###################################
# 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_chemical_shifts_1_hyen_E
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1_hyen_E
_Assigned_chem_shift_list.Entry_ID 50163
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'hyen E'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1_hyen_E
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1_DSS
_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-1H TOCSY' . . . 50163 1
2 '2D 1H-1H NOESY' . . . 50163 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 1 1 GLY HA2 H 1 4.155 . . . . . . . . 1 G HA1 . 50163 1
2 . 1 . 1 1 1 GLY HA3 H 1 3.487 . . . . . . . . 1 G HA2 . 50163 1
3 . 1 . 1 2 2 VAL H H 1 7.957 . . . . . . . . 2 V HN . 50163 1
4 . 1 . 1 2 2 VAL HA H 1 4.755 . . . . . . . . 2 V HA . 50163 1
5 . 1 . 1 3 3 PRO HA H 1 4.242 . . . . . . . . 3 P HA . 50163 1
6 . 1 . 1 3 3 PRO HD2 H 1 4.113 . . . . . . . . 3 P HD2 . 50163 1
7 . 1 . 1 4 4 CYS H H 1 8.527 . . . . . . . . 4 C HN . 50163 1
8 . 1 . 1 4 4 CYS HA H 1 4.588 . . . . . . . . 4 C HA . 50163 1
9 . 1 . 1 5 5 GLY H H 1 8.816 . . . . . . . . 5 G HN . 50163 1
10 . 1 . 1 5 5 GLY HA2 H 1 4.159 . . . . . . . . 5 G HA1 . 50163 1
11 . 1 . 1 5 5 GLY HA3 H 1 3.654 . . . . . . . . 5 G HA2 . 50163 1
12 . 1 . 1 6 6 GLU H H 1 7.760 . . . . . . . . 6 E HN . 50163 1
13 . 1 . 1 6 6 GLU HA H 1 4.628 . . . . . . . . 6 E HA . 50163 1
14 . 1 . 1 7 7 SER H H 1 8.694 . . . . . . . . 7 S HN . 50163 1
15 . 1 . 1 7 7 SER HA H 1 4.737 . . . . . . . . 7 S HA . 50163 1
16 . 1 . 1 8 8 CYS H H 1 8.102 . . . . . . . . 8 C HN . 50163 1
17 . 1 . 1 8 8 CYS HA H 1 5.459 . . . . . . . . 8 C HA . 50163 1
18 . 1 . 1 9 9 VAL H H 1 7.860 . . . . . . . . 9 V HN . 50163 1
19 . 1 . 1 9 9 VAL HA H 1 3.507 . . . . . . . . 9 V HA . 50163 1
20 . 1 . 1 10 10 TYR H H 1 8.276 . . . . . . . . 10 Y HN . 50163 1
21 . 1 . 1 10 10 TYR HA H 1 4.678 . . . . . . . . 10 Y HA . 50163 1
22 . 1 . 1 11 11 ILE H H 1 7.578 . . . . . . . . 11 I HN . 50163 1
23 . 1 . 1 11 11 ILE HA H 1 4.689 . . . . . . . . 11 I HA . 50163 1
24 . 1 . 1 12 12 PRO HA H 1 4.405 . . . . . . . . 12 P HA . 50163 1
25 . 1 . 1 12 12 PRO HD2 H 1 3.766 . . . . . . . . 12 P HD2 . 50163 1
26 . 1 . 1 13 13 CYS H H 1 8.396 . . . . . . . . 13 C HN . 50163 1
27 . 1 . 1 13 13 CYS HA H 1 4.321 . . . . . . . . 13 C HA . 50163 1
28 . 1 . 1 14 14 PHE H H 1 8.816 . . . . . . . . 14 F HN . 50163 1
29 . 1 . 1 14 14 PHE HA H 1 4.697 . . . . . . . . 14 F HA . 50163 1
30 . 1 . 1 15 15 THR H H 1 8.200 . . . . . . . . 15 T HN . 50163 1
31 . 1 . 1 15 15 THR HA H 1 4.691 . . . . . . . . 15 T HA . 50163 1
32 . 1 . 1 16 16 GLY H H 1 6.920 . . . . . . . . 16 G HN . 50163 1
33 . 1 . 1 16 16 GLY HA2 H 1 3.782 . . . . . . . . 16 G HA1 . 50163 1
34 . 1 . 1 17 17 ILE H H 1 8.098 . . . . . . . . 17 I HN . 50163 1
35 . 1 . 1 17 17 ILE HA H 1 4.088 . . . . . . . . 17 I HA . 50163 1
36 . 1 . 1 18 18 ILE H H 1 8.006 . . . . . . . . 18 I HN . 50163 1
37 . 1 . 1 18 18 ILE HA H 1 4.241 . . . . . . . . 18 I HA . 50163 1
38 . 1 . 1 19 19 ASN H H 1 8.436 . . . . . . . . 19 N HN . 50163 1
39 . 1 . 1 19 19 ASN HA H 1 4.645 . . . . . . . . 19 N HA . 50163 1
40 . 1 . 1 20 20 CYS H H 1 7.951 . . . . . . . . 20 C HN . 50163 1
41 . 1 . 1 20 20 CYS HA H 1 4.922 . . . . . . . . 20 C HA . 50163 1
42 . 1 . 1 21 21 SER H H 1 9.377 . . . . . . . . 21 S HN . 50163 1
43 . 1 . 1 21 21 SER HA H 1 4.703 . . . . . . . . 21 S HA . 50163 1
44 . 1 . 1 22 22 CYS H H 1 8.914 . . . . . . . . 22 C HN . 50163 1
45 . 1 . 1 22 22 CYS HA H 1 4.766 . . . . . . . . 22 C HA . 50163 1
46 . 1 . 1 23 23 ARG H H 1 9.619 . . . . . . . . 23 R HN . 50163 1
47 . 1 . 1 23 23 ARG HA H 1 4.596 . . . . . . . . 23 R HA . 50163 1
48 . 1 . 1 24 24 ASP H H 1 9.284 . . . . . . . . 24 D HN . 50163 1
49 . 1 . 1 24 24 ASP HA H 1 4.264 . . . . . . . . 24 D HA . 50163 1
50 . 1 . 1 25 25 LYS H H 1 8.202 . . . . . . . . 25 K HN . 50163 1
51 . 1 . 1 25 25 LYS HA H 1 3.513 . . . . . . . . 25 K HA . 50163 1
52 . 1 . 1 26 26 VAL H H 1 7.972 . . . . . . . . 26 V HN . 50163 1
53 . 1 . 1 26 26 VAL HA H 1 4.232 . . . . . . . . 26 V HA . 50163 1
54 . 1 . 1 27 27 CYS H H 1 9.299 . . . . . . . . 27 C HN . 50163 1
55 . 1 . 1 27 27 CYS HA H 1 5.115 . . . . . . . . 27 C HA . 50163 1
56 . 1 . 1 28 28 TYR H H 1 7.547 . . . . . . . . 28 Y HN . 50163 1
57 . 1 . 1 28 28 TYR HA H 1 5.095 . . . . . . . . 28 Y HA . 50163 1
58 . 1 . 1 29 29 ASN H H 1 9.710 . . . . . . . . 29 N HN . 50163 1
59 . 1 . 1 29 29 ASN HA H 1 5.103 . . . . . . . . 29 N HA . 50163 1
60 . 1 . 1 30 30 ASN H H 1 9.416 . . . . . . . . 30 N HN . 50163 1
61 . 1 . 1 30 30 ASN HA H 1 4.331 . . . . . . . . 30 N HA . 50163 1
stop_
save_