################################### # 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_backbone_chemical_shift_oleate_-free_jug_r_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode backbone_chemical_shift_oleate_-free_jug_r_3 _Assigned_chem_shift_list.Entry_ID 27637 _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 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _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 'backbone chemical shifts of apo jug r 3 protein' _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' . . . 27637 1 4 '3D HNCACB' . . . 27637 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.Ambiguity_set_ID _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 2 2 ALA H H 1 8.681 0.020 . 1 . . . . . 2 ALA H . 27637 1 2 . 1 1 2 2 ALA C C 13 174.398 0.3 . 1 . . . . . 2 ALA C . 27637 1 3 . 1 1 2 2 ALA CA C 13 49.817 0.3 . 1 . . . . . 2 ALA CA . 27637 1 4 . 1 1 2 2 ALA CB C 13 16.169 0.3 . 1 . . . . . 2 ALA CB . 27637 1 5 . 1 1 2 2 ALA N N 15 125.434 0.3 . 1 . . . . . 2 ALA N . 27637 1 6 . 1 1 3 3 GLU H H 1 8.414 0.020 . 1 . . . . . 3 GLU H . 27637 1 7 . 1 1 3 3 GLU C C 13 173.508 0.3 . 1 . . . . . 3 GLU C . 27637 1 8 . 1 1 3 3 GLU CA C 13 54.199 0.3 . 1 . . . . . 3 GLU CA . 27637 1 9 . 1 1 3 3 GLU CB C 13 27.272 0.3 . 1 . . . . . 3 GLU CB . 27637 1 10 . 1 1 3 3 GLU N N 15 120.369 0.3 . 1 . . . . . 3 GLU N . 27637 1 11 . 1 1 4 4 PHE H H 1 8.194 0.020 . 1 . . . . . 4 PHE H . 27637 1 12 . 1 1 4 4 PHE C C 13 172.345 0.3 . 1 . . . . . 4 PHE C . 27637 1 13 . 1 1 4 4 PHE CA C 13 54.919 0.3 . 1 . . . . . 4 PHE CA . 27637 1 14 . 1 1 4 4 PHE CB C 13 36.581 0.3 . 1 . . . . . 4 PHE CB . 27637 1 15 . 1 1 4 4 PHE N N 15 120.645 0.3 . 1 . . . . . 4 PHE N . 27637 1 16 . 1 1 5 5 VAL H H 1 7.808 0.020 . 1 . . . . . 5 VAL H . 27637 1 17 . 1 1 5 5 VAL C C 13 173.319 0.3 . 1 . . . . . 5 VAL C . 27637 1 18 . 1 1 5 5 VAL CA C 13 59.204 0.3 . 1 . . . . . 5 VAL CA . 27637 1 19 . 1 1 5 5 VAL N N 15 121.710 0.3 . 1 . . . . . 5 VAL N . 27637 1 20 . 1 1 6 6 ILE H H 1 8.015 0.020 . 1 . . . . . 6 ILE H . 27637 1 21 . 1 1 6 6 ILE C C 13 172.631 0.3 . 1 . . . . . 6 ILE C . 27637 1 22 . 1 1 6 6 ILE CA C 13 58.940 0.3 . 1 . . . . . 6 ILE CA . 27637 1 23 . 1 1 6 6 ILE CB C 13 34.920 0.3 . 1 . . . . . 6 ILE CB . 27637 1 24 . 1 1 6 6 ILE N N 15 124.165 0.3 . 1 . . . . . 6 ILE N . 27637 1 25 . 1 1 7 7 THR H H 1 7.685 0.020 . 1 . . . . . 7 THR H . 27637 1 26 . 1 1 7 7 THR CA C 13 57.670 0.3 . 1 . . . . . 7 THR CA . 27637 1 27 . 1 1 7 7 THR N N 15 114.806 0.3 . 1 . . . . . 7 THR N . 27637 1 28 . 1 1 12 12 ALA H H 1 8.372 0.020 . 1 . . . . . 12 ALA H . 27637 1 29 . 1 1 12 12 ALA CA C 13 52.430 0.3 . 1 . . . . . 12 ALA CA . 27637 1 30 . 1 1 12 12 ALA CB C 13 15.247 0.3 . 1 . . . . . 12 ALA CB . 27637 1 31 . 1 1 12 12 ALA N N 15 121.180 0.3 . 1 . . . . . 12 ALA N . 27637 1 32 . 1 1 13 13 SER H H 1 7.920 0.020 . 1 . . . . . 13 SER H . 27637 1 33 . 1 1 13 13 SER C C 13 174.694 0.3 . 1 . . . . . 13 SER C . 27637 1 34 . 1 1 13 13 SER CA C 13 58.345 0.3 . 1 . . . . . 13 SER CA . 27637 1 35 . 1 1 13 13 SER CB C 13 60.031 0.3 . 1 . . . . . 13 SER CB . 27637 1 36 . 1 1 13 13 SER N N 15 112.175 0.3 . 1 . . . . . 13 SER N . 27637 1 37 . 1 1 14 14 SER H H 1 7.957 0.020 . 1 . . . . . 14 SER H . 27637 1 38 . 1 1 14 14 SER C C 13 173.359 0.3 . 1 . . . . . 14 SER C . 27637 1 39 . 1 1 14 14 SER CA C 13 59.659 0.3 . 1 . . . . . 14 SER CA . 27637 1 40 . 1 1 14 14 SER CB C 13 60.249 0.3 . 1 . . . . . 14 SER CB . 27637 1 41 . 1 1 14 14 SER N N 15 118.001 0.3 . 1 . . . . . 14 SER N . 27637 1 42 . 1 1 17 17 SER H H 1 8.455 0.020 . 1 . . . . . 17 SER H . 27637 1 43 . 1 1 17 17 SER C C 13 172.672 0.3 . 1 . . . . . 17 SER C . 27637 1 44 . 1 1 17 17 SER CA C 13 57.165 0.3 . 1 . . . . . 17 SER CA . 27637 1 45 . 1 1 17 17 SER N N 15 114.496 0.3 . 1 . . . . . 17 SER N . 27637 1 46 . 1 1 18 18 CYS H H 1 8.428 0.020 . 1 . . . . . 18 CYS H . 27637 1 47 . 1 1 18 18 CYS C C 13 172.699 0.3 . 1 . . . . . 18 CYS C . 27637 1 48 . 1 1 18 18 CYS CA C 13 51.654 0.3 . 1 . . . . . 18 CYS CA . 27637 1 49 . 1 1 18 18 CYS CB C 13 39.941 0.3 . 1 . . . . . 18 CYS CB . 27637 1 50 . 1 1 18 18 CYS N N 15 117.594 0.3 . 1 . . . . . 18 CYS N . 27637 1 51 . 1 1 19 19 ILE H H 1 7.316 0.020 . 1 . . . . . 19 ILE H . 27637 1 52 . 1 1 19 19 ILE C C 13 173.548 0.3 . 1 . . . . . 19 ILE C . 27637 1 53 . 1 1 19 19 ILE CA C 13 63.122 0.3 . 1 . . . . . 19 ILE CA . 27637 1 54 . 1 1 19 19 ILE CB C 13 33.543 0.3 . 1 . . . . . 19 ILE CB . 27637 1 55 . 1 1 19 19 ILE N N 15 118.738 0.3 . 1 . . . . . 19 ILE N . 27637 1 56 . 1 1 20 20 GLY H H 1 8.379 0.020 . 1 . . . . . 20 GLY H . 27637 1 57 . 1 1 20 20 GLY C C 13 173.993 0.3 . 1 . . . . . 20 GLY C . 27637 1 58 . 1 1 20 20 GLY CA C 13 44.848 0.3 . 1 . . . . . 20 GLY CA . 27637 1 59 . 1 1 20 20 GLY N N 15 108.006 0.3 . 1 . . . . . 20 GLY N . 27637 1 60 . 1 1 21 21 TYR H H 1 8.671 0.020 . 1 . . . . . 21 TYR H . 27637 1 61 . 1 1 21 21 TYR C C 13 175.557 0.3 . 1 . . . . . 21 TYR C . 27637 1 62 . 1 1 21 21 TYR CA C 13 58.580 0.3 . 1 . . . . . 21 TYR CA . 27637 1 63 . 1 1 21 21 TYR CB C 13 35.007 0.3 . 1 . . . . . 21 TYR CB . 27637 1 64 . 1 1 21 21 TYR N N 15 124.169 0.3 . 1 . . . . . 21 TYR N . 27637 1 65 . 1 1 22 22 LEU H H 1 8.170 0.020 . 1 . . . . . 22 LEU H . 27637 1 66 . 1 1 22 22 LEU C C 13 174.236 0.3 . 1 . . . . . 22 LEU C . 27637 1 67 . 1 1 22 22 LEU CA C 13 54.435 0.3 . 1 . . . . . 22 LEU CA . 27637 1 68 . 1 1 22 22 LEU CB C 13 39.250 0.3 . 1 . . . . . 22 LEU CB . 27637 1 69 . 1 1 22 22 LEU N N 15 118.332 0.3 . 1 . . . . . 22 LEU N . 27637 1 70 . 1 1 23 23 ARG H H 1 7.883 0.020 . 1 . . . . . 23 ARG H . 27637 1 71 . 1 1 23 23 ARG C C 13 174.455 0.3 . 1 . . . . . 23 ARG C . 27637 1 72 . 1 1 23 23 ARG CA C 13 53.414 0.3 . 1 . . . . . 23 ARG CA . 27637 1 73 . 1 1 23 23 ARG CB C 13 28.623 0.3 . 1 . . . . . 23 ARG CB . 27637 1 74 . 1 1 23 23 ARG N N 15 115.060 0.3 . 1 . . . . . 23 ARG N . 27637 1 75 . 1 1 24 24 GLY H H 1 7.845 0.020 . 1 . . . . . 24 GLY H . 27637 1 76 . 1 1 24 24 GLY C C 13 173.063 0.3 . 1 . . . . . 24 GLY C . 27637 1 77 . 1 1 24 24 GLY CA C 13 42.557 0.3 . 1 . . . . . 24 GLY CA . 27637 1 78 . 1 1 24 24 GLY N N 15 107.798 0.3 . 1 . . . . . 24 GLY N . 27637 1 79 . 1 1 25 25 THR H H 1 8.136 0.020 . 1 . . . . . 25 THR H . 27637 1 80 . 1 1 25 25 THR C C 13 171.566 0.3 . 1 . . . . . 25 THR C . 27637 1 81 . 1 1 25 25 THR CA C 13 60.615 0.3 . 1 . . . . . 25 THR CA . 27637 1 82 . 1 1 25 25 THR CB C 13 66.173 0.3 . 1 . . . . . 25 THR CB . 27637 1 83 . 1 1 25 25 THR N N 15 111.722 0.3 . 1 . . . . . 25 THR N . 27637 1 84 . 1 1 26 26 VAL H H 1 6.797 0.020 . 1 . . . . . 26 VAL H . 27637 1 85 . 1 1 26 26 VAL C C 13 173.009 0.3 . 1 . . . . . 26 VAL C . 27637 1 86 . 1 1 26 26 VAL CA C 13 55.345 0.3 . 1 . . . . . 26 VAL CA . 27637 1 87 . 1 1 26 26 VAL CB C 13 31.449 0.3 . 1 . . . . . 26 VAL CB . 27637 1 88 . 1 1 26 26 VAL N N 15 116.392 0.3 . 1 . . . . . 26 VAL N . 27637 1 89 . 1 1 28 28 THR H H 1 7.037 0.020 . 1 . . . . . 28 THR H . 27637 1 90 . 1 1 28 28 THR C C 13 170.339 0.3 . 1 . . . . . 28 THR C . 27637 1 91 . 1 1 28 28 THR CA C 13 56.398 0.3 . 1 . . . . . 28 THR CA . 27637 1 92 . 1 1 28 28 THR CB C 13 68.126 0.3 . 1 . . . . . 28 THR CB . 27637 1 93 . 1 1 28 28 THR N N 15 110.196 0.3 . 1 . . . . . 28 THR N . 27637 1 94 . 1 1 29 29 VAL H H 1 8.295 0.020 . 1 . . . . . 29 VAL H . 27637 1 95 . 1 1 29 29 VAL C C 13 171.324 0.3 . 1 . . . . . 29 VAL C . 27637 1 96 . 1 1 29 29 VAL CA C 13 57.045 0.3 . 1 . . . . . 29 VAL CA . 27637 1 97 . 1 1 29 29 VAL CB C 13 29.085 0.3 . 1 . . . . . 29 VAL CB . 27637 1 98 . 1 1 29 29 VAL N N 15 124.813 0.3 . 1 . . . . . 29 VAL N . 27637 1 99 . 1 1 32 32 SER H H 1 8.436 0.020 . 1 . . . . . 32 SER H . 27637 1 100 . 1 1 32 32 SER C C 13 174.357 0.3 . 1 . . . . . 32 SER C . 27637 1 101 . 1 1 32 32 SER CA C 13 58.177 0.3 . 1 . . . . . 32 SER CA . 27637 1 102 . 1 1 32 32 SER CB C 13 59.026 0.3 . 1 . . . . . 32 SER CB . 27637 1 103 . 1 1 32 32 SER N N 15 110.697 0.3 . 1 . . . . . 32 SER N . 27637 1 104 . 1 1 33 33 CYS H H 1 7.486 0.020 . 1 . . . . . 33 CYS H . 27637 1 105 . 1 1 33 33 CYS C C 13 172.861 0.3 . 1 . . . . . 33 CYS C . 27637 1 106 . 1 1 33 33 CYS CA C 13 55.862 0.3 . 1 . . . . . 33 CYS CA . 27637 1 107 . 1 1 33 33 CYS CB C 13 35.904 0.3 . 1 . . . . . 33 CYS CB . 27637 1 108 . 1 1 33 33 CYS N N 15 122.236 0.3 . 1 . . . . . 33 CYS N . 27637 1 109 . 1 1 34 34 CYS H H 1 6.960 0.020 . 1 . . . . . 34 CYS H . 27637 1 110 . 1 1 34 34 CYS C C 13 174.735 0.3 . 1 . . . . . 34 CYS C . 27637 1 111 . 1 1 34 34 CYS CA C 13 51.862 0.3 . 1 . . . . . 34 CYS CA . 27637 1 112 . 1 1 34 34 CYS N N 15 116.047 0.3 . 1 . . . . . 34 CYS N . 27637 1 113 . 1 1 35 35 ASN H H 1 8.808 0.020 . 1 . . . . . 35 ASN H . 27637 1 114 . 1 1 35 35 ASN C C 13 175.503 0.3 . 1 . . . . . 35 ASN C . 27637 1 115 . 1 1 35 35 ASN CA C 13 53.527 0.3 . 1 . . . . . 35 ASN CA . 27637 1 116 . 1 1 35 35 ASN CB C 13 34.704 0.3 . 1 . . . . . 35 ASN CB . 27637 1 117 . 1 1 35 35 ASN N N 15 119.232 0.3 . 1 . . . . . 35 ASN N . 27637 1 118 . 1 1 36 36 GLY H H 1 7.881 0.020 . 1 . . . . . 36 GLY H . 27637 1 119 . 1 1 36 36 GLY C C 13 173.090 0.3 . 1 . . . . . 36 GLY C . 27637 1 120 . 1 1 36 36 GLY CA C 13 44.660 0.3 . 1 . . . . . 36 GLY CA . 27637 1 121 . 1 1 36 36 GLY N N 15 111.029 0.3 . 1 . . . . . 36 GLY N . 27637 1 122 . 1 1 37 37 VAL H H 1 8.252 0.020 . 1 . . . . . 37 VAL H . 27637 1 123 . 1 1 37 37 VAL C C 13 175.382 0.3 . 1 . . . . . 37 VAL C . 27637 1 124 . 1 1 37 37 VAL CA C 13 64.243 0.3 . 1 . . . . . 37 VAL CA . 27637 1 125 . 1 1 37 37 VAL CB C 13 28.715 0.3 . 1 . . . . . 37 VAL CB . 27637 1 126 . 1 1 37 37 VAL N N 15 122.130 0.3 . 1 . . . . . 37 VAL N . 27637 1 127 . 1 1 38 38 LYS H H 1 8.395 0.020 . 1 . . . . . 38 LYS H . 27637 1 128 . 1 1 38 38 LYS C C 13 176.770 0.3 . 1 . . . . . 38 LYS C . 27637 1 129 . 1 1 38 38 LYS CA C 13 57.637 0.3 . 1 . . . . . 38 LYS CA . 27637 1 130 . 1 1 38 38 LYS CB C 13 29.612 0.3 . 1 . . . . . 38 LYS CB . 27637 1 131 . 1 1 38 38 LYS N N 15 119.265 0.3 . 1 . . . . . 38 LYS N . 27637 1 132 . 1 1 39 39 SER H H 1 8.184 0.020 . 1 . . . . . 39 SER H . 27637 1 133 . 1 1 39 39 SER C C 13 173.885 0.3 . 1 . . . . . 39 SER C . 27637 1 134 . 1 1 39 39 SER CA C 13 59.041 0.3 . 1 . . . . . 39 SER CA . 27637 1 135 . 1 1 39 39 SER CB C 13 59.866 0.3 . 1 . . . . . 39 SER CB . 27637 1 136 . 1 1 39 39 SER N N 15 115.697 0.3 . 1 . . . . . 39 SER N . 27637 1 137 . 1 1 40 40 LEU H H 1 7.987 0.020 . 1 . . . . . 40 LEU H . 27637 1 138 . 1 1 40 40 LEU CA C 13 54.566 0.3 . 1 . . . . . 40 LEU CA . 27637 1 139 . 1 1 40 40 LEU N N 15 122.982 0.3 . 1 . . . . . 40 LEU N . 27637 1 140 . 1 1 41 41 ASN H H 1 7.717 0.020 . 1 . . . . . 41 ASN H . 27637 1 141 . 1 1 41 41 ASN C C 13 173.885 0.3 . 1 . . . . . 41 ASN C . 27637 1 142 . 1 1 41 41 ASN CA C 13 52.388 0.3 . 1 . . . . . 41 ASN CA . 27637 1 143 . 1 1 41 41 ASN CB C 13 36.732 0.3 . 1 . . . . . 41 ASN CB . 27637 1 144 . 1 1 41 41 ASN N N 15 116.116 0.3 . 1 . . . . . 41 ASN N . 27637 1 145 . 1 1 42 42 LYS H H 1 7.711 0.020 . 1 . . . . . 42 LYS H . 27637 1 146 . 1 1 42 42 LYS C C 13 174.869 0.3 . 1 . . . . . 42 LYS C . 27637 1 147 . 1 1 42 42 LYS CA C 13 55.041 0.3 . 1 . . . . . 42 LYS CA . 27637 1 148 . 1 1 42 42 LYS CB C 13 29.846 0.3 . 1 . . . . . 42 LYS CB . 27637 1 149 . 1 1 42 42 LYS N N 15 118.278 0.3 . 1 . . . . . 42 LYS N . 27637 1 150 . 1 1 43 43 ALA H H 1 7.868 0.020 . 1 . . . . . 43 ALA H . 27637 1 151 . 1 1 43 43 ALA C C 13 175.190 0.3 . 1 . . . . . 43 ALA C . 27637 1 152 . 1 1 43 43 ALA CA C 13 50.727 0.3 . 1 . . . . . 43 ALA CA . 27637 1 153 . 1 1 43 43 ALA CB C 13 15.787 0.3 . 1 . . . . . 43 ALA CB . 27637 1 154 . 1 1 43 43 ALA N N 15 120.543 0.3 . 1 . . . . . 43 ALA N . 27637 1 155 . 1 1 44 44 ALA H H 1 7.489 0.020 . 1 . . . . . 44 ALA H . 27637 1 156 . 1 1 44 44 ALA C C 13 172.807 0.3 . 1 . . . . . 44 ALA C . 27637 1 157 . 1 1 44 44 ALA CA C 13 48.426 0.3 . 1 . . . . . 44 ALA CA . 27637 1 158 . 1 1 44 44 ALA CB C 13 14.231 0.3 . 1 . . . . . 44 ALA CB . 27637 1 159 . 1 1 44 44 ALA N N 15 119.972 0.3 . 1 . . . . . 44 ALA N . 27637 1 160 . 1 1 45 45 ALA H H 1 8.193 0.020 . 1 . . . . . 45 ALA H . 27637 1 161 . 1 1 45 45 ALA C C 13 175.287 0.3 . 1 . . . . . 45 ALA C . 27637 1 162 . 1 1 45 45 ALA CA C 13 50.660 0.3 . 1 . . . . . 45 ALA CA . 27637 1 163 . 1 1 45 45 ALA CB C 13 17.642 0.3 . 1 . . . . . 45 ALA CB . 27637 1 164 . 1 1 45 45 ALA N N 15 126.148 0.3 . 1 . . . . . 45 ALA N . 27637 1 165 . 1 1 46 46 THR H H 1 8.022 0.020 . 1 . . . . . 46 THR H . 27637 1 166 . 1 1 46 46 THR C C 13 172.766 0.3 . 1 . . . . . 46 THR C . 27637 1 167 . 1 1 46 46 THR CA C 13 56.792 0.3 . 1 . . . . . 46 THR CA . 27637 1 168 . 1 1 46 46 THR CB C 13 70.034 0.3 . 1 . . . . . 46 THR CB . 27637 1 169 . 1 1 46 46 THR N N 15 108.645 0.3 . 1 . . . . . 46 THR N . 27637 1 170 . 1 1 47 47 THR H H 1 8.802 0.020 . 1 . . . . . 47 THR H . 27637 1 171 . 1 1 47 47 THR C C 13 173.012 0.3 . 1 . . . . . 47 THR C . 27637 1 172 . 1 1 47 47 THR CA C 13 65.126 0.3 . 1 . . . . . 47 THR CA . 27637 1 173 . 1 1 47 47 THR CB C 13 66.232 0.3 . 1 . . . . . 47 THR CB . 27637 1 174 . 1 1 47 47 THR N N 15 119.703 0.3 . 1 . . . . . 47 THR N . 27637 1 175 . 1 1 48 48 ALA H H 1 8.412 0.020 . 1 . . . . . 48 ALA H . 27637 1 176 . 1 1 48 48 ALA C C 13 178.213 0.3 . 1 . . . . . 48 ALA C . 27637 1 177 . 1 1 48 48 ALA CA C 13 52.636 0.3 . 1 . . . . . 48 ALA CA . 27637 1 178 . 1 1 48 48 ALA CB C 13 15.253 0.3 . 1 . . . . . 48 ALA CB . 27637 1 179 . 1 1 48 48 ALA N N 15 121.667 0.3 . 1 . . . . . 48 ALA N . 27637 1 180 . 1 1 49 49 ASP H H 1 7.812 0.020 . 1 . . . . . 49 ASP H . 27637 1 181 . 1 1 49 49 ASP C C 13 175.854 0.3 . 1 . . . . . 49 ASP C . 27637 1 182 . 1 1 49 49 ASP CA C 13 54.766 0.3 . 1 . . . . . 49 ASP CA . 27637 1 183 . 1 1 49 49 ASP CB C 13 39.132 0.3 . 1 . . . . . 49 ASP CB . 27637 1 184 . 1 1 49 49 ASP N N 15 117.986 0.3 . 1 . . . . . 49 ASP N . 27637 1 185 . 1 1 50 50 ARG H H 1 8.242 0.020 . 1 . . . . . 50 ARG H . 27637 1 186 . 1 1 50 50 ARG C C 13 175.988 0.3 . 1 . . . . . 50 ARG C . 27637 1 187 . 1 1 50 50 ARG CA C 13 57.880 0.3 . 1 . . . . . 50 ARG CA . 27637 1 188 . 1 1 50 50 ARG CB C 13 28.898 0.3 . 1 . . . . . 50 ARG CB . 27637 1 189 . 1 1 50 50 ARG N N 15 120.666 0.3 . 1 . . . . . 50 ARG N . 27637 1 190 . 1 1 51 51 GLN H H 1 8.547 0.020 . 1 . . . . . 51 GLN H . 27637 1 191 . 1 1 51 51 GLN C C 13 175.503 0.3 . 1 . . . . . 51 GLN C . 27637 1 192 . 1 1 51 51 GLN CA C 13 57.458 0.3 . 1 . . . . . 51 GLN CA . 27637 1 193 . 1 1 51 51 GLN CB C 13 24.126 0.3 . 1 . . . . . 51 GLN CB . 27637 1 194 . 1 1 51 51 GLN N N 15 118.080 0.3 . 1 . . . . . 51 GLN N . 27637 1 195 . 1 1 52 52 ALA H H 1 7.879 0.020 . 1 . . . . . 52 ALA H . 27637 1 196 . 1 1 52 52 ALA C C 13 177.701 0.3 . 1 . . . . . 52 ALA C . 27637 1 197 . 1 1 52 52 ALA CA C 13 52.248 0.3 . 1 . . . . . 52 ALA CA . 27637 1 198 . 1 1 52 52 ALA CB C 13 15.379 0.3 . 1 . . . . . 52 ALA CB . 27637 1 199 . 1 1 52 52 ALA N N 15 121.183 0.3 . 1 . . . . . 52 ALA N . 27637 1 200 . 1 1 53 53 ALA H H 1 8.392 0.020 . 1 . . . . . 53 ALA H . 27637 1 201 . 1 1 53 53 ALA C C 13 175.624 0.3 . 1 . . . . . 53 ALA C . 27637 1 202 . 1 1 53 53 ALA CA C 13 53.040 0.3 . 1 . . . . . 53 ALA CA . 27637 1 203 . 1 1 53 53 ALA N N 15 121.806 0.3 . 1 . . . . . 53 ALA N . 27637 1 204 . 1 1 54 54 CYS H H 1 7.764 0.020 . 1 . . . . . 54 CYS H . 27637 1 205 . 1 1 54 54 CYS C C 13 173.885 0.3 . 1 . . . . . 54 CYS C . 27637 1 206 . 1 1 54 54 CYS CA C 13 57.621 0.3 . 1 . . . . . 54 CYS CA . 27637 1 207 . 1 1 54 54 CYS CB C 13 30.921 0.3 . 1 . . . . . 54 CYS CB . 27637 1 208 . 1 1 54 54 CYS N N 15 117.020 0.3 . 1 . . . . . 54 CYS N . 27637 1 209 . 1 1 55 55 GLU H H 1 8.308 0.020 . 1 . . . . . 55 GLU H . 27637 1 210 . 1 1 55 55 GLU C C 13 177.512 0.3 . 1 . . . . . 55 GLU C . 27637 1 211 . 1 1 55 55 GLU CA C 13 56.297 0.3 . 1 . . . . . 55 GLU CA . 27637 1 212 . 1 1 55 55 GLU CB C 13 26.088 0.3 . 1 . . . . . 55 GLU CB . 27637 1 213 . 1 1 55 55 GLU N N 15 122.124 0.3 . 1 . . . . . 55 GLU N . 27637 1 214 . 1 1 56 56 CYS H H 1 8.413 0.020 . 1 . . . . . 56 CYS H . 27637 1 215 . 1 1 56 56 CYS C C 13 175.557 0.3 . 1 . . . . . 56 CYS C . 27637 1 216 . 1 1 56 56 CYS CA C 13 54.721 0.3 . 1 . . . . . 56 CYS CA . 27637 1 217 . 1 1 56 56 CYS CB C 13 34.632 0.3 . 1 . . . . . 56 CYS CB . 27637 1 218 . 1 1 56 56 CYS N N 15 118.382 0.3 . 1 . . . . . 56 CYS N . 27637 1 219 . 1 1 57 57 LEU H H 1 8.566 0.020 . 1 . . . . . 57 LEU H . 27637 1 220 . 1 1 57 57 LEU C C 13 176.150 0.3 . 1 . . . . . 57 LEU C . 27637 1 221 . 1 1 57 57 LEU CA C 13 55.412 0.3 . 1 . . . . . 57 LEU CA . 27637 1 222 . 1 1 57 57 LEU CB C 13 38.360 0.3 . 1 . . . . . 57 LEU CB . 27637 1 223 . 1 1 57 57 LEU N N 15 123.426 0.3 . 1 . . . . . 57 LEU N . 27637 1 224 . 1 1 58 58 LYS H H 1 8.641 0.020 . 1 . . . . . 58 LYS H . 27637 1 225 . 1 1 58 58 LYS CA C 13 57.030 0.3 . 1 . . . . . 58 LYS CA . 27637 1 226 . 1 1 58 58 LYS CB C 13 30.670 0.3 . 1 . . . . . 58 LYS CB . 27637 1 227 . 1 1 58 58 LYS N N 15 125.472 0.3 . 1 . . . . . 58 LYS N . 27637 1 228 . 1 1 59 59 LYS H H 1 7.856 0.020 . 1 . . . . . 59 LYS H . 27637 1 229 . 1 1 59 59 LYS C C 13 177.606 0.3 . 1 . . . . . 59 LYS C . 27637 1 230 . 1 1 59 59 LYS CA C 13 56.263 0.3 . 1 . . . . . 59 LYS CA . 27637 1 231 . 1 1 59 59 LYS CB C 13 29.220 0.3 . 1 . . . . . 59 LYS CB . 27637 1 232 . 1 1 59 59 LYS N N 15 119.360 0.3 . 1 . . . . . 59 LYS N . 27637 1 233 . 1 1 60 60 THR H H 1 8.371 0.020 . 1 . . . . . 60 THR H . 27637 1 234 . 1 1 60 60 THR CA C 13 64.614 0.3 . 1 . . . . . 60 THR CA . 27637 1 235 . 1 1 60 60 THR CB C 13 65.690 0.3 . 1 . . . . . 60 THR CB . 27637 1 236 . 1 1 60 60 THR N N 15 117.891 0.3 . 1 . . . . . 60 THR N . 27637 1 237 . 1 1 61 61 SER H H 1 8.150 0.020 . 1 . . . . . 61 SER H . 27637 1 238 . 1 1 61 61 SER C C 13 172.433 0.3 . 1 . . . . . 61 SER C . 27637 1 239 . 1 1 61 61 SER CA C 13 59.964 0.3 . 1 . . . . . 61 SER CA . 27637 1 240 . 1 1 61 61 SER CB C 13 60.405 0.3 . 1 . . . . . 61 SER CB . 27637 1 241 . 1 1 61 61 SER N N 15 115.979 0.3 . 1 . . . . . 61 SER N . 27637 1 242 . 1 1 62 62 GLY H H 1 7.493 0.020 . 1 . . . . . 62 GLY H . 27637 1 243 . 1 1 62 62 GLY C C 13 171.661 0.3 . 1 . . . . . 62 GLY C . 27637 1 244 . 1 1 62 62 GLY CA C 13 42.853 0.3 . 1 . . . . . 62 GLY CA . 27637 1 245 . 1 1 62 62 GLY N N 15 106.149 0.3 . 1 . . . . . 62 GLY N . 27637 1 246 . 1 1 63 63 SER H H 1 7.585 0.020 . 1 . . . . . 63 SER H . 27637 1 247 . 1 1 63 63 SER C C 13 171.081 0.3 . 1 . . . . . 63 SER C . 27637 1 248 . 1 1 63 63 SER CA C 13 56.178 0.3 . 1 . . . . . 63 SER CA . 27637 1 249 . 1 1 63 63 SER CB C 13 61.665 0.3 . 1 . . . . . 63 SER CB . 27637 1 250 . 1 1 63 63 SER N N 15 113.937 0.3 . 1 . . . . . 63 SER N . 27637 1 251 . 1 1 64 64 ILE H H 1 7.101 0.020 . 1 . . . . . 64 ILE H . 27637 1 252 . 1 1 64 64 ILE C C 13 170.838 0.3 . 1 . . . . . 64 ILE C . 27637 1 253 . 1 1 64 64 ILE CA C 13 55.597 0.3 . 1 . . . . . 64 ILE CA . 27637 1 254 . 1 1 64 64 ILE CB C 13 35.962 0.3 . 1 . . . . . 64 ILE CB . 27637 1 255 . 1 1 64 64 ILE N N 15 122.882 0.3 . 1 . . . . . 64 ILE N . 27637 1 256 . 1 1 66 66 GLY H H 1 8.825 0.020 . 1 . . . . . 66 GLY H . 27637 1 257 . 1 1 66 66 GLY C C 13 171.661 0.3 . 1 . . . . . 66 GLY C . 27637 1 258 . 1 1 66 66 GLY CA C 13 42.971 0.3 . 1 . . . . . 66 GLY CA . 27637 1 259 . 1 1 66 66 GLY N N 15 110.812 0.3 . 1 . . . . . 66 GLY N . 27637 1 260 . 1 1 67 67 LEU H H 1 7.228 0.020 . 1 . . . . . 67 LEU H . 27637 1 261 . 1 1 67 67 LEU C C 13 173.373 0.3 . 1 . . . . . 67 LEU C . 27637 1 262 . 1 1 67 67 LEU CA C 13 53.415 0.3 . 1 . . . . . 67 LEU CA . 27637 1 263 . 1 1 67 67 LEU CB C 13 39.091 0.3 . 1 . . . . . 67 LEU CB . 27637 1 264 . 1 1 67 67 LEU N N 15 119.706 0.3 . 1 . . . . . 67 LEU N . 27637 1 265 . 1 1 68 68 ASN H H 1 8.616 0.020 . 1 . . . . . 68 ASN H . 27637 1 266 . 1 1 68 68 ASN C C 13 171.297 0.3 . 1 . . . . . 68 ASN C . 27637 1 267 . 1 1 68 68 ASN CA C 13 48.096 0.3 . 1 . . . . . 68 ASN CA . 27637 1 268 . 1 1 68 68 ASN CB C 13 36.562 0.3 . 1 . . . . . 68 ASN CB . 27637 1 269 . 1 1 68 68 ASN N N 15 127.589 0.3 . 1 . . . . . 68 ASN N . 27637 1 270 . 1 1 70 70 GLY H H 1 8.290 0.020 . 1 . . . . . 70 GLY H . 27637 1 271 . 1 1 70 70 GLY C C 13 174.586 0.3 . 1 . . . . . 70 GLY C . 27637 1 272 . 1 1 70 70 GLY CA C 13 44.115 0.3 . 1 . . . . . 70 GLY CA . 27637 1 273 . 1 1 70 70 GLY N N 15 108.593 0.3 . 1 . . . . . 70 GLY N . 27637 1 274 . 1 1 71 71 LEU H H 1 7.672 0.020 . 1 . . . . . 71 LEU H . 27637 1 275 . 1 1 71 71 LEU C C 13 177.930 0.3 . 1 . . . . . 71 LEU C . 27637 1 276 . 1 1 71 71 LEU CA C 13 53.819 0.3 . 1 . . . . . 71 LEU CA . 27637 1 277 . 1 1 71 71 LEU CB C 13 38.128 0.3 . 1 . . . . . 71 LEU CB . 27637 1 278 . 1 1 71 71 LEU N N 15 121.996 0.3 . 1 . . . . . 71 LEU N . 27637 1 279 . 1 1 72 72 ALA H H 1 7.717 0.020 . 1 . . . . . 72 ALA H . 27637 1 280 . 1 1 72 72 ALA C C 13 175.854 0.3 . 1 . . . . . 72 ALA C . 27637 1 281 . 1 1 72 72 ALA CA C 13 52.623 0.3 . 1 . . . . . 72 ALA CA . 27637 1 282 . 1 1 72 72 ALA CB C 13 14.841 0.3 . 1 . . . . . 72 ALA CB . 27637 1 283 . 1 1 72 72 ALA N N 15 121.112 0.3 . 1 . . . . . 72 ALA N . 27637 1 284 . 1 1 73 73 ALA H H 1 7.941 0.020 . 1 . . . . . 73 ALA H . 27637 1 285 . 1 1 73 73 ALA C C 13 177.849 0.3 . 1 . . . . . 73 ALA C . 27637 1 286 . 1 1 73 73 ALA CA C 13 51.676 0.3 . 1 . . . . . 73 ALA CA . 27637 1 287 . 1 1 73 73 ALA CB C 13 15.080 0.3 . 1 . . . . . 73 ALA CB . 27637 1 288 . 1 1 73 73 ALA N N 15 117.432 0.3 . 1 . . . . . 73 ALA N . 27637 1 289 . 1 1 74 74 GLY H H 1 7.581 0.020 . 1 . . . . . 74 GLY H . 27637 1 290 . 1 1 74 74 GLY C C 13 171.849 0.3 . 1 . . . . . 74 GLY C . 27637 1 291 . 1 1 74 74 GLY CA C 13 42.205 0.3 . 1 . . . . . 74 GLY CA . 27637 1 292 . 1 1 74 74 GLY N N 15 101.662 0.3 . 1 . . . . . 74 GLY N . 27637 1 293 . 1 1 75 75 LEU H H 1 7.220 0.020 . 1 . . . . . 75 LEU H . 27637 1 294 . 1 1 75 75 LEU C C 13 171.283 0.3 . 1 . . . . . 75 LEU C . 27637 1 295 . 1 1 75 75 LEU CA C 13 57.047 0.3 . 1 . . . . . 75 LEU CA . 27637 1 296 . 1 1 75 75 LEU CB C 13 36.989 0.3 . 1 . . . . . 75 LEU CB . 27637 1 297 . 1 1 75 75 LEU N N 15 121.896 0.3 . 1 . . . . . 75 LEU N . 27637 1 298 . 1 1 77 77 GLY H H 1 8.205 0.020 . 1 . . . . . 77 GLY H . 27637 1 299 . 1 1 77 77 GLY C C 13 175.341 0.3 . 1 . . . . . 77 GLY C . 27637 1 300 . 1 1 77 77 GLY CA C 13 44.299 0.3 . 1 . . . . . 77 GLY CA . 27637 1 301 . 1 1 77 77 GLY N N 15 105.224 0.3 . 1 . . . . . 77 GLY N . 27637 1 302 . 1 1 78 78 LYS H H 1 8.108 0.020 . 1 . . . . . 78 LYS H . 27637 1 303 . 1 1 78 78 LYS C C 13 176.245 0.3 . 1 . . . . . 78 LYS C . 27637 1 304 . 1 1 78 78 LYS CA C 13 54.864 0.3 . 1 . . . . . 78 LYS CA . 27637 1 305 . 1 1 78 78 LYS CB C 13 28.974 0.3 . 1 . . . . . 78 LYS CB . 27637 1 306 . 1 1 78 78 LYS N N 15 122.240 0.3 . 1 . . . . . 78 LYS N . 27637 1 307 . 1 1 79 79 CYS H H 1 7.752 0.020 . 1 . . . . . 79 CYS H . 27637 1 308 . 1 1 79 79 CYS C C 13 172.186 0.3 . 1 . . . . . 79 CYS C . 27637 1 309 . 1 1 79 79 CYS CA C 13 50.442 0.3 . 1 . . . . . 79 CYS CA . 27637 1 310 . 1 1 79 79 CYS CB C 13 33.464 0.3 . 1 . . . . . 79 CYS CB . 27637 1 311 . 1 1 79 79 CYS N N 15 114.466 0.3 . 1 . . . . . 79 CYS N . 27637 1 312 . 1 1 80 80 GLY H H 1 7.904 0.020 . 1 . . . . . 80 GLY H . 27637 1 313 . 1 1 80 80 GLY C C 13 171.526 0.3 . 1 . . . . . 80 GLY C . 27637 1 314 . 1 1 80 80 GLY CA C 13 43.817 0.3 . 1 . . . . . 80 GLY CA . 27637 1 315 . 1 1 80 80 GLY N N 15 110.192 0.3 . 1 . . . . . 80 GLY N . 27637 1 316 . 1 1 81 81 VAL H H 1 7.990 0.020 . 1 . . . . . 81 VAL H . 27637 1 317 . 1 1 81 81 VAL C C 13 171.485 0.3 . 1 . . . . . 81 VAL C . 27637 1 318 . 1 1 81 81 VAL CA C 13 57.165 0.3 . 1 . . . . . 81 VAL CA . 27637 1 319 . 1 1 81 81 VAL CB C 13 31.771 0.3 . 1 . . . . . 81 VAL CB . 27637 1 320 . 1 1 81 81 VAL N N 15 117.758 0.3 . 1 . . . . . 81 VAL N . 27637 1 321 . 1 1 82 82 SER H H 1 8.378 0.020 . 1 . . . . . 82 SER H . 27637 1 322 . 1 1 82 82 SER C C 13 171.013 0.3 . 1 . . . . . 82 SER C . 27637 1 323 . 1 1 82 82 SER CA C 13 54.013 0.3 . 1 . . . . . 82 SER CA . 27637 1 324 . 1 1 82 82 SER CB C 13 60.086 0.3 . 1 . . . . . 82 SER CB . 27637 1 325 . 1 1 82 82 SER N N 15 120.684 0.3 . 1 . . . . . 82 SER N . 27637 1 326 . 1 1 83 83 VAL H H 1 7.921 0.020 . 1 . . . . . 83 VAL H . 27637 1 327 . 1 1 83 83 VAL C C 13 173.238 0.3 . 1 . . . . . 83 VAL C . 27637 1 328 . 1 1 83 83 VAL CA C 13 55.544 0.3 . 1 . . . . . 83 VAL CA . 27637 1 329 . 1 1 83 83 VAL CB C 13 30.805 0.3 . 1 . . . . . 83 VAL CB . 27637 1 330 . 1 1 83 83 VAL N N 15 124.557 0.3 . 1 . . . . . 83 VAL N . 27637 1 331 . 1 1 88 88 SER H H 1 7.417 0.020 . 1 . . . . . 88 SER H . 27637 1 332 . 1 1 88 88 SER C C 13 171.162 0.3 . 1 . . . . . 88 SER C . 27637 1 333 . 1 1 88 88 SER CA C 13 54.072 0.3 . 1 . . . . . 88 SER CA . 27637 1 334 . 1 1 88 88 SER CB C 13 62.123 0.3 . 1 . . . . . 88 SER CB . 27637 1 335 . 1 1 88 88 SER N N 15 120.279 0.3 . 1 . . . . . 88 SER N . 27637 1 336 . 1 1 89 89 THR H H 1 8.510 0.020 . 1 . . . . . 89 THR H . 27637 1 337 . 1 1 89 89 THR C C 13 172.537 0.3 . 1 . . . . . 89 THR C . 27637 1 338 . 1 1 89 89 THR CA C 13 61.351 0.3 . 1 . . . . . 89 THR CA . 27637 1 339 . 1 1 89 89 THR CB C 13 65.999 0.3 . 1 . . . . . 89 THR CB . 27637 1 340 . 1 1 89 89 THR N N 15 112.539 0.3 . 1 . . . . . 89 THR N . 27637 1 341 . 1 1 90 90 SER H H 1 8.101 0.020 . 1 . . . . . 90 SER H . 27637 1 342 . 1 1 90 90 SER C C 13 171.876 0.3 . 1 . . . . . 90 SER C . 27637 1 343 . 1 1 90 90 SER CA C 13 54.807 0.3 . 1 . . . . . 90 SER CA . 27637 1 344 . 1 1 90 90 SER CB C 13 61.014 0.3 . 1 . . . . . 90 SER CB . 27637 1 345 . 1 1 90 90 SER N N 15 113.113 0.3 . 1 . . . . . 90 SER N . 27637 1 346 . 1 1 91 91 THR H H 1 7.016 0.020 . 1 . . . . . 91 THR H . 27637 1 347 . 1 1 91 91 THR C C 13 169.342 0.3 . 1 . . . . . 91 THR C . 27637 1 348 . 1 1 91 91 THR CA C 13 61.478 0.3 . 1 . . . . . 91 THR CA . 27637 1 349 . 1 1 91 91 THR CB C 13 67.388 0.3 . 1 . . . . . 91 THR CB . 27637 1 350 . 1 1 91 91 THR N N 15 120.591 0.3 . 1 . . . . . 91 THR N . 27637 1 351 . 1 1 92 92 ASN H H 1 8.754 0.020 . 1 . . . . . 92 ASN H . 27637 1 352 . 1 1 92 92 ASN C C 13 173.953 0.3 . 1 . . . . . 92 ASN C . 27637 1 353 . 1 1 92 92 ASN CA C 13 48.266 0.3 . 1 . . . . . 92 ASN CA . 27637 1 354 . 1 1 92 92 ASN CB C 13 33.788 0.3 . 1 . . . . . 92 ASN CB . 27637 1 355 . 1 1 92 92 ASN N N 15 123.130 0.3 . 1 . . . . . 92 ASN N . 27637 1 356 . 1 1 93 93 CYS H H 1 9.111 0.020 . 1 . . . . . 93 CYS H . 27637 1 357 . 1 1 93 93 CYS C C 13 173.076 0.3 . 1 . . . . . 93 CYS C . 27637 1 358 . 1 1 93 93 CYS CA C 13 52.774 0.3 . 1 . . . . . 93 CYS CA . 27637 1 359 . 1 1 93 93 CYS CB C 13 33.659 0.3 . 1 . . . . . 93 CYS CB . 27637 1 360 . 1 1 93 93 CYS N N 15 126.479 0.3 . 1 . . . . . 93 CYS N . 27637 1 361 . 1 1 94 94 LYS H H 1 7.642 0.020 . 1 . . . . . 94 LYS H . 27637 1 362 . 1 1 94 94 LYS C C 13 173.993 0.3 . 1 . . . . . 94 LYS C . 27637 1 363 . 1 1 94 94 LYS CA C 13 54.349 0.3 . 1 . . . . . 94 LYS CA . 27637 1 364 . 1 1 94 94 LYS CB C 13 28.233 0.3 . 1 . . . . . 94 LYS CB . 27637 1 365 . 1 1 94 94 LYS N N 15 116.226 0.3 . 1 . . . . . 94 LYS N . 27637 1 366 . 1 1 95 95 ALA H H 1 6.873 0.020 . 1 . . . . . 95 ALA H . 27637 1 367 . 1 1 95 95 ALA C C 13 174.505 0.3 . 1 . . . . . 95 ALA C . 27637 1 368 . 1 1 95 95 ALA CA C 13 48.651 0.3 . 1 . . . . . 95 ALA CA . 27637 1 369 . 1 1 95 95 ALA CB C 13 16.235 0.3 . 1 . . . . . 95 ALA CB . 27637 1 370 . 1 1 95 95 ALA N N 15 118.953 0.3 . 1 . . . . . 95 ALA N . 27637 1 371 . 1 1 96 96 VAL H H 1 6.939 0.020 . 1 . . . . . 96 VAL H . 27637 1 372 . 1 1 96 96 VAL C C 13 172.052 0.3 . 1 . . . . . 96 VAL C . 27637 1 373 . 1 1 96 96 VAL CA C 13 60.755 0.3 . 1 . . . . . 96 VAL CA . 27637 1 374 . 1 1 96 96 VAL CB C 13 29.849 0.3 . 1 . . . . . 96 VAL CB . 27637 1 375 . 1 1 96 96 VAL N N 15 121.083 0.3 . 1 . . . . . 96 VAL N . 27637 1 376 . 1 1 97 97 LYS H H 1 8.005 0.020 . 1 . . . . . 97 LYS H . 27637 1 377 . 1 1 97 97 LYS C C 13 167.454 0.3 . 1 . . . . . 97 LYS C . 27637 1 378 . 1 1 97 97 LYS CA C 13 54.456 0.3 . 1 . . . . . 97 LYS CA . 27637 1 379 . 1 1 97 97 LYS CB C 13 31.218 0.3 . 1 . . . . . 97 LYS CB . 27637 1 380 . 1 1 97 97 LYS N N 15 131.904 0.3 . 1 . . . . . 97 LYS N . 27637 1 stop_ save_