###################################
# 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 19765
_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 0.01
_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
2 '2D 1H-1H NOESY' . . . 19765 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $SPARKY . . 19765 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 HIS HA H 1 4.299 0.010 . . . . . A 1 HIS HA . 19765 1
2 . 1 1 1 1 HIS HB2 H 1 3.282 0.010 . . . . . A 1 HIS HB2 . 19765 1
3 . 1 1 1 1 HIS HB3 H 1 3.282 0.010 . . . . . A 1 HIS HB3 . 19765 1
4 . 1 1 1 1 HIS HD2 H 1 7.314 0.010 . . . . . A 1 HIS HD2 . 19765 1
5 . 1 1 1 1 HIS HE1 H 1 8.354 0.010 . . . . . A 1 HIS HE1 . 19765 1
6 . 1 1 2 2 ALA H H 1 8.753 0.002 . . . . . A 2 ALA H . 19765 1
7 . 1 1 2 2 ALA HA H 1 4.491 0.004 . . . . . A 2 ALA HA . 19765 1
8 . 1 1 2 2 ALA HB1 H 1 1.286 0.002 . . . . . A 2 ALA HB1 . 19765 1
9 . 1 1 2 2 ALA HB2 H 1 1.286 0.002 . . . . . A 2 ALA HB2 . 19765 1
10 . 1 1 2 2 ALA HB3 H 1 1.286 0.002 . . . . . A 2 ALA HB3 . 19765 1
11 . 1 1 3 3 TRP H H 1 8.325 0.010 . . . . . A 3 TRP H . 19765 1
12 . 1 1 3 3 TRP HA H 1 4.704 0.010 . . . . . A 3 TRP HA . 19765 1
13 . 1 1 3 3 TRP HB2 H 1 3.399 0.010 . . . . . A 3 TRP HB2 . 19765 1
14 . 1 1 3 3 TRP HB3 H 1 3.356 0.001 . . . . . A 3 TRP HB3 . 19765 1
15 . 1 1 3 3 TRP HD1 H 1 7.382 0.010 . . . . . A 3 TRP HD1 . 19765 1
16 . 1 1 3 3 TRP HE1 H 1 10.028 0.002 . . . . . A 3 TRP HE1 . 19765 1
17 . 1 1 3 3 TRP HE3 H 1 7.667 0.002 . . . . . A 3 TRP HE3 . 19765 1
18 . 1 1 3 3 TRP HZ2 H 1 7.523 0.001 . . . . . A 3 TRP HZ2 . 19765 1
19 . 1 1 3 3 TRP HZ3 H 1 7.196 0.010 . . . . . A 3 TRP HZ3 . 19765 1
20 . 1 1 3 3 TRP HH2 H 1 7.275 0.010 . . . . . A 3 TRP HH2 . 19765 1
21 . 1 1 4 4 TYR H H 1 7.159 0.001 . . . . . A 4 TYR H . 19765 1
22 . 1 1 4 4 TYR HA H 1 4.486 0.010 . . . . . A 4 TYR HA . 19765 1
23 . 1 1 4 4 TYR HB2 H 1 2.975 0.010 . . . . . A 4 TYR HB2 . 19765 1
24 . 1 1 4 4 TYR HB3 H 1 2.586 0.010 . . . . . A 4 TYR HB3 . 19765 1
25 . 1 1 4 4 TYR HD1 H 1 6.845 0.010 . . . . . A 4 TYR HD1 . 19765 1
26 . 1 1 4 4 TYR HD2 H 1 6.845 0.010 . . . . . A 4 TYR HD2 . 19765 1
27 . 1 1 5 5 SER H H 1 7.889 0.002 . . . . . A 5 SER H . 19765 1
28 . 1 1 5 5 SER HA H 1 4.275 0.010 . . . . . A 5 SER HA . 19765 1
29 . 1 1 5 5 SER HB2 H 1 3.946 0.010 . . . . . A 5 SER HB2 . 19765 1
30 . 1 1 5 5 SER HB3 H 1 3.946 0.010 . . . . . A 5 SER HB3 . 19765 1
31 . 1 1 6 6 HIS H H 1 8.380 0.001 . . . . . A 6 HIS H . 19765 1
32 . 1 1 6 6 HIS HA H 1 4.526 0.010 . . . . . A 6 HIS HA . 19765 1
33 . 1 1 6 6 HIS HB2 H 1 3.270 0.010 . . . . . A 6 HIS HB2 . 19765 1
34 . 1 1 6 6 HIS HB3 H 1 3.270 0.010 . . . . . A 6 HIS HB3 . 19765 1
35 . 1 1 6 6 HIS HD2 H 1 7.167 0.010 . . . . . A 6 HIS HD2 . 19765 1
36 . 1 1 6 6 HIS HE1 H 1 8.477 0.010 . . . . . A 6 HIS HE1 . 19765 1
37 . 1 1 7 7 TYR H H 1 7.851 0.001 . . . . . A 7 TYR H . 19765 1
38 . 1 1 7 7 TYR HA H 1 4.416 0.001 . . . . . A 7 TYR HA . 19765 1
39 . 1 1 7 7 TYR HB2 H 1 3.229 0.010 . . . . . A 7 TYR HB2 . 19765 1
40 . 1 1 7 7 TYR HB3 H 1 3.113 0.010 . . . . . A 7 TYR HB3 . 19765 1
41 . 1 1 7 7 TYR HD1 H 1 7.201 0.010 . . . . . A 7 TYR HD1 . 19765 1
42 . 1 1 7 7 TYR HD2 H 1 7.201 0.010 . . . . . A 7 TYR HD2 . 19765 1
43 . 1 1 8 8 VAL H H 1 7.692 0.003 . . . . . A 8 VAL H . 19765 1
44 . 1 1 8 8 VAL HA H 1 3.897 0.010 . . . . . A 8 VAL HA . 19765 1
45 . 1 1 8 8 VAL HB H 1 2.222 0.002 . . . . . A 8 VAL HB . 19765 1
46 . 1 1 8 8 VAL HG11 H 1 1.123 0.002 . . . . . A 8 VAL HG11 . 19765 1
47 . 1 1 8 8 VAL HG12 H 1 1.123 0.002 . . . . . A 8 VAL HG12 . 19765 1
48 . 1 1 8 8 VAL HG13 H 1 1.123 0.002 . . . . . A 8 VAL HG13 . 19765 1
49 . 1 1 8 8 VAL HG21 H 1 1.064 0.002 . . . . . A 8 VAL HG21 . 19765 1
50 . 1 1 8 8 VAL HG22 H 1 1.064 0.002 . . . . . A 8 VAL HG22 . 19765 1
51 . 1 1 8 8 VAL HG23 H 1 1.064 0.002 . . . . . A 8 VAL HG23 . 19765 1
52 . 1 1 9 9 LEU H H 1 7.758 0.001 . . . . . A 9 LEU H . 19765 1
53 . 1 1 9 9 LEU HA H 1 4.277 0.010 . . . . . A 9 LEU HA . 19765 1
54 . 1 1 9 9 LEU HB2 H 1 1.791 0.010 . . . . . A 9 LEU HB2 . 19765 1
55 . 1 1 9 9 LEU HB3 H 1 1.732 0.001 . . . . . A 9 LEU HB3 . 19765 1
56 . 1 1 9 9 LEU HD11 H 1 1.011 0.010 . . . . . A 9 LEU HD11 . 19765 1
57 . 1 1 9 9 LEU HD12 H 1 1.011 0.010 . . . . . A 9 LEU HD12 . 19765 1
58 . 1 1 9 9 LEU HD13 H 1 1.011 0.010 . . . . . A 9 LEU HD13 . 19765 1
59 . 1 1 9 9 LEU HD21 H 1 0.973 0.010 . . . . . A 9 LEU HD21 . 19765 1
60 . 1 1 9 9 LEU HD22 H 1 0.973 0.010 . . . . . A 9 LEU HD22 . 19765 1
61 . 1 1 9 9 LEU HD23 H 1 0.973 0.010 . . . . . A 9 LEU HD23 . 19765 1
62 . 1 1 10 10 LYS H H 1 7.706 0.001 . . . . . A 10 LYS H . 19765 1
63 . 1 1 10 10 LYS HA H 1 4.029 0.001 . . . . . A 10 LYS HA . 19765 1
64 . 1 1 10 10 LYS HB2 H 1 1.962 0.002 . . . . . A 10 LYS HB2 . 19765 1
65 . 1 1 10 10 LYS HB3 H 1 1.962 0.002 . . . . . A 10 LYS HB3 . 19765 1
66 . 1 1 10 10 LYS HG2 H 1 1.564 0.010 . . . . . A 10 LYS HG2 . 19765 1
67 . 1 1 10 10 LYS HG3 H 1 1.470 0.010 . . . . . A 10 LYS HG3 . 19765 1
68 . 1 1 10 10 LYS HD2 H 1 1.780 0.010 . . . . . A 10 LYS HD2 . 19765 1
69 . 1 1 10 10 LYS HD3 H 1 1.747 0.010 . . . . . A 10 LYS HD3 . 19765 1
70 . 1 1 10 10 LYS HE2 H 1 3.019 0.010 . . . . . A 10 LYS HE2 . 19765 1
71 . 1 1 10 10 LYS HE3 H 1 3.019 0.010 . . . . . A 10 LYS HE3 . 19765 1
72 . 1 1 11 11 PHE H H 1 7.846 0.002 . . . . . A 11 PHE H . 19765 1
73 . 1 1 11 11 PHE HA H 1 4.302 0.001 . . . . . A 11 PHE HA . 19765 1
74 . 1 1 11 11 PHE HB2 H 1 3.292 0.001 . . . . . A 11 PHE HB2 . 19765 1
75 . 1 1 11 11 PHE HB3 H 1 3.153 0.002 . . . . . A 11 PHE HB3 . 19765 1
76 . 1 1 11 11 PHE HD1 H 1 7.077 0.001 . . . . . A 11 PHE HD1 . 19765 1
77 . 1 1 11 11 PHE HD2 H 1 7.077 0.001 . . . . . A 11 PHE HD2 . 19765 1
78 . 1 1 12 12 PHE H H 1 8.361 0.003 . . . . . A 12 PHE H . 19765 1
79 . 1 1 12 12 PHE HA H 1 4.251 0.003 . . . . . A 12 PHE HA . 19765 1
80 . 1 1 12 12 PHE HB2 H 1 3.311 0.002 . . . . . A 12 PHE HB2 . 19765 1
81 . 1 1 12 12 PHE HB3 H 1 3.311 0.002 . . . . . A 12 PHE HB3 . 19765 1
82 . 1 1 12 12 PHE HD1 H 1 7.325 0.003 . . . . . A 12 PHE HD1 . 19765 1
83 . 1 1 12 12 PHE HD2 H 1 7.325 0.003 . . . . . A 12 PHE HD2 . 19765 1
84 . 1 1 13 13 LEU H H 1 8.496 0.001 . . . . . A 13 LEU H . 19765 1
85 . 1 1 13 13 LEU HA H 1 4.168 0.001 . . . . . A 13 LEU HA . 19765 1
86 . 1 1 13 13 LEU HB2 H 1 2.041 0.004 . . . . . A 13 LEU HB2 . 19765 1
87 . 1 1 13 13 LEU HB3 H 1 1.605 0.002 . . . . . A 13 LEU HB3 . 19765 1
88 . 1 1 13 13 LEU HG H 1 2.020 0.010 . . . . . A 13 LEU HG . 19765 1
89 . 1 1 13 13 LEU HD11 H 1 0.986 0.010 . . . . . A 13 LEU HD11 . 19765 1
90 . 1 1 13 13 LEU HD12 H 1 0.986 0.010 . . . . . A 13 LEU HD12 . 19765 1
91 . 1 1 13 13 LEU HD13 H 1 0.986 0.010 . . . . . A 13 LEU HD13 . 19765 1
92 . 1 1 13 13 LEU HD21 H 1 0.986 0.010 . . . . . A 13 LEU HD21 . 19765 1
93 . 1 1 13 13 LEU HD22 H 1 0.986 0.010 . . . . . A 13 LEU HD22 . 19765 1
94 . 1 1 13 13 LEU HD23 H 1 0.986 0.010 . . . . . A 13 LEU HD23 . 19765 1
95 . 1 1 14 14 LEU H H 1 8.054 0.002 . . . . . A 14 LEU H . 19765 1
96 . 1 1 14 14 LEU HA H 1 4.207 0.005 . . . . . A 14 LEU HA . 19765 1
97 . 1 1 14 14 LEU HB2 H 1 1.928 0.005 . . . . . A 14 LEU HB2 . 19765 1
98 . 1 1 14 14 LEU HB3 H 1 1.719 0.001 . . . . . A 14 LEU HB3 . 19765 1
99 . 1 1 14 14 LEU HG H 1 1.807 0.010 . . . . . A 14 LEU HG . 19765 1
100 . 1 1 14 14 LEU HD11 H 1 0.980 0.010 . . . . . A 14 LEU HD11 . 19765 1
101 . 1 1 14 14 LEU HD12 H 1 0.980 0.010 . . . . . A 14 LEU HD12 . 19765 1
102 . 1 1 14 14 LEU HD13 H 1 0.980 0.010 . . . . . A 14 LEU HD13 . 19765 1
103 . 1 1 14 14 LEU HD21 H 1 0.946 0.010 . . . . . A 14 LEU HD21 . 19765 1
104 . 1 1 14 14 LEU HD22 H 1 0.946 0.010 . . . . . A 14 LEU HD22 . 19765 1
105 . 1 1 14 14 LEU HD23 H 1 0.946 0.010 . . . . . A 14 LEU HD23 . 19765 1
106 . 1 1 15 15 VAL H H 1 8.012 0.002 . . . . . A 15 VAL H . 19765 1
107 . 1 1 15 15 VAL HA H 1 3.634 0.001 . . . . . A 15 VAL HA . 19765 1
108 . 1 1 15 15 VAL HB H 1 1.673 0.008 . . . . . A 15 VAL HB . 19765 1
109 . 1 1 15 15 VAL HG11 H 1 0.564 0.002 . . . . . A 15 VAL HG11 . 19765 1
110 . 1 1 15 15 VAL HG12 H 1 0.564 0.002 . . . . . A 15 VAL HG12 . 19765 1
111 . 1 1 15 15 VAL HG13 H 1 0.564 0.002 . . . . . A 15 VAL HG13 . 19765 1
112 . 1 1 15 15 VAL HG21 H 1 0.427 0.006 . . . . . A 15 VAL HG21 . 19765 1
113 . 1 1 15 15 VAL HG22 H 1 0.427 0.006 . . . . . A 15 VAL HG22 . 19765 1
114 . 1 1 15 15 VAL HG23 H 1 0.427 0.006 . . . . . A 15 VAL HG23 . 19765 1
115 . 1 1 16 16 PHE H H 1 8.478 0.002 . . . . . A 16 PHE H . 19765 1
116 . 1 1 16 16 PHE HA H 1 4.592 0.001 . . . . . A 16 PHE HA . 19765 1
117 . 1 1 16 16 PHE HB2 H 1 3.137 0.002 . . . . . A 16 PHE HB2 . 19765 1
118 . 1 1 16 16 PHE HB3 H 1 2.891 0.002 . . . . . A 16 PHE HB3 . 19765 1
119 . 1 1 16 16 PHE HD1 H 1 7.225 0.012 . . . . . A 16 PHE HD1 . 19765 1
120 . 1 1 16 16 PHE HD2 H 1 7.225 0.012 . . . . . A 16 PHE HD2 . 19765 1
121 . 1 1 17 17 GLY H H 1 8.130 0.001 . . . . . A 17 GLY H . 19765 1
122 . 1 1 17 17 GLY HA2 H 1 4.059 0.001 . . . . . A 17 GLY HA2 . 19765 1
123 . 1 1 17 17 GLY HA3 H 1 4.059 0.001 . . . . . A 17 GLY HA3 . 19765 1
124 . 1 1 18 18 GLU H H 1 8.322 0.003 . . . . . A 18 GLU H . 19765 1
125 . 1 1 18 18 GLU HA H 1 4.322 0.004 . . . . . A 18 GLU HA . 19765 1
126 . 1 1 18 18 GLU HB2 H 1 2.253 0.002 . . . . . A 18 GLU HB2 . 19765 1
127 . 1 1 18 18 GLU HB3 H 1 2.194 0.001 . . . . . A 18 GLU HB3 . 19765 1
128 . 1 1 18 18 GLU HG2 H 1 2.607 0.010 . . . . . A 18 GLU HG2 . 19765 1
129 . 1 1 18 18 GLU HG3 H 1 2.571 0.010 . . . . . A 18 GLU HG3 . 19765 1
130 . 1 1 19 19 ASN H H 1 8.131 0.003 . . . . . A 19 ASN H . 19765 1
131 . 1 1 19 19 ASN HA H 1 4.793 0.010 . . . . . A 19 ASN HA . 19765 1
132 . 1 1 19 19 ASN HB2 H 1 2.973 0.010 . . . . . A 19 ASN HB2 . 19765 1
133 . 1 1 19 19 ASN HB3 H 1 2.905 0.003 . . . . . A 19 ASN HB3 . 19765 1
134 . 1 1 19 19 ASN HD21 H 1 7.498 0.001 . . . . . A 19 ASN HD21 . 19765 1
135 . 1 1 19 19 ASN HD22 H 1 6.668 0.010 . . . . . A 19 ASN HD22 . 19765 1
136 . 1 1 20 20 GLY H H 1 8.215 0.004 . . . . . A 20 GLY H . 19765 1
137 . 1 1 20 20 GLY HA2 H 1 4.003 0.003 . . . . . A 20 GLY HA2 . 19765 1
138 . 1 1 20 20 GLY HA3 H 1 4.003 0.003 . . . . . A 20 GLY HA3 . 19765 1
139 . 1 1 21 21 VAL H H 1 7.762 0.001 . . . . . A 21 VAL H . 19765 1
140 . 1 1 21 21 VAL HA H 1 3.923 0.002 . . . . . A 21 VAL HA . 19765 1
141 . 1 1 21 21 VAL HB H 1 2.058 0.005 . . . . . A 21 VAL HB . 19765 1
142 . 1 1 21 21 VAL HG11 H 1 0.946 0.002 . . . . . A 21 VAL HG11 . 19765 1
143 . 1 1 21 21 VAL HG12 H 1 0.946 0.002 . . . . . A 21 VAL HG12 . 19765 1
144 . 1 1 21 21 VAL HG13 H 1 0.946 0.002 . . . . . A 21 VAL HG13 . 19765 1
145 . 1 1 21 21 VAL HG21 H 1 0.817 0.003 . . . . . A 21 VAL HG21 . 19765 1
146 . 1 1 21 21 VAL HG22 H 1 0.817 0.003 . . . . . A 21 VAL HG22 . 19765 1
147 . 1 1 21 21 VAL HG23 H 1 0.817 0.003 . . . . . A 21 VAL HG23 . 19765 1
148 . 1 1 22 22 PHE H H 1 7.814 0.010 . . . . . A 22 PHE H . 19765 1
149 . 1 1 22 22 PHE HA H 1 4.476 0.010 . . . . . A 22 PHE HA . 19765 1
150 . 1 1 22 22 PHE HB2 H 1 2.972 0.010 . . . . . A 22 PHE HB2 . 19765 1
151 . 1 1 22 22 PHE HB3 H 1 2.972 0.010 . . . . . A 22 PHE HB3 . 19765 1
152 . 1 1 22 22 PHE HD1 H 1 7.147 0.010 . . . . . A 22 PHE HD1 . 19765 1
153 . 1 1 22 22 PHE HD2 H 1 7.147 0.010 . . . . . A 22 PHE HD2 . 19765 1
154 . 1 1 23 23 PHE H H 1 7.706 0.015 . . . . . A 23 PHE H . 19765 1
155 . 1 1 23 23 PHE HA H 1 4.499 0.010 . . . . . A 23 PHE HA . 19765 1
156 . 1 1 23 23 PHE HB2 H 1 3.134 0.010 . . . . . A 23 PHE HB2 . 19765 1
157 . 1 1 23 23 PHE HB3 H 1 3.029 0.010 . . . . . A 23 PHE HB3 . 19765 1
158 . 1 1 23 23 PHE HD1 H 1 7.164 0.010 . . . . . A 23 PHE HD1 . 19765 1
159 . 1 1 23 23 PHE HD2 H 1 7.164 0.010 . . . . . A 23 PHE HD2 . 19765 1
160 . 1 1 24 24 TYR H H 1 7.647 0.010 . . . . . A 24 TYR H . 19765 1
161 . 1 1 24 24 TYR HA H 1 4.370 0.001 . . . . . A 24 TYR HA . 19765 1
162 . 1 1 24 24 TYR HB2 H 1 3.116 0.010 . . . . . A 24 TYR HB2 . 19765 1
163 . 1 1 24 24 TYR HB3 H 1 3.064 0.010 . . . . . A 24 TYR HB3 . 19765 1
164 . 1 1 24 24 TYR HD1 H 1 7.202 0.010 . . . . . A 24 TYR HD1 . 19765 1
165 . 1 1 24 24 TYR HD2 H 1 7.202 0.010 . . . . . A 24 TYR HD2 . 19765 1
166 . 1 1 25 25 LYS H H 1 7.795 0.001 . . . . . A 25 LYS H . 19765 1
167 . 1 1 25 25 LYS HA H 1 4.272 0.010 . . . . . A 25 LYS HA . 19765 1
168 . 1 1 25 25 LYS HB2 H 1 1.932 0.010 . . . . . A 25 LYS HB2 . 19765 1
169 . 1 1 25 25 LYS HB3 H 1 1.819 0.010 . . . . . A 25 LYS HB3 . 19765 1
170 . 1 1 25 25 LYS HG2 H 1 1.502 0.010 . . . . . A 25 LYS HG2 . 19765 1
171 . 1 1 25 25 LYS HG3 H 1 1.468 0.010 . . . . . A 25 LYS HG3 . 19765 1
172 . 1 1 25 25 LYS HD2 H 1 1.761 0.010 . . . . . A 25 LYS HD2 . 19765 1
173 . 1 1 25 25 LYS HD3 H 1 1.761 0.010 . . . . . A 25 LYS HD3 . 19765 1
174 . 1 1 25 25 LYS HE2 H 1 3.048 0.010 . . . . . A 25 LYS HE2 . 19765 1
175 . 1 1 25 25 LYS HE3 H 1 3.048 0.010 . . . . . A 25 LYS HE3 . 19765 1
stop_
save_