Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
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 18995
_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 '2D 1H-15N HSQC' . . . 18995 1
2 '3D HNCA' . . . 18995 1
3 '3D HN(CO)CA' . . . 18995 1
4 '3D HNCO' . . . 18995 1
5 '3D HCACO' . . . 18995 1
6 '3D CBCA(CO)NH' . . . 18995 1
7 '3D HNCACB' . . . 18995 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 . 2 2 1 1 SER C C 13 174.260 0.20 0.990 1 . . . B 1 SER C . 18995 1
2 . 2 2 1 1 SER CA C 13 57.700 0.20 1.000 1 . . . B 1 SER CA . 18995 1
3 . 2 2 1 1 SER CB C 13 65.500 0.20 1.000 1 . . . B 1 SER CB . 18995 1
4 . 2 2 2 2 GLU H H 1 9.267 0.02 0.990 1 . . . B 2 GLU H . 18995 1
5 . 2 2 2 2 GLU CA C 13 60.100 0.20 0.635 1 . . . B 2 GLU CA . 18995 1
6 . 2 2 2 2 GLU CB C 13 29.300 0.20 0.629 1 . . . B 2 GLU CB . 18995 1
7 . 2 2 2 2 GLU N N 15 120.641 0.20 0.990 1 . . . B 2 GLU N . 18995 1
8 . 2 2 3 3 LEU C C 13 177.352 0.20 1.000 1 . . . B 3 LEU C . 18995 1
9 . 2 2 3 3 LEU CA C 13 58.400 0.20 1.000 1 . . . B 3 LEU CA . 18995 1
10 . 2 2 3 3 LEU CB C 13 42.400 0.20 1.000 1 . . . B 3 LEU CB . 18995 1
11 . 2 2 4 4 GLU H H 1 8.237 0.02 1.000 1 . . . B 4 GLU H . 18995 1
12 . 2 2 4 4 GLU C C 13 178.536 0.20 1.000 1 . . . B 4 GLU C . 18995 1
13 . 2 2 4 4 GLU CA C 13 59.900 0.20 1.000 1 . . . B 4 GLU CA . 18995 1
14 . 2 2 4 4 GLU CB C 13 30.000 0.20 1.000 1 . . . B 4 GLU CB . 18995 1
15 . 2 2 4 4 GLU N N 15 120.469 0.20 1.000 1 . . . B 4 GLU N . 18995 1
16 . 2 2 5 5 LYS H H 1 8.729 0.02 1.000 1 . . . B 5 LYS H . 18995 1
17 . 2 2 5 5 LYS C C 13 179.518 0.20 1.000 1 . . . B 5 LYS C . 18995 1
18 . 2 2 5 5 LYS CA C 13 60.400 0.20 1.000 1 . . . B 5 LYS CA . 18995 1
19 . 2 2 5 5 LYS CB C 13 32.900 0.20 1.000 1 . . . B 5 LYS CB . 18995 1
20 . 2 2 5 5 LYS CE C 13 42.100 0.20 0.161 1 . . . B 5 LYS CE . 18995 1
21 . 2 2 5 5 LYS N N 15 117.682 0.20 1.000 1 . . . B 5 LYS N . 18995 1
22 . 2 2 6 6 ALA H H 1 8.084 0.02 1.000 1 . . . B 6 ALA H . 18995 1
23 . 2 2 6 6 ALA CA C 13 55.300 0.20 1.000 1 . . . B 6 ALA CA . 18995 1
24 . 2 2 6 6 ALA N N 15 124.152 0.20 1.000 1 . . . B 6 ALA N . 18995 1
25 . 2 2 8 8 VAL C C 13 177.294 0.20 1.000 1 . . . B 8 VAL C . 18995 1
26 . 2 2 8 8 VAL CA C 13 66.900 0.20 1.000 1 . . . B 8 VAL CA . 18995 1
27 . 2 2 8 8 VAL CB C 13 32.000 0.20 1.000 1 . . . B 8 VAL CB . 18995 1
28 . 2 2 9 9 ALA H H 1 8.050 0.02 1.000 1 . . . B 9 ALA H . 18995 1
29 . 2 2 9 9 ALA C C 13 178.639 0.20 1.000 1 . . . B 9 ALA C . 18995 1
30 . 2 2 9 9 ALA CA C 13 55.400 0.20 1.000 1 . . . B 9 ALA CA . 18995 1
31 . 2 2 9 9 ALA CB C 13 18.400 0.20 1.000 1 . . . B 9 ALA CB . 18995 1
32 . 2 2 9 9 ALA N N 15 122.839 0.20 1.000 1 . . . B 9 ALA N . 18995 1
33 . 2 2 10 10 LEU H H 1 8.179 0.02 1.000 1 . . . B 10 LEU H . 18995 1
34 . 2 2 10 10 LEU C C 13 178.381 0.20 1.000 1 . . . B 10 LEU C . 18995 1
35 . 2 2 10 10 LEU CA C 13 59.100 0.20 1.000 1 . . . B 10 LEU CA . 18995 1
36 . 2 2 10 10 LEU CB C 13 42.500 0.20 1.000 1 . . . B 10 LEU CB . 18995 1
37 . 2 2 10 10 LEU N N 15 117.815 0.20 1.000 1 . . . B 10 LEU N . 18995 1
38 . 2 2 11 11 ILE H H 1 7.666 0.02 1.000 1 . . . B 11 ILE H . 18995 1
39 . 2 2 11 11 ILE C C 13 177.860 0.20 1.000 1 . . . B 11 ILE C . 18995 1
40 . 2 2 11 11 ILE CA C 13 65.100 0.20 1.000 1 . . . B 11 ILE CA . 18995 1
41 . 2 2 11 11 ILE N N 15 118.370 0.20 1.000 1 . . . B 11 ILE N . 18995 1
42 . 2 2 12 12 ASP H H 1 8.719 0.02 1.000 1 . . . B 12 ASP H . 18995 1
43 . 2 2 12 12 ASP C C 13 179.459 0.20 1.000 1 . . . B 12 ASP C . 18995 1
44 . 2 2 12 12 ASP CA C 13 58.100 0.20 1.000 1 . . . B 12 ASP CA . 18995 1
45 . 2 2 12 12 ASP CB C 13 40.900 0.20 1.000 1 . . . B 12 ASP CB . 18995 1
46 . 2 2 12 12 ASP N N 15 122.812 0.20 1.000 1 . . . B 12 ASP N . 18995 1
47 . 2 2 13 13 VAL H H 1 8.929 0.02 1.000 1 . . . B 13 VAL H . 18995 1
48 . 2 2 13 13 VAL C C 13 177.167 0.20 1.000 1 . . . B 13 VAL C . 18995 1
49 . 2 2 13 13 VAL CA C 13 66.700 0.20 1.000 1 . . . B 13 VAL CA . 18995 1
50 . 2 2 13 13 VAL N N 15 121.403 0.20 1.000 1 . . . B 13 VAL N . 18995 1
51 . 2 2 14 14 PHE H H 1 8.058 0.02 1.000 1 . . . B 14 PHE H . 18995 1
52 . 2 2 14 14 PHE C C 13 177.234 0.20 1.000 1 . . . B 14 PHE C . 18995 1
53 . 2 2 14 14 PHE CA C 13 63.200 0.20 1.000 1 . . . B 14 PHE CA . 18995 1
54 . 2 2 14 14 PHE CB C 13 39.400 0.20 1.000 1 . . . B 14 PHE CB . 18995 1
55 . 2 2 14 14 PHE N N 15 120.152 0.20 1.000 1 . . . B 14 PHE N . 18995 1
56 . 2 2 15 15 HIS H H 1 8.239 0.02 1.000 1 . . . B 15 HIS H . 18995 1
57 . 2 2 15 15 HIS C C 13 178.154 0.20 1.000 1 . . . B 15 HIS C . 18995 1
58 . 2 2 15 15 HIS CA C 13 58.400 0.20 1.000 1 . . . B 15 HIS CA . 18995 1
59 . 2 2 15 15 HIS CB C 13 29.000 0.20 1.000 1 . . . B 15 HIS CB . 18995 1
60 . 2 2 15 15 HIS N N 15 116.727 0.20 1.000 1 . . . B 15 HIS N . 18995 1
61 . 2 2 16 16 GLN H H 1 8.363 0.02 1.000 1 . . . B 16 GLN H . 18995 1
62 . 2 2 16 16 GLN C C 13 177.482 0.20 1.000 1 . . . B 16 GLN C . 18995 1
63 . 2 2 16 16 GLN CA C 13 58.900 0.20 1.000 1 . . . B 16 GLN CA . 18995 1
64 . 2 2 16 16 GLN CB C 13 28.300 0.20 1.000 1 . . . B 16 GLN CB . 18995 1
65 . 2 2 16 16 GLN N N 15 122.963 0.20 1.000 1 . . . B 16 GLN N . 18995 1
66 . 2 2 17 17 TYR H H 1 7.264 0.02 1.000 1 . . . B 17 TYR H . 18995 1
67 . 2 2 17 17 TYR C C 13 176.106 0.20 1.000 1 . . . B 17 TYR C . 18995 1
68 . 2 2 17 17 TYR CA C 13 61.300 0.20 1.000 1 . . . B 17 TYR CA . 18995 1
69 . 2 2 17 17 TYR CB C 13 40.400 0.20 1.000 1 . . . B 17 TYR CB . 18995 1
70 . 2 2 17 17 TYR N N 15 116.073 0.20 1.000 1 . . . B 17 TYR N . 18995 1
71 . 2 2 18 18 SER H H 1 9.228 0.02 1.000 1 . . . B 18 SER H . 18995 1
72 . 2 2 18 18 SER C C 13 177.339 0.20 1.000 1 . . . B 18 SER C . 18995 1
73 . 2 2 18 18 SER CA C 13 62.100 0.20 1.000 1 . . . B 18 SER CA . 18995 1
74 . 2 2 18 18 SER N N 15 116.120 0.20 1.000 1 . . . B 18 SER N . 18995 1
75 . 2 2 19 19 GLY H H 1 7.758 0.02 1.000 1 . . . B 19 GLY H . 18995 1
76 . 2 2 19 19 GLY C C 13 173.303 0.20 1.000 1 . . . B 19 GLY C . 18995 1
77 . 2 2 19 19 GLY CA C 13 45.700 0.20 1.000 1 . . . B 19 GLY CA . 18995 1
78 . 2 2 19 19 GLY N N 15 110.664 0.20 1.000 1 . . . B 19 GLY N . 18995 1
79 . 2 2 20 20 ARG H H 1 7.135 0.02 1.000 1 . . . B 20 ARG H . 18995 1
80 . 2 2 20 20 ARG C C 13 177.097 0.20 1.000 1 . . . B 20 ARG C . 18995 1
81 . 2 2 20 20 ARG CA C 13 60.100 0.20 1.000 1 . . . B 20 ARG CA . 18995 1
82 . 2 2 20 20 ARG CB C 13 31.000 0.20 1.000 1 . . . B 20 ARG CB . 18995 1
83 . 2 2 20 20 ARG CD C 13 43.300 0.20 0.155 1 . . . B 20 ARG CD . 18995 1
84 . 2 2 20 20 ARG N N 15 121.554 0.20 1.000 1 . . . B 20 ARG N . 18995 1
85 . 2 2 21 21 GLU H H 1 9.468 0.02 1.000 1 . . . B 21 GLU H . 18995 1
86 . 2 2 21 21 GLU C C 13 175.055 0.20 0.998 1 . . . B 21 GLU C . 18995 1
87 . 2 2 21 21 GLU CA C 13 55.600 0.20 1.000 1 . . . B 21 GLU CA . 18995 1
88 . 2 2 21 21 GLU CB C 13 35.700 0.20 1.000 1 . . . B 21 GLU CB . 18995 1
89 . 2 2 21 21 GLU N N 15 116.519 0.20 1.000 1 . . . B 21 GLU N . 18995 1
90 . 2 2 23 23 ASP H H 1 8.115 0.02 1.000 1 . . . B 23 ASP H . 18995 1
91 . 2 2 23 23 ASP C C 13 178.957 0.20 1.000 1 . . . B 23 ASP C . 18995 1
92 . 2 2 23 23 ASP CA C 13 55.500 0.20 1.000 1 . . . B 23 ASP CA . 18995 1
93 . 2 2 24 24 LYS C C 13 176.539 0.20 1.000 1 . . . B 24 LYS C . 18995 1
94 . 2 2 24 24 LYS CA C 13 58.200 0.20 1.000 1 . . . B 24 LYS CA . 18995 1
95 . 2 2 24 24 LYS CB C 13 31.700 0.20 1.000 1 . . . B 24 LYS CB . 18995 1
96 . 2 2 24 24 LYS CE C 13 42.100 0.20 0.161 1 . . . B 24 LYS CE . 18995 1
97 . 2 2 24 24 LYS N N 15 131.954 0.20 1.000 1 . . . B 24 LYS N . 18995 1
98 . 2 2 25 25 HIS H H 1 9.589 0.02 1.000 1 . . . B 25 HIS H . 18995 1
99 . 2 2 25 25 HIS C C 13 172.815 0.20 1.000 1 . . . B 25 HIS C . 18995 1
100 . 2 2 25 25 HIS CA C 13 55.500 0.20 1.000 1 . . . B 25 HIS CA . 18995 1
101 . 2 2 25 25 HIS CB C 13 30.800 0.20 1.000 1 . . . B 25 HIS CB . 18995 1
102 . 2 2 25 25 HIS N N 15 119.313 0.20 1.000 1 . . . B 25 HIS N . 18995 1
103 . 2 2 26 26 LYS H H 1 7.095 0.02 1.000 1 . . . B 26 LYS H . 18995 1
104 . 2 2 26 26 LYS C C 13 174.608 0.20 1.000 1 . . . B 26 LYS C . 18995 1
105 . 2 2 26 26 LYS CA C 13 55.400 0.20 1.000 1 . . . B 26 LYS CA . 18995 1
106 . 2 2 26 26 LYS CB C 13 39.100 0.20 1.000 1 . . . B 26 LYS CB . 18995 1
107 . 2 2 26 26 LYS CE C 13 42.100 0.20 0.161 1 . . . B 26 LYS CE . 18995 1
108 . 2 2 26 26 LYS N N 15 115.394 0.20 1.000 1 . . . B 26 LYS N . 18995 1
109 . 2 2 27 27 LEU H H 1 9.595 0.02 1.000 1 . . . B 27 LEU H . 18995 1
110 . 2 2 27 27 LEU C C 13 175.637 0.20 1.000 1 . . . B 27 LEU C . 18995 1
111 . 2 2 27 27 LEU CA C 13 52.800 0.20 1.000 1 . . . B 27 LEU CA . 18995 1
112 . 2 2 27 27 LEU CB C 13 43.700 0.20 1.000 1 . . . B 27 LEU CB . 18995 1
113 . 2 2 27 27 LEU N N 15 126.263 0.20 1.000 1 . . . B 27 LEU N . 18995 1
114 . 2 2 28 28 LYS H H 1 9.711 0.02 1.000 1 . . . B 28 LYS H . 18995 1
115 . 2 2 28 28 LYS C C 13 177.395 0.20 1.000 1 . . . B 28 LYS C . 18995 1
116 . 2 2 28 28 LYS CA C 13 55.200 0.20 1.000 1 . . . B 28 LYS CA . 18995 1
117 . 2 2 28 28 LYS CB C 13 33.000 0.20 1.000 1 . . . B 28 LYS CB . 18995 1
118 . 2 2 28 28 LYS CE C 13 42.100 0.20 0.161 1 . . . B 28 LYS CE . 18995 1
119 . 2 2 28 28 LYS N N 15 124.436 0.20 1.000 1 . . . B 28 LYS N . 18995 1
120 . 2 2 29 29 LYS H H 1 9.084 0.02 1.000 1 . . . B 29 LYS H . 18995 1
121 . 2 2 29 29 LYS C C 13 177.400 0.20 1.000 1 . . . B 29 LYS C . 18995 1
122 . 2 2 29 29 LYS CA C 13 62.700 0.20 1.000 1 . . . B 29 LYS CA . 18995 1
123 . 2 2 29 29 LYS CB C 13 32.500 0.20 1.000 1 . . . B 29 LYS CB . 18995 1
124 . 2 2 29 29 LYS CE C 13 42.100 0.20 0.161 1 . . . B 29 LYS CE . 18995 1
125 . 2 2 29 29 LYS N N 15 121.980 0.20 1.000 1 . . . B 29 LYS N . 18995 1
126 . 2 2 30 30 SER H H 1 8.267 0.02 1.000 1 . . . B 30 SER H . 18995 1
127 . 2 2 30 30 SER C C 13 176.950 0.20 1.000 1 . . . B 30 SER C . 18995 1
128 . 2 2 30 30 SER CA C 13 61.100 0.20 1.000 1 . . . B 30 SER CA . 18995 1
129 . 2 2 30 30 SER CB C 13 61.300 0.20 1.000 1 . . . B 30 SER CB . 18995 1
130 . 2 2 30 30 SER N N 15 111.519 0.20 1.000 1 . . . B 30 SER N . 18995 1
131 . 2 2 31 31 GLU H H 1 6.603 0.02 1.000 1 . . . B 31 GLU H . 18995 1
132 . 2 2 31 31 GLU C C 13 179.463 0.20 1.000 1 . . . B 31 GLU C . 18995 1
133 . 2 2 31 31 GLU CA C 13 60.100 0.20 1.000 1 . . . B 31 GLU CA . 18995 1
134 . 2 2 31 31 GLU CB C 13 29.200 0.20 1.000 1 . . . B 31 GLU CB . 18995 1
135 . 2 2 31 31 GLU N N 15 123.792 0.20 1.000 1 . . . B 31 GLU N . 18995 1
136 . 2 2 32 32 LEU H H 1 8.936 0.02 1.000 1 . . . B 32 LEU H . 18995 1
137 . 2 2 32 32 LEU C C 13 176.995 0.20 1.000 1 . . . B 32 LEU C . 18995 1
138 . 2 2 32 32 LEU CA C 13 57.900 0.20 1.000 1 . . . B 32 LEU CA . 18995 1
139 . 2 2 32 32 LEU CB C 13 42.300 0.20 1.000 1 . . . B 32 LEU CB . 18995 1
140 . 2 2 32 32 LEU N N 15 121.954 0.20 1.000 1 . . . B 32 LEU N . 18995 1
141 . 2 2 33 33 LYS H H 1 8.390 0.02 1.000 1 . . . B 33 LYS H . 18995 1
142 . 2 2 33 33 LYS C C 13 176.714 0.20 1.000 1 . . . B 33 LYS C . 18995 1
143 . 2 2 33 33 LYS CA C 13 60.500 0.20 1.000 1 . . . B 33 LYS CA . 18995 1
144 . 2 2 33 33 LYS CB C 13 32.900 0.20 1.000 1 . . . B 33 LYS CB . 18995 1
145 . 2 2 33 33 LYS CE C 13 42.100 0.20 0.161 1 . . . B 33 LYS CE . 18995 1
146 . 2 2 33 33 LYS N N 15 118.576 0.20 1.000 1 . . . B 33 LYS N . 18995 1
147 . 2 2 34 34 GLU H H 1 7.326 0.02 1.000 1 . . . B 34 GLU H . 18995 1
148 . 2 2 34 34 GLU C C 13 177.689 0.20 1.000 1 . . . B 34 GLU C . 18995 1
149 . 2 2 34 34 GLU CA C 13 59.400 0.20 1.000 1 . . . B 34 GLU CA . 18995 1
150 . 2 2 34 34 GLU CB C 13 29.400 0.20 1.000 1 . . . B 34 GLU CB . 18995 1
151 . 2 2 34 34 GLU N N 15 116.152 0.20 1.000 1 . . . B 34 GLU N . 18995 1
152 . 2 2 35 35 LEU H H 1 7.978 0.02 1.000 1 . . . B 35 LEU H . 18995 1
153 . 2 2 35 35 LEU C C 13 178.845 0.20 1.000 1 . . . B 35 LEU C . 18995 1
154 . 2 2 35 35 LEU CA C 13 59.800 0.20 1.000 1 . . . B 35 LEU CA . 18995 1
155 . 2 2 35 35 LEU CB C 13 42.000 0.20 1.000 1 . . . B 35 LEU CB . 18995 1
156 . 2 2 35 35 LEU N N 15 123.632 0.20 1.000 1 . . . B 35 LEU N . 18995 1
157 . 2 2 36 36 ILE H H 1 8.470 0.02 1.000 1 . . . B 36 ILE H . 18995 1
158 . 2 2 36 36 ILE C C 13 178.328 0.20 1.000 1 . . . B 36 ILE C . 18995 1
159 . 2 2 36 36 ILE CA C 13 66.300 0.20 1.000 1 . . . B 36 ILE CA . 18995 1
160 . 2 2 36 36 ILE CB C 13 38.700 0.20 1.000 1 . . . B 36 ILE CB . 18995 1
161 . 2 2 36 36 ILE N N 15 121.271 0.20 1.000 1 . . . B 36 ILE N . 18995 1
162 . 2 2 37 37 ASN H H 1 8.336 0.02 1.000 1 . . . B 37 ASN H . 18995 1
163 . 2 2 37 37 ASN C C 13 177.052 0.20 1.000 1 . . . B 37 ASN C . 18995 1
164 . 2 2 37 37 ASN CA C 13 54.800 0.20 1.000 1 . . . B 37 ASN CA . 18995 1
165 . 2 2 37 37 ASN CB C 13 37.500 0.20 1.000 1 . . . B 37 ASN CB . 18995 1
166 . 2 2 37 37 ASN N N 15 118.242 0.20 1.000 1 . . . B 37 ASN N . 18995 1
167 . 2 2 38 38 ASN H H 1 8.213 0.02 1.000 1 . . . B 38 ASN H . 18995 1
168 . 2 2 38 38 ASN C C 13 176.578 0.20 1.000 1 . . . B 38 ASN C . 18995 1
169 . 2 2 38 38 ASN CA C 13 55.200 0.20 1.000 1 . . . B 38 ASN CA . 18995 1
170 . 2 2 38 38 ASN CB C 13 40.800 0.20 1.000 1 . . . B 38 ASN CB . 18995 1
171 . 2 2 38 38 ASN N N 15 114.845 0.20 1.000 1 . . . B 38 ASN N . 18995 1
172 . 2 2 39 39 GLU H H 1 8.522 0.02 1.000 1 . . . B 39 GLU H . 18995 1
173 . 2 2 39 39 GLU C C 13 177.689 0.20 1.000 1 . . . B 39 GLU C . 18995 1
174 . 2 2 39 39 GLU CA C 13 55.200 0.20 1.000 1 . . . B 39 GLU CA . 18995 1
175 . 2 2 39 39 GLU CB C 13 31.300 0.20 1.000 1 . . . B 39 GLU CB . 18995 1
176 . 2 2 39 39 GLU N N 15 113.797 0.20 1.000 1 . . . B 39 GLU N . 18995 1
177 . 2 2 40 40 LEU H H 1 7.552 0.02 1.000 1 . . . B 40 LEU H . 18995 1
178 . 2 2 40 40 LEU C C 13 177.212 0.20 1.000 1 . . . B 40 LEU C . 18995 1
179 . 2 2 40 40 LEU CA C 13 54.100 0.20 1.000 1 . . . B 40 LEU CA . 18995 1
180 . 2 2 40 40 LEU CB C 13 42.700 0.20 1.000 1 . . . B 40 LEU CB . 18995 1
181 . 2 2 40 40 LEU N N 15 119.982 0.20 1.000 1 . . . B 40 LEU N . 18995 1
182 . 2 2 41 41 SER H H 1 7.592 0.02 1.000 1 . . . B 41 SER H . 18995 1
183 . 2 2 41 41 SER C C 13 175.688 0.20 1.000 1 . . . B 41 SER C . 18995 1
184 . 2 2 41 41 SER CA C 13 60.800 0.20 1.000 1 . . . B 41 SER CA . 18995 1
185 . 2 2 41 41 SER CB C 13 64.100 0.20 1.000 1 . . . B 41 SER CB . 18995 1
186 . 2 2 41 41 SER N N 15 114.635 0.20 1.000 1 . . . B 41 SER N . 18995 1
187 . 2 2 42 42 HIS H H 1 10.406 0.02 1.000 1 . . . B 42 HIS H . 18995 1
188 . 2 2 42 42 HIS C C 13 175.523 0.20 1.000 1 . . . B 42 HIS C . 18995 1
189 . 2 2 42 42 HIS CA C 13 58.700 0.20 1.000 1 . . . B 42 HIS CA . 18995 1
190 . 2 2 42 42 HIS CB C 13 28.600 0.20 1.000 1 . . . B 42 HIS CB . 18995 1
191 . 2 2 42 42 HIS N N 15 122.397 0.20 1.000 1 . . . B 42 HIS N . 18995 1
192 . 2 2 43 43 PHE H H 1 7.785 0.02 1.000 1 . . . B 43 PHE H . 18995 1
193 . 2 2 43 43 PHE C C 13 177.431 0.20 1.000 1 . . . B 43 PHE C . 18995 1
194 . 2 2 43 43 PHE CA C 13 58.800 0.20 1.000 1 . . . B 43 PHE CA . 18995 1
195 . 2 2 43 43 PHE N N 15 117.618 0.20 1.000 1 . . . B 43 PHE N . 18995 1
196 . 2 2 44 44 LEU H H 1 8.533 0.02 1.000 1 . . . B 44 LEU H . 18995 1
197 . 2 2 44 44 LEU C C 13 175.829 0.20 1.000 1 . . . B 44 LEU C . 18995 1
198 . 2 2 44 44 LEU CA C 13 53.800 0.20 1.000 1 . . . B 44 LEU CA . 18995 1
199 . 2 2 44 44 LEU CB C 13 45.000 0.20 1.000 1 . . . B 44 LEU CB . 18995 1
200 . 2 2 44 44 LEU N N 15 120.185 0.20 1.000 1 . . . B 44 LEU N . 18995 1
201 . 2 2 45 45 GLU H H 1 8.130 0.02 1.000 1 . . . B 45 GLU H . 18995 1
202 . 2 2 45 45 GLU C C 13 175.060 0.20 1.000 1 . . . B 45 GLU C . 18995 1
203 . 2 2 45 45 GLU CA C 13 56.600 0.20 1.000 1 . . . B 45 GLU CA . 18995 1
204 . 2 2 45 45 GLU CB C 13 30.600 0.20 1.000 1 . . . B 45 GLU CB . 18995 1
205 . 2 2 45 45 GLU N N 15 121.499 0.20 1.000 1 . . . B 45 GLU N . 18995 1
206 . 2 2 46 46 GLU H H 1 8.123 0.02 1.000 1 . . . B 46 GLU H . 18995 1
207 . 2 2 46 46 GLU C C 13 176.861 0.20 1.000 1 . . . B 46 GLU C . 18995 1
208 . 2 2 46 46 GLU CA C 13 56.800 0.20 1.000 1 . . . B 46 GLU CA . 18995 1
209 . 2 2 46 46 GLU CB C 13 30.700 0.20 1.000 1 . . . B 46 GLU CB . 18995 1
210 . 2 2 46 46 GLU N N 15 122.480 0.20 1.000 1 . . . B 46 GLU N . 18995 1
211 . 2 2 47 47 ILE H H 1 9.897 0.02 1.000 1 . . . B 47 ILE H . 18995 1
212 . 2 2 47 47 ILE C C 13 175.931 0.20 1.000 1 . . . B 47 ILE C . 18995 1
213 . 2 2 47 47 ILE CA C 13 62.100 0.20 1.000 1 . . . B 47 ILE CA . 18995 1
214 . 2 2 47 47 ILE CB C 13 38.600 0.20 1.000 1 . . . B 47 ILE CB . 18995 1
215 . 2 2 47 47 ILE N N 15 127.680 0.20 1.000 1 . . . B 47 ILE N . 18995 1
216 . 2 2 48 48 LYS H H 1 9.077 0.02 1.000 1 . . . B 48 LYS H . 18995 1
217 . 2 2 48 48 LYS C C 13 175.896 0.20 1.000 1 . . . B 48 LYS C . 18995 1
218 . 2 2 48 48 LYS CA C 13 56.600 0.20 1.000 1 . . . B 48 LYS CA . 18995 1
219 . 2 2 48 48 LYS CB C 13 34.700 0.20 1.000 1 . . . B 48 LYS CB . 18995 1
220 . 2 2 48 48 LYS CE C 13 42.100 0.20 0.161 1 . . . B 48 LYS CE . 18995 1
221 . 2 2 48 48 LYS N N 15 126.846 0.20 1.000 1 . . . B 48 LYS N . 18995 1
222 . 2 2 49 49 GLU H H 1 7.636 0.02 1.000 1 . . . B 49 GLU H . 18995 1
223 . 2 2 49 49 GLU C C 13 179.470 0.20 1.000 1 . . . B 49 GLU C . 18995 1
224 . 2 2 49 49 GLU CA C 13 55.600 0.20 1.000 1 . . . B 49 GLU CA . 18995 1
225 . 2 2 49 49 GLU CB C 13 31.800 0.20 1.000 1 . . . B 49 GLU CB . 18995 1
226 . 2 2 49 49 GLU N N 15 118.747 0.20 1.000 1 . . . B 49 GLU N . 18995 1
227 . 2 2 50 50 GLN H H 1 9.041 0.02 1.000 1 . . . B 50 GLN H . 18995 1
228 . 2 2 50 50 GLN C C 13 176.883 0.20 1.000 1 . . . B 50 GLN C . 18995 1
229 . 2 2 50 50 GLN CA C 13 58.500 0.20 1.000 1 . . . B 50 GLN CA . 18995 1
230 . 2 2 50 50 GLN CB C 13 28.400 0.20 1.000 1 . . . B 50 GLN CB . 18995 1
231 . 2 2 50 50 GLN N N 15 125.850 0.20 1.000 1 . . . B 50 GLN N . 18995 1
232 . 2 2 51 51 GLU H H 1 9.352 0.02 1.000 1 . . . B 51 GLU H . 18995 1
233 . 2 2 51 51 GLU C C 13 178.262 0.20 1.000 1 . . . B 51 GLU C . 18995 1
234 . 2 2 51 51 GLU CA C 13 59.700 0.20 1.000 1 . . . B 51 GLU CA . 18995 1
235 . 2 2 51 51 GLU CB C 13 29.300 0.20 1.000 1 . . . B 51 GLU CB . 18995 1
236 . 2 2 51 51 GLU N N 15 117.404 0.20 1.000 1 . . . B 51 GLU N . 18995 1
237 . 2 2 52 52 VAL H H 1 7.247 0.02 1.000 1 . . . B 52 VAL H . 18995 1
238 . 2 2 52 52 VAL C C 13 177.677 0.20 1.000 1 . . . B 52 VAL C . 18995 1
239 . 2 2 52 52 VAL CA C 13 66.100 0.20 1.000 1 . . . B 52 VAL CA . 18995 1
240 . 2 2 52 52 VAL CB C 13 31.700 0.20 1.000 1 . . . B 52 VAL CB . 18995 1
241 . 2 2 52 52 VAL N N 15 118.888 0.20 1.000 1 . . . B 52 VAL N . 18995 1
242 . 2 2 53 53 VAL H H 1 7.264 0.02 1.000 1 . . . B 53 VAL H . 18995 1
243 . 2 2 53 53 VAL C C 13 176.742 0.20 1.000 1 . . . B 53 VAL C . 18995 1
244 . 2 2 53 53 VAL CA C 13 66.200 0.20 1.000 1 . . . B 53 VAL CA . 18995 1
245 . 2 2 53 53 VAL CB C 13 31.600 0.20 1.000 1 . . . B 53 VAL CB . 18995 1
246 . 2 2 53 53 VAL N N 15 119.906 0.20 1.000 1 . . . B 53 VAL N . 18995 1
247 . 2 2 54 54 ASP H H 1 8.524 0.02 1.000 1 . . . B 54 ASP H . 18995 1
248 . 2 2 54 54 ASP C C 13 178.291 0.20 1.000 1 . . . B 54 ASP C . 18995 1
249 . 2 2 54 54 ASP CA C 13 58.200 0.20 1.000 1 . . . B 54 ASP CA . 18995 1
250 . 2 2 54 54 ASP CB C 13 40.000 0.20 1.000 1 . . . B 54 ASP CB . 18995 1
251 . 2 2 54 54 ASP N N 15 121.483 0.20 1.000 1 . . . B 54 ASP N . 18995 1
252 . 2 2 55 55 LYS H H 1 7.580 0.02 1.000 1 . . . B 55 LYS H . 18995 1
253 . 2 2 55 55 LYS C C 13 179.054 0.20 1.000 1 . . . B 55 LYS C . 18995 1
254 . 2 2 55 55 LYS CA C 13 58.900 0.20 1.000 1 . . . B 55 LYS CA . 18995 1
255 . 2 2 55 55 LYS CB C 13 32.200 0.20 1.000 1 . . . B 55 LYS CB . 18995 1
256 . 2 2 55 55 LYS CE C 13 42.100 0.20 0.161 1 . . . B 55 LYS CE . 18995 1
257 . 2 2 55 55 LYS N N 15 120.875 0.20 1.000 1 . . . B 55 LYS N . 18995 1
258 . 2 2 56 56 VAL H H 1 8.279 0.02 1.000 1 . . . B 56 VAL H . 18995 1
259 . 2 2 56 56 VAL C C 13 178.221 0.20 1.000 1 . . . B 56 VAL C . 18995 1
260 . 2 2 56 56 VAL CA C 13 67.000 0.20 1.000 1 . . . B 56 VAL CA . 18995 1
261 . 2 2 56 56 VAL CB C 13 31.700 0.20 1.000 1 . . . B 56 VAL CB . 18995 1
262 . 2 2 56 56 VAL N N 15 121.960 0.20 1.000 1 . . . B 56 VAL N . 18995 1
263 . 2 2 57 57 MET H H 1 8.467 0.02 1.000 1 . . . B 57 MET H . 18995 1
264 . 2 2 57 57 MET C C 13 176.888 0.20 1.000 1 . . . B 57 MET C . 18995 1
265 . 2 2 57 57 MET CA C 13 57.900 0.20 1.000 1 . . . B 57 MET CA . 18995 1
266 . 2 2 57 57 MET CB C 13 32.900 0.20 1.000 1 . . . B 57 MET CB . 18995 1
267 . 2 2 57 57 MET N N 15 118.815 0.20 1.000 1 . . . B 57 MET N . 18995 1
268 . 2 2 58 58 GLU H H 1 8.073 0.02 1.000 1 . . . B 58 GLU H . 18995 1
269 . 2 2 58 58 GLU C C 13 178.510 0.20 1.000 1 . . . B 58 GLU C . 18995 1
270 . 2 2 58 58 GLU CA C 13 59.400 0.20 1.000 1 . . . B 58 GLU CA . 18995 1
271 . 2 2 58 58 GLU CB C 13 29.800 0.20 1.000 1 . . . B 58 GLU CB . 18995 1
272 . 2 2 58 58 GLU N N 15 117.894 0.20 1.000 1 . . . B 58 GLU N . 18995 1
273 . 2 2 59 59 THR H H 1 7.739 0.02 1.000 1 . . . B 59 THR H . 18995 1
274 . 2 2 59 59 THR C C 13 174.778 0.20 1.000 1 . . . B 59 THR C . 18995 1
275 . 2 2 59 59 THR CA C 13 65.600 0.20 1.000 1 . . . B 59 THR CA . 18995 1
276 . 2 2 59 59 THR CB C 13 69.600 0.20 1.000 1 . . . B 59 THR CB . 18995 1
277 . 2 2 59 59 THR N N 15 113.244 0.20 1.000 1 . . . B 59 THR N . 18995 1
278 . 2 2 60 60 LEU H H 1 7.643 0.02 1.000 1 . . . B 60 LEU H . 18995 1
279 . 2 2 60 60 LEU C C 13 177.561 0.20 1.000 1 . . . B 60 LEU C . 18995 1
280 . 2 2 60 60 LEU CA C 13 55.600 0.20 1.000 1 . . . B 60 LEU CA . 18995 1
281 . 2 2 60 60 LEU CB C 13 43.300 0.20 1.000 1 . . . B 60 LEU CB . 18995 1
282 . 2 2 60 60 LEU N N 15 119.636 0.20 1.000 1 . . . B 60 LEU N . 18995 1
283 . 2 2 61 61 ASP H H 1 7.984 0.02 1.000 1 . . . B 61 ASP H . 18995 1
284 . 2 2 61 61 ASP C C 13 175.915 0.20 1.000 1 . . . B 61 ASP C . 18995 1
285 . 2 2 61 61 ASP CA C 13 54.600 0.20 1.000 1 . . . B 61 ASP CA . 18995 1
286 . 2 2 61 61 ASP CB C 13 40.100 0.20 1.000 1 . . . B 61 ASP CB . 18995 1
287 . 2 2 61 61 ASP N N 15 117.424 0.20 1.000 1 . . . B 61 ASP N . 18995 1
288 . 2 2 62 62 ASN H H 1 9.032 0.02 1.000 1 . . . B 62 ASN H . 18995 1
289 . 2 2 62 62 ASN C C 13 175.905 0.20 1.000 1 . . . B 62 ASN C . 18995 1
290 . 2 2 62 62 ASN CA C 13 54.900 0.20 1.000 1 . . . B 62 ASN CA . 18995 1
291 . 2 2 62 62 ASN CB C 13 40.400 0.20 1.000 1 . . . B 62 ASN CB . 18995 1
292 . 2 2 62 62 ASN N N 15 127.650 0.20 1.000 1 . . . B 62 ASN N . 18995 1
293 . 2 2 63 63 ASP H H 1 8.302 0.02 1.000 1 . . . B 63 ASP H . 18995 1
294 . 2 2 63 63 ASP C C 13 177.604 0.20 1.000 1 . . . B 63 ASP C . 18995 1
295 . 2 2 63 63 ASP CA C 13 53.400 0.20 1.000 1 . . . B 63 ASP CA . 18995 1
296 . 2 2 63 63 ASP CB C 13 40.200 0.20 1.000 1 . . . B 63 ASP CB . 18995 1
297 . 2 2 63 63 ASP N N 15 116.676 0.20 1.000 1 . . . B 63 ASP N . 18995 1
298 . 2 2 64 64 GLY H H 1 7.681 0.02 1.000 1 . . . B 64 GLY H . 18995 1
299 . 2 2 64 64 GLY C C 13 174.834 0.20 1.000 1 . . . B 64 GLY C . 18995 1
300 . 2 2 64 64 GLY CA C 13 47.700 0.20 1.000 1 . . . B 64 GLY CA . 18995 1
301 . 2 2 64 64 GLY N N 15 109.334 0.20 1.000 1 . . . B 64 GLY N . 18995 1
302 . 2 2 65 65 ASP H H 1 8.386 0.02 1.000 1 . . . B 65 ASP H . 18995 1
303 . 2 2 65 65 ASP C C 13 177.010 0.20 1.000 1 . . . B 65 ASP C . 18995 1
304 . 2 2 65 65 ASP CA C 13 53.800 0.20 1.000 1 . . . B 65 ASP CA . 18995 1
305 . 2 2 65 65 ASP CB C 13 40.300 0.20 1.000 1 . . . B 65 ASP CB . 18995 1
306 . 2 2 65 65 ASP N N 15 120.960 0.20 1.000 1 . . . B 65 ASP N . 18995 1
307 . 2 2 66 66 GLY H H 1 10.212 0.02 1.000 1 . . . B 66 GLY H . 18995 1
308 . 2 2 66 66 GLY C C 13 172.343 0.20 1.000 1 . . . B 66 GLY C . 18995 1
309 . 2 2 66 66 GLY CA C 13 45.900 0.20 1.000 1 . . . B 66 GLY CA . 18995 1
310 . 2 2 66 66 GLY N N 15 113.875 0.20 1.000 1 . . . B 66 GLY N . 18995 1
311 . 2 2 67 67 GLU H H 1 7.949 0.02 1.000 1 . . . B 67 GLU H . 18995 1
312 . 2 2 67 67 GLU C C 13 174.711 0.20 1.000 1 . . . B 67 GLU C . 18995 1
313 . 2 2 67 67 GLU CA C 13 55.200 0.20 1.000 1 . . . B 67 GLU CA . 18995 1
314 . 2 2 67 67 GLU CB C 13 34.400 0.20 1.000 1 . . . B 67 GLU CB . 18995 1
315 . 2 2 67 67 GLU N N 15 118.701 0.20 1.000 1 . . . B 67 GLU N . 18995 1
316 . 2 2 68 68 CYS H H 1 9.486 0.02 1.000 1 . . . B 68 CYS H . 18995 1
317 . 2 2 68 68 CYS C C 13 174.411 0.20 1.000 1 . . . B 68 CYS C . 18995 1
318 . 2 2 68 68 CYS CA C 13 57.000 0.20 1.000 1 . . . B 68 CYS CA . 18995 1
319 . 2 2 68 68 CYS CB C 13 28.100 0.20 1.000 1 . . . B 68 CYS CB . 18995 1
320 . 2 2 68 68 CYS N N 15 124.753 0.20 1.000 1 . . . B 68 CYS N . 18995 1
321 . 2 2 69 69 ASP H H 1 9.911 0.02 1.000 1 . . . B 69 ASP H . 18995 1
322 . 2 2 69 69 ASP C C 13 175.307 0.20 1.000 1 . . . B 69 ASP C . 18995 1
323 . 2 2 69 69 ASP CA C 13 53.300 0.20 1.000 1 . . . B 69 ASP CA . 18995 1
324 . 2 2 69 69 ASP CB C 13 40.600 0.20 1.000 1 . . . B 69 ASP CB . 18995 1
325 . 2 2 69 69 ASP N N 15 132.376 0.20 1.000 1 . . . B 69 ASP N . 18995 1
326 . 2 2 70 70 PHE H H 1 9.075 0.02 1.000 1 . . . B 70 PHE H . 18995 1
327 . 2 2 70 70 PHE C C 13 176.482 0.20 1.000 1 . . . B 70 PHE C . 18995 1
328 . 2 2 70 70 PHE CA C 13 62.900 0.20 1.000 1 . . . B 70 PHE CA . 18995 1
329 . 2 2 70 70 PHE CB C 13 39.100 0.20 1.000 1 . . . B 70 PHE CB . 18995 1
330 . 2 2 70 70 PHE N N 15 119.131 0.20 1.000 1 . . . B 70 PHE N . 18995 1
331 . 2 2 71 71 GLN H H 1 8.047 0.02 1.000 1 . . . B 71 GLN H . 18995 1
332 . 2 2 71 71 GLN C C 13 179.517 0.20 1.000 1 . . . B 71 GLN C . 18995 1
333 . 2 2 71 71 GLN CA C 13 60.100 0.20 1.000 1 . . . B 71 GLN CA . 18995 1
334 . 2 2 71 71 GLN CB C 13 28.200 0.20 1.000 1 . . . B 71 GLN CB . 18995 1
335 . 2 2 71 71 GLN N N 15 119.323 0.20 1.000 1 . . . B 71 GLN N . 18995 1
336 . 2 2 72 72 GLU H H 1 9.061 0.02 1.000 1 . . . B 72 GLU H . 18995 1
337 . 2 2 72 72 GLU C C 13 179.337 0.20 1.000 1 . . . B 72 GLU C . 18995 1
338 . 2 2 72 72 GLU CA C 13 58.900 0.20 1.000 1 . . . B 72 GLU CA . 18995 1
339 . 2 2 72 72 GLU CB C 13 30.300 0.20 1.000 1 . . . B 72 GLU CB . 18995 1
340 . 2 2 72 72 GLU N N 15 123.228 0.20 1.000 1 . . . B 72 GLU N . 18995 1
341 . 2 2 73 73 PHE H H 1 8.863 0.02 1.000 1 . . . B 73 PHE H . 18995 1
342 . 2 2 73 73 PHE C C 13 176.497 0.20 1.000 1 . . . B 73 PHE C . 18995 1
343 . 2 2 73 73 PHE CA C 13 60.800 0.20 1.000 1 . . . B 73 PHE CA . 18995 1
344 . 2 2 73 73 PHE CB C 13 39.700 0.20 1.000 1 . . . B 73 PHE CB . 18995 1
345 . 2 2 73 73 PHE N N 15 123.155 0.20 1.000 1 . . . B 73 PHE N . 18995 1
346 . 2 2 74 74 MET H H 1 8.217 0.02 1.000 1 . . . B 74 MET H . 18995 1
347 . 2 2 74 74 MET C C 13 178.476 0.20 1.000 1 . . . B 74 MET C . 18995 1
348 . 2 2 74 74 MET CA C 13 56.200 0.20 1.000 1 . . . B 74 MET CA . 18995 1
349 . 2 2 74 74 MET CB C 13 30.400 0.20 1.000 1 . . . B 74 MET CB . 18995 1
350 . 2 2 74 74 MET N N 15 119.622 0.20 1.000 1 . . . B 74 MET N . 18995 1
351 . 2 2 75 75 ALA H H 1 7.490 0.02 1.000 1 . . . B 75 ALA H . 18995 1
352 . 2 2 75 75 ALA C C 13 180.129 0.20 1.000 1 . . . B 75 ALA C . 18995 1
353 . 2 2 75 75 ALA CA C 13 55.200 0.20 1.000 1 . . . B 75 ALA CA . 18995 1
354 . 2 2 75 75 ALA N N 15 123.073 0.20 1.000 1 . . . B 75 ALA N . 18995 1
355 . 2 2 76 76 PHE H H 1 7.676 0.02 1.000 1 . . . B 76 PHE H . 18995 1
356 . 2 2 76 76 PHE C C 13 176.365 0.20 1.000 1 . . . B 76 PHE C . 18995 1
357 . 2 2 76 76 PHE CA C 13 59.800 0.20 1.000 1 . . . B 76 PHE CA . 18995 1
358 . 2 2 76 76 PHE CB C 13 38.600 0.20 1.000 1 . . . B 76 PHE CB . 18995 1
359 . 2 2 76 76 PHE N N 15 122.171 0.20 1.000 1 . . . B 76 PHE N . 18995 1
360 . 2 2 77 77 VAL H H 1 8.498 0.02 1.000 1 . . . B 77 VAL H . 18995 1
361 . 2 2 77 77 VAL C C 13 179.175 0.20 1.000 1 . . . B 77 VAL C . 18995 1
362 . 2 2 77 77 VAL CA C 13 66.800 0.20 1.000 1 . . . B 77 VAL CA . 18995 1
363 . 2 2 77 77 VAL CB C 13 31.200 0.20 1.000 1 . . . B 77 VAL CB . 18995 1
364 . 2 2 77 77 VAL N N 15 119.765 0.20 1.000 1 . . . B 77 VAL N . 18995 1
365 . 2 2 78 78 ALA H H 1 8.193 0.02 1.000 1 . . . B 78 ALA H . 18995 1
366 . 2 2 78 78 ALA C C 13 178.630 0.20 1.000 1 . . . B 78 ALA C . 18995 1
367 . 2 2 78 78 ALA CA C 13 56.100 0.20 1.000 1 . . . B 78 ALA CA . 18995 1
368 . 2 2 78 78 ALA CB C 13 18.300 0.20 1.000 1 . . . B 78 ALA CB . 18995 1
369 . 2 2 78 78 ALA N N 15 123.880 0.20 1.000 1 . . . B 78 ALA N . 18995 1
370 . 2 2 79 79 MET H H 1 7.883 0.02 1.000 1 . . . B 79 MET H . 18995 1
371 . 2 2 79 79 MET C C 13 178.430 0.20 1.000 1 . . . B 79 MET C . 18995 1
372 . 2 2 79 79 MET CA C 13 59.500 0.20 1.000 1 . . . B 79 MET CA . 18995 1
373 . 2 2 79 79 MET CB C 13 32.800 0.20 1.000 1 . . . B 79 MET CB . 18995 1
374 . 2 2 79 79 MET N N 15 120.537 0.20 1.000 1 . . . B 79 MET N . 18995 1
375 . 2 2 80 80 VAL H H 1 8.299 0.02 1.000 1 . . . B 80 VAL H . 18995 1
376 . 2 2 80 80 VAL CA C 13 66.200 0.20 0.716 1 . . . B 80 VAL CA . 18995 1
377 . 2 2 80 80 VAL N N 15 120.374 0.20 1.000 1 . . . B 80 VAL N . 18995 1
378 . 2 2 82 82 THR C C 13 175.144 0.20 1.000 1 . . . B 82 THR C . 18995 1
379 . 2 2 82 82 THR CA C 13 65.800 0.20 1.000 1 . . . B 82 THR CA . 18995 1
380 . 2 2 83 83 ALA H H 1 7.587 0.02 1.000 1 . . . B 83 ALA H . 18995 1
381 . 2 2 83 83 ALA C C 13 178.574 0.20 1.000 1 . . . B 83 ALA C . 18995 1
382 . 2 2 83 83 ALA CA C 13 53.900 0.20 1.000 1 . . . B 83 ALA CA . 18995 1
383 . 2 2 83 83 ALA CB C 13 19.000 0.20 1.000 1 . . . B 83 ALA CB . 18995 1
384 . 2 2 83 83 ALA N N 15 123.244 0.20 1.000 1 . . . B 83 ALA N . 18995 1
385 . 2 2 84 84 CYS H H 1 7.788 0.02 1.000 1 . . . B 84 CYS H . 18995 1
386 . 2 2 84 84 CYS CA C 13 59.800 0.20 0.630 1 . . . B 84 CYS CA . 18995 1
387 . 2 2 84 84 CYS CB C 13 27.900 0.20 0.478 1 . . . B 84 CYS CB . 18995 1
388 . 2 2 84 84 CYS N N 15 116.910 0.20 1.000 1 . . . B 84 CYS N . 18995 1
389 . 2 2 86 86 GLU CA C 13 58.600 0.20 1.000 1 . . . B 86 GLU CA . 18995 1
390 . 2 2 86 86 GLU CB C 13 29.400 0.20 1.000 1 . . . B 86 GLU CB . 18995 1
391 . 2 2 87 87 PHE H H 1 7.838 0.02 1.000 1 . . . B 87 PHE H . 18995 1
392 . 2 2 87 87 PHE C C 13 175.597 0.20 1.000 1 . . . B 87 PHE C . 18995 1
393 . 2 2 87 87 PHE CA C 13 59.100 0.20 1.000 1 . . . B 87 PHE CA . 18995 1
394 . 2 2 87 87 PHE CB C 13 39.400 0.20 1.000 1 . . . B 87 PHE CB . 18995 1
395 . 2 2 87 87 PHE N N 15 118.550 0.20 1.000 1 . . . B 87 PHE N . 18995 1
396 . 2 2 88 88 PHE H H 1 7.718 0.02 1.000 1 . . . B 88 PHE H . 18995 1
397 . 2 2 88 88 PHE C C 13 175.241 0.20 1.000 1 . . . B 88 PHE C . 18995 1
398 . 2 2 88 88 PHE CA C 13 58.200 0.20 1.000 1 . . . B 88 PHE CA . 18995 1
399 . 2 2 88 88 PHE CB C 13 39.700 0.20 1.000 1 . . . B 88 PHE CB . 18995 1
400 . 2 2 88 88 PHE N N 15 118.438 0.20 1.000 1 . . . B 88 PHE N . 18995 1
401 . 2 2 89 89 GLU H H 1 7.959 0.02 1.000 1 . . . B 89 GLU H . 18995 1
402 . 2 2 89 89 GLU C C 13 175.437 0.20 1.000 1 . . . B 89 GLU C . 18995 1
403 . 2 2 89 89 GLU CA C 13 56.600 0.20 1.000 1 . . . B 89 GLU CA . 18995 1
404 . 2 2 89 89 GLU CB C 13 30.300 0.20 1.000 1 . . . B 89 GLU CB . 18995 1
405 . 2 2 89 89 GLU N N 15 121.366 0.20 1.000 1 . . . B 89 GLU N . 18995 1
406 . 2 2 90 90 HIS H H 1 8.116 0.02 1.000 1 . . . B 90 HIS H . 18995 1
407 . 2 2 90 90 HIS C C 13 173.652 0.20 1.000 1 . . . B 90 HIS C . 18995 1
408 . 2 2 90 90 HIS CA C 13 55.800 0.20 1.000 1 . . . B 90 HIS CA . 18995 1
409 . 2 2 90 90 HIS CB C 13 30.100 0.20 1.000 1 . . . B 90 HIS CB . 18995 1
410 . 2 2 90 90 HIS N N 15 120.349 0.20 1.000 1 . . . B 90 HIS N . 18995 1
411 . 2 2 91 91 GLU H H 1 8.235 0.02 1.000 1 . . . B 91 GLU H . 18995 1
412 . 2 2 91 91 GLU N N 15 127.965 0.20 1.000 1 . . . B 91 GLU N . 18995 1
stop_
save_