################################### # 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_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode set_1 _Assigned_chem_shift_list.Entry_ID 17796 _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 '3D HNCACB' . . . 17796 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 ASP HA H 1 4.19 . . 1 . . . . 1 ASP HA . 17796 1 2 . 1 1 1 1 ASP CA C 13 52.50 . . 1 . . . . 1 ASP CA . 17796 1 3 . 1 1 1 1 ASP CB C 13 40.65 . . 1 . . . . 1 ASP CB . 17796 1 4 . 1 1 2 2 ALA H H 1 8.17 . . 1 . . . . 2 ALA H . 17796 1 5 . 1 1 2 2 ALA HA H 1 4.30 . . 1 . . . . 2 ALA HA . 17796 1 6 . 1 1 2 2 ALA CA C 13 52.81 . . 1 . . . . 2 ALA CA . 17796 1 7 . 1 1 2 2 ALA CB C 13 19.32 . . 1 . . . . 2 ALA CB . 17796 1 8 . 1 1 2 2 ALA N N 15 123.60 . . 1 . . . . 2 ALA N . 17796 1 9 . 1 1 3 3 GLU H H 1 8.58 . . 1 . . . . 3 GLU H . 17796 1 10 . 1 1 3 3 GLU HA H 1 4.19 . . 1 . . . . 3 GLU HA . 17796 1 11 . 1 1 3 3 GLU CA C 13 56.39 . . 1 . . . . 3 GLU CA . 17796 1 12 . 1 1 3 3 GLU CB C 13 30.44 . . 1 . . . . 3 GLU CB . 17796 1 13 . 1 1 3 3 GLU N N 15 120.70 . . 1 . . . . 3 GLU N . 17796 1 14 . 1 1 4 4 PHE H H 1 8.47 . . 1 . . . . 4 PHE H . 17796 1 15 . 1 1 4 4 PHE HA H 1 4.55 . . 1 . . . . 4 PHE HA . 17796 1 16 . 1 1 4 4 PHE CA C 13 57.53 . . 1 . . . . 4 PHE CA . 17796 1 17 . 1 1 4 4 PHE CB C 13 39.44 . . 1 . . . . 4 PHE CB . 17796 1 18 . 1 1 4 4 PHE N N 15 122.10 . . 1 . . . . 4 PHE N . 17796 1 19 . 1 1 5 5 ARG H H 1 8.28 . . 1 . . . . 5 ARG H . 17796 1 20 . 1 1 5 5 ARG HA H 1 4.25 . . 1 . . . . 5 ARG HA . 17796 1 21 . 1 1 5 5 ARG CA C 13 55.62 . . 1 . . . . 5 ARG CA . 17796 1 22 . 1 1 5 5 ARG CB C 13 31.25 . . 1 . . . . 5 ARG CB . 17796 1 23 . 1 1 5 5 ARG N N 15 124.00 . . 1 . . . . 5 ARG N . 17796 1 24 . 1 1 6 6 HIS HA H 1 4.53 . . 1 . . . . 6 HIS HA . 17796 1 25 . 1 1 6 6 HIS CA C 13 56.28 . . 1 . . . . 6 HIS CA . 17796 1 26 . 1 1 6 6 HIS CB C 13 30.48 . . 1 . . . . 6 HIS CB . 17796 1 27 . 1 1 7 7 ASP H H 1 8.50 . . 1 . . . . 7 ASP H . 17796 1 28 . 1 1 7 7 ASP HA H 1 4.63 . . 1 . . . . 7 ASP HA . 17796 1 29 . 1 1 7 7 ASP CA C 13 53.96 . . 1 . . . . 7 ASP CA . 17796 1 30 . 1 1 7 7 ASP CB C 13 41.14 . . 1 . . . . 7 ASP CB . 17796 1 31 . 1 1 7 7 ASP N N 15 121.80 . . 1 . . . . 7 ASP N . 17796 1 32 . 1 1 8 8 SER H H 1 8.57 . . 1 . . . . 8 SER H . 17796 1 33 . 1 1 8 8 SER HA H 1 4.37 . . 1 . . . . 8 SER HA . 17796 1 34 . 1 1 8 8 SER CA C 13 58.93 . . 1 . . . . 8 SER CA . 17796 1 35 . 1 1 8 8 SER CB C 13 63.48 . . 1 . . . . 8 SER CB . 17796 1 36 . 1 1 8 8 SER N N 15 116.80 . . 1 . . . . 8 SER N . 17796 1 37 . 1 1 9 9 GLY H H 1 8.67 . . 1 . . . . 9 GLY H . 17796 1 38 . 1 1 9 9 GLY HA2 H 1 3.88 . . 2 . . . . 9 GLY HA1 . 17796 1 39 . 1 1 9 9 GLY HA3 H 1 3.95 . . 2 . . . . 9 GLY HA2 . 17796 1 40 . 1 1 9 9 GLY CA C 13 45.32 . . 1 . . . . 9 GLY CA . 17796 1 41 . 1 1 9 9 GLY N N 15 110.90 . . 1 . . . . 9 GLY N . 17796 1 42 . 1 1 10 10 TYR H H 1 8.07 . . 1 . . . . 10 TYR H . 17796 1 43 . 1 1 10 10 TYR HA H 1 4.51 . . 1 . . . . 10 TYR HA . 17796 1 44 . 1 1 10 10 TYR CA C 13 58.15 . . 1 . . . . 10 TYR CA . 17796 1 45 . 1 1 10 10 TYR CB C 13 38.84 . . 1 . . . . 10 TYR CB . 17796 1 46 . 1 1 10 10 TYR N N 15 120.30 . . 1 . . . . 10 TYR N . 17796 1 47 . 1 1 11 11 GLU H H 1 8.50 . . 1 . . . . 11 GLU H . 17796 1 48 . 1 1 11 11 GLU HA H 1 4.19 . . 1 . . . . 11 GLU HA . 17796 1 49 . 1 1 11 11 GLU CA C 13 56.38 . . 1 . . . . 11 GLU CA . 17796 1 50 . 1 1 11 11 GLU CB C 13 30.36 . . 1 . . . . 11 GLU CB . 17796 1 51 . 1 1 11 11 GLU N N 15 122.50 . . 1 . . . . 11 GLU N . 17796 1 52 . 1 1 12 12 VAL H H 1 8.21 . . 1 . . . . 12 VAL H . 17796 1 53 . 1 1 12 12 VAL HA H 1 3.92 . . 1 . . . . 12 VAL HA . 17796 1 54 . 1 1 12 12 VAL CA C 13 62.80 . . 1 . . . . 12 VAL CA . 17796 1 55 . 1 1 12 12 VAL CB C 13 32.71 . . 1 . . . . 12 VAL CB . 17796 1 56 . 1 1 12 12 VAL N N 15 121.40 . . 1 . . . . 12 VAL N . 17796 1 57 . 1 1 13 13 HIS H H 1 8.42 . . 1 . . . . 13 HIS H . 17796 1 58 . 1 1 13 13 HIS HA H 1 4.59 . . 1 . . . . 13 HIS HA . 17796 1 59 . 1 1 13 13 HIS CA C 13 55.79 . . 1 . . . . 13 HIS CA . 17796 1 60 . 1 1 13 13 HIS CB C 13 30.47 . . 1 . . . . 13 HIS CB . 17796 1 61 . 1 1 13 13 HIS N N 15 122.50 . . 1 . . . . 13 HIS N . 17796 1 62 . 1 1 14 14 HIS H H 1 8.37 . . 1 . . . . 14 HIS H . 17796 1 63 . 1 1 14 14 HIS HA H 1 4.56 . . 1 . . . . 14 HIS HA . 17796 1 64 . 1 1 14 14 HIS CA C 13 56.03 . . 1 . . . . 14 HIS CA . 17796 1 65 . 1 1 14 14 HIS CB C 13 30.66 . . 1 . . . . 14 HIS CB . 17796 1 66 . 1 1 14 14 HIS N N 15 121.10 . . 1 . . . . 14 HIS N . 17796 1 67 . 1 1 15 15 GLN H H 1 8.55 . . 1 . . . . 15 GLN H . 17796 1 68 . 1 1 15 15 GLN HA H 1 4.26 . . 1 . . . . 15 GLN HA . 17796 1 69 . 1 1 15 15 GLN CA C 13 56.20 . . 1 . . . . 15 GLN CA . 17796 1 70 . 1 1 15 15 GLN CB C 13 29.46 . . 1 . . . . 15 GLN CB . 17796 1 71 . 1 1 15 15 GLN N N 15 121.70 . . 1 . . . . 15 GLN N . 17796 1 72 . 1 1 16 16 LYS H H 1 8.55 . . 1 . . . . 16 LYS H . 17796 1 73 . 1 1 16 16 LYS HA H 1 4.26 . . 1 . . . . 16 LYS HA . 17796 1 74 . 1 1 16 16 LYS CA C 13 56.35 . . 1 . . . . 16 LYS CA . 17796 1 75 . 1 1 16 16 LYS CB C 13 33.11 . . 1 . . . . 16 LYS CB . 17796 1 76 . 1 1 16 16 LYS N N 15 123.30 . . 1 . . . . 16 LYS N . 17796 1 77 . 1 1 17 17 LEU H H 1 8.42 . . 1 . . . . 17 LEU H . 17796 1 78 . 1 1 17 17 LEU HA H 1 4.33 . . 1 . . . . 17 LEU HA . 17796 1 79 . 1 1 17 17 LEU CA C 13 55.04 . . 1 . . . . 17 LEU CA . 17796 1 80 . 1 1 17 17 LEU CB C 13 42.40 . . 1 . . . . 17 LEU CB . 17796 1 81 . 1 1 17 17 LEU N N 15 124.20 . . 1 . . . . 17 LEU N . 17796 1 82 . 1 1 18 18 VAL H H 1 8.15 . . 1 . . . . 18 VAL H . 17796 1 83 . 1 1 18 18 VAL HA H 1 4.03 . . 1 . . . . 18 VAL HA . 17796 1 84 . 1 1 18 18 VAL CA C 13 61.87 . . 1 . . . . 18 VAL CA . 17796 1 85 . 1 1 18 18 VAL CB C 13 33.22 . . 1 . . . . 18 VAL CB . 17796 1 86 . 1 1 18 18 VAL N N 15 121.80 . . 1 . . . . 18 VAL N . 17796 1 87 . 1 1 19 19 PHE H H 1 8.42 . . 1 . . . . 19 PHE H . 17796 1 88 . 1 1 19 19 PHE HA H 1 4.57 . . 1 . . . . 19 PHE HA . 17796 1 89 . 1 1 19 19 PHE CA C 13 57.31 . . 1 . . . . 19 PHE CA . 17796 1 90 . 1 1 19 19 PHE CB C 13 40.20 . . 1 . . . . 19 PHE CB . 17796 1 91 . 1 1 19 19 PHE N N 15 124.70 . . 1 . . . . 19 PHE N . 17796 1 92 . 1 1 20 20 PHE H H 1 8.36 . . 1 . . . . 20 PHE H . 17796 1 93 . 1 1 20 20 PHE HA H 1 4.56 . . 1 . . . . 20 PHE HA . 17796 1 94 . 1 1 20 20 PHE CA C 13 57.23 . . 1 . . . . 20 PHE CA . 17796 1 95 . 1 1 20 20 PHE CB C 13 40.07 . . 1 . . . . 20 PHE CB . 17796 1 96 . 1 1 20 20 PHE N N 15 123.30 . . 1 . . . . 20 PHE N . 17796 1 97 . 1 1 21 21 ALA H H 1 8.39 . . 1 . . . . 21 ALA H . 17796 1 98 . 1 1 21 21 ALA HA H 1 4.21 . . 1 . . . . 21 ALA HA . 17796 1 99 . 1 1 21 21 ALA CA C 13 52.51 . . 1 . . . . 21 ALA CA . 17796 1 100 . 1 1 21 21 ALA CB C 13 19.59 . . 1 . . . . 21 ALA CB . 17796 1 101 . 1 1 21 21 ALA N N 15 126.50 . . 1 . . . . 21 ALA N . 17796 1 102 . 1 1 22 22 GLU H H 1 8.50 . . 1 . . . . 22 GLU H . 17796 1 103 . 1 1 22 22 GLU HA H 1 4.20 . . 1 . . . . 22 GLU HA . 17796 1 104 . 1 1 22 22 GLU CA C 13 56.29 . . 1 . . . . 22 GLU CA . 17796 1 105 . 1 1 22 22 GLU CB C 13 30.44 . . 1 . . . . 22 GLU CB . 17796 1 106 . 1 1 22 22 GLU N N 15 120.00 . . 1 . . . . 22 GLU N . 17796 1 107 . 1 1 23 23 ASP H H 1 8.57 . . 1 . . . . 23 ASP H . 17796 1 108 . 1 1 23 23 ASP HA H 1 4.65 . . 1 . . . . 23 ASP HA . 17796 1 109 . 1 1 23 23 ASP CA C 13 53.97 . . 1 . . . . 23 ASP CA . 17796 1 110 . 1 1 23 23 ASP CB C 13 41.12 . . 1 . . . . 23 ASP CB . 17796 1 111 . 1 1 23 23 ASP N N 15 122.00 . . 1 . . . . 23 ASP N . 17796 1 112 . 1 1 24 24 VAL H H 1 8.31 . . 1 . . . . 24 VAL H . 17796 1 113 . 1 1 24 24 VAL HA H 1 4.15 . . 1 . . . . 24 VAL HA . 17796 1 114 . 1 1 24 24 VAL CA C 13 62.86 . . 1 . . . . 24 VAL CA . 17796 1 115 . 1 1 24 24 VAL CB C 13 32.37 . . 1 . . . . 24 VAL CB . 17796 1 116 . 1 1 24 24 VAL N N 15 120.80 . . 1 . . . . 24 VAL N . 17796 1 117 . 1 1 25 25 GLY H H 1 8.69 . . 1 . . . . 25 GLY H . 17796 1 118 . 1 1 25 25 GLY HA2 H 1 3.98 . . 2 . . . . 25 GLY HA1 . 17796 1 119 . 1 1 25 25 GLY HA3 H 1 3.98 . . 2 . . . . 25 GLY HA2 . 17796 1 120 . 1 1 25 25 GLY CA C 13 45.40 . . 1 . . . . 25 GLY CA . 17796 1 121 . 1 1 25 25 GLY N N 15 111.80 . . 1 . . . . 25 GLY N . 17796 1 122 . 1 1 26 26 SER H H 1 8.27 . . 1 . . . . 26 SER H . 17796 1 123 . 1 1 26 26 SER HA H 1 4.43 . . 1 . . . . 26 SER HA . 17796 1 124 . 1 1 26 26 SER CA C 13 58.47 . . 1 . . . . 26 SER CA . 17796 1 125 . 1 1 26 26 SER CB C 13 63.65 . . 1 . . . . 26 SER CB . 17796 1 126 . 1 1 26 26 SER N N 15 115.70 . . 1 . . . . 26 SER N . 17796 1 127 . 1 1 27 27 ASN H H 1 8.62 . . 1 . . . . 27 ASN H . 17796 1 128 . 1 1 27 27 ASN HA H 1 4.74 . . 1 . . . . 27 ASN HA . 17796 1 129 . 1 1 27 27 ASN CA C 13 53.39 . . 1 . . . . 27 ASN CA . 17796 1 130 . 1 1 27 27 ASN CB C 13 38.53 . . 1 . . . . 27 ASN CB . 17796 1 131 . 1 1 27 27 ASN N N 15 120.70 . . 1 . . . . 27 ASN N . 17796 1 132 . 1 1 28 28 LYS H H 1 8.47 . . 1 . . . . 28 LYS H . 17796 1 133 . 1 1 28 28 LYS HA H 1 4.26 . . 1 . . . . 28 LYS HA . 17796 1 134 . 1 1 28 28 LYS CA C 13 56.57 . . 1 . . . . 28 LYS CA . 17796 1 135 . 1 1 28 28 LYS CB C 13 32.55 . . 1 . . . . 28 LYS CB . 17796 1 136 . 1 1 28 28 LYS N N 15 121.80 . . 1 . . . . 28 LYS N . 17796 1 137 . 1 1 29 29 GLY H H 1 8.56 . . 1 . . . . 29 GLY H . 17796 1 138 . 1 1 29 29 GLY HA2 H 1 3.93 . . 2 . . . . 29 GLY HA1 . 17796 1 139 . 1 1 29 29 GLY HA3 H 1 3.93 . . 2 . . . . 29 GLY HA2 . 17796 1 140 . 1 1 29 29 GLY CA C 13 45.09 . . 1 . . . . 29 GLY CA . 17796 1 141 . 1 1 29 29 GLY N N 15 109.60 . . 1 . . . . 29 GLY N . 17796 1 142 . 1 1 30 30 ALA H H 1 8.17 . . 1 . . . . 30 ALA H . 17796 1 143 . 1 1 30 30 ALA HA H 1 4.31 . . 1 . . . . 30 ALA HA . 17796 1 144 . 1 1 30 30 ALA CA C 13 52.56 . . 1 . . . . 30 ALA CA . 17796 1 145 . 1 1 30 30 ALA CB C 13 19.47 . . 1 . . . . 30 ALA CB . 17796 1 146 . 1 1 30 30 ALA N N 15 123.60 . . 1 . . . . 30 ALA N . 17796 1 147 . 1 1 31 31 ILE H H 1 8.34 . . 1 . . . . 31 ILE H . 17796 1 148 . 1 1 31 31 ILE HA H 1 4.15 . . 1 . . . . 31 ILE HA . 17796 1 149 . 1 1 31 31 ILE CA C 13 61.01 . . 1 . . . . 31 ILE CA . 17796 1 150 . 1 1 31 31 ILE CB C 13 38.47 . . 1 . . . . 31 ILE CB . 17796 1 151 . 1 1 31 31 ILE N N 15 121.10 . . 1 . . . . 31 ILE N . 17796 1 152 . 1 1 32 32 ILE H H 1 8.45 . . 1 . . . . 32 ILE H . 17796 1 153 . 1 1 32 32 ILE HA H 1 4.15 . . 1 . . . . 32 ILE HA . 17796 1 154 . 1 1 32 32 ILE CA C 13 61.02 . . 1 . . . . 32 ILE CA . 17796 1 155 . 1 1 32 32 ILE CB C 13 38.48 . . 1 . . . . 32 ILE CB . 17796 1 156 . 1 1 32 32 ILE N N 15 126.50 . . 1 . . . . 32 ILE N . 17796 1 157 . 1 1 33 33 GLY H H 1 8.63 . . 1 . . . . 33 GLY H . 17796 1 158 . 1 1 33 33 GLY HA2 H 1 3.92 . . 2 . . . . 33 GLY HA1 . 17796 1 159 . 1 1 33 33 GLY HA3 H 1 3.95 . . 2 . . . . 33 GLY HA2 . 17796 1 160 . 1 1 33 33 GLY CA C 13 45.09 . . 1 . . . . 33 GLY CA . 17796 1 161 . 1 1 33 33 GLY N N 15 113.20 . . 1 . . . . 33 GLY N . 17796 1 162 . 1 1 34 34 LEU H H 1 8.21 . . 1 . . . . 34 LEU H . 17796 1 163 . 1 1 34 34 LEU HA H 1 4.34 . . 1 . . . . 34 LEU HA . 17796 1 164 . 1 1 34 34 LEU CA C 13 55.17 . . 1 . . . . 34 LEU CA . 17796 1 165 . 1 1 34 34 LEU CB C 13 42.62 . . 1 . . . . 34 LEU CB . 17796 1 166 . 1 1 34 34 LEU N N 15 121.80 . . 1 . . . . 34 LEU N . 17796 1 167 . 1 1 35 35 MET H H 1 8.60 . . 1 . . . . 35 MET H . 17796 1 168 . 1 1 35 35 MET HA H 1 4.54 . . 1 . . . . 35 MET HA . 17796 1 169 . 1 1 35 35 MET CA C 13 55.54 . . 1 . . . . 35 MET CA . 17796 1 170 . 1 1 35 35 MET CB C 13 32.72 . . 1 . . . . 35 MET CB . 17796 1 171 . 1 1 35 35 MET N N 15 122.20 . . 1 . . . . 35 MET N . 17796 1 172 . 1 1 36 36 VAL H H 1 8.41 . . 1 . . . . 36 VAL H . 17796 1 173 . 1 1 36 36 VAL HA H 1 4.12 . . 1 . . . . 36 VAL HA . 17796 1 174 . 1 1 36 36 VAL CA C 13 62.51 . . 1 . . . . 36 VAL CA . 17796 1 175 . 1 1 36 36 VAL CB C 13 32.79 . . 1 . . . . 36 VAL CB . 17796 1 176 . 1 1 36 36 VAL N N 15 122.60 . . 1 . . . . 36 VAL N . 17796 1 177 . 1 1 37 37 GLY H H 1 8.77 . . 1 . . . . 37 GLY H . 17796 1 178 . 1 1 37 37 GLY HA2 H 1 4.00 . . 2 . . . . 37 GLY HA1 . 17796 1 179 . 1 1 37 37 GLY HA3 H 1 4.00 . . 2 . . . . 37 GLY HA2 . 17796 1 180 . 1 1 37 37 GLY CA C 13 45.16 . . 1 . . . . 37 GLY CA . 17796 1 181 . 1 1 37 37 GLY N N 15 113.30 . . 1 . . . . 37 GLY N . 17796 1 182 . 1 1 38 38 GLY H H 1 8.39 . . 1 . . . . 38 GLY H . 17796 1 183 . 1 1 38 38 GLY HA2 H 1 3.94 . . 2 . . . . 38 GLY HA1 . 17796 1 184 . 1 1 38 38 GLY HA3 H 1 4.01 . . 2 . . . . 38 GLY HA2 . 17796 1 185 . 1 1 38 38 GLY CA C 13 45.00 . . 1 . . . . 38 GLY CA . 17796 1 186 . 1 1 38 38 GLY N N 15 108.90 . . 1 . . . . 38 GLY N . 17796 1 187 . 1 1 39 39 VAL H H 1 8.23 . . 1 . . . . 39 VAL H . 17796 1 188 . 1 1 39 39 VAL HA H 1 4.18 . . 1 . . . . 39 VAL HA . 17796 1 189 . 1 1 39 39 VAL CA C 13 62.32 . . 1 . . . . 39 VAL CA . 17796 1 190 . 1 1 39 39 VAL CB C 13 33.03 . . 1 . . . . 39 VAL CB . 17796 1 191 . 1 1 39 39 VAL N N 15 120.00 . . 1 . . . . 39 VAL N . 17796 1 192 . 1 1 40 40 VAL H H 1 7.98 . . 1 . . . . 40 VAL H . 17796 1 193 . 1 1 40 40 VAL HA H 1 4.05 . . 1 . . . . 40 VAL HA . 17796 1 194 . 1 1 40 40 VAL CA C 13 63.79 . . 1 . . . . 40 VAL CA . 17796 1 195 . 1 1 40 40 VAL CB C 13 33.27 . . 1 . . . . 40 VAL CB . 17796 1 196 . 1 1 40 40 VAL N N 15 128.60 . . 1 . . . . 40 VAL N . 17796 1 stop_ save_