################################### # 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 16735 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 16735 1 2 '3D CBCA(CO)NH' . . . 16735 1 3 '3D HNCACB' . . . 16735 1 4 '3D HN(CO)CA' . . . 16735 1 5 '3D HNCA' . . . 16735 1 6 '3D HNCO' . . . 16735 1 7 '3D HCACO' . . . 16735 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 GLY H H 1 7.859 0.0015 . 1 . . . . 1 GLY H . 16735 1 2 . 1 1 1 1 GLY CA C 13 45.715 0.0015 . 1 . . . . 1 GLY CA . 16735 1 3 . 1 1 1 1 GLY N N 15 106.813 0.0015 . 1 . . . . 1 GLY N . 16735 1 4 . 1 1 2 2 SER H H 1 8.182 0.0015 . 1 . . . . 2 SER H . 16735 1 5 . 1 1 2 2 SER CA C 13 58.727 0.0015 . 1 . . . . 2 SER CA . 16735 1 6 . 1 1 2 2 SER CB C 13 63.845 0.0015 . 1 . . . . 2 SER CB . 16735 1 7 . 1 1 2 2 SER N N 15 115.491 0.0015 . 1 . . . . 2 SER N . 16735 1 8 . 1 1 3 3 LYS H H 1 8.591 0.0015 . 1 . . . . 3 LYS H . 16735 1 9 . 1 1 3 3 LYS C C 13 177.024 0.0015 . 1 . . . . 3 LYS C . 16735 1 10 . 1 1 3 3 LYS CA C 13 56.464 0.0015 . 1 . . . . 3 LYS CA . 16735 1 11 . 1 1 3 3 LYS CB C 13 32.857 0.0015 . 1 . . . . 3 LYS CB . 16735 1 12 . 1 1 3 3 LYS N N 15 123.364 0.0015 . 1 . . . . 3 LYS N . 16735 1 13 . 1 1 4 4 GLY H H 1 8.460 0.0015 . 1 . . . . 4 GLY H . 16735 1 14 . 1 1 4 4 GLY C C 13 174.059 0.0015 . 1 . . . . 4 GLY C . 16735 1 15 . 1 1 4 4 GLY CA C 13 45.280 0.0015 . 1 . . . . 4 GLY CA . 16735 1 16 . 1 1 4 4 GLY N N 15 110.289 0.0015 . 1 . . . . 4 GLY N . 16735 1 17 . 1 1 5 5 VAL H H 1 8.000 0.0015 . 1 . . . . 5 VAL H . 16735 1 18 . 1 1 5 5 VAL CA C 13 62.305 0.0015 . 1 . . . . 5 VAL CA . 16735 1 19 . 1 1 5 5 VAL CB C 13 32.521 0.0015 . 1 . . . . 5 VAL CB . 16735 1 20 . 1 1 5 5 VAL N N 15 119.230 0.0015 . 1 . . . . 5 VAL N . 16735 1 21 . 1 1 6 6 GLU H H 1 8.543 0.0015 . 1 . . . . 6 GLU H . 16735 1 22 . 1 1 6 6 GLU C C 13 176.103 0.0015 . 1 . . . . 6 GLU C . 16735 1 23 . 1 1 6 6 GLU CA C 13 56.322 0.0015 . 1 . . . . 6 GLU CA . 16735 1 24 . 1 1 6 6 GLU CB C 13 30.178 0.0015 . 1 . . . . 6 GLU CB . 16735 1 25 . 1 1 6 6 GLU N N 15 124.694 0.0015 . 1 . . . . 6 GLU N . 16735 1 26 . 1 1 7 7 LEU H H 1 8.299 0.0015 . 1 . . . . 7 LEU H . 16735 1 27 . 1 1 7 7 LEU C C 13 177.055 0.0015 . 1 . . . . 7 LEU C . 16735 1 28 . 1 1 7 7 LEU CA C 13 54.968 0.0015 . 1 . . . . 7 LEU CA . 16735 1 29 . 1 1 7 7 LEU CB C 13 42.252 0.0015 . 1 . . . . 7 LEU CB . 16735 1 30 . 1 1 7 7 LEU N N 15 124.049 0.0015 . 1 . . . . 7 LEU N . 16735 1 31 . 1 1 8 8 ARG H H 1 8.357 0.0015 . 1 . . . . 8 ARG H . 16735 1 32 . 1 1 8 8 ARG C C 13 175.903 0.0015 . 1 . . . . 8 ARG C . 16735 1 33 . 1 1 8 8 ARG CA C 13 55.894 0.0015 . 1 . . . . 8 ARG CA . 16735 1 34 . 1 1 8 8 ARG CB C 13 31.112 0.0015 . 1 . . . . 8 ARG CB . 16735 1 35 . 1 1 8 8 ARG N N 15 122.015 0.0015 . 1 . . . . 8 ARG N . 16735 1 36 . 1 1 9 9 ASN H H 1 8.530 0.0015 . 1 . . . . 9 ASN H . 16735 1 37 . 1 1 9 9 ASN C C 13 174.828 0.0015 . 1 . . . . 9 ASN C . 16735 1 38 . 1 1 9 9 ASN CA C 13 53.116 0.0015 . 1 . . . . 9 ASN CA . 16735 1 39 . 1 1 9 9 ASN CB C 13 38.829 0.0015 . 1 . . . . 9 ASN CB . 16735 1 40 . 1 1 9 9 ASN N N 15 120.379 0.0015 . 1 . . . . 9 ASN N . 16735 1 41 . 1 1 10 10 ASP H H 1 8.406 0.0015 . 1 . . . . 10 ASP H . 16735 1 42 . 1 1 10 10 ASP C C 13 176.564 0.0015 . 1 . . . . 10 ASP C . 16735 1 43 . 1 1 10 10 ASP CA C 13 54.470 0.0015 . 1 . . . . 10 ASP CA . 16735 1 44 . 1 1 10 10 ASP CB C 13 40.977 0.0015 . 1 . . . . 10 ASP CB . 16735 1 45 . 1 1 10 10 ASP N N 15 120.993 0.0015 . 1 . . . . 10 ASP N . 16735 1 46 . 1 1 11 11 SER H H 1 8.257 0.0015 . 1 . . . . 11 SER H . 16735 1 47 . 1 1 11 11 SER C C 13 174.854 0.0015 . 1 . . . . 11 SER C . 16735 1 48 . 1 1 11 11 SER CA C 13 58.993 0.0015 . 1 . . . . 11 SER CA . 16735 1 49 . 1 1 11 11 SER CB C 13 63.524 0.0015 . 1 . . . . 11 SER CB . 16735 1 50 . 1 1 11 11 SER N N 15 115.601 0.0015 . 1 . . . . 11 SER N . 16735 1 51 . 1 1 12 12 GLU H H 1 8.364 0.0015 . 1 . . . . 12 GLU H . 16735 1 52 . 1 1 12 12 GLU C C 13 177.009 0.0015 . 1 . . . . 12 GLU C . 16735 1 53 . 1 1 12 12 GLU CA C 13 57.105 0.0015 . 1 . . . . 12 GLU CA . 16735 1 54 . 1 1 12 12 GLU CB C 13 29.971 0.0015 . 1 . . . . 12 GLU CB . 16735 1 55 . 1 1 12 12 GLU N N 15 122.107 0.0015 . 1 . . . . 12 GLU N . 16735 1 56 . 1 1 13 13 GLY H H 1 8.305 0.0015 . 1 . . . . 13 GLY H . 16735 1 57 . 1 1 13 13 GLY C C 13 173.875 0.0015 . 1 . . . . 13 GLY C . 16735 1 58 . 1 1 13 13 GLY CA C 13 45.387 0.0015 . 1 . . . . 13 GLY CA . 16735 1 59 . 1 1 13 13 GLY N N 15 108.975 0.0015 . 1 . . . . 13 GLY N . 16735 1 60 . 1 1 14 14 PHE H H 1 8.011 0.0015 . 1 . . . . 14 PHE H . 16735 1 61 . 1 1 14 14 PHE C C 13 175.780 0.0015 . 1 . . . . 14 PHE C . 16735 1 62 . 1 1 14 14 PHE CA C 13 57.925 0.0015 . 1 . . . . 14 PHE CA . 16735 1 63 . 1 1 14 14 PHE CB C 13 39.395 0.0015 . 1 . . . . 14 PHE CB . 16735 1 64 . 1 1 14 14 PHE N N 15 120.101 0.0015 . 1 . . . . 14 PHE N . 16735 1 65 . 1 1 15 15 ILE H H 1 7.989 0.0015 . 1 . . . . 15 ILE H . 16735 1 66 . 1 1 15 15 ILE CA C 13 61.166 0.0015 . 1 . . . . 15 ILE CA . 16735 1 67 . 1 1 15 15 ILE CB C 13 38.274 0.0015 . 1 . . . . 15 ILE CB . 16735 1 68 . 1 1 15 15 ILE N N 15 122.198 0.0015 . 1 . . . . 15 ILE N . 16735 1 69 . 1 1 16 16 HIS H H 1 8.266 0.0015 . 1 . . . . 16 HIS H . 16735 1 70 . 1 1 16 16 HIS C C 13 174.950 0.0015 . 1 . . . . 16 HIS C . 16735 1 71 . 1 1 16 16 HIS CA C 13 56.001 0.0015 . 1 . . . . 16 HIS CA . 16735 1 72 . 1 1 16 16 HIS CB C 13 30.173 0.0015 . 1 . . . . 16 HIS CB . 16735 1 73 . 1 1 16 16 HIS N N 15 122.914 0.0015 . 1 . . . . 16 HIS N . 16735 1 74 . 1 1 17 17 GLU H H 1 8.296 0.0015 . 1 . . . . 17 GLU H . 16735 1 75 . 1 1 17 17 GLU C C 13 176.087 0.0015 . 1 . . . . 17 GLU C . 16735 1 76 . 1 1 17 17 GLU CA C 13 56.714 0.0015 . 1 . . . . 17 GLU CA . 16735 1 77 . 1 1 17 17 GLU CB C 13 30.354 0.0015 . 1 . . . . 17 GLU CB . 16735 1 78 . 1 1 17 17 GLU N N 15 122.086 0.0015 . 1 . . . . 17 GLU N . 16735 1 79 . 1 1 18 18 PHE H H 1 8.381 0.0015 . 1 . . . . 18 PHE H . 16735 1 80 . 1 1 18 18 PHE C C 13 176.379 0.0015 . 1 . . . . 18 PHE C . 16735 1 81 . 1 1 18 18 PHE CA C 13 57.960 0.0015 . 1 . . . . 18 PHE CA . 16735 1 82 . 1 1 18 18 PHE CB C 13 39.299 0.0015 . 1 . . . . 18 PHE CB . 16735 1 83 . 1 1 18 18 PHE N N 15 120.618 0.0015 . 1 . . . . 18 PHE N . 16735 1 84 . 1 1 19 19 GLY H H 1 8.330 0.0015 . 1 . . . . 19 GLY H . 16735 1 85 . 1 1 19 19 GLY C C 13 173.783 0.0015 . 1 . . . . 19 GLY C . 16735 1 86 . 1 1 19 19 GLY CA C 13 45.387 0.0015 . 1 . . . . 19 GLY CA . 16735 1 87 . 1 1 19 19 GLY N N 15 109.928 0.0015 . 1 . . . . 19 GLY N . 16735 1 88 . 1 1 20 20 HIS H H 1 8.120 0.0015 . 1 . . . . 20 HIS H . 16735 1 89 . 1 1 20 20 HIS C C 13 174.490 0.0015 . 1 . . . . 20 HIS C . 16735 1 90 . 1 1 20 20 HIS CA C 13 55.574 0.0015 . 1 . . . . 20 HIS CA . 16735 1 91 . 1 1 20 20 HIS CB C 13 29.947 0.0015 . 1 . . . . 20 HIS CB . 16735 1 92 . 1 1 20 20 HIS N N 15 118.374 0.0015 . 1 . . . . 20 HIS N . 16735 1 93 . 1 1 21 21 ALA H H 1 8.391 0.0015 . 1 . . . . 21 ALA H . 16735 1 94 . 1 1 21 21 ALA C C 13 177.839 0.0015 . 1 . . . . 21 ALA C . 16735 1 95 . 1 1 21 21 ALA CA C 13 52.475 0.0015 . 1 . . . . 21 ALA CA . 16735 1 96 . 1 1 21 21 ALA CB C 13 19.234 0.0015 . 1 . . . . 21 ALA CB . 16735 1 97 . 1 1 21 21 ALA N N 15 125.187 0.0015 . 1 . . . . 21 ALA N . 16735 1 98 . 1 1 22 22 VAL H H 1 8.141 0.0015 . 1 . . . . 22 VAL H . 16735 1 99 . 1 1 22 22 VAL C C 13 175.964 0.0015 . 1 . . . . 22 VAL C . 16735 1 100 . 1 1 22 22 VAL CA C 13 62.840 0.0015 . 1 . . . . 22 VAL CA . 16735 1 101 . 1 1 22 22 VAL CB C 13 32.521 0.0015 . 1 . . . . 22 VAL CB . 16735 1 102 . 1 1 22 22 VAL N N 15 118.709 0.0015 . 1 . . . . 22 VAL N . 16735 1 103 . 1 1 23 23 ASP H H 1 8.215 0.0015 . 1 . . . . 23 ASP H . 16735 1 104 . 1 1 23 23 ASP C C 13 176.170 0.0015 . 1 . . . . 23 ASP C . 16735 1 105 . 1 1 23 23 ASP CA C 13 54.602 0.0015 . 1 . . . . 23 ASP CA . 16735 1 106 . 1 1 23 23 ASP CB C 13 40.977 0.0015 . 1 . . . . 23 ASP CB . 16735 1 107 . 1 1 23 23 ASP N N 15 121.772 0.0015 . 1 . . . . 23 ASP N . 16735 1 108 . 1 1 24 24 ASP H H 1 8.065 0.0015 . 1 . . . . 24 ASP H . 16735 1 109 . 1 1 24 24 ASP C C 13 176.385 0.0015 . 1 . . . . 24 ASP C . 16735 1 110 . 1 1 24 24 ASP CA C 13 54.631 0.0015 . 1 . . . . 24 ASP CA . 16735 1 111 . 1 1 24 24 ASP CB C 13 41.054 0.0015 . 1 . . . . 24 ASP CB . 16735 1 112 . 1 1 24 24 ASP N N 15 119.928 0.0015 . 1 . . . . 24 ASP N . 16735 1 113 . 1 1 25 25 TYR H H 1 8.135 0.0015 . 1 . . . . 25 TYR H . 16735 1 114 . 1 1 25 25 TYR C C 13 176.094 0.0015 . 1 . . . . 25 TYR C . 16735 1 115 . 1 1 25 25 TYR CA C 13 58.517 0.0015 . 1 . . . . 25 TYR CA . 16735 1 116 . 1 1 25 25 TYR CB C 13 38.164 0.0015 . 1 . . . . 25 TYR CB . 16735 1 117 . 1 1 25 25 TYR N N 15 120.541 0.0015 . 1 . . . . 25 TYR N . 16735 1 118 . 1 1 26 26 ALA H H 1 8.023 0.0015 . 1 . . . . 26 ALA H . 16735 1 119 . 1 1 26 26 ALA C C 13 178.591 0.0015 . 1 . . . . 26 ALA C . 16735 1 120 . 1 1 26 26 ALA CA C 13 53.900 0.0015 . 1 . . . . 26 ALA CA . 16735 1 121 . 1 1 26 26 ALA CB C 13 18.568 0.0015 . 1 . . . . 26 ALA CB . 16735 1 122 . 1 1 26 26 ALA N N 15 124.148 0.0015 . 1 . . . . 26 ALA N . 16735 1 123 . 1 1 27 27 GLY H H 1 7.967 0.0015 . 1 . . . . 27 GLY H . 16735 1 124 . 1 1 27 27 GLY C C 13 174.505 0.0015 . 1 . . . . 27 GLY C . 16735 1 125 . 1 1 27 27 GLY CA C 13 45.850 0.0015 . 1 . . . . 27 GLY CA . 16735 1 126 . 1 1 27 27 GLY N N 15 105.909 0.0015 . 1 . . . . 27 GLY N . 16735 1 127 . 1 1 28 28 TYR H H 1 7.668 0.0015 . 1 . . . . 28 TYR H . 16735 1 128 . 1 1 28 28 TYR C C 13 175.749 0.0015 . 1 . . . . 28 TYR C . 16735 1 129 . 1 1 28 28 TYR CA C 13 58.708 0.0015 . 1 . . . . 28 TYR CA . 16735 1 130 . 1 1 28 28 TYR CB C 13 38.494 0.0015 . 1 . . . . 28 TYR CB . 16735 1 131 . 1 1 28 28 TYR N N 15 119.851 0.0015 . 1 . . . . 28 TYR N . 16735 1 132 . 1 1 29 29 LEU H H 1 7.816 0.0015 . 1 . . . . 29 LEU H . 16735 1 133 . 1 1 29 29 LEU CA C 13 55.289 0.0015 . 1 . . . . 29 LEU CA . 16735 1 134 . 1 1 29 29 LEU CB C 13 42.014 0.0015 . 1 . . . . 29 LEU CB . 16735 1 135 . 1 1 29 29 LEU N N 15 120.875 0.0015 . 1 . . . . 29 LEU N . 16735 1 136 . 1 1 30 30 LEU H H 1 7.865 0.0015 . 1 . . . . 30 LEU H . 16735 1 137 . 1 1 30 30 LEU CA C 13 55.583 0.0015 . 1 . . . . 30 LEU CA . 16735 1 138 . 1 1 30 30 LEU CB C 13 42.464 0.0015 . 1 . . . . 30 LEU CB . 16735 1 139 . 1 1 30 30 LEU N N 15 121.666 0.0015 . 1 . . . . 30 LEU N . 16735 1 140 . 1 1 32 32 LYS C C 13 177.288 0.0015 . 1 . . . . 32 LYS C . 16735 1 141 . 1 1 32 32 LYS CA C 13 58.313 0.0015 . 1 . . . . 32 LYS CA . 16735 1 142 . 1 1 32 32 LYS CB C 13 32.253 0.0015 . 1 . . . . 32 LYS CB . 16735 1 143 . 1 1 33 33 ASN H H 1 8.325 0.0015 . 1 . . . . 33 ASN H . 16735 1 144 . 1 1 33 33 ASN CA C 13 55.090 0.0015 . 1 . . . . 33 ASN CA . 16735 1 145 . 1 1 33 33 ASN CB C 13 38.053 0.0015 . 1 . . . . 33 ASN CB . 16735 1 146 . 1 1 33 33 ASN N N 15 116.829 0.0015 . 1 . . . . 33 ASN N . 16735 1 147 . 1 1 34 34 GLN C C 13 177.379 0.0015 . 1 . . . . 34 GLN C . 16735 1 148 . 1 1 34 34 GLN CA C 13 57.497 0.0015 . 1 . . . . 34 GLN CA . 16735 1 149 . 1 1 34 34 GLN CB C 13 29.099 0.0015 . 1 . . . . 34 GLN CB . 16735 1 150 . 1 1 35 35 SER H H 1 8.328 0.0015 . 1 . . . . 35 SER H . 16735 1 151 . 1 1 35 35 SER CA C 13 60.988 0.0015 . 1 . . . . 35 SER CA . 16735 1 152 . 1 1 35 35 SER CB C 13 62.558 0.0015 . 1 . . . . 35 SER CB . 16735 1 153 . 1 1 35 35 SER N N 15 114.919 0.0015 . 1 . . . . 35 SER N . 16735 1 154 . 1 1 40 40 ASN C C 13 175.304 0.0015 . 1 . . . . 40 ASN C . 16735 1 155 . 1 1 40 40 ASN CA C 13 52.726 0.0015 . 1 . . . . 40 ASN CA . 16735 1 156 . 1 1 40 40 ASN CB C 13 38.762 0.0015 . 1 . . . . 40 ASN CB . 16735 1 157 . 1 1 41 41 SER H H 1 7.642 0.0015 . 1 . . . . 41 SER H . 16735 1 158 . 1 1 41 41 SER CA C 13 58.037 0.0015 . 1 . . . . 41 SER CA . 16735 1 159 . 1 1 41 41 SER CB C 13 64.415 0.0015 . 1 . . . . 41 SER CB . 16735 1 160 . 1 1 41 41 SER N N 15 115.872 0.0015 . 1 . . . . 41 SER N . 16735 1 161 . 1 1 46 46 ASP C C 13 179.798 0.0015 . 1 . . . . 46 ASP C . 16735 1 162 . 1 1 46 46 ASP CA C 13 57.462 0.0015 . 1 . . . . 46 ASP CA . 16735 1 163 . 1 1 46 46 ASP CB C 13 39.836 0.0015 . 1 . . . . 46 ASP CB . 16735 1 164 . 1 1 47 47 ILE H H 1 7.486 0.0015 . 1 . . . . 47 ILE H . 16735 1 165 . 1 1 47 47 ILE C C 13 177.531 0.0015 . 1 . . . . 47 ILE C . 16735 1 166 . 1 1 47 47 ILE CA C 13 65.938 0.0015 . 1 . . . . 47 ILE CA . 16735 1 167 . 1 1 47 47 ILE CB C 13 37.769 0.0015 . 1 . . . . 47 ILE CB . 16735 1 168 . 1 1 47 47 ILE N N 15 123.011 0.0015 . 1 . . . . 47 ILE N . 16735 1 169 . 1 1 48 48 PHE H H 1 8.820 0.0015 . 1 . . . . 48 PHE H . 16735 1 170 . 1 1 48 48 PHE C C 13 178.282 0.0015 . 1 . . . . 48 PHE C . 16735 1 171 . 1 1 48 48 PHE CA C 13 60.614 0.0015 . 1 . . . . 48 PHE CA . 16735 1 172 . 1 1 48 48 PHE CB C 13 38.494 0.0015 . 1 . . . . 48 PHE CB . 16735 1 173 . 1 1 48 48 PHE N N 15 122.251 0.0015 . 1 . . . . 48 PHE N . 16735 1 174 . 1 1 49 49 LYS H H 1 8.321 0.0015 . 1 . . . . 49 LYS H . 16735 1 175 . 1 1 49 49 LYS C C 13 177.301 0.0015 . 1 . . . . 49 LYS C . 16735 1 176 . 1 1 49 49 LYS CA C 13 59.565 0.0015 . 1 . . . . 49 LYS CA . 16735 1 177 . 1 1 49 49 LYS CB C 13 32.106 0.0015 . 1 . . . . 49 LYS CB . 16735 1 178 . 1 1 49 49 LYS N N 15 120.058 0.0015 . 1 . . . . 49 LYS N . 16735 1 179 . 1 1 50 50 GLU H H 1 7.160 0.0015 . 1 . . . . 50 GLU H . 16735 1 180 . 1 1 50 50 GLU C C 13 178.359 0.0015 . 1 . . . . 50 GLU C . 16735 1 181 . 1 1 50 50 GLU CA C 13 58.482 0.0015 . 1 . . . . 50 GLU CA . 16735 1 182 . 1 1 50 50 GLU CB C 13 31.328 0.0015 . 1 . . . . 50 GLU CB . 16735 1 183 . 1 1 50 50 GLU N N 15 117.170 0.0015 . 1 . . . . 50 GLU N . 16735 1 184 . 1 1 51 51 GLU H H 1 8.744 0.0015 . 1 . . . . 51 GLU H . 16735 1 185 . 1 1 51 51 GLU C C 13 177.163 0.0015 . 1 . . . . 51 GLU C . 16735 1 186 . 1 1 51 51 GLU CA C 13 56.717 0.0015 . 1 . . . . 51 GLU CA . 16735 1 187 . 1 1 51 51 GLU CB C 13 31.476 0.0015 . 1 . . . . 51 GLU CB . 16735 1 188 . 1 1 51 51 GLU N N 15 116.027 0.0015 . 1 . . . . 51 GLU N . 16735 1 189 . 1 1 52 52 GLY H H 1 7.735 0.0015 . 1 . . . . 52 GLY H . 16735 1 190 . 1 1 52 52 GLY C C 13 174.413 0.0015 . 1 . . . . 52 GLY C . 16735 1 191 . 1 1 52 52 GLY CA C 13 46.705 0.0015 . 1 . . . . 52 GLY CA . 16735 1 192 . 1 1 52 52 GLY N N 15 106.370 0.0015 . 1 . . . . 52 GLY N . 16735 1 193 . 1 1 53 53 SER H H 1 8.022 0.0015 . 1 . . . . 53 SER H . 16735 1 194 . 1 1 53 53 SER C C 13 176.087 0.0015 . 1 . . . . 53 SER C . 16735 1 195 . 1 1 53 53 SER CA C 13 57.946 0.0015 . 1 . . . . 53 SER CA . 16735 1 196 . 1 1 53 53 SER CB C 13 63.256 0.0015 . 1 . . . . 53 SER CB . 16735 1 197 . 1 1 53 53 SER N N 15 114.182 0.0015 . 1 . . . . 53 SER N . 16735 1 198 . 1 1 54 54 ASN H H 1 8.212 0.0015 . 1 . . . . 54 ASN H . 16735 1 199 . 1 1 54 54 ASN CA C 13 54.470 0.0015 . 1 . . . . 54 ASN CA . 16735 1 200 . 1 1 54 54 ASN CB C 13 38.225 0.0015 . 1 . . . . 54 ASN CB . 16735 1 201 . 1 1 54 54 ASN N N 15 118.332 0.0015 . 1 . . . . 54 ASN N . 16735 1 202 . 1 1 55 55 LEU H H 1 8.522 0.0015 . 1 . . . . 55 LEU H . 16735 1 203 . 1 1 55 55 LEU C C 13 176.057 0.0015 . 1 . . . . 55 LEU C . 16735 1 204 . 1 1 55 55 LEU CA C 13 54.327 0.0015 . 1 . . . . 55 LEU CA . 16735 1 205 . 1 1 55 55 LEU CB C 13 42.252 0.0015 . 1 . . . . 55 LEU CB . 16735 1 206 . 1 1 55 55 LEU N N 15 118.216 0.0015 . 1 . . . . 55 LEU N . 16735 1 207 . 1 1 56 56 THR H H 1 7.546 0.0015 . 1 . . . . 56 THR H . 16735 1 208 . 1 1 56 56 THR C C 13 175.027 0.0015 . 1 . . . . 56 THR C . 16735 1 209 . 1 1 56 56 THR CA C 13 60.489 0.0015 . 1 . . . . 56 THR CA . 16735 1 210 . 1 1 56 56 THR CB C 13 70.771 0.0015 . 1 . . . . 56 THR CB . 16735 1 211 . 1 1 56 56 THR N N 15 111.305 0.0015 . 1 . . . . 56 THR N . 16735 1 212 . 1 1 57 57 SER C C 13 175.084 0.0015 . 1 . . . . 57 SER C . 16735 1 213 . 1 1 57 57 SER CA C 13 59.634 0.0015 . 1 . . . . 57 SER CA . 16735 1 214 . 1 1 57 57 SER CB C 13 62.987 0.0015 . 1 . . . . 57 SER CB . 16735 1 215 . 1 1 58 58 TYR H H 1 7.882 0.0015 . 1 . . . . 58 TYR H . 16735 1 216 . 1 1 58 58 TYR C C 13 176.195 0.0015 . 1 . . . . 58 TYR C . 16735 1 217 . 1 1 58 58 TYR CA C 13 57.925 0.0015 . 1 . . . . 58 TYR CA . 16735 1 218 . 1 1 58 58 TYR CB C 13 38.427 0.0015 . 1 . . . . 58 TYR CB . 16735 1 219 . 1 1 58 58 TYR N N 15 120.229 0.0015 . 1 . . . . 58 TYR N . 16735 1 220 . 1 1 59 59 GLY H H 1 8.049 0.0015 . 1 . . . . 59 GLY H . 16735 1 221 . 1 1 59 59 GLY C C 13 172.800 0.0015 . 1 . . . . 59 GLY C . 16735 1 222 . 1 1 59 59 GLY CA C 13 45.245 0.0015 . 1 . . . . 59 GLY CA . 16735 1 223 . 1 1 59 59 GLY N N 15 109.115 0.0015 . 1 . . . . 59 GLY N . 16735 1 224 . 1 1 60 60 ARG H H 1 7.886 0.0015 . 1 . . . . 60 ARG H . 16735 1 225 . 1 1 60 60 ARG C C 13 176.948 0.0015 . 1 . . . . 60 ARG C . 16735 1 226 . 1 1 60 60 ARG CA C 13 56.144 0.0015 . 1 . . . . 60 ARG CA . 16735 1 227 . 1 1 60 60 ARG CB C 13 30.844 0.0015 . 1 . . . . 60 ARG CB . 16735 1 228 . 1 1 60 60 ARG N N 15 118.466 0.0015 . 1 . . . . 60 ARG N . 16735 1 229 . 1 1 61 61 THR H H 1 8.463 0.0015 . 1 . . . . 61 THR H . 16735 1 230 . 1 1 61 61 THR C C 13 174.182 0.0015 . 1 . . . . 61 THR C . 16735 1 231 . 1 1 61 61 THR CA C 13 61.949 0.0015 . 1 . . . . 61 THR CA . 16735 1 232 . 1 1 61 61 THR CB C 13 69.863 0.0015 . 1 . . . . 61 THR CB . 16735 1 233 . 1 1 61 61 THR N N 15 115.187 0.0015 . 1 . . . . 61 THR N . 16735 1 234 . 1 1 62 62 ASN H H 1 8.452 0.0015 . 1 . . . . 62 ASN H . 16735 1 235 . 1 1 62 62 ASN C C 13 173.584 0.0015 . 1 . . . . 62 ASN C . 16735 1 236 . 1 1 62 62 ASN CA C 13 52.475 0.0015 . 1 . . . . 62 ASN CA . 16735 1 237 . 1 1 62 62 ASN CB C 13 40.104 0.0015 . 1 . . . . 62 ASN CB . 16735 1 238 . 1 1 62 62 ASN N N 15 117.325 0.0015 . 1 . . . . 62 ASN N . 16735 1 239 . 1 1 63 63 GLU H H 1 10.030 0.0015 . 1 . . . . 63 GLU H . 16735 1 240 . 1 1 63 63 GLU C C 13 177.531 0.0015 . 1 . . . . 63 GLU C . 16735 1 241 . 1 1 63 63 GLU CA C 13 61.433 0.0015 . 1 . . . . 63 GLU CA . 16735 1 242 . 1 1 63 63 GLU CB C 13 28.814 0.0015 . 1 . . . . 63 GLU CB . 16735 1 243 . 1 1 63 63 GLU N N 15 120.688 0.0015 . 1 . . . . 63 GLU N . 16735 1 244 . 1 1 64 64 ALA H H 1 8.122 0.0015 . 1 . . . . 64 ALA H . 16735 1 245 . 1 1 64 64 ALA C C 13 181.096 0.0015 . 1 . . . . 64 ALA C . 16735 1 246 . 1 1 64 64 ALA CA C 13 55.574 0.0015 . 1 . . . . 64 ALA CA . 16735 1 247 . 1 1 64 64 ALA CB C 13 18.228 0.0015 . 1 . . . . 64 ALA CB . 16735 1 248 . 1 1 64 64 ALA N N 15 121.540 0.0015 . 1 . . . . 64 ALA N . 16735 1 249 . 1 1 65 65 GLU H H 1 8.463 0.0015 . 1 . . . . 65 GLU H . 16735 1 250 . 1 1 65 65 GLU C C 13 179.436 0.0015 . 1 . . . . 65 GLU C . 16735 1 251 . 1 1 65 65 GLU CA C 13 58.922 0.0015 . 1 . . . . 65 GLU CA . 16735 1 252 . 1 1 65 65 GLU CB C 13 29.367 0.0015 . 1 . . . . 65 GLU CB . 16735 1 253 . 1 1 65 65 GLU N N 15 119.884 0.0015 . 1 . . . . 65 GLU N . 16735 1 254 . 1 1 66 66 PHE H H 1 8.790 0.0015 . 1 . . . . 66 PHE H . 16735 1 255 . 1 1 66 66 PHE C C 13 176.517 0.0015 . 1 . . . . 66 PHE C . 16735 1 256 . 1 1 66 66 PHE CA C 13 61.878 0.0015 . 1 . . . . 66 PHE CA . 16735 1 257 . 1 1 66 66 PHE CB C 13 40.438 0.0015 . 1 . . . . 66 PHE CB . 16735 1 258 . 1 1 66 66 PHE N N 15 122.392 0.0015 . 1 . . . . 66 PHE N . 16735 1 259 . 1 1 67 67 PHE H H 1 8.665 0.0015 . 1 . . . . 67 PHE H . 16735 1 260 . 1 1 67 67 PHE C C 13 176.354 0.0015 . 1 . . . . 67 PHE C . 16735 1 261 . 1 1 67 67 PHE CA C 13 62.056 0.0015 . 1 . . . . 67 PHE CA . 16735 1 262 . 1 1 67 67 PHE CB C 13 39.272 0.0015 . 1 . . . . 67 PHE CB . 16735 1 263 . 1 1 67 67 PHE N N 15 118.354 0.0015 . 1 . . . . 67 PHE N . 16735 1 264 . 1 1 68 68 ALA H H 1 8.012 0.0015 . 1 . . . . 68 ALA H . 16735 1 265 . 1 1 68 68 ALA C C 13 180.312 0.0015 . 1 . . . . 68 ALA C . 16735 1 266 . 1 1 68 68 ALA CA C 13 55.289 0.0015 . 1 . . . . 68 ALA CA . 16735 1 267 . 1 1 68 68 ALA CB C 13 17.959 0.0015 . 1 . . . . 68 ALA CB . 16735 1 268 . 1 1 68 68 ALA N N 15 118.563 0.0015 . 1 . . . . 68 ALA N . 16735 1 269 . 1 1 69 69 GLU H H 1 8.201 0.0015 . 1 . . . . 69 GLU H . 16735 1 270 . 1 1 69 69 GLU C C 13 177.854 0.0015 . 1 . . . . 69 GLU C . 16735 1 271 . 1 1 69 69 GLU CA C 13 58.245 0.0015 . 1 . . . . 69 GLU CA . 16735 1 272 . 1 1 69 69 GLU CB C 13 29.099 0.0015 . 1 . . . . 69 GLU CB . 16735 1 273 . 1 1 69 69 GLU N N 15 120.308 0.0015 . 1 . . . . 69 GLU N . 16735 1 274 . 1 1 70 70 ALA H H 1 8.472 0.0015 . 1 . . . . 70 ALA H . 16735 1 275 . 1 1 70 70 ALA C C 13 178.899 0.0015 . 1 . . . . 70 ALA C . 16735 1 276 . 1 1 70 70 ALA CA C 13 55.431 0.0015 . 1 . . . . 70 ALA CA . 16735 1 277 . 1 1 70 70 ALA CB C 13 17.825 0.0015 . 1 . . . . 70 ALA CB . 16735 1 278 . 1 1 70 70 ALA N N 15 121.580 0.0015 . 1 . . . . 70 ALA N . 16735 1 279 . 1 1 71 71 PHE H H 1 8.662 0.0015 . 1 . . . . 71 PHE H . 16735 1 280 . 1 1 71 71 PHE C C 13 178.346 0.0015 . 1 . . . . 71 PHE C . 16735 1 281 . 1 1 71 71 PHE CA C 13 62.555 0.0015 . 1 . . . . 71 PHE CA . 16735 1 282 . 1 1 71 71 PHE CB C 13 39.366 0.0015 . 1 . . . . 71 PHE CB . 16735 1 283 . 1 1 71 71 PHE N N 15 117.264 0.0015 . 1 . . . . 71 PHE N . 16735 1 284 . 1 1 72 72 ARG H H 1 8.341 0.0015 . 1 . . . . 72 ARG H . 16735 1 285 . 1 1 72 72 ARG C C 13 180.005 0.0015 . 1 . . . . 72 ARG C . 16735 1 286 . 1 1 72 72 ARG CA C 13 59.634 0.0015 . 1 . . . . 72 ARG CA . 16735 1 287 . 1 1 72 72 ARG CB C 13 30.131 0.0015 . 1 . . . . 72 ARG CB . 16735 1 288 . 1 1 72 72 ARG N N 15 120.993 0.0015 . 1 . . . . 72 ARG N . 16735 1 289 . 1 1 73 73 LEU H H 1 8.400 0.0015 . 1 . . . . 73 LEU H . 16735 1 290 . 1 1 73 73 LEU C C 13 178.848 0.0015 . 1 . . . . 73 LEU C . 16735 1 291 . 1 1 73 73 LEU CA C 13 58.028 0.0015 . 1 . . . . 73 LEU CA . 16735 1 292 . 1 1 73 73 LEU CB C 13 42.144 0.0015 . 1 . . . . 73 LEU CB . 16735 1 293 . 1 1 73 73 LEU N N 15 120.319 0.0015 . 1 . . . . 73 LEU N . 16735 1 294 . 1 1 74 74 MET H H 1 8.122 0.0015 . 1 . . . . 74 MET H . 16735 1 295 . 1 1 74 74 MET C C 13 176.461 0.0015 . 1 . . . . 74 MET C . 16735 1 296 . 1 1 74 74 MET CA C 13 58.889 0.0015 . 1 . . . . 74 MET CA . 16735 1 297 . 1 1 74 74 MET CB C 13 33.796 0.0015 . 1 . . . . 74 MET CB . 16735 1 298 . 1 1 74 74 MET N N 15 113.853 0.0015 . 1 . . . . 74 MET N . 16735 1 299 . 1 1 75 75 HIS H H 1 7.184 0.0015 . 1 . . . . 75 HIS H . 16735 1 300 . 1 1 75 75 HIS C C 13 173.401 0.0015 . 1 . . . . 75 HIS C . 16735 1 301 . 1 1 75 75 HIS CA C 13 56.429 0.0015 . 1 . . . . 75 HIS CA . 16735 1 302 . 1 1 75 75 HIS CB C 13 28.294 0.0015 . 1 . . . . 75 HIS CB . 16735 1 303 . 1 1 75 75 HIS N N 15 114.291 0.0015 . 1 . . . . 75 HIS N . 16735 1 304 . 1 1 76 76 SER H H 1 7.174 0.0015 . 1 . . . . 76 SER H . 16735 1 305 . 1 1 76 76 SER C C 13 175.864 0.0015 . 1 . . . . 76 SER C . 16735 1 306 . 1 1 76 76 SER CA C 13 57.699 0.0015 . 1 . . . . 76 SER CA . 16735 1 307 . 1 1 76 76 SER CB C 13 63.994 0.0015 . 1 . . . . 76 SER CB . 16735 1 308 . 1 1 76 76 SER N N 15 115.777 0.0015 . 1 . . . . 76 SER N . 16735 1 309 . 1 1 77 77 THR H H 1 8.463 0.0015 . 1 . . . . 77 THR H . 16735 1 310 . 1 1 77 77 THR C C 13 174.395 0.0015 . 1 . . . . 77 THR C . 16735 1 311 . 1 1 77 77 THR CA C 13 63.410 0.0015 . 1 . . . . 77 THR CA . 16735 1 312 . 1 1 77 77 THR CB C 13 68.850 0.0015 . 1 . . . . 77 THR CB . 16735 1 313 . 1 1 77 77 THR N N 15 115.840 0.0015 . 1 . . . . 77 THR N . 16735 1 314 . 1 1 78 78 ASP H H 1 8.679 0.0015 . 1 . . . . 78 ASP H . 16735 1 315 . 1 1 78 78 ASP C C 13 176.966 0.0015 . 1 . . . . 78 ASP C . 16735 1 316 . 1 1 78 78 ASP CA C 13 53.046 0.0015 . 1 . . . . 78 ASP CA . 16735 1 317 . 1 1 78 78 ASP CB C 13 41.312 0.0015 . 1 . . . . 78 ASP CB . 16735 1 318 . 1 1 78 78 ASP N N 15 123.182 0.0015 . 1 . . . . 78 ASP N . 16735 1 319 . 1 1 79 79 HIS H H 1 9.013 0.0015 . 1 . . . . 79 HIS H . 16735 1 320 . 1 1 79 79 HIS C C 13 176.614 0.0015 . 1 . . . . 79 HIS C . 16735 1 321 . 1 1 79 79 HIS CA C 13 59.353 0.0015 . 1 . . . . 79 HIS CA . 16735 1 322 . 1 1 79 79 HIS CB C 13 29.703 0.0015 . 1 . . . . 79 HIS CB . 16735 1 323 . 1 1 79 79 HIS N N 15 126.994 0.0015 . 1 . . . . 79 HIS N . 16735 1 324 . 1 1 80 80 ALA H H 1 8.341 0.0015 . 1 . . . . 80 ALA H . 16735 1 325 . 1 1 80 80 ALA C C 13 181.465 0.0015 . 1 . . . . 80 ALA C . 16735 1 326 . 1 1 80 80 ALA CA C 13 54.933 0.0015 . 1 . . . . 80 ALA CA . 16735 1 327 . 1 1 80 80 ALA CB C 13 18.094 0.0015 . 1 . . . . 80 ALA CB . 16735 1 328 . 1 1 80 80 ALA N N 15 120.165 0.0015 . 1 . . . . 80 ALA N . 16735 1 329 . 1 1 81 81 GLU H H 1 7.666 0.0015 . 1 . . . . 81 GLU H . 16735 1 330 . 1 1 81 81 GLU C C 13 177.425 0.0015 . 1 . . . . 81 GLU C . 16735 1 331 . 1 1 81 81 GLU CA C 13 59.741 0.0015 . 1 . . . . 81 GLU CA . 16735 1 332 . 1 1 81 81 GLU CB C 13 28.965 0.0015 . 1 . . . . 81 GLU CB . 16735 1 333 . 1 1 81 81 GLU N N 15 118.820 0.0015 . 1 . . . . 81 GLU N . 16735 1 334 . 1 1 82 82 ARG H H 1 7.052 0.0015 . 1 . . . . 82 ARG H . 16735 1 335 . 1 1 82 82 ARG C C 13 179.430 0.0015 . 1 . . . . 82 ARG C . 16735 1 336 . 1 1 82 82 ARG CA C 13 59.705 0.0015 . 1 . . . . 82 ARG CA . 16735 1 337 . 1 1 82 82 ARG CB C 13 29.582 0.0015 . 1 . . . . 82 ARG CB . 16735 1 338 . 1 1 82 82 ARG N N 15 118.403 0.0015 . 1 . . . . 82 ARG N . 16735 1 339 . 1 1 83 83 LEU H H 1 7.734 0.0015 . 1 . . . . 83 LEU H . 16735 1 340 . 1 1 83 83 LEU C C 13 178.451 0.0015 . 1 . . . . 83 LEU C . 16735 1 341 . 1 1 83 83 LEU CA C 13 56.892 0.0015 . 1 . . . . 83 LEU CA . 16735 1 342 . 1 1 83 83 LEU CB C 13 41.648 0.0015 . 1 . . . . 83 LEU CB . 16735 1 343 . 1 1 83 83 LEU N N 15 118.034 0.0015 . 1 . . . . 83 LEU N . 16735 1 344 . 1 1 84 84 LYS H H 1 7.536 0.0015 . 1 . . . . 84 LYS H . 16735 1 345 . 1 1 84 84 LYS C C 13 178.879 0.0015 . 1 . . . . 84 LYS C . 16735 1 346 . 1 1 84 84 LYS CA C 13 59.777 0.0015 . 1 . . . . 84 LYS CA . 16735 1 347 . 1 1 84 84 LYS CB C 13 32.119 0.0015 . 1 . . . . 84 LYS CB . 16735 1 348 . 1 1 84 84 LYS N N 15 119.218 0.0015 . 1 . . . . 84 LYS N . 16735 1 349 . 1 1 85 85 VAL H H 1 7.304 0.0015 . 1 . . . . 85 VAL H . 16735 1 350 . 1 1 85 85 VAL C C 13 175.864 0.0015 . 1 . . . . 85 VAL C . 16735 1 351 . 1 1 85 85 VAL CA C 13 65.689 0.0015 . 1 . . . . 85 VAL CA . 16735 1 352 . 1 1 85 85 VAL CB C 13 31.356 0.0015 . 1 . . . . 85 VAL CB . 16735 1 353 . 1 1 85 85 VAL N N 15 116.850 0.0015 . 1 . . . . 85 VAL N . 16735 1 354 . 1 1 86 86 GLN H H 1 7.093 0.0015 . 1 . . . . 86 GLN H . 16735 1 355 . 1 1 86 86 GLN C C 13 176.951 0.0015 . 1 . . . . 86 GLN C . 16735 1 356 . 1 1 86 86 GLN CA C 13 59.456 0.0015 . 1 . . . . 86 GLN CA . 16735 1 357 . 1 1 86 86 GLN CB C 13 28.185 0.0015 . 1 . . . . 86 GLN CB . 16735 1 358 . 1 1 86 86 GLN N N 15 118.628 0.0015 . 1 . . . . 86 GLN N . 16735 1 359 . 1 1 87 87 LYS H H 1 7.995 0.0015 . 1 . . . . 87 LYS H . 16735 1 360 . 1 1 87 87 LYS C C 13 178.129 0.0015 . 1 . . . . 87 LYS C . 16735 1 361 . 1 1 87 87 LYS CA C 13 57.746 0.0015 . 1 . . . . 87 LYS CA . 16735 1 362 . 1 1 87 87 LYS CB C 13 32.924 0.0015 . 1 . . . . 87 LYS CB . 16735 1 363 . 1 1 87 87 LYS N N 15 113.309 0.0015 . 1 . . . . 87 LYS N . 16735 1 364 . 1 1 88 88 ASN H H 1 8.044 0.0015 . 1 . . . . 88 ASN H . 16735 1 365 . 1 1 88 88 ASN C C 13 174.564 0.0015 . 1 . . . . 88 ASN C . 16735 1 366 . 1 1 88 88 ASN CA C 13 54.461 0.0015 . 1 . . . . 88 ASN CA . 16735 1 367 . 1 1 88 88 ASN CB C 13 39.232 0.0015 . 1 . . . . 88 ASN CB . 16735 1 368 . 1 1 88 88 ASN N N 15 114.516 0.0015 . 1 . . . . 88 ASN N . 16735 1 369 . 1 1 89 89 ALA H H 1 8.468 0.0015 . 1 . . . . 89 ALA H . 16735 1 370 . 1 1 89 89 ALA C C 13 171.763 0.0015 . 1 . . . . 89 ALA C . 16735 1 371 . 1 1 89 89 ALA CA C 13 50.338 0.0015 . 1 . . . . 89 ALA CA . 16735 1 372 . 1 1 89 89 ALA CB C 13 18.362 0.0015 . 1 . . . . 89 ALA CB . 16735 1 373 . 1 1 89 89 ALA N N 15 123.978 0.0015 . 1 . . . . 89 ALA N . 16735 1 374 . 1 1 90 90 PRO CA C 13 65.486 0.0015 . 1 . . . . 90 PRO CA . 16735 1 375 . 1 1 90 90 PRO CB C 13 31.752 0.0015 . 1 . . . . 90 PRO CB . 16735 1 376 . 1 1 91 91 LYS H H 1 11.170 0.0015 . 1 . . . . 91 LYS H . 16735 1 377 . 1 1 91 91 LYS C C 13 180.800 0.0015 . 1 . . . . 91 LYS C . 16735 1 378 . 1 1 91 91 LYS CA C 13 60.525 0.0015 . 1 . . . . 91 LYS CA . 16735 1 379 . 1 1 91 91 LYS CB C 13 32.561 0.0015 . 1 . . . . 91 LYS CB . 16735 1 380 . 1 1 91 91 LYS N N 15 124.683 0.0015 . 1 . . . . 91 LYS N . 16735 1 381 . 1 1 92 92 THR H H 1 9.947 0.0015 . 1 . . . . 92 THR H . 16735 1 382 . 1 1 92 92 THR CA C 13 67.290 0.0015 . 1 . . . . 92 THR CA . 16735 1 383 . 1 1 92 92 THR CB C 13 69.071 0.0015 . 1 . . . . 92 THR CB . 16735 1 384 . 1 1 92 92 THR N N 15 125.754 0.0015 . 1 . . . . 92 THR N . 16735 1 385 . 1 1 93 93 PHE H H 1 8.954 0.0015 . 1 . . . . 93 PHE H . 16735 1 386 . 1 1 93 93 PHE C C 13 176.840 0.0015 . 1 . . . . 93 PHE C . 16735 1 387 . 1 1 93 93 PHE CA C 13 61.201 0.0015 . 1 . . . . 93 PHE CA . 16735 1 388 . 1 1 93 93 PHE CB C 13 39.970 0.0015 . 1 . . . . 93 PHE CB . 16735 1 389 . 1 1 93 93 PHE N N 15 122.064 0.0015 . 1 . . . . 93 PHE N . 16735 1 390 . 1 1 94 94 GLN H H 1 8.070 0.0015 . 1 . . . . 94 GLN H . 16735 1 391 . 1 1 94 94 GLN C C 13 177.255 0.0015 . 1 . . . . 94 GLN C . 16735 1 392 . 1 1 94 94 GLN CA C 13 58.601 0.0015 . 1 . . . . 94 GLN CA . 16735 1 393 . 1 1 94 94 GLN CB C 13 28.763 0.0015 . 1 . . . . 94 GLN CB . 16735 1 394 . 1 1 94 94 GLN N N 15 117.107 0.0015 . 1 . . . . 94 GLN N . 16735 1 395 . 1 1 95 95 PHE H H 1 8.557 0.0015 . 1 . . . . 95 PHE H . 16735 1 396 . 1 1 95 95 PHE C C 13 178.161 0.0015 . 1 . . . . 95 PHE C . 16735 1 397 . 1 1 95 95 PHE CA C 13 61.736 0.0015 . 1 . . . . 95 PHE CA . 16735 1 398 . 1 1 95 95 PHE CB C 13 40.028 0.0015 . 1 . . . . 95 PHE CB . 16735 1 399 . 1 1 95 95 PHE N N 15 120.073 0.0015 . 1 . . . . 95 PHE N . 16735 1 400 . 1 1 96 96 ILE H H 1 8.929 0.0015 . 1 . . . . 96 ILE H . 16735 1 401 . 1 1 96 96 ILE C C 13 177.624 0.0015 . 1 . . . . 96 ILE C . 16735 1 402 . 1 1 96 96 ILE CA C 13 66.793 0.0015 . 1 . . . . 96 ILE CA . 16735 1 403 . 1 1 96 96 ILE CB C 13 36.682 0.0015 . 1 . . . . 96 ILE CB . 16735 1 404 . 1 1 96 96 ILE N N 15 119.055 0.0015 . 1 . . . . 96 ILE N . 16735 1 405 . 1 1 97 97 ASN H H 1 7.877 0.0015 . 1 . . . . 97 ASN H . 16735 1 406 . 1 1 97 97 ASN C C 13 177.885 0.0015 . 1 . . . . 97 ASN C . 16735 1 407 . 1 1 97 97 ASN CA C 13 56.286 0.0015 . 1 . . . . 97 ASN CA . 16735 1 408 . 1 1 97 97 ASN CB C 13 37.638 0.0015 . 1 . . . . 97 ASN CB . 16735 1 409 . 1 1 97 97 ASN N N 15 117.544 0.0015 . 1 . . . . 97 ASN N . 16735 1 410 . 1 1 98 98 ASP H H 1 8.437 0.0015 . 1 . . . . 98 ASP H . 16735 1 411 . 1 1 98 98 ASP C C 13 178.177 0.0015 . 1 . . . . 98 ASP C . 16735 1 412 . 1 1 98 98 ASP CA C 13 56.785 0.0015 . 1 . . . . 98 ASP CA . 16735 1 413 . 1 1 98 98 ASP CB C 13 40.373 0.0015 . 1 . . . . 98 ASP CB . 16735 1 414 . 1 1 98 98 ASP N N 15 119.189 0.0015 . 1 . . . . 98 ASP N . 16735 1 415 . 1 1 99 99 GLN H H 1 7.963 0.0015 . 1 . . . . 99 GLN H . 16735 1 416 . 1 1 99 99 GLN C C 13 177.916 0.0015 . 1 . . . . 99 GLN C . 16735 1 417 . 1 1 99 99 GLN CA C 13 56.911 0.0015 . 1 . . . . 99 GLN CA . 16735 1 418 . 1 1 99 99 GLN CB C 13 28.800 0.0015 . 1 . . . . 99 GLN CB . 16735 1 419 . 1 1 99 99 GLN N N 15 117.840 0.0015 . 1 . . . . 99 GLN N . 16735 1 420 . 1 1 100 100 ILE H H 1 7.899 0.0015 . 1 . . . . 100 ILE H . 16735 1 421 . 1 1 100 100 ILE CA C 13 63.725 0.0015 . 1 . . . . 100 ILE CA . 16735 1 422 . 1 1 100 100 ILE CB C 13 39.745 0.0015 . 1 . . . . 100 ILE CB . 16735 1 423 . 1 1 100 100 ILE N N 15 119.221 0.0015 . 1 . . . . 100 ILE N . 16735 1 424 . 1 1 102 102 PHE C C 13 176.630 0.0015 . 1 . . . . 102 PHE C . 16735 1 425 . 1 1 102 102 PHE CA C 13 58.798 0.0015 . 1 . . . . 102 PHE CA . 16735 1 426 . 1 1 102 102 PHE CB C 13 39.045 0.0015 . 1 . . . . 102 PHE CB . 16735 1 427 . 1 1 103 103 ILE H H 1 7.869 0.0015 . 1 . . . . 103 ILE H . 16735 1 428 . 1 1 103 103 ILE C C 13 176.825 0.0015 . 1 . . . . 103 ILE C . 16735 1 429 . 1 1 103 103 ILE CA C 13 62.626 0.0015 . 1 . . . . 103 ILE CA . 16735 1 430 . 1 1 103 103 ILE CB C 13 32.620 0.0015 . 1 . . . . 103 ILE CB . 16735 1 431 . 1 1 103 103 ILE N N 15 119.540 0.0015 . 1 . . . . 103 ILE N . 16735 1 432 . 1 1 105 105 ASN H H 1 8.037 0.0015 . 1 . . . . 105 ASN H . 16735 1 433 . 1 1 105 105 ASN CA C 13 53.330 0.0015 . 1 . . . . 105 ASN CA . 16735 1 434 . 1 1 105 105 ASN CB C 13 38.963 0.0015 . 1 . . . . 105 ASN CB . 16735 1 435 . 1 1 105 105 ASN N N 15 120.826 0.0015 . 1 . . . . 105 ASN N . 16735 1 436 . 1 1 106 106 SER H H 1 7.723 0.0015 . 1 . . . . 106 SER H . 16735 1 437 . 1 1 106 106 SER C C 13 178.591 0.0015 . 1 . . . . 106 SER C . 16735 1 438 . 1 1 106 106 SER CA C 13 60.168 0.0015 . 1 . . . . 106 SER CA . 16735 1 439 . 1 1 106 106 SER CB C 13 64.799 0.0015 . 1 . . . . 106 SER CB . 16735 1 440 . 1 1 106 106 SER N N 15 121.544 0.0015 . 1 . . . . 106 SER N . 16735 1 stop_ save_