263 . 1 1 110 110 PRO HB2 H 1 2.219 0.02 . 2 . . . . 110 PRO HB2 . 19314 1 1264 . 1 1 110 110 PRO HB3 H 1 1.869 0.02 . 2 . . . . 110 PRO HB3 . 19314 1 1265 . 1 1 110 110 PRO HG2 H 1 1.955 0.02 . 2 . . . . 110 PRO HG2 . 19314 1 1266 . 1 1 110 110 PRO HG3 H 1 1.890 0.02 . 2 . . . . 110 PRO HG3 . 19314 1 1267 . 1 1 110 110 PRO HD2 H 1 3.675 0.02 . 2 . . . . 110 PRO HD2 . 19314 1 1268 . 1 1 110 110 PRO HD3 H 1 3.516 0.02 . 2 . . . . 110 PRO HD3 . 19314 1 1269 . 1 1 110 110 PRO CA C 13 62.924 0.4 . 1 . . . . 110 PRO CA . 19314 1 1270 . 1 1 110 110 PRO CB C 13 31.933 0.4 . 1 . . . . 110 PRO CB . 19314 1 1271 . 1 1 110 110 PRO CG C 13 27.310 0.4 . 1 . . . . 110 PRO CG . 19314 1 1272 . 1 1 110 110 PRO CD C 13 50.267 0.4 . 1 . . . . 110 PRO CD . 19314 1 1273 . 1 1 111 111 ALA H H 1 8.465 0.02 . 1 . . . . 111 ALA H . 19314 1 1274 . 1 1 111 111 ALA HA H 1 4.256 0.02 . 1 . . . . 111 ALA HA . 19314 1 1275 . 1 1 111 111 ALA HB1 H 1 1.364 0.02 . 1 . . . . 111 ALA HB . 19314 1 1276 . 1 1 111 111 ALA HB2 H 1 1.364 0.02 . 1 . . . . 111 ALA HB . 19314 1 1277 . 1 1 111 111 ALA HB3 H 1 1.364 0.02 . 1 . . . . 111 ALA HB . 19314 1 1278 . 1 1 111 111 ALA C C 13 176.835 0.4 . 1 . . . . 111 ALA C . 19314 1 1279 . 1 1 111 111 ALA CA C 13 52.254 0.4 . 1 . . . . 111 ALA CA . 19314 1 1280 . 1 1 111 111 ALA CB C 13 19.081 0.4 . 1 . . . . 111 ALA CB . 19314 1 1281 . 1 1 111 111 ALA N N 15 124.604 0.4 . 1 . . . . 111 ALA N . 19314 1 1282 . 1 1 112 112 ARG H H 1 7.956 0.02 . 1 . . . . 112 ARG H . 19314 1 1283 . 1 1 112 112 ARG HA H 1 4.115 0.02 . 1 . . . . 112 ARG HA . 19314 1 1284 . 1 1 112 112 ARG HB2 H 1 1.801 0.02 . 2 . . . . 112 ARG HB2 . 19314 1 1285 . 1 1 112 112 ARG HB3 H 1 1.690 0.02 . 2 . . . . 112 ARG HB3 . 19314 1 1286 . 1 1 112 112 ARG HG2 H 1 1.550 0.02 . 1 . . . . 112 ARG HG2 . 19314 1 1287 . 1 1 112 112 ARG HG3 H 1 1.550 0.02 . 1 . . . . 112 ARG HG3 . 19314 1 1288 . 1 1 112 112 ARG HD2 H 1 3.130 0.02 . 1 . . . . 112 ARG HD2 . 19314 1 1289 . 1 1 112 112 ARG HD3 H 1 3.130 0.02 . 1 . . . . 112 ARG HD3 . 19314 1 1290 . 1 1 112 112 ARG CA C 13 57.247 0.4 . 1 . . . . 112 ARG CA . 19314 1 1291 . 1 1 112 112 ARG CB C 13 31.290 0.4 . 1 . . . . 112 ARG CB . 19314 1 1292 . 1 1 112 112 ARG CG C 13 26.893 0.4 . 1 . . . . 112 ARG CG . 19314 1 1293 . 1 1 112 112 ARG CD C 13 43.354 0.4 . 1 . . . . 112 ARG CD . 19314 1 1294 . 1 1 112 112 ARG N N 15 124.971 0.4 . 1 . . . . 112 ARG N . 19314 1 stop_ save_