################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17484 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17484 1 3 '3D HNCO' . . . 17484 1 5 '3D HNCACB' . . . 17484 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 17484 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 4.687 0.020 . 1 . . . . 10 HIS HA . 17484 1 2 . 1 1 10 10 HIS HB2 H 1 3.201 0.020 . 2 . . . . 10 HIS HB2 . 17484 1 3 . 1 1 10 10 HIS HB3 H 1 3.106 0.020 . 2 . . . . 10 HIS HB3 . 17484 1 4 . 1 1 10 10 HIS HD2 H 1 7.067 0.020 . 1 . . . . 10 HIS HD2 . 17484 1 5 . 1 1 10 10 HIS C C 13 175.190 0.400 . 1 . . . . 10 HIS C . 17484 1 6 . 1 1 10 10 HIS CA C 13 56.002 0.400 . 1 . . . . 10 HIS CA . 17484 1 7 . 1 1 10 10 HIS CB C 13 30.634 0.400 . 1 . . . . 10 HIS CB . 17484 1 8 . 1 1 10 10 HIS CD2 C 13 119.578 0.400 . 1 . . . . 10 HIS CD2 . 17484 1 9 . 1 1 11 11 MET H H 1 8.234 0.020 . 1 . . . . 11 MET H . 17484 1 10 . 1 1 11 11 MET HA H 1 4.659 0.020 . 1 . . . . 11 MET HA . 17484 1 11 . 1 1 11 11 MET HB2 H 1 1.996 0.020 . 2 . . . . 11 MET HB2 . 17484 1 12 . 1 1 11 11 MET HB3 H 1 1.835 0.020 . 2 . . . . 11 MET HB3 . 17484 1 13 . 1 1 11 11 MET HG2 H 1 2.386 0.020 . 2 . . . . 11 MET HG2 . 17484 1 14 . 1 1 11 11 MET HG3 H 1 2.484 0.020 . 2 . . . . 11 MET HG3 . 17484 1 15 . 1 1 11 11 MET C C 13 175.775 0.400 . 1 . . . . 11 MET C . 17484 1 16 . 1 1 11 11 MET CA C 13 55.347 0.400 . 1 . . . . 11 MET CA . 17484 1 17 . 1 1 11 11 MET CB C 13 34.981 0.400 . 1 . . . . 11 MET CB . 17484 1 18 . 1 1 11 11 MET CG C 13 32.805 0.400 . 1 . . . . 11 MET CG . 17484 1 19 . 1 1 11 11 MET N N 15 121.293 0.400 . 1 . . . . 11 MET N . 17484 1 20 . 1 1 12 12 SER H H 1 9.360 0.020 . 1 . . . . 12 SER H . 17484 1 21 . 1 1 12 12 SER HA H 1 4.586 0.020 . 1 . . . . 12 SER HA . 17484 1 22 . 1 1 12 12 SER HB2 H 1 4.374 0.020 . 2 . . . . 12 SER HB2 . 17484 1 23 . 1 1 12 12 SER HB3 H 1 3.948 0.020 . 2 . . . . 12 SER HB3 . 17484 1 24 . 1 1 12 12 SER CA C 13 56.516 0.400 . 1 . . . . 12 SER CA . 17484 1 25 . 1 1 12 12 SER CB C 13 65.530 0.400 . 1 . . . . 12 SER CB . 17484 1 26 . 1 1 12 12 SER N N 15 119.618 0.400 . 1 . . . . 12 SER N . 17484 1 27 . 1 1 13 13 HIS HA H 1 4.375 0.020 . 1 . . . . 13 HIS HA . 17484 1 28 . 1 1 13 13 HIS HB2 H 1 3.212 0.020 . 2 . . . . 13 HIS HB2 . 17484 1 29 . 1 1 13 13 HIS HB3 H 1 3.272 0.020 . 2 . . . . 13 HIS HB3 . 17484 1 30 . 1 1 13 13 HIS HD2 H 1 7.121 0.020 . 1 . . . . 13 HIS HD2 . 17484 1 31 . 1 1 13 13 HIS C C 13 176.950 0.400 . 1 . . . . 13 HIS C . 17484 1 32 . 1 1 13 13 HIS CA C 13 59.745 0.400 . 1 . . . . 13 HIS CA . 17484 1 33 . 1 1 13 13 HIS CB C 13 29.607 0.400 . 1 . . . . 13 HIS CB . 17484 1 34 . 1 1 13 13 HIS CD2 C 13 119.520 0.400 . 1 . . . . 13 HIS CD2 . 17484 1 35 . 1 1 14 14 THR H H 1 7.917 0.020 . 1 . . . . 14 THR H . 17484 1 36 . 1 1 14 14 THR HA H 1 3.812 0.020 . 1 . . . . 14 THR HA . 17484 1 37 . 1 1 14 14 THR HB H 1 4.045 0.020 . 1 . . . . 14 THR HB . 17484 1 38 . 1 1 14 14 THR HG21 H 1 1.208 0.020 . 1 . . . . 14 THR HG21 . 17484 1 39 . 1 1 14 14 THR HG22 H 1 1.208 0.020 . 1 . . . . 14 THR HG21 . 17484 1 40 . 1 1 14 14 THR HG23 H 1 1.208 0.020 . 1 . . . . 14 THR HG21 . 17484 1 41 . 1 1 14 14 THR C C 13 176.087 0.400 . 1 . . . . 14 THR C . 17484 1 42 . 1 1 14 14 THR CA C 13 65.624 0.400 . 1 . . . . 14 THR CA . 17484 1 43 . 1 1 14 14 THR CB C 13 68.516 0.400 . 1 . . . . 14 THR CB . 17484 1 44 . 1 1 14 14 THR CG2 C 13 21.815 0.400 . 1 . . . . 14 THR CG2 . 17484 1 45 . 1 1 14 14 THR N N 15 111.332 0.400 . 1 . . . . 14 THR N . 17484 1 46 . 1 1 15 15 GLN H H 1 7.507 0.020 . 1 . . . . 15 GLN H . 17484 1 47 . 1 1 15 15 GLN HA H 1 3.793 0.020 . 1 . . . . 15 GLN HA . 17484 1 48 . 1 1 15 15 GLN HB2 H 1 2.504 0.020 . 2 . . . . 15 GLN HB2 . 17484 1 49 . 1 1 15 15 GLN HB3 H 1 1.633 0.020 . 2 . . . . 15 GLN HB3 . 17484 1 50 . 1 1 15 15 GLN HG2 H 1 2.298 0.020 . 2 . . . . 15 GLN HG2 . 17484 1 51 . 1 1 15 15 GLN HG3 H 1 2.485 0.020 . 2 . . . . 15 GLN HG3 . 17484 1 52 . 1 1 15 15 GLN HE21 H 1 7.795 0.020 . 2 . . . . 15 GLN HE21 . 17484 1 53 . 1 1 15 15 GLN HE22 H 1 6.693 0.020 . 2 . . . . 15 GLN HE22 . 17484 1 54 . 1 1 15 15 GLN C C 13 176.854 0.400 . 1 . . . . 15 GLN C . 17484 1 55 . 1 1 15 15 GLN CA C 13 59.351 0.400 . 1 . . . . 15 GLN CA . 17484 1 56 . 1 1 15 15 GLN CB C 13 28.067 0.400 . 1 . . . . 15 GLN CB . 17484 1 57 . 1 1 15 15 GLN CG C 13 35.208 0.400 . 1 . . . . 15 GLN CG . 17484 1 58 . 1 1 15 15 GLN N N 15 120.358 0.400 . 1 . . . . 15 GLN N . 17484 1 59 . 1 1 15 15 GLN NE2 N 15 112.243 0.400 . 1 . . . . 15 GLN NE2 . 17484 1 60 . 1 1 16 16 VAL H H 1 7.825 0.020 . 1 . . . . 16 VAL H . 17484 1 61 . 1 1 16 16 VAL HA H 1 3.225 0.020 . 1 . . . . 16 VAL HA . 17484 1 62 . 1 1 16 16 VAL HB H 1 2.074 0.020 . 1 . . . . 16 VAL HB . 17484 1 63 . 1 1 16 16 VAL HG11 H 1 1.034 0.020 . 2 . . . . 16 VAL HG11 . 17484 1 64 . 1 1 16 16 VAL HG12 H 1 1.034 0.020 . 2 . . . . 16 VAL HG11 . 17484 1 65 . 1 1 16 16 VAL HG13 H 1 1.034 0.020 . 2 . . . . 16 VAL HG11 . 17484 1 66 . 1 1 16 16 VAL HG21 H 1 1.014 0.020 . 2 . . . . 16 VAL HG21 . 17484 1 67 . 1 1 16 16 VAL HG22 H 1 1.014 0.020 . 2 . . . . 16 VAL HG21 . 17484 1 68 . 1 1 16 16 VAL HG23 H 1 1.014 0.020 . 2 . . . . 16 VAL HG21 . 17484 1 69 . 1 1 16 16 VAL C C 13 177.405 0.400 . 1 . . . . 16 VAL C . 17484 1 70 . 1 1 16 16 VAL CA C 13 67.297 0.400 . 1 . . . . 16 VAL CA . 17484 1 71 . 1 1 16 16 VAL CB C 13 31.488 0.400 . 1 . . . . 16 VAL CB . 17484 1 72 . 1 1 16 16 VAL CG1 C 13 21.875 0.400 . 1 . . . . 16 VAL CG1 . 17484 1 73 . 1 1 16 16 VAL CG2 C 13 23.283 0.400 . 1 . . . . 16 VAL CG2 . 17484 1 74 . 1 1 16 16 VAL N N 15 117.358 0.400 . 1 . . . . 16 VAL N . 17484 1 75 . 1 1 17 17 ILE H H 1 8.010 0.020 . 1 . . . . 17 ILE H . 17484 1 76 . 1 1 17 17 ILE HA H 1 3.685 0.020 . 1 . . . . 17 ILE HA . 17484 1 77 . 1 1 17 17 ILE HB H 1 1.838 0.020 . 1 . . . . 17 ILE HB . 17484 1 78 . 1 1 17 17 ILE HG12 H 1 1.083 0.020 . 2 . . . . 17 ILE HG12 . 17484 1 79 . 1 1 17 17 ILE HG13 H 1 1.376 0.020 . 2 . . . . 17 ILE HG13 . 17484 1 80 . 1 1 17 17 ILE HG21 H 1 0.806 0.020 . 1 . . . . 17 ILE HG21 . 17484 1 81 . 1 1 17 17 ILE HG22 H 1 0.806 0.020 . 1 . . . . 17 ILE HG21 . 17484 1 82 . 1 1 17 17 ILE HG23 H 1 0.806 0.020 . 1 . . . . 17 ILE HG21 . 17484 1 83 . 1 1 17 17 ILE HD11 H 1 0.700 0.020 . 1 . . . . 17 ILE HD11 . 17484 1 84 . 1 1 17 17 ILE HD12 H 1 0.700 0.020 . 1 . . . . 17 ILE HD11 . 17484 1 85 . 1 1 17 17 ILE HD13 H 1 0.700 0.020 . 1 . . . . 17 ILE HD11 . 17484 1 86 . 1 1 17 17 ILE C C 13 179.130 0.400 . 1 . . . . 17 ILE C . 17484 1 87 . 1 1 17 17 ILE CA C 13 64.320 0.400 . 1 . . . . 17 ILE CA . 17484 1 88 . 1 1 17 17 ILE CB C 13 37.267 0.400 . 1 . . . . 17 ILE CB . 17484 1 89 . 1 1 17 17 ILE CG1 C 13 28.437 0.400 . 1 . . . . 17 ILE CG1 . 17484 1 90 . 1 1 17 17 ILE CG2 C 13 17.207 0.400 . 1 . . . . 17 ILE CG2 . 17484 1 91 . 1 1 17 17 ILE CD1 C 13 12.317 0.400 . 1 . . . . 17 ILE CD1 . 17484 1 92 . 1 1 17 17 ILE N N 15 118.342 0.400 . 1 . . . . 17 ILE N . 17484 1 93 . 1 1 18 18 GLU H H 1 7.552 0.020 . 1 . . . . 18 GLU H . 17484 1 94 . 1 1 18 18 GLU HA H 1 4.194 0.020 . 1 . . . . 18 GLU HA . 17484 1 95 . 1 1 18 18 GLU HB2 H 1 1.995 0.020 . 1 . . . . 18 GLU HB2 . 17484 1 96 . 1 1 18 18 GLU HB3 H 1 1.995 0.020 . 1 . . . . 18 GLU HB3 . 17484 1 97 . 1 1 18 18 GLU HG2 H 1 2.276 0.020 . 2 . . . . 18 GLU HG2 . 17484 1 98 . 1 1 18 18 GLU HG3 H 1 2.407 0.020 . 2 . . . . 18 GLU HG3 . 17484 1 99 . 1 1 18 18 GLU C C 13 179.730 0.400 . 1 . . . . 18 GLU C . 17484 1 100 . 1 1 18 18 GLU CA C 13 58.414 0.400 . 1 . . . . 18 GLU CA . 17484 1 101 . 1 1 18 18 GLU CB C 13 29.574 0.400 . 1 . . . . 18 GLU CB . 17484 1 102 . 1 1 18 18 GLU CG C 13 35.247 0.400 . 1 . . . . 18 GLU CG . 17484 1 103 . 1 1 18 18 GLU N N 15 119.233 0.400 . 1 . . . . 18 GLU N . 17484 1 104 . 1 1 19 19 LEU H H 1 7.984 0.020 . 1 . . . . 19 LEU H . 17484 1 105 . 1 1 19 19 LEU HA H 1 3.640 0.020 . 1 . . . . 19 LEU HA . 17484 1 106 . 1 1 19 19 LEU HB2 H 1 0.709 0.020 . 2 . . . . 19 LEU HB2 . 17484 1 107 . 1 1 19 19 LEU HB3 H 1 -0.755 0.020 . 2 . . . . 19 LEU HB3 . 17484 1 108 . 1 1 19 19 LEU HG H 1 1.241 0.020 . 1 . . . . 19 LEU HG . 17484 1 109 . 1 1 19 19 LEU HD11 H 1 -0.280 0.020 . 2 . . . . 19 LEU HD11 . 17484 1 110 . 1 1 19 19 LEU HD12 H 1 -0.280 0.020 . 2 . . . . 19 LEU HD11 . 17484 1 111 . 1 1 19 19 LEU HD13 H 1 -0.280 0.020 . 2 . . . . 19 LEU HD11 . 17484 1 112 . 1 1 19 19 LEU HD21 H 1 0.534 0.020 . 2 . . . . 19 LEU HD21 . 17484 1 113 . 1 1 19 19 LEU HD22 H 1 0.534 0.020 . 2 . . . . 19 LEU HD21 . 17484 1 114 . 1 1 19 19 LEU HD23 H 1 0.534 0.020 . 2 . . . . 19 LEU HD21 . 17484 1 115 . 1 1 19 19 LEU C C 13 177.812 0.400 . 1 . . . . 19 LEU C . 17484 1 116 . 1 1 19 19 LEU CA C 13 58.536 0.400 . 1 . . . . 19 LEU CA . 17484 1 117 . 1 1 19 19 LEU CB C 13 37.720 0.400 . 1 . . . . 19 LEU CB . 17484 1 118 . 1 1 19 19 LEU CG C 13 25.696 0.400 . 1 . . . . 19 LEU CG . 17484 1 119 . 1 1 19 19 LEU CD1 C 13 24.602 0.400 . 1 . . . . 19 LEU CD1 . 17484 1 120 . 1 1 19 19 LEU CD2 C 13 23.510 0.400 . 1 . . . . 19 LEU CD2 . 17484 1 121 . 1 1 19 19 LEU N N 15 124.248 0.400 . 1 . . . . 19 LEU N . 17484 1 122 . 1 1 20 20 GLU H H 1 8.409 0.020 . 1 . . . . 20 GLU H . 17484 1 123 . 1 1 20 20 GLU HA H 1 4.221 0.020 . 1 . . . . 20 GLU HA . 17484 1 124 . 1 1 20 20 GLU HB2 H 1 2.164 0.020 . 2 . . . . 20 GLU HB2 . 17484 1 125 . 1 1 20 20 GLU HB3 H 1 2.040 0.020 . 2 . . . . 20 GLU HB3 . 17484 1 126 . 1 1 20 20 GLU HG2 H 1 2.463 0.020 . 2 . . . . 20 GLU HG2 . 17484 1 127 . 1 1 20 20 GLU HG3 H 1 2.423 0.020 . 2 . . . . 20 GLU HG3 . 17484 1 128 . 1 1 20 20 GLU C C 13 179.873 0.400 . 1 . . . . 20 GLU C . 17484 1 129 . 1 1 20 20 GLU CA C 13 59.068 0.400 . 1 . . . . 20 GLU CA . 17484 1 130 . 1 1 20 20 GLU CB C 13 28.888 0.400 . 1 . . . . 20 GLU CB . 17484 1 131 . 1 1 20 20 GLU CG C 13 35.401 0.400 . 1 . . . . 20 GLU CG . 17484 1 132 . 1 1 20 20 GLU N N 15 118.680 0.400 . 1 . . . . 20 GLU N . 17484 1 133 . 1 1 21 21 ARG H H 1 8.311 0.020 . 1 . . . . 21 ARG H . 17484 1 134 . 1 1 21 21 ARG HA H 1 4.071 0.020 . 1 . . . . 21 ARG HA . 17484 1 135 . 1 1 21 21 ARG HB2 H 1 1.966 0.020 . 2 . . . . 21 ARG HB2 . 17484 1 136 . 1 1 21 21 ARG HB3 H 1 1.969 0.020 . 2 . . . . 21 ARG HB3 . 17484 1 137 . 1 1 21 21 ARG HG2 H 1 1.859 0.020 . 2 . . . . 21 ARG HG2 . 17484 1 138 . 1 1 21 21 ARG HG3 H 1 1.604 0.020 . 2 . . . . 21 ARG HG3 . 17484 1 139 . 1 1 21 21 ARG HD2 H 1 3.200 0.020 . 2 . . . . 21 ARG HD2 . 17484 1 140 . 1 1 21 21 ARG HD3 H 1 3.234 0.020 . 2 . . . . 21 ARG HD3 . 17484 1 141 . 1 1 21 21 ARG C C 13 179.754 0.400 . 1 . . . . 21 ARG C . 17484 1 142 . 1 1 21 21 ARG CA C 13 59.555 0.400 . 1 . . . . 21 ARG CA . 17484 1 143 . 1 1 21 21 ARG CB C 13 30.194 0.400 . 1 . . . . 21 ARG CB . 17484 1 144 . 1 1 21 21 ARG CG C 13 27.310 0.400 . 1 . . . . 21 ARG CG . 17484 1 145 . 1 1 21 21 ARG CD C 13 43.431 0.400 . 1 . . . . 21 ARG CD . 17484 1 146 . 1 1 21 21 ARG N N 15 121.061 0.400 . 1 . . . . 21 ARG N . 17484 1 147 . 1 1 22 22 LYS H H 1 8.030 0.020 . 1 . . . . 22 LYS H . 17484 1 148 . 1 1 22 22 LYS HA H 1 4.351 0.020 . 1 . . . . 22 LYS HA . 17484 1 149 . 1 1 22 22 LYS HB2 H 1 2.056 0.020 . 2 . . . . 22 LYS HB2 . 17484 1 150 . 1 1 22 22 LYS HB3 H 1 2.380 0.020 . 2 . . . . 22 LYS HB3 . 17484 1 151 . 1 1 22 22 LYS HG2 H 1 1.714 0.020 . 2 . . . . 22 LYS HG2 . 17484 1 152 . 1 1 22 22 LYS HG3 H 1 1.678 0.020 . 2 . . . . 22 LYS HG3 . 17484 1 153 . 1 1 22 22 LYS HD2 H 1 1.819 0.020 . 2 . . . . 22 LYS HD2 . 17484 1 154 . 1 1 22 22 LYS HD3 H 1 1.960 0.020 . 2 . . . . 22 LYS HD3 . 17484 1 155 . 1 1 22 22 LYS HE2 H 1 2.802 0.020 . 2 . . . . 22 LYS HE2 . 17484 1 156 . 1 1 22 22 LYS HE3 H 1 2.950 0.020 . 2 . . . . 22 LYS HE3 . 17484 1 157 . 1 1 22 22 LYS C C 13 178.052 0.400 . 1 . . . . 22 LYS C . 17484 1 158 . 1 1 22 22 LYS CA C 13 57.923 0.400 . 1 . . . . 22 LYS CA . 17484 1 159 . 1 1 22 22 LYS CB C 13 30.619 0.400 . 1 . . . . 22 LYS CB . 17484 1 160 . 1 1 22 22 LYS CG C 13 24.774 0.400 . 1 . . . . 22 LYS CG . 17484 1 161 . 1 1 22 22 LYS CD C 13 27.946 0.400 . 1 . . . . 22 LYS CD . 17484 1 162 . 1 1 22 22 LYS CE C 13 42.078 0.400 . 1 . . . . 22 LYS CE . 17484 1 163 . 1 1 22 22 LYS N N 15 120.920 0.400 . 1 . . . . 22 LYS N . 17484 1 164 . 1 1 23 23 PHE H H 1 8.995 0.020 . 1 . . . . 23 PHE H . 17484 1 165 . 1 1 23 23 PHE HA H 1 4.757 0.020 . 1 . . . . 23 PHE HA . 17484 1 166 . 1 1 23 23 PHE HB2 H 1 3.154 0.020 . 2 . . . . 23 PHE HB2 . 17484 1 167 . 1 1 23 23 PHE HB3 H 1 3.079 0.020 . 2 . . . . 23 PHE HB3 . 17484 1 168 . 1 1 23 23 PHE HD1 H 1 7.059 0.020 . 1 . . . . 23 PHE HD1 . 17484 1 169 . 1 1 23 23 PHE HD2 H 1 7.059 0.020 . 1 . . . . 23 PHE HD2 . 17484 1 170 . 1 1 23 23 PHE HE1 H 1 7.174 0.020 . 1 . . . . 23 PHE HE1 . 17484 1 171 . 1 1 23 23 PHE HE2 H 1 7.174 0.020 . 1 . . . . 23 PHE HE2 . 17484 1 172 . 1 1 23 23 PHE HZ H 1 6.946 0.020 . 1 . . . . 23 PHE HZ . 17484 1 173 . 1 1 23 23 PHE C C 13 176.255 0.400 . 1 . . . . 23 PHE C . 17484 1 174 . 1 1 23 23 PHE CA C 13 60.132 0.400 . 1 . . . . 23 PHE CA . 17484 1 175 . 1 1 23 23 PHE CB C 13 39.316 0.400 . 1 . . . . 23 PHE CB . 17484 1 176 . 1 1 23 23 PHE CD1 C 13 132.367 0.400 . 1 . . . . 23 PHE CD1 . 17484 1 177 . 1 1 23 23 PHE CD2 C 13 132.511 0.400 . 1 . . . . 23 PHE CD2 . 17484 1 178 . 1 1 23 23 PHE CE1 C 13 130.753 0.400 . 1 . . . . 23 PHE CE1 . 17484 1 179 . 1 1 23 23 PHE CE2 C 13 130.600 0.400 . 1 . . . . 23 PHE CE2 . 17484 1 180 . 1 1 23 23 PHE CZ C 13 128.825 0.400 . 1 . . . . 23 PHE CZ . 17484 1 181 . 1 1 23 23 PHE N N 15 121.576 0.400 . 1 . . . . 23 PHE N . 17484 1 182 . 1 1 24 24 SER H H 1 8.128 0.020 . 1 . . . . 24 SER H . 17484 1 183 . 1 1 24 24 SER HA H 1 4.078 0.020 . 1 . . . . 24 SER HA . 17484 1 184 . 1 1 24 24 SER HB2 H 1 3.969 0.020 . 2 . . . . 24 SER HB2 . 17484 1 185 . 1 1 24 24 SER HB3 H 1 3.971 0.020 . 2 . . . . 24 SER HB3 . 17484 1 186 . 1 1 24 24 SER C C 13 174.530 0.400 . 1 . . . . 24 SER C . 17484 1 187 . 1 1 24 24 SER CA C 13 61.105 0.400 . 1 . . . . 24 SER CA . 17484 1 188 . 1 1 24 24 SER CB C 13 63.026 0.400 . 1 . . . . 24 SER CB . 17484 1 189 . 1 1 24 24 SER N N 15 111.736 0.400 . 1 . . . . 24 SER N . 17484 1 190 . 1 1 25 25 HIS H H 1 7.635 0.020 . 1 . . . . 25 HIS H . 17484 1 191 . 1 1 25 25 HIS HA H 1 4.699 0.020 . 1 . . . . 25 HIS HA . 17484 1 192 . 1 1 25 25 HIS HB2 H 1 3.371 0.020 . 2 . . . . 25 HIS HB2 . 17484 1 193 . 1 1 25 25 HIS HB3 H 1 3.307 0.020 . 2 . . . . 25 HIS HB3 . 17484 1 194 . 1 1 25 25 HIS HD2 H 1 7.306 0.020 . 1 . . . . 25 HIS HD2 . 17484 1 195 . 1 1 25 25 HIS C C 13 174.865 0.400 . 1 . . . . 25 HIS C . 17484 1 196 . 1 1 25 25 HIS CA C 13 56.948 0.400 . 1 . . . . 25 HIS CA . 17484 1 197 . 1 1 25 25 HIS CB C 13 31.203 0.400 . 1 . . . . 25 HIS CB . 17484 1 198 . 1 1 25 25 HIS CD2 C 13 120.871 0.400 . 1 . . . . 25 HIS CD2 . 17484 1 199 . 1 1 25 25 HIS N N 15 118.436 0.400 . 1 . . . . 25 HIS N . 17484 1 200 . 1 1 26 26 GLN H H 1 8.506 0.020 . 1 . . . . 26 GLN H . 17484 1 201 . 1 1 26 26 GLN HA H 1 4.486 0.020 . 1 . . . . 26 GLN HA . 17484 1 202 . 1 1 26 26 GLN HB2 H 1 2.022 0.020 . 1 . . . . 26 GLN HB2 . 17484 1 203 . 1 1 26 26 GLN HB3 H 1 2.022 0.020 . 1 . . . . 26 GLN HB3 . 17484 1 204 . 1 1 26 26 GLN HG2 H 1 2.288 0.020 . 1 . . . . 26 GLN HG2 . 17484 1 205 . 1 1 26 26 GLN HG3 H 1 2.289 0.020 . 1 . . . . 26 GLN HG3 . 17484 1 206 . 1 1 26 26 GLN HE21 H 1 7.402 0.020 . 2 . . . . 26 GLN HE21 . 17484 1 207 . 1 1 26 26 GLN HE22 H 1 7.645 0.020 . 2 . . . . 26 GLN HE22 . 17484 1 208 . 1 1 26 26 GLN C C 13 171.797 0.400 . 1 . . . . 26 GLN C . 17484 1 209 . 1 1 26 26 GLN CA C 13 55.435 0.400 . 1 . . . . 26 GLN CA . 17484 1 210 . 1 1 26 26 GLN CB C 13 31.797 0.400 . 1 . . . . 26 GLN CB . 17484 1 211 . 1 1 26 26 GLN CG C 13 34.105 0.400 . 1 . . . . 26 GLN CG . 17484 1 212 . 1 1 26 26 GLN N N 15 121.108 0.400 . 1 . . . . 26 GLN N . 17484 1 213 . 1 1 26 26 GLN NE2 N 15 113.367 0.400 . 1 . . . . 26 GLN NE2 . 17484 1 214 . 1 1 27 27 LYS H H 1 8.121 0.020 . 1 . . . . 27 LYS H . 17484 1 215 . 1 1 27 27 LYS HA H 1 3.902 0.020 . 1 . . . . 27 LYS HA . 17484 1 216 . 1 1 27 27 LYS HB2 H 1 1.418 0.020 . 2 . . . . 27 LYS HB2 . 17484 1 217 . 1 1 27 27 LYS HB3 H 1 1.560 0.020 . 2 . . . . 27 LYS HB3 . 17484 1 218 . 1 1 27 27 LYS HG2 H 1 0.632 0.020 . 2 . . . . 27 LYS HG2 . 17484 1 219 . 1 1 27 27 LYS HG3 H 1 1.156 0.020 . 2 . . . . 27 LYS HG3 . 17484 1 220 . 1 1 27 27 LYS HD2 H 1 1.231 0.020 . 2 . . . . 27 LYS HD2 . 17484 1 221 . 1 1 27 27 LYS HD3 H 1 1.334 0.020 . 2 . . . . 27 LYS HD3 . 17484 1 222 . 1 1 27 27 LYS HE2 H 1 2.836 0.020 . 2 . . . . 27 LYS HE2 . 17484 1 223 . 1 1 27 27 LYS HE3 H 1 2.763 0.020 . 2 . . . . 27 LYS HE3 . 17484 1 224 . 1 1 27 27 LYS C C 13 174.625 0.400 . 1 . . . . 27 LYS C . 17484 1 225 . 1 1 27 27 LYS CA C 13 56.759 0.400 . 1 . . . . 27 LYS CA . 17484 1 226 . 1 1 27 27 LYS CB C 13 32.954 0.400 . 1 . . . . 27 LYS CB . 17484 1 227 . 1 1 27 27 LYS CG C 13 24.910 0.400 . 1 . . . . 27 LYS CG . 17484 1 228 . 1 1 27 27 LYS CD C 13 28.522 0.400 . 1 . . . . 27 LYS CD . 17484 1 229 . 1 1 27 27 LYS CE C 13 42.400 0.400 . 1 . . . . 27 LYS CE . 17484 1 230 . 1 1 27 27 LYS N N 15 119.983 0.400 . 1 . . . . 27 LYS N . 17484 1 231 . 1 1 28 28 TYR H H 1 7.503 0.020 . 1 . . . . 28 TYR H . 17484 1 232 . 1 1 28 28 TYR HA H 1 4.719 0.020 . 1 . . . . 28 TYR HA . 17484 1 233 . 1 1 28 28 TYR HB2 H 1 2.946 0.020 . 2 . . . . 28 TYR HB2 . 17484 1 234 . 1 1 28 28 TYR HB3 H 1 2.717 0.020 . 2 . . . . 28 TYR HB3 . 17484 1 235 . 1 1 28 28 TYR HD1 H 1 7.127 0.020 . 1 . . . . 28 TYR HD1 . 17484 1 236 . 1 1 28 28 TYR HD2 H 1 7.127 0.020 . 1 . . . . 28 TYR HD2 . 17484 1 237 . 1 1 28 28 TYR HE1 H 1 6.789 0.020 . 1 . . . . 28 TYR HE1 . 17484 1 238 . 1 1 28 28 TYR HE2 H 1 6.789 0.020 . 1 . . . . 28 TYR HE2 . 17484 1 239 . 1 1 28 28 TYR C C 13 174.529 0.400 . 1 . . . . 28 TYR C . 17484 1 240 . 1 1 28 28 TYR CA C 13 56.378 0.400 . 1 . . . . 28 TYR CA . 17484 1 241 . 1 1 28 28 TYR CB C 13 41.184 0.400 . 1 . . . . 28 TYR CB . 17484 1 242 . 1 1 28 28 TYR CD1 C 13 133.552 0.400 . 1 . . . . 28 TYR CD1 . 17484 1 243 . 1 1 28 28 TYR CD2 C 13 133.605 0.400 . 1 . . . . 28 TYR CD2 . 17484 1 244 . 1 1 28 28 TYR CE1 C 13 117.713 0.400 . 1 . . . . 28 TYR CE1 . 17484 1 245 . 1 1 28 28 TYR CE2 C 13 117.910 0.400 . 1 . . . . 28 TYR CE2 . 17484 1 246 . 1 1 28 28 TYR N N 15 113.084 0.400 . 1 . . . . 28 TYR N . 17484 1 247 . 1 1 29 29 LEU H H 1 8.503 0.020 . 1 . . . . 29 LEU H . 17484 1 248 . 1 1 29 29 LEU HA H 1 4.584 0.020 . 1 . . . . 29 LEU HA . 17484 1 249 . 1 1 29 29 LEU HB2 H 1 1.243 0.020 . 2 . . . . 29 LEU HB2 . 17484 1 250 . 1 1 29 29 LEU HB3 H 1 1.461 0.020 . 2 . . . . 29 LEU HB3 . 17484 1 251 . 1 1 29 29 LEU HG H 1 0.741 0.020 . 1 . . . . 29 LEU HG . 17484 1 252 . 1 1 29 29 LEU HD11 H 1 0.148 0.020 . 2 . . . . 29 LEU HD11 . 17484 1 253 . 1 1 29 29 LEU HD12 H 1 0.148 0.020 . 2 . . . . 29 LEU HD11 . 17484 1 254 . 1 1 29 29 LEU HD13 H 1 0.148 0.020 . 2 . . . . 29 LEU HD11 . 17484 1 255 . 1 1 29 29 LEU HD21 H 1 0.461 0.020 . 2 . . . . 29 LEU HD21 . 17484 1 256 . 1 1 29 29 LEU HD22 H 1 0.461 0.020 . 2 . . . . 29 LEU HD21 . 17484 1 257 . 1 1 29 29 LEU HD23 H 1 0.461 0.020 . 2 . . . . 29 LEU HD21 . 17484 1 258 . 1 1 29 29 LEU C C 13 176.710 0.400 . 1 . . . . 29 LEU C . 17484 1 259 . 1 1 29 29 LEU CA C 13 53.057 0.400 . 1 . . . . 29 LEU CA . 17484 1 260 . 1 1 29 29 LEU CB C 13 44.306 0.400 . 1 . . . . 29 LEU CB . 17484 1 261 . 1 1 29 29 LEU CG C 13 26.770 0.400 . 1 . . . . 29 LEU CG . 17484 1 262 . 1 1 29 29 LEU CD1 C 13 26.449 0.400 . 1 . . . . 29 LEU CD1 . 17484 1 263 . 1 1 29 29 LEU CD2 C 13 23.312 0.400 . 1 . . . . 29 LEU CD2 . 17484 1 264 . 1 1 29 29 LEU N N 15 122.842 0.400 . 1 . . . . 29 LEU N . 17484 1 265 . 1 1 30 30 SER H H 1 8.979 0.020 . 1 . . . . 30 SER H . 17484 1 266 . 1 1 30 30 SER HA H 1 4.554 0.020 . 1 . . . . 30 SER HA . 17484 1 267 . 1 1 30 30 SER HB2 H 1 4.010 0.020 . 2 . . . . 30 SER HB2 . 17484 1 268 . 1 1 30 30 SER HB3 H 1 4.224 0.020 . 2 . . . . 30 SER HB3 . 17484 1 269 . 1 1 30 30 SER C C 13 174.313 0.400 . 1 . . . . 30 SER C . 17484 1 270 . 1 1 30 30 SER CA C 13 56.863 0.400 . 1 . . . . 30 SER CA . 17484 1 271 . 1 1 30 30 SER CB C 13 64.903 0.400 . 1 . . . . 30 SER CB . 17484 1 272 . 1 1 30 30 SER N N 15 118.858 0.400 . 1 . . . . 30 SER N . 17484 1 273 . 1 1 31 31 ALA H H 1 9.180 0.020 . 1 . . . . 31 ALA H . 17484 1 274 . 1 1 31 31 ALA HA H 1 4.211 0.020 . 1 . . . . 31 ALA HA . 17484 1 275 . 1 1 31 31 ALA HB1 H 1 1.558 0.020 . 1 . . . . 31 ALA HB1 . 17484 1 276 . 1 1 31 31 ALA HB2 H 1 1.558 0.020 . 1 . . . . 31 ALA HB1 . 17484 1 277 . 1 1 31 31 ALA HB3 H 1 1.558 0.020 . 1 . . . . 31 ALA HB1 . 17484 1 278 . 1 1 31 31 ALA CA C 13 57.187 0.400 . 1 . . . . 31 ALA CA . 17484 1 279 . 1 1 31 31 ALA CB C 13 15.325 0.400 . 1 . . . . 31 ALA CB . 17484 1 280 . 1 1 31 31 ALA N N 15 123.123 0.400 . 1 . . . . 31 ALA N . 17484 1 281 . 1 1 32 32 PRO HA H 1 4.381 0.020 . 1 . . . . 32 PRO HA . 17484 1 282 . 1 1 32 32 PRO HB2 H 1 1.796 0.020 . 2 . . . . 32 PRO HB2 . 17484 1 283 . 1 1 32 32 PRO HB3 H 1 2.308 0.020 . 2 . . . . 32 PRO HB3 . 17484 1 284 . 1 1 32 32 PRO HG2 H 1 1.981 0.020 . 2 . . . . 32 PRO HG2 . 17484 1 285 . 1 1 32 32 PRO HG3 H 1 2.098 0.020 . 2 . . . . 32 PRO HG3 . 17484 1 286 . 1 1 32 32 PRO HD2 H 1 3.912 0.020 . 2 . . . . 32 PRO HD2 . 17484 1 287 . 1 1 32 32 PRO HD3 H 1 3.799 0.020 . 2 . . . . 32 PRO HD3 . 17484 1 288 . 1 1 32 32 PRO C C 13 179.873 0.400 . 1 . . . . 32 PRO C . 17484 1 289 . 1 1 32 32 PRO CA C 13 65.822 0.400 . 1 . . . . 32 PRO CA . 17484 1 290 . 1 1 32 32 PRO CB C 13 30.877 0.400 . 1 . . . . 32 PRO CB . 17484 1 291 . 1 1 32 32 PRO CG C 13 28.378 0.400 . 1 . . . . 32 PRO CG . 17484 1 292 . 1 1 32 32 PRO CD C 13 50.036 0.400 . 1 . . . . 32 PRO CD . 17484 1 293 . 1 1 33 33 GLU H H 1 7.209 0.020 . 1 . . . . 33 GLU H . 17484 1 294 . 1 1 33 33 GLU HA H 1 4.072 0.020 . 1 . . . . 33 GLU HA . 17484 1 295 . 1 1 33 33 GLU HB2 H 1 1.883 0.020 . 2 . . . . 33 GLU HB2 . 17484 1 296 . 1 1 33 33 GLU HB3 H 1 2.317 0.020 . 2 . . . . 33 GLU HB3 . 17484 1 297 . 1 1 33 33 GLU HG2 H 1 2.323 0.020 . 2 . . . . 33 GLU HG2 . 17484 1 298 . 1 1 33 33 GLU HG3 H 1 2.233 0.020 . 2 . . . . 33 GLU HG3 . 17484 1 299 . 1 1 33 33 GLU C C 13 179.538 0.400 . 1 . . . . 33 GLU C . 17484 1 300 . 1 1 33 33 GLU CA C 13 58.903 0.400 . 1 . . . . 33 GLU CA . 17484 1 301 . 1 1 33 33 GLU CB C 13 30.881 0.400 . 1 . . . . 33 GLU CB . 17484 1 302 . 1 1 33 33 GLU CG C 13 37.358 0.400 . 1 . . . . 33 GLU CG . 17484 1 303 . 1 1 33 33 GLU N N 15 117.779 0.400 . 1 . . . . 33 GLU N . 17484 1 304 . 1 1 34 34 ARG H H 1 8.732 0.020 . 1 . . . . 34 ARG H . 17484 1 305 . 1 1 34 34 ARG HA H 1 3.789 0.020 . 1 . . . . 34 ARG HA . 17484 1 306 . 1 1 34 34 ARG HB2 H 1 1.938 0.020 . 2 . . . . 34 ARG HB2 . 17484 1 307 . 1 1 34 34 ARG HB3 H 1 1.859 0.020 . 2 . . . . 34 ARG HB3 . 17484 1 308 . 1 1 34 34 ARG HG2 H 1 1.342 0.020 . 2 . . . . 34 ARG HG2 . 17484 1 309 . 1 1 34 34 ARG HG3 H 1 1.586 0.020 . 2 . . . . 34 ARG HG3 . 17484 1 310 . 1 1 34 34 ARG HD2 H 1 3.545 0.020 . 2 . . . . 34 ARG HD2 . 17484 1 311 . 1 1 34 34 ARG HD3 H 1 3.269 0.020 . 2 . . . . 34 ARG HD3 . 17484 1 312 . 1 1 34 34 ARG C C 13 177.165 0.400 . 1 . . . . 34 ARG C . 17484 1 313 . 1 1 34 34 ARG CA C 13 59.866 0.400 . 1 . . . . 34 ARG CA . 17484 1 314 . 1 1 34 34 ARG CB C 13 29.955 0.400 . 1 . . . . 34 ARG CB . 17484 1 315 . 1 1 34 34 ARG CG C 13 28.147 0.400 . 1 . . . . 34 ARG CG . 17484 1 316 . 1 1 34 34 ARG CD C 13 43.100 0.400 . 1 . . . . 34 ARG CD . 17484 1 317 . 1 1 34 34 ARG N N 15 121.670 0.400 . 1 . . . . 34 ARG N . 17484 1 318 . 1 1 35 35 ALA H H 1 8.152 0.020 . 1 . . . . 35 ALA H . 17484 1 319 . 1 1 35 35 ALA HA H 1 3.981 0.020 . 1 . . . . 35 ALA HA . 17484 1 320 . 1 1 35 35 ALA HB1 H 1 1.486 0.020 . 1 . . . . 35 ALA HB1 . 17484 1 321 . 1 1 35 35 ALA HB2 H 1 1.486 0.020 . 1 . . . . 35 ALA HB1 . 17484 1 322 . 1 1 35 35 ALA HB3 H 1 1.486 0.020 . 1 . . . . 35 ALA HB1 . 17484 1 323 . 1 1 35 35 ALA C C 13 180.089 0.400 . 1 . . . . 35 ALA C . 17484 1 324 . 1 1 35 35 ALA CA C 13 55.190 0.400 . 1 . . . . 35 ALA CA . 17484 1 325 . 1 1 35 35 ALA CB C 13 17.885 0.400 . 1 . . . . 35 ALA CB . 17484 1 326 . 1 1 35 35 ALA N N 15 120.967 0.400 . 1 . . . . 35 ALA N . 17484 1 327 . 1 1 36 36 HIS H H 1 7.990 0.020 . 1 . . . . 36 HIS H . 17484 1 328 . 1 1 36 36 HIS HA H 1 4.317 0.020 . 1 . . . . 36 HIS HA . 17484 1 329 . 1 1 36 36 HIS HB2 H 1 3.188 0.020 . 1 . . . . 36 HIS HB2 . 17484 1 330 . 1 1 36 36 HIS HB3 H 1 3.188 0.020 . 1 . . . . 36 HIS HB3 . 17484 1 331 . 1 1 36 36 HIS HD2 H 1 7.047 0.020 . 1 . . . . 36 HIS HD2 . 17484 1 332 . 1 1 36 36 HIS C C 13 177.069 0.400 . 1 . . . . 36 HIS C . 17484 1 333 . 1 1 36 36 HIS CA C 13 59.410 0.400 . 1 . . . . 36 HIS CA . 17484 1 334 . 1 1 36 36 HIS CB C 13 30.634 0.400 . 1 . . . . 36 HIS CB . 17484 1 335 . 1 1 36 36 HIS CD2 C 13 119.735 0.400 . 1 . . . . 36 HIS CD2 . 17484 1 336 . 1 1 36 36 HIS N N 15 118.295 0.400 . 1 . . . . 36 HIS N . 17484 1 337 . 1 1 37 37 LEU H H 1 8.067 0.020 . 1 . . . . 37 LEU H . 17484 1 338 . 1 1 37 37 LEU HA H 1 4.060 0.020 . 1 . . . . 37 LEU HA . 17484 1 339 . 1 1 37 37 LEU HB2 H 1 1.664 0.020 . 2 . . . . 37 LEU HB2 . 17484 1 340 . 1 1 37 37 LEU HB3 H 1 1.732 0.020 . 2 . . . . 37 LEU HB3 . 17484 1 341 . 1 1 37 37 LEU HG H 1 1.560 0.020 . 1 . . . . 37 LEU HG . 17484 1 342 . 1 1 37 37 LEU HD11 H 1 0.963 0.020 . 2 . . . . 37 LEU HD11 . 17484 1 343 . 1 1 37 37 LEU HD12 H 1 0.963 0.020 . 2 . . . . 37 LEU HD11 . 17484 1 344 . 1 1 37 37 LEU HD13 H 1 0.963 0.020 . 2 . . . . 37 LEU HD11 . 17484 1 345 . 1 1 37 37 LEU HD21 H 1 0.918 0.020 . 2 . . . . 37 LEU HD21 . 17484 1 346 . 1 1 37 37 LEU HD22 H 1 0.918 0.020 . 2 . . . . 37 LEU HD21 . 17484 1 347 . 1 1 37 37 LEU HD23 H 1 0.918 0.020 . 2 . . . . 37 LEU HD21 . 17484 1 348 . 1 1 37 37 LEU C C 13 177.980 0.400 . 1 . . . . 37 LEU C . 17484 1 349 . 1 1 37 37 LEU CA C 13 57.843 0.400 . 1 . . . . 37 LEU CA . 17484 1 350 . 1 1 37 37 LEU CB C 13 42.651 0.400 . 1 . . . . 37 LEU CB . 17484 1 351 . 1 1 37 37 LEU CG C 13 26.770 0.400 . 1 . . . . 37 LEU CG . 17484 1 352 . 1 1 37 37 LEU CD1 C 13 24.233 0.400 . 1 . . . . 37 LEU CD1 . 17484 1 353 . 1 1 37 37 LEU CD2 C 13 27.313 0.400 . 1 . . . . 37 LEU CD2 . 17484 1 354 . 1 1 37 37 LEU N N 15 120.686 0.400 . 1 . . . . 37 LEU N . 17484 1 355 . 1 1 38 38 ALA H H 1 8.436 0.020 . 1 . . . . 38 ALA H . 17484 1 356 . 1 1 38 38 ALA HA H 1 3.613 0.020 . 1 . . . . 38 ALA HA . 17484 1 357 . 1 1 38 38 ALA HB1 H 1 1.345 0.020 . 1 . . . . 38 ALA HB1 . 17484 1 358 . 1 1 38 38 ALA HB2 H 1 1.345 0.020 . 1 . . . . 38 ALA HB1 . 17484 1 359 . 1 1 38 38 ALA HB3 H 1 1.345 0.020 . 1 . . . . 38 ALA HB1 . 17484 1 360 . 1 1 38 38 ALA C C 13 179.107 0.400 . 1 . . . . 38 ALA C . 17484 1 361 . 1 1 38 38 ALA CA C 13 55.883 0.400 . 1 . . . . 38 ALA CA . 17484 1 362 . 1 1 38 38 ALA CB C 13 17.519 0.400 . 1 . . . . 38 ALA CB . 17484 1 363 . 1 1 38 38 ALA N N 15 119.326 0.400 . 1 . . . . 38 ALA N . 17484 1 364 . 1 1 39 39 LYS H H 1 7.674 0.020 . 1 . . . . 39 LYS H . 17484 1 365 . 1 1 39 39 LYS HA H 1 4.082 0.020 . 1 . . . . 39 LYS HA . 17484 1 366 . 1 1 39 39 LYS HB2 H 1 1.922 0.020 . 2 . . . . 39 LYS HB2 . 17484 1 367 . 1 1 39 39 LYS HB3 H 1 1.924 0.020 . 2 . . . . 39 LYS HB3 . 17484 1 368 . 1 1 39 39 LYS HG2 H 1 1.430 0.020 . 2 . . . . 39 LYS HG2 . 17484 1 369 . 1 1 39 39 LYS HG3 H 1 1.545 0.020 . 2 . . . . 39 LYS HG3 . 17484 1 370 . 1 1 39 39 LYS HD2 H 1 1.694 0.020 . 1 . . . . 39 LYS HD2 . 17484 1 371 . 1 1 39 39 LYS HD3 H 1 1.694 0.020 . 1 . . . . 39 LYS HD3 . 17484 1 372 . 1 1 39 39 LYS HE2 H 1 2.981 0.020 . 1 . . . . 39 LYS HE2 . 17484 1 373 . 1 1 39 39 LYS HE3 H 1 2.981 0.020 . 1 . . . . 39 LYS HE3 . 17484 1 374 . 1 1 39 39 LYS C C 13 179.897 0.400 . 1 . . . . 39 LYS C . 17484 1 375 . 1 1 39 39 LYS CA C 13 59.025 0.400 . 1 . . . . 39 LYS CA . 17484 1 376 . 1 1 39 39 LYS CB C 13 32.119 0.400 . 1 . . . . 39 LYS CB . 17484 1 377 . 1 1 39 39 LYS CG C 13 24.824 0.400 . 1 . . . . 39 LYS CG . 17484 1 378 . 1 1 39 39 LYS CD C 13 28.780 0.400 . 1 . . . . 39 LYS CD . 17484 1 379 . 1 1 39 39 LYS CE C 13 41.780 0.400 . 1 . . . . 39 LYS CE . 17484 1 380 . 1 1 39 39 LYS N N 15 116.420 0.400 . 1 . . . . 39 LYS N . 17484 1 381 . 1 1 40 40 ASN H H 1 8.018 0.020 . 1 . . . . 40 ASN H . 17484 1 382 . 1 1 40 40 ASN HA H 1 4.372 0.020 . 1 . . . . 40 ASN HA . 17484 1 383 . 1 1 40 40 ASN HB2 H 1 2.763 0.020 . 2 . . . . 40 ASN HB2 . 17484 1 384 . 1 1 40 40 ASN HB3 H 1 2.700 0.020 . 2 . . . . 40 ASN HB3 . 17484 1 385 . 1 1 40 40 ASN HD21 H 1 7.290 0.020 . 2 . . . . 40 ASN HD21 . 17484 1 386 . 1 1 40 40 ASN HD22 H 1 6.524 0.020 . 2 . . . . 40 ASN HD22 . 17484 1 387 . 1 1 40 40 ASN C C 13 176.734 0.400 . 1 . . . . 40 ASN C . 17484 1 388 . 1 1 40 40 ASN CA C 13 55.842 0.400 . 1 . . . . 40 ASN CA . 17484 1 389 . 1 1 40 40 ASN CB C 13 38.333 0.400 . 1 . . . . 40 ASN CB . 17484 1 390 . 1 1 40 40 ASN N N 15 117.686 0.400 . 1 . . . . 40 ASN N . 17484 1 391 . 1 1 40 40 ASN ND2 N 15 110.971 0.400 . 1 . . . . 40 ASN ND2 . 17484 1 392 . 1 1 41 41 LEU H H 1 8.057 0.020 . 1 . . . . 41 LEU H . 17484 1 393 . 1 1 41 41 LEU HA H 1 4.340 0.020 . 1 . . . . 41 LEU HA . 17484 1 394 . 1 1 41 41 LEU HB2 H 1 1.617 0.020 . 2 . . . . 41 LEU HB2 . 17484 1 395 . 1 1 41 41 LEU HB3 H 1 1.427 0.020 . 2 . . . . 41 LEU HB3 . 17484 1 396 . 1 1 41 41 LEU HG H 1 1.867 0.020 . 1 . . . . 41 LEU HG . 17484 1 397 . 1 1 41 41 LEU HD11 H 1 0.719 0.020 . 2 . . . . 41 LEU HD11 . 17484 1 398 . 1 1 41 41 LEU HD12 H 1 0.719 0.020 . 2 . . . . 41 LEU HD11 . 17484 1 399 . 1 1 41 41 LEU HD13 H 1 0.719 0.020 . 2 . . . . 41 LEU HD11 . 17484 1 400 . 1 1 41 41 LEU HD21 H 1 0.749 0.020 . 2 . . . . 41 LEU HD21 . 17484 1 401 . 1 1 41 41 LEU HD22 H 1 0.749 0.020 . 2 . . . . 41 LEU HD21 . 17484 1 402 . 1 1 41 41 LEU HD23 H 1 0.749 0.020 . 2 . . . . 41 LEU HD21 . 17484 1 403 . 1 1 41 41 LEU C C 13 175.991 0.400 . 1 . . . . 41 LEU C . 17484 1 404 . 1 1 41 41 LEU CA C 13 54.536 0.400 . 1 . . . . 41 LEU CA . 17484 1 405 . 1 1 41 41 LEU CB C 13 42.537 0.400 . 1 . . . . 41 LEU CB . 17484 1 406 . 1 1 41 41 LEU CG C 13 26.770 0.400 . 1 . . . . 41 LEU CG . 17484 1 407 . 1 1 41 41 LEU CD1 C 13 26.104 0.400 . 1 . . . . 41 LEU CD1 . 17484 1 408 . 1 1 41 41 LEU CD2 C 13 22.707 0.400 . 1 . . . . 41 LEU CD2 . 17484 1 409 . 1 1 41 41 LEU N N 15 116.045 0.400 . 1 . . . . 41 LEU N . 17484 1 410 . 1 1 42 42 LYS H H 1 7.904 0.020 . 1 . . . . 42 LYS H . 17484 1 411 . 1 1 42 42 LYS HA H 1 3.980 0.020 . 1 . . . . 42 LYS HA . 17484 1 412 . 1 1 42 42 LYS HB2 H 1 1.890 0.020 . 2 . . . . 42 LYS HB2 . 17484 1 413 . 1 1 42 42 LYS HB3 H 1 2.153 0.020 . 2 . . . . 42 LYS HB3 . 17484 1 414 . 1 1 42 42 LYS HG2 H 1 1.355 0.020 . 1 . . . . 42 LYS HG2 . 17484 1 415 . 1 1 42 42 LYS HG3 H 1 1.355 0.020 . 1 . . . . 42 LYS HG3 . 17484 1 416 . 1 1 42 42 LYS HD2 H 1 1.720 0.020 . 2 . . . . 42 LYS HD2 . 17484 1 417 . 1 1 42 42 LYS HD3 H 1 1.660 0.020 . 2 . . . . 42 LYS HD3 . 17484 1 418 . 1 1 42 42 LYS HE2 H 1 3.018 0.020 . 1 . . . . 42 LYS HE2 . 17484 1 419 . 1 1 42 42 LYS HE3 H 1 3.018 0.020 . 1 . . . . 42 LYS HE3 . 17484 1 420 . 1 1 42 42 LYS C C 13 175.008 0.400 . 1 . . . . 42 LYS C . 17484 1 421 . 1 1 42 42 LYS CA C 13 57.598 0.400 . 1 . . . . 42 LYS CA . 17484 1 422 . 1 1 42 42 LYS CB C 13 28.293 0.400 . 1 . . . . 42 LYS CB . 17484 1 423 . 1 1 42 42 LYS CG C 13 24.910 0.400 . 1 . . . . 42 LYS CG . 17484 1 424 . 1 1 42 42 LYS CD C 13 29.040 0.400 . 1 . . . . 42 LYS CD . 17484 1 425 . 1 1 42 42 LYS CE C 13 42.113 0.400 . 1 . . . . 42 LYS CE . 17484 1 426 . 1 1 42 42 LYS N N 15 117.733 0.400 . 1 . . . . 42 LYS N . 17484 1 427 . 1 1 43 43 LEU H H 1 8.328 0.020 . 1 . . . . 43 LEU H . 17484 1 428 . 1 1 43 43 LEU HA H 1 4.868 0.020 . 1 . . . . 43 LEU HA . 17484 1 429 . 1 1 43 43 LEU HB2 H 1 1.226 0.020 . 2 . . . . 43 LEU HB2 . 17484 1 430 . 1 1 43 43 LEU HB3 H 1 1.603 0.020 . 2 . . . . 43 LEU HB3 . 17484 1 431 . 1 1 43 43 LEU HG H 1 1.471 0.020 . 1 . . . . 43 LEU HG . 17484 1 432 . 1 1 43 43 LEU HD11 H 1 0.655 0.020 . 2 . . . . 43 LEU HD11 . 17484 1 433 . 1 1 43 43 LEU HD12 H 1 0.655 0.020 . 2 . . . . 43 LEU HD11 . 17484 1 434 . 1 1 43 43 LEU HD13 H 1 0.655 0.020 . 2 . . . . 43 LEU HD11 . 17484 1 435 . 1 1 43 43 LEU HD21 H 1 0.854 0.020 . 2 . . . . 43 LEU HD21 . 17484 1 436 . 1 1 43 43 LEU HD22 H 1 0.854 0.020 . 2 . . . . 43 LEU HD21 . 17484 1 437 . 1 1 43 43 LEU HD23 H 1 0.854 0.020 . 2 . . . . 43 LEU HD21 . 17484 1 438 . 1 1 43 43 LEU C C 13 176.686 0.400 . 1 . . . . 43 LEU C . 17484 1 439 . 1 1 43 43 LEU CA C 13 52.536 0.400 . 1 . . . . 43 LEU CA . 17484 1 440 . 1 1 43 43 LEU CB C 13 47.680 0.400 . 1 . . . . 43 LEU CB . 17484 1 441 . 1 1 43 43 LEU CG C 13 26.438 0.400 . 1 . . . . 43 LEU CG . 17484 1 442 . 1 1 43 43 LEU CD1 C 13 27.600 0.400 . 1 . . . . 43 LEU CD1 . 17484 1 443 . 1 1 43 43 LEU CD2 C 13 24.313 0.400 . 1 . . . . 43 LEU CD2 . 17484 1 444 . 1 1 43 43 LEU N N 15 119.561 0.400 . 1 . . . . 43 LEU N . 17484 1 445 . 1 1 44 44 THR H H 1 8.838 0.020 . 1 . . . . 44 THR H . 17484 1 446 . 1 1 44 44 THR HA H 1 4.653 0.020 . 1 . . . . 44 THR HA . 17484 1 447 . 1 1 44 44 THR HB H 1 4.784 0.020 . 1 . . . . 44 THR HB . 17484 1 448 . 1 1 44 44 THR HG21 H 1 1.283 0.020 . 1 . . . . 44 THR HG21 . 17484 1 449 . 1 1 44 44 THR HG22 H 1 1.283 0.020 . 1 . . . . 44 THR HG21 . 17484 1 450 . 1 1 44 44 THR HG23 H 1 1.283 0.020 . 1 . . . . 44 THR HG21 . 17484 1 451 . 1 1 44 44 THR C C 13 176.351 0.400 . 1 . . . . 44 THR C . 17484 1 452 . 1 1 44 44 THR CA C 13 60.292 0.400 . 1 . . . . 44 THR CA . 17484 1 453 . 1 1 44 44 THR CB C 13 70.740 0.400 . 1 . . . . 44 THR CB . 17484 1 454 . 1 1 44 44 THR CG2 C 13 21.702 0.400 . 1 . . . . 44 THR CG2 . 17484 1 455 . 1 1 44 44 THR N N 15 109.641 0.400 . 1 . . . . 44 THR N . 17484 1 456 . 1 1 45 45 GLU H H 1 9.240 0.020 . 1 . . . . 45 GLU H . 17484 1 457 . 1 1 45 45 GLU HA H 1 3.642 0.020 . 1 . . . . 45 GLU HA . 17484 1 458 . 1 1 45 45 GLU HB2 H 1 2.044 0.020 . 2 . . . . 45 GLU HB2 . 17484 1 459 . 1 1 45 45 GLU HB3 H 1 2.046 0.020 . 2 . . . . 45 GLU HB3 . 17484 1 460 . 1 1 45 45 GLU HG2 H 1 2.398 0.020 . 2 . . . . 45 GLU HG2 . 17484 1 461 . 1 1 45 45 GLU HG3 H 1 2.071 0.020 . 2 . . . . 45 GLU HG3 . 17484 1 462 . 1 1 45 45 GLU C C 13 178.627 0.400 . 1 . . . . 45 GLU C . 17484 1 463 . 1 1 45 45 GLU CA C 13 61.076 0.400 . 1 . . . . 45 GLU CA . 17484 1 464 . 1 1 45 45 GLU CB C 13 29.231 0.400 . 1 . . . . 45 GLU CB . 17484 1 465 . 1 1 45 45 GLU CG C 13 37.976 0.400 . 1 . . . . 45 GLU CG . 17484 1 466 . 1 1 45 45 GLU N N 15 121.295 0.400 . 1 . . . . 45 GLU N . 17484 1 467 . 1 1 46 46 THR H H 1 8.143 0.020 . 1 . . . . 46 THR H . 17484 1 468 . 1 1 46 46 THR HA H 1 3.903 0.020 . 1 . . . . 46 THR HA . 17484 1 469 . 1 1 46 46 THR HB H 1 4.060 0.020 . 1 . . . . 46 THR HB . 17484 1 470 . 1 1 46 46 THR HG21 H 1 1.251 0.020 . 1 . . . . 46 THR HG21 . 17484 1 471 . 1 1 46 46 THR HG22 H 1 1.251 0.020 . 1 . . . . 46 THR HG21 . 17484 1 472 . 1 1 46 46 THR HG23 H 1 1.251 0.020 . 1 . . . . 46 THR HG21 . 17484 1 473 . 1 1 46 46 THR C C 13 175.128 0.400 . 1 . . . . 46 THR C . 17484 1 474 . 1 1 46 46 THR CA C 13 66.495 0.400 . 1 . . . . 46 THR CA . 17484 1 475 . 1 1 46 46 THR CB C 13 68.821 0.400 . 1 . . . . 46 THR CB . 17484 1 476 . 1 1 46 46 THR CG2 C 13 21.983 0.400 . 1 . . . . 46 THR CG2 . 17484 1 477 . 1 1 46 46 THR N N 15 115.248 0.400 . 1 . . . . 46 THR N . 17484 1 478 . 1 1 47 47 GLN H H 1 8.052 0.020 . 1 . . . . 47 GLN H . 17484 1 479 . 1 1 47 47 GLN HA H 1 3.958 0.020 . 1 . . . . 47 GLN HA . 17484 1 480 . 1 1 47 47 GLN HB2 H 1 2.581 0.020 . 2 . . . . 47 GLN HB2 . 17484 1 481 . 1 1 47 47 GLN HB3 H 1 1.826 0.020 . 2 . . . . 47 GLN HB3 . 17484 1 482 . 1 1 47 47 GLN HG2 H 1 2.548 0.020 . 2 . . . . 47 GLN HG2 . 17484 1 483 . 1 1 47 47 GLN HG3 H 1 2.403 0.020 . 2 . . . . 47 GLN HG3 . 17484 1 484 . 1 1 47 47 GLN HE21 H 1 6.907 0.020 . 2 . . . . 47 GLN HE21 . 17484 1 485 . 1 1 47 47 GLN HE22 H 1 7.667 0.020 . 2 . . . . 47 GLN HE22 . 17484 1 486 . 1 1 47 47 GLN C C 13 179.658 0.400 . 1 . . . . 47 GLN C . 17484 1 487 . 1 1 47 47 GLN CA C 13 59.662 0.400 . 1 . . . . 47 GLN CA . 17484 1 488 . 1 1 47 47 GLN CB C 13 29.956 0.400 . 1 . . . . 47 GLN CB . 17484 1 489 . 1 1 47 47 GLN CG C 13 35.627 0.400 . 1 . . . . 47 GLN CG . 17484 1 490 . 1 1 47 47 GLN N N 15 120.264 0.400 . 1 . . . . 47 GLN N . 17484 1 491 . 1 1 47 47 GLN NE2 N 15 112.233 0.400 . 1 . . . . 47 GLN NE2 . 17484 1 492 . 1 1 48 48 VAL H H 1 7.683 0.020 . 1 . . . . 48 VAL H . 17484 1 493 . 1 1 48 48 VAL HA H 1 3.629 0.020 . 1 . . . . 48 VAL HA . 17484 1 494 . 1 1 48 48 VAL HB H 1 2.164 0.020 . 1 . . . . 48 VAL HB . 17484 1 495 . 1 1 48 48 VAL HG11 H 1 0.998 0.020 . 2 . . . . 48 VAL HG11 . 17484 1 496 . 1 1 48 48 VAL HG12 H 1 0.998 0.020 . 2 . . . . 48 VAL HG11 . 17484 1 497 . 1 1 48 48 VAL HG13 H 1 0.998 0.020 . 2 . . . . 48 VAL HG11 . 17484 1 498 . 1 1 48 48 VAL HG21 H 1 0.952 0.020 . 2 . . . . 48 VAL HG21 . 17484 1 499 . 1 1 48 48 VAL HG22 H 1 0.952 0.020 . 2 . . . . 48 VAL HG21 . 17484 1 500 . 1 1 48 48 VAL HG23 H 1 0.952 0.020 . 2 . . . . 48 VAL HG21 . 17484 1 501 . 1 1 48 48 VAL C C 13 176.518 0.400 . 1 . . . . 48 VAL C . 17484 1 502 . 1 1 48 48 VAL CA C 13 67.457 0.400 . 1 . . . . 48 VAL CA . 17484 1 503 . 1 1 48 48 VAL CB C 13 32.062 0.400 . 1 . . . . 48 VAL CB . 17484 1 504 . 1 1 48 48 VAL CG1 C 13 23.571 0.400 . 1 . . . . 48 VAL CG1 . 17484 1 505 . 1 1 48 48 VAL CG2 C 13 23.791 0.400 . 1 . . . . 48 VAL CG2 . 17484 1 506 . 1 1 48 48 VAL N N 15 118.717 0.400 . 1 . . . . 48 VAL N . 17484 1 507 . 1 1 49 49 LYS H H 1 8.540 0.020 . 1 . . . . 49 LYS H . 17484 1 508 . 1 1 49 49 LYS HA H 1 4.328 0.020 . 1 . . . . 49 LYS HA . 17484 1 509 . 1 1 49 49 LYS HB2 H 1 2.127 0.020 . 2 . . . . 49 LYS HB2 . 17484 1 510 . 1 1 49 49 LYS HB3 H 1 1.881 0.020 . 2 . . . . 49 LYS HB3 . 17484 1 511 . 1 1 49 49 LYS HG2 H 1 1.571 0.020 . 2 . . . . 49 LYS HG2 . 17484 1 512 . 1 1 49 49 LYS HG3 H 1 1.398 0.020 . 2 . . . . 49 LYS HG3 . 17484 1 513 . 1 1 49 49 LYS HD2 H 1 1.703 0.020 . 1 . . . . 49 LYS HD2 . 17484 1 514 . 1 1 49 49 LYS HD3 H 1 1.702 0.020 . 1 . . . . 49 LYS HD3 . 17484 1 515 . 1 1 49 49 LYS HE2 H 1 2.979 0.020 . 1 . . . . 49 LYS HE2 . 17484 1 516 . 1 1 49 49 LYS HE3 H 1 2.979 0.020 . 1 . . . . 49 LYS HE3 . 17484 1 517 . 1 1 49 49 LYS C C 13 179.849 0.400 . 1 . . . . 49 LYS C . 17484 1 518 . 1 1 49 49 LYS CA C 13 59.984 0.400 . 1 . . . . 49 LYS CA . 17484 1 519 . 1 1 49 49 LYS CB C 13 33.101 0.400 . 1 . . . . 49 LYS CB . 17484 1 520 . 1 1 49 49 LYS CG C 13 24.910 0.400 . 1 . . . . 49 LYS CG . 17484 1 521 . 1 1 49 49 LYS CD C 13 29.385 0.400 . 1 . . . . 49 LYS CD . 17484 1 522 . 1 1 49 49 LYS CE C 13 42.171 0.400 . 1 . . . . 49 LYS CE . 17484 1 523 . 1 1 49 49 LYS N N 15 121.108 0.400 . 1 . . . . 49 LYS N . 17484 1 524 . 1 1 50 50 ILE H H 1 8.689 0.020 . 1 . . . . 50 ILE H . 17484 1 525 . 1 1 50 50 ILE HA H 1 3.773 0.020 . 1 . . . . 50 ILE HA . 17484 1 526 . 1 1 50 50 ILE HB H 1 1.936 0.020 . 1 . . . . 50 ILE HB . 17484 1 527 . 1 1 50 50 ILE HG12 H 1 1.289 0.020 . 2 . . . . 50 ILE HG12 . 17484 1 528 . 1 1 50 50 ILE HG13 H 1 1.692 0.020 . 2 . . . . 50 ILE HG13 . 17484 1 529 . 1 1 50 50 ILE HG21 H 1 0.914 0.020 . 1 . . . . 50 ILE HG21 . 17484 1 530 . 1 1 50 50 ILE HG22 H 1 0.914 0.020 . 1 . . . . 50 ILE HG21 . 17484 1 531 . 1 1 50 50 ILE HG23 H 1 0.914 0.020 . 1 . . . . 50 ILE HG21 . 17484 1 532 . 1 1 50 50 ILE HD11 H 1 0.797 0.020 . 1 . . . . 50 ILE HD11 . 17484 1 533 . 1 1 50 50 ILE HD12 H 1 0.797 0.020 . 1 . . . . 50 ILE HD11 . 17484 1 534 . 1 1 50 50 ILE HD13 H 1 0.797 0.020 . 1 . . . . 50 ILE HD11 . 17484 1 535 . 1 1 50 50 ILE C C 13 177.477 0.400 . 1 . . . . 50 ILE C . 17484 1 536 . 1 1 50 50 ILE CA C 13 64.046 0.400 . 1 . . . . 50 ILE CA . 17484 1 537 . 1 1 50 50 ILE CB C 13 37.639 0.400 . 1 . . . . 50 ILE CB . 17484 1 538 . 1 1 50 50 ILE CG1 C 13 29.134 0.400 . 1 . . . . 50 ILE CG1 . 17484 1 539 . 1 1 50 50 ILE CG2 C 13 17.215 0.400 . 1 . . . . 50 ILE CG2 . 17484 1 540 . 1 1 50 50 ILE CD1 C 13 12.547 0.400 . 1 . . . . 50 ILE CD1 . 17484 1 541 . 1 1 50 50 ILE N N 15 119.983 0.400 . 1 . . . . 50 ILE N . 17484 1 542 . 1 1 51 51 TRP H H 1 8.265 0.020 . 1 . . . . 51 TRP H . 17484 1 543 . 1 1 51 51 TRP HA H 1 4.017 0.020 . 1 . . . . 51 TRP HA . 17484 1 544 . 1 1 51 51 TRP HB2 H 1 3.503 0.020 . 2 . . . . 51 TRP HB2 . 17484 1 545 . 1 1 51 51 TRP HB3 H 1 3.291 0.020 . 2 . . . . 51 TRP HB3 . 17484 1 546 . 1 1 51 51 TRP HD1 H 1 7.141 0.020 . 1 . . . . 51 TRP HD1 . 17484 1 547 . 1 1 51 51 TRP HE1 H 1 9.950 0.020 . 1 . . . . 51 TRP HE1 . 17484 1 548 . 1 1 51 51 TRP HE3 H 1 6.969 0.020 . 1 . . . . 51 TRP HE3 . 17484 1 549 . 1 1 51 51 TRP HZ2 H 1 7.250 0.020 . 1 . . . . 51 TRP HZ2 . 17484 1 550 . 1 1 51 51 TRP HZ3 H 1 5.718 0.020 . 1 . . . . 51 TRP HZ3 . 17484 1 551 . 1 1 51 51 TRP HH2 H 1 6.443 0.020 . 1 . . . . 51 TRP HH2 . 17484 1 552 . 1 1 51 51 TRP C C 13 179.634 0.400 . 1 . . . . 51 TRP C . 17484 1 553 . 1 1 51 51 TRP CA C 13 63.117 0.400 . 1 . . . . 51 TRP CA . 17484 1 554 . 1 1 51 51 TRP CB C 13 29.174 0.400 . 1 . . . . 51 TRP CB . 17484 1 555 . 1 1 51 51 TRP CD1 C 13 127.123 0.400 . 1 . . . . 51 TRP CD1 . 17484 1 556 . 1 1 51 51 TRP CE3 C 13 121.202 0.400 . 1 . . . . 51 TRP CE3 . 17484 1 557 . 1 1 51 51 TRP CZ2 C 13 114.117 0.400 . 1 . . . . 51 TRP CZ2 . 17484 1 558 . 1 1 51 51 TRP CZ3 C 13 120.869 0.400 . 1 . . . . 51 TRP CZ3 . 17484 1 559 . 1 1 51 51 TRP CH2 C 13 123.506 0.400 . 1 . . . . 51 TRP CH2 . 17484 1 560 . 1 1 51 51 TRP N N 15 121.670 0.400 . 1 . . . . 51 TRP N . 17484 1 561 . 1 1 51 51 TRP NE1 N 15 128.495 0.400 . 1 . . . . 51 TRP NE1 . 17484 1 562 . 1 1 52 52 PHE H H 1 8.937 0.020 . 1 . . . . 52 PHE H . 17484 1 563 . 1 1 52 52 PHE HA H 1 3.756 0.020 . 1 . . . . 52 PHE HA . 17484 1 564 . 1 1 52 52 PHE HB2 H 1 3.274 0.020 . 2 . . . . 52 PHE HB2 . 17484 1 565 . 1 1 52 52 PHE HB3 H 1 3.531 0.020 . 2 . . . . 52 PHE HB3 . 17484 1 566 . 1 1 52 52 PHE HD1 H 1 7.746 0.020 . 1 . . . . 52 PHE HD1 . 17484 1 567 . 1 1 52 52 PHE HD2 H 1 7.746 0.020 . 1 . . . . 52 PHE HD2 . 17484 1 568 . 1 1 52 52 PHE HE1 H 1 7.529 0.020 . 1 . . . . 52 PHE HE1 . 17484 1 569 . 1 1 52 52 PHE HE2 H 1 7.529 0.020 . 1 . . . . 52 PHE HE2 . 17484 1 570 . 1 1 52 52 PHE HZ H 1 7.178 0.020 . 1 . . . . 52 PHE HZ . 17484 1 571 . 1 1 52 52 PHE C C 13 177.429 0.400 . 1 . . . . 52 PHE C . 17484 1 572 . 1 1 52 52 PHE CA C 13 63.312 0.400 . 1 . . . . 52 PHE CA . 17484 1 573 . 1 1 52 52 PHE CB C 13 39.639 0.400 . 1 . . . . 52 PHE CB . 17484 1 574 . 1 1 52 52 PHE CD1 C 13 131.446 0.400 . 1 . . . . 52 PHE CD1 . 17484 1 575 . 1 1 52 52 PHE CD2 C 13 131.979 0.400 . 1 . . . . 52 PHE CD2 . 17484 1 576 . 1 1 52 52 PHE CE1 C 13 131.873 0.400 . 1 . . . . 52 PHE CE1 . 17484 1 577 . 1 1 52 52 PHE CE2 C 13 132.278 0.400 . 1 . . . . 52 PHE CE2 . 17484 1 578 . 1 1 52 52 PHE CZ C 13 129.075 0.400 . 1 . . . . 52 PHE CZ . 17484 1 579 . 1 1 52 52 PHE N N 15 119.279 0.400 . 1 . . . . 52 PHE N . 17484 1 580 . 1 1 53 53 GLN H H 1 8.034 0.020 . 1 . . . . 53 GLN H . 17484 1 581 . 1 1 53 53 GLN HA H 1 3.937 0.020 . 1 . . . . 53 GLN HA . 17484 1 582 . 1 1 53 53 GLN HB2 H 1 2.150 0.020 . 2 . . . . 53 GLN HB2 . 17484 1 583 . 1 1 53 53 GLN HB3 H 1 2.218 0.020 . 2 . . . . 53 GLN HB3 . 17484 1 584 . 1 1 53 53 GLN HG2 H 1 2.438 0.020 . 2 . . . . 53 GLN HG2 . 17484 1 585 . 1 1 53 53 GLN HG3 H 1 2.368 0.020 . 2 . . . . 53 GLN HG3 . 17484 1 586 . 1 1 53 53 GLN HE21 H 1 6.932 0.020 . 2 . . . . 53 GLN HE21 . 17484 1 587 . 1 1 53 53 GLN HE22 H 1 7.502 0.020 . 2 . . . . 53 GLN HE22 . 17484 1 588 . 1 1 53 53 GLN C C 13 178.316 0.400 . 1 . . . . 53 GLN C . 17484 1 589 . 1 1 53 53 GLN CA C 13 59.149 0.400 . 1 . . . . 53 GLN CA . 17484 1 590 . 1 1 53 53 GLN CB C 13 28.538 0.400 . 1 . . . . 53 GLN CB . 17484 1 591 . 1 1 53 53 GLN CG C 13 33.720 0.400 . 1 . . . . 53 GLN CG . 17484 1 592 . 1 1 53 53 GLN N N 15 118.154 0.400 . 1 . . . . 53 GLN N . 17484 1 593 . 1 1 53 53 GLN NE2 N 15 111.447 0.400 . 1 . . . . 53 GLN NE2 . 17484 1 594 . 1 1 54 54 ASN H H 1 8.294 0.020 . 1 . . . . 54 ASN H . 17484 1 595 . 1 1 54 54 ASN HA H 1 4.355 0.020 . 1 . . . . 54 ASN HA . 17484 1 596 . 1 1 54 54 ASN HB2 H 1 2.475 0.020 . 2 . . . . 54 ASN HB2 . 17484 1 597 . 1 1 54 54 ASN HB3 H 1 2.649 0.020 . 2 . . . . 54 ASN HB3 . 17484 1 598 . 1 1 54 54 ASN HD21 H 1 7.487 0.020 . 2 . . . . 54 ASN HD21 . 17484 1 599 . 1 1 54 54 ASN HD22 H 1 6.906 0.020 . 2 . . . . 54 ASN HD22 . 17484 1 600 . 1 1 54 54 ASN C C 13 177.261 0.400 . 1 . . . . 54 ASN C . 17484 1 601 . 1 1 54 54 ASN CA C 13 55.108 0.400 . 1 . . . . 54 ASN CA . 17484 1 602 . 1 1 54 54 ASN CB C 13 37.681 0.400 . 1 . . . . 54 ASN CB . 17484 1 603 . 1 1 54 54 ASN N N 15 117.451 0.400 . 1 . . . . 54 ASN N . 17484 1 604 . 1 1 54 54 ASN ND2 N 15 112.830 0.400 . 1 . . . . 54 ASN ND2 . 17484 1 605 . 1 1 55 55 ARG H H 1 8.075 0.020 . 1 . . . . 55 ARG H . 17484 1 606 . 1 1 55 55 ARG HA H 1 3.431 0.020 . 1 . . . . 55 ARG HA . 17484 1 607 . 1 1 55 55 ARG HB2 H 1 0.650 0.020 . 2 . . . . 55 ARG HB2 . 17484 1 608 . 1 1 55 55 ARG HB3 H 1 -0.278 0.020 . 2 . . . . 55 ARG HB3 . 17484 1 609 . 1 1 55 55 ARG HG2 H 1 -0.283 0.020 . 2 . . . . 55 ARG HG2 . 17484 1 610 . 1 1 55 55 ARG HG3 H 1 -0.438 0.020 . 2 . . . . 55 ARG HG3 . 17484 1 611 . 1 1 55 55 ARG HD2 H 1 2.407 0.020 . 2 . . . . 55 ARG HD2 . 17484 1 612 . 1 1 55 55 ARG HD3 H 1 1.971 0.020 . 2 . . . . 55 ARG HD3 . 17484 1 613 . 1 1 55 55 ARG C C 13 178.891 0.400 . 1 . . . . 55 ARG C . 17484 1 614 . 1 1 55 55 ARG CA C 13 56.087 0.400 . 1 . . . . 55 ARG CA . 17484 1 615 . 1 1 55 55 ARG CB C 13 28.406 0.400 . 1 . . . . 55 ARG CB . 17484 1 616 . 1 1 55 55 ARG CG C 13 23.540 0.400 . 1 . . . . 55 ARG CG . 17484 1 617 . 1 1 55 55 ARG CD C 13 40.778 0.400 . 1 . . . . 55 ARG CD . 17484 1 618 . 1 1 55 55 ARG N N 15 122.795 0.400 . 1 . . . . 55 ARG N . 17484 1 619 . 1 1 56 56 ARG H H 1 7.746 0.020 . 1 . . . . 56 ARG H . 17484 1 620 . 1 1 56 56 ARG HA H 1 4.080 0.020 . 1 . . . . 56 ARG HA . 17484 1 621 . 1 1 56 56 ARG HB2 H 1 1.721 0.020 . 2 . . . . 56 ARG HB2 . 17484 1 622 . 1 1 56 56 ARG HB3 H 1 2.036 0.020 . 2 . . . . 56 ARG HB3 . 17484 1 623 . 1 1 56 56 ARG HG2 H 1 2.198 0.020 . 2 . . . . 56 ARG HG2 . 17484 1 624 . 1 1 56 56 ARG HG3 H 1 1.453 0.020 . 2 . . . . 56 ARG HG3 . 17484 1 625 . 1 1 56 56 ARG HD2 H 1 2.712 0.020 . 2 . . . . 56 ARG HD2 . 17484 1 626 . 1 1 56 56 ARG HD3 H 1 2.843 0.020 . 2 . . . . 56 ARG HD3 . 17484 1 627 . 1 1 56 56 ARG C C 13 178.292 0.400 . 1 . . . . 56 ARG C . 17484 1 628 . 1 1 56 56 ARG CA C 13 59.512 0.400 . 1 . . . . 56 ARG CA . 17484 1 629 . 1 1 56 56 ARG CB C 13 31.630 0.400 . 1 . . . . 56 ARG CB . 17484 1 630 . 1 1 56 56 ARG CG C 13 30.335 0.400 . 1 . . . . 56 ARG CG . 17484 1 631 . 1 1 56 56 ARG CD C 13 43.431 0.400 . 1 . . . . 56 ARG CD . 17484 1 632 . 1 1 56 56 ARG N N 15 117.779 0.400 . 1 . . . . 56 ARG N . 17484 1 633 . 1 1 57 57 TYR H H 1 7.564 0.020 . 1 . . . . 57 TYR H . 17484 1 634 . 1 1 57 57 TYR HA H 1 4.438 0.020 . 1 . . . . 57 TYR HA . 17484 1 635 . 1 1 57 57 TYR HB2 H 1 3.094 0.020 . 2 . . . . 57 TYR HB2 . 17484 1 636 . 1 1 57 57 TYR HB3 H 1 3.166 0.020 . 2 . . . . 57 TYR HB3 . 17484 1 637 . 1 1 57 57 TYR HD1 H 1 7.145 0.020 . 1 . . . . 57 TYR HD1 . 17484 1 638 . 1 1 57 57 TYR HD2 H 1 7.145 0.020 . 1 . . . . 57 TYR HD2 . 17484 1 639 . 1 1 57 57 TYR HE1 H 1 6.815 0.020 . 1 . . . . 57 TYR HE1 . 17484 1 640 . 1 1 57 57 TYR HE2 H 1 6.815 0.020 . 1 . . . . 57 TYR HE2 . 17484 1 641 . 1 1 57 57 TYR C C 13 176.662 0.400 . 1 . . . . 57 TYR C . 17484 1 642 . 1 1 57 57 TYR CA C 13 59.025 0.400 . 1 . . . . 57 TYR CA . 17484 1 643 . 1 1 57 57 TYR CB C 13 37.924 0.400 . 1 . . . . 57 TYR CB . 17484 1 644 . 1 1 57 57 TYR CD1 C 13 132.894 0.400 . 1 . . . . 57 TYR CD1 . 17484 1 645 . 1 1 57 57 TYR CD2 C 13 133.123 0.400 . 1 . . . . 57 TYR CD2 . 17484 1 646 . 1 1 57 57 TYR CE1 C 13 117.877 0.400 . 1 . . . . 57 TYR CE1 . 17484 1 647 . 1 1 57 57 TYR CE2 C 13 117.910 0.400 . 1 . . . . 57 TYR CE2 . 17484 1 648 . 1 1 57 57 TYR N N 15 119.045 0.400 . 1 . . . . 57 TYR N . 17484 1 649 . 1 1 58 58 LYS H H 1 7.679 0.020 . 1 . . . . 58 LYS H . 17484 1 650 . 1 1 58 58 LYS HA H 1 4.108 0.020 . 1 . . . . 58 LYS HA . 17484 1 651 . 1 1 58 58 LYS HB2 H 1 1.802 0.020 . 2 . . . . 58 LYS HB2 . 17484 1 652 . 1 1 58 58 LYS HB3 H 1 1.731 0.020 . 2 . . . . 58 LYS HB3 . 17484 1 653 . 1 1 58 58 LYS HG2 H 1 1.360 0.020 . 2 . . . . 58 LYS HG2 . 17484 1 654 . 1 1 58 58 LYS HG3 H 1 1.454 0.020 . 2 . . . . 58 LYS HG3 . 17484 1 655 . 1 1 58 58 LYS HD2 H 1 1.540 0.020 . 1 . . . . 58 LYS HD2 . 17484 1 656 . 1 1 58 58 LYS HD3 H 1 1.540 0.020 . 1 . . . . 58 LYS HD3 . 17484 1 657 . 1 1 58 58 LYS HE2 H 1 2.870 0.020 . 1 . . . . 58 LYS HE2 . 17484 1 658 . 1 1 58 58 LYS HE3 H 1 2.870 0.020 . 1 . . . . 58 LYS HE3 . 17484 1 659 . 1 1 58 58 LYS C C 13 176.974 0.400 . 1 . . . . 58 LYS C . 17484 1 660 . 1 1 58 58 LYS CA C 13 57.477 0.400 . 1 . . . . 58 LYS CA . 17484 1 661 . 1 1 58 58 LYS CB C 13 32.425 0.400 . 1 . . . . 58 LYS CB . 17484 1 662 . 1 1 58 58 LYS CG C 13 24.851 0.400 . 1 . . . . 58 LYS CG . 17484 1 663 . 1 1 58 58 LYS CD C 13 29.097 0.400 . 1 . . . . 58 LYS CD . 17484 1 664 . 1 1 58 58 LYS CE C 13 41.780 0.400 . 1 . . . . 58 LYS CE . 17484 1 665 . 1 1 58 58 LYS N N 15 119.795 0.400 . 1 . . . . 58 LYS N . 17484 1 666 . 1 1 59 59 THR H H 1 7.724 0.020 . 1 . . . . 59 THR H . 17484 1 667 . 1 1 59 59 THR HA H 1 4.261 0.020 . 1 . . . . 59 THR HA . 17484 1 668 . 1 1 59 59 THR HB H 1 4.282 0.020 . 1 . . . . 59 THR HB . 17484 1 669 . 1 1 59 59 THR HG21 H 1 1.294 0.020 . 1 . . . . 59 THR HG21 . 17484 1 670 . 1 1 59 59 THR HG22 H 1 1.294 0.020 . 1 . . . . 59 THR HG21 . 17484 1 671 . 1 1 59 59 THR HG23 H 1 1.294 0.020 . 1 . . . . 59 THR HG21 . 17484 1 672 . 1 1 59 59 THR C C 13 174.600 0.400 . 1 . . . . 59 THR C . 17484 1 673 . 1 1 59 59 THR CA C 13 62.827 0.400 . 1 . . . . 59 THR CA . 17484 1 674 . 1 1 59 59 THR CB C 13 69.657 0.400 . 1 . . . . 59 THR CB . 17484 1 675 . 1 1 59 59 THR CG2 C 13 21.730 0.400 . 1 . . . . 59 THR CG2 . 17484 1 676 . 1 1 59 59 THR N N 15 113.002 0.400 . 1 . . . . 59 THR N . 17484 1 677 . 1 1 60 60 LYS H H 1 7.983 0.020 . 1 . . . . 60 LYS H . 17484 1 678 . 1 1 60 60 LYS HA H 1 4.264 0.020 . 1 . . . . 60 LYS HA . 17484 1 679 . 1 1 60 60 LYS HB2 H 1 1.835 0.020 . 2 . . . . 60 LYS HB2 . 17484 1 680 . 1 1 60 60 LYS HB3 H 1 1.778 0.020 . 2 . . . . 60 LYS HB3 . 17484 1 681 . 1 1 60 60 LYS HG2 H 1 1.426 0.020 . 1 . . . . 60 LYS HG2 . 17484 1 682 . 1 1 60 60 LYS HG3 H 1 1.427 0.020 . 1 . . . . 60 LYS HG3 . 17484 1 683 . 1 1 60 60 LYS HD2 H 1 1.672 0.020 . 2 . . . . 60 LYS HD2 . 17484 1 684 . 1 1 60 60 LYS HD3 H 1 1.670 0.020 . 2 . . . . 60 LYS HD3 . 17484 1 685 . 1 1 60 60 LYS HE2 H 1 2.982 0.020 . 1 . . . . 60 LYS HE2 . 17484 1 686 . 1 1 60 60 LYS HE3 H 1 2.983 0.020 . 1 . . . . 60 LYS HE3 . 17484 1 687 . 1 1 60 60 LYS C C 13 176.460 0.400 . 1 . . . . 60 LYS C . 17484 1 688 . 1 1 60 60 LYS CA C 13 56.500 0.400 . 1 . . . . 60 LYS CA . 17484 1 689 . 1 1 60 60 LYS CB C 13 32.758 0.400 . 1 . . . . 60 LYS CB . 17484 1 690 . 1 1 60 60 LYS CG C 13 24.658 0.400 . 1 . . . . 60 LYS CG . 17484 1 691 . 1 1 60 60 LYS CD C 13 28.780 0.400 . 1 . . . . 60 LYS CD . 17484 1 692 . 1 1 60 60 LYS CE C 13 42.171 0.400 . 1 . . . . 60 LYS CE . 17484 1 693 . 1 1 60 60 LYS N N 15 123.029 0.400 . 1 . . . . 60 LYS N . 17484 1 694 . 1 1 61 61 ARG H H 1 8.173 0.020 . 1 . . . . 61 ARG H . 17484 1 695 . 1 1 61 61 ARG HA H 1 4.243 0.020 . 1 . . . . 61 ARG HA . 17484 1 696 . 1 1 61 61 ARG HB2 H 1 1.811 0.020 . 2 . . . . 61 ARG HB2 . 17484 1 697 . 1 1 61 61 ARG HB3 H 1 1.727 0.020 . 2 . . . . 61 ARG HB3 . 17484 1 698 . 1 1 61 61 ARG HG2 H 1 1.596 0.020 . 1 . . . . 61 ARG HG2 . 17484 1 699 . 1 1 61 61 ARG HG3 H 1 1.595 0.020 . 1 . . . . 61 ARG HG3 . 17484 1 700 . 1 1 61 61 ARG HD2 H 1 3.141 0.020 . 1 . . . . 61 ARG HD2 . 17484 1 701 . 1 1 61 61 ARG HD3 H 1 3.141 0.020 . 1 . . . . 61 ARG HD3 . 17484 1 702 . 1 1 61 61 ARG C C 13 176.111 0.400 . 1 . . . . 61 ARG C . 17484 1 703 . 1 1 61 61 ARG CA C 13 56.374 0.400 . 1 . . . . 61 ARG CA . 17484 1 704 . 1 1 61 61 ARG CB C 13 30.538 0.400 . 1 . . . . 61 ARG CB . 17484 1 705 . 1 1 61 61 ARG CG C 13 27.310 0.400 . 1 . . . . 61 ARG CG . 17484 1 706 . 1 1 61 61 ARG CD C 13 43.258 0.400 . 1 . . . . 61 ARG CD . 17484 1 707 . 1 1 61 61 ARG N N 15 121.811 0.400 . 1 . . . . 61 ARG N . 17484 1 708 . 1 1 62 62 LYS H H 1 8.301 0.020 . 1 . . . . 62 LYS H . 17484 1 709 . 1 1 62 62 LYS HA H 1 4.259 0.020 . 1 . . . . 62 LYS HA . 17484 1 710 . 1 1 62 62 LYS HB2 H 1 1.828 0.020 . 2 . . . . 62 LYS HB2 . 17484 1 711 . 1 1 62 62 LYS HB3 H 1 1.775 0.020 . 2 . . . . 62 LYS HB3 . 17484 1 712 . 1 1 62 62 LYS HG2 H 1 1.433 0.020 . 1 . . . . 62 LYS HG2 . 17484 1 713 . 1 1 62 62 LYS HG3 H 1 1.433 0.020 . 1 . . . . 62 LYS HG3 . 17484 1 714 . 1 1 62 62 LYS HD2 H 1 1.670 0.020 . 1 . . . . 62 LYS HD2 . 17484 1 715 . 1 1 62 62 LYS HD3 H 1 1.669 0.020 . 1 . . . . 62 LYS HD3 . 17484 1 716 . 1 1 62 62 LYS HE2 H 1 2.983 0.020 . 2 . . . . 62 LYS HE2 . 17484 1 717 . 1 1 62 62 LYS HE3 H 1 2.986 0.020 . 2 . . . . 62 LYS HE3 . 17484 1 718 . 1 1 62 62 LYS C C 13 176.279 0.400 . 1 . . . . 62 LYS C . 17484 1 719 . 1 1 62 62 LYS CA C 13 56.574 0.400 . 1 . . . . 62 LYS CA . 17484 1 720 . 1 1 62 62 LYS CB C 13 32.701 0.400 . 1 . . . . 62 LYS CB . 17484 1 721 . 1 1 62 62 LYS CG C 13 24.910 0.400 . 1 . . . . 62 LYS CG . 17484 1 722 . 1 1 62 62 LYS CD C 13 28.780 0.400 . 1 . . . . 62 LYS CD . 17484 1 723 . 1 1 62 62 LYS CE C 13 42.113 0.400 . 1 . . . . 62 LYS CE . 17484 1 724 . 1 1 62 62 LYS N N 15 122.701 0.400 . 1 . . . . 62 LYS N . 17484 1 725 . 1 1 63 63 GLN H H 1 8.375 0.020 . 1 . . . . 63 GLN H . 17484 1 726 . 1 1 63 63 GLN HA H 1 4.314 0.020 . 1 . . . . 63 GLN HA . 17484 1 727 . 1 1 63 63 GLN HB2 H 1 2.077 0.020 . 2 . . . . 63 GLN HB2 . 17484 1 728 . 1 1 63 63 GLN HB3 H 1 1.996 0.020 . 2 . . . . 63 GLN HB3 . 17484 1 729 . 1 1 63 63 GLN HG2 H 1 2.358 0.020 . 2 . . . . 63 GLN HG2 . 17484 1 730 . 1 1 63 63 GLN HG3 H 1 2.360 0.020 . 2 . . . . 63 GLN HG3 . 17484 1 731 . 1 1 63 63 GLN HE21 H 1 7.532 0.020 . 2 . . . . 63 GLN HE21 . 17484 1 732 . 1 1 63 63 GLN HE22 H 1 6.870 0.020 . 2 . . . . 63 GLN HE22 . 17484 1 733 . 1 1 63 63 GLN C C 13 175.679 0.400 . 1 . . . . 63 GLN C . 17484 1 734 . 1 1 63 63 GLN CA C 13 55.965 0.400 . 1 . . . . 63 GLN CA . 17484 1 735 . 1 1 63 63 GLN CB C 13 29.354 0.400 . 1 . . . . 63 GLN CB . 17484 1 736 . 1 1 63 63 GLN CG C 13 33.720 0.400 . 1 . . . . 63 GLN CG . 17484 1 737 . 1 1 63 63 GLN N N 15 121.717 0.400 . 1 . . . . 63 GLN N . 17484 1 738 . 1 1 63 63 GLN NE2 N 15 112.442 0.400 . 1 . . . . 63 GLN NE2 . 17484 1 739 . 1 1 64 64 LEU H H 1 8.384 0.020 . 1 . . . . 64 LEU H . 17484 1 740 . 1 1 64 64 LEU HA H 1 4.374 0.020 . 1 . . . . 64 LEU HA . 17484 1 741 . 1 1 64 64 LEU HB2 H 1 1.661 0.020 . 2 . . . . 64 LEU HB2 . 17484 1 742 . 1 1 64 64 LEU HB3 H 1 1.617 0.020 . 2 . . . . 64 LEU HB3 . 17484 1 743 . 1 1 64 64 LEU HG H 1 1.639 0.020 . 1 . . . . 64 LEU HG . 17484 1 744 . 1 1 64 64 LEU HD11 H 1 0.906 0.020 . 2 . . . . 64 LEU HD11 . 17484 1 745 . 1 1 64 64 LEU HD12 H 1 0.906 0.020 . 2 . . . . 64 LEU HD11 . 17484 1 746 . 1 1 64 64 LEU HD13 H 1 0.906 0.020 . 2 . . . . 64 LEU HD11 . 17484 1 747 . 1 1 64 64 LEU HD21 H 1 0.848 0.020 . 2 . . . . 64 LEU HD21 . 17484 1 748 . 1 1 64 64 LEU HD22 H 1 0.848 0.020 . 2 . . . . 64 LEU HD21 . 17484 1 749 . 1 1 64 64 LEU HD23 H 1 0.848 0.020 . 2 . . . . 64 LEU HD21 . 17484 1 750 . 1 1 64 64 LEU C C 13 177.453 0.400 . 1 . . . . 64 LEU C . 17484 1 751 . 1 1 64 64 LEU CA C 13 55.190 0.400 . 1 . . . . 64 LEU CA . 17484 1 752 . 1 1 64 64 LEU CB C 13 42.383 0.400 . 1 . . . . 64 LEU CB . 17484 1 753 . 1 1 64 64 LEU CG C 13 26.770 0.400 . 1 . . . . 64 LEU CG . 17484 1 754 . 1 1 64 64 LEU CD1 C 13 25.325 0.400 . 1 . . . . 64 LEU CD1 . 17484 1 755 . 1 1 64 64 LEU CD2 C 13 23.254 0.400 . 1 . . . . 64 LEU CD2 . 17484 1 756 . 1 1 64 64 LEU N N 15 123.545 0.400 . 1 . . . . 64 LEU N . 17484 1 757 . 1 1 65 65 SER H H 1 8.354 0.020 . 1 . . . . 65 SER H . 17484 1 758 . 1 1 65 65 SER HA H 1 4.435 0.020 . 1 . . . . 65 SER HA . 17484 1 759 . 1 1 65 65 SER HB2 H 1 3.930 0.020 . 2 . . . . 65 SER HB2 . 17484 1 760 . 1 1 65 65 SER HB3 H 1 3.868 0.020 . 2 . . . . 65 SER HB3 . 17484 1 761 . 1 1 65 65 SER C C 13 174.530 0.400 . 1 . . . . 65 SER C . 17484 1 762 . 1 1 65 65 SER CA C 13 58.536 0.400 . 1 . . . . 65 SER CA . 17484 1 763 . 1 1 65 65 SER CB C 13 63.719 0.400 . 1 . . . . 65 SER CB . 17484 1 764 . 1 1 65 65 SER N N 15 116.279 0.400 . 1 . . . . 65 SER N . 17484 1 765 . 1 1 66 66 SER H H 1 8.280 0.020 . 1 . . . . 66 SER H . 17484 1 766 . 1 1 66 66 SER HA H 1 4.451 0.020 . 1 . . . . 66 SER HA . 17484 1 767 . 1 1 66 66 SER HB2 H 1 3.942 0.020 . 2 . . . . 66 SER HB2 . 17484 1 768 . 1 1 66 66 SER HB3 H 1 3.867 0.020 . 2 . . . . 66 SER HB3 . 17484 1 769 . 1 1 66 66 SER C C 13 174.530 0.400 . 1 . . . . 66 SER C . 17484 1 770 . 1 1 66 66 SER CA C 13 58.332 0.400 . 1 . . . . 66 SER CA . 17484 1 771 . 1 1 66 66 SER CB C 13 63.842 0.400 . 1 . . . . 66 SER CB . 17484 1 772 . 1 1 66 66 SER N N 15 117.123 0.400 . 1 . . . . 66 SER N . 17484 1 773 . 1 1 67 67 GLU H H 1 8.399 0.020 . 1 . . . . 67 GLU H . 17484 1 774 . 1 1 67 67 GLU HA H 1 4.313 0.020 . 1 . . . . 67 GLU HA . 17484 1 775 . 1 1 67 67 GLU HB2 H 1 2.086 0.020 . 2 . . . . 67 GLU HB2 . 17484 1 776 . 1 1 67 67 GLU HB3 H 1 1.959 0.020 . 2 . . . . 67 GLU HB3 . 17484 1 777 . 1 1 67 67 GLU HG2 H 1 2.280 0.020 . 2 . . . . 67 GLU HG2 . 17484 1 778 . 1 1 67 67 GLU HG3 H 1 2.245 0.020 . 2 . . . . 67 GLU HG3 . 17484 1 779 . 1 1 67 67 GLU C C 13 176.159 0.400 . 1 . . . . 67 GLU C . 17484 1 780 . 1 1 67 67 GLU CA C 13 56.577 0.400 . 1 . . . . 67 GLU CA . 17484 1 781 . 1 1 67 67 GLU CB C 13 29.909 0.400 . 1 . . . . 67 GLU CB . 17484 1 782 . 1 1 67 67 GLU CG C 13 36.010 0.400 . 1 . . . . 67 GLU CG . 17484 1 783 . 1 1 67 67 GLU N N 15 122.420 0.400 . 1 . . . . 67 GLU N . 17484 1 784 . 1 1 68 68 LEU H H 1 8.143 0.020 . 1 . . . . 68 LEU H . 17484 1 785 . 1 1 68 68 LEU HA H 1 4.363 0.020 . 1 . . . . 68 LEU HA . 17484 1 786 . 1 1 68 68 LEU HB2 H 1 1.636 0.020 . 2 . . . . 68 LEU HB2 . 17484 1 787 . 1 1 68 68 LEU HB3 H 1 1.631 0.020 . 2 . . . . 68 LEU HB3 . 17484 1 788 . 1 1 68 68 LEU HG H 1 1.615 0.020 . 1 . . . . 68 LEU HG . 17484 1 789 . 1 1 68 68 LEU HD11 H 1 0.861 0.020 . 2 . . . . 68 LEU HD11 . 17484 1 790 . 1 1 68 68 LEU HD12 H 1 0.861 0.020 . 2 . . . . 68 LEU HD11 . 17484 1 791 . 1 1 68 68 LEU HD13 H 1 0.861 0.020 . 2 . . . . 68 LEU HD11 . 17484 1 792 . 1 1 68 68 LEU HD21 H 1 0.858 0.020 . 2 . . . . 68 LEU HD21 . 17484 1 793 . 1 1 68 68 LEU HD22 H 1 0.858 0.020 . 2 . . . . 68 LEU HD21 . 17484 1 794 . 1 1 68 68 LEU HD23 H 1 0.858 0.020 . 2 . . . . 68 LEU HD21 . 17484 1 795 . 1 1 68 68 LEU C C 13 176.638 0.400 . 1 . . . . 68 LEU C . 17484 1 796 . 1 1 68 68 LEU CA C 13 54.945 0.400 . 1 . . . . 68 LEU CA . 17484 1 797 . 1 1 68 68 LEU CB C 13 42.415 0.400 . 1 . . . . 68 LEU CB . 17484 1 798 . 1 1 68 68 LEU CG C 13 26.770 0.400 . 1 . . . . 68 LEU CG . 17484 1 799 . 1 1 68 68 LEU CD1 C 13 23.202 0.400 . 1 . . . . 68 LEU CD1 . 17484 1 800 . 1 1 68 68 LEU CD2 C 13 23.149 0.400 . 1 . . . . 68 LEU CD2 . 17484 1 801 . 1 1 68 68 LEU N N 15 122.186 0.400 . 1 . . . . 68 LEU N . 17484 1 802 . 1 1 69 69 GLY H H 1 7.900 0.020 . 1 . . . . 69 GLY H . 17484 1 803 . 1 1 69 69 GLY HA2 H 1 3.745 0.020 . 1 . . . . 69 GLY HA2 . 17484 1 804 . 1 1 69 69 GLY HA3 H 1 3.746 0.020 . 1 . . . . 69 GLY HA3 . 17484 1 805 . 1 1 69 69 GLY CA C 13 45.950 0.400 . 1 . . . . 69 GLY CA . 17484 1 806 . 1 1 69 69 GLY N N 15 115.342 0.400 . 1 . . . . 69 GLY N . 17484 1 stop_ save_