################################### # 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 18848 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method 'approximated from digital resolution' _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' . . . 18848 1 2 '3D CBCA(CO)NH' . . . 18848 1 3 '3D HNCO' . . . 18848 1 4 '3D HNCA' . . . 18848 1 5 '3D CBCANH' . . . 18848 1 6 '3D HBHA(CO)NH' . . . 18848 1 9 '3D HN(CA)CO' . . . 18848 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 SER C C 13 174.335 0.2 . 1 . . . . 1 SER C . 18848 1 2 . 1 1 1 1 SER CA C 13 58.437 0.2 . 1 . . . . 1 SER CA . 18848 1 3 . 1 1 1 1 SER CB C 13 63.951 0.2 . 1 . . . . 1 SER CB . 18848 1 4 . 1 1 2 2 ALA H H 1 8.714 0.02 . 1 . . . . 2 ALA H . 18848 1 5 . 1 1 2 2 ALA HA H 1 4.349 0.02 . 1 . . . . 2 ALA HA . 18848 1 6 . 1 1 2 2 ALA HB1 H 1 1.356 0.02 . 1 . . . . 2 ALA HB1 . 18848 1 7 . 1 1 2 2 ALA HB2 H 1 1.356 0.02 . 1 . . . . 2 ALA HB2 . 18848 1 8 . 1 1 2 2 ALA HB3 H 1 1.356 0.02 . 1 . . . . 2 ALA HB3 . 18848 1 9 . 1 1 2 2 ALA C C 13 177.595 0.2 . 1 . . . . 2 ALA C . 18848 1 10 . 1 1 2 2 ALA CA C 13 52.721 0.2 . 1 . . . . 2 ALA CA . 18848 1 11 . 1 1 2 2 ALA CB C 13 19.552 0.2 . 1 . . . . 2 ALA CB . 18848 1 12 . 1 1 2 2 ALA N N 15 126.313 0.2 . 1 . . . . 2 ALA N . 18848 1 13 . 1 1 3 3 SER H H 1 8.289 0.02 . 1 . . . . 3 SER H . 18848 1 14 . 1 1 3 3 SER HA H 1 4.421 0.02 . 1 . . . . 3 SER HA . 18848 1 15 . 1 1 3 3 SER HB2 H 1 3.918 0.02 . 2 . . . . 3 SER HB2 . 18848 1 16 . 1 1 3 3 SER HB3 H 1 3.838 0.02 . 2 . . . . 3 SER HB3 . 18848 1 17 . 1 1 3 3 SER C C 13 174.439 0.2 . 1 . . . . 3 SER C . 18848 1 18 . 1 1 3 3 SER CA C 13 58.258 0.2 . 1 . . . . 3 SER CA . 18848 1 19 . 1 1 3 3 SER CB C 13 64.136 0.2 . 1 . . . . 3 SER CB . 18848 1 20 . 1 1 3 3 SER N N 15 115.539 0.2 . 1 . . . . 3 SER N . 18848 1 21 . 1 1 4 4 PHE H H 1 8.285 0.02 . 1 . . . . 4 PHE H . 18848 1 22 . 1 1 4 4 PHE HA H 1 4.537 0.02 . 1 . . . . 4 PHE HA . 18848 1 23 . 1 1 4 4 PHE HB2 H 1 3.087 0.02 . 2 . . . . 4 PHE HB2 . 18848 1 24 . 1 1 4 4 PHE HB3 H 1 3.089 0.02 . 2 . . . . 4 PHE HB3 . 18848 1 25 . 1 1 4 4 PHE C C 13 176.066 0.2 . 1 . . . . 4 PHE C . 18848 1 26 . 1 1 4 4 PHE CA C 13 58.764 0.2 . 1 . . . . 4 PHE CA . 18848 1 27 . 1 1 4 4 PHE CB C 13 39.488 0.2 . 1 . . . . 4 PHE CB . 18848 1 28 . 1 1 4 4 PHE N N 15 122.287 0.2 . 1 . . . . 4 PHE N . 18848 1 29 . 1 1 5 5 GLU H H 1 8.397 0.02 . 1 . . . . 5 GLU H . 18848 1 30 . 1 1 5 5 GLU HA H 1 4.193 0.02 . 1 . . . . 5 GLU HA . 18848 1 31 . 1 1 5 5 GLU HB2 H 1 1.988 0.02 . 1 . . . . 5 GLU HB2 . 18848 1 32 . 1 1 5 5 GLU HB3 H 1 1.988 0.02 . 1 . . . . 5 GLU HB3 . 18848 1 33 . 1 1 5 5 GLU C C 13 176.763 0.2 . 1 . . . . 5 GLU C . 18848 1 34 . 1 1 5 5 GLU CA C 13 57.417 0.2 . 1 . . . . 5 GLU CA . 18848 1 35 . 1 1 5 5 GLU CB C 13 30.246 0.2 . 1 . . . . 5 GLU CB . 18848 1 36 . 1 1 5 5 GLU N N 15 121.795 0.2 . 1 . . . . 5 GLU N . 18848 1 37 . 1 1 6 6 GLU H H 1 8.230 0.02 . 1 . . . . 6 GLU H . 18848 1 38 . 1 1 6 6 GLU HA H 1 4.241 0.02 . 1 . . . . 6 GLU HA . 18848 1 39 . 1 1 6 6 GLU HB2 H 1 2.046 0.02 . 1 . . . . 6 GLU HB2 . 18848 1 40 . 1 1 6 6 GLU HB3 H 1 2.046 0.02 . 1 . . . . 6 GLU HB3 . 18848 1 41 . 1 1 6 6 GLU C C 13 176.884 0.2 . 1 . . . . 6 GLU C . 18848 1 42 . 1 1 6 6 GLU CA C 13 57.134 0.2 . 1 . . . . 6 GLU CA . 18848 1 43 . 1 1 6 6 GLU CB C 13 30.206 0.2 . 1 . . . . 6 GLU CB . 18848 1 44 . 1 1 6 6 GLU N N 15 121.987 0.2 . 1 . . . . 6 GLU N . 18848 1 45 . 1 1 7 7 LEU H H 1 8.222 0.02 . 1 . . . . 7 LEU H . 18848 1 46 . 1 1 7 7 LEU HA H 1 4.327 0.02 . 1 . . . . 7 LEU HA . 18848 1 47 . 1 1 7 7 LEU HB2 H 1 1.692 0.02 . 2 . . . . 7 LEU HB2 . 18848 1 48 . 1 1 7 7 LEU HB3 H 1 1.563 0.02 . 2 . . . . 7 LEU HB3 . 18848 1 49 . 1 1 7 7 LEU C C 13 177.757 0.2 . 1 . . . . 7 LEU C . 18848 1 50 . 1 1 7 7 LEU CA C 13 55.421 0.2 . 1 . . . . 7 LEU CA . 18848 1 51 . 1 1 7 7 LEU CB C 13 42.437 0.2 . 1 . . . . 7 LEU CB . 18848 1 52 . 1 1 7 7 LEU N N 15 123.313 0.2 . 1 . . . . 7 LEU N . 18848 1 53 . 1 1 8 8 GLN H H 1 8.337 0.02 . 1 . . . . 8 GLN H . 18848 1 54 . 1 1 8 8 GLN HA H 1 4.264 0.02 . 1 . . . . 8 GLN HA . 18848 1 55 . 1 1 8 8 GLN HB2 H 1 1.985 0.02 . 2 . . . . 8 GLN HB2 . 18848 1 56 . 1 1 8 8 GLN HB3 H 1 2.117 0.02 . 2 . . . . 8 GLN HB3 . 18848 1 57 . 1 1 8 8 GLN C C 13 176.154 0.2 . 1 . . . . 8 GLN C . 18848 1 58 . 1 1 8 8 GLN CA C 13 56.114 0.2 . 1 . . . . 8 GLN CA . 18848 1 59 . 1 1 8 8 GLN CB C 13 29.436 0.2 . 1 . . . . 8 GLN CB . 18848 1 60 . 1 1 8 8 GLN N N 15 121.202 0.2 . 1 . . . . 8 GLN N . 18848 1 61 . 1 1 9 9 ALA H H 1 8.229 0.02 . 1 . . . . 9 ALA H . 18848 1 62 . 1 1 9 9 ALA HA H 1 4.265 0.02 . 1 . . . . 9 ALA HA . 18848 1 63 . 1 1 9 9 ALA HB1 H 1 1.425 0.02 . 1 . . . . 9 ALA HB1 . 18848 1 64 . 1 1 9 9 ALA HB2 H 1 1.425 0.02 . 1 . . . . 9 ALA HB2 . 18848 1 65 . 1 1 9 9 ALA HB3 H 1 1.425 0.02 . 1 . . . . 9 ALA HB3 . 18848 1 66 . 1 1 9 9 ALA C C 13 178.196 0.2 . 1 . . . . 9 ALA C . 18848 1 67 . 1 1 9 9 ALA CA C 13 53.295 0.2 . 1 . . . . 9 ALA CA . 18848 1 68 . 1 1 9 9 ALA CB C 13 19.242 0.2 . 1 . . . . 9 ALA CB . 18848 1 69 . 1 1 9 9 ALA N N 15 125.008 0.2 . 1 . . . . 9 ALA N . 18848 1 70 . 1 1 10 10 GLU H H 1 8.408 0.02 . 1 . . . . 10 GLU H . 18848 1 71 . 1 1 10 10 GLU HA H 1 4.266 0.02 . 1 . . . . 10 GLU HA . 18848 1 72 . 1 1 10 10 GLU HB2 H 1 2.004 0.02 . 2 . . . . 10 GLU HB2 . 18848 1 73 . 1 1 10 10 GLU HB3 H 1 2.093 0.02 . 2 . . . . 10 GLU HB3 . 18848 1 74 . 1 1 10 10 GLU C C 13 176.783 0.2 . 1 . . . . 10 GLU C . 18848 1 75 . 1 1 10 10 GLU CA C 13 57.144 0.2 . 1 . . . . 10 GLU CA . 18848 1 76 . 1 1 10 10 GLU CB C 13 30.219 0.2 . 1 . . . . 10 GLU CB . 18848 1 77 . 1 1 10 10 GLU N N 15 119.867 0.2 . 1 . . . . 10 GLU N . 18848 1 78 . 1 1 11 11 GLU H H 1 8.252 0.02 . 1 . . . . 11 GLU H . 18848 1 79 . 1 1 11 11 GLU HA H 1 4.228 0.02 . 1 . . . . 11 GLU HA . 18848 1 80 . 1 1 11 11 GLU HB2 H 1 1.931 0.02 . 2 . . . . 11 GLU HB2 . 18848 1 81 . 1 1 11 11 GLU HB3 H 1 2.021 0.02 . 2 . . . . 11 GLU HB3 . 18848 1 82 . 1 1 11 11 GLU C C 13 176.071 0.2 . 1 . . . . 11 GLU C . 18848 1 83 . 1 1 11 11 GLU N N 15 121.339 0.2 . 1 . . . . 11 GLU N . 18848 1 84 . 1 1 12 12 CYS H H 1 8.198 0.02 . 1 . . . . 12 CYS H . 18848 1 85 . 1 1 12 12 CYS HA H 1 4.164 0.02 . 1 . . . . 12 CYS HA . 18848 1 86 . 1 1 12 12 CYS HB3 H 1 2.987 0.02 . 1 . . . . 12 CYS HB3 . 18848 1 87 . 1 1 12 12 CYS N N 15 119.003 0.2 . 1 . . . . 12 CYS N . 18848 1 88 . 1 1 13 13 GLY HA2 H 1 3.787 0.02 . 2 . . . . 13 GLY HA2 . 18848 1 89 . 1 1 13 13 GLY HA3 H 1 3.492 0.02 . 2 . . . . 13 GLY HA3 . 18848 1 90 . 1 1 13 13 GLY C C 13 173.998 0.2 . 1 . . . . 11 GLU N . 18848 1 91 . 1 1 13 13 GLY CA C 13 46.310 0.2 . 1 . . . . 11 GLU N . 18848 1 92 . 1 1 14 14 ILE H H 1 7.438 0.02 . 1 . . . . 14 ILE H . 18848 1 93 . 1 1 14 14 ILE HA H 1 4.108 0.02 . 1 . . . . 14 ILE HA . 18848 1 94 . 1 1 14 14 ILE HB H 1 1.768 0.02 . 1 . . . . 14 ILE HB . 18848 1 95 . 1 1 14 14 ILE C C 13 176.467 0.2 . 1 . . . . 11 GLU N . 18848 1 96 . 1 1 14 14 ILE CA C 13 61.317 0.2 . 1 . . . . 14 ILE CA . 18848 1 97 . 1 1 14 14 ILE CB C 13 38.764 0.2 . 1 . . . . 14 ILE CB . 18848 1 98 . 1 1 14 14 ILE N N 15 120.774 0.2 . 1 . . . . 14 ILE N . 18848 1 99 . 1 1 15 15 LEU H H 1 8.210 0.02 . 1 . . . . 15 LEU H . 18848 1 100 . 1 1 15 15 LEU HA H 1 4.189 0.02 . 1 . . . . 15 LEU HA . 18848 1 101 . 1 1 15 15 LEU HB3 H 1 1.619 0.02 . 1 . . . . 15 LEU HB3 . 18848 1 102 . 1 1 15 15 LEU C C 13 177.293 0.2 . 1 . . . . 15 LEU C . 18848 1 103 . 1 1 15 15 LEU CA C 13 56.334 0.2 . 1 . . . . 15 LEU CA . 18848 1 104 . 1 1 15 15 LEU N N 15 126.441 0.2 . 1 . . . . 15 LEU N . 18848 1 105 . 1 1 16 16 ASN H H 1 8.378 0.02 . 1 . . . . 16 ASN H . 18848 1 106 . 1 1 16 16 ASN HA H 1 4.553 0.02 . 1 . . . . 16 ASN HA . 18848 1 107 . 1 1 16 16 ASN HB2 H 1 2.855 0.02 . 2 . . . . 16 ASN HB2 . 18848 1 108 . 1 1 16 16 ASN HB3 H 1 2.752 0.02 . 2 . . . . 16 ASN HB3 . 18848 1 109 . 1 1 16 16 ASN C C 13 175.315 0.2 . 1 . . . . 16 ASN C . 18848 1 110 . 1 1 16 16 ASN CA C 13 53.924 0.2 . 1 . . . . 16 ASN CA . 18848 1 111 . 1 1 16 16 ASN CB C 13 38.598 0.2 . 1 . . . . 16 ASN CB . 18848 1 112 . 1 1 16 16 ASN N N 15 117.954 0.2 . 1 . . . . 16 ASN N . 18848 1 113 . 1 1 17 17 GLY H H 1 7.970 0.02 . 1 . . . . 17 GLY H . 18848 1 114 . 1 1 17 17 GLY HA2 H 1 3.913 0.02 . 1 . . . . 17 GLY HA2 . 18848 1 115 . 1 1 17 17 GLY HA3 H 1 3.913 0.02 . 1 . . . . 17 GLY HA3 . 18848 1 116 . 1 1 17 17 GLY C C 13 173.439 0.2 . 1 . . . . 17 GLY C . 18848 1 117 . 1 1 17 17 GLY CA C 13 45.603 0.2 . 1 . . . . 17 GLY CA . 18848 1 118 . 1 1 17 17 GLY N N 15 107.458 0.2 . 1 . . . . 17 GLY N . 18848 1 119 . 1 1 18 18 CYS H H 1 8.488 0.02 . 1 . . . . 18 CYS H . 18848 1 120 . 1 1 18 18 CYS HA H 1 4.358 0.02 . 1 . . . . 18 CYS HA . 18848 1 121 . 1 1 18 18 CYS HB2 H 1 2.632 0.02 . 2 . . . . 18 CYS HB2 . 18848 1 122 . 1 1 18 18 CYS HB3 H 1 2.463 0.02 . 2 . . . . 18 CYS HB3 . 18848 1 123 . 1 1 18 18 CYS C C 13 173.860 0.2 . 1 . . . . 18 CYS C . 18848 1 124 . 1 1 18 18 CYS CA C 13 55.040 0.2 . 1 . . . . 18 CYS CA . 18848 1 125 . 1 1 18 18 CYS N N 15 115.970 0.2 . 1 . . . . 18 CYS N . 18848 1 126 . 1 1 19 19 GLU HA H 1 4.016 0.02 . 1 . . . . 19 GLU HA . 18848 1 127 . 1 1 19 19 GLU HB2 H 1 1.898 0.02 . 1 . . . . 19 GLU HB2 . 18848 1 128 . 1 1 19 19 GLU C C 13 176.181 0.2 . 1 . . . . 19 GLU C . 18848 1 129 . 1 1 19 19 GLU CA C 13 57.573 0.2 . 1 . . . . 19 GLU CA . 18848 1 130 . 1 1 20 20 ASN H H 1 8.653 0.02 . 1 . . . . 20 ASN H . 18848 1 131 . 1 1 20 20 ASN HA H 1 3.823 0.02 . 1 . . . . 20 ASN HA . 18848 1 132 . 1 1 20 20 ASN HB2 H 1 1.143 0.02 . 2 . . . . 20 ASN HB2 . 18848 1 133 . 1 1 20 20 ASN HB3 H 1 2.179 0.02 . 2 . . . . 20 ASN HB3 . 18848 1 134 . 1 1 20 20 ASN C C 13 172.208 0.2 . 1 . . . . 20 ASN C . 18848 1 135 . 1 1 20 20 ASN CA C 13 54.352 0.2 . 1 . . . . 20 ASN CA . 18848 1 136 . 1 1 20 20 ASN CB C 13 36.574 0.2 . 1 . . . . 20 ASN CB . 18848 1 137 . 1 1 20 20 ASN N N 15 117.413 0.2 . 1 . . . . 20 ASN N . 18848 1 138 . 1 1 21 21 GLY H H 1 6.840 0.02 . 1 . . . . 21 GLY H . 18848 1 139 . 1 1 21 21 GLY HA2 H 1 3.325 0.02 . 2 . . . . 21 GLY HA2 . 18848 1 140 . 1 1 21 21 GLY HA3 H 1 2.891 0.02 . 2 . . . . 21 GLY HA3 . 18848 1 141 . 1 1 21 21 GLY C C 13 170.550 0.2 . 1 . . . . 21 GLY C . 18848 1 142 . 1 1 21 21 GLY CA C 13 45.751 0.2 . 1 . . . . 21 GLY CA . 18848 1 143 . 1 1 21 21 GLY N N 15 104.570 0.2 . 1 . . . . 21 GLY N . 18848 1 144 . 1 1 22 22 ARG H H 1 7.924 0.02 . 1 . . . . 22 ARG H . 18848 1 145 . 1 1 22 22 ARG HA H 1 4.678 0.02 . 1 . . . . 22 ARG HA . 18848 1 146 . 1 1 22 22 ARG HB2 H 1 1.754 0.02 . 2 . . . . 22 ARG HB2 . 18848 1 147 . 1 1 22 22 ARG HB3 H 1 1.810 0.02 . 2 . . . . 22 ARG HB3 . 18848 1 148 . 1 1 22 22 ARG C C 13 174.707 0.2 . 1 . . . . 22 ARG C . 18848 1 149 . 1 1 22 22 ARG CA C 13 53.802 0.2 . 1 . . . . 22 ARG CA . 18848 1 150 . 1 1 22 22 ARG CB C 13 33.505 0.2 . 1 . . . . 22 ARG CB . 18848 1 151 . 1 1 22 22 ARG N N 15 118.018 0.2 . 1 . . . . 22 ARG N . 18848 1 152 . 1 1 23 23 CYS H H 1 9.058 0.02 . 1 . . . . 23 CYS H . 18848 1 153 . 1 1 23 23 CYS HA H 1 5.121 0.02 . 1 . . . . 23 CYS HA . 18848 1 154 . 1 1 23 23 CYS HB2 H 1 3.354 0.02 . 2 . . . . 23 CYS HB2 . 18848 1 155 . 1 1 23 23 CYS HB3 H 1 2.889 0.02 . 2 . . . . 23 CYS HB3 . 18848 1 156 . 1 1 23 23 CYS C C 13 173.957 0.2 . 1 . . . . 23 CYS C . 18848 1 157 . 1 1 23 23 CYS CA C 13 56.366 0.2 . 1 . . . . 23 CYS CA . 18848 1 158 . 1 1 23 23 CYS CB C 13 42.754 0.2 . 1 . . . . 23 CYS CB . 18848 1 159 . 1 1 23 23 CYS N N 15 125.912 0.2 . 1 . . . . 23 CYS N . 18848 1 160 . 1 1 24 24 VAL H H 1 8.950 0.02 . 1 . . . . 24 VAL H . 18848 1 161 . 1 1 24 24 VAL HA H 1 4.599 0.02 . 1 . . . . 24 VAL HA . 18848 1 162 . 1 1 24 24 VAL HB H 1 1.946 0.02 . 1 . . . . 24 VAL HB . 18848 1 163 . 1 1 24 24 VAL C C 13 174.094 0.2 . 1 . . . . 24 VAL C . 18848 1 164 . 1 1 24 24 VAL CA C 13 60.563 0.2 . 1 . . . . 24 VAL CA . 18848 1 165 . 1 1 24 24 VAL CB C 13 35.710 0.2 . 1 . . . . 24 VAL CB . 18848 1 166 . 1 1 24 24 VAL N N 15 125.920 0.2 . 1 . . . . 24 VAL N . 18848 1 167 . 1 1 25 25 ARG H H 1 8.637 0.02 . 1 . . . . 25 ARG H . 18848 1 168 . 1 1 25 25 ARG HA H 1 4.286 0.02 . 1 . . . . 25 ARG HA . 18848 1 169 . 1 1 25 25 ARG HB2 H 1 1.523 0.02 . 1 . . . . 25 ARG HB2 . 18848 1 170 . 1 1 25 25 ARG C C 13 176.181 0.2 . 1 . . . . 25 ARG C . 18848 1 171 . 1 1 25 25 ARG CA C 13 56.032 0.2 . 1 . . . . 25 ARG CA . 18848 1 172 . 1 1 25 25 ARG N N 15 125.608 0.2 . 1 . . . . 25 ARG N . 18848 1 173 . 1 1 26 26 VAL H H 1 8.211 0.02 . 1 . . . . 26 VAL H . 18848 1 174 . 1 1 26 26 VAL HA H 1 4.429 0.02 . 1 . . . . 26 VAL HA . 18848 1 175 . 1 1 26 26 VAL HB H 1 2.193 0.02 . 1 . . . . 26 VAL HB . 18848 1 176 . 1 1 26 26 VAL C C 13 175.929 0.2 . 1 . . . . 26 VAL C . 18848 1 177 . 1 1 26 26 VAL CA C 13 60.239 0.2 . 1 . . . . 26 VAL CA . 18848 1 178 . 1 1 26 26 VAL CB C 13 33.985 0.2 . 1 . . . . 26 VAL CB . 18848 1 179 . 1 1 26 26 VAL N N 15 122.471 0.2 . 1 . . . . 26 VAL N . 18848 1 180 . 1 1 27 27 GLN H H 1 8.717 0.02 . 1 . . . . 27 GLN H . 18848 1 181 . 1 1 27 27 GLN HA H 1 3.847 0.02 . 1 . . . . 27 GLN HA . 18848 1 182 . 1 1 27 27 GLN HB2 H 1 2.172 0.02 . 2 . . . . 27 GLN HB2 . 18848 1 183 . 1 1 27 27 GLN HB3 H 1 2.072 0.02 . 2 . . . . 27 GLN HB3 . 18848 1 184 . 1 1 27 27 GLN C C 13 177.052 0.2 . 1 . . . . 27 GLN C . 18848 1 185 . 1 1 27 27 GLN CA C 13 59.481 0.2 . 1 . . . . 27 GLN CA . 18848 1 186 . 1 1 27 27 GLN CB C 13 27.696 0.2 . 1 . . . . 27 GLN CB . 18848 1 187 . 1 1 27 27 GLN N N 15 123.006 0.2 . 1 . . . . 27 GLN N . 18848 1 188 . 1 1 28 28 GLU H H 1 8.525 0.02 . 1 . . . . 28 GLU H . 18848 1 189 . 1 1 28 28 GLU HA H 1 4.317 0.02 . 1 . . . . 28 GLU HA . 18848 1 190 . 1 1 28 28 GLU HB2 H 1 2.185 0.02 . 2 . . . . 28 GLU HB2 . 18848 1 191 . 1 1 28 28 GLU HB3 H 1 1.954 0.02 . 2 . . . . 28 GLU HB3 . 18848 1 192 . 1 1 28 28 GLU C C 13 175.755 0.2 . 1 . . . . 28 GLU C . 18848 1 193 . 1 1 28 28 GLU CA C 13 56.813 0.2 . 1 . . . . 28 GLU CA . 18848 1 194 . 1 1 28 28 GLU CB C 13 29.270 0.2 . 1 . . . . 28 GLU CB . 18848 1 195 . 1 1 28 28 GLU N N 15 117.421 0.2 . 1 . . . . 28 GLU N . 18848 1 196 . 1 1 29 29 GLY H H 1 7.621 0.02 . 1 . . . . 29 GLY H . 18848 1 197 . 1 1 29 29 GLY HA2 H 1 3.871 0.02 . 2 . . . . 29 GLY HA2 . 18848 1 198 . 1 1 29 29 GLY HA3 H 1 4.169 0.02 . 2 . . . . 29 GLY HA3 . 18848 1 199 . 1 1 29 29 GLY C C 13 171.805 0.2 . 1 . . . . 29 GLY C . 18848 1 200 . 1 1 29 29 GLY CA C 13 45.273 0.2 . 1 . . . . 29 GLY CA . 18848 1 201 . 1 1 29 29 GLY N N 15 109.639 0.2 . 1 . . . . 29 GLY N . 18848 1 202 . 1 1 30 30 TYR H H 1 8.411 0.02 . 1 . . . . 30 TYR H . 18848 1 203 . 1 1 30 30 TYR HA H 1 5.375 0.02 . 1 . . . . 30 TYR HA . 18848 1 204 . 1 1 30 30 TYR HB2 H 1 2.984 0.02 . 2 . . . . 30 TYR HB2 . 18848 1 205 . 1 1 30 30 TYR HB3 H 1 2.741 0.02 . 2 . . . . 30 TYR HB3 . 18848 1 206 . 1 1 30 30 TYR C C 13 174.829 0.2 . 1 . . . . 30 TYR C . 18848 1 207 . 1 1 30 30 TYR CA C 13 57.392 0.2 . 1 . . . . 30 TYR CA . 18848 1 208 . 1 1 30 30 TYR CB C 13 42.048 0.2 . 1 . . . . 30 TYR CB . 18848 1 209 . 1 1 30 30 TYR N N 15 120.842 0.2 . 1 . . . . 30 TYR N . 18848 1 210 . 1 1 31 31 THR H H 1 9.126 0.02 . 1 . . . . 31 THR H . 18848 1 211 . 1 1 31 31 THR HA H 1 4.605 0.02 . 1 . . . . 31 THR HA . 18848 1 212 . 1 1 31 31 THR HB H 1 3.960 0.02 . 1 . . . . 31 THR HB . 18848 1 213 . 1 1 31 31 THR HG21 H 1 0.784 0.02 . 1 . . . . 31 THR HG21 . 18848 1 214 . 1 1 31 31 THR HG22 H 1 0.784 0.02 . 1 . . . . 31 THR HG22 . 18848 1 215 . 1 1 31 31 THR HG23 H 1 0.784 0.02 . 1 . . . . 31 THR HG23 . 18848 1 216 . 1 1 31 31 THR C C 13 172.146 0.2 . 1 . . . . 31 THR C . 18848 1 217 . 1 1 31 31 THR CA C 13 59.571 0.2 . 1 . . . . 31 THR CA . 18848 1 218 . 1 1 31 31 THR CB C 13 69.874 0.2 . 1 . . . . 31 THR CB . 18848 1 219 . 1 1 31 31 THR N N 15 116.268 0.2 . 1 . . . . 31 THR N . 18848 1 220 . 1 1 32 32 CYS H H 1 7.728 0.02 . 1 . . . . 32 CYS H . 18848 1 221 . 1 1 32 32 CYS HA H 1 5.427 0.02 . 1 . . . . 32 CYS HA . 18848 1 222 . 1 1 32 32 CYS HB2 H 1 2.477 0.02 . 2 . . . . 32 CYS HB2 . 18848 1 223 . 1 1 32 32 CYS HB3 H 1 2.359 0.02 . 2 . . . . 32 CYS HB3 . 18848 1 224 . 1 1 32 32 CYS C C 13 173.192 0.2 . 1 . . . . 32 CYS C . 18848 1 225 . 1 1 32 32 CYS CA C 13 52.266 0.2 . 1 . . . . 32 CYS CA . 18848 1 226 . 1 1 32 32 CYS CB C 13 40.366 0.2 . 1 . . . . 32 CYS CB . 18848 1 227 . 1 1 32 32 CYS N N 15 118.076 0.2 . 1 . . . . 32 CYS N . 18848 1 228 . 1 1 33 33 ASP H H 1 9.176 0.02 . 1 . . . . 33 ASP H . 18848 1 229 . 1 1 33 33 ASP HA H 1 4.847 0.02 . 1 . . . . 33 ASP HA . 18848 1 230 . 1 1 33 33 ASP HB2 H 1 2.448 0.02 . 2 . . . . 33 ASP HB2 . 18848 1 231 . 1 1 33 33 ASP HB3 H 1 2.762 0.02 . 2 . . . . 33 ASP HB3 . 18848 1 232 . 1 1 33 33 ASP C C 13 176.646 0.2 . 1 . . . . 33 ASP C . 18848 1 233 . 1 1 33 33 ASP CA C 13 52.826 0.2 . 1 . . . . 33 ASP CA . 18848 1 234 . 1 1 33 33 ASP CB C 13 41.738 0.2 . 1 . . . . 33 ASP CB . 18848 1 235 . 1 1 33 33 ASP N N 15 126.117 0.2 . 1 . . . . 33 ASP N . 18848 1 236 . 1 1 34 34 CYS H H 1 8.471 0.02 . 1 . . . . 34 CYS H . 18848 1 237 . 1 1 34 34 CYS HB3 H 1 2.711 0.02 . 1 . . . . 34 CYS HB3 . 18848 1 238 . 1 1 34 34 CYS C C 13 175.448 0.2 . 1 . . . . 34 CYS C . 18848 1 239 . 1 1 34 34 CYS CA C 13 53.737 0.2 . 1 . . . . 34 CYS CA . 18848 1 240 . 1 1 34 34 CYS CB C 13 37.520 0.2 . 1 . . . . 34 CYS CB . 18848 1 241 . 1 1 34 34 CYS N N 15 123.982 0.2 . 1 . . . . 34 CYS N . 18848 1 242 . 1 1 35 35 PHE H H 1 8.470 0.02 . 1 . . . . 35 PHE H . 18848 1 243 . 1 1 35 35 PHE HA H 1 4.969 0.02 . 1 . . . . 35 PHE HA . 18848 1 244 . 1 1 35 35 PHE HB2 H 1 3.596 0.02 . 2 . . . . 35 PHE HB2 . 18848 1 245 . 1 1 35 35 PHE HB3 H 1 2.840 0.02 . 2 . . . . 35 PHE HB3 . 18848 1 246 . 1 1 35 35 PHE C C 13 175.324 0.2 . 1 . . . . 35 PHE C . 18848 1 247 . 1 1 35 35 PHE CA C 13 55.000 0.2 . 1 . . . . 35 PHE CA . 18848 1 248 . 1 1 35 35 PHE CB C 13 38.532 0.2 . 1 . . . . 35 PHE CB . 18848 1 249 . 1 1 35 35 PHE N N 15 123.068 0.2 . 1 . . . . 35 PHE N . 18848 1 250 . 1 1 36 36 ASP H H 1 8.602 0.02 . 1 . . . . 36 ASP H . 18848 1 251 . 1 1 36 36 ASP HA H 1 4.572 0.02 . 1 . . . . 36 ASP HA . 18848 1 252 . 1 1 36 36 ASP HB2 H 1 2.743 0.02 . 1 . . . . 36 ASP HB2 . 18848 1 253 . 1 1 36 36 ASP HB3 H 1 2.743 0.02 . 1 . . . . 36 ASP HB3 . 18848 1 254 . 1 1 36 36 ASP C C 13 176.618 0.2 . 1 . . . . 36 ASP C . 18848 1 255 . 1 1 36 36 ASP CA C 13 56.558 0.2 . 1 . . . . 36 ASP CA . 18848 1 256 . 1 1 36 36 ASP CB C 13 40.861 0.2 . 1 . . . . 36 ASP CB . 18848 1 257 . 1 1 36 36 ASP N N 15 120.469 0.2 . 1 . . . . 36 ASP N . 18848 1 258 . 1 1 37 37 GLY H H 1 8.743 0.02 . 1 . . . . 37 GLY H . 18848 1 259 . 1 1 37 37 GLY HA2 H 1 4.441 0.02 . 2 . . . . 37 GLY HA2 . 18848 1 260 . 1 1 37 37 GLY HA3 H 1 3.354 0.02 . 2 . . . . 37 GLY HA3 . 18848 1 261 . 1 1 37 37 GLY C C 13 173.481 0.2 . 1 . . . . 37 GLY C . 18848 1 262 . 1 1 37 37 GLY CA C 13 44.693 0.2 . 1 . . . . 37 GLY CA . 18848 1 263 . 1 1 37 37 GLY N N 15 111.124 0.2 . 1 . . . . 37 GLY N . 18848 1 264 . 1 1 38 38 TYR H H 1 8.424 0.02 . 1 . . . . 38 TYR H . 18848 1 265 . 1 1 38 38 TYR HA H 1 5.294 0.02 . 1 . . . . 38 TYR HA . 18848 1 266 . 1 1 38 38 TYR HB2 H 1 2.682 0.02 . 2 . . . . 38 TYR HB2 . 18848 1 267 . 1 1 38 38 TYR HB3 H 1 3.206 0.02 . 2 . . . . 38 TYR HB3 . 18848 1 268 . 1 1 38 38 TYR C C 13 174.671 0.2 . 1 . . . . 38 TYR C . 18848 1 269 . 1 1 38 38 TYR CA C 13 56.978 0.2 . 1 . . . . 38 TYR CA . 18848 1 270 . 1 1 38 38 TYR CB C 13 41.966 0.2 . 1 . . . . 38 TYR CB . 18848 1 271 . 1 1 38 38 TYR N N 15 118.037 0.2 . 1 . . . . 38 TYR N . 18848 1 272 . 1 1 39 39 HIS H H 1 9.781 0.02 . 1 . . . . 39 HIS H . 18848 1 273 . 1 1 39 39 HIS HA H 1 5.055 0.02 . 1 . . . . 39 HIS HA . 18848 1 274 . 1 1 39 39 HIS HB2 H 1 3.262 0.02 . 2 . . . . 39 HIS HB2 . 18848 1 275 . 1 1 39 39 HIS HB3 H 1 3.118 0.02 . 2 . . . . 39 HIS HB3 . 18848 1 276 . 1 1 39 39 HIS C C 13 173.550 0.2 . 1 . . . . 39 HIS C . 18848 1 277 . 1 1 39 39 HIS CA C 13 53.597 0.2 . 1 . . . . 39 HIS CA . 18848 1 278 . 1 1 39 39 HIS CB C 13 32.184 0.2 . 1 . . . . 39 HIS CB . 18848 1 279 . 1 1 39 39 HIS N N 15 116.632 0.2 . 1 . . . . 39 HIS N . 18848 1 280 . 1 1 40 40 LEU H H 1 8.759 0.02 . 1 . . . . 40 LEU H . 18848 1 281 . 1 1 40 40 LEU C C 13 176.189 0.2 . 1 . . . . 40 LEU C . 18848 1 282 . 1 1 40 40 LEU CA C 13 56.253 0.2 . 1 . . . . 40 LEU CA . 18848 1 283 . 1 1 40 40 LEU N N 15 126.633 0.2 . 1 . . . . 40 LEU N . 18848 1 284 . 1 1 41 41 ASP HA H 1 4.851 0.02 . 1 . . . . 41 ASP HA . 18848 1 285 . 1 1 41 41 ASP HB2 H 1 2.563 0.02 . 2 . . . . 41 ASP HB2 . 18848 1 286 . 1 1 41 41 ASP HB3 H 1 2.980 0.02 . 2 . . . . 41 ASP HB3 . 18848 1 287 . 1 1 41 41 ASP CA C 13 53.060 0.2 . 1 . . . . 41 ASP CA . 18848 1 288 . 1 1 42 42 THR H H 1 8.558 0.02 . 1 . . . . 42 THR H . 18848 1 289 . 1 1 42 42 THR HA H 1 4.054 0.02 . 1 . . . . 42 THR HA . 18848 1 290 . 1 1 42 42 THR CA C 13 64.699 0.2 . 1 . . . . 42 THR CA . 18848 1 291 . 1 1 42 42 THR N N 15 118.036 0.2 . 1 . . . . 42 THR N . 18848 1 292 . 1 1 47 47 CYS HA H 1 5.166 0.02 . 1 . . . . 47 CYS HA . 18848 1 293 . 1 1 47 47 CYS HB2 H 1 2.428 0.02 . 2 . . . . 47 CYS HB2 . 18848 1 294 . 1 1 47 47 CYS HB3 H 1 3.454 0.02 . 2 . . . . 47 CYS HB3 . 18848 1 295 . 1 1 47 47 CYS C C 13 174.108 0.2 . 1 . . . . 47 CYS C . 18848 1 296 . 1 1 47 47 CYS CA C 13 55.524 0.2 . 1 . . . . 47 CYS CA . 18848 1 297 . 1 1 47 47 CYS CB C 13 42.428 0.2 . 1 . . . . 47 CYS CB . 18848 1 298 . 1 1 48 48 VAL H H 1 9.379 0.02 . 1 . . . . 48 VAL H . 18848 1 299 . 1 1 48 48 VAL HA H 1 4.867 0.02 . 1 . . . . 48 VAL HA . 18848 1 300 . 1 1 48 48 VAL HB H 1 2.322 0.02 . 1 . . . . 48 VAL HB . 18848 1 301 . 1 1 48 48 VAL C C 13 175.841 0.2 . 1 . . . . 48 VAL C . 18848 1 302 . 1 1 48 48 VAL CA C 13 59.626 0.2 . 1 . . . . 48 VAL CA . 18848 1 303 . 1 1 48 48 VAL CB C 13 35.203 0.2 . 1 . . . . 48 VAL CB . 18848 1 304 . 1 1 48 48 VAL N N 15 120.979 0.2 . 1 . . . . 48 VAL N . 18848 1 305 . 1 1 49 49 ASP H H 1 9.098 0.02 . 1 . . . . 49 ASP H . 18848 1 306 . 1 1 49 49 ASP HA H 1 4.223 0.02 . 1 . . . . 49 ASP HA . 18848 1 307 . 1 1 49 49 ASP HB2 H 1 2.366 0.02 . 2 . . . . 49 ASP HB2 . 18848 1 308 . 1 1 49 49 ASP HB3 H 1 2.884 0.02 . 2 . . . . 49 ASP HB3 . 18848 1 309 . 1 1 49 49 ASP C C 13 176.045 0.2 . 1 . . . . 49 ASP C . 18848 1 310 . 1 1 49 49 ASP CA C 13 56.354 0.2 . 1 . . . . 49 ASP CA . 18848 1 311 . 1 1 49 49 ASP CB C 13 43.155 0.2 . 1 . . . . 49 ASP CB . 18848 1 312 . 1 1 49 49 ASP N N 15 124.297 0.2 . 1 . . . . 49 ASP N . 18848 1 313 . 1 1 50 50 VAL H H 1 7.803 0.02 . 1 . . . . 50 VAL H . 18848 1 314 . 1 1 50 50 VAL HA H 1 3.654 0.02 . 1 . . . . 50 VAL HA . 18848 1 315 . 1 1 50 50 VAL HB H 1 1.596 0.02 . 1 . . . . 50 VAL HB . 18848 1 316 . 1 1 50 50 VAL C C 13 174.073 0.2 . 1 . . . . 50 VAL C . 18848 1 317 . 1 1 50 50 VAL CA C 13 62.010 0.2 . 1 . . . . 50 VAL CA . 18848 1 318 . 1 1 50 50 VAL CB C 13 33.418 0.2 . 1 . . . . 50 VAL CB . 18848 1 319 . 1 1 50 50 VAL N N 15 127.111 0.2 . 1 . . . . 50 VAL N . 18848 1 320 . 1 1 51 51 ASN H H 1 9.129 0.02 . 1 . . . . 51 ASN H . 18848 1 321 . 1 1 51 51 ASN HA H 1 4.973 0.02 . 1 . . . . 51 ASN HA . 18848 1 322 . 1 1 51 51 ASN HB2 H 1 3.162 0.02 . 2 . . . . 51 ASN HB2 . 18848 1 323 . 1 1 51 51 ASN HB3 H 1 2.650 0.02 . 2 . . . . 51 ASN HB3 . 18848 1 324 . 1 1 51 51 ASN C C 13 175.826 0.2 . 1 . . . . 51 ASN C . 18848 1 325 . 1 1 51 51 ASN CA C 13 50.389 0.2 . 1 . . . . 51 ASN CA . 18848 1 326 . 1 1 51 51 ASN CB C 13 36.560 0.2 . 1 . . . . 51 ASN CB . 18848 1 327 . 1 1 51 51 ASN N N 15 126.912 0.2 . 1 . . . . 51 ASN N . 18848 1 328 . 1 1 52 52 GLU H H 1 9.782 0.02 . 1 . . . . 52 GLU H . 18848 1 329 . 1 1 52 52 GLU HA H 1 3.522 0.02 . 1 . . . . 52 GLU HA . 18848 1 330 . 1 1 52 52 GLU HB2 H 1 1.224 0.02 . 2 . . . . 52 GLU HB2 . 18848 1 331 . 1 1 52 52 GLU HB3 H 1 1.474 0.02 . 2 . . . . 52 GLU HB3 . 18848 1 332 . 1 1 52 52 GLU C C 13 176.594 0.2 . 1 . . . . 52 GLU C . 18848 1 333 . 1 1 52 52 GLU CA C 13 61.713 0.2 . 1 . . . . 52 GLU CA . 18848 1 334 . 1 1 52 52 GLU CB C 13 28.246 0.2 . 1 . . . . 52 GLU CB . 18848 1 335 . 1 1 52 52 GLU N N 15 127.466 0.2 . 1 . . . . 52 GLU N . 18848 1 336 . 1 1 53 53 CYS H H 1 7.512 0.02 . 1 . . . . 53 CYS H . 18848 1 337 . 1 1 53 53 CYS HA H 1 4.361 0.02 . 1 . . . . 53 CYS HA . 18848 1 338 . 1 1 53 53 CYS HB2 H 1 3.310 0.02 . 2 . . . . 53 CYS HB2 . 18848 1 339 . 1 1 53 53 CYS HB3 H 1 2.960 0.02 . 2 . . . . 53 CYS HB3 . 18848 1 340 . 1 1 53 53 CYS C C 13 175.705 0.2 . 1 . . . . 53 CYS C . 18848 1 341 . 1 1 53 53 CYS CA C 13 53.137 0.2 . 1 . . . . 53 CYS CA . 18848 1 342 . 1 1 53 53 CYS CB C 13 35.757 0.2 . 1 . . . . 53 CYS CB . 18848 1 343 . 1 1 53 53 CYS N N 15 111.907 0.2 . 1 . . . . 53 CYS N . 18848 1 344 . 1 1 54 54 ASP H H 1 7.051 0.02 . 1 . . . . 54 ASP H . 18848 1 345 . 1 1 54 54 ASP HA H 1 4.622 0.02 . 1 . . . . 54 ASP HA . 18848 1 346 . 1 1 54 54 ASP HB2 H 1 2.745 0.02 . 2 . . . . 54 ASP HB2 . 18848 1 347 . 1 1 54 54 ASP HB3 H 1 2.478 0.02 . 2 . . . . 54 ASP HB3 . 18848 1 348 . 1 1 54 54 ASP C C 13 176.595 0.2 . 1 . . . . 54 ASP C . 18848 1 349 . 1 1 54 54 ASP CA C 13 54.662 0.2 . 1 . . . . 54 ASP CA . 18848 1 350 . 1 1 54 54 ASP CB C 13 41.524 0.2 . 1 . . . . 54 ASP CB . 18848 1 351 . 1 1 54 54 ASP N N 15 119.783 0.2 . 1 . . . . 54 ASP N . 18848 1 352 . 1 1 55 55 GLU H H 1 8.008 0.02 . 1 . . . . 55 GLU H . 18848 1 353 . 1 1 55 55 GLU HA H 1 4.244 0.02 . 1 . . . . 55 GLU HA . 18848 1 354 . 1 1 55 55 GLU HB2 H 1 1.884 0.02 . 2 . . . . 55 GLU HB2 . 18848 1 355 . 1 1 55 55 GLU HB3 H 1 2.036 0.02 . 2 . . . . 55 GLU HB3 . 18848 1 356 . 1 1 55 55 GLU C C 13 177.334 0.2 . 1 . . . . 55 GLU C . 18848 1 357 . 1 1 55 55 GLU CA C 13 57.702 0.2 . 1 . . . . 55 GLU CA . 18848 1 358 . 1 1 55 55 GLU CB C 13 30.455 0.2 . 1 . . . . 55 GLU CB . 18848 1 359 . 1 1 55 55 GLU N N 15 121.154 0.2 . 1 . . . . 55 GLU N . 18848 1 360 . 1 1 56 56 LEU H H 1 8.179 0.02 . 1 . . . . 56 LEU H . 18848 1 361 . 1 1 56 56 LEU HA H 1 4.235 0.02 . 1 . . . . 56 LEU HA . 18848 1 362 . 1 1 56 56 LEU HB2 H 1 1.567 0.02 . 2 . . . . 56 LEU HB2 . 18848 1 363 . 1 1 56 56 LEU HB3 H 1 1.703 0.02 . 2 . . . . 56 LEU HB3 . 18848 1 364 . 1 1 56 56 LEU C C 13 178.158 0.2 . 1 . . . . 56 LEU C . 18848 1 365 . 1 1 56 56 LEU CA C 13 56.433 0.2 . 1 . . . . 56 LEU CA . 18848 1 366 . 1 1 56 56 LEU CB C 13 42.045 0.2 . 1 . . . . 56 LEU CB . 18848 1 367 . 1 1 56 56 LEU N N 15 121.569 0.2 . 1 . . . . 56 LEU N . 18848 1 368 . 1 1 57 57 ASN H H 1 8.292 0.02 . 1 . . . . 57 ASN H . 18848 1 369 . 1 1 57 57 ASN HA H 1 4.593 0.02 . 1 . . . . 57 ASN HA . 18848 1 370 . 1 1 57 57 ASN HB2 H 1 2.734 0.02 . 2 . . . . 57 ASN HB2 . 18848 1 371 . 1 1 57 57 ASN HB3 H 1 2.838 0.02 . 2 . . . . 57 ASN HB3 . 18848 1 372 . 1 1 57 57 ASN C C 13 175.755 0.2 . 1 . . . . 57 ASN C . 18848 1 373 . 1 1 57 57 ASN CA C 13 54.578 0.2 . 1 . . . . 57 ASN CA . 18848 1 374 . 1 1 57 57 ASN CB C 13 38.896 0.2 . 1 . . . . 57 ASN CB . 18848 1 375 . 1 1 57 57 ASN N N 15 117.864 0.2 . 1 . . . . 57 ASN N . 18848 1 376 . 1 1 58 58 ASN H H 1 8.210 0.02 . 1 . . . . 58 ASN H . 18848 1 377 . 1 1 58 58 ASN HA H 1 4.637 0.02 . 1 . . . . 58 ASN HA . 18848 1 378 . 1 1 58 58 ASN HB2 H 1 2.824 0.02 . 1 . . . . 58 ASN HB2 . 18848 1 379 . 1 1 58 58 ASN HB3 H 1 2.824 0.02 . 1 . . . . 58 ASN HB3 . 18848 1 380 . 1 1 58 58 ASN C C 13 175.899 0.2 . 1 . . . . 58 ASN C . 18848 1 381 . 1 1 58 58 ASN CA C 13 54.023 0.2 . 1 . . . . 58 ASN CA . 18848 1 382 . 1 1 58 58 ASN CB C 13 38.382 0.2 . 1 . . . . 58 ASN CB . 18848 1 383 . 1 1 58 58 ASN N N 15 117.714 0.2 . 1 . . . . 58 ASN N . 18848 1 384 . 1 1 59 59 ARG H H 1 8.051 0.02 . 1 . . . . 59 ARG H . 18848 1 385 . 1 1 59 59 ARG HA H 1 4.173 0.02 . 1 . . . . 59 ARG HA . 18848 1 386 . 1 1 59 59 ARG HB2 H 1 1.890 0.02 . 1 . . . . 59 ARG HB2 . 18848 1 387 . 1 1 59 59 ARG HB3 H 1 1.890 0.02 . 1 . . . . 59 ARG HB3 . 18848 1 388 . 1 1 59 59 ARG C C 13 176.650 0.2 . 1 . . . . 59 ARG C . 18848 1 389 . 1 1 59 59 ARG CA C 13 57.738 0.2 . 1 . . . . 59 ARG CA . 18848 1 390 . 1 1 59 59 ARG CB C 13 30.076 0.2 . 1 . . . . 59 ARG CB . 18848 1 391 . 1 1 59 59 ARG N N 15 119.570 0.2 . 1 . . . . 59 ARG N . 18848 1 392 . 1 1 60 60 MET H H 1 8.160 0.02 . 1 . . . . 60 MET H . 18848 1 393 . 1 1 60 60 MET HA H 1 4.509 0.02 . 1 . . . . 60 MET HA . 18848 1 394 . 1 1 60 60 MET HB2 H 1 1.995 0.02 . 2 . . . . 60 MET HB2 . 18848 1 395 . 1 1 60 60 MET HB3 H 1 2.122 0.02 . 2 . . . . 60 MET HB3 . 18848 1 396 . 1 1 60 60 MET C C 13 175.864 0.2 . 1 . . . . 60 MET C . 18848 1 397 . 1 1 60 60 MET CA C 13 55.627 0.2 . 1 . . . . 60 MET CA . 18848 1 398 . 1 1 60 60 MET CB C 13 32.622 0.2 . 1 . . . . 60 MET CB . 18848 1 399 . 1 1 60 60 MET N N 15 117.937 0.2 . 1 . . . . 60 MET N . 18848 1 400 . 1 1 61 61 SER H H 1 8.112 0.02 . 1 . . . . 61 SER H . 18848 1 401 . 1 1 61 61 SER HA H 1 4.406 0.02 . 1 . . . . 61 SER HA . 18848 1 402 . 1 1 61 61 SER HB2 H 1 3.854 0.02 . 1 . . . . 61 SER HB2 . 18848 1 403 . 1 1 61 61 SER HB3 H 1 3.854 0.02 . 1 . . . . 61 SER HB3 . 18848 1 404 . 1 1 61 61 SER C C 13 174.727 0.2 . 1 . . . . 61 SER C . 18848 1 405 . 1 1 61 61 SER CA C 13 58.321 0.2 . 1 . . . . 61 SER CA . 18848 1 406 . 1 1 61 61 SER CB C 13 63.689 0.2 . 1 . . . . 61 SER CB . 18848 1 407 . 1 1 61 61 SER N N 15 115.765 0.2 . 1 . . . . 61 SER N . 18848 1 408 . 1 1 62 62 LEU H H 1 8.085 0.02 . 1 . . . . 62 LEU H . 18848 1 409 . 1 1 62 62 LEU HA H 1 4.129 0.02 . 1 . . . . 62 LEU HA . 18848 1 410 . 1 1 62 62 LEU HB2 H 1 1.458 0.02 . 1 . . . . 62 LEU HB2 . 18848 1 411 . 1 1 62 62 LEU HB3 H 1 1.458 0.02 . 1 . . . . 62 LEU HB3 . 18848 1 412 . 1 1 62 62 LEU C C 13 177.321 0.2 . 1 . . . . 62 LEU C . 18848 1 413 . 1 1 62 62 LEU CA C 13 57.125 0.2 . 1 . . . . 62 LEU CA . 18848 1 414 . 1 1 62 62 LEU CB C 13 42.677 0.2 . 1 . . . . 62 LEU CB . 18848 1 415 . 1 1 62 62 LEU N N 15 124.576 0.2 . 1 . . . . 62 LEU N . 18848 1 416 . 1 1 63 63 CYS H H 1 8.004 0.02 . 1 . . . . 63 CYS H . 18848 1 417 . 1 1 63 63 CYS HA H 1 5.120 0.02 . 1 . . . . 63 CYS HA . 18848 1 418 . 1 1 63 63 CYS HB2 H 1 2.522 0.02 . 2 . . . . 63 CYS HB2 . 18848 1 419 . 1 1 63 63 CYS HB3 H 1 2.664 0.02 . 2 . . . . 63 CYS HB3 . 18848 1 420 . 1 1 63 63 CYS C C 13 174.012 0.2 . 1 . . . . 63 CYS C . 18848 1 421 . 1 1 63 63 CYS CA C 13 52.001 0.2 . 1 . . . . 63 CYS CA . 18848 1 422 . 1 1 63 63 CYS CB C 13 39.970 0.2 . 1 . . . . 63 CYS CB . 18848 1 423 . 1 1 63 63 CYS N N 15 114.769 0.2 . 1 . . . . 63 CYS N . 18848 1 424 . 1 1 64 64 LYS H H 1 8.407 0.02 . 1 . . . . 64 LYS H . 18848 1 425 . 1 1 64 64 LYS HA H 1 4.482 0.02 . 1 . . . . 64 LYS HA . 18848 1 426 . 1 1 64 64 LYS HB2 H 1 1.651 0.02 . 1 . . . . 64 LYS HB2 . 18848 1 427 . 1 1 64 64 LYS HB3 H 1 1.651 0.02 . 1 . . . . 64 LYS HB3 . 18848 1 428 . 1 1 64 64 LYS C C 13 175.327 0.2 . 1 . . . . 64 LYS C . 18848 1 429 . 1 1 64 64 LYS CA C 13 55.758 0.2 . 1 . . . . 64 LYS CA . 18848 1 430 . 1 1 64 64 LYS CB C 13 34.328 0.2 . 1 . . . . 64 LYS CB . 18848 1 431 . 1 1 64 64 LYS N N 15 123.136 0.2 . 1 . . . . 64 LYS N . 18848 1 432 . 1 1 65 65 ASN H H 1 9.033 0.02 . 1 . . . . 65 ASN H . 18848 1 433 . 1 1 65 65 ASN HA H 1 3.736 0.02 . 1 . . . . 65 ASN HA . 18848 1 434 . 1 1 65 65 ASN HB2 H 1 2.763 0.02 . 2 . . . . 65 ASN HB2 . 18848 1 435 . 1 1 65 65 ASN HB3 H 1 1.290 0.02 . 2 . . . . 65 ASN HB3 . 18848 1 436 . 1 1 65 65 ASN C C 13 172.948 0.2 . 1 . . . . 65 ASN C . 18848 1 437 . 1 1 65 65 ASN CA C 13 53.967 0.2 . 1 . . . . 65 ASN CA . 18848 1 438 . 1 1 65 65 ASN CB C 13 36.467 0.2 . 1 . . . . 65 ASN CB . 18848 1 439 . 1 1 65 65 ASN N N 15 122.861 0.2 . 1 . . . . 65 ASN N . 18848 1 440 . 1 1 66 66 ALA H H 1 7.136 0.02 . 1 . . . . 66 ALA H . 18848 1 441 . 1 1 66 66 ALA HA H 1 4.696 0.02 . 1 . . . . 66 ALA HA . 18848 1 442 . 1 1 66 66 ALA HB1 H 1 1.038 0.02 . 1 . . . . 66 ALA HB1 . 18848 1 443 . 1 1 66 66 ALA HB2 H 1 1.038 0.02 . 1 . . . . 66 ALA HB2 . 18848 1 444 . 1 1 66 66 ALA HB3 H 1 1.038 0.02 . 1 . . . . 66 ALA HB3 . 18848 1 445 . 1 1 66 66 ALA C C 13 174.419 0.2 . 1 . . . . 66 ALA C . 18848 1 446 . 1 1 66 66 ALA CA C 13 50.814 0.2 . 1 . . . . 66 ALA CA . 18848 1 447 . 1 1 66 66 ALA CB C 13 24.146 0.2 . 1 . . . . 66 ALA CB . 18848 1 448 . 1 1 66 66 ALA N N 15 115.739 0.2 . 1 . . . . 66 ALA N . 18848 1 449 . 1 1 67 67 LYS H H 1 8.865 0.02 . 1 . . . . 67 LYS H . 18848 1 450 . 1 1 67 67 LYS HA H 1 4.485 0.02 . 1 . . . . 67 LYS HA . 18848 1 451 . 1 1 67 67 LYS HB2 H 1 1.769 0.02 . 2 . . . . 67 LYS HB2 . 18848 1 452 . 1 1 67 67 LYS HB3 H 1 1.714 0.02 . 2 . . . . 67 LYS HB3 . 18848 1 453 . 1 1 67 67 LYS C C 13 174.469 0.2 . 1 . . . . 67 LYS C . 18848 1 454 . 1 1 67 67 LYS CA C 13 54.427 0.2 . 1 . . . . 67 LYS CA . 18848 1 455 . 1 1 67 67 LYS CB C 13 35.104 0.2 . 1 . . . . 67 LYS CB . 18848 1 456 . 1 1 67 67 LYS N N 15 121.078 0.2 . 1 . . . . 67 LYS N . 18848 1 457 . 1 1 68 68 CYS H H 1 8.741 0.02 . 1 . . . . 68 CYS H . 18848 1 458 . 1 1 68 68 CYS HA H 1 5.164 0.02 . 1 . . . . 68 CYS HA . 18848 1 459 . 1 1 68 68 CYS HB2 H 1 2.640 0.02 . 2 . . . . 68 CYS HB2 . 18848 1 460 . 1 1 68 68 CYS HB3 H 1 3.192 0.02 . 2 . . . . 68 CYS HB3 . 18848 1 461 . 1 1 68 68 CYS C C 13 174.177 0.2 . 1 . . . . 68 CYS C . 18848 1 462 . 1 1 68 68 CYS CA C 13 57.917 0.2 . 1 . . . . 68 CYS CA . 18848 1 463 . 1 1 68 68 CYS CB C 13 36.029 0.2 . 1 . . . . 68 CYS CB . 18848 1 464 . 1 1 68 68 CYS N N 15 126.579 0.2 . 1 . . . . 68 CYS N . 18848 1 465 . 1 1 69 69 ILE H H 1 9.680 0.02 . 1 . . . . 69 ILE H . 18848 1 466 . 1 1 69 69 ILE HA H 1 4.409 0.02 . 1 . . . . 69 ILE HA . 18848 1 467 . 1 1 69 69 ILE HB H 1 1.879 0.02 . 1 . . . . 69 ILE HB . 18848 1 468 . 1 1 69 69 ILE C C 13 174.680 0.2 . 1 . . . . 69 ILE C . 18848 1 469 . 1 1 69 69 ILE CA C 13 59.612 0.2 . 1 . . . . 69 ILE CA . 18848 1 470 . 1 1 69 69 ILE CB C 13 39.485 0.2 . 1 . . . . 69 ILE CB . 18848 1 471 . 1 1 69 69 ILE N N 15 132.154 0.2 . 1 . . . . 69 ILE N . 18848 1 472 . 1 1 70 70 ASN H H 1 9.044 0.02 . 1 . . . . 70 ASN H . 18848 1 473 . 1 1 70 70 ASN HA H 1 4.919 0.02 . 1 . . . . 70 ASN HA . 18848 1 474 . 1 1 70 70 ASN HB2 H 1 2.867 0.02 . 2 . . . . 70 ASN HB2 . 18848 1 475 . 1 1 70 70 ASN HB3 H 1 2.666 0.02 . 2 . . . . 70 ASN HB3 . 18848 1 476 . 1 1 70 70 ASN C C 13 175.081 0.2 . 1 . . . . 70 ASN C . 18848 1 477 . 1 1 70 70 ASN CA C 13 54.365 0.2 . 1 . . . . 70 ASN CA . 18848 1 478 . 1 1 70 70 ASN CB C 13 39.521 0.2 . 1 . . . . 70 ASN CB . 18848 1 479 . 1 1 70 70 ASN N N 15 127.594 0.2 . 1 . . . . 70 ASN N . 18848 1 480 . 1 1 71 71 THR H H 1 7.897 0.02 . 1 . . . . 71 THR H . 18848 1 481 . 1 1 71 71 THR HA H 1 4.727 0.02 . 1 . . . . 71 THR HA . 18848 1 482 . 1 1 71 71 THR HB H 1 4.249 0.02 . 1 . . . . 71 THR HB . 18848 1 483 . 1 1 71 71 THR C C 13 173.751 0.2 . 1 . . . . 71 THR C . 18848 1 484 . 1 1 71 71 THR CA C 13 59.665 0.2 . 1 . . . . 71 THR CA . 18848 1 485 . 1 1 71 71 THR CB C 13 70.854 0.2 . 1 . . . . 71 THR CB . 18848 1 486 . 1 1 71 71 THR N N 15 117.429 0.2 . 1 . . . . 71 THR N . 18848 1 487 . 1 1 72 72 ASP H H 1 8.734 0.02 . 1 . . . . 72 ASP H . 18848 1 488 . 1 1 72 72 ASP HA H 1 4.303 0.02 . 1 . . . . 72 ASP HA . 18848 1 489 . 1 1 72 72 ASP HB2 H 1 2.868 0.02 . 2 . . . . 72 ASP HB2 . 18848 1 490 . 1 1 72 72 ASP HB3 H 1 2.630 0.02 . 2 . . . . 72 ASP HB3 . 18848 1 491 . 1 1 72 72 ASP C C 13 175.594 0.2 . 1 . . . . 72 ASP C . 18848 1 492 . 1 1 72 72 ASP CA C 13 55.723 0.2 . 1 . . . . 72 ASP CA . 18848 1 493 . 1 1 72 72 ASP CB C 13 40.297 0.2 . 1 . . . . 72 ASP CB . 18848 1 494 . 1 1 72 72 ASP N N 15 123.765 0.2 . 1 . . . . 72 ASP N . 18848 1 495 . 1 1 73 73 GLY H H 1 9.230 0.02 . 1 . . . . 73 GLY H . 18848 1 496 . 1 1 73 73 GLY HA2 H 1 4.272 0.02 . 2 . . . . 73 GLY HA2 . 18848 1 497 . 1 1 73 73 GLY HA3 H 1 2.958 0.02 . 2 . . . . 73 GLY HA3 . 18848 1 498 . 1 1 73 73 GLY C C 13 174.225 0.2 . 1 . . . . 73 GLY C . 18848 1 499 . 1 1 73 73 GLY CA C 13 46.372 0.2 . 1 . . . . 73 GLY CA . 18848 1 500 . 1 1 73 73 GLY N N 15 119.827 0.2 . 1 . . . . 73 GLY N . 18848 1 501 . 1 1 74 74 SER H H 1 6.645 0.02 . 1 . . . . 74 SER H . 18848 1 502 . 1 1 74 74 SER HA H 1 4.386 0.02 . 1 . . . . 74 SER HA . 18848 1 503 . 1 1 74 74 SER HB2 H 1 3.873 0.02 . 2 . . . . 74 SER HB2 . 18848 1 504 . 1 1 74 74 SER HB3 H 1 3.398 0.02 . 2 . . . . 74 SER HB3 . 18848 1 505 . 1 1 74 74 SER C C 13 173.549 0.2 . 1 . . . . 74 SER C . 18848 1 506 . 1 1 74 74 SER CA C 13 56.184 0.2 . 1 . . . . 74 SER CA . 18848 1 507 . 1 1 74 74 SER CB C 13 63.041 0.2 . 1 . . . . 74 SER CB . 18848 1 508 . 1 1 74 74 SER N N 15 113.308 0.2 . 1 . . . . 74 SER N . 18848 1 509 . 1 1 75 75 TYR H H 1 9.045 0.02 . 1 . . . . 75 TYR H . 18848 1 510 . 1 1 75 75 TYR HA H 1 5.053 0.02 . 1 . . . . 75 TYR HA . 18848 1 511 . 1 1 75 75 TYR HB2 H 1 2.965 0.02 . 2 . . . . 75 TYR HB2 . 18848 1 512 . 1 1 75 75 TYR HB3 H 1 3.548 0.02 . 2 . . . . 75 TYR HB3 . 18848 1 513 . 1 1 75 75 TYR C C 13 172.703 0.2 . 1 . . . . 75 TYR C . 18848 1 514 . 1 1 75 75 TYR CA C 13 57.478 0.2 . 1 . . . . 75 TYR CA . 18848 1 515 . 1 1 75 75 TYR CB C 13 39.123 0.2 . 1 . . . . 75 TYR CB . 18848 1 516 . 1 1 75 75 TYR N N 15 118.680 0.2 . 1 . . . . 75 TYR N . 18848 1 517 . 1 1 76 76 LYS H H 1 9.662 0.02 . 1 . . . . 76 LYS H . 18848 1 518 . 1 1 76 76 LYS HA H 1 4.508 0.02 . 1 . . . . 76 LYS HA . 18848 1 519 . 1 1 76 76 LYS HB2 H 1 1.672 0.02 . 1 . . . . 76 LYS HB2 . 18848 1 520 . 1 1 76 76 LYS HB3 H 1 1.672 0.02 . 1 . . . . 76 LYS HB3 . 18848 1 521 . 1 1 76 76 LYS C C 13 174.126 0.2 . 1 . . . . 76 LYS C . 18848 1 522 . 1 1 76 76 LYS CA C 13 54.611 0.2 . 1 . . . . 76 LYS CA . 18848 1 523 . 1 1 76 76 LYS CB C 13 36.504 0.2 . 1 . . . . 76 LYS CB . 18848 1 524 . 1 1 76 76 LYS N N 15 120.160 0.2 . 1 . . . . 76 LYS N . 18848 1 525 . 1 1 77 77 CYS H H 1 8.517 0.02 . 1 . . . . 77 CYS H . 18848 1 526 . 1 1 77 77 CYS HA H 1 5.509 0.02 . 1 . . . . 77 CYS HA . 18848 1 527 . 1 1 77 77 CYS HB2 H 1 2.521 0.02 . 2 . . . . 77 CYS HB2 . 18848 1 528 . 1 1 77 77 CYS HB3 H 1 2.822 0.02 . 2 . . . . 77 CYS HB3 . 18848 1 529 . 1 1 77 77 CYS C C 13 173.898 0.2 . 1 . . . . 77 CYS C . 18848 1 530 . 1 1 77 77 CYS CA C 13 52.165 0.2 . 1 . . . . 77 CYS CA . 18848 1 531 . 1 1 77 77 CYS CB C 13 39.187 0.2 . 1 . . . . 77 CYS CB . 18848 1 532 . 1 1 77 77 CYS N N 15 119.056 0.2 . 1 . . . . 77 CYS N . 18848 1 533 . 1 1 78 78 LEU H H 1 9.085 0.02 . 1 . . . . 78 LEU H . 18848 1 534 . 1 1 78 78 LEU HA H 1 4.713 0.02 . 1 . . . . 78 LEU HA . 18848 1 535 . 1 1 78 78 LEU HB2 H 1 1.720 0.02 . 2 . . . . 78 LEU HB2 . 18848 1 536 . 1 1 78 78 LEU HB3 H 1 1.466 0.02 . 2 . . . . 78 LEU HB3 . 18848 1 537 . 1 1 78 78 LEU C C 13 176.152 0.2 . 1 . . . . 78 LEU C . 18848 1 538 . 1 1 78 78 LEU CA C 13 53.199 0.2 . 1 . . . . 78 LEU CA . 18848 1 539 . 1 1 78 78 LEU CB C 13 43.596 0.2 . 1 . . . . 78 LEU CB . 18848 1 540 . 1 1 78 78 LEU N N 15 126.998 0.2 . 1 . . . . 78 LEU N . 18848 1 541 . 1 1 79 79 CYS H H 1 8.711 0.02 . 1 . . . . 79 CYS H . 18848 1 542 . 1 1 79 79 CYS HA H 1 4.567 0.02 . 1 . . . . 79 CYS HA . 18848 1 543 . 1 1 79 79 CYS HB2 H 1 2.738 0.02 . 2 . . . . 79 CYS HB2 . 18848 1 544 . 1 1 79 79 CYS HB3 H 1 3.110 0.02 . 2 . . . . 79 CYS HB3 . 18848 1 545 . 1 1 79 79 CYS C C 13 175.217 0.2 . 1 . . . . 79 CYS C . 18848 1 546 . 1 1 79 79 CYS CA C 13 53.803 0.2 . 1 . . . . 79 CYS CA . 18848 1 547 . 1 1 79 79 CYS CB C 13 37.877 0.2 . 1 . . . . 79 CYS CB . 18848 1 548 . 1 1 79 79 CYS N N 15 124.073 0.2 . 1 . . . . 79 CYS N . 18848 1 549 . 1 1 80 80 LEU H H 1 7.659 0.02 . 1 . . . . 80 LEU H . 18848 1 550 . 1 1 80 80 LEU C C 13 173.692 0.2 . 1 . . . . 80 LEU C . 18848 1 551 . 1 1 80 80 LEU CA C 13 53.729 0.2 . 1 . . . . 80 LEU CA . 18848 1 552 . 1 1 80 80 LEU CB C 13 40.706 0.2 . 1 . . . . 80 LEU CB . 18848 1 553 . 1 1 80 80 LEU N N 15 124.168 0.2 . 1 . . . . 80 LEU N . 18848 1 554 . 1 1 81 81 PRO HA H 1 4.457 0.02 . 1 . . . . 81 PRO HA . 18848 1 555 . 1 1 81 81 PRO HB2 H 1 1.894 0.02 . 2 . . . . 81 PRO HB2 . 18848 1 556 . 1 1 81 81 PRO HB3 H 1 2.365 0.02 . 2 . . . . 81 PRO HB3 . 18848 1 557 . 1 1 81 81 PRO C C 13 178.080 0.2 . 1 . . . . 81 PRO C . 18848 1 558 . 1 1 81 81 PRO CA C 13 64.367 0.2 . 1 . . . . 81 PRO CA . 18848 1 559 . 1 1 81 81 PRO CB C 13 31.604 0.2 . 1 . . . . 81 PRO CB . 18848 1 560 . 1 1 82 82 GLY H H 1 8.837 0.02 . 1 . . . . 82 GLY H . 18848 1 561 . 1 1 82 82 GLY HA2 H 1 3.520 0.02 . 2 . . . . 82 GLY HA2 . 18848 1 562 . 1 1 82 82 GLY HA3 H 1 4.183 0.02 . 2 . . . . 82 GLY HA3 . 18848 1 563 . 1 1 82 82 GLY C C 13 173.496 0.2 . 1 . . . . 82 GLY C . 18848 1 564 . 1 1 82 82 GLY CA C 13 44.997 0.2 . 1 . . . . 82 GLY CA . 18848 1 565 . 1 1 82 82 GLY N N 15 112.104 0.2 . 1 . . . . 82 GLY N . 18848 1 566 . 1 1 83 83 TYR H H 1 8.444 0.02 . 1 . . . . 83 TYR H . 18848 1 567 . 1 1 83 83 TYR HA H 1 5.167 0.02 . 1 . . . . 83 TYR HA . 18848 1 568 . 1 1 83 83 TYR HB2 H 1 3.146 0.02 . 2 . . . . 83 TYR HB2 . 18848 1 569 . 1 1 83 83 TYR HB3 H 1 2.603 0.02 . 2 . . . . 83 TYR HB3 . 18848 1 570 . 1 1 83 83 TYR C C 13 174.551 0.2 . 1 . . . . 83 TYR C . 18848 1 571 . 1 1 83 83 TYR CA C 13 56.436 0.2 . 1 . . . . 83 TYR CA . 18848 1 572 . 1 1 83 83 TYR CB C 13 40.876 0.2 . 1 . . . . 83 TYR CB . 18848 1 573 . 1 1 83 83 TYR N N 15 120.930 0.2 . 1 . . . . 83 TYR N . 18848 1 574 . 1 1 84 84 VAL H H 1 9.395 0.02 . 1 . . . . 84 VAL H . 18848 1 575 . 1 1 84 84 VAL HA H 1 5.042 0.02 . 1 . . . . 84 VAL HA . 18848 1 576 . 1 1 84 84 VAL C C 13 173.772 0.2 . 1 . . . . 84 VAL C . 18848 1 577 . 1 1 84 84 VAL CA C 13 58.721 0.2 . 1 . . . . 84 VAL CA . 18848 1 578 . 1 1 84 84 VAL CB C 13 33.308 0.2 . 1 . . . . 84 VAL CB . 18848 1 579 . 1 1 84 84 VAL N N 15 114.694 0.2 . 1 . . . . 84 VAL N . 18848 1 580 . 1 1 85 85 PRO HA H 1 4.529 0.02 . 1 . . . . 85 PRO HA . 18848 1 581 . 1 1 85 85 PRO HB2 H 1 1.974 0.02 . 2 . . . . 85 PRO HB2 . 18848 1 582 . 1 1 85 85 PRO HB3 H 1 2.523 0.02 . 2 . . . . 85 PRO HB3 . 18848 1 583 . 1 1 85 85 PRO C C 13 176.793 0.2 . 1 . . . . 85 PRO C . 18848 1 584 . 1 1 85 85 PRO CA C 13 64.604 0.2 . 1 . . . . 85 PRO CA . 18848 1 585 . 1 1 85 85 PRO CB C 13 32.559 0.2 . 1 . . . . 85 PRO CB . 18848 1 586 . 1 1 86 86 SER H H 1 8.534 0.02 . 1 . . . . 86 SER H . 18848 1 587 . 1 1 86 86 SER HA H 1 5.003 0.02 . 1 . . . . 86 SER HA . 18848 1 588 . 1 1 86 86 SER HB2 H 1 3.983 0.02 . 2 . . . . 86 SER HB2 . 18848 1 589 . 1 1 86 86 SER HB3 H 1 4.395 0.02 . 2 . . . . 86 SER HB3 . 18848 1 590 . 1 1 86 86 SER C C 13 173.486 0.2 . 1 . . . . 86 SER C . 18848 1 591 . 1 1 86 86 SER CA C 13 57.362 0.2 . 1 . . . . 86 SER CA . 18848 1 592 . 1 1 86 86 SER CB C 13 66.744 0.2 . 1 . . . . 86 SER CB . 18848 1 593 . 1 1 86 86 SER N N 15 119.606 0.2 . 1 . . . . 86 SER N . 18848 1 594 . 1 1 87 87 ASP H H 1 8.721 0.02 . 1 . . . . 87 ASP H . 18848 1 595 . 1 1 87 87 ASP HA H 1 4.498 0.02 . 1 . . . . 87 ASP HA . 18848 1 596 . 1 1 87 87 ASP HB2 H 1 2.725 0.02 . 2 . . . . 87 ASP HB2 . 18848 1 597 . 1 1 87 87 ASP HB3 H 1 2.813 0.02 . 2 . . . . 87 ASP HB3 . 18848 1 598 . 1 1 87 87 ASP C C 13 175.987 0.2 . 1 . . . . 87 ASP C . 18848 1 599 . 1 1 87 87 ASP CA C 13 55.325 0.2 . 1 . . . . 87 ASP CA . 18848 1 600 . 1 1 87 87 ASP CB C 13 40.072 0.2 . 1 . . . . 87 ASP CB . 18848 1 601 . 1 1 87 87 ASP N N 15 118.346 0.2 . 1 . . . . 87 ASP N . 18848 1 602 . 1 1 88 88 LYS H H 1 8.507 0.02 . 1 . . . . 88 LYS H . 18848 1 603 . 1 1 88 88 LYS C C 13 174.960 0.2 . 1 . . . . 88 LYS C . 18848 1 604 . 1 1 88 88 LYS CA C 13 52.930 0.2 . 1 . . . . 88 LYS CA . 18848 1 605 . 1 1 88 88 LYS CB C 13 33.474 0.2 . 1 . . . . 88 LYS CB . 18848 1 606 . 1 1 88 88 LYS N N 15 122.864 0.2 . 1 . . . . 88 LYS N . 18848 1 607 . 1 1 89 89 PRO HA H 1 4.343 0.02 . 1 . . . . 89 PRO HA . 18848 1 608 . 1 1 89 89 PRO HB2 H 1 2.331 0.02 . 2 . . . . 89 PRO HB2 . 18848 1 609 . 1 1 89 89 PRO HB3 H 1 1.913 0.02 . 2 . . . . 89 PRO HB3 . 18848 1 610 . 1 1 89 89 PRO C C 13 176.531 0.2 . 1 . . . . 89 PRO C . 18848 1 611 . 1 1 89 89 PRO CA C 13 64.289 0.2 . 1 . . . . 89 PRO CA . 18848 1 612 . 1 1 89 89 PRO CB C 13 32.058 0.2 . 1 . . . . 89 PRO CB . 18848 1 613 . 1 1 90 90 ASN H H 1 8.290 0.02 . 1 . . . . 90 ASN H . 18848 1 614 . 1 1 90 90 ASN HA H 1 4.589 0.02 . 1 . . . . 90 ASN HA . 18848 1 615 . 1 1 90 90 ASN HB2 H 1 3.464 0.02 . 2 . . . . 90 ASN HB2 . 18848 1 616 . 1 1 90 90 ASN HB3 H 1 3.256 0.02 . 2 . . . . 90 ASN HB3 . 18848 1 617 . 1 1 90 90 ASN C C 13 173.403 0.2 . 1 . . . . 90 ASN C . 18848 1 618 . 1 1 90 90 ASN CA C 13 54.105 0.2 . 1 . . . . 90 ASN CA . 18848 1 619 . 1 1 90 90 ASN CB C 13 37.642 0.2 . 1 . . . . 90 ASN CB . 18848 1 620 . 1 1 90 90 ASN N N 15 114.376 0.2 . 1 . . . . 90 ASN N . 18848 1 621 . 1 1 91 91 TYR H H 1 7.749 0.02 . 1 . . . . 91 TYR H . 18848 1 622 . 1 1 91 91 TYR HA H 1 5.095 0.02 . 1 . . . . 91 TYR HA . 18848 1 623 . 1 1 91 91 TYR HB2 H 1 2.915 0.02 . 1 . . . . 91 TYR HB2 . 18848 1 624 . 1 1 91 91 TYR HB3 H 1 2.915 0.02 . 1 . . . . 91 TYR HB3 . 18848 1 625 . 1 1 91 91 TYR C C 13 175.285 0.2 . 1 . . . . 91 TYR C . 18848 1 626 . 1 1 91 91 TYR CA C 13 56.679 0.2 . 1 . . . . 91 TYR CA . 18848 1 627 . 1 1 91 91 TYR CB C 13 40.363 0.2 . 1 . . . . 91 TYR CB . 18848 1 628 . 1 1 91 91 TYR N N 15 120.107 0.2 . 1 . . . . 91 TYR N . 18848 1 629 . 1 1 92 92 CYS H H 1 7.717 0.02 . 1 . . . . 92 CYS H . 18848 1 630 . 1 1 92 92 CYS HA H 1 5.432 0.02 . 1 . . . . 92 CYS HA . 18848 1 631 . 1 1 92 92 CYS HB2 H 1 2.787 0.02 . 2 . . . . 92 CYS HB2 . 18848 1 632 . 1 1 92 92 CYS HB3 H 1 3.610 0.02 . 2 . . . . 92 CYS HB3 . 18848 1 633 . 1 1 92 92 CYS C C 13 172.120 0.2 . 1 . . . . 92 CYS C . 18848 1 634 . 1 1 92 92 CYS CA C 13 56.642 0.2 . 1 . . . . 92 CYS CA . 18848 1 635 . 1 1 92 92 CYS CB C 13 46.977 0.2 . 1 . . . . 92 CYS CB . 18848 1 636 . 1 1 92 92 CYS N N 15 125.055 0.2 . 1 . . . . 92 CYS N . 18848 1 637 . 1 1 93 93 THR H H 1 9.627 0.02 . 1 . . . . 93 THR H . 18848 1 638 . 1 1 93 93 THR HA H 1 5.023 0.02 . 1 . . . . 93 THR HA . 18848 1 639 . 1 1 93 93 THR C C 13 172.102 0.2 . 1 . . . . 93 THR C . 18848 1 640 . 1 1 93 93 THR CA C 13 58.591 0.2 . 1 . . . . 93 THR CA . 18848 1 641 . 1 1 93 93 THR CB C 13 71.675 0.2 . 1 . . . . 93 THR CB . 18848 1 642 . 1 1 93 93 THR N N 15 118.812 0.2 . 1 . . . . 93 THR N . 18848 1 643 . 1 1 94 94 PRO HA H 1 4.095 0.02 . 1 . . . . 94 PRO HA . 18848 1 644 . 1 1 94 94 PRO HB2 H 1 1.803 0.02 . 2 . . . . 94 PRO HB2 . 18848 1 645 . 1 1 94 94 PRO HB3 H 1 1.970 0.02 . 2 . . . . 94 PRO HB3 . 18848 1 646 . 1 1 94 94 PRO C C 13 177.271 0.2 . 1 . . . . 94 PRO C . 18848 1 647 . 1 1 94 94 PRO CA C 13 63.594 0.2 . 1 . . . . 94 PRO CA . 18848 1 648 . 1 1 94 94 PRO CB C 13 31.800 0.2 . 1 . . . . 94 PRO CB . 18848 1 649 . 1 1 95 95 LEU H H 1 8.064 0.02 . 1 . . . . 95 LEU H . 18848 1 650 . 1 1 95 95 LEU HA H 1 4.149 0.02 . 1 . . . . 95 LEU HA . 18848 1 651 . 1 1 95 95 LEU HB2 H 1 1.402 0.02 . 2 . . . . 95 LEU HB2 . 18848 1 652 . 1 1 95 95 LEU HB3 H 1 1.475 0.02 . 2 . . . . 95 LEU HB3 . 18848 1 653 . 1 1 95 95 LEU C C 13 176.963 0.2 . 1 . . . . 95 LEU C . 18848 1 654 . 1 1 95 95 LEU CA C 13 56.155 0.2 . 1 . . . . 95 LEU CA . 18848 1 655 . 1 1 95 95 LEU CB C 13 42.901 0.2 . 1 . . . . 95 LEU CB . 18848 1 656 . 1 1 95 95 LEU N N 15 124.230 0.2 . 1 . . . . 95 LEU N . 18848 1 657 . 1 1 96 96 ASN H H 1 8.465 0.02 . 1 . . . . 96 ASN H . 18848 1 658 . 1 1 96 96 ASN HA H 1 4.749 0.02 . 1 . . . . 96 ASN HA . 18848 1 659 . 1 1 96 96 ASN HB2 H 1 2.845 0.02 . 2 . . . . 96 ASN HB2 . 18848 1 660 . 1 1 96 96 ASN HB3 H 1 2.750 0.02 . 2 . . . . 96 ASN HB3 . 18848 1 661 . 1 1 96 96 ASN C C 13 175.535 0.2 . 1 . . . . 96 ASN C . 18848 1 662 . 1 1 96 96 ASN CA C 13 53.281 0.2 . 1 . . . . 96 ASN CA . 18848 1 663 . 1 1 96 96 ASN CB C 13 38.599 0.2 . 1 . . . . 96 ASN CB . 18848 1 664 . 1 1 96 96 ASN N N 15 119.926 0.2 . 1 . . . . 96 ASN N . 18848 1 665 . 1 1 97 97 THR H H 1 8.046 0.02 . 1 . . . . 97 THR H . 18848 1 666 . 1 1 97 97 THR HA H 1 4.275 0.02 . 1 . . . . 97 THR HA . 18848 1 667 . 1 1 97 97 THR HB H 1 4.275 0.02 . 1 . . . . 97 THR HB . 18848 1 668 . 1 1 97 97 THR C C 13 174.511 0.2 . 1 . . . . 97 THR C . 18848 1 669 . 1 1 97 97 THR CA C 13 62.291 0.2 . 1 . . . . 97 THR CA . 18848 1 670 . 1 1 97 97 THR CB C 13 69.540 0.2 . 1 . . . . 97 THR CB . 18848 1 671 . 1 1 97 97 THR N N 15 115.102 0.2 . 1 . . . . 97 THR N . 18848 1 672 . 1 1 98 98 ALA H H 1 8.159 0.02 . 1 . . . . 98 ALA H . 18848 1 673 . 1 1 98 98 ALA HA H 1 4.336 0.02 . 1 . . . . 98 ALA HA . 18848 1 674 . 1 1 98 98 ALA HB1 H 1 1.401 0.02 . 1 . . . . 98 ALA HB1 . 18848 1 675 . 1 1 98 98 ALA HB2 H 1 1.401 0.02 . 1 . . . . 98 ALA HB2 . 18848 1 676 . 1 1 98 98 ALA HB3 H 1 1.401 0.02 . 1 . . . . 98 ALA HB3 . 18848 1 677 . 1 1 98 98 ALA C C 13 177.714 0.2 . 1 . . . . 98 ALA C . 18848 1 678 . 1 1 98 98 ALA CA C 13 52.808 0.2 . 1 . . . . 98 ALA CA . 18848 1 679 . 1 1 98 98 ALA CB C 13 19.178 0.2 . 1 . . . . 98 ALA CB . 18848 1 680 . 1 1 98 98 ALA N N 15 126.186 0.2 . 1 . . . . 98 ALA N . 18848 1 681 . 1 1 99 99 LEU H H 1 7.980 0.02 . 1 . . . . 99 LEU H . 18848 1 682 . 1 1 99 99 LEU HA H 1 4.299 0.02 . 1 . . . . 99 LEU HA . 18848 1 683 . 1 1 99 99 LEU HB2 H 1 1.600 0.02 . 1 . . . . 99 LEU HB2 . 18848 1 684 . 1 1 99 99 LEU HB3 H 1 1.600 0.02 . 1 . . . . 99 LEU HB3 . 18848 1 685 . 1 1 99 99 LEU C C 13 177.025 0.2 . 1 . . . . 99 LEU C . 18848 1 686 . 1 1 99 99 LEU CA C 13 55.376 0.2 . 1 . . . . 99 LEU CA . 18848 1 687 . 1 1 99 99 LEU CB C 13 42.575 0.2 . 1 . . . . 99 LEU CB . 18848 1 688 . 1 1 99 99 LEU N N 15 120.837 0.2 . 1 . . . . 99 LEU N . 18848 1 689 . 1 1 100 100 ASN H H 1 8.310 0.02 . 1 . . . . 100 ASN H . 18848 1 690 . 1 1 100 100 ASN HA H 1 4.710 0.02 . 1 . . . . 100 ASN HA . 18848 1 691 . 1 1 100 100 ASN HB2 H 1 2.755 0.02 . 2 . . . . 100 ASN HB2 . 18848 1 692 . 1 1 100 100 ASN HB3 H 1 2.864 0.02 . 2 . . . . 100 ASN HB3 . 18848 1 693 . 1 1 100 100 ASN C C 13 175.028 0.2 . 1 . . . . 100 ASN C . 18848 1 694 . 1 1 100 100 ASN CA C 13 53.298 0.2 . 1 . . . . 100 ASN CA . 18848 1 695 . 1 1 100 100 ASN CB C 13 38.715 0.2 . 1 . . . . 100 ASN CB . 18848 1 696 . 1 1 100 100 ASN N N 15 119.570 0.2 . 1 . . . . 100 ASN N . 18848 1 697 . 1 1 101 101 LEU H H 1 8.192 0.02 . 1 . . . . 101 LEU H . 18848 1 698 . 1 1 101 101 LEU HA H 1 4.341 0.02 . 1 . . . . 101 LEU HA . 18848 1 699 . 1 1 101 101 LEU HB2 H 1 1.636 0.02 . 1 . . . . 101 LEU HB2 . 18848 1 700 . 1 1 101 101 LEU HB3 H 1 1.636 0.02 . 1 . . . . 101 LEU HB3 . 18848 1 701 . 1 1 101 101 LEU C C 13 177.529 0.2 . 1 . . . . 101 LEU C . 18848 1 702 . 1 1 101 101 LEU CA C 13 55.339 0.2 . 1 . . . . 101 LEU CA . 18848 1 703 . 1 1 101 101 LEU CB C 13 42.419 0.2 . 1 . . . . 101 LEU CB . 18848 1 704 . 1 1 101 101 LEU N N 15 123.093 0.2 . 1 . . . . 101 LEU N . 18848 1 705 . 1 1 102 102 GLU H H 1 8.328 0.02 . 1 . . . . 102 GLU H . 18848 1 706 . 1 1 102 102 GLU HA H 1 4.293 0.02 . 1 . . . . 102 GLU HA . 18848 1 707 . 1 1 102 102 GLU HB2 H 1 1.984 0.02 . 2 . . . . 102 GLU HB2 . 18848 1 708 . 1 1 102 102 GLU HB3 H 1 2.076 0.02 . 2 . . . . 102 GLU HB3 . 18848 1 709 . 1 1 102 102 GLU C C 13 176.470 0.2 . 1 . . . . 102 GLU C . 18848 1 710 . 1 1 102 102 GLU CA C 13 56.721 0.2 . 1 . . . . 102 GLU CA . 18848 1 711 . 1 1 102 102 GLU CB C 13 30.198 0.2 . 1 . . . . 102 GLU CB . 18848 1 712 . 1 1 102 102 GLU N N 15 121.740 0.2 . 1 . . . . 102 GLU N . 18848 1 713 . 1 1 103 103 LYS H H 1 8.240 0.02 . 1 . . . . 103 LYS H . 18848 1 714 . 1 1 103 103 LYS HA H 1 4.341 0.02 . 1 . . . . 103 LYS HA . 18848 1 715 . 1 1 103 103 LYS HB2 H 1 1.791 0.02 . 2 . . . . 103 LYS HB2 . 18848 1 716 . 1 1 103 103 LYS HB3 H 1 1.835 0.02 . 2 . . . . 103 LYS HB3 . 18848 1 717 . 1 1 103 103 LYS C C 13 176.331 0.2 . 1 . . . . 103 LYS C . 18848 1 718 . 1 1 103 103 LYS CA C 13 56.367 0.2 . 1 . . . . 103 LYS CA . 18848 1 719 . 1 1 103 103 LYS CB C 13 33.423 0.2 . 1 . . . . 103 LYS CB . 18848 1 720 . 1 1 103 103 LYS N N 15 122.612 0.2 . 1 . . . . 103 LYS N . 18848 1 721 . 1 1 104 104 ASP H H 1 8.433 0.02 . 1 . . . . 104 ASP H . 18848 1 722 . 1 1 104 104 ASP HA H 1 4.636 0.02 . 1 . . . . 104 ASP HA . 18848 1 723 . 1 1 104 104 ASP HB2 H 1 2.776 0.02 . 2 . . . . 104 ASP HB2 . 18848 1 724 . 1 1 104 104 ASP HB3 H 1 2.664 0.02 . 2 . . . . 104 ASP HB3 . 18848 1 725 . 1 1 104 104 ASP C C 13 176.440 0.2 . 1 . . . . 104 ASP C . 18848 1 726 . 1 1 104 104 ASP CA C 13 54.687 0.2 . 1 . . . . 104 ASP CA . 18848 1 727 . 1 1 104 104 ASP CB C 13 41.210 0.2 . 1 . . . . 104 ASP CB . 18848 1 728 . 1 1 104 104 ASP N N 15 122.392 0.2 . 1 . . . . 104 ASP N . 18848 1 729 . 1 1 105 105 SER H H 1 8.230 0.02 . 1 . . . . 105 SER H . 18848 1 730 . 1 1 105 105 SER HA H 1 4.444 0.02 . 1 . . . . 105 SER HA . 18848 1 731 . 1 1 105 105 SER HB2 H 1 3.870 0.02 . 2 . . . . 105 SER HB2 . 18848 1 732 . 1 1 105 105 SER HB3 H 1 3.921 0.02 . 2 . . . . 105 SER HB3 . 18848 1 733 . 1 1 105 105 SER C C 13 174.404 0.2 . 1 . . . . 105 SER C . 18848 1 734 . 1 1 105 105 SER CA C 13 58.712 0.2 . 1 . . . . 105 SER CA . 18848 1 735 . 1 1 105 105 SER CB C 13 64.095 0.2 . 1 . . . . 105 SER CB . 18848 1 736 . 1 1 105 105 SER N N 15 116.554 0.2 . 1 . . . . 105 SER N . 18848 1 737 . 1 1 106 106 ASP H H 1 8.441 0.02 . 1 . . . . 106 ASP H . 18848 1 738 . 1 1 106 106 ASP HA H 1 4.679 0.02 . 1 . . . . 106 ASP HA . 18848 1 739 . 1 1 106 106 ASP HB2 H 1 2.766 0.02 . 2 . . . . 106 ASP HB2 . 18848 1 740 . 1 1 106 106 ASP HB3 H 1 2.701 0.02 . 2 . . . . 106 ASP HB3 . 18848 1 741 . 1 1 106 106 ASP C C 13 176.084 0.2 . 1 . . . . 106 ASP C . 18848 1 742 . 1 1 106 106 ASP CA C 13 54.559 0.2 . 1 . . . . 106 ASP CA . 18848 1 743 . 1 1 106 106 ASP CB C 13 41.051 0.2 . 1 . . . . 106 ASP CB . 18848 1 744 . 1 1 106 106 ASP N N 15 122.726 0.2 . 1 . . . . 106 ASP N . 18848 1 745 . 1 1 107 107 LEU H H 1 8.048 0.02 . 1 . . . . 107 LEU H . 18848 1 746 . 1 1 107 107 LEU HA H 1 4.372 0.02 . 1 . . . . 107 LEU HA . 18848 1 747 . 1 1 107 107 LEU HB2 H 1 1.657 0.02 . 1 . . . . 107 LEU HB2 . 18848 1 748 . 1 1 107 107 LEU HB3 H 1 1.657 0.02 . 1 . . . . 107 LEU HB3 . 18848 1 749 . 1 1 107 107 LEU C C 13 176.575 0.2 . 1 . . . . 107 LEU C . 18848 1 750 . 1 1 107 107 LEU CA C 13 55.323 0.2 . 1 . . . . 107 LEU CA . 18848 1 751 . 1 1 107 107 LEU CB C 13 42.629 0.2 . 1 . . . . 107 LEU CB . 18848 1 752 . 1 1 107 107 LEU N N 15 122.433 0.2 . 1 . . . . 107 LEU N . 18848 1 753 . 1 1 108 108 GLU H H 1 7.849 0.02 . 1 . . . . 108 GLU H . 18848 1 754 . 1 1 108 108 GLU HA H 1 4.138 0.02 . 1 . . . . 108 GLU HA . 18848 1 755 . 1 1 108 108 GLU HB2 H 1 1.903 0.02 . 1 . . . . 108 GLU HB2 . 18848 1 756 . 1 1 108 108 GLU C C 13 181.229 0.2 . 1 . . . . 108 GLU C . 18848 1 757 . 1 1 108 108 GLU CA C 13 58.058 0.2 . 1 . . . . 108 GLU CA . 18848 1 758 . 1 1 108 108 GLU CB C 13 31.239 0.2 . 1 . . . . 108 GLU CB . 18848 1 759 . 1 1 108 108 GLU N N 15 126.542 0.2 . 1 . . . . 108 GLU N . 18848 1 stop_ save_