################################### # 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 19870 _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 _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' 1 $sample_1 isotropic 19870 1 2 '2D 1H-13C HSQC' 2 $sample_2 isotropic 19870 1 3 '3D HNCACB' 2 $sample_2 isotropic 19870 1 4 '3D HNCA' 2 $sample_2 isotropic 19870 1 5 '3D 1H-15N NOESY' 1 $sample_1 isotropic 19870 1 6 '3D 1H-15N TOCSY' 1 $sample_1 isotropic 19870 1 8 '3D CBCA(CO)NH' 2 $sample_2 isotropic 19870 1 9 '3D HNCO' 2 $sample_2 isotropic 19870 1 10 '3D HCCH-TOCSY' 2 $sample_2 isotropic 19870 1 11 '3D HCACO' 2 $sample_2 isotropic 19870 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 5 $CARA . . 19870 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ASN HA H 1 4.783 0.020 . 1 . . . A 1 ASN HA . 19870 1 2 . 1 1 1 1 ASN HB2 H 1 2.447 0.020 . 2 . . . A 1 ASN HB2 . 19870 1 3 . 1 1 1 1 ASN HB3 H 1 2.540 0.020 . 2 . . . A 1 ASN HB3 . 19870 1 4 . 1 1 1 1 ASN HD21 H 1 7.646 0.020 . 1 . . . A 1 ASN HD21 . 19870 1 5 . 1 1 1 1 ASN HD22 H 1 7.381 0.020 . 1 . . . A 1 ASN HD22 . 19870 1 6 . 1 1 1 1 ASN ND2 N 15 113.375 0.3 . 1 . . . A 1 ASN ND2 . 19870 1 7 . 1 1 2 2 PHE HA H 1 4.836 0.020 . 1 . . . A 2 PHE HA . 19870 1 8 . 1 1 2 2 PHE HB2 H 1 3.360 0.020 . 2 . . . A 2 PHE HB2 . 19870 1 9 . 1 1 2 2 PHE HB3 H 1 2.696 0.020 . 2 . . . A 2 PHE HB3 . 19870 1 10 . 1 1 2 2 PHE HD1 H 1 6.961 0.020 . 3 . . . A 2 PHE HD1 . 19870 1 11 . 1 1 2 2 PHE HD2 H 1 6.976 0.020 . 3 . . . A 2 PHE HD2 . 19870 1 12 . 1 1 2 2 PHE HE1 H 1 6.890 0.020 . 1 . . . A 2 PHE HE1 . 19870 1 13 . 1 1 2 2 PHE HE2 H 1 6.890 0.020 . 1 . . . A 2 PHE HE2 . 19870 1 14 . 1 1 2 2 PHE HZ H 1 7.080 0.020 . 1 . . . A 2 PHE HZ . 19870 1 15 . 1 1 2 2 PHE C C 13 174.202 0.3 . 1 . . . A 2 PHE C . 19870 1 16 . 1 1 2 2 PHE CA C 13 57.584 0.3 . 1 . . . A 2 PHE CA . 19870 1 17 . 1 1 2 2 PHE CB C 13 41.173 0.3 . 1 . . . A 2 PHE CB . 19870 1 18 . 1 1 3 3 MET H H 1 8.895 0.020 . 1 . . . A 3 MET H . 19870 1 19 . 1 1 3 3 MET HA H 1 4.701 0.020 . 1 . . . A 3 MET HA . 19870 1 20 . 1 1 3 3 MET HB2 H 1 2.014 0.020 . 2 . . . A 3 MET HB2 . 19870 1 21 . 1 1 3 3 MET HB3 H 1 1.955 0.020 . 2 . . . A 3 MET HB3 . 19870 1 22 . 1 1 3 3 MET HG2 H 1 2.595 0.020 . 2 . . . A 3 MET HG2 . 19870 1 23 . 1 1 3 3 MET HG3 H 1 2.536 0.020 . 2 . . . A 3 MET HG3 . 19870 1 24 . 1 1 3 3 MET HE1 H 1 2.125 0.020 . 1 . . . A 3 MET HE1 . 19870 1 25 . 1 1 3 3 MET HE2 H 1 2.125 0.020 . 1 . . . A 3 MET HE2 . 19870 1 26 . 1 1 3 3 MET HE3 H 1 2.125 0.020 . 1 . . . A 3 MET HE3 . 19870 1 27 . 1 1 3 3 MET C C 13 175.332 0.3 . 1 . . . A 3 MET C . 19870 1 28 . 1 1 3 3 MET CA C 13 53.526 0.3 . 1 . . . A 3 MET CA . 19870 1 29 . 1 1 3 3 MET CB C 13 35.688 0.3 . 1 . . . A 3 MET CB . 19870 1 30 . 1 1 3 3 MET CG C 13 31.728 0.3 . 1 . . . A 3 MET CG . 19870 1 31 . 1 1 3 3 MET CE C 13 16.837 0.3 . 1 . . . A 3 MET CE . 19870 1 32 . 1 1 3 3 MET N N 15 116.859 0.3 . 1 . . . A 3 MET N . 19870 1 33 . 1 1 4 4 LEU H H 1 8.725 0.020 . 1 . . . A 4 LEU H . 19870 1 34 . 1 1 4 4 LEU HA H 1 5.199 0.020 . 1 . . . A 4 LEU HA . 19870 1 35 . 1 1 4 4 LEU HB2 H 1 1.502 0.020 . 2 . . . A 4 LEU HB2 . 19870 1 36 . 1 1 4 4 LEU HB3 H 1 1.453 0.020 . 2 . . . A 4 LEU HB3 . 19870 1 37 . 1 1 4 4 LEU HG H 1 0.773 0.020 . 1 . . . A 4 LEU HG . 19870 1 38 . 1 1 4 4 LEU HD11 H 1 0.586 0.020 . 2 . . . A 4 LEU HD11 . 19870 1 39 . 1 1 4 4 LEU HD12 H 1 0.586 0.020 . 2 . . . A 4 LEU HD12 . 19870 1 40 . 1 1 4 4 LEU HD13 H 1 0.586 0.020 . 2 . . . A 4 LEU HD13 . 19870 1 41 . 1 1 4 4 LEU HD21 H 1 0.675 0.020 . 2 . . . A 4 LEU HD21 . 19870 1 42 . 1 1 4 4 LEU HD22 H 1 0.675 0.020 . 2 . . . A 4 LEU HD22 . 19870 1 43 . 1 1 4 4 LEU HD23 H 1 0.675 0.020 . 2 . . . A 4 LEU HD23 . 19870 1 44 . 1 1 4 4 LEU C C 13 175.332 0.3 . 1 . . . A 4 LEU C . 19870 1 45 . 1 1 4 4 LEU CA C 13 53.615 0.3 . 1 . . . A 4 LEU CA . 19870 1 46 . 1 1 4 4 LEU CB C 13 43.760 0.3 . 1 . . . A 4 LEU CB . 19870 1 47 . 1 1 4 4 LEU CG C 13 25.800 0.3 . 1 . . . A 4 LEU CG . 19870 1 48 . 1 1 4 4 LEU CD1 C 13 26.000 0.3 . 1 . . . A 4 LEU CD1 . 19870 1 49 . 1 1 4 4 LEU CD2 C 13 23.600 0.3 . 1 . . . A 4 LEU CD2 . 19870 1 50 . 1 1 4 4 LEU N N 15 122.767 0.3 . 1 . . . A 4 LEU N . 19870 1 51 . 1 1 5 5 THR H H 1 8.971 0.020 . 1 . . . A 5 THR H . 19870 1 52 . 1 1 5 5 THR HA H 1 4.779 0.020 . 1 . . . A 5 THR HA . 19870 1 53 . 1 1 5 5 THR HB H 1 4.022 0.020 . 1 . . . A 5 THR HB . 19870 1 54 . 1 1 5 5 THR HG21 H 1 1.256 0.020 . 1 . . . A 5 THR HG21 . 19870 1 55 . 1 1 5 5 THR HG22 H 1 1.256 0.020 . 1 . . . A 5 THR HG22 . 19870 1 56 . 1 1 5 5 THR HG23 H 1 1.256 0.020 . 1 . . . A 5 THR HG23 . 19870 1 57 . 1 1 5 5 THR C C 13 174.310 0.3 . 1 . . . A 5 THR C . 19870 1 58 . 1 1 5 5 THR CA C 13 61.464 0.3 . 1 . . . A 5 THR CA . 19870 1 59 . 1 1 5 5 THR CB C 13 69.848 0.3 . 1 . . . A 5 THR CB . 19870 1 60 . 1 1 5 5 THR CG2 C 13 21.219 0.3 . 1 . . . A 5 THR CG2 . 19870 1 61 . 1 1 5 5 THR N N 15 117.587 0.3 . 1 . . . A 5 THR N . 19870 1 62 . 1 1 6 6 GLN H H 1 9.411 0.020 . 1 . . . A 6 GLN H . 19870 1 63 . 1 1 6 6 GLN HA H 1 5.354 0.020 . 1 . . . A 6 GLN HA . 19870 1 64 . 1 1 6 6 GLN HB2 H 1 2.464 0.020 . 2 . . . A 6 GLN HB2 . 19870 1 65 . 1 1 6 6 GLN HB3 H 1 1.876 0.020 . 2 . . . A 6 GLN HB3 . 19870 1 66 . 1 1 6 6 GLN HG2 H 1 2.830 0.020 . 2 . . . A 6 GLN HG2 . 19870 1 67 . 1 1 6 6 GLN HG3 H 1 2.000 0.020 . 2 . . . A 6 GLN HG3 . 19870 1 68 . 1 1 6 6 GLN HE21 H 1 6.508 0.020 . 1 . . . A 6 GLN HE21 . 19870 1 69 . 1 1 6 6 GLN HE22 H 1 7.375 0.020 . 1 . . . A 6 GLN HE22 . 19870 1 70 . 1 1 6 6 GLN C C 13 173.900 0.3 . 1 . . . A 6 GLN C . 19870 1 71 . 1 1 6 6 GLN CA C 13 52.055 0.3 . 1 . . . A 6 GLN CA . 19870 1 72 . 1 1 6 6 GLN CB C 13 31.853 0.3 . 1 . . . A 6 GLN CB . 19870 1 73 . 1 1 6 6 GLN CG C 13 36.004 0.3 . 1 . . . A 6 GLN CG . 19870 1 74 . 1 1 6 6 GLN N N 15 126.713 0.3 . 1 . . . A 6 GLN N . 19870 1 75 . 1 1 6 6 GLN NE2 N 15 111.834 0.3 . 1 . . . A 6 GLN NE2 . 19870 1 76 . 1 1 8 8 HIS HA H 1 4.570 0.020 . 1 . . . A 8 HIS HA . 19870 1 77 . 1 1 8 8 HIS HB2 H 1 3.250 0.020 . 2 . . . A 8 HIS HB2 . 19870 1 78 . 1 1 8 8 HIS HB3 H 1 3.304 0.020 . 2 . . . A 8 HIS HB3 . 19870 1 79 . 1 1 8 8 HIS HD2 H 1 7.500 0.020 . 1 . . . A 8 HIS HD2 . 19870 1 80 . 1 1 8 8 HIS HE1 H 1 8.680 0.020 . 1 . . . A 8 HIS HE1 . 19870 1 81 . 1 1 8 8 HIS C C 13 176.679 0.3 . 1 . . . A 8 HIS C . 19870 1 82 . 1 1 8 8 HIS CA C 13 58.562 0.3 . 1 . . . A 8 HIS CA . 19870 1 83 . 1 1 8 8 HIS CB C 13 28.354 0.3 . 1 . . . A 8 HIS CB . 19870 1 84 . 1 1 9 9 SER H H 1 7.889 0.020 . 1 . . . A 9 SER H . 19870 1 85 . 1 1 9 9 SER HA H 1 5.362 0.020 . 1 . . . A 9 SER HA . 19870 1 86 . 1 1 9 9 SER HB2 H 1 4.811 0.020 . 2 . . . A 9 SER HB2 . 19870 1 87 . 1 1 9 9 SER HB3 H 1 3.865 0.020 . 2 . . . A 9 SER HB3 . 19870 1 88 . 1 1 9 9 SER C C 13 172.452 0.3 . 1 . . . A 9 SER C . 19870 1 89 . 1 1 9 9 SER CA C 13 57.045 0.3 . 1 . . . A 9 SER CA . 19870 1 90 . 1 1 9 9 SER CB C 13 65.283 0.3 . 1 . . . A 9 SER CB . 19870 1 91 . 1 1 9 9 SER N N 15 110.723 0.3 . 1 . . . A 9 SER N . 19870 1 92 . 1 1 10 10 VAL H H 1 8.582 0.020 . 1 . . . A 10 VAL H . 19870 1 93 . 1 1 10 10 VAL HA H 1 4.452 0.020 . 1 . . . A 10 VAL HA . 19870 1 94 . 1 1 10 10 VAL HB H 1 1.863 0.020 . 1 . . . A 10 VAL HB . 19870 1 95 . 1 1 10 10 VAL HG11 H 1 0.930 0.020 . 2 . . . A 10 VAL HG11 . 19870 1 96 . 1 1 10 10 VAL HG12 H 1 0.930 0.020 . 2 . . . A 10 VAL HG12 . 19870 1 97 . 1 1 10 10 VAL HG13 H 1 0.930 0.020 . 2 . . . A 10 VAL HG13 . 19870 1 98 . 1 1 10 10 VAL HG21 H 1 0.842 0.020 . 2 . . . A 10 VAL HG21 . 19870 1 99 . 1 1 10 10 VAL HG22 H 1 0.842 0.020 . 2 . . . A 10 VAL HG22 . 19870 1 100 . 1 1 10 10 VAL HG23 H 1 0.842 0.020 . 2 . . . A 10 VAL HG23 . 19870 1 101 . 1 1 10 10 VAL C C 13 173.474 0.3 . 1 . . . A 10 VAL C . 19870 1 102 . 1 1 10 10 VAL CA C 13 61.020 0.3 . 1 . . . A 10 VAL CA . 19870 1 103 . 1 1 10 10 VAL CB C 13 36.045 0.3 . 1 . . . A 10 VAL CB . 19870 1 104 . 1 1 10 10 VAL CG1 C 13 21.526 0.3 . 1 . . . A 10 VAL CG1 . 19870 1 105 . 1 1 10 10 VAL CG2 C 13 21.300 0.3 . 1 . . . A 10 VAL CG2 . 19870 1 106 . 1 1 10 10 VAL N N 15 120.425 0.3 . 1 . . . A 10 VAL N . 19870 1 107 . 1 1 11 11 SER H H 1 8.288 0.020 . 1 . . . A 11 SER H . 19870 1 108 . 1 1 11 11 SER HA H 1 5.765 0.020 . 1 . . . A 11 SER HA . 19870 1 109 . 1 1 11 11 SER HB2 H 1 3.688 0.020 . 2 . . . A 11 SER HB2 . 19870 1 110 . 1 1 11 11 SER HB3 H 1 3.586 0.020 . 2 . . . A 11 SER HB3 . 19870 1 111 . 1 1 11 11 SER C C 13 173.118 0.3 . 1 . . . A 11 SER C . 19870 1 112 . 1 1 11 11 SER CA C 13 56.068 0.3 . 1 . . . A 11 SER CA . 19870 1 113 . 1 1 11 11 SER CB C 13 65.611 0.3 . 1 . . . A 11 SER CB . 19870 1 114 . 1 1 11 11 SER N N 15 118.694 0.3 . 1 . . . A 11 SER N . 19870 1 115 . 1 1 12 12 GLU H H 1 8.206 0.020 . 1 . . . A 12 GLU H . 19870 1 116 . 1 1 12 12 GLU HA H 1 4.571 0.020 . 1 . . . A 12 GLU HA . 19870 1 117 . 1 1 12 12 GLU HB2 H 1 1.800 0.020 . 2 . . . A 12 GLU HB2 . 19870 1 118 . 1 1 12 12 GLU HB3 H 1 1.590 0.020 . 2 . . . A 12 GLU HB3 . 19870 1 119 . 1 1 12 12 GLU HG2 H 1 2.516 0.020 . 2 . . . A 12 GLU HG2 . 19870 1 120 . 1 1 12 12 GLU HG3 H 1 2.437 0.020 . 2 . . . A 12 GLU HG3 . 19870 1 121 . 1 1 12 12 GLU C C 13 174.200 0.3 . 1 . . . A 12 GLU C . 19870 1 122 . 1 1 12 12 GLU CA C 13 54.418 0.3 . 1 . . . A 12 GLU CA . 19870 1 123 . 1 1 12 12 GLU CB C 13 35.019 0.3 . 1 . . . A 12 GLU CB . 19870 1 124 . 1 1 12 12 GLU CG C 13 36.775 0.3 . 1 . . . A 12 GLU CG . 19870 1 125 . 1 1 12 12 GLU N N 15 123.688 0.3 . 1 . . . A 12 GLU N . 19870 1 126 . 1 1 13 13 SER H H 1 9.665 0.020 . 1 . . . A 13 SER H . 19870 1 127 . 1 1 13 13 SER HA H 1 4.840 0.020 . 1 . . . A 13 SER HA . 19870 1 128 . 1 1 13 13 SER HB2 H 1 3.943 0.020 . 2 . . . A 13 SER HB2 . 19870 1 129 . 1 1 13 13 SER HB3 H 1 3.599 0.020 . 2 . . . A 13 SER HB3 . 19870 1 130 . 1 1 13 13 SER C C 13 170.915 0.3 . 1 . . . A 13 SER C . 19870 1 131 . 1 1 13 13 SER CA C 13 57.406 0.3 . 1 . . . A 13 SER CA . 19870 1 132 . 1 1 13 13 SER CB C 13 62.668 0.3 . 1 . . . A 13 SER CB . 19870 1 133 . 1 1 13 13 SER N N 15 119.292 0.3 . 1 . . . A 13 SER N . 19870 1 134 . 1 1 14 14 PRO HA H 1 3.944 0.020 . 1 . . . A 14 PRO HA . 19870 1 135 . 1 1 14 14 PRO HB2 H 1 2.201 0.020 . 2 . . . A 14 PRO HB2 . 19870 1 136 . 1 1 14 14 PRO HB3 H 1 1.807 0.020 . 2 . . . A 14 PRO HB3 . 19870 1 137 . 1 1 14 14 PRO C C 13 177.624 0.3 . 1 . . . A 14 PRO C . 19870 1 138 . 1 1 14 14 PRO CA C 13 63.248 0.3 . 1 . . . A 14 PRO CA . 19870 1 139 . 1 1 14 14 PRO CB C 13 31.541 0.3 . 1 . . . A 14 PRO CB . 19870 1 140 . 1 1 15 15 GLY H H 1 10.059 0.020 . 1 . . . A 15 GLY H . 19870 1 141 . 1 1 15 15 GLY HA2 H 1 4.323 0.020 . 2 . . . A 15 GLY HA2 . 19870 1 142 . 1 1 15 15 GLY HA3 H 1 3.383 0.020 . 2 . . . A 15 GLY HA3 . 19870 1 143 . 1 1 15 15 GLY C C 13 174.697 0.3 . 1 . . . A 15 GLY C . 19870 1 144 . 1 1 15 15 GLY CA C 13 44.696 0.3 . 1 . . . A 15 GLY CA . 19870 1 145 . 1 1 15 15 GLY N N 15 111.980 0.3 . 1 . . . A 15 GLY N . 19870 1 146 . 1 1 16 16 LYS H H 1 7.183 0.020 . 1 . . . A 16 LYS H . 19870 1 147 . 1 1 16 16 LYS HA H 1 4.479 0.020 . 1 . . . A 16 LYS HA . 19870 1 148 . 1 1 16 16 LYS HB2 H 1 1.908 0.020 . 2 . . . A 16 LYS HB2 . 19870 1 149 . 1 1 16 16 LYS HB3 H 1 1.880 0.020 . 2 . . . A 16 LYS HB3 . 19870 1 150 . 1 1 16 16 LYS HG2 H 1 1.216 0.020 . 2 . . . A 16 LYS HG2 . 19870 1 151 . 1 1 16 16 LYS HG3 H 1 1.166 0.020 . 2 . . . A 16 LYS HG3 . 19870 1 152 . 1 1 16 16 LYS HD2 H 1 1.605 0.020 . 2 . . . A 16 LYS HD2 . 19870 1 153 . 1 1 16 16 LYS HD3 H 1 1.620 0.020 . 2 . . . A 16 LYS HD3 . 19870 1 154 . 1 1 16 16 LYS HE2 H 1 2.990 0.020 . 1 . . . A 16 LYS HE2 . 19870 1 155 . 1 1 16 16 LYS HE3 H 1 2.990 0.020 . 1 . . . A 16 LYS HE3 . 19870 1 156 . 1 1 16 16 LYS C C 13 174.202 0.3 . 1 . . . A 16 LYS C . 19870 1 157 . 1 1 16 16 LYS CA C 13 54.733 0.3 . 1 . . . A 16 LYS CA . 19870 1 158 . 1 1 16 16 LYS CB C 13 32.113 0.3 . 1 . . . A 16 LYS CB . 19870 1 159 . 1 1 16 16 LYS CG C 13 24.880 0.3 . 1 . . . A 16 LYS CG . 19870 1 160 . 1 1 16 16 LYS CD C 13 27.900 0.3 . 1 . . . A 16 LYS CD . 19870 1 161 . 1 1 16 16 LYS CE C 13 42.200 0.3 . 1 . . . A 16 LYS CE . 19870 1 162 . 1 1 16 16 LYS N N 15 121.029 0.3 . 1 . . . A 16 LYS N . 19870 1 163 . 1 1 17 17 THR H H 1 8.033 0.020 . 1 . . . A 17 THR H . 19870 1 164 . 1 1 17 17 THR HA H 1 5.385 0.020 . 1 . . . A 17 THR HA . 19870 1 165 . 1 1 17 17 THR HB H 1 3.827 0.020 . 1 . . . A 17 THR HB . 19870 1 166 . 1 1 17 17 THR HG21 H 1 0.896 0.020 . 1 . . . A 17 THR HG21 . 19870 1 167 . 1 1 17 17 THR HG22 H 1 0.896 0.020 . 1 . . . A 17 THR HG22 . 19870 1 168 . 1 1 17 17 THR HG23 H 1 0.896 0.020 . 1 . . . A 17 THR HG23 . 19870 1 169 . 1 1 17 17 THR C C 13 173.800 0.3 . 1 . . . A 17 THR C . 19870 1 170 . 1 1 17 17 THR CA C 13 61.165 0.3 . 1 . . . A 17 THR CA . 19870 1 171 . 1 1 17 17 THR CB C 13 70.342 0.3 . 1 . . . A 17 THR CB . 19870 1 172 . 1 1 17 17 THR CG2 C 13 21.500 0.3 . 1 . . . A 17 THR CG2 . 19870 1 173 . 1 1 17 17 THR N N 15 115.372 0.3 . 1 . . . A 17 THR N . 19870 1 174 . 1 1 18 18 VAL H H 1 8.550 0.020 . 1 . . . A 18 VAL H . 19870 1 175 . 1 1 18 18 VAL HA H 1 4.564 0.020 . 1 . . . A 18 VAL HA . 19870 1 176 . 1 1 18 18 VAL HB H 1 1.673 0.020 . 1 . . . A 18 VAL HB . 19870 1 177 . 1 1 18 18 VAL HG11 H 1 0.721 0.020 . 2 . . . A 18 VAL HG11 . 19870 1 178 . 1 1 18 18 VAL HG12 H 1 0.721 0.020 . 2 . . . A 18 VAL HG12 . 19870 1 179 . 1 1 18 18 VAL HG13 H 1 0.721 0.020 . 2 . . . A 18 VAL HG13 . 19870 1 180 . 1 1 18 18 VAL HG21 H 1 0.777 0.020 . 2 . . . A 18 VAL HG21 . 19870 1 181 . 1 1 18 18 VAL HG22 H 1 0.777 0.020 . 2 . . . A 18 VAL HG22 . 19870 1 182 . 1 1 18 18 VAL HG23 H 1 0.777 0.020 . 2 . . . A 18 VAL HG23 . 19870 1 183 . 1 1 18 18 VAL C C 13 172.343 0.3 . 1 . . . A 18 VAL C . 19870 1 184 . 1 1 18 18 VAL CA C 13 58.811 0.3 . 1 . . . A 18 VAL CA . 19870 1 185 . 1 1 18 18 VAL CB C 13 35.653 0.3 . 1 . . . A 18 VAL CB . 19870 1 186 . 1 1 18 18 VAL CG1 C 13 21.162 0.3 . 1 . . . A 18 VAL CG1 . 19870 1 187 . 1 1 18 18 VAL CG2 C 13 21.300 0.3 . 1 . . . A 18 VAL CG2 . 19870 1 188 . 1 1 18 18 VAL N N 15 123.875 0.3 . 1 . . . A 18 VAL N . 19870 1 189 . 1 1 19 19 THR H H 1 8.099 0.020 . 1 . . . A 19 THR H . 19870 1 190 . 1 1 19 19 THR HA H 1 5.125 0.020 . 1 . . . A 19 THR HA . 19870 1 191 . 1 1 19 19 THR HB H 1 3.633 0.020 . 1 . . . A 19 THR HB . 19870 1 192 . 1 1 19 19 THR HG21 H 1 0.930 0.020 . 1 . . . A 19 THR HG21 . 19870 1 193 . 1 1 19 19 THR HG22 H 1 0.930 0.020 . 1 . . . A 19 THR HG22 . 19870 1 194 . 1 1 19 19 THR HG23 H 1 0.930 0.020 . 1 . . . A 19 THR HG23 . 19870 1 195 . 1 1 19 19 THR C C 13 173.195 0.3 . 1 . . . A 19 THR C . 19870 1 196 . 1 1 19 19 THR CA C 13 60.804 0.3 . 1 . . . A 19 THR CA . 19870 1 197 . 1 1 19 19 THR CB C 13 70.921 0.3 . 1 . . . A 19 THR CB . 19870 1 198 . 1 1 19 19 THR CG2 C 13 21.402 0.3 . 1 . . . A 19 THR CG2 . 19870 1 199 . 1 1 19 19 THR N N 15 119.624 0.3 . 1 . . . A 19 THR N . 19870 1 200 . 1 1 20 20 ILE H H 1 9.172 0.020 . 1 . . . A 20 ILE H . 19870 1 201 . 1 1 20 20 ILE HA H 1 4.046 0.020 . 1 . . . A 20 ILE HA . 19870 1 202 . 1 1 20 20 ILE HB H 1 1.460 0.020 . 1 . . . A 20 ILE HB . 19870 1 203 . 1 1 20 20 ILE HG12 H 1 1.343 0.020 . 2 . . . A 20 ILE HG12 . 19870 1 204 . 1 1 20 20 ILE HG13 H 1 0.760 0.020 . 2 . . . A 20 ILE HG13 . 19870 1 205 . 1 1 20 20 ILE HG21 H 1 1.187 0.020 . 1 . . . A 20 ILE HG21 . 19870 1 206 . 1 1 20 20 ILE HG22 H 1 1.187 0.020 . 1 . . . A 20 ILE HG22 . 19870 1 207 . 1 1 20 20 ILE HG23 H 1 1.187 0.020 . 1 . . . A 20 ILE HG23 . 19870 1 208 . 1 1 20 20 ILE HD11 H 1 0.378 0.020 . 1 . . . A 20 ILE HD11 . 19870 1 209 . 1 1 20 20 ILE HD12 H 1 0.378 0.020 . 1 . . . A 20 ILE HD12 . 19870 1 210 . 1 1 20 20 ILE HD13 H 1 0.378 0.020 . 1 . . . A 20 ILE HD13 . 19870 1 211 . 1 1 20 20 ILE C C 13 174.100 0.3 . 1 . . . A 20 ILE C . 19870 1 212 . 1 1 20 20 ILE CA C 13 60.891 0.3 . 1 . . . A 20 ILE CA . 19870 1 213 . 1 1 20 20 ILE CB C 13 40.500 0.3 . 1 . . . A 20 ILE CB . 19870 1 214 . 1 1 20 20 ILE CG1 C 13 28.584 0.3 . 1 . . . A 20 ILE CG1 . 19870 1 215 . 1 1 20 20 ILE CG2 C 13 18.362 0.3 . 1 . . . A 20 ILE CG2 . 19870 1 216 . 1 1 20 20 ILE CD1 C 13 13.367 0.3 . 1 . . . A 20 ILE CD1 . 19870 1 217 . 1 1 20 20 ILE N N 15 127.371 0.3 . 1 . . . A 20 ILE N . 19870 1 218 . 1 1 21 21 SER H H 1 7.542 0.020 . 1 . . . A 21 SER H . 19870 1 219 . 1 1 21 21 SER HA H 1 5.430 0.020 . 1 . . . A 21 SER HA . 19870 1 220 . 1 1 21 21 SER HB2 H 1 3.875 0.020 . 2 . . . A 21 SER HB2 . 19870 1 221 . 1 1 21 21 SER HB3 H 1 3.825 0.020 . 2 . . . A 21 SER HB3 . 19870 1 222 . 1 1 21 21 SER C C 13 173.272 0.3 . 1 . . . A 21 SER C . 19870 1 223 . 1 1 21 21 SER CA C 13 57.551 0.3 . 1 . . . A 21 SER CA . 19870 1 224 . 1 1 21 21 SER CB C 13 65.885 0.3 . 1 . . . A 21 SER CB . 19870 1 225 . 1 1 21 21 SER N N 15 119.951 0.3 . 1 . . . A 21 SER N . 19870 1 226 . 1 1 22 22 CYS H H 1 8.597 0.020 . 1 . . . A 22 CYS H . 19870 1 227 . 1 1 22 22 CYS HA H 1 5.115 0.020 . 1 . . . A 22 CYS HA . 19870 1 228 . 1 1 22 22 CYS HB2 H 1 3.569 0.020 . 2 . . . A 22 CYS HB2 . 19870 1 229 . 1 1 22 22 CYS HB3 H 1 2.920 0.020 . 2 . . . A 22 CYS HB3 . 19870 1 230 . 1 1 22 22 CYS C C 13 174.047 0.3 . 1 . . . A 22 CYS C . 19870 1 231 . 1 1 22 22 CYS CA C 13 55.383 0.3 . 1 . . . A 22 CYS CA . 19870 1 232 . 1 1 22 22 CYS CB C 13 46.710 0.3 . 1 . . . A 22 CYS CB . 19870 1 233 . 1 1 22 22 CYS N N 15 120.452 0.3 . 1 . . . A 22 CYS N . 19870 1 234 . 1 1 23 23 THR H H 1 9.276 0.020 . 1 . . . A 23 THR H . 19870 1 235 . 1 1 23 23 THR HA H 1 4.584 0.020 . 1 . . . A 23 THR HA . 19870 1 236 . 1 1 23 23 THR HB H 1 3.963 0.020 . 1 . . . A 23 THR HB . 19870 1 237 . 1 1 23 23 THR HG21 H 1 1.246 0.020 . 1 . . . A 23 THR HG21 . 19870 1 238 . 1 1 23 23 THR HG22 H 1 1.246 0.020 . 1 . . . A 23 THR HG22 . 19870 1 239 . 1 1 23 23 THR HG23 H 1 1.246 0.020 . 1 . . . A 23 THR HG23 . 19870 1 240 . 1 1 23 23 THR C C 13 174.093 0.3 . 1 . . . A 23 THR C . 19870 1 241 . 1 1 23 23 THR CA C 13 62.769 0.3 . 1 . . . A 23 THR CA . 19870 1 242 . 1 1 23 23 THR CB C 13 70.084 0.3 . 1 . . . A 23 THR CB . 19870 1 243 . 1 1 23 23 THR CG2 C 13 21.205 0.3 . 1 . . . A 23 THR CG2 . 19870 1 244 . 1 1 23 23 THR N N 15 122.873 0.3 . 1 . . . A 23 THR N . 19870 1 245 . 1 1 24 24 ARG H H 1 8.457 0.020 . 1 . . . A 24 ARG H . 19870 1 246 . 1 1 24 24 ARG HA H 1 5.164 0.020 . 1 . . . A 24 ARG HA . 19870 1 247 . 1 1 24 24 ARG HB2 H 1 1.689 0.020 . 2 . . . A 24 ARG HB2 . 19870 1 248 . 1 1 24 24 ARG HB3 H 1 2.014 0.020 . 2 . . . A 24 ARG HB3 . 19870 1 249 . 1 1 24 24 ARG C C 13 176.756 0.3 . 1 . . . A 24 ARG C . 19870 1 250 . 1 1 24 24 ARG CA C 13 55.455 0.3 . 1 . . . A 24 ARG CA . 19870 1 251 . 1 1 24 24 ARG CB C 13 31.607 0.3 . 1 . . . A 24 ARG CB . 19870 1 252 . 1 1 24 24 ARG N N 15 129.364 0.3 . 1 . . . A 24 ARG N . 19870 1 253 . 1 1 25 25 SER H H 1 9.148 0.020 . 1 . . . A 25 SER H . 19870 1 254 . 1 1 25 25 SER HA H 1 4.742 0.020 . 1 . . . A 25 SER HA . 19870 1 255 . 1 1 25 25 SER HB2 H 1 3.853 0.020 . 2 . . . A 25 SER HB2 . 19870 1 256 . 1 1 25 25 SER HB3 H 1 3.823 0.020 . 2 . . . A 25 SER HB3 . 19870 1 257 . 1 1 25 25 SER C C 13 173.923 0.3 . 1 . . . A 25 SER C . 19870 1 258 . 1 1 25 25 SER CA C 13 61.236 0.3 . 1 . . . A 25 SER CA . 19870 1 259 . 1 1 25 25 SER CB C 13 62.827 0.3 . 1 . . . A 25 SER CB . 19870 1 260 . 1 1 25 25 SER N N 15 123.892 0.3 . 1 . . . A 25 SER N . 19870 1 261 . 1 1 26 26 SER H H 1 6.921 0.020 . 1 . . . A 26 SER H . 19870 1 262 . 1 1 26 26 SER HA H 1 5.049 0.020 . 1 . . . A 26 SER HA . 19870 1 263 . 1 1 26 26 SER HB2 H 1 4.174 0.020 . 2 . . . A 26 SER HB2 . 19870 1 264 . 1 1 26 26 SER HB3 H 1 4.115 0.020 . 2 . . . A 26 SER HB3 . 19870 1 265 . 1 1 26 26 SER C C 13 173.900 0.3 . 1 . . . A 26 SER C . 19870 1 266 . 1 1 26 26 SER CA C 13 57.334 0.3 . 1 . . . A 26 SER CA . 19870 1 267 . 1 1 26 26 SER CB C 13 62.537 0.3 . 1 . . . A 26 SER CB . 19870 1 268 . 1 1 26 26 SER N N 15 114.586 0.3 . 1 . . . A 26 SER N . 19870 1 269 . 1 1 27 27 GLY HA2 H 1 4.004 0.020 . 2 . . . A 27 GLY HA2 . 19870 1 270 . 1 1 27 27 GLY HA3 H 1 3.757 0.020 . 2 . . . A 27 GLY HA3 . 19870 1 271 . 1 1 27 27 GLY C C 13 172.560 0.3 . 1 . . . A 27 GLY C . 19870 1 272 . 1 1 27 27 GLY CA C 13 44.108 0.3 . 1 . . . A 27 GLY CA . 19870 1 273 . 1 1 28 28 SER H H 1 8.412 0.020 . 1 . . . A 28 SER H . 19870 1 274 . 1 1 28 28 SER HA H 1 4.830 0.020 . 1 . . . A 28 SER HA . 19870 1 275 . 1 1 28 28 SER HB2 H 1 3.780 0.020 . 2 . . . A 28 SER HB2 . 19870 1 276 . 1 1 28 28 SER HB3 H 1 3.750 0.020 . 2 . . . A 28 SER HB3 . 19870 1 277 . 1 1 28 28 SER C C 13 177.391 0.3 . 1 . . . A 28 SER C . 19870 1 278 . 1 1 28 28 SER CA C 13 56.683 0.3 . 1 . . . A 28 SER CA . 19870 1 279 . 1 1 28 28 SER CB C 13 63.116 0.3 . 1 . . . A 28 SER CB . 19870 1 280 . 1 1 28 28 SER N N 15 114.018 0.3 . 1 . . . A 28 SER N . 19870 1 281 . 1 1 29 29 ILE H H 1 9.170 0.020 . 1 . . . A 29 ILE H . 19870 1 282 . 1 1 29 29 ILE HA H 1 3.855 0.020 . 1 . . . A 29 ILE HA . 19870 1 283 . 1 1 29 29 ILE HB H 1 1.285 0.020 . 1 . . . A 29 ILE HB . 19870 1 284 . 1 1 29 29 ILE HG12 H 1 1.344 0.020 . 2 . . . A 29 ILE HG12 . 19870 1 285 . 1 1 29 29 ILE HG13 H 1 1.212 0.020 . 2 . . . A 29 ILE HG13 . 19870 1 286 . 1 1 29 29 ILE HG21 H 1 0.863 0.020 . 1 . . . A 29 ILE HG21 . 19870 1 287 . 1 1 29 29 ILE HG22 H 1 0.863 0.020 . 1 . . . A 29 ILE HG22 . 19870 1 288 . 1 1 29 29 ILE HG23 H 1 0.863 0.020 . 1 . . . A 29 ILE HG23 . 19870 1 289 . 1 1 29 29 ILE HD11 H 1 0.858 0.020 . 1 . . . A 29 ILE HD11 . 19870 1 290 . 1 1 29 29 ILE HD12 H 1 0.858 0.020 . 1 . . . A 29 ILE HD12 . 19870 1 291 . 1 1 29 29 ILE HD13 H 1 0.858 0.020 . 1 . . . A 29 ILE HD13 . 19870 1 292 . 1 1 29 29 ILE C C 13 174.600 0.3 . 1 . . . A 29 ILE C . 19870 1 293 . 1 1 29 29 ILE CA C 13 61.000 0.3 . 1 . . . A 29 ILE CA . 19870 1 294 . 1 1 29 29 ILE CB C 13 40.000 0.3 . 1 . . . A 29 ILE CB . 19870 1 295 . 1 1 29 29 ILE CG1 C 13 28.800 0.3 . 1 . . . A 29 ILE CG1 . 19870 1 296 . 1 1 29 29 ILE CG2 C 13 17.659 0.3 . 1 . . . A 29 ILE CG2 . 19870 1 297 . 1 1 29 29 ILE CD1 C 13 14.690 0.3 . 1 . . . A 29 ILE CD1 . 19870 1 298 . 1 1 29 29 ILE N N 15 129.641 0.3 . 1 . . . A 29 ILE N . 19870 1 299 . 1 1 30 30 ALA H H 1 7.446 0.020 . 1 . . . A 30 ALA H . 19870 1 300 . 1 1 30 30 ALA HA H 1 4.495 0.020 . 1 . . . A 30 ALA HA . 19870 1 301 . 1 1 30 30 ALA HB1 H 1 1.206 0.020 . 1 . . . A 30 ALA HB1 . 19870 1 302 . 1 1 30 30 ALA HB2 H 1 1.206 0.020 . 1 . . . A 30 ALA HB2 . 19870 1 303 . 1 1 30 30 ALA HB3 H 1 1.206 0.020 . 1 . . . A 30 ALA HB3 . 19870 1 304 . 1 1 30 30 ALA C C 13 177.794 0.3 . 1 . . . A 30 ALA C . 19870 1 305 . 1 1 30 30 ALA CA C 13 51.553 0.3 . 1 . . . A 30 ALA CA . 19870 1 306 . 1 1 30 30 ALA CB C 13 18.291 0.3 . 1 . . . A 30 ALA CB . 19870 1 307 . 1 1 30 30 ALA N N 15 120.527 0.3 . 1 . . . A 30 ALA N . 19870 1 308 . 1 1 31 31 SER H H 1 7.801 0.020 . 1 . . . A 31 SER H . 19870 1 309 . 1 1 31 31 SER HA H 1 4.032 0.020 . 1 . . . A 31 SER HA . 19870 1 310 . 1 1 31 31 SER HB2 H 1 3.789 0.020 . 2 . . . A 31 SER HB2 . 19870 1 311 . 1 1 31 31 SER HB3 H 1 3.759 0.020 . 2 . . . A 31 SER HB3 . 19870 1 312 . 1 1 31 31 SER C C 13 173.458 0.3 . 1 . . . A 31 SER C . 19870 1 313 . 1 1 31 31 SER CA C 13 60.370 0.3 . 1 . . . A 31 SER CA . 19870 1 314 . 1 1 31 31 SER CB C 13 63.694 0.3 . 1 . . . A 31 SER CB . 19870 1 315 . 1 1 31 31 SER N N 15 113.454 0.3 . 1 . . . A 31 SER N . 19870 1 316 . 1 1 32 32 ASN H H 1 7.209 0.020 . 1 . . . A 32 ASN H . 19870 1 317 . 1 1 32 32 ASN HA H 1 4.708 0.020 . 1 . . . A 32 ASN HA . 19870 1 318 . 1 1 32 32 ASN HB2 H 1 2.682 0.020 . 2 . . . A 32 ASN HB2 . 19870 1 319 . 1 1 32 32 ASN HB3 H 1 2.447 0.020 . 2 . . . A 32 ASN HB3 . 19870 1 320 . 1 1 32 32 ASN HD21 H 1 7.368 0.020 . 1 . . . A 32 ASN HD21 . 19870 1 321 . 1 1 32 32 ASN C C 13 173.087 0.3 . 1 . . . A 32 ASN C . 19870 1 322 . 1 1 32 32 ASN CA C 13 52.564 0.3 . 1 . . . A 32 ASN CA . 19870 1 323 . 1 1 32 32 ASN CB C 13 43.836 0.3 . 1 . . . A 32 ASN CB . 19870 1 324 . 1 1 32 32 ASN N N 15 116.373 0.3 . 1 . . . A 32 ASN N . 19870 1 325 . 1 1 33 33 TYR H H 1 8.264 0.020 . 1 . . . A 33 TYR H . 19870 1 326 . 1 1 33 33 TYR HA H 1 5.027 0.020 . 1 . . . A 33 TYR HA . 19870 1 327 . 1 1 33 33 TYR HB2 H 1 3.048 0.020 . 2 . . . A 33 TYR HB2 . 19870 1 328 . 1 1 33 33 TYR HB3 H 1 2.969 0.020 . 2 . . . A 33 TYR HB3 . 19870 1 329 . 1 1 33 33 TYR HD1 H 1 7.321 0.020 . 3 . . . A 33 TYR HD1 . 19870 1 330 . 1 1 33 33 TYR HD2 H 1 7.272 0.020 . 3 . . . A 33 TYR HD2 . 19870 1 331 . 1 1 33 33 TYR HE1 H 1 6.930 0.020 . 3 . . . A 33 TYR HE1 . 19870 1 332 . 1 1 33 33 TYR HE2 H 1 6.882 0.020 . 3 . . . A 33 TYR HE2 . 19870 1 333 . 1 1 33 33 TYR C C 13 178.400 0.3 . 1 . . . A 33 TYR C . 19870 1 334 . 1 1 33 33 TYR CA C 13 57.696 0.3 . 1 . . . A 33 TYR CA . 19870 1 335 . 1 1 33 33 TYR CB C 13 41.291 0.3 . 1 . . . A 33 TYR CB . 19870 1 336 . 1 1 33 33 TYR N N 15 117.600 0.3 . 1 . . . A 33 TYR N . 19870 1 337 . 1 1 34 34 VAL H H 1 9.484 0.020 . 1 . . . A 34 VAL H . 19870 1 338 . 1 1 34 34 VAL HA H 1 4.643 0.020 . 1 . . . A 34 VAL HA . 19870 1 339 . 1 1 34 34 VAL HB H 1 2.035 0.020 . 1 . . . A 34 VAL HB . 19870 1 340 . 1 1 34 34 VAL HG11 H 1 0.463 0.020 . 2 . . . A 34 VAL HG11 . 19870 1 341 . 1 1 34 34 VAL HG12 H 1 0.463 0.020 . 2 . . . A 34 VAL HG12 . 19870 1 342 . 1 1 34 34 VAL HG13 H 1 0.463 0.020 . 2 . . . A 34 VAL HG13 . 19870 1 343 . 1 1 34 34 VAL HG21 H 1 0.881 0.020 . 2 . . . A 34 VAL HG21 . 19870 1 344 . 1 1 34 34 VAL HG22 H 1 0.881 0.020 . 2 . . . A 34 VAL HG22 . 19870 1 345 . 1 1 34 34 VAL HG23 H 1 0.881 0.020 . 2 . . . A 34 VAL HG23 . 19870 1 346 . 1 1 34 34 VAL C C 13 174.093 0.3 . 1 . . . A 34 VAL C . 19870 1 347 . 1 1 34 34 VAL CA C 13 61.671 0.3 . 1 . . . A 34 VAL CA . 19870 1 348 . 1 1 34 34 VAL CB C 13 33.400 0.3 . 1 . . . A 34 VAL CB . 19870 1 349 . 1 1 34 34 VAL CG1 C 13 21.234 0.3 . 1 . . . A 34 VAL CG1 . 19870 1 350 . 1 1 34 34 VAL CG2 C 13 21.339 0.3 . 1 . . . A 34 VAL CG2 . 19870 1 351 . 1 1 34 34 VAL N N 15 126.332 0.3 . 1 . . . A 34 VAL N . 19870 1 352 . 1 1 35 35 GLN H H 1 8.676 0.020 . 1 . . . A 35 GLN H . 19870 1 353 . 1 1 35 35 GLN HA H 1 4.908 0.020 . 1 . . . A 35 GLN HA . 19870 1 354 . 1 1 35 35 GLN HB2 H 1 1.965 0.020 . 2 . . . A 35 GLN HB2 . 19870 1 355 . 1 1 35 35 GLN HB3 H 1 1.886 0.020 . 2 . . . A 35 GLN HB3 . 19870 1 356 . 1 1 35 35 GLN HG2 H 1 2.494 0.020 . 2 . . . A 35 GLN HG2 . 19870 1 357 . 1 1 35 35 GLN HG3 H 1 2.464 0.020 . 2 . . . A 35 GLN HG3 . 19870 1 358 . 1 1 35 35 GLN C C 13 174.300 0.3 . 1 . . . A 35 GLN C . 19870 1 359 . 1 1 35 35 GLN CA C 13 53.061 0.3 . 1 . . . A 35 GLN CA . 19870 1 360 . 1 1 35 35 GLN CB C 13 33.484 0.3 . 1 . . . A 35 GLN CB . 19870 1 361 . 1 1 35 35 GLN CG C 13 36.500 0.3 . 1 . . . A 35 GLN CG . 19870 1 362 . 1 1 35 35 GLN N N 15 125.494 0.3 . 1 . . . A 35 GLN N . 19870 1 363 . 1 1 36 36 TRP H H 1 9.104 0.020 . 1 . . . A 36 TRP H . 19870 1 364 . 1 1 36 36 TRP HA H 1 5.568 0.020 . 1 . . . A 36 TRP HA . 19870 1 365 . 1 1 36 36 TRP HB2 H 1 2.979 0.020 . 2 . . . A 36 TRP HB2 . 19870 1 366 . 1 1 36 36 TRP HB3 H 1 2.775 0.020 . 2 . . . A 36 TRP HB3 . 19870 1 367 . 1 1 36 36 TRP HD1 H 1 6.654 0.020 . 1 . . . A 36 TRP HD1 . 19870 1 368 . 1 1 36 36 TRP HE3 H 1 7.299 0.020 . 1 . . . A 36 TRP HE3 . 19870 1 369 . 1 1 36 36 TRP HZ2 H 1 7.067 0.020 . 1 . . . A 36 TRP HZ2 . 19870 1 370 . 1 1 36 36 TRP HZ3 H 1 6.760 0.020 . 1 . . . A 36 TRP HZ3 . 19870 1 371 . 1 1 36 36 TRP HH2 H 1 6.890 0.020 . 1 . . . A 36 TRP HH2 . 19870 1 372 . 1 1 36 36 TRP C C 13 174.202 0.3 . 1 . . . A 36 TRP C . 19870 1 373 . 1 1 36 36 TRP CA C 13 55.700 0.3 . 1 . . . A 36 TRP CA . 19870 1 374 . 1 1 36 36 TRP CB C 13 33.300 0.3 . 1 . . . A 36 TRP CB . 19870 1 375 . 1 1 36 36 TRP N N 15 116.954 0.3 . 1 . . . A 36 TRP N . 19870 1 376 . 1 1 37 37 TYR H H 1 9.621 0.020 . 1 . . . A 37 TYR H . 19870 1 377 . 1 1 37 37 TYR HA H 1 5.568 0.020 . 1 . . . A 37 TYR HA . 19870 1 378 . 1 1 37 37 TYR HB2 H 1 2.796 0.020 . 2 . . . A 37 TYR HB2 . 19870 1 379 . 1 1 37 37 TYR HB3 H 1 2.564 0.020 . 2 . . . A 37 TYR HB3 . 19870 1 380 . 1 1 37 37 TYR HD1 H 1 6.732 0.020 . 3 . . . A 37 TYR HD1 . 19870 1 381 . 1 1 37 37 TYR HD2 H 1 6.771 0.020 . 3 . . . A 37 TYR HD2 . 19870 1 382 . 1 1 37 37 TYR HE1 H 1 6.850 0.020 . 1 . . . A 37 TYR HE1 . 19870 1 383 . 1 1 37 37 TYR HE2 H 1 6.850 0.020 . 1 . . . A 37 TYR HE2 . 19870 1 384 . 1 1 37 37 TYR C C 13 174.496 0.3 . 1 . . . A 37 TYR C . 19870 1 385 . 1 1 37 37 TYR CA C 13 55.889 0.3 . 1 . . . A 37 TYR CA . 19870 1 386 . 1 1 37 37 TYR CB C 13 42.447 0.3 . 1 . . . A 37 TYR CB . 19870 1 387 . 1 1 37 37 TYR N N 15 119.383 0.3 . 1 . . . A 37 TYR N . 19870 1 388 . 1 1 38 38 GLN H H 1 9.358 0.020 . 1 . . . A 38 GLN H . 19870 1 389 . 1 1 38 38 GLN HA H 1 4.400 0.020 . 1 . . . A 38 GLN HA . 19870 1 390 . 1 1 38 38 GLN HB2 H 1 1.500 0.020 . 2 . . . A 38 GLN HB2 . 19870 1 391 . 1 1 38 38 GLN HB3 H 1 1.470 0.020 . 2 . . . A 38 GLN HB3 . 19870 1 392 . 1 1 38 38 GLN HG2 H 1 1.620 0.020 . 2 . . . A 38 GLN HG2 . 19870 1 393 . 1 1 38 38 GLN HG3 H 1 1.590 0.020 . 2 . . . A 38 GLN HG3 . 19870 1 394 . 1 1 38 38 GLN HE21 H 1 7.845 0.020 . 1 . . . A 38 GLN HE21 . 19870 1 395 . 1 1 38 38 GLN HE22 H 1 7.635 0.020 . 1 . . . A 38 GLN HE22 . 19870 1 396 . 1 1 38 38 GLN C C 13 174.062 0.3 . 1 . . . A 38 GLN C . 19870 1 397 . 1 1 38 38 GLN CA C 13 53.793 0.3 . 1 . . . A 38 GLN CA . 19870 1 398 . 1 1 38 38 GLN CB C 13 34.352 0.3 . 1 . . . A 38 GLN CB . 19870 1 399 . 1 1 38 38 GLN CG C 13 35.600 0.3 . 1 . . . A 38 GLN CG . 19870 1 400 . 1 1 38 38 GLN N N 15 122.798 0.3 . 1 . . . A 38 GLN N . 19870 1 401 . 1 1 38 38 GLN NE2 N 15 112.623 0.3 . 1 . . . A 38 GLN NE2 . 19870 1 402 . 1 1 39 39 GLN H H 1 9.482 0.020 . 1 . . . A 39 GLN H . 19870 1 403 . 1 1 39 39 GLN HA H 1 4.836 0.020 . 1 . . . A 39 GLN HA . 19870 1 404 . 1 1 39 39 GLN HB2 H 1 1.959 0.020 . 2 . . . A 39 GLN HB2 . 19870 1 405 . 1 1 39 39 GLN HB3 H 1 1.929 0.020 . 2 . . . A 39 GLN HB3 . 19870 1 406 . 1 1 39 39 GLN HG2 H 1 2.339 0.020 . 2 . . . A 39 GLN HG2 . 19870 1 407 . 1 1 39 39 GLN HG3 H 1 2.280 0.020 . 2 . . . A 39 GLN HG3 . 19870 1 408 . 1 1 39 39 GLN HE21 H 1 7.610 0.020 . 1 . . . A 39 GLN HE21 . 19870 1 409 . 1 1 39 39 GLN HE22 H 1 6.857 0.020 . 1 . . . A 39 GLN HE22 . 19870 1 410 . 1 1 39 39 GLN C C 13 175.100 0.3 . 1 . . . A 39 GLN C . 19870 1 411 . 1 1 39 39 GLN CA C 13 54.401 0.3 . 1 . . . A 39 GLN CA . 19870 1 412 . 1 1 39 39 GLN CB C 13 31.535 0.3 . 1 . . . A 39 GLN CB . 19870 1 413 . 1 1 39 39 GLN CG C 13 33.600 0.3 . 1 . . . A 39 GLN CG . 19870 1 414 . 1 1 39 39 GLN N N 15 128.353 0.3 . 1 . . . A 39 GLN N . 19870 1 415 . 1 1 39 39 GLN NE2 N 15 112.735 0.3 . 1 . . . A 39 GLN NE2 . 19870 1 416 . 1 1 41 41 PRO HA H 1 4.362 0.020 . 1 . . . A 41 PRO HA . 19870 1 417 . 1 1 41 41 PRO HB2 H 1 2.280 0.020 . 2 . . . A 41 PRO HB2 . 19870 1 418 . 1 1 41 41 PRO HB3 H 1 1.838 0.020 . 2 . . . A 41 PRO HB3 . 19870 1 419 . 1 1 41 41 PRO C C 13 178.700 0.3 . 1 . . . A 41 PRO C . 19870 1 420 . 1 1 41 41 PRO CA C 13 64.055 0.3 . 1 . . . A 41 PRO CA . 19870 1 421 . 1 1 41 41 PRO CB C 13 31.156 0.3 . 1 . . . A 41 PRO CB . 19870 1 422 . 1 1 42 42 GLY H H 1 8.833 0.020 . 1 . . . A 42 GLY H . 19870 1 423 . 1 1 42 42 GLY HA2 H 1 4.125 0.020 . 2 . . . A 42 GLY HA2 . 19870 1 424 . 1 1 42 42 GLY HA3 H 1 3.778 0.020 . 2 . . . A 42 GLY HA3 . 19870 1 425 . 1 1 42 42 GLY C C 13 174.200 0.3 . 1 . . . A 42 GLY C . 19870 1 426 . 1 1 42 42 GLY CA C 13 45.555 0.3 . 1 . . . A 42 GLY CA . 19870 1 427 . 1 1 42 42 GLY N N 15 114.178 0.3 . 1 . . . A 42 GLY N . 19870 1 428 . 1 1 43 43 SER H H 1 8.004 0.020 . 1 . . . A 43 SER H . 19870 1 429 . 1 1 43 43 SER HA H 1 5.020 0.020 . 1 . . . A 43 SER HA . 19870 1 430 . 1 1 43 43 SER HB2 H 1 3.816 0.020 . 2 . . . A 43 SER HB2 . 19870 1 431 . 1 1 43 43 SER HB3 H 1 3.733 0.020 . 2 . . . A 43 SER HB3 . 19870 1 432 . 1 1 43 43 SER C C 13 172.932 0.3 . 1 . . . A 43 SER C . 19870 1 433 . 1 1 43 43 SER CA C 13 56.395 0.3 . 1 . . . A 43 SER CA . 19870 1 434 . 1 1 43 43 SER CB C 13 65.645 0.3 . 1 . . . A 43 SER CB . 19870 1 435 . 1 1 43 43 SER N N 15 115.076 0.3 . 1 . . . A 43 SER N . 19870 1 436 . 1 1 45 45 PRO HA H 1 4.410 0.020 . 1 . . . A 45 PRO HA . 19870 1 437 . 1 1 45 45 PRO HB2 H 1 2.280 0.020 . 2 . . . A 45 PRO HB2 . 19870 1 438 . 1 1 45 45 PRO HB3 H 1 1.900 0.020 . 2 . . . A 45 PRO HB3 . 19870 1 439 . 1 1 45 45 PRO C C 13 175.951 0.3 . 1 . . . A 45 PRO C . 19870 1 440 . 1 1 45 45 PRO CA C 13 62.465 0.3 . 1 . . . A 45 PRO CA . 19870 1 441 . 1 1 45 45 PRO CB C 13 33.630 0.3 . 1 . . . A 45 PRO CB . 19870 1 442 . 1 1 46 46 THR H H 1 9.167 0.020 . 1 . . . A 46 THR H . 19870 1 443 . 1 1 46 46 THR HA H 1 4.787 0.020 . 1 . . . A 46 THR HA . 19870 1 444 . 1 1 46 46 THR HB H 1 4.193 0.020 . 1 . . . A 46 THR HB . 19870 1 445 . 1 1 46 46 THR HG21 H 1 1.210 0.020 . 1 . . . A 46 THR HG21 . 19870 1 446 . 1 1 46 46 THR HG22 H 1 1.210 0.020 . 1 . . . A 46 THR HG22 . 19870 1 447 . 1 1 46 46 THR HG23 H 1 1.210 0.020 . 1 . . . A 46 THR HG23 . 19870 1 448 . 1 1 46 46 THR C C 13 174.186 0.3 . 1 . . . A 46 THR C . 19870 1 449 . 1 1 46 46 THR CA C 13 60.152 0.3 . 1 . . . A 46 THR CA . 19870 1 450 . 1 1 46 46 THR CB C 13 70.632 0.3 . 1 . . . A 46 THR CB . 19870 1 451 . 1 1 46 46 THR CG2 C 13 20.812 0.3 . 1 . . . A 46 THR CG2 . 19870 1 452 . 1 1 46 46 THR N N 15 117.145 0.3 . 1 . . . A 46 THR N . 19870 1 453 . 1 1 47 47 THR H H 1 8.974 0.020 . 1 . . . A 47 THR H . 19870 1 454 . 1 1 47 47 THR HA H 1 4.128 0.020 . 1 . . . A 47 THR HA . 19870 1 455 . 1 1 47 47 THR HB H 1 4.003 0.020 . 1 . . . A 47 THR HB . 19870 1 456 . 1 1 47 47 THR HG21 H 1 1.041 0.020 . 1 . . . A 47 THR HG21 . 19870 1 457 . 1 1 47 47 THR HG22 H 1 1.041 0.020 . 1 . . . A 47 THR HG22 . 19870 1 458 . 1 1 47 47 THR HG23 H 1 1.041 0.020 . 1 . . . A 47 THR HG23 . 19870 1 459 . 1 1 47 47 THR C C 13 174.651 0.3 . 1 . . . A 47 THR C . 19870 1 460 . 1 1 47 47 THR CA C 13 64.634 0.3 . 1 . . . A 47 THR CA . 19870 1 461 . 1 1 47 47 THR CB C 13 68.443 0.3 . 1 . . . A 47 THR CB . 19870 1 462 . 1 1 47 47 THR CG2 C 13 22.306 0.3 . 1 . . . A 47 THR CG2 . 19870 1 463 . 1 1 47 47 THR N N 15 123.928 0.3 . 1 . . . A 47 THR N . 19870 1 464 . 1 1 48 48 VAL H H 1 8.995 0.020 . 1 . . . A 48 VAL H . 19870 1 465 . 1 1 48 48 VAL HA H 1 4.483 0.020 . 1 . . . A 48 VAL HA . 19870 1 466 . 1 1 48 48 VAL HB H 1 1.699 0.020 . 1 . . . A 48 VAL HB . 19870 1 467 . 1 1 48 48 VAL HG11 H 1 0.520 0.020 . 2 . . . A 48 VAL HG11 . 19870 1 468 . 1 1 48 48 VAL HG12 H 1 0.520 0.020 . 2 . . . A 48 VAL HG12 . 19870 1 469 . 1 1 48 48 VAL HG13 H 1 0.520 0.020 . 2 . . . A 48 VAL HG13 . 19870 1 470 . 1 1 48 48 VAL HG21 H 1 0.790 0.020 . 2 . . . A 48 VAL HG21 . 19870 1 471 . 1 1 48 48 VAL HG22 H 1 0.790 0.020 . 2 . . . A 48 VAL HG22 . 19870 1 472 . 1 1 48 48 VAL HG23 H 1 0.790 0.020 . 2 . . . A 48 VAL HG23 . 19870 1 473 . 1 1 48 48 VAL C C 13 172.591 0.3 . 1 . . . A 48 VAL C . 19870 1 474 . 1 1 48 48 VAL CA C 13 61.592 0.3 . 1 . . . A 48 VAL CA . 19870 1 475 . 1 1 48 48 VAL CB C 13 33.268 0.3 . 1 . . . A 48 VAL CB . 19870 1 476 . 1 1 48 48 VAL CG1 C 13 22.483 0.3 . 1 . . . A 48 VAL CG1 . 19870 1 477 . 1 1 48 48 VAL CG2 C 13 19.851 0.3 . 1 . . . A 48 VAL CG2 . 19870 1 478 . 1 1 48 48 VAL N N 15 121.483 0.3 . 1 . . . A 48 VAL N . 19870 1 479 . 1 1 49 49 ILE H H 1 7.282 0.020 . 1 . . . A 49 ILE H . 19870 1 480 . 1 1 49 49 ILE HA H 1 5.138 0.020 . 1 . . . A 49 ILE HA . 19870 1 481 . 1 1 49 49 ILE HB H 1 1.937 0.020 . 1 . . . A 49 ILE HB . 19870 1 482 . 1 1 49 49 ILE HG12 H 1 1.320 0.020 . 2 . . . A 49 ILE HG12 . 19870 1 483 . 1 1 49 49 ILE HG13 H 1 1.006 0.020 . 2 . . . A 49 ILE HG13 . 19870 1 484 . 1 1 49 49 ILE HG21 H 1 0.768 0.020 . 1 . . . A 49 ILE HG21 . 19870 1 485 . 1 1 49 49 ILE HG22 H 1 0.768 0.020 . 1 . . . A 49 ILE HG22 . 19870 1 486 . 1 1 49 49 ILE HG23 H 1 0.768 0.020 . 1 . . . A 49 ILE HG23 . 19870 1 487 . 1 1 49 49 ILE HD11 H 1 0.575 0.020 . 1 . . . A 49 ILE HD11 . 19870 1 488 . 1 1 49 49 ILE HD12 H 1 0.575 0.020 . 1 . . . A 49 ILE HD12 . 19870 1 489 . 1 1 49 49 ILE HD13 H 1 0.575 0.020 . 1 . . . A 49 ILE HD13 . 19870 1 490 . 1 1 49 49 ILE C C 13 174.511 0.3 . 1 . . . A 49 ILE C . 19870 1 491 . 1 1 49 49 ILE CA C 13 55.962 0.3 . 1 . . . A 49 ILE CA . 19870 1 492 . 1 1 49 49 ILE CB C 13 41.300 0.3 . 1 . . . A 49 ILE CB . 19870 1 493 . 1 1 49 49 ILE CG1 C 13 27.400 0.3 . 1 . . . A 49 ILE CG1 . 19870 1 494 . 1 1 49 49 ILE CG2 C 13 17.573 0.3 . 1 . . . A 49 ILE CG2 . 19870 1 495 . 1 1 49 49 ILE CD1 C 13 9.094 0.3 . 1 . . . A 49 ILE CD1 . 19870 1 496 . 1 1 49 49 ILE N N 15 116.532 0.3 . 1 . . . A 49 ILE N . 19870 1 497 . 1 1 50 50 TYR H H 1 9.386 0.020 . 1 . . . A 50 TYR H . 19870 1 498 . 1 1 50 50 TYR HA H 1 5.134 0.020 . 1 . . . A 50 TYR HA . 19870 1 499 . 1 1 50 50 TYR HB2 H 1 3.045 0.020 . 2 . . . A 50 TYR HB2 . 19870 1 500 . 1 1 50 50 TYR HB3 H 1 2.780 0.020 . 2 . . . A 50 TYR HB3 . 19870 1 501 . 1 1 50 50 TYR HD1 H 1 6.767 0.020 . 3 . . . A 50 TYR HD1 . 19870 1 502 . 1 1 50 50 TYR HD2 H 1 6.587 0.020 . 3 . . . A 50 TYR HD2 . 19870 1 503 . 1 1 50 50 TYR HE1 H 1 6.304 0.020 . 3 . . . A 50 TYR HE1 . 19870 1 504 . 1 1 50 50 TYR HE2 H 1 6.400 0.020 . 3 . . . A 50 TYR HE2 . 19870 1 505 . 1 1 50 50 TYR C C 13 172.600 0.3 . 1 . . . A 50 TYR C . 19870 1 506 . 1 1 50 50 TYR CA C 13 54.589 0.3 . 1 . . . A 50 TYR CA . 19870 1 507 . 1 1 50 50 TYR CB C 13 41.200 0.3 . 1 . . . A 50 TYR CB . 19870 1 508 . 1 1 50 50 TYR N N 15 122.768 0.3 . 1 . . . A 50 TYR N . 19870 1 509 . 1 1 51 51 GLU H H 1 9.167 0.020 . 1 . . . A 51 GLU H . 19870 1 510 . 1 1 51 51 GLU HA H 1 3.044 0.020 . 1 . . . A 51 GLU HA . 19870 1 511 . 1 1 51 51 GLU HB2 H 1 1.590 0.020 . 2 . . . A 51 GLU HB2 . 19870 1 512 . 1 1 51 51 GLU HB3 H 1 1.450 0.020 . 2 . . . A 51 GLU HB3 . 19870 1 513 . 1 1 51 51 GLU HG2 H 1 1.862 0.020 . 2 . . . A 51 GLU HG2 . 19870 1 514 . 1 1 51 51 GLU HG3 H 1 1.762 0.020 . 2 . . . A 51 GLU HG3 . 19870 1 515 . 1 1 51 51 GLU C C 13 176.600 0.3 . 1 . . . A 51 GLU C . 19870 1 516 . 1 1 51 51 GLU CA C 13 57.190 0.3 . 1 . . . A 51 GLU CA . 19870 1 517 . 1 1 51 51 GLU CB C 13 26.837 0.3 . 1 . . . A 51 GLU CB . 19870 1 518 . 1 1 51 51 GLU CG C 13 35.789 0.3 . 1 . . . A 51 GLU CG . 19870 1 519 . 1 1 51 51 GLU N N 15 115.947 0.3 . 1 . . . A 51 GLU N . 19870 1 520 . 1 1 52 52 ASP H H 1 8.940 0.020 . 1 . . . A 52 ASP H . 19870 1 521 . 1 1 52 52 ASP HA H 1 4.168 0.020 . 1 . . . A 52 ASP HA . 19870 1 522 . 1 1 52 52 ASP HB2 H 1 2.431 0.020 . 2 . . . A 52 ASP HB2 . 19870 1 523 . 1 1 52 52 ASP HB3 H 1 2.386 0.020 . 2 . . . A 52 ASP HB3 . 19870 1 524 . 1 1 52 52 ASP C C 13 178.057 0.3 . 1 . . . A 52 ASP C . 19870 1 525 . 1 1 52 52 ASP CA C 13 59.575 0.3 . 1 . . . A 52 ASP CA . 19870 1 526 . 1 1 52 52 ASP CB C 13 40.279 0.3 . 1 . . . A 52 ASP CB . 19870 1 527 . 1 1 52 52 ASP N N 15 113.712 0.3 . 1 . . . A 52 ASP N . 19870 1 528 . 1 1 53 53 ASN H H 1 8.737 0.020 . 1 . . . A 53 ASN H . 19870 1 529 . 1 1 53 53 ASN HA H 1 4.463 0.020 . 1 . . . A 53 ASN HA . 19870 1 530 . 1 1 53 53 ASN HB2 H 1 3.188 0.020 . 2 . . . A 53 ASN HB2 . 19870 1 531 . 1 1 53 53 ASN HB3 H 1 2.589 0.020 . 2 . . . A 53 ASN HB3 . 19870 1 532 . 1 1 53 53 ASN HD21 H 1 7.530 0.020 . 1 . . . A 53 ASN HD21 . 19870 1 533 . 1 1 53 53 ASN HD22 H 1 6.828 0.020 . 1 . . . A 53 ASN HD22 . 19870 1 534 . 1 1 53 53 ASN C C 13 176.000 0.3 . 1 . . . A 53 ASN C . 19870 1 535 . 1 1 53 53 ASN CA C 13 52.710 0.3 . 1 . . . A 53 ASN CA . 19870 1 536 . 1 1 53 53 ASN CB C 13 39.556 0.3 . 1 . . . A 53 ASN CB . 19870 1 537 . 1 1 53 53 ASN N N 15 115.088 0.3 . 1 . . . A 53 ASN N . 19870 1 538 . 1 1 53 53 ASN ND2 N 15 110.832 0.3 . 1 . . . A 53 ASN ND2 . 19870 1 539 . 1 1 54 54 GLN H H 1 8.636 0.020 . 1 . . . A 54 GLN H . 19870 1 540 . 1 1 54 54 GLN HA H 1 4.400 0.020 . 1 . . . A 54 GLN HA . 19870 1 541 . 1 1 54 54 GLN HB2 H 1 1.950 0.020 . 2 . . . A 54 GLN HB2 . 19870 1 542 . 1 1 54 54 GLN HB3 H 1 1.321 0.020 . 2 . . . A 54 GLN HB3 . 19870 1 543 . 1 1 54 54 GLN HG2 H 1 2.278 0.020 . 2 . . . A 54 GLN HG2 . 19870 1 544 . 1 1 54 54 GLN HG3 H 1 2.042 0.020 . 2 . . . A 54 GLN HG3 . 19870 1 545 . 1 1 54 54 GLN HE21 H 1 7.456 0.020 . 1 . . . A 54 GLN HE21 . 19870 1 546 . 1 1 54 54 GLN HE22 H 1 6.788 0.020 . 1 . . . A 54 GLN HE22 . 19870 1 547 . 1 1 54 54 GLN C C 13 174.100 0.3 . 1 . . . A 54 GLN C . 19870 1 548 . 1 1 54 54 GLN CA C 13 54.299 0.3 . 1 . . . A 54 GLN CA . 19870 1 549 . 1 1 54 54 GLN CB C 13 28.499 0.3 . 1 . . . A 54 GLN CB . 19870 1 550 . 1 1 54 54 GLN CG C 13 33.500 0.3 . 1 . . . A 54 GLN CG . 19870 1 551 . 1 1 54 54 GLN N N 15 121.080 0.3 . 1 . . . A 54 GLN N . 19870 1 552 . 1 1 54 54 GLN NE2 N 15 115.062 0.3 . 1 . . . A 54 GLN NE2 . 19870 1 553 . 1 1 55 55 ARG H H 1 8.539 0.020 . 1 . . . A 55 ARG H . 19870 1 554 . 1 1 55 55 ARG HA H 1 5.150 0.020 . 1 . . . A 55 ARG HA . 19870 1 555 . 1 1 55 55 ARG HB2 H 1 1.810 0.020 . 2 . . . A 55 ARG HB2 . 19870 1 556 . 1 1 55 55 ARG HB3 H 1 1.610 0.020 . 2 . . . A 55 ARG HB3 . 19870 1 557 . 1 1 55 55 ARG HG2 H 1 1.800 0.020 . 2 . . . A 55 ARG HG2 . 19870 1 558 . 1 1 55 55 ARG HG3 H 1 1.610 0.020 . 2 . . . A 55 ARG HG3 . 19870 1 559 . 1 1 55 55 ARG HD2 H 1 3.650 0.020 . 2 . . . A 55 ARG HD2 . 19870 1 560 . 1 1 55 55 ARG HD3 H 1 3.120 0.020 . 2 . . . A 55 ARG HD3 . 19870 1 561 . 1 1 55 55 ARG HH22 H 1 7.130 0.020 . 1 . . . A 55 ARG HH22 . 19870 1 562 . 1 1 55 55 ARG HH12 H 1 6.680 0.020 . 1 . . . A 55 ARG HH12 . 19870 1 563 . 1 1 55 55 ARG C C 13 175.600 0.3 . 1 . . . A 55 ARG C . 19870 1 564 . 1 1 55 55 ARG CA C 13 52.565 0.3 . 1 . . . A 55 ARG CA . 19870 1 565 . 1 1 55 55 ARG CB C 13 32.980 0.3 . 1 . . . A 55 ARG CB . 19870 1 566 . 1 1 55 55 ARG CG C 13 28.075 0.3 . 1 . . . A 55 ARG CG . 19870 1 567 . 1 1 55 55 ARG CD C 13 43.700 0.3 . 1 . . . A 55 ARG CD . 19870 1 568 . 1 1 55 55 ARG N N 15 122.285 0.3 . 1 . . . A 55 ARG N . 19870 1 569 . 1 1 56 56 PRO HA H 1 4.370 0.020 . 1 . . . A 56 PRO HA . 19870 1 570 . 1 1 56 56 PRO HB2 H 1 2.360 0.020 . 2 . . . A 56 PRO HB2 . 19870 1 571 . 1 1 56 56 PRO HB3 H 1 1.840 0.020 . 2 . . . A 56 PRO HB3 . 19870 1 572 . 1 1 56 56 PRO HD2 H 1 3.750 0.020 . 1 . . . A 56 PRO HD2 . 19870 1 573 . 1 1 56 56 PRO C C 13 176.200 0.3 . 1 . . . A 56 PRO C . 19870 1 574 . 1 1 56 56 PRO CA C 13 62.405 0.3 . 1 . . . A 56 PRO CA . 19870 1 575 . 1 1 56 56 PRO CB C 13 32.500 0.3 . 1 . . . A 56 PRO CB . 19870 1 576 . 1 1 57 57 SER H H 1 8.554 0.020 . 1 . . . A 57 SER H . 19870 1 577 . 1 1 57 57 SER HA H 1 4.250 0.020 . 1 . . . A 57 SER HA . 19870 1 578 . 1 1 57 57 SER HB2 H 1 3.881 0.020 . 2 . . . A 57 SER HB2 . 19870 1 579 . 1 1 57 57 SER HB3 H 1 3.880 0.020 . 2 . . . A 57 SER HB3 . 19870 1 580 . 1 1 57 57 SER C C 13 176.200 0.3 . 1 . . . A 57 SER C . 19870 1 581 . 1 1 57 57 SER CA C 13 59.935 0.3 . 1 . . . A 57 SER CA . 19870 1 582 . 1 1 57 57 SER CB C 13 63.000 0.3 . 1 . . . A 57 SER CB . 19870 1 583 . 1 1 57 57 SER N N 15 116.392 0.3 . 1 . . . A 57 SER N . 19870 1 584 . 1 1 58 58 GLY HA2 H 1 4.188 0.020 . 2 . . . A 58 GLY HA2 . 19870 1 585 . 1 1 58 58 GLY HA3 H 1 3.698 0.020 . 2 . . . A 58 GLY HA3 . 19870 1 586 . 1 1 58 58 GLY C C 13 174.186 0.3 . 1 . . . A 58 GLY C . 19870 1 587 . 1 1 58 58 GLY CA C 13 44.977 0.3 . 1 . . . A 58 GLY CA . 19870 1 588 . 1 1 59 59 VAL H H 1 7.472 0.020 . 1 . . . A 59 VAL H . 19870 1 589 . 1 1 59 59 VAL HA H 1 4.373 0.020 . 1 . . . A 59 VAL HA . 19870 1 590 . 1 1 59 59 VAL HB H 1 2.099 0.020 . 1 . . . A 59 VAL HB . 19870 1 591 . 1 1 59 59 VAL HG11 H 1 0.964 0.020 . 2 . . . A 59 VAL HG11 . 19870 1 592 . 1 1 59 59 VAL HG12 H 1 0.964 0.020 . 2 . . . A 59 VAL HG12 . 19870 1 593 . 1 1 59 59 VAL HG13 H 1 0.964 0.020 . 2 . . . A 59 VAL HG13 . 19870 1 594 . 1 1 59 59 VAL HG21 H 1 1.067 0.020 . 2 . . . A 59 VAL HG21 . 19870 1 595 . 1 1 59 59 VAL HG22 H 1 1.067 0.020 . 2 . . . A 59 VAL HG22 . 19870 1 596 . 1 1 59 59 VAL HG23 H 1 1.067 0.020 . 2 . . . A 59 VAL HG23 . 19870 1 597 . 1 1 59 59 VAL C C 13 174.600 0.3 . 1 . . . A 59 VAL C . 19870 1 598 . 1 1 59 59 VAL CA C 13 59.801 0.3 . 1 . . . A 59 VAL CA . 19870 1 599 . 1 1 59 59 VAL CB C 13 32.980 0.3 . 1 . . . A 59 VAL CB . 19870 1 600 . 1 1 59 59 VAL CG1 C 13 22.697 0.3 . 1 . . . A 59 VAL CG1 . 19870 1 601 . 1 1 59 59 VAL CG2 C 13 19.087 0.3 . 1 . . . A 59 VAL CG2 . 19870 1 602 . 1 1 59 59 VAL N N 15 124.280 0.3 . 1 . . . A 59 VAL N . 19870 1 603 . 1 1 60 60 PRO HA H 1 4.530 0.020 . 1 . . . A 60 PRO HA . 19870 1 604 . 1 1 60 60 PRO HB2 H 1 2.640 0.020 . 2 . . . A 60 PRO HB2 . 19870 1 605 . 1 1 60 60 PRO HB3 H 1 2.050 0.020 . 2 . . . A 60 PRO HB3 . 19870 1 606 . 1 1 60 60 PRO C C 13 176.500 0.3 . 1 . . . A 60 PRO C . 19870 1 607 . 1 1 60 60 PRO CA C 13 63.044 0.3 . 1 . . . A 60 PRO CA . 19870 1 608 . 1 1 60 60 PRO CB C 13 33.131 0.3 . 1 . . . A 60 PRO CB . 19870 1 609 . 1 1 61 61 ASP H H 1 8.498 0.020 . 1 . . . A 61 ASP H . 19870 1 610 . 1 1 61 61 ASP HA H 1 4.111 0.020 . 1 . . . A 61 ASP HA . 19870 1 611 . 1 1 61 61 ASP HB2 H 1 2.911 0.020 . 2 . . . A 61 ASP HB2 . 19870 1 612 . 1 1 61 61 ASP HB3 H 1 2.590 0.020 . 2 . . . A 61 ASP HB3 . 19870 1 613 . 1 1 61 61 ASP C C 13 175.600 0.3 . 1 . . . A 61 ASP C . 19870 1 614 . 1 1 61 61 ASP CA C 13 55.239 0.3 . 1 . . . A 61 ASP CA . 19870 1 615 . 1 1 61 61 ASP CB C 13 39.267 0.3 . 1 . . . A 61 ASP CB . 19870 1 616 . 1 1 61 61 ASP N N 15 119.322 0.3 . 1 . . . A 61 ASP N . 19870 1 617 . 1 1 62 62 ARG H H 1 6.675 0.020 . 1 . . . A 62 ARG H . 19870 1 618 . 1 1 62 62 ARG HA H 1 4.090 0.020 . 1 . . . A 62 ARG HA . 19870 1 619 . 1 1 62 62 ARG C C 13 175.626 0.3 . 1 . . . A 62 ARG C . 19870 1 620 . 1 1 62 62 ARG CA C 13 56.829 0.3 . 1 . . . A 62 ARG CA . 19870 1 621 . 1 1 62 62 ARG CB C 13 29.222 0.3 . 1 . . . A 62 ARG CB . 19870 1 622 . 1 1 62 62 ARG N N 15 114.708 0.3 . 1 . . . A 62 ARG N . 19870 1 623 . 1 1 63 63 PHE H H 1 7.670 0.020 . 1 . . . A 63 PHE H . 19870 1 624 . 1 1 63 63 PHE HA H 1 4.797 0.020 . 1 . . . A 63 PHE HA . 19870 1 625 . 1 1 63 63 PHE HB2 H 1 3.010 0.020 . 2 . . . A 63 PHE HB2 . 19870 1 626 . 1 1 63 63 PHE HB3 H 1 2.353 0.020 . 2 . . . A 63 PHE HB3 . 19870 1 627 . 1 1 63 63 PHE HD1 H 1 7.120 0.020 . 3 . . . A 63 PHE HD1 . 19870 1 628 . 1 1 63 63 PHE HD2 H 1 7.064 0.020 . 3 . . . A 63 PHE HD2 . 19870 1 629 . 1 1 63 63 PHE HE1 H 1 7.260 0.020 . 3 . . . A 63 PHE HE1 . 19870 1 630 . 1 1 63 63 PHE HE2 H 1 7.248 0.020 . 3 . . . A 63 PHE HE2 . 19870 1 631 . 1 1 63 63 PHE HZ H 1 7.380 0.020 . 1 . . . A 63 PHE HZ . 19870 1 632 . 1 1 63 63 PHE C C 13 174.589 0.3 . 1 . . . A 63 PHE C . 19870 1 633 . 1 1 63 63 PHE CA C 13 57.856 0.3 . 1 . . . A 63 PHE CA . 19870 1 634 . 1 1 63 63 PHE CB C 13 40.320 0.3 . 1 . . . A 63 PHE CB . 19870 1 635 . 1 1 63 63 PHE N N 15 119.970 0.3 . 1 . . . A 63 PHE N . 19870 1 636 . 1 1 64 64 SER H H 1 8.862 0.020 . 1 . . . A 64 SER H . 19870 1 637 . 1 1 64 64 SER HA H 1 4.784 0.020 . 1 . . . A 64 SER HA . 19870 1 638 . 1 1 64 64 SER HB2 H 1 3.762 0.020 . 2 . . . A 64 SER HB2 . 19870 1 639 . 1 1 64 64 SER HB3 H 1 3.652 0.020 . 2 . . . A 64 SER HB3 . 19870 1 640 . 1 1 64 64 SER C C 13 172.374 0.3 . 1 . . . A 64 SER C . 19870 1 641 . 1 1 64 64 SER CA C 13 56.900 0.3 . 1 . . . A 64 SER CA . 19870 1 642 . 1 1 64 64 SER CB C 13 65.284 0.3 . 1 . . . A 64 SER CB . 19870 1 643 . 1 1 64 64 SER N N 15 114.719 0.3 . 1 . . . A 64 SER N . 19870 1 644 . 1 1 65 65 GLY H H 1 8.796 0.020 . 1 . . . A 65 GLY H . 19870 1 645 . 1 1 65 65 GLY HA2 H 1 5.403 0.020 . 2 . . . A 65 GLY HA2 . 19870 1 646 . 1 1 65 65 GLY HA3 H 1 3.688 0.020 . 2 . . . A 65 GLY HA3 . 19870 1 647 . 1 1 65 65 GLY C C 13 172.498 0.3 . 1 . . . A 65 GLY C . 19870 1 648 . 1 1 65 65 GLY CA C 13 43.459 0.3 . 1 . . . A 65 GLY CA . 19870 1 649 . 1 1 65 65 GLY N N 15 110.076 0.3 . 1 . . . A 65 GLY N . 19870 1 650 . 1 1 66 66 SER H H 1 8.661 0.020 . 1 . . . A 66 SER H . 19870 1 651 . 1 1 66 66 SER HA H 1 4.778 0.020 . 1 . . . A 66 SER HA . 19870 1 652 . 1 1 66 66 SER HB2 H 1 3.744 0.020 . 2 . . . A 66 SER HB2 . 19870 1 653 . 1 1 66 66 SER HB3 H 1 3.714 0.020 . 2 . . . A 66 SER HB3 . 19870 1 654 . 1 1 66 66 SER C C 13 173.149 0.3 . 1 . . . A 66 SER C . 19870 1 655 . 1 1 66 66 SER CA C 13 56.901 0.3 . 1 . . . A 66 SER CA . 19870 1 656 . 1 1 66 66 SER CB C 13 65.718 0.3 . 1 . . . A 66 SER CB . 19870 1 657 . 1 1 66 66 SER N N 15 113.017 0.3 . 1 . . . A 66 SER N . 19870 1 658 . 1 1 67 67 ILE H H 1 8.501 0.020 . 1 . . . A 67 ILE H . 19870 1 659 . 1 1 67 67 ILE HA H 1 4.785 0.020 . 1 . . . A 67 ILE HA . 19870 1 660 . 1 1 67 67 ILE HB H 1 1.970 0.020 . 1 . . . A 67 ILE HB . 19870 1 661 . 1 1 67 67 ILE HG12 H 1 1.540 0.020 . 2 . . . A 67 ILE HG12 . 19870 1 662 . 1 1 67 67 ILE HG13 H 1 1.339 0.020 . 2 . . . A 67 ILE HG13 . 19870 1 663 . 1 1 67 67 ILE HG21 H 1 0.856 0.020 . 1 . . . A 67 ILE HG21 . 19870 1 664 . 1 1 67 67 ILE HG22 H 1 0.856 0.020 . 1 . . . A 67 ILE HG22 . 19870 1 665 . 1 1 67 67 ILE HG23 H 1 0.856 0.020 . 1 . . . A 67 ILE HG23 . 19870 1 666 . 1 1 67 67 ILE HD11 H 1 0.921 0.020 . 1 . . . A 67 ILE HD11 . 19870 1 667 . 1 1 67 67 ILE HD12 H 1 0.921 0.020 . 1 . . . A 67 ILE HD12 . 19870 1 668 . 1 1 67 67 ILE HD13 H 1 0.921 0.020 . 1 . . . A 67 ILE HD13 . 19870 1 669 . 1 1 67 67 ILE C C 13 174.372 0.3 . 1 . . . A 67 ILE C . 19870 1 670 . 1 1 67 67 ILE CA C 13 59.600 0.3 . 1 . . . A 67 ILE CA . 19870 1 671 . 1 1 67 67 ILE CB C 13 40.400 0.3 . 1 . . . A 67 ILE CB . 19870 1 672 . 1 1 67 67 ILE CG1 C 13 26.900 0.3 . 1 . . . A 67 ILE CG1 . 19870 1 673 . 1 1 67 67 ILE CG2 C 13 16.595 0.3 . 1 . . . A 67 ILE CG2 . 19870 1 674 . 1 1 67 67 ILE CD1 C 13 10.928 0.3 . 1 . . . A 67 ILE CD1 . 19870 1 675 . 1 1 67 67 ILE N N 15 121.376 0.3 . 1 . . . A 67 ILE N . 19870 1 676 . 1 1 68 68 ASP H H 1 9.123 0.020 . 1 . . . A 68 ASP H . 19870 1 677 . 1 1 68 68 ASP HA H 1 5.059 0.020 . 1 . . . A 68 ASP HA . 19870 1 678 . 1 1 68 68 ASP HB2 H 1 2.893 0.020 . 2 . . . A 68 ASP HB2 . 19870 1 679 . 1 1 68 68 ASP HB3 H 1 2.454 0.020 . 2 . . . A 68 ASP HB3 . 19870 1 680 . 1 1 68 68 ASP C C 13 176.060 0.3 . 1 . . . A 68 ASP C . 19870 1 681 . 1 1 68 68 ASP CA C 13 52.131 0.3 . 1 . . . A 68 ASP CA . 19870 1 682 . 1 1 68 68 ASP CB C 13 42.014 0.3 . 1 . . . A 68 ASP CB . 19870 1 683 . 1 1 68 68 ASP N N 15 125.956 0.3 . 1 . . . A 68 ASP N . 19870 1 684 . 1 1 70 70 SER HA H 1 4.333 0.020 . 1 . . . A 70 SER HA . 19870 1 685 . 1 1 70 70 SER HB2 H 1 4.060 0.020 . 2 . . . A 70 SER HB2 . 19870 1 686 . 1 1 70 70 SER HB3 H 1 4.030 0.020 . 2 . . . A 70 SER HB3 . 19870 1 687 . 1 1 70 70 SER C C 13 175.100 0.3 . 1 . . . A 70 SER C . 19870 1 688 . 1 1 70 70 SER CA C 13 61.158 0.3 . 1 . . . A 70 SER CA . 19870 1 689 . 1 1 70 70 SER CB C 13 62.900 0.3 . 1 . . . A 70 SER CB . 19870 1 690 . 1 1 71 71 SER H H 1 7.369 0.020 . 1 . . . A 71 SER H . 19870 1 691 . 1 1 71 71 SER HA H 1 4.613 0.020 . 1 . . . A 71 SER HA . 19870 1 692 . 1 1 71 71 SER HB2 H 1 4.039 0.020 . 2 . . . A 71 SER HB2 . 19870 1 693 . 1 1 71 71 SER HB3 H 1 3.730 0.020 . 2 . . . A 71 SER HB3 . 19870 1 694 . 1 1 71 71 SER C C 13 174.573 0.3 . 1 . . . A 71 SER C . 19870 1 695 . 1 1 71 71 SER CA C 13 57.479 0.3 . 1 . . . A 71 SER CA . 19870 1 696 . 1 1 71 71 SER CB C 13 63.694 0.3 . 1 . . . A 71 SER CB . 19870 1 697 . 1 1 71 71 SER N N 15 113.903 0.3 . 1 . . . A 71 SER N . 19870 1 698 . 1 1 72 72 ASN H H 1 8.071 0.020 . 1 . . . A 72 ASN H . 19870 1 699 . 1 1 72 72 ASN HA H 1 4.534 0.020 . 1 . . . A 72 ASN HA . 19870 1 700 . 1 1 72 72 ASN HB2 H 1 3.683 0.020 . 2 . . . A 72 ASN HB2 . 19870 1 701 . 1 1 72 72 ASN HB3 H 1 2.510 0.020 . 2 . . . A 72 ASN HB3 . 19870 1 702 . 1 1 72 72 ASN C C 13 173.226 0.3 . 1 . . . A 72 ASN C . 19870 1 703 . 1 1 72 72 ASN CA C 13 53.649 0.3 . 1 . . . A 72 ASN CA . 19870 1 704 . 1 1 72 72 ASN CB C 13 39.340 0.3 . 1 . . . A 72 ASN CB . 19870 1 705 . 1 1 72 72 ASN N N 15 124.613 0.3 . 1 . . . A 72 ASN N . 19870 1 706 . 1 1 73 73 SER H H 1 8.116 0.020 . 1 . . . A 73 SER H . 19870 1 707 . 1 1 73 73 SER HA H 1 5.592 0.020 . 1 . . . A 73 SER HA . 19870 1 708 . 1 1 73 73 SER HB2 H 1 3.709 0.020 . 2 . . . A 73 SER HB2 . 19870 1 709 . 1 1 73 73 SER HB3 H 1 3.616 0.020 . 2 . . . A 73 SER HB3 . 19870 1 710 . 1 1 73 73 SER C C 13 171.724 0.3 . 1 . . . A 73 SER C . 19870 1 711 . 1 1 73 73 SER CA C 13 56.177 0.3 . 1 . . . A 73 SER CA . 19870 1 712 . 1 1 73 73 SER CB C 13 68.031 0.3 . 1 . . . A 73 SER CB . 19870 1 713 . 1 1 73 73 SER N N 15 108.967 0.3 . 1 . . . A 73 SER N . 19870 1 714 . 1 1 74 74 ALA H H 1 9.231 0.020 . 1 . . . A 74 ALA H . 19870 1 715 . 1 1 74 74 ALA HA H 1 5.376 0.020 . 1 . . . A 74 ALA HA . 19870 1 716 . 1 1 74 74 ALA HB1 H 1 1.690 0.020 . 1 . . . A 74 ALA HB1 . 19870 1 717 . 1 1 74 74 ALA HB2 H 1 1.690 0.020 . 1 . . . A 74 ALA HB2 . 19870 1 718 . 1 1 74 74 ALA HB3 H 1 1.690 0.020 . 1 . . . A 74 ALA HB3 . 19870 1 719 . 1 1 74 74 ALA C C 13 176.571 0.3 . 1 . . . A 74 ALA C . 19870 1 720 . 1 1 74 74 ALA CA C 13 49.714 0.3 . 1 . . . A 74 ALA CA . 19870 1 721 . 1 1 74 74 ALA CB C 13 23.585 0.3 . 1 . . . A 74 ALA CB . 19870 1 722 . 1 1 74 74 ALA N N 15 125.224 0.3 . 1 . . . A 74 ALA N . 19870 1 723 . 1 1 75 75 SER H H 1 8.909 0.020 . 1 . . . A 75 SER H . 19870 1 724 . 1 1 75 75 SER HA H 1 5.696 0.020 . 1 . . . A 75 SER HA . 19870 1 725 . 1 1 75 75 SER HB2 H 1 3.454 0.020 . 2 . . . A 75 SER HB2 . 19870 1 726 . 1 1 75 75 SER HB3 H 1 3.394 0.020 . 2 . . . A 75 SER HB3 . 19870 1 727 . 1 1 75 75 SER C C 13 171.569 0.3 . 1 . . . A 75 SER C . 19870 1 728 . 1 1 75 75 SER CA C 13 57.624 0.3 . 1 . . . A 75 SER CA . 19870 1 729 . 1 1 75 75 SER CB C 13 66.368 0.3 . 1 . . . A 75 SER CB . 19870 1 730 . 1 1 75 75 SER N N 15 114.085 0.3 . 1 . . . A 75 SER N . 19870 1 731 . 1 1 76 76 LEU H H 1 8.322 0.020 . 1 . . . A 76 LEU H . 19870 1 732 . 1 1 76 76 LEU HA H 1 4.388 0.020 . 1 . . . A 76 LEU HA . 19870 1 733 . 1 1 76 76 LEU HB2 H 1 0.310 0.020 . 2 . . . A 76 LEU HB2 . 19870 1 734 . 1 1 76 76 LEU HB3 H 1 0.256 0.020 . 2 . . . A 76 LEU HB3 . 19870 1 735 . 1 1 76 76 LEU HG H 1 0.845 0.020 . 1 . . . A 76 LEU HG . 19870 1 736 . 1 1 76 76 LEU HD11 H 1 0.207 0.020 . 2 . . . A 76 LEU HD11 . 19870 1 737 . 1 1 76 76 LEU HD12 H 1 0.207 0.020 . 2 . . . A 76 LEU HD12 . 19870 1 738 . 1 1 76 76 LEU HD13 H 1 0.207 0.020 . 2 . . . A 76 LEU HD13 . 19870 1 739 . 1 1 76 76 LEU HD21 H 1 -1.520 0.020 . 2 . . . A 76 LEU HD21 . 19870 1 740 . 1 1 76 76 LEU HD22 H 1 -1.520 0.020 . 2 . . . A 76 LEU HD22 . 19870 1 741 . 1 1 76 76 LEU HD23 H 1 -1.520 0.020 . 2 . . . A 76 LEU HD23 . 19870 1 742 . 1 1 76 76 LEU C C 13 174.700 0.3 . 1 . . . A 76 LEU C . 19870 1 743 . 1 1 76 76 LEU CA C 13 52.500 0.3 . 1 . . . A 76 LEU CA . 19870 1 744 . 1 1 76 76 LEU CB C 13 41.394 0.3 . 1 . . . A 76 LEU CB . 19870 1 745 . 1 1 76 76 LEU CG C 13 26.800 0.3 . 1 . . . A 76 LEU CG . 19870 1 746 . 1 1 76 76 LEU CD1 C 13 27.300 0.3 . 1 . . . A 76 LEU CD1 . 19870 1 747 . 1 1 76 76 LEU CD2 C 13 23.600 0.3 . 1 . . . A 76 LEU CD2 . 19870 1 748 . 1 1 76 76 LEU N N 15 127.649 0.3 . 1 . . . A 76 LEU N . 19870 1 749 . 1 1 77 77 THR H H 1 9.015 0.020 . 1 . . . A 77 THR H . 19870 1 750 . 1 1 77 77 THR HA H 1 4.954 0.020 . 1 . . . A 77 THR HA . 19870 1 751 . 1 1 77 77 THR HB H 1 3.574 0.020 . 1 . . . A 77 THR HB . 19870 1 752 . 1 1 77 77 THR HG21 H 1 0.811 0.020 . 1 . . . A 77 THR HG21 . 19870 1 753 . 1 1 77 77 THR HG22 H 1 0.811 0.020 . 1 . . . A 77 THR HG22 . 19870 1 754 . 1 1 77 77 THR HG23 H 1 0.811 0.020 . 1 . . . A 77 THR HG23 . 19870 1 755 . 1 1 77 77 THR C C 13 173.000 0.3 . 1 . . . A 77 THR C . 19870 1 756 . 1 1 77 77 THR CA C 13 61.165 0.3 . 1 . . . A 77 THR CA . 19870 1 757 . 1 1 77 77 THR CB C 13 69.910 0.3 . 1 . . . A 77 THR CB . 19870 1 758 . 1 1 77 77 THR CG2 C 13 21.300 0.3 . 1 . . . A 77 THR CG2 . 19870 1 759 . 1 1 77 77 THR N N 15 124.468 0.3 . 1 . . . A 77 THR N . 19870 1 760 . 1 1 78 78 ILE H H 1 8.674 0.020 . 1 . . . A 78 ILE H . 19870 1 761 . 1 1 78 78 ILE HA H 1 4.240 0.020 . 1 . . . A 78 ILE HA . 19870 1 762 . 1 1 78 78 ILE HB H 1 1.241 0.020 . 1 . . . A 78 ILE HB . 19870 1 763 . 1 1 78 78 ILE HG12 H 1 0.819 0.020 . 2 . . . A 78 ILE HG12 . 19870 1 764 . 1 1 78 78 ILE HG13 H 1 0.789 0.020 . 2 . . . A 78 ILE HG13 . 19870 1 765 . 1 1 78 78 ILE HG21 H 1 -0.029 0.020 . 1 . . . A 78 ILE HG21 . 19870 1 766 . 1 1 78 78 ILE HG22 H 1 -0.029 0.020 . 1 . . . A 78 ILE HG22 . 19870 1 767 . 1 1 78 78 ILE HG23 H 1 -0.029 0.020 . 1 . . . A 78 ILE HG23 . 19870 1 768 . 1 1 78 78 ILE HD11 H 1 0.124 0.020 . 1 . . . A 78 ILE HD11 . 19870 1 769 . 1 1 78 78 ILE HD12 H 1 0.124 0.020 . 1 . . . A 78 ILE HD12 . 19870 1 770 . 1 1 78 78 ILE HD13 H 1 0.124 0.020 . 1 . . . A 78 ILE HD13 . 19870 1 771 . 1 1 78 78 ILE C C 13 174.697 0.3 . 1 . . . A 78 ILE C . 19870 1 772 . 1 1 78 78 ILE CA C 13 60.300 0.3 . 1 . . . A 78 ILE CA . 19870 1 773 . 1 1 78 78 ILE CB C 13 39.300 0.3 . 1 . . . A 78 ILE CB . 19870 1 774 . 1 1 78 78 ILE CG1 C 13 26.000 0.3 . 1 . . . A 78 ILE CG1 . 19870 1 775 . 1 1 78 78 ILE CG2 C 13 17.066 0.3 . 1 . . . A 78 ILE CG2 . 19870 1 776 . 1 1 78 78 ILE CD1 C 13 13.610 0.3 . 1 . . . A 78 ILE CD1 . 19870 1 777 . 1 1 78 78 ILE N N 15 127.006 0.3 . 1 . . . A 78 ILE N . 19870 1 778 . 1 1 79 79 SER H H 1 8.495 0.020 . 1 . . . A 79 SER H . 19870 1 779 . 1 1 79 79 SER HA H 1 4.800 0.020 . 1 . . . A 79 SER HA . 19870 1 780 . 1 1 79 79 SER HB2 H 1 3.700 0.020 . 2 . . . A 79 SER HB2 . 19870 1 781 . 1 1 79 79 SER HB3 H 1 3.613 0.020 . 2 . . . A 79 SER HB3 . 19870 1 782 . 1 1 79 79 SER C C 13 173.800 0.3 . 1 . . . A 79 SER C . 19870 1 783 . 1 1 79 79 SER CA C 13 56.540 0.3 . 1 . . . A 79 SER CA . 19870 1 784 . 1 1 79 79 SER CB C 13 64.273 0.3 . 1 . . . A 79 SER CB . 19870 1 785 . 1 1 79 79 SER N N 15 121.450 0.3 . 1 . . . A 79 SER N . 19870 1 786 . 1 1 80 80 GLY H H 1 7.728 0.020 . 1 . . . A 80 GLY H . 19870 1 787 . 1 1 80 80 GLY HA2 H 1 3.585 0.020 . 2 . . . A 80 GLY HA2 . 19870 1 788 . 1 1 80 80 GLY HA3 H 1 3.333 0.020 . 2 . . . A 80 GLY HA3 . 19870 1 789 . 1 1 80 80 GLY C C 13 174.356 0.3 . 1 . . . A 80 GLY C . 19870 1 790 . 1 1 80 80 GLY CA C 13 47.144 0.3 . 1 . . . A 80 GLY CA . 19870 1 791 . 1 1 80 80 GLY N N 15 110.237 0.3 . 1 . . . A 80 GLY N . 19870 1 792 . 1 1 81 81 LEU H H 1 7.954 0.020 . 1 . . . A 81 LEU H . 19870 1 793 . 1 1 81 81 LEU HA H 1 3.667 0.020 . 1 . . . A 81 LEU HA . 19870 1 794 . 1 1 81 81 LEU HB2 H 1 1.425 0.020 . 2 . . . A 81 LEU HB2 . 19870 1 795 . 1 1 81 81 LEU HB3 H 1 1.420 0.020 . 2 . . . A 81 LEU HB3 . 19870 1 796 . 1 1 81 81 LEU HG H 1 1.394 0.020 . 1 . . . A 81 LEU HG . 19870 1 797 . 1 1 81 81 LEU HD11 H 1 0.663 0.020 . 2 . . . A 81 LEU HD11 . 19870 1 798 . 1 1 81 81 LEU HD12 H 1 0.663 0.020 . 2 . . . A 81 LEU HD12 . 19870 1 799 . 1 1 81 81 LEU HD13 H 1 0.663 0.020 . 2 . . . A 81 LEU HD13 . 19870 1 800 . 1 1 81 81 LEU HD21 H 1 0.728 0.020 . 2 . . . A 81 LEU HD21 . 19870 1 801 . 1 1 81 81 LEU HD22 H 1 0.728 0.020 . 2 . . . A 81 LEU HD22 . 19870 1 802 . 1 1 81 81 LEU HD23 H 1 0.728 0.020 . 2 . . . A 81 LEU HD23 . 19870 1 803 . 1 1 81 81 LEU C C 13 174.248 0.3 . 1 . . . A 81 LEU C . 19870 1 804 . 1 1 81 81 LEU CA C 13 56.600 0.3 . 1 . . . A 81 LEU CA . 19870 1 805 . 1 1 81 81 LEU CB C 13 43.827 0.3 . 1 . . . A 81 LEU CB . 19870 1 806 . 1 1 81 81 LEU CG C 13 26.700 0.3 . 1 . . . A 81 LEU CG . 19870 1 807 . 1 1 81 81 LEU CD1 C 13 26.500 0.3 . 1 . . . A 81 LEU CD1 . 19870 1 808 . 1 1 81 81 LEU CD2 C 13 25.800 0.3 . 1 . . . A 81 LEU CD2 . 19870 1 809 . 1 1 81 81 LEU N N 15 117.160 0.3 . 1 . . . A 81 LEU N . 19870 1 810 . 1 1 82 82 LYS H H 1 9.026 0.020 . 1 . . . A 82 LYS H . 19870 1 811 . 1 1 82 82 LYS HA H 1 4.839 0.020 . 1 . . . A 82 LYS HA . 19870 1 812 . 1 1 82 82 LYS HB2 H 1 2.143 0.020 . 2 . . . A 82 LYS HB2 . 19870 1 813 . 1 1 82 82 LYS HB3 H 1 1.540 0.020 . 2 . . . A 82 LYS HB3 . 19870 1 814 . 1 1 82 82 LYS HG2 H 1 1.617 0.020 . 2 . . . A 82 LYS HG2 . 19870 1 815 . 1 1 82 82 LYS HG3 H 1 1.366 0.020 . 2 . . . A 82 LYS HG3 . 19870 1 816 . 1 1 82 82 LYS HD2 H 1 1.670 0.020 . 2 . . . A 82 LYS HD2 . 19870 1 817 . 1 1 82 82 LYS HD3 H 1 1.640 0.020 . 2 . . . A 82 LYS HD3 . 19870 1 818 . 1 1 82 82 LYS HE2 H 1 2.893 0.020 . 2 . . . A 82 LYS HE2 . 19870 1 819 . 1 1 82 82 LYS HE3 H 1 3.010 0.020 . 2 . . . A 82 LYS HE3 . 19870 1 820 . 1 1 82 82 LYS C C 13 177.252 0.3 . 1 . . . A 82 LYS C . 19870 1 821 . 1 1 82 82 LYS CA C 13 53.649 0.3 . 1 . . . A 82 LYS CA . 19870 1 822 . 1 1 82 82 LYS CB C 13 36.087 0.3 . 1 . . . A 82 LYS CB . 19870 1 823 . 1 1 82 82 LYS CG C 13 24.477 0.3 . 1 . . . A 82 LYS CG . 19870 1 824 . 1 1 82 82 LYS CD C 13 29.200 0.3 . 1 . . . A 82 LYS CD . 19870 1 825 . 1 1 82 82 LYS CE C 13 42.400 0.3 . 1 . . . A 82 LYS CE . 19870 1 826 . 1 1 82 82 LYS N N 15 125.252 0.3 . 1 . . . A 82 LYS N . 19870 1 827 . 1 1 83 83 THR H H 1 8.806 0.020 . 1 . . . A 83 THR H . 19870 1 828 . 1 1 83 83 THR HA H 1 4.159 0.020 . 1 . . . A 83 THR HA . 19870 1 829 . 1 1 83 83 THR HB H 1 3.797 0.020 . 1 . . . A 83 THR HB . 19870 1 830 . 1 1 83 83 THR HG21 H 1 1.298 0.020 . 1 . . . A 83 THR HG21 . 19870 1 831 . 1 1 83 83 THR HG22 H 1 1.298 0.020 . 1 . . . A 83 THR HG22 . 19870 1 832 . 1 1 83 83 THR HG23 H 1 1.298 0.020 . 1 . . . A 83 THR HG23 . 19870 1 833 . 1 1 83 83 THR C C 13 177.237 0.3 . 1 . . . A 83 THR C . 19870 1 834 . 1 1 83 83 THR CA C 13 67.823 0.3 . 1 . . . A 83 THR CA . 19870 1 835 . 1 1 83 83 THR CB C 13 66.442 0.3 . 1 . . . A 83 THR CB . 19870 1 836 . 1 1 83 83 THR CG2 C 13 21.808 0.3 . 1 . . . A 83 THR CG2 . 19870 1 837 . 1 1 83 83 THR N N 15 116.297 0.3 . 1 . . . A 83 THR N . 19870 1 838 . 1 1 84 84 GLU H H 1 8.798 0.020 . 1 . . . A 84 GLU H . 19870 1 839 . 1 1 84 84 GLU HA H 1 4.305 0.020 . 1 . . . A 84 GLU HA . 19870 1 840 . 1 1 84 84 GLU HB2 H 1 2.140 0.020 . 2 . . . A 84 GLU HB2 . 19870 1 841 . 1 1 84 84 GLU HB3 H 1 2.060 0.020 . 2 . . . A 84 GLU HB3 . 19870 1 842 . 1 1 84 84 GLU HG2 H 1 2.177 0.020 . 2 . . . A 84 GLU HG2 . 19870 1 843 . 1 1 84 84 GLU HG3 H 1 2.170 0.020 . 2 . . . A 84 GLU HG3 . 19870 1 844 . 1 1 84 84 GLU C C 13 175.394 0.3 . 1 . . . A 84 GLU C . 19870 1 845 . 1 1 84 84 GLU CA C 13 57.985 0.3 . 1 . . . A 84 GLU CA . 19870 1 846 . 1 1 84 84 GLU CB C 13 28.427 0.3 . 1 . . . A 84 GLU CB . 19870 1 847 . 1 1 84 84 GLU CG C 13 35.711 0.3 . 1 . . . A 84 GLU CG . 19870 1 848 . 1 1 84 84 GLU N N 15 118.205 0.3 . 1 . . . A 84 GLU N . 19870 1 849 . 1 1 85 85 ASP H H 1 8.101 0.020 . 1 . . . A 85 ASP H . 19870 1 850 . 1 1 85 85 ASP HA H 1 4.568 0.020 . 1 . . . A 85 ASP HA . 19870 1 851 . 1 1 85 85 ASP HB2 H 1 2.900 0.020 . 2 . . . A 85 ASP HB2 . 19870 1 852 . 1 1 85 85 ASP HB3 H 1 2.630 0.020 . 2 . . . A 85 ASP HB3 . 19870 1 853 . 1 1 85 85 ASP C C 13 177.407 0.3 . 1 . . . A 85 ASP C . 19870 1 854 . 1 1 85 85 ASP CA C 13 54.509 0.3 . 1 . . . A 85 ASP CA . 19870 1 855 . 1 1 85 85 ASP CB C 13 40.430 0.3 . 1 . . . A 85 ASP CB . 19870 1 856 . 1 1 85 85 ASP N N 15 119.742 0.3 . 1 . . . A 85 ASP N . 19870 1 857 . 1 1 86 86 GLU H H 1 7.518 0.020 . 1 . . . A 86 GLU H . 19870 1 858 . 1 1 86 86 GLU HA H 1 4.120 0.020 . 1 . . . A 86 GLU HA . 19870 1 859 . 1 1 86 86 GLU HB2 H 1 2.226 0.020 . 2 . . . A 86 GLU HB2 . 19870 1 860 . 1 1 86 86 GLU HB3 H 1 2.132 0.020 . 2 . . . A 86 GLU HB3 . 19870 1 861 . 1 1 86 86 GLU HG2 H 1 3.100 0.020 . 2 . . . A 86 GLU HG2 . 19870 1 862 . 1 1 86 86 GLU HG3 H 1 2.159 0.020 . 2 . . . A 86 GLU HG3 . 19870 1 863 . 1 1 86 86 GLU C C 13 174.914 0.3 . 1 . . . A 86 GLU C . 19870 1 864 . 1 1 86 86 GLU CA C 13 58.852 0.3 . 1 . . . A 86 GLU CA . 19870 1 865 . 1 1 86 86 GLU CB C 13 29.655 0.3 . 1 . . . A 86 GLU CB . 19870 1 866 . 1 1 86 86 GLU CG C 13 36.376 0.3 . 1 . . . A 86 GLU CG . 19870 1 867 . 1 1 86 86 GLU N N 15 121.665 0.3 . 1 . . . A 86 GLU N . 19870 1 868 . 1 1 87 87 ALA H H 1 8.077 0.020 . 1 . . . A 87 ALA H . 19870 1 869 . 1 1 87 87 ALA HA H 1 4.362 0.020 . 1 . . . A 87 ALA HA . 19870 1 870 . 1 1 87 87 ALA HB1 H 1 1.037 0.020 . 1 . . . A 87 ALA HB1 . 19870 1 871 . 1 1 87 87 ALA HB2 H 1 1.037 0.020 . 1 . . . A 87 ALA HB2 . 19870 1 872 . 1 1 87 87 ALA HB3 H 1 1.037 0.020 . 1 . . . A 87 ALA HB3 . 19870 1 873 . 1 1 87 87 ALA C C 13 174.511 0.3 . 1 . . . A 87 ALA C . 19870 1 874 . 1 1 87 87 ALA CA C 13 51.553 0.3 . 1 . . . A 87 ALA CA . 19870 1 875 . 1 1 87 87 ALA CB C 13 19.833 0.3 . 1 . . . A 87 ALA CB . 19870 1 876 . 1 1 87 87 ALA N N 15 126.586 0.3 . 1 . . . A 87 ALA N . 19870 1 877 . 1 1 88 88 ASP H H 1 7.623 0.020 . 1 . . . A 88 ASP H . 19870 1 878 . 1 1 88 88 ASP HA H 1 5.727 0.020 . 1 . . . A 88 ASP HA . 19870 1 879 . 1 1 88 88 ASP HB2 H 1 2.530 0.020 . 2 . . . A 88 ASP HB2 . 19870 1 880 . 1 1 88 88 ASP HB3 H 1 2.084 0.020 . 2 . . . A 88 ASP HB3 . 19870 1 881 . 1 1 88 88 ASP C C 13 175.300 0.3 . 1 . . . A 88 ASP C . 19870 1 882 . 1 1 88 88 ASP CA C 13 53.504 0.3 . 1 . . . A 88 ASP CA . 19870 1 883 . 1 1 88 88 ASP CB C 13 43.025 0.3 . 1 . . . A 88 ASP CB . 19870 1 884 . 1 1 88 88 ASP N N 15 117.376 0.3 . 1 . . . A 88 ASP N . 19870 1 885 . 1 1 89 89 TYR H H 1 8.974 0.020 . 1 . . . A 89 TYR H . 19870 1 886 . 1 1 89 89 TYR HA H 1 5.730 0.020 . 1 . . . A 89 TYR HA . 19870 1 887 . 1 1 89 89 TYR HB2 H 1 2.870 0.020 . 2 . . . A 89 TYR HB2 . 19870 1 888 . 1 1 89 89 TYR HB3 H 1 2.730 0.020 . 2 . . . A 89 TYR HB3 . 19870 1 889 . 1 1 89 89 TYR HD1 H 1 6.980 0.020 . 1 . . . A 89 TYR HD1 . 19870 1 890 . 1 1 89 89 TYR HD2 H 1 6.980 0.020 . 1 . . . A 89 TYR HD2 . 19870 1 891 . 1 1 89 89 TYR HE1 H 1 6.880 0.020 . 1 . . . A 89 TYR HE1 . 19870 1 892 . 1 1 89 89 TYR HE2 H 1 6.880 0.020 . 1 . . . A 89 TYR HE2 . 19870 1 893 . 1 1 89 89 TYR C C 13 176.697 0.3 . 1 . . . A 89 TYR C . 19870 1 894 . 1 1 89 89 TYR CA C 13 56.323 0.3 . 1 . . . A 89 TYR CA . 19870 1 895 . 1 1 89 89 TYR CB C 13 42.561 0.3 . 1 . . . A 89 TYR CB . 19870 1 896 . 1 1 89 89 TYR N N 15 117.753 0.3 . 1 . . . A 89 TYR N . 19870 1 897 . 1 1 90 90 TYR H H 1 9.305 0.020 . 1 . . . A 90 TYR H . 19870 1 898 . 1 1 90 90 TYR HA H 1 5.246 0.020 . 1 . . . A 90 TYR HA . 19870 1 899 . 1 1 90 90 TYR HB2 H 1 3.070 0.020 . 2 . . . A 90 TYR HB2 . 19870 1 900 . 1 1 90 90 TYR HB3 H 1 2.720 0.020 . 2 . . . A 90 TYR HB3 . 19870 1 901 . 1 1 90 90 TYR HD1 H 1 6.873 0.020 . 3 . . . A 90 TYR HD1 . 19870 1 902 . 1 1 90 90 TYR HD2 H 1 6.873 0.020 . 3 . . . A 90 TYR HD2 . 19870 1 903 . 1 1 90 90 TYR HE1 H 1 6.670 0.020 . 1 . . . A 90 TYR HE1 . 19870 1 904 . 1 1 90 90 TYR HE2 H 1 6.670 0.020 . 1 . . . A 90 TYR HE2 . 19870 1 905 . 1 1 90 90 TYR C C 13 175.208 0.3 . 1 . . . A 90 TYR C . 19870 1 906 . 1 1 90 90 TYR CA C 13 57.300 0.3 . 1 . . . A 90 TYR CA . 19870 1 907 . 1 1 90 90 TYR CB C 13 42.881 0.3 . 1 . . . A 90 TYR CB . 19870 1 908 . 1 1 90 90 TYR N N 15 120.755 0.3 . 1 . . . A 90 TYR N . 19870 1 909 . 1 1 91 91 CYS H H 1 7.739 0.020 . 1 . . . A 91 CYS H . 19870 1 910 . 1 1 91 91 CYS HA H 1 5.000 0.020 . 1 . . . A 91 CYS HA . 19870 1 911 . 1 1 91 91 CYS C C 13 173.551 0.3 . 1 . . . A 91 CYS C . 19870 1 912 . 1 1 91 91 CYS CA C 13 53.288 0.3 . 1 . . . A 91 CYS CA . 19870 1 913 . 1 1 91 91 CYS CB C 13 44.837 0.3 . 1 . . . A 91 CYS CB . 19870 1 914 . 1 1 91 91 CYS N N 15 117.771 0.3 . 1 . . . A 91 CYS N . 19870 1 915 . 1 1 92 92 GLN H H 1 8.410 0.020 . 1 . . . A 92 GLN H . 19870 1 916 . 1 1 92 92 GLN HA H 1 4.814 0.020 . 1 . . . A 92 GLN HA . 19870 1 917 . 1 1 92 92 GLN HB2 H 1 1.310 0.020 . 2 . . . A 92 GLN HB2 . 19870 1 918 . 1 1 92 92 GLN HB3 H 1 1.280 0.020 . 2 . . . A 92 GLN HB3 . 19870 1 919 . 1 1 92 92 GLN HG2 H 1 1.630 0.020 . 2 . . . A 92 GLN HG2 . 19870 1 920 . 1 1 92 92 GLN HG3 H 1 1.650 0.020 . 2 . . . A 92 GLN HG3 . 19870 1 921 . 1 1 92 92 GLN C C 13 173.800 0.3 . 1 . . . A 92 GLN C . 19870 1 922 . 1 1 92 92 GLN CA C 13 54.500 0.3 . 1 . . . A 92 GLN CA . 19870 1 923 . 1 1 92 92 GLN CB C 13 32.200 0.3 . 1 . . . A 92 GLN CB . 19870 1 924 . 1 1 92 92 GLN CG C 13 32.400 0.3 . 1 . . . A 92 GLN CG . 19870 1 925 . 1 1 92 92 GLN N N 15 121.161 0.3 . 1 . . . A 92 GLN N . 19870 1 926 . 1 1 93 93 SER H H 1 8.819 0.020 . 1 . . . A 93 SER H . 19870 1 927 . 1 1 93 93 SER HA H 1 4.327 0.020 . 1 . . . A 93 SER HA . 19870 1 928 . 1 1 93 93 SER HB2 H 1 3.473 0.020 . 2 . . . A 93 SER HB2 . 19870 1 929 . 1 1 93 93 SER HB3 H 1 3.361 0.020 . 2 . . . A 93 SER HB3 . 19870 1 930 . 1 1 93 93 SER C C 13 173.800 0.3 . 1 . . . A 93 SER C . 19870 1 931 . 1 1 93 93 SER CA C 13 55.255 0.3 . 1 . . . A 93 SER CA . 19870 1 932 . 1 1 93 93 SER CB C 13 64.923 0.3 . 1 . . . A 93 SER CB . 19870 1 933 . 1 1 93 93 SER N N 15 119.790 0.3 . 1 . . . A 93 SER N . 19870 1 934 . 1 1 94 94 TYR HA H 1 5.660 0.020 . 1 . . . A 94 TYR HA . 19870 1 935 . 1 1 94 94 TYR HB2 H 1 2.891 0.020 . 2 . . . A 94 TYR HB2 . 19870 1 936 . 1 1 94 94 TYR HB3 H 1 2.343 0.020 . 2 . . . A 94 TYR HB3 . 19870 1 937 . 1 1 94 94 TYR HD1 H 1 6.833 0.020 . 1 . . . A 94 TYR HD1 . 19870 1 938 . 1 1 94 94 TYR HD2 H 1 6.833 0.020 . 1 . . . A 94 TYR HD2 . 19870 1 939 . 1 1 94 94 TYR HE1 H 1 6.910 0.020 . 1 . . . A 94 TYR HE1 . 19870 1 940 . 1 1 94 94 TYR HE2 H 1 6.910 0.020 . 1 . . . A 94 TYR HE2 . 19870 1 941 . 1 1 94 94 TYR C C 13 173.907 0.3 . 1 . . . A 94 TYR C . 19870 1 942 . 1 1 94 94 TYR CA C 13 55.673 0.3 . 1 . . . A 94 TYR CA . 19870 1 943 . 1 1 94 94 TYR CB C 13 43.242 0.3 . 1 . . . A 94 TYR CB . 19870 1 944 . 1 1 95 95 ASP H H 1 8.408 0.020 . 1 . . . A 95 ASP H . 19870 1 945 . 1 1 95 95 ASP HA H 1 4.553 0.020 . 1 . . . A 95 ASP HA . 19870 1 946 . 1 1 95 95 ASP HB2 H 1 3.457 0.020 . 2 . . . A 95 ASP HB2 . 19870 1 947 . 1 1 95 95 ASP HB3 H 1 2.709 0.020 . 2 . . . A 95 ASP HB3 . 19870 1 948 . 1 1 95 95 ASP C C 13 178.785 0.3 . 1 . . . A 95 ASP C . 19870 1 949 . 1 1 95 95 ASP CA C 13 51.625 0.3 . 1 . . . A 95 ASP CA . 19870 1 950 . 1 1 95 95 ASP CB C 13 41.869 0.3 . 1 . . . A 95 ASP CB . 19870 1 951 . 1 1 95 95 ASP N N 15 118.148 0.3 . 1 . . . A 95 ASP N . 19870 1 952 . 1 1 96 96 SER HA H 1 4.208 0.020 . 1 . . . A 96 SER HA . 19870 1 953 . 1 1 96 96 SER HB2 H 1 3.910 0.020 . 2 . . . A 96 SER HB2 . 19870 1 954 . 1 1 96 96 SER HB3 H 1 3.880 0.020 . 2 . . . A 96 SER HB3 . 19870 1 955 . 1 1 96 96 SER C C 13 175.400 0.3 . 1 . . . A 96 SER C . 19870 1 956 . 1 1 96 96 SER CA C 13 60.297 0.3 . 1 . . . A 96 SER CA . 19870 1 957 . 1 1 96 96 SER CB C 13 62.393 0.3 . 1 . . . A 96 SER CB . 19870 1 958 . 1 1 97 97 SER H H 1 8.204 0.020 . 1 . . . A 97 SER H . 19870 1 959 . 1 1 97 97 SER HA H 1 4.541 0.020 . 1 . . . A 97 SER HA . 19870 1 960 . 1 1 97 97 SER HB2 H 1 3.720 0.020 . 2 . . . A 97 SER HB2 . 19870 1 961 . 1 1 97 97 SER HB3 H 1 3.540 0.020 . 2 . . . A 97 SER HB3 . 19870 1 962 . 1 1 97 97 SER C C 13 172.932 0.3 . 1 . . . A 97 SER C . 19870 1 963 . 1 1 97 97 SER CA C 13 57.624 0.3 . 1 . . . A 97 SER CA . 19870 1 964 . 1 1 97 97 SER CB C 13 62.560 0.3 . 1 . . . A 97 SER CB . 19870 1 965 . 1 1 97 97 SER N N 15 118.409 0.3 . 1 . . . A 97 SER N . 19870 1 966 . 1 1 98 98 ASN H H 1 8.350 0.020 . 1 . . . A 98 ASN H . 19870 1 967 . 1 1 98 98 ASN HA H 1 4.266 0.020 . 1 . . . A 98 ASN HA . 19870 1 968 . 1 1 98 98 ASN HB2 H 1 3.023 0.020 . 2 . . . A 98 ASN HB2 . 19870 1 969 . 1 1 98 98 ASN HB3 H 1 2.686 0.020 . 2 . . . A 98 ASN HB3 . 19870 1 970 . 1 1 98 98 ASN HD21 H 1 7.281 0.020 . 1 . . . A 98 ASN HD21 . 19870 1 971 . 1 1 98 98 ASN HD22 H 1 6.576 0.020 . 1 . . . A 98 ASN HD22 . 19870 1 972 . 1 1 98 98 ASN C C 13 173.938 0.3 . 1 . . . A 98 ASN C . 19870 1 973 . 1 1 98 98 ASN CA C 13 54.425 0.3 . 1 . . . A 98 ASN CA . 19870 1 974 . 1 1 98 98 ASN CB C 13 37.533 0.3 . 1 . . . A 98 ASN CB . 19870 1 975 . 1 1 98 98 ASN N N 15 115.462 0.3 . 1 . . . A 98 ASN N . 19870 1 976 . 1 1 98 98 ASN ND2 N 15 112.221 0.3 . 1 . . . A 98 ASN ND2 . 19870 1 977 . 1 1 99 99 HIS H H 1 8.448 0.020 . 1 . . . A 99 HIS H . 19870 1 978 . 1 1 99 99 HIS HA H 1 5.040 0.020 . 1 . . . A 99 HIS HA . 19870 1 979 . 1 1 99 99 HIS HB2 H 1 3.350 0.020 . 2 . . . A 99 HIS HB2 . 19870 1 980 . 1 1 99 99 HIS HB3 H 1 3.150 0.020 . 2 . . . A 99 HIS HB3 . 19870 1 981 . 1 1 99 99 HIS HD2 H 1 7.230 0.020 . 1 . . . A 99 HIS HD2 . 19870 1 982 . 1 1 99 99 HIS HE1 H 1 8.560 0.020 . 1 . . . A 99 HIS HE1 . 19870 1 983 . 1 1 99 99 HIS C C 13 175.100 0.3 . 1 . . . A 99 HIS C . 19870 1 984 . 1 1 99 99 HIS CA C 13 54.600 0.3 . 1 . . . A 99 HIS CA . 19870 1 985 . 1 1 99 99 HIS CB C 13 28.700 0.3 . 1 . . . A 99 HIS CB . 19870 1 986 . 1 1 99 99 HIS N N 15 117.924 0.3 . 1 . . . A 99 HIS N . 19870 1 987 . 1 1 100 100 VAL HA H 1 3.692 0.020 . 1 . . . A 100 VAL HA . 19870 1 988 . 1 1 100 100 VAL HB H 1 1.950 0.020 . 1 . . . A 100 VAL HB . 19870 1 989 . 1 1 100 100 VAL HG11 H 1 0.971 0.020 . 2 . . . A 100 VAL HG11 . 19870 1 990 . 1 1 100 100 VAL HG12 H 1 0.971 0.020 . 2 . . . A 100 VAL HG12 . 19870 1 991 . 1 1 100 100 VAL HG13 H 1 0.971 0.020 . 2 . . . A 100 VAL HG13 . 19870 1 992 . 1 1 100 100 VAL HG21 H 1 0.605 0.020 . 2 . . . A 100 VAL HG21 . 19870 1 993 . 1 1 100 100 VAL HG22 H 1 0.605 0.020 . 2 . . . A 100 VAL HG22 . 19870 1 994 . 1 1 100 100 VAL HG23 H 1 0.605 0.020 . 2 . . . A 100 VAL HG23 . 19870 1 995 . 1 1 100 100 VAL C C 13 173.425 0.3 . 1 . . . A 100 VAL C . 19870 1 996 . 1 1 100 100 VAL CA C 13 61.165 0.3 . 1 . . . A 100 VAL CA . 19870 1 997 . 1 1 100 100 VAL CB C 13 31.823 0.3 . 1 . . . A 100 VAL CB . 19870 1 998 . 1 1 100 100 VAL CG1 C 13 22.613 0.3 . 1 . . . A 100 VAL CG1 . 19870 1 999 . 1 1 100 100 VAL CG2 C 13 21.696 0.3 . 1 . . . A 100 VAL CG2 . 19870 1 1000 . 1 1 101 101 VAL H H 1 7.979 0.020 . 1 . . . A 101 VAL H . 19870 1 1001 . 1 1 101 101 VAL HA H 1 4.126 0.020 . 1 . . . A 101 VAL HA . 19870 1 1002 . 1 1 101 101 VAL HB H 1 1.615 0.020 . 1 . . . A 101 VAL HB . 19870 1 1003 . 1 1 101 101 VAL HG11 H 1 0.565 0.020 . 2 . . . A 101 VAL HG11 . 19870 1 1004 . 1 1 101 101 VAL HG12 H 1 0.565 0.020 . 2 . . . A 101 VAL HG12 . 19870 1 1005 . 1 1 101 101 VAL HG13 H 1 0.565 0.020 . 2 . . . A 101 VAL HG13 . 19870 1 1006 . 1 1 101 101 VAL HG21 H 1 1.203 0.020 . 2 . . . A 101 VAL HG21 . 19870 1 1007 . 1 1 101 101 VAL HG22 H 1 1.203 0.020 . 2 . . . A 101 VAL HG22 . 19870 1 1008 . 1 1 101 101 VAL HG23 H 1 1.203 0.020 . 2 . . . A 101 VAL HG23 . 19870 1 1009 . 1 1 101 101 VAL C C 13 173.800 0.3 . 1 . . . A 101 VAL C . 19870 1 1010 . 1 1 101 101 VAL CA C 13 60.128 0.3 . 1 . . . A 101 VAL CA . 19870 1 1011 . 1 1 101 101 VAL CB C 13 35.076 0.3 . 1 . . . A 101 VAL CB . 19870 1 1012 . 1 1 101 101 VAL CG1 C 13 21.500 0.3 . 1 . . . A 101 VAL CG1 . 19870 1 1013 . 1 1 101 101 VAL CG2 C 13 21.174 0.3 . 1 . . . A 101 VAL CG2 . 19870 1 1014 . 1 1 101 101 VAL N N 15 127.789 0.3 . 1 . . . A 101 VAL N . 19870 1 1015 . 1 1 102 102 PHE HA H 1 4.888 0.020 . 1 . . . A 102 PHE HA . 19870 1 1016 . 1 1 102 102 PHE HB2 H 1 3.426 0.020 . 2 . . . A 102 PHE HB2 . 19870 1 1017 . 1 1 102 102 PHE HB3 H 1 2.913 0.020 . 2 . . . A 102 PHE HB3 . 19870 1 1018 . 1 1 102 102 PHE C C 13 174.500 0.3 . 1 . . . A 102 PHE C . 19870 1 1019 . 1 1 103 103 GLY H H 1 9.104 0.020 . 1 . . . A 103 GLY H . 19870 1 1020 . 1 1 103 103 GLY HA2 H 1 4.316 0.020 . 2 . . . A 103 GLY HA2 . 19870 1 1021 . 1 1 103 103 GLY HA3 H 1 4.207 0.020 . 2 . . . A 103 GLY HA3 . 19870 1 1022 . 1 1 103 103 GLY C C 13 174.516 0.3 . 1 . . . A 103 GLY C . 19870 1 1023 . 1 1 103 103 GLY CA C 13 44.832 0.3 . 1 . . . A 103 GLY CA . 19870 1 1024 . 1 1 103 103 GLY N N 15 109.758 0.3 . 1 . . . A 103 GLY N . 19870 1 1025 . 1 1 105 105 GLY H H 1 7.023 0.020 . 1 . . . A 105 GLY H . 19870 1 1026 . 1 1 105 105 GLY HA2 H 1 3.886 0.020 . 2 . . . A 105 GLY HA2 . 19870 1 1027 . 1 1 105 105 GLY HA3 H 1 3.127 0.020 . 2 . . . A 105 GLY HA3 . 19870 1 1028 . 1 1 105 105 GLY C C 13 172.226 0.3 . 1 . . . A 105 GLY C . 19870 1 1029 . 1 1 105 105 GLY CA C 13 45.555 0.3 . 1 . . . A 105 GLY CA . 19870 1 1030 . 1 1 105 105 GLY N N 15 105.775 0.3 . 1 . . . A 105 GLY N . 19870 1 1031 . 1 1 106 106 THR H H 1 8.148 0.020 . 1 . . . A 106 THR H . 19870 1 1032 . 1 1 106 106 THR HA H 1 4.730 0.020 . 1 . . . A 106 THR HA . 19870 1 1033 . 1 1 106 106 THR HB H 1 3.645 0.020 . 1 . . . A 106 THR HB . 19870 1 1034 . 1 1 106 106 THR HG21 H 1 1.008 0.020 . 1 . . . A 106 THR HG21 . 19870 1 1035 . 1 1 106 106 THR HG22 H 1 1.008 0.020 . 1 . . . A 106 THR HG22 . 19870 1 1036 . 1 1 106 106 THR HG23 H 1 1.008 0.020 . 1 . . . A 106 THR HG23 . 19870 1 1037 . 1 1 106 106 THR C C 13 173.600 0.3 . 1 . . . A 106 THR C . 19870 1 1038 . 1 1 106 106 THR CA C 13 60.804 0.3 . 1 . . . A 106 THR CA . 19870 1 1039 . 1 1 106 106 THR CB C 13 72.945 0.3 . 1 . . . A 106 THR CB . 19870 1 1040 . 1 1 106 106 THR CG2 C 13 22.553 0.3 . 1 . . . A 106 THR CG2 . 19870 1 1041 . 1 1 106 106 THR N N 15 119.104 0.3 . 1 . . . A 106 THR N . 19870 1 1042 . 1 1 107 107 LYS H H 1 8.236 0.020 . 1 . . . A 107 LYS H . 19870 1 1043 . 1 1 107 107 LYS HA H 1 4.779 0.020 . 1 . . . A 107 LYS HA . 19870 1 1044 . 1 1 107 107 LYS HB2 H 1 1.773 0.020 . 2 . . . A 107 LYS HB2 . 19870 1 1045 . 1 1 107 107 LYS HB3 H 1 1.743 0.020 . 2 . . . A 107 LYS HB3 . 19870 1 1046 . 1 1 107 107 LYS HG2 H 1 1.320 0.020 . 2 . . . A 107 LYS HG2 . 19870 1 1047 . 1 1 107 107 LYS HG3 H 1 1.290 0.020 . 2 . . . A 107 LYS HG3 . 19870 1 1048 . 1 1 107 107 LYS HD2 H 1 1.690 0.020 . 2 . . . A 107 LYS HD2 . 19870 1 1049 . 1 1 107 107 LYS HD3 H 1 1.660 0.020 . 2 . . . A 107 LYS HD3 . 19870 1 1050 . 1 1 107 107 LYS HE2 H 1 2.970 0.020 . 1 . . . A 107 LYS HE2 . 19870 1 1051 . 1 1 107 107 LYS HE3 H 1 2.970 0.020 . 1 . . . A 107 LYS HE3 . 19870 1 1052 . 1 1 107 107 LYS C C 13 174.777 0.3 . 1 . . . A 107 LYS C . 19870 1 1053 . 1 1 107 107 LYS CA C 13 55.962 0.3 . 1 . . . A 107 LYS CA . 19870 1 1054 . 1 1 107 107 LYS CB C 13 32.200 0.3 . 1 . . . A 107 LYS CB . 19870 1 1055 . 1 1 107 107 LYS CG C 13 24.100 0.3 . 1 . . . A 107 LYS CG . 19870 1 1056 . 1 1 107 107 LYS CD C 13 28.400 0.3 . 1 . . . A 107 LYS CD . 19870 1 1057 . 1 1 107 107 LYS CE C 13 41.800 0.3 . 1 . . . A 107 LYS CE . 19870 1 1058 . 1 1 107 107 LYS N N 15 128.712 0.3 . 1 . . . A 107 LYS N . 19870 1 1059 . 1 1 108 108 LEU H H 1 8.894 0.020 . 1 . . . A 108 LEU H . 19870 1 1060 . 1 1 108 108 LEU HA H 1 5.372 0.020 . 1 . . . A 108 LEU HA . 19870 1 1061 . 1 1 108 108 LEU HB2 H 1 2.446 0.020 . 2 . . . A 108 LEU HB2 . 19870 1 1062 . 1 1 108 108 LEU HB3 H 1 1.256 0.020 . 2 . . . A 108 LEU HB3 . 19870 1 1063 . 1 1 108 108 LEU HG H 1 1.410 0.020 . 1 . . . A 108 LEU HG . 19870 1 1064 . 1 1 108 108 LEU HD11 H 1 0.760 0.020 . 2 . . . A 108 LEU HD11 . 19870 1 1065 . 1 1 108 108 LEU HD12 H 1 0.760 0.020 . 2 . . . A 108 LEU HD12 . 19870 1 1066 . 1 1 108 108 LEU HD13 H 1 0.760 0.020 . 2 . . . A 108 LEU HD13 . 19870 1 1067 . 1 1 108 108 LEU HD21 H 1 0.729 0.020 . 2 . . . A 108 LEU HD21 . 19870 1 1068 . 1 1 108 108 LEU HD22 H 1 0.729 0.020 . 2 . . . A 108 LEU HD22 . 19870 1 1069 . 1 1 108 108 LEU HD23 H 1 0.729 0.020 . 2 . . . A 108 LEU HD23 . 19870 1 1070 . 1 1 108 108 LEU C C 13 175.301 0.3 . 1 . . . A 108 LEU C . 19870 1 1071 . 1 1 108 108 LEU CA C 13 54.100 0.3 . 1 . . . A 108 LEU CA . 19870 1 1072 . 1 1 108 108 LEU CB C 13 44.300 0.3 . 1 . . . A 108 LEU CB . 19870 1 1073 . 1 1 108 108 LEU CG C 13 28.500 0.3 . 1 . . . A 108 LEU CG . 19870 1 1074 . 1 1 108 108 LEU CD1 C 13 26.200 0.3 . 1 . . . A 108 LEU CD1 . 19870 1 1075 . 1 1 108 108 LEU CD2 C 13 25.400 0.3 . 1 . . . A 108 LEU CD2 . 19870 1 1076 . 1 1 108 108 LEU N N 15 133.744 0.3 . 1 . . . A 108 LEU N . 19870 1 1077 . 1 1 109 109 THR H H 1 8.634 0.020 . 1 . . . A 109 THR H . 19870 1 1078 . 1 1 109 109 THR HA H 1 4.527 0.020 . 1 . . . A 109 THR HA . 19870 1 1079 . 1 1 109 109 THR HB H 1 3.969 0.020 . 1 . . . A 109 THR HB . 19870 1 1080 . 1 1 109 109 THR HG21 H 1 1.125 0.020 . 1 . . . A 109 THR HG21 . 19870 1 1081 . 1 1 109 109 THR HG22 H 1 1.125 0.020 . 1 . . . A 109 THR HG22 . 19870 1 1082 . 1 1 109 109 THR HG23 H 1 1.125 0.020 . 1 . . . A 109 THR HG23 . 19870 1 1083 . 1 1 109 109 THR C C 13 172.500 0.3 . 1 . . . A 109 THR C . 19870 1 1084 . 1 1 109 109 THR CA C 13 61.021 0.3 . 1 . . . A 109 THR CA . 19870 1 1085 . 1 1 109 109 THR CB C 13 70.705 0.3 . 1 . . . A 109 THR CB . 19870 1 1086 . 1 1 109 109 THR CG2 C 13 21.538 0.3 . 1 . . . A 109 THR CG2 . 19870 1 1087 . 1 1 109 109 THR N N 15 122.592 0.3 . 1 . . . A 109 THR N . 19870 1 1088 . 1 1 110 110 VAL H H 1 8.831 0.020 . 1 . . . A 110 VAL H . 19870 1 1089 . 1 1 110 110 VAL HA H 1 4.846 0.020 . 1 . . . A 110 VAL HA . 19870 1 1090 . 1 1 110 110 VAL HB H 1 2.010 0.020 . 1 . . . A 110 VAL HB . 19870 1 1091 . 1 1 110 110 VAL HG11 H 1 0.768 0.020 . 2 . . . A 110 VAL HG11 . 19870 1 1092 . 1 1 110 110 VAL HG12 H 1 0.768 0.020 . 2 . . . A 110 VAL HG12 . 19870 1 1093 . 1 1 110 110 VAL HG13 H 1 0.768 0.020 . 2 . . . A 110 VAL HG13 . 19870 1 1094 . 1 1 110 110 VAL HG21 H 1 0.820 0.020 . 2 . . . A 110 VAL HG21 . 19870 1 1095 . 1 1 110 110 VAL HG22 H 1 0.820 0.020 . 2 . . . A 110 VAL HG22 . 19870 1 1096 . 1 1 110 110 VAL HG23 H 1 0.820 0.020 . 2 . . . A 110 VAL HG23 . 19870 1 1097 . 1 1 110 110 VAL C C 13 175.487 0.3 . 1 . . . A 110 VAL C . 19870 1 1098 . 1 1 110 110 VAL CA C 13 60.731 0.3 . 1 . . . A 110 VAL CA . 19870 1 1099 . 1 1 110 110 VAL CB C 13 31.824 0.3 . 1 . . . A 110 VAL CB . 19870 1 1100 . 1 1 110 110 VAL CG1 C 13 21.200 0.3 . 1 . . . A 110 VAL CG1 . 19870 1 1101 . 1 1 110 110 VAL CG2 C 13 21.000 0.3 . 1 . . . A 110 VAL CG2 . 19870 1 1102 . 1 1 110 110 VAL N N 15 126.117 0.3 . 1 . . . A 110 VAL N . 19870 1 1103 . 1 1 111 111 LEU H H 1 8.120 0.020 . 1 . . . A 111 LEU H . 19870 1 1104 . 1 1 111 111 LEU HA H 1 4.022 0.020 . 1 . . . A 111 LEU HA . 19870 1 1105 . 1 1 111 111 LEU HB2 H 1 1.510 0.020 . 2 . . . A 111 LEU HB2 . 19870 1 1106 . 1 1 111 111 LEU HB3 H 1 1.380 0.020 . 2 . . . A 111 LEU HB3 . 19870 1 1107 . 1 1 111 111 LEU HG H 1 1.328 0.020 . 1 . . . A 111 LEU HG . 19870 1 1108 . 1 1 111 111 LEU HD11 H 1 0.769 0.020 . 2 . . . A 111 LEU HD11 . 19870 1 1109 . 1 1 111 111 LEU HD12 H 1 0.769 0.020 . 2 . . . A 111 LEU HD12 . 19870 1 1110 . 1 1 111 111 LEU HD13 H 1 0.769 0.020 . 2 . . . A 111 LEU HD13 . 19870 1 1111 . 1 1 111 111 LEU HD21 H 1 0.776 0.020 . 2 . . . A 111 LEU HD21 . 19870 1 1112 . 1 1 111 111 LEU HD22 H 1 0.776 0.020 . 2 . . . A 111 LEU HD22 . 19870 1 1113 . 1 1 111 111 LEU HD23 H 1 0.776 0.020 . 2 . . . A 111 LEU HD23 . 19870 1 1114 . 1 1 111 111 LEU C C 13 181.400 0.3 . 1 . . . A 111 LEU C . 19870 1 1115 . 1 1 111 111 LEU CA C 13 56.900 0.3 . 1 . . . A 111 LEU CA . 19870 1 1116 . 1 1 111 111 LEU CB C 13 43.900 0.3 . 1 . . . A 111 LEU CB . 19870 1 1117 . 1 1 111 111 LEU CG C 13 27.300 0.3 . 1 . . . A 111 LEU CG . 19870 1 1118 . 1 1 111 111 LEU CD1 C 13 24.697 0.3 . 1 . . . A 111 LEU CD1 . 19870 1 1119 . 1 1 111 111 LEU CD2 C 13 22.900 0.3 . 1 . . . A 111 LEU CD2 . 19870 1 1120 . 1 1 111 111 LEU N N 15 134.126 0.3 . 1 . . . A 111 LEU N . 19870 1 stop_ save_