Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 51275
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'LLL His NM pH 7.7'
_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 $chem_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 '2D 1H-15N HSQC' . . . 51275 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
1 $software_1 . . 51275 1
2 $software_2 . . 51275 1
3 $software_3 . . 51275 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 2 2 GLY H H 1 8.49 . . . . . . . . 2 GLY H . 51275 1
2 . 1 . 1 2 2 GLY N N 15 109.45 . . . . . . . . 2 GLY N . 51275 1
3 . 1 . 1 3 3 ASN H H 1 8.55 . . . . . . . . 3 ASN H . 51275 1
4 . 1 . 1 3 3 ASN N N 15 119.46 . . . . . . . . 3 ASN N . 51275 1
5 . 1 . 1 4 4 ARG H H 1 9.48 . . . . . . . . 4 ARG H . 51275 1
6 . 1 . 1 4 4 ARG N N 15 121.8 . . . . . . . . 4 ARG N . 51275 1
7 . 1 . 1 5 5 ALA H H 1 9.49 . . . . . . . . 5 ALA H . 51275 1
8 . 1 . 1 5 5 ALA N N 15 121.79 . . . . . . . . 5 ALA N . 51275 1
9 . 1 . 1 6 6 LEU H H 1 10.25 . . . . . . . . 6 LEU H . 51275 1
10 . 1 . 1 6 6 LEU N N 15 122.99 . . . . . . . . 6 LEU N . 51275 1
11 . 1 . 1 7 7 LYS H H 1 9.06 . . . . . . . . 7 LYS H . 51275 1
12 . 1 . 1 7 7 LYS N N 15 126.2 . . . . . . . . 7 LYS N . 51275 1
13 . 1 . 1 8 8 SER H H 1 9.99 . . . . . . . . 8 SER H . 51275 1
14 . 1 . 1 8 8 SER N N 15 125.7 . . . . . . . . 8 SER N . 51275 1
15 . 1 . 1 10 10 HIS H H 1 7.14 . . . . . . . . 10 HIS H . 51275 1
16 . 1 . 1 10 10 HIS N N 15 113.51 . . . . . . . . 10 HIS N . 51275 1
17 . 1 . 1 11 11 GLY H H 1 7.61 . . . . . . . . 11 GLY H . 51275 1
18 . 1 . 1 11 11 GLY N N 15 106.04 . . . . . . . . 11 GLY N . 51275 1
19 . 1 . 1 12 12 HIS H H 1 7.06 . . . . . . . . 12 HIS H . 51275 1
20 . 1 . 1 12 12 HIS N N 15 117.46 . . . . . . . . 12 HIS N . 51275 1
21 . 1 . 1 13 13 PHE H H 1 9.34 . . . . . . . . 13 PHE H . 51275 1
22 . 1 . 1 13 13 PHE N N 15 118.46 . . . . . . . . 13 PHE N . 51275 1
23 . 1 . 1 14 14 LEU H H 1 8.69 . . . . . . . . 14 LEU H . 51275 1
24 . 1 . 1 14 14 LEU N N 15 122.19 . . . . . . . . 14 LEU N . 51275 1
25 . 1 . 1 15 15 SER H H 1 8.71 . . . . . . . . 15 SER H . 51275 1
26 . 1 . 1 15 15 SER N N 15 115.72 . . . . . . . . 15 SER N . 51275 1
27 . 1 . 1 16 16 ALA H H 1 8.38 . . . . . . . . 16 ALA H . 51275 1
28 . 1 . 1 16 16 ALA N N 15 128.76 . . . . . . . . 16 ALA N . 51275 1
29 . 1 . 1 17 17 GLU H H 1 8.4 . . . . . . . . 17 GLU H . 51275 1
30 . 1 . 1 17 17 GLU N N 15 121.57 . . . . . . . . 17 GLU N . 51275 1
31 . 1 . 1 20 20 ALA H H 1 8.25 . . . . . . . . 20 ALA H . 51275 1
32 . 1 . 1 20 20 ALA N N 15 124.73 . . . . . . . . 20 ALA N . 51275 1
33 . 1 . 1 21 21 VAL H H 1 8.3 . . . . . . . . 21 VAL H . 51275 1
34 . 1 . 1 21 21 VAL N N 15 119.52 . . . . . . . . 21 VAL N . 51275 1
35 . 1 . 1 22 22 LYS H H 1 9.38 . . . . . . . . 22 LYS H . 51275 1
36 . 1 . 1 22 22 LYS N N 15 127.43 . . . . . . . . 22 LYS N . 51275 1
37 . 1 . 1 23 23 THR H H 1 7.82 . . . . . . . . 23 THR H . 51275 1
38 . 1 . 1 23 23 THR N N 15 105.87 . . . . . . . . 23 THR N . 51275 1
39 . 1 . 1 24 24 HIS H H 1 9.76 . . . . . . . . 24 HIS H . 51275 1
40 . 1 . 1 24 24 HIS N N 15 120.47 . . . . . . . . 24 HIS N . 51275 1
41 . 1 . 1 33 33 HIS H H 1 7.45 . . . . . . . . 33 HIS H . 51275 1
42 . 1 . 1 33 33 HIS N N 15 120.16 . . . . . . . . 33 HIS N . 51275 1
43 . 1 . 1 34 34 PHE H H 1 9.75 . . . . . . . . 34 PHE H . 51275 1
44 . 1 . 1 34 34 PHE N N 15 123.34 . . . . . . . . 34 PHE N . 51275 1
45 . 1 . 1 36 36 VAL H H 1 8.58 . . . . . . . . 36 VAL H . 51275 1
46 . 1 . 1 36 36 VAL N N 15 127.27 . . . . . . . . 36 VAL N . 51275 1
47 . 1 . 1 37 37 GLU H H 1 9.12 . . . . . . . . 37 GLU H . 51275 1
48 . 1 . 1 37 37 GLU N N 15 127.1 . . . . . . . . 37 GLU N . 51275 1
49 . 1 . 1 38 38 ASN H H 1 8.71 . . . . . . . . 38 ASN H . 51275 1
50 . 1 . 1 38 38 ASN N N 15 120.96 . . . . . . . . 38 ASN N . 51275 1
51 . 1 . 1 39 39 HIS H H 1 8.91 . . . . . . . . 39 HIS H . 51275 1
52 . 1 . 1 39 39 HIS N N 15 125.95 . . . . . . . . 39 HIS N . 51275 1
53 . 1 . 1 42 42 LYS H H 1 7.63 . . . . . . . . 42 LYS H . 51275 1
54 . 1 . 1 42 42 LYS N N 15 120.2 . . . . . . . . 42 LYS N . 51275 1
55 . 1 . 1 43 43 VAL H H 1 9.57 . . . . . . . . 43 VAL H . 51275 1
56 . 1 . 1 43 43 VAL N N 15 113.12 . . . . . . . . 43 VAL N . 51275 1
57 . 1 . 1 44 44 ALA H H 1 9.07 . . . . . . . . 44 ALA H . 51275 1
58 . 1 . 1 44 44 ALA N N 15 123.04 . . . . . . . . 44 ALA N . 51275 1
59 . 1 . 1 45 45 LEU H H 1 10.72 . . . . . . . . 45 LEU H . 51275 1
60 . 1 . 1 45 45 LEU N N 15 124.5 . . . . . . . . 45 LEU N . 51275 1
61 . 1 . 1 46 46 LYS H H 1 9.06 . . . . . . . . 46 LYS H . 51275 1
62 . 1 . 1 46 46 LYS N N 15 126.2 . . . . . . . . 46 LYS N . 51275 1
63 . 1 . 1 47 47 THR H H 1 9.39 . . . . . . . . 47 THR H . 51275 1
64 . 1 . 1 47 47 THR N N 15 117.89 . . . . . . . . 47 THR N . 51275 1
65 . 1 . 1 49 49 CYS H H 1 7.61 . . . . . . . . 49 CYS H . 51275 1
66 . 1 . 1 49 49 CYS N N 15 113.37 . . . . . . . . 49 CYS N . 51275 1
67 . 1 . 1 50 50 GLY H H 1 7.85 . . . . . . . . 50 GLY H . 51275 1
68 . 1 . 1 50 50 GLY N N 15 111.85 . . . . . . . . 50 GLY N . 51275 1
69 . 1 . 1 51 51 LYS H H 1 7.87 . . . . . . . . 51 LYS H . 51275 1
70 . 1 . 1 51 51 LYS N N 15 119.68 . . . . . . . . 51 LYS N . 51275 1
71 . 1 . 1 52 52 TYR H H 1 9.03 . . . . . . . . 52 TYR H . 51275 1
72 . 1 . 1 52 52 TYR N N 15 114.65 . . . . . . . . 52 TYR N . 51275 1
73 . 1 . 1 53 53 LEU H H 1 8.98 . . . . . . . . 53 LEU H . 51275 1
74 . 1 . 1 53 53 LEU N N 15 131.43 . . . . . . . . 53 LEU N . 51275 1
75 . 1 . 1 54 54 SER H H 1 8.83 . . . . . . . . 54 SER H . 51275 1
76 . 1 . 1 54 54 SER N N 15 121.24 . . . . . . . . 54 SER N . 51275 1
77 . 1 . 1 55 55 ILE H H 1 8.4 . . . . . . . . 55 ILE H . 51275 1
78 . 1 . 1 55 55 ILE N N 15 121.57 . . . . . . . . 55 ILE N . 51275 1
79 . 1 . 1 56 56 GLY H H 1 8.59 . . . . . . . . 56 GLY H . 51275 1
80 . 1 . 1 56 56 GLY N N 15 107.33 . . . . . . . . 56 GLY N . 51275 1
81 . 1 . 1 59 59 LYS H H 1 7.88 . . . . . . . . 59 LYS H . 51275 1
82 . 1 . 1 59 59 LYS N N 15 112.26 . . . . . . . . 59 LYS N . 51275 1
83 . 1 . 1 60 60 GLN H H 1 9.25 . . . . . . . . 60 GLN H . 51275 1
84 . 1 . 1 60 60 GLN N N 15 122.39 . . . . . . . . 60 GLN N . 51275 1
85 . 1 . 1 61 61 VAL H H 1 8.73 . . . . . . . . 61 VAL H . 51275 1
86 . 1 . 1 61 61 VAL N N 15 123.98 . . . . . . . . 61 VAL N . 51275 1
87 . 1 . 1 62 62 TYR H H 1 9.45 . . . . . . . . 62 TYR H . 51275 1
88 . 1 . 1 62 62 TYR N N 15 127.27 . . . . . . . . 62 TYR N . 51275 1
89 . 1 . 1 63 63 LEU H H 1 8.43 . . . . . . . . 63 LEU H . 51275 1
90 . 1 . 1 63 63 LEU N N 15 117.66 . . . . . . . . 63 LEU N . 51275 1
91 . 1 . 1 64 64 SER H H 1 8.43 . . . . . . . . 64 SER H . 51275 1
92 . 1 . 1 64 64 SER N N 15 117.66 . . . . . . . . 64 SER N . 51275 1
93 . 1 . 1 66 66 HIS H H 1 7.71 . . . . . . . . 66 HIS H . 51275 1
94 . 1 . 1 66 66 HIS N N 15 114.33 . . . . . . . . 66 HIS N . 51275 1
95 . 1 . 1 67 67 LEU H H 1 8.66 . . . . . . . . 67 LEU H . 51275 1
96 . 1 . 1 67 67 LEU N N 15 125.16 . . . . . . . . 67 LEU N . 51275 1
97 . 1 . 1 68 68 HIS H H 1 7.8 . . . . . . . . 68 HIS H . 51275 1
98 . 1 . 1 68 68 HIS N N 15 132.83 . . . . . . . . 68 HIS N . 51275 1
99 . 1 . 1 69 69 GLY H H 1 8.41 . . . . . . . . 69 GLY H . 51275 1
100 . 1 . 1 69 69 GLY N N 15 114.08 . . . . . . . . 69 GLY N . 51275 1
101 . 1 . 1 70 70 ASP H H 1 8.82 . . . . . . . . 70 ASP H . 51275 1
102 . 1 . 1 70 70 ASP N N 15 116.81 . . . . . . . . 70 ASP N . 51275 1
103 . 1 . 1 71 71 HIS H H 1 8.99 . . . . . . . . 71 HIS H . 51275 1
104 . 1 . 1 71 71 HIS N N 15 115.81 . . . . . . . . 71 HIS N . 51275 1
105 . 1 . 1 72 72 SER H H 1 8.72 . . . . . . . . 72 SER H . 51275 1
106 . 1 . 1 72 72 SER N N 15 112.53 . . . . . . . . 72 SER N . 51275 1
107 . 1 . 1 73 73 LEU H H 1 6.21 . . . . . . . . 73 LEU H . 51275 1
108 . 1 . 1 73 73 LEU N N 15 115.16 . . . . . . . . 73 LEU N . 51275 1
109 . 1 . 1 74 74 PHE H H 1 9.65 . . . . . . . . 74 PHE H . 51275 1
110 . 1 . 1 74 74 PHE N N 15 119.39 . . . . . . . . 74 PHE N . 51275 1
111 . 1 . 1 75 75 HIS H H 1 9.7 . . . . . . . . 75 HIS H . 51275 1
112 . 1 . 1 75 75 HIS N N 15 120.96 . . . . . . . . 75 HIS N . 51275 1
113 . 1 . 1 76 76 LEU H H 1 8.84 . . . . . . . . 76 LEU H . 51275 1
114 . 1 . 1 76 76 LEU N N 15 128.67 . . . . . . . . 76 LEU N . 51275 1
115 . 1 . 1 77 77 GLU H H 1 8.93 . . . . . . . . 77 GLU H . 51275 1
116 . 1 . 1 77 77 GLU N N 15 125.45 . . . . . . . . 77 GLU N . 51275 1
117 . 1 . 1 78 78 HIS H H 1 8.53 . . . . . . . . 78 HIS H . 51275 1
118 . 1 . 1 78 78 HIS N N 15 120.94 . . . . . . . . 78 HIS N . 51275 1
119 . 1 . 1 79 79 HIS H H 1 8.73 . . . . . . . . 79 HIS H . 51275 1
120 . 1 . 1 79 79 HIS N N 15 123.98 . . . . . . . . 79 HIS N . 51275 1
121 . 1 . 1 82 82 LYS H H 1 7.84 . . . . . . . . 82 LYS H . 51275 1
122 . 1 . 1 82 82 LYS N N 15 120.36 . . . . . . . . 82 LYS N . 51275 1
123 . 1 . 1 83 83 VAL H H 1 9.81 . . . . . . . . 83 VAL H . 51275 1
124 . 1 . 1 83 83 VAL N N 15 115.13 . . . . . . . . 83 VAL N . 51275 1
125 . 1 . 1 84 84 SER H H 1 8.91 . . . . . . . . 84 SER H . 51275 1
126 . 1 . 1 84 84 SER N N 15 115.36 . . . . . . . . 84 SER N . 51275 1
127 . 1 . 1 85 85 LEU H H 1 10.2 . . . . . . . . 85 LEU H . 51275 1
128 . 1 . 1 85 85 LEU N N 15 126.12 . . . . . . . . 85 LEU N . 51275 1
129 . 1 . 1 86 86 LYS H H 1 8.82 . . . . . . . . 86 LYS H . 51275 1
130 . 1 . 1 86 86 LYS N N 15 125.23 . . . . . . . . 86 LYS N . 51275 1
131 . 1 . 1 87 87 GLY H H 1 9.45 . . . . . . . . 87 GLY H . 51275 1
132 . 1 . 1 87 87 GLY N N 15 118.69 . . . . . . . . 87 GLY N . 51275 1
133 . 1 . 1 88 88 HIS H H 1 9.03 . . . . . . . . 88 HIS H . 51275 1
134 . 1 . 1 88 88 HIS N N 15 126.19 . . . . . . . . 88 HIS N . 51275 1
135 . 1 . 1 89 89 HIS H H 1 7.63 . . . . . . . . 89 HIS H . 51275 1
136 . 1 . 1 89 89 HIS N N 15 116.24 . . . . . . . . 89 HIS N . 51275 1
137 . 1 . 1 90 90 HIS H H 1 8.47 . . . . . . . . 90 HIS H . 51275 1
138 . 1 . 1 90 90 HIS N N 15 112.95 . . . . . . . . 90 HIS N . 51275 1
139 . 1 . 1 91 91 HIS H H 1 7.12 . . . . . . . . 91 HIS H . 51275 1
140 . 1 . 1 91 91 HIS N N 15 117.23 . . . . . . . . 91 HIS N . 51275 1
141 . 1 . 1 92 92 TYR H H 1 9.27 . . . . . . . . 92 TYR H . 51275 1
142 . 1 . 1 92 92 TYR N N 15 119.54 . . . . . . . . 92 TYR N . 51275 1
143 . 1 . 1 93 93 LEU H H 1 8.04 . . . . . . . . 93 LEU H . 51275 1
144 . 1 . 1 93 93 LEU N N 15 120.68 . . . . . . . . 93 LEU N . 51275 1
145 . 1 . 1 94 94 SER H H 1 8.87 . . . . . . . . 94 SER H . 51275 1
146 . 1 . 1 94 94 SER N N 15 120.23 . . . . . . . . 94 SER N . 51275 1
147 . 1 . 1 95 95 ALA H H 1 8.67 . . . . . . . . 95 ALA H . 51275 1
148 . 1 . 1 95 95 ALA N N 15 125.91 . . . . . . . . 95 ALA N . 51275 1
149 . 1 . 1 96 96 ASP H H 1 7.86 . . . . . . . . 96 ASP H . 51275 1
150 . 1 . 1 96 96 ASP N N 15 118.85 . . . . . . . . 96 ASP N . 51275 1
151 . 1 . 1 98 98 HIS H H 1 7.44 . . . . . . . . 98 HIS H . 51275 1
152 . 1 . 1 98 98 HIS N N 15 118.24 . . . . . . . . 98 HIS N . 51275 1
153 . 1 . 1 99 99 GLY H H 1 8.29 . . . . . . . . 99 GLY H . 51275 1
154 . 1 . 1 99 99 GLY N N 15 107.94 . . . . . . . . 99 GLY N . 51275 1
155 . 1 . 1 100 100 HIS H H 1 8.35 . . . . . . . . 100 HIS H . 51275 1
156 . 1 . 1 100 100 HIS N N 15 120.65 . . . . . . . . 100 HIS N . 51275 1
157 . 1 . 1 101 101 VAL H H 1 8.81 . . . . . . . . 101 VAL H . 51275 1
158 . 1 . 1 101 101 VAL N N 15 128.34 . . . . . . . . 101 VAL N . 51275 1
159 . 1 . 1 102 102 SER H H 1 9.01 . . . . . . . . 102 SER H . 51275 1
160 . 1 . 1 102 102 SER N N 15 123.93 . . . . . . . . 102 SER N . 51275 1
161 . 1 . 1 103 103 THR H H 1 8.47 . . . . . . . . 103 THR H . 51275 1
162 . 1 . 1 103 103 THR N N 15 108.05 . . . . . . . . 103 THR N . 51275 1
163 . 1 . 1 104 104 LYS H H 1 8.92 . . . . . . . . 104 LYS H . 51275 1
164 . 1 . 1 104 104 LYS N N 15 116.67 . . . . . . . . 104 LYS N . 51275 1
165 . 1 . 1 105 105 GLU H H 1 8.82 . . . . . . . . 105 GLU H . 51275 1
166 . 1 . 1 105 105 GLU N N 15 120.27 . . . . . . . . 105 GLU N . 51275 1
167 . 1 . 1 106 106 HIS H H 1 7.26 . . . . . . . . 106 HIS H . 51275 1
168 . 1 . 1 106 106 HIS N N 15 115.53 . . . . . . . . 106 HIS N . 51275 1
169 . 1 . 1 107 107 HIS H H 1 8.18 . . . . . . . . 107 HIS H . 51275 1
170 . 1 . 1 107 107 HIS N N 15 120.69 . . . . . . . . 107 HIS N . 51275 1
171 . 1 . 1 108 108 ASP H H 1 7.79 . . . . . . . . 108 ASP H . 51275 1
172 . 1 . 1 108 108 ASP N N 15 125.78 . . . . . . . . 108 ASP N . 51275 1
173 . 1 . 1 110 110 ASP H H 1 7.8 . . . . . . . . 110 ASP H . 51275 1
174 . 1 . 1 110 110 ASP N N 15 117.62 . . . . . . . . 110 ASP N . 51275 1
175 . 1 . 1 111 111 THR H H 1 7.48 . . . . . . . . 111 THR H . 51275 1
176 . 1 . 1 111 111 THR N N 15 108.06 . . . . . . . . 111 THR N . 51275 1
177 . 1 . 1 112 112 THR H H 1 7.39 . . . . . . . . 112 THR H . 51275 1
178 . 1 . 1 112 112 THR N N 15 118.35 . . . . . . . . 112 THR N . 51275 1
179 . 1 . 1 113 113 PHE H H 1 9.59 . . . . . . . . 113 PHE H . 51275 1
180 . 1 . 1 113 113 PHE N N 15 122.7 . . . . . . . . 113 PHE N . 51275 1
181 . 1 . 1 114 114 GLU H H 1 9.5 . . . . . . . . 114 GLU H . 51275 1
182 . 1 . 1 114 114 GLU N N 15 121.03 . . . . . . . . 114 GLU N . 51275 1
183 . 1 . 1 115 115 GLU H H 1 9.05 . . . . . . . . 115 GLU H . 51275 1
184 . 1 . 1 115 115 GLU N N 15 125.29 . . . . . . . . 115 GLU N . 51275 1
185 . 1 . 1 116 116 ILE H H 1 9.22 . . . . . . . . 116 ILE H . 51275 1
186 . 1 . 1 116 116 ILE N N 15 128.52 . . . . . . . . 116 ILE N . 51275 1
187 . 1 . 1 117 117 ILE H H 1 8.56 . . . . . . . . 117 ILE H . 51275 1
188 . 1 . 1 117 117 ILE N N 15 127.88 . . . . . . . . 117 ILE N . 51275 1
189 . 1 . 1 118 118 ILE H H 1 7.32 . . . . . . . . 118 ILE H . 51275 1
190 . 1 . 1 118 118 ILE N N 15 131.8 . . . . . . . . 118 ILE N . 51275 1
stop_
save_