###################################
# 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_chemical_shifts_wCa
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shifts_wCa
_Assigned_chem_shift_list.Entry_ID 9500
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_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 HNCACB 1 $sample_1 isotropic 9500 1
2 CBCA(CO)NH 1 $sample_1 isotropic 9500 1
3 HNCA 1 $sample_1 isotropic 9500 1
4 HN(CO)CA 1 $sample_1 isotropic 9500 1
5 HNCO 1 $sample_1 isotropic 9500 1
6 H(CCO)NH 1 $sample_1 isotropic 9500 1
7 C(CO)NH 1 $sample_1 isotropic 9500 1
8 HCCH-TOCSY 1 $sample_1 isotropic 9500 1
9 '2D 13C-NOESY' 1 $sample_1 isotropic 9500 1
10 '2D aromatic 13C-edited NOESY' 2 $sample_2 isotropic 9500 1
11 '3D 13C-edited NOESY' 1 $sample_1 isotropic 9500 1
12 '3D 15N-edited NOESY' 1 $sample_1 isotropic 9500 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 4 4 MET H H 1 8.513 . . 1 . . . . 134 MET H . 9500 1
2 . 1 1 4 4 MET N N 15 120.6 . . 1 . . . . 134 MET N . 9500 1
3 . 1 1 5 5 ASP CA C 13 55.8 . . 1 . . . . 135 ASP CA . 9500 1
4 . 1 1 5 5 ASP CB C 13 41.3 . . 1 . . . . 135 ASP CB . 9500 1
5 . 1 1 6 6 LEU H H 1 8.402 . . 1 . . . . 136 LEU H . 9500 1
6 . 1 1 6 6 LEU CA C 13 55.8 . . 1 . . . . 136 LEU CA . 9500 1
7 . 1 1 6 6 LEU CB C 13 41.3 . . 1 . . . . 136 LEU CB . 9500 1
8 . 1 1 6 6 LEU N N 15 119.5 . . 1 . . . . 136 LEU N . 9500 1
9 . 1 1 7 7 ARG H H 1 8.374 . . 1 . . . . 137 ARG H . 9500 1
10 . 1 1 7 7 ARG CA C 13 56.83 . . 1 . . . . 137 ARG CA . 9500 1
11 . 1 1 7 7 ARG CB C 13 30.3 . . 1 . . . . 137 ARG CB . 9500 1
12 . 1 1 7 7 ARG N N 15 119.7 . . 1 . . . . 137 ARG N . 9500 1
13 . 1 1 8 8 ALA H H 1 8.098 . . 1 . . . . 138 ALA H . 9500 1
14 . 1 1 8 8 ALA CA C 13 53.2 . . 1 . . . . 138 ALA CA . 9500 1
15 . 1 1 8 8 ALA CB C 13 19.45 . . 1 . . . . 138 ALA CB . 9500 1
16 . 1 1 8 8 ALA N N 15 123 . . 1 . . . . 138 ALA N . 9500 1
17 . 1 1 9 9 ASN H H 1 8.26 . . 1 . . . . 139 ASN H . 9500 1
18 . 1 1 9 9 ASN CA C 13 53.51 . . 1 . . . . 139 ASN CA . 9500 1
19 . 1 1 9 9 ASN CB C 13 38.83 . . 1 . . . . 139 ASN CB . 9500 1
20 . 1 1 9 9 ASN N N 15 116.8 . . 1 . . . . 139 ASN N . 9500 1
21 . 1 1 10 10 LEU H H 1 8.057 . . 1 . . . . 140 LEU H . 9500 1
22 . 1 1 10 10 LEU CA C 13 55.46 . . 1 . . . . 140 LEU CA . 9500 1
23 . 1 1 10 10 LEU CB C 13 42.24 . . 1 . . . . 140 LEU CB . 9500 1
24 . 1 1 10 10 LEU N N 15 121.6 . . 1 . . . . 140 LEU N . 9500 1
25 . 1 1 11 11 LYS H H 1 8.151 . . 1 . . . . 141 LYS H . 9500 1
26 . 1 1 11 11 LYS CA C 13 56.59 . . 1 . . . . 141 LYS CA . 9500 1
27 . 1 1 11 11 LYS CB C 13 32.92 . . 1 . . . . 141 LYS CB . 9500 1
28 . 1 1 11 11 LYS N N 15 121 . . 1 . . . . 141 LYS N . 9500 1
29 . 1 1 12 12 GLN H H 1 8.255 . . 1 . . . . 142 GLN H . 9500 1
30 . 1 1 12 12 GLN CA C 13 55.8 . . 1 . . . . 142 GLN CA . 9500 1
31 . 1 1 12 12 GLN CB C 13 29.6 . . 1 . . . . 142 GLN CB . 9500 1
32 . 1 1 12 12 GLN N N 15 121.3 . . 1 . . . . 142 GLN N . 9500 1
33 . 1 1 13 13 VAL H H 1 8.188 . . 1 . . . . 143 VAL H . 9500 1
34 . 1 1 13 13 VAL CA C 13 62.38 . . 1 . . . . 143 VAL CA . 9500 1
35 . 1 1 13 13 VAL CB C 13 32.89 . . 1 . . . . 143 VAL CB . 9500 1
36 . 1 1 13 13 VAL N N 15 122.1 . . 1 . . . . 143 VAL N . 9500 1
37 . 1 1 14 14 LYS H H 1 8.451 . . 1 . . . . 144 LYS H . 9500 1
38 . 1 1 14 14 LYS CA C 13 56.06 . . 1 . . . . 144 LYS CA . 9500 1
39 . 1 1 14 14 LYS CB C 13 33.34 . . 1 . . . . 144 LYS CB . 9500 1
40 . 1 1 14 14 LYS N N 15 125.9 . . 1 . . . . 144 LYS N . 9500 1
41 . 1 1 15 15 LYS H H 1 8.483 . . 1 . . . . 145 LYS H . 9500 1
42 . 1 1 15 15 LYS CA C 13 56.58 . . 1 . . . . 145 LYS CA . 9500 1
43 . 1 1 15 15 LYS CB C 13 33.33 . . 1 . . . . 145 LYS CB . 9500 1
44 . 1 1 15 15 LYS N N 15 124.4 . . 1 . . . . 145 LYS N . 9500 1
45 . 1 1 16 16 GLU H H 1 8.657 . . 1 . . . . 146 GLU H . 9500 1
46 . 1 1 16 16 GLU CA C 13 56.7 . . 1 . . . . 146 GLU CA . 9500 1
47 . 1 1 16 16 GLU CB C 13 30.52 . . 1 . . . . 146 GLU CB . 9500 1
48 . 1 1 16 16 GLU N N 15 122.2 . . 1 . . . . 146 GLU N . 9500 1
49 . 1 1 17 17 ASP H H 1 8.463 . . 1 . . . . 147 ASP H . 9500 1
50 . 1 1 17 17 ASP CA C 13 54.66 . . 1 . . . . 147 ASP CA . 9500 1
51 . 1 1 17 17 ASP CB C 13 41.21 . . 1 . . . . 147 ASP CB . 9500 1
52 . 1 1 17 17 ASP N N 15 121.8 . . 1 . . . . 147 ASP N . 9500 1
53 . 1 1 18 18 THR H H 1 8.115 . . 1 . . . . 148 THR H . 9500 1
54 . 1 1 18 18 THR CA C 13 62.36 . . 1 . . . . 148 THR CA . 9500 1
55 . 1 1 18 18 THR CB C 13 69.55 . . 1 . . . . 148 THR CB . 9500 1
56 . 1 1 18 18 THR N N 15 113.9 . . 1 . . . . 148 THR N . 9500 1
57 . 1 1 19 19 GLU H H 1 8.406 . . 1 . . . . 149 GLU H . 9500 1
58 . 1 1 19 19 GLU CA C 13 57.02 . . 1 . . . . 149 GLU CA . 9500 1
59 . 1 1 19 19 GLU CB C 13 30.18 . . 1 . . . . 149 GLU CB . 9500 1
60 . 1 1 19 19 GLU N N 15 122.8 . . 1 . . . . 149 GLU N . 9500 1
61 . 1 1 20 20 LYS H H 1 8.181 . . 1 . . . . 150 LYS H . 9500 1
62 . 1 1 20 20 LYS CA C 13 56.8 . . 1 . . . . 150 LYS CA . 9500 1
63 . 1 1 20 20 LYS CB C 13 33.13 . . 1 . . . . 150 LYS CB . 9500 1
64 . 1 1 20 20 LYS N N 15 121.7 . . 1 . . . . 150 LYS N . 9500 1
65 . 1 1 21 21 GLU H H 1 8.377 . . 1 . . . . 151 GLU H . 9500 1
66 . 1 1 21 21 GLU CA C 13 56.99 . . 1 . . . . 151 GLU CA . 9500 1
67 . 1 1 21 21 GLU CB C 13 30.13 . . 1 . . . . 151 GLU CB . 9500 1
68 . 1 1 21 21 GLU N N 15 121.3 . . 1 . . . . 151 GLU N . 9500 1
69 . 1 1 22 22 LYS H H 1 8.22 . . 1 . . . . 152 LYS H . 9500 1
70 . 1 1 22 22 LYS CA C 13 56.88 . . 1 . . . . 152 LYS CA . 9500 1
71 . 1 1 22 22 LYS CB C 13 33.23 . . 1 . . . . 152 LYS CB . 9500 1
72 . 1 1 22 22 LYS N N 15 121.7 . . 1 . . . . 152 LYS N . 9500 1
73 . 1 1 23 23 ASP H H 1 8.354 . . 1 . . . . 153 ASP H . 9500 1
74 . 1 1 23 23 ASP CA C 13 54.45 . . 1 . . . . 153 ASP CA . 9500 1
75 . 1 1 23 23 ASP CB C 13 41.4 . . 1 . . . . 153 ASP CB . 9500 1
76 . 1 1 23 23 ASP N N 15 121.2 . . 1 . . . . 153 ASP N . 9500 1
77 . 1 1 24 24 LEU H H 1 8.188 . . 1 . . . . 154 LEU H . 9500 1
78 . 1 1 24 24 LEU CA C 13 55.5 . . 1 . . . . 154 LEU CA . 9500 1
79 . 1 1 24 24 LEU CB C 13 42.06 . . 1 . . . . 154 LEU CB . 9500 1
80 . 1 1 24 24 LEU N N 15 123 . . 1 . . . . 154 LEU N . 9500 1
81 . 1 1 25 25 ARG H H 1 8.241 . . 1 . . . . 155 ARG H . 9500 1
82 . 1 1 25 25 ARG CA C 13 56.63 . . 1 . . . . 155 ARG CA . 9500 1
83 . 1 1 25 25 ARG CB C 13 30.82 . . 1 . . . . 155 ARG CB . 9500 1
84 . 1 1 25 25 ARG N N 15 120.7 . . 1 . . . . 155 ARG N . 9500 1
85 . 1 1 26 26 ASP H H 1 8.331 . . 1 . . . . 156 ASP H . 9500 1
86 . 1 1 26 26 ASP CA C 13 54.39 . . 1 . . . . 156 ASP CA . 9500 1
87 . 1 1 26 26 ASP CB C 13 41.4 . . 1 . . . . 156 ASP CB . 9500 1
88 . 1 1 26 26 ASP N N 15 120.9 . . 1 . . . . 156 ASP N . 9500 1
89 . 1 1 27 27 VAL H H 1 8.043 . . 1 . . . . 157 VAL H . 9500 1
90 . 1 1 27 27 VAL CA C 13 62.51 . . 1 . . . . 157 VAL CA . 9500 1
91 . 1 1 27 27 VAL CB C 13 32.66 . . 1 . . . . 157 VAL CB . 9500 1
92 . 1 1 27 27 VAL N N 15 119.4 . . 1 . . . . 157 VAL N . 9500 1
93 . 1 1 28 28 GLY H H 1 8.405 . . 1 . . . . 158 GLY H . 9500 1
94 . 1 1 28 28 GLY CA C 13 45.56 . . 1 . . . . 158 GLY CA . 9500 1
95 . 1 1 28 28 GLY N N 15 111.1 . . 1 . . . . 158 GLY N . 9500 1
96 . 1 1 29 29 ASP H H 1 8.213 . . 1 . . . . 159 ASP H . 9500 1
97 . 1 1 29 29 ASP CA C 13 54.45 . . 1 . . . . 159 ASP CA . 9500 1
98 . 1 1 29 29 ASP CB C 13 41.07 . . 1 . . . . 159 ASP CB . 9500 1
99 . 1 1 29 29 ASP N N 15 121 . . 1 . . . . 159 ASP N . 9500 1
100 . 1 1 30 30 TRP H H 1 7.979 . . 1 . . . . 160 TRP H . 9500 1
101 . 1 1 30 30 TRP CA C 13 57.93 . . 1 . . . . 160 TRP CA . 9500 1
102 . 1 1 30 30 TRP CB C 13 29 . . 1 . . . . 160 TRP CB . 9500 1
103 . 1 1 30 30 TRP N N 15 122 . . 1 . . . . 160 TRP N . 9500 1
104 . 1 1 31 31 ARG H H 1 7.786 . . 1 . . . . 161 ARG H . 9500 1
105 . 1 1 31 31 ARG CA C 13 56.96 . . 1 . . . . 161 ARG CA . 9500 1
106 . 1 1 31 31 ARG CB C 13 30.23 . . 1 . . . . 161 ARG CB . 9500 1
107 . 1 1 31 31 ARG N N 15 121.4 . . 1 . . . . 161 ARG N . 9500 1
108 . 1 1 32 32 LYS H H 1 7.885 . . 1 . . . . 162 LYS H . 9500 1
109 . 1 1 32 32 LYS CA C 13 56.79 . . 1 . . . . 162 LYS CA . 9500 1
110 . 1 1 32 32 LYS CB C 13 32.97 . . 1 . . . . 162 LYS CB . 9500 1
111 . 1 1 32 32 LYS N N 15 120.4 . . 1 . . . . 162 LYS N . 9500 1
112 . 1 1 33 33 ASN H H 1 8.252 . . 1 . . . . 163 ASN H . 9500 1
113 . 1 1 33 33 ASN CA C 13 53.62 . . 1 . . . . 163 ASN CA . 9500 1
114 . 1 1 33 33 ASN CB C 13 38.84 . . 1 . . . . 163 ASN CB . 9500 1
115 . 1 1 33 33 ASN N N 15 118.8 . . 1 . . . . 163 ASN N . 9500 1
116 . 1 1 34 34 ILE H H 1 7.974 . . 1 . . . . 164 ILE H . 9500 1
117 . 1 1 34 34 ILE CA C 13 61.66 . . 1 . . . . 164 ILE CA . 9500 1
118 . 1 1 34 34 ILE CB C 13 38.78 . . 1 . . . . 164 ILE CB . 9500 1
119 . 1 1 34 34 ILE N N 15 120.4 . . 1 . . . . 164 ILE N . 9500 1
120 . 1 1 35 35 GLU H H 1 8.394 . . 1 . . . . 165 GLU H . 9500 1
121 . 1 1 35 35 GLU CA C 13 56.97 . . 1 . . . . 165 GLU CA . 9500 1
122 . 1 1 35 35 GLU CB C 13 30.34 . . 1 . . . . 165 GLU CB . 9500 1
123 . 1 1 35 35 GLU N N 15 124 . . 1 . . . . 165 GLU N . 9500 1
124 . 1 1 36 36 GLU H H 1 8.374 . . 1 . . . . 166 GLU H . 9500 1
125 . 1 1 36 36 GLU CA C 13 56.81 . . 1 . . . . 166 GLU CA . 9500 1
126 . 1 1 36 36 GLU CB C 13 30.3 . . 1 . . . . 166 GLU CB . 9500 1
127 . 1 1 36 36 GLU N N 15 122.3 . . 1 . . . . 166 GLU N . 9500 1
128 . 1 1 37 37 LYS H H 1 8.352 . . 1 . . . . 167 LYS H . 9500 1
129 . 1 1 37 37 LYS CA C 13 56.56 . . 1 . . . . 167 LYS CA . 9500 1
130 . 1 1 37 37 LYS CB C 13 33.05 . . 1 . . . . 167 LYS CB . 9500 1
131 . 1 1 37 37 LYS N N 15 122.2 . . 1 . . . . 167 LYS N . 9500 1
132 . 1 1 38 38 SER H H 1 8.405 . . 1 . . . . 168 SER H . 9500 1
133 . 1 1 38 38 SER CA C 13 58.77 . . 1 . . . . 168 SER CA . 9500 1
134 . 1 1 38 38 SER CB C 13 63.83 . . 1 . . . . 168 SER CB . 9500 1
135 . 1 1 38 38 SER N N 15 116.6 . . 1 . . . . 168 SER N . 9500 1
136 . 1 1 39 39 GLY H H 1 8.529 . . 1 . . . . 169 GLY H . 9500 1
137 . 1 1 39 39 GLY CA C 13 45.66 . . 1 . . . . 169 GLY CA . 9500 1
138 . 1 1 39 39 GLY N N 15 110.9 . . 1 . . . . 169 GLY N . 9500 1
139 . 1 1 40 40 MET H H 1 8.263 . . 1 . . . . 170 MET H . 9500 1
140 . 1 1 40 40 MET CA C 13 55.82 . . 1 . . . . 170 MET CA . 9500 1
141 . 1 1 40 40 MET CB C 13 32.86 . . 1 . . . . 170 MET CB . 9500 1
142 . 1 1 40 40 MET N N 15 119.7 . . 1 . . . . 170 MET N . 9500 1
143 . 1 1 41 41 GLU H H 1 8.612 . . 1 . . . . 171 GLU H . 9500 1
144 . 1 1 41 41 GLU CA C 13 57.46 . . 1 . . . . 171 GLU CA . 9500 1
145 . 1 1 41 41 GLU CB C 13 29.96 . . 1 . . . . 171 GLU CB . 9500 1
146 . 1 1 41 41 GLU N N 15 121.5 . . 1 . . . . 171 GLU N . 9500 1
147 . 1 1 42 42 GLY H H 1 8.43 . . 1 . . . . 172 GLY H . 9500 1
148 . 1 1 42 42 GLY CA C 13 45.58 . . 1 . . . . 172 GLY CA . 9500 1
149 . 1 1 42 42 GLY N N 15 109.6 . . 1 . . . . 172 GLY N . 9500 1
150 . 1 1 43 43 ARG H H 1 8.054 . . 1 . . . . 173 ARG H . 9500 1
151 . 1 1 43 43 ARG CA C 13 56.4 . . 1 . . . . 173 ARG CA . 9500 1
152 . 1 1 43 43 ARG CB C 13 30.79 . . 1 . . . . 173 ARG CB . 9500 1
153 . 1 1 43 43 ARG N N 15 120.5 . . 1 . . . . 173 ARG N . 9500 1
154 . 1 1 44 44 LYS H H 1 8.285 . . 1 . . . . 174 LYS H . 9500 1
155 . 1 1 44 44 LYS CA C 13 56.58 . . 1 . . . . 174 LYS CA . 9500 1
156 . 1 1 44 44 LYS CB C 13 33.23 . . 1 . . . . 174 LYS CB . 9500 1
157 . 1 1 44 44 LYS N N 15 122.3 . . 1 . . . . 174 LYS N . 9500 1
158 . 1 1 45 45 LYS H H 1 8.303 . . 1 . . . . 175 LYS H . 9500 1
159 . 1 1 45 45 LYS CA C 13 56.53 . . 1 . . . . 175 LYS CA . 9500 1
160 . 1 1 45 45 LYS CB C 13 33 . . 1 . . . . 175 LYS CB . 9500 1
161 . 1 1 45 45 LYS N N 15 122.4 . . 1 . . . . 175 LYS N . 9500 1
162 . 1 1 46 46 MET H H 1 8.307 . . 1 . . . . 176 MET H . 9500 1
163 . 1 1 46 46 MET CA C 13 55.81 . . 1 . . . . 176 MET CA . 9500 1
164 . 1 1 46 46 MET CB C 13 32.97 . . 1 . . . . 176 MET CB . 9500 1
165 . 1 1 46 46 MET N N 15 121.3 . . 1 . . . . 176 MET N . 9500 1
166 . 1 1 47 47 PHE H H 1 8.195 . . 1 . . . . 177 PHE H . 9500 1
167 . 1 1 47 47 PHE CA C 13 57.75 . . 1 . . . . 177 PHE CA . 9500 1
168 . 1 1 47 47 PHE CB C 13 39.65 . . 1 . . . . 177 PHE CB . 9500 1
169 . 1 1 47 47 PHE N N 15 120.5 . . 1 . . . . 177 PHE N . 9500 1
170 . 1 1 48 48 GLU H H 1 8.344 . . 1 . . . . 178 GLU H . 9500 1
171 . 1 1 48 48 GLU CA C 13 56.38 . . 1 . . . . 178 GLU CA . 9500 1
172 . 1 1 48 48 GLU CB C 13 30.67 . . 1 . . . . 178 GLU CB . 9500 1
173 . 1 1 48 48 GLU N N 15 122.6 . . 1 . . . . 178 GLU N . 9500 1
174 . 1 1 49 49 ALA H H 1 8.338 . . 1 . . . . 179 ALA H . 9500 1
175 . 1 1 49 49 ALA CA C 13 52.8 . . 1 . . . . 179 ALA CA . 9500 1
176 . 1 1 49 49 ALA CB C 13 19.33 . . 1 . . . . 179 ALA CB . 9500 1
177 . 1 1 49 49 ALA N N 15 125 . . 1 . . . . 179 ALA N . 9500 1
178 . 1 1 50 50 GLY H H 1 8.365 . . 1 . . . . 180 GLY H . 9500 1
179 . 1 1 50 50 GLY CA C 13 45.24 . . 1 . . . . 180 GLY CA . 9500 1
180 . 1 1 50 50 GLY N N 15 108.2 . . 1 . . . . 180 GLY N . 9500 1
181 . 1 1 51 51 GLU H H 1 8.254 . . 1 . . . . 181 GLU H . 9500 1
182 . 1 1 51 51 GLU CA C 13 56.47 . . 1 . . . . 181 GLU CA . 9500 1
183 . 1 1 51 51 GLU CB C 13 30.76 . . 1 . . . . 181 GLU CB . 9500 1
184 . 1 1 51 51 GLU N N 15 120.8 . . 1 . . . . 181 GLU N . 9500 1
185 . 1 1 52 52 SER H H 1 8.023 . . 1 . . . . 182 SER H . 9500 1
186 . 1 1 52 52 SER CA C 13 60.02 . . 1 . . . . 182 SER CA . 9500 1
187 . 1 1 52 52 SER CB C 13 64.96 . . 1 . . . . 182 SER CB . 9500 1
188 . 1 1 52 52 SER N N 15 122.2 . . 1 . . . . 182 SER N . 9500 1
stop_
save_