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 26720
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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' . . . 26720 1
2 '3D HNCO' . . . 26720 1
3 '3D HNCA' . . . 26720 1
4 '3D HNCACB' . . . 26720 1
5 '3D CBCA(CO)NH' . . . 26720 1
6 '3D (H)N(COCA)NH' . . . 26720 1
7 '3D HN(CA)CO' . . . 26720 1
8 '2D NCO' . . . 26720 1
9 '3D (HA)CANCO' . . . 26720 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 $TOPSPIN . . 26720 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 ALA H H 1 8.487 0.020 . 1 . . . . . 2 ALA H . 26720 1
2 . 1 . 1 2 2 ALA C C 13 175.076 0.3 . 1 . . . . . 2 ALA C . 26720 1
3 . 1 . 1 2 2 ALA CA C 13 49.790 0.3 . 1 . . . . . 2 ALA CA . 26720 1
4 . 1 . 1 2 2 ALA CB C 13 16.238 0.3 . 1 . . . . . 2 ALA CB . 26720 1
5 . 1 . 1 2 2 ALA N N 15 123.575 0.3 . 1 . . . . . 2 ALA N . 26720 1
6 . 1 . 1 3 3 SER H H 1 8.310 0.020 . 1 . . . . . 3 SER H . 26720 1
7 . 1 . 1 3 3 SER C C 13 171.404 0.3 . 1 . . . . . 3 SER C . 26720 1
8 . 1 . 1 3 3 SER CA C 13 55.223 0.3 . 1 . . . . . 3 SER CA . 26720 1
9 . 1 . 1 3 3 SER CB C 13 60.941 0.3 . 1 . . . . . 3 SER CB . 26720 1
10 . 1 . 1 3 3 SER N N 15 115.437 0.3 . 1 . . . . . 3 SER N . 26720 1
11 . 1 . 1 4 4 ALA H H 1 8.332 0.020 . 1 . . . . . 4 ALA H . 26720 1
12 . 1 . 1 4 4 ALA C C 13 174.763 0.3 . 1 . . . . . 4 ALA C . 26720 1
13 . 1 . 1 4 4 ALA CA C 13 49.757 0.3 . 1 . . . . . 4 ALA CA . 26720 1
14 . 1 . 1 4 4 ALA CB C 13 16.254 0.3 . 1 . . . . . 4 ALA CB . 26720 1
15 . 1 . 1 4 4 ALA N N 15 125.987 0.3 . 1 . . . . . 4 ALA N . 26720 1
16 . 1 . 1 5 5 SER H H 1 8.128 0.020 . 1 . . . . . 5 SER H . 26720 1
17 . 1 . 1 5 5 SER C C 13 171.672 0.3 . 1 . . . . . 5 SER C . 26720 1
18 . 1 . 1 5 5 SER CA C 13 54.967 0.3 . 1 . . . . . 5 SER CA . 26720 1
19 . 1 . 1 5 5 SER CB C 13 60.864 0.3 . 1 . . . . . 5 SER CB . 26720 1
20 . 1 . 1 5 5 SER N N 15 114.835 0.3 . 1 . . . . . 5 SER N . 26720 1
21 . 1 . 1 6 6 SER H H 1 8.221 0.020 . 1 . . . . . 6 SER H . 26720 1
22 . 1 . 1 6 6 SER C C 13 171.294 0.3 . 1 . . . . . 6 SER C . 26720 1
23 . 1 . 1 6 6 SER CA C 13 55.363 0.3 . 1 . . . . . 6 SER CA . 26720 1
24 . 1 . 1 6 6 SER CB C 13 60.860 0.3 . 1 . . . . . 6 SER CB . 26720 1
25 . 1 . 1 6 6 SER N N 15 117.962 0.3 . 1 . . . . . 6 SER N . 26720 1
26 . 1 . 1 7 7 SER H H 1 8.535 0.020 . 1 . . . . . 7 SER H . 26720 1
27 . 1 . 1 7 7 SER C C 13 169.252 0.3 . 1 . . . . . 7 SER C . 26720 1
28 . 1 . 1 7 7 SER CA C 13 53.008 0.3 . 1 . . . . . 7 SER CA . 26720 1
29 . 1 . 1 7 7 SER CB C 13 61.637 0.3 . 1 . . . . . 7 SER CB . 26720 1
30 . 1 . 1 7 7 SER N N 15 120.418 0.3 . 1 . . . . . 7 SER N . 26720 1
31 . 1 . 1 9 9 SER H H 1 8.802 0.020 . 1 . . . . . 9 SER H . 26720 1
32 . 1 . 1 9 9 SER C C 13 169.588 0.3 . 1 . . . . . 9 SER C . 26720 1
33 . 1 . 1 9 9 SER CA C 13 52.985 0.3 . 1 . . . . . 9 SER CA . 26720 1
34 . 1 . 1 9 9 SER CB C 13 61.603 0.3 . 1 . . . . . 9 SER CB . 26720 1
35 . 1 . 1 9 9 SER N N 15 119.623 0.3 . 1 . . . . . 9 SER N . 26720 1
36 . 1 . 1 11 11 SER H H 1 8.284 0.020 . 1 . . . . . 11 SER H . 26720 1
37 . 1 . 1 11 11 SER C C 13 171.314 0.3 . 1 . . . . . 11 SER C . 26720 1
38 . 1 . 1 11 11 SER CA C 13 55.476 0.3 . 1 . . . . . 11 SER CA . 26720 1
39 . 1 . 1 11 11 SER CB C 13 60.970 0.3 . 1 . . . . . 11 SER CB . 26720 1
40 . 1 . 1 11 11 SER N N 15 116.718 0.3 . 1 . . . . . 11 SER N . 26720 1
41 . 1 . 1 12 12 THR H H 1 8.491 0.020 . 1 . . . . . 12 THR H . 26720 1
42 . 1 . 1 12 12 THR C C 13 170.107 0.3 . 1 . . . . . 12 THR C . 26720 1
43 . 1 . 1 12 12 THR CA C 13 56.934 0.3 . 1 . . . . . 12 THR CA . 26720 1
44 . 1 . 1 12 12 THR CB C 13 68.858 0.3 . 1 . . . . . 12 THR CB . 26720 1
45 . 1 . 1 12 12 THR N N 15 119.745 0.3 . 1 . . . . . 12 THR N . 26720 1
46 . 1 . 1 14 14 THR H H 1 8.397 0.020 . 1 . . . . . 14 THR H . 26720 1
47 . 1 . 1 14 14 THR C C 13 172.198 0.3 . 1 . . . . . 14 THR C . 26720 1
48 . 1 . 1 14 14 THR CA C 13 59.980 0.3 . 1 . . . . . 14 THR CA . 26720 1
49 . 1 . 1 14 14 THR CB C 13 66.277 0.3 . 1 . . . . . 14 THR CB . 26720 1
50 . 1 . 1 14 14 THR N N 15 115.154 0.3 . 1 . . . . . 14 THR N . 26720 1
51 . 1 . 1 15 15 LYS H H 1 8.227 0.020 . 1 . . . . . 15 LYS H . 26720 1
52 . 1 . 1 15 15 LYS C C 13 173.901 0.3 . 1 . . . . . 15 LYS C . 26720 1
53 . 1 . 1 15 15 LYS CA C 13 53.525 0.3 . 1 . . . . . 15 LYS CA . 26720 1
54 . 1 . 1 15 15 LYS CB C 13 29.396 0.3 . 1 . . . . . 15 LYS CB . 26720 1
55 . 1 . 1 15 15 LYS N N 15 123.505 0.3 . 1 . . . . . 15 LYS N . 26720 1
56 . 1 . 1 16 16 SER H H 1 8.233 0.020 . 1 . . . . . 16 SER H . 26720 1
57 . 1 . 1 16 16 SER C C 13 172.480 0.3 . 1 . . . . . 16 SER C . 26720 1
58 . 1 . 1 16 16 SER CA C 13 55.712 0.3 . 1 . . . . . 16 SER CA . 26720 1
59 . 1 . 1 16 16 SER CB C 13 60.919 0.3 . 1 . . . . . 16 SER CB . 26720 1
60 . 1 . 1 16 16 SER N N 15 116.281 0.3 . 1 . . . . . 16 SER N . 26720 1
61 . 1 . 1 17 17 GLY H H 1 8.306 0.020 . 1 . . . . . 17 GLY H . 26720 1
62 . 1 . 1 17 17 GLY C C 13 171.370 0.3 . 1 . . . . . 17 GLY C . 26720 1
63 . 1 . 1 17 17 GLY CA C 13 42.415 0.3 . 1 . . . . . 17 GLY CA . 26720 1
64 . 1 . 1 17 17 GLY N N 15 110.906 0.3 . 1 . . . . . 17 GLY N . 26720 1
65 . 1 . 1 18 18 LYS H H 1 7.924 0.020 . 1 . . . . . 18 LYS H . 26720 1
66 . 1 . 1 18 18 LYS C C 13 173.905 0.3 . 1 . . . . . 18 LYS C . 26720 1
67 . 1 . 1 18 18 LYS CA C 13 53.314 0.3 . 1 . . . . . 18 LYS CA . 26720 1
68 . 1 . 1 18 18 LYS CB C 13 29.936 0.3 . 1 . . . . . 18 LYS CB . 26720 1
69 . 1 . 1 18 18 LYS N N 15 120.648 0.3 . 1 . . . . . 18 LYS N . 26720 1
70 . 1 . 1 19 19 MET H H 1 8.221 0.020 . 1 . . . . . 19 MET H . 26720 1
71 . 1 . 1 19 19 MET C C 13 173.371 0.3 . 1 . . . . . 19 MET C . 26720 1
72 . 1 . 1 19 19 MET CA C 13 52.491 0.3 . 1 . . . . . 19 MET CA . 26720 1
73 . 1 . 1 19 19 MET CB C 13 29.663 0.3 . 1 . . . . . 19 MET CB . 26720 1
74 . 1 . 1 19 19 MET N N 15 121.381 0.3 . 1 . . . . . 19 MET N . 26720 1
75 . 1 . 1 20 20 ARG H H 1 8.210 0.020 . 1 . . . . . 20 ARG H . 26720 1
76 . 1 . 1 20 20 ARG C C 13 173.448 0.3 . 1 . . . . . 20 ARG C . 26720 1
77 . 1 . 1 20 20 ARG CA C 13 53.177 0.3 . 1 . . . . . 20 ARG CA . 26720 1
78 . 1 . 1 20 20 ARG CB C 13 27.681 0.3 . 1 . . . . . 20 ARG CB . 26720 1
79 . 1 . 1 20 20 ARG N N 15 122.834 0.3 . 1 . . . . . 20 ARG N . 26720 1
80 . 1 . 1 21 21 SER H H 1 8.286 0.020 . 1 . . . . . 21 SER H . 26720 1
81 . 1 . 1 21 21 SER C C 13 171.603 0.3 . 1 . . . . . 21 SER C . 26720 1
82 . 1 . 1 21 21 SER CA C 13 55.467 0.3 . 1 . . . . . 21 SER CA . 26720 1
83 . 1 . 1 21 21 SER CB C 13 60.795 0.3 . 1 . . . . . 21 SER CB . 26720 1
84 . 1 . 1 21 21 SER N N 15 117.653 0.3 . 1 . . . . . 21 SER N . 26720 1
85 . 1 . 1 22 22 ARG H H 1 8.329 0.020 . 1 . . . . . 22 ARG H . 26720 1
86 . 1 . 1 22 22 ARG C C 13 173.463 0.3 . 1 . . . . . 22 ARG C . 26720 1
87 . 1 . 1 22 22 ARG CA C 13 53.076 0.3 . 1 . . . . . 22 ARG CA . 26720 1
88 . 1 . 1 22 22 ARG CB C 13 27.734 0.3 . 1 . . . . . 22 ARG CB . 26720 1
89 . 1 . 1 22 22 ARG N N 15 123.138 0.3 . 1 . . . . . 22 ARG N . 26720 1
90 . 1 . 1 23 23 SER H H 1 8.297 0.020 . 1 . . . . . 23 SER H . 26720 1
91 . 1 . 1 23 23 SER C C 13 171.728 0.3 . 1 . . . . . 23 SER C . 26720 1
92 . 1 . 1 23 23 SER CA C 13 55.412 0.3 . 1 . . . . . 23 SER CA . 26720 1
93 . 1 . 1 23 23 SER CB C 13 60.818 0.3 . 1 . . . . . 23 SER CB . 26720 1
94 . 1 . 1 23 23 SER N N 15 117.401 0.3 . 1 . . . . . 23 SER N . 26720 1
95 . 1 . 1 24 24 SER H H 1 8.247 0.020 . 1 . . . . . 24 SER H . 26720 1
96 . 1 . 1 24 24 SER C C 13 171.282 0.3 . 1 . . . . . 24 SER C . 26720 1
97 . 1 . 1 24 24 SER CA C 13 55.340 0.3 . 1 . . . . . 24 SER CA . 26720 1
98 . 1 . 1 24 24 SER CB C 13 60.859 0.3 . 1 . . . . . 24 SER CB . 26720 1
99 . 1 . 1 24 24 SER N N 15 117.910 0.3 . 1 . . . . . 24 SER N . 26720 1
100 . 1 . 1 25 25 SER H H 1 8.489 0.020 . 1 . . . . . 25 SER H . 26720 1
101 . 1 . 1 25 25 SER C C 13 169.053 0.3 . 1 . . . . . 25 SER C . 26720 1
102 . 1 . 1 25 25 SER CA C 13 53.240 0.3 . 1 . . . . . 25 SER CA . 26720 1
103 . 1 . 1 25 25 SER CB C 13 61.522 0.3 . 1 . . . . . 25 SER CB . 26720 1
104 . 1 . 1 25 25 SER N N 15 120.726 0.3 . 1 . . . . . 25 SER N . 26720 1
105 . 1 . 1 27 27 VAL H H 1 8.185 0.020 . 1 . . . . . 27 VAL H . 26720 1
106 . 1 . 1 27 27 VAL C C 13 173.347 0.3 . 1 . . . . . 27 VAL C . 26720 1
107 . 1 . 1 27 27 VAL CA C 13 59.712 0.3 . 1 . . . . . 27 VAL CA . 26720 1
108 . 1 . 1 27 27 VAL CB C 13 29.033 0.3 . 1 . . . . . 27 VAL CB . 26720 1
109 . 1 . 1 27 27 VAL N N 15 121.735 0.3 . 1 . . . . . 27 VAL N . 26720 1
110 . 1 . 1 28 28 ARG H H 1 8.350 0.020 . 1 . . . . . 28 ARG H . 26720 1
111 . 1 . 1 28 28 ARG C C 13 171.087 0.3 . 1 . . . . . 28 ARG C . 26720 1
112 . 1 . 1 28 28 ARG CA C 13 50.704 0.3 . 1 . . . . . 28 ARG CA . 26720 1
113 . 1 . 1 28 28 ARG CB C 13 27.099 0.3 . 1 . . . . . 28 ARG CB . 26720 1
114 . 1 . 1 28 28 ARG N N 15 127.583 0.3 . 1 . . . . . 28 ARG N . 26720 1
115 . 1 . 1 29 29 PRO CA C 13 60.002 0.3 . 1 . . . . . 29 PRO CA . 26720 1
116 . 1 . 1 29 29 PRO N N 15 136.287 0.3 . 1 . . . . . 29 PRO N . 26720 1
117 . 1 . 1 30 30 LYS H H 1 8.200 0.020 . 1 . . . . . 30 LYS H . 26720 1
118 . 1 . 1 30 30 LYS C C 13 173.130 0.3 . 1 . . . . . 30 LYS C . 26720 1
119 . 1 . 1 30 30 LYS CA C 13 53.067 0.3 . 1 . . . . . 30 LYS CA . 26720 1
120 . 1 . 1 30 30 LYS CB C 13 30.135 0.3 . 1 . . . . . 30 LYS CB . 26720 1
121 . 1 . 1 30 30 LYS N N 15 122.176 0.3 . 1 . . . . . 30 LYS N . 26720 1
122 . 1 . 1 31 31 ALA H H 1 8.224 0.020 . 1 . . . . . 31 ALA H . 26720 1
123 . 1 . 1 31 31 ALA C C 13 174.151 0.3 . 1 . . . . . 31 ALA C . 26720 1
124 . 1 . 1 31 31 ALA CA C 13 48.906 0.3 . 1 . . . . . 31 ALA CA . 26720 1
125 . 1 . 1 31 31 ALA CB C 13 16.262 0.3 . 1 . . . . . 31 ALA CB . 26720 1
126 . 1 . 1 31 31 ALA N N 15 126.128 0.3 . 1 . . . . . 31 ALA N . 26720 1
127 . 1 . 1 32 32 TYR H H 1 8.020 0.020 . 1 . . . . . 32 TYR H . 26720 1
128 . 1 . 1 32 32 TYR C C 13 172.402 0.3 . 1 . . . . . 32 TYR C . 26720 1
129 . 1 . 1 32 32 TYR CA C 13 54.680 0.3 . 1 . . . . . 32 TYR CA . 26720 1
130 . 1 . 1 32 32 TYR CB C 13 36.132 0.3 . 1 . . . . . 32 TYR CB . 26720 1
131 . 1 . 1 32 32 TYR N N 15 120.503 0.3 . 1 . . . . . 32 TYR N . 26720 1
132 . 1 . 1 33 33 THR H H 1 8.477 0.020 . 1 . . . . . 33 THR H . 26720 1
133 . 1 . 1 33 33 THR C C 13 168.739 0.3 . 1 . . . . . 33 THR C . 26720 1
134 . 1 . 1 33 33 THR CA C 13 56.037 0.3 . 1 . . . . . 33 THR CA . 26720 1
135 . 1 . 1 33 33 THR CB C 13 69.657 0.3 . 1 . . . . . 33 THR CB . 26720 1
136 . 1 . 1 33 33 THR N N 15 123.098 0.3 . 1 . . . . . 33 THR N . 26720 1
137 . 1 . 1 35 35 SER H H 1 8.726 0.020 . 1 . . . . . 35 SER H . 26720 1
138 . 1 . 1 35 35 SER C C 13 169.579 0.3 . 1 . . . . . 35 SER C . 26720 1
139 . 1 . 1 35 35 SER CA C 13 52.870 0.3 . 1 . . . . . 35 SER CA . 26720 1
140 . 1 . 1 35 35 SER CB C 13 61.703 0.3 . 1 . . . . . 35 SER CB . 26720 1
141 . 1 . 1 35 35 SER N N 15 119.696 0.3 . 1 . . . . . 35 SER N . 26720 1
142 . 1 . 1 37 37 ARG H H 1 8.074 0.020 . 1 . . . . . 37 ARG H . 26720 1
143 . 1 . 1 37 37 ARG C C 13 173.204 0.3 . 1 . . . . . 37 ARG C . 26720 1
144 . 1 . 1 37 37 ARG CA C 13 52.435 0.3 . 1 . . . . . 37 ARG CA . 26720 1
145 . 1 . 1 37 37 ARG CB C 13 28.058 0.3 . 1 . . . . . 37 ARG CB . 26720 1
146 . 1 . 1 37 37 ARG N N 15 120.453 0.3 . 1 . . . . . 37 ARG N . 26720 1
147 . 1 . 1 38 38 SER H H 1 8.538 0.020 . 1 . . . . . 38 SER H . 26720 1
148 . 1 . 1 38 38 SER C C 13 170.234 0.3 . 1 . . . . . 38 SER C . 26720 1
149 . 1 . 1 38 38 SER CA C 13 52.687 0.3 . 1 . . . . . 38 SER CA . 26720 1
150 . 1 . 1 38 38 SER CB C 13 62.218 0.3 . 1 . . . . . 38 SER CB . 26720 1
151 . 1 . 1 38 38 SER N N 15 118.915 0.3 . 1 . . . . . 38 SER N . 26720 1
152 . 1 . 1 40 40 ASN H H 1 8.057 0.020 . 1 . . . . . 40 ASN H . 26720 1
153 . 1 . 1 40 40 ASN C C 13 171.922 0.3 . 1 . . . . . 40 ASN C . 26720 1
154 . 1 . 1 40 40 ASN CA C 13 50.106 0.3 . 1 . . . . . 40 ASN CA . 26720 1
155 . 1 . 1 40 40 ASN CB C 13 35.670 0.3 . 1 . . . . . 40 ASN CB . 26720 1
156 . 1 . 1 40 40 ASN N N 15 116.448 0.3 . 1 . . . . . 40 ASN N . 26720 1
157 . 1 . 1 41 41 TYR H H 1 7.746 0.020 . 1 . . . . . 41 TYR H . 26720 1
158 . 1 . 1 41 41 TYR C C 13 172.785 0.3 . 1 . . . . . 41 TYR C . 26720 1
159 . 1 . 1 41 41 TYR CA C 13 55.649 0.3 . 1 . . . . . 41 TYR CA . 26720 1
160 . 1 . 1 41 41 TYR CB C 13 35.578 0.3 . 1 . . . . . 41 TYR CB . 26720 1
161 . 1 . 1 41 41 TYR N N 15 121.039 0.3 . 1 . . . . . 41 TYR N . 26720 1
162 . 1 . 1 42 42 HIS H H 1 8.039 0.020 . 1 . . . . . 42 HIS H . 26720 1
163 . 1 . 1 42 42 HIS C C 13 171.339 0.3 . 1 . . . . . 42 HIS C . 26720 1
164 . 1 . 1 42 42 HIS CA C 13 52.661 0.3 . 1 . . . . . 42 HIS CA . 26720 1
165 . 1 . 1 42 42 HIS CB C 13 26.527 0.3 . 1 . . . . . 42 HIS CB . 26720 1
166 . 1 . 1 42 42 HIS N N 15 121.356 0.3 . 1 . . . . . 42 HIS N . 26720 1
167 . 1 . 1 43 43 ARG H H 1 7.828 0.020 . 1 . . . . . 43 ARG H . 26720 1
168 . 1 . 1 43 43 ARG C C 13 172.972 0.3 . 1 . . . . . 43 ARG C . 26720 1
169 . 1 . 1 43 43 ARG CA C 13 53.450 0.3 . 1 . . . . . 43 ARG CA . 26720 1
170 . 1 . 1 43 43 ARG CB C 13 27.471 0.3 . 1 . . . . . 43 ARG CB . 26720 1
171 . 1 . 1 43 43 ARG N N 15 122.040 0.3 . 1 . . . . . 43 ARG N . 26720 1
172 . 1 . 1 44 44 PHE H H 1 8.033 0.020 . 1 . . . . . 44 PHE H . 26720 1
173 . 1 . 1 44 44 PHE C C 13 172.432 0.3 . 1 . . . . . 44 PHE C . 26720 1
174 . 1 . 1 44 44 PHE CA C 13 54.528 0.3 . 1 . . . . . 44 PHE CA . 26720 1
175 . 1 . 1 44 44 PHE CB C 13 36.279 0.3 . 1 . . . . . 44 PHE CB . 26720 1
176 . 1 . 1 44 44 PHE N N 15 120.746 0.3 . 1 . . . . . 44 PHE N . 26720 1
177 . 1 . 1 45 45 ALA H H 1 7.991 0.020 . 1 . . . . . 45 ALA H . 26720 1
178 . 1 . 1 45 45 ALA C C 13 174.347 0.3 . 1 . . . . . 45 ALA C . 26720 1
179 . 1 . 1 45 45 ALA CA C 13 49.475 0.3 . 1 . . . . . 45 ALA CA . 26720 1
180 . 1 . 1 45 45 ALA CB C 13 16.332 0.3 . 1 . . . . . 45 ALA CB . 26720 1
181 . 1 . 1 45 45 ALA N N 15 124.907 0.3 . 1 . . . . . 45 ALA N . 26720 1
182 . 1 . 1 46 46 LEU H H 1 7.992 0.020 . 1 . . . . . 46 LEU H . 26720 1
183 . 1 . 1 46 46 LEU C C 13 174.166 0.3 . 1 . . . . . 46 LEU C . 26720 1
184 . 1 . 1 46 46 LEU CA C 13 51.851 0.3 . 1 . . . . . 46 LEU CA . 26720 1
185 . 1 . 1 46 46 LEU CB C 13 39.281 0.3 . 1 . . . . . 46 LEU CB . 26720 1
186 . 1 . 1 46 46 LEU N N 15 120.892 0.3 . 1 . . . . . 46 LEU N . 26720 1
187 . 1 . 1 47 47 ASP H H 1 8.016 0.020 . 1 . . . . . 47 ASP H . 26720 1
188 . 1 . 1 47 47 ASP C C 13 172.987 0.3 . 1 . . . . . 47 ASP C . 26720 1
189 . 1 . 1 47 47 ASP CA C 13 51.382 0.3 . 1 . . . . . 47 ASP CA . 26720 1
190 . 1 . 1 47 47 ASP CB C 13 38.290 0.3 . 1 . . . . . 47 ASP CB . 26720 1
191 . 1 . 1 47 47 ASP N N 15 120.404 0.3 . 1 . . . . . 47 ASP N . 26720 1
192 . 1 . 1 48 48 SER H H 1 8.415 0.020 . 1 . . . . . 48 SER H . 26720 1
193 . 1 . 1 48 48 SER C C 13 168.820 0.3 . 1 . . . . . 48 SER C . 26720 1
194 . 1 . 1 48 48 SER CA C 13 52.806 0.3 . 1 . . . . . 48 SER CA . 26720 1
195 . 1 . 1 48 48 SER CB C 13 61.853 0.3 . 1 . . . . . 48 SER CB . 26720 1
196 . 1 . 1 48 48 SER N N 15 118.304 0.3 . 1 . . . . . 48 SER N . 26720 1
197 . 1 . 1 49 49 PRO CA C 13 58.815 0.3 . 1 . . . . . 49 PRO CA . 26720 1
198 . 1 . 1 49 49 PRO N N 15 139.438 0.3 . 1 . . . . . 49 PRO N . 26720 1
199 . 1 . 1 50 50 PRO CA C 13 59.924 0.3 . 1 . . . . . 50 PRO CA . 26720 1
200 . 1 . 1 50 50 PRO N N 15 135.361 0.3 . 1 . . . . . 50 PRO N . 26720 1
201 . 1 . 1 51 51 GLN H H 1 8.344 0.020 . 1 . . . . . 51 GLN H . 26720 1
202 . 1 . 1 51 51 GLN C C 13 172.889 0.3 . 1 . . . . . 51 GLN C . 26720 1
203 . 1 . 1 51 51 GLN CA C 13 52.543 0.3 . 1 . . . . . 51 GLN CA . 26720 1
204 . 1 . 1 51 51 GLN CB C 13 27.027 0.3 . 1 . . . . . 51 GLN CB . 26720 1
205 . 1 . 1 51 51 GLN N N 15 120.917 0.3 . 1 . . . . . 51 GLN N . 26720 1
206 . 1 . 1 52 52 SER H H 1 8.632 0.020 . 1 . . . . . 52 SER H . 26720 1
207 . 1 . 1 52 52 SER C C 13 169.802 0.3 . 1 . . . . . 52 SER C . 26720 1
208 . 1 . 1 52 52 SER CA C 13 52.734 0.3 . 1 . . . . . 52 SER CA . 26720 1
209 . 1 . 1 52 52 SER CB C 13 61.876 0.3 . 1 . . . . . 52 SER CB . 26720 1
210 . 1 . 1 52 52 SER N N 15 119.940 0.3 . 1 . . . . . 52 SER N . 26720 1
211 . 1 . 1 54 54 ARG H H 1 8.292 0.020 . 1 . . . . . 54 ARG H . 26720 1
212 . 1 . 1 54 54 ARG C C 13 173.808 0.3 . 1 . . . . . 54 ARG C . 26720 1
213 . 1 . 1 54 54 ARG CA C 13 53.262 0.3 . 1 . . . . . 54 ARG CA . 26720 1
214 . 1 . 1 54 54 ARG CB C 13 27.396 0.3 . 1 . . . . . 54 ARG CB . 26720 1
215 . 1 . 1 54 54 ARG N N 15 120.746 0.3 . 1 . . . . . 54 ARG N . 26720 1
216 . 1 . 1 55 55 ARG H H 1 8.274 0.020 . 1 . . . . . 55 ARG H . 26720 1
217 . 1 . 1 55 55 ARG C C 13 173.659 0.3 . 1 . . . . . 55 ARG C . 26720 1
218 . 1 . 1 55 55 ARG CA C 13 53.038 0.3 . 1 . . . . . 55 ARG CA . 26720 1
219 . 1 . 1 55 55 ARG CB C 13 27.719 0.3 . 1 . . . . . 55 ARG CB . 26720 1
220 . 1 . 1 55 55 ARG N N 15 122.553 0.3 . 1 . . . . . 55 ARG N . 26720 1
221 . 1 . 1 56 56 SER H H 1 8.280 0.020 . 1 . . . . . 56 SER H . 26720 1
222 . 1 . 1 56 56 SER C C 13 171.351 0.3 . 1 . . . . . 56 SER C . 26720 1
223 . 1 . 1 56 56 SER CA C 13 55.368 0.3 . 1 . . . . . 56 SER CA . 26720 1
224 . 1 . 1 56 56 SER CB C 13 61.010 0.3 . 1 . . . . . 56 SER CB . 26720 1
225 . 1 . 1 56 56 SER N N 15 117.011 0.3 . 1 . . . . . 56 SER N . 26720 1
226 . 1 . 1 57 57 SER H H 1 8.356 0.020 . 1 . . . . . 57 SER H . 26720 1
227 . 1 . 1 57 57 SER C C 13 171.469 0.3 . 1 . . . . . 57 SER C . 26720 1
228 . 1 . 1 57 57 SER CA C 13 55.599 0.3 . 1 . . . . . 57 SER CA . 26720 1
229 . 1 . 1 57 57 SER CB C 13 61.005 0.3 . 1 . . . . . 57 SER CB . 26720 1
230 . 1 . 1 57 57 SER N N 15 117.909 0.3 . 1 . . . . . 57 SER N . 26720 1
231 . 1 . 1 58 58 ASN H H 1 8.333 0.020 . 1 . . . . . 58 ASN H . 26720 1
232 . 1 . 1 58 58 ASN C C 13 172.405 0.3 . 1 . . . . . 58 ASN C . 26720 1
233 . 1 . 1 58 58 ASN CA C 13 50.415 0.3 . 1 . . . . . 58 ASN CA . 26720 1
234 . 1 . 1 58 58 ASN CB C 13 35.772 0.3 . 1 . . . . . 58 ASN CB . 26720 1
235 . 1 . 1 58 58 ASN N N 15 120.453 0.3 . 1 . . . . . 58 ASN N . 26720 1
236 . 1 . 1 59 59 SER H H 1 8.063 0.020 . 1 . . . . . 59 SER H . 26720 1
237 . 1 . 1 59 59 SER C C 13 171.765 0.3 . 1 . . . . . 59 SER C . 26720 1
238 . 1 . 1 59 59 SER CA C 13 55.636 0.3 . 1 . . . . . 59 SER CA . 26720 1
239 . 1 . 1 59 59 SER CB C 13 60.856 0.3 . 1 . . . . . 59 SER CB . 26720 1
240 . 1 . 1 59 59 SER N N 15 115.716 0.3 . 1 . . . . . 59 SER N . 26720 1
241 . 1 . 1 60 60 SER H H 1 8.591 0.020 . 1 . . . . . 60 SER H . 26720 1
242 . 1 . 1 60 60 SER C C 13 172.245 0.3 . 1 . . . . . 60 SER C . 26720 1
243 . 1 . 1 60 60 SER CA C 13 55.247 0.3 . 1 . . . . . 60 SER CA . 26720 1
244 . 1 . 1 60 60 SER CB C 13 62.486 0.3 . 1 . . . . . 60 SER CB . 26720 1
245 . 1 . 1 60 60 SER N N 15 118.768 0.3 . 1 . . . . . 60 SER N . 26720 1
246 . 1 . 1 61 61 ILE H H 1 8.172 0.020 . 1 . . . . . 61 ILE H . 26720 1
247 . 1 . 1 61 61 ILE C C 13 174.031 0.3 . 1 . . . . . 61 ILE C . 26720 1
248 . 1 . 1 61 61 ILE CA C 13 59.205 0.3 . 1 . . . . . 61 ILE CA . 26720 1
249 . 1 . 1 61 61 ILE CB C 13 35.423 0.3 . 1 . . . . . 61 ILE CB . 26720 1
250 . 1 . 1 61 61 ILE N N 15 122.327 0.3 . 1 . . . . . 61 ILE N . 26720 1
251 . 1 . 1 62 62 THR H H 1 7.869 0.020 . 1 . . . . . 62 THR H . 26720 1
252 . 1 . 1 62 62 THR C C 13 171.992 0.3 . 1 . . . . . 62 THR C . 26720 1
253 . 1 . 1 62 62 THR CA C 13 59.682 0.3 . 1 . . . . . 62 THR CA . 26720 1
254 . 1 . 1 62 62 THR CB C 13 66.313 0.3 . 1 . . . . . 62 THR CB . 26720 1
255 . 1 . 1 62 62 THR N N 15 117.230 0.3 . 1 . . . . . 62 THR N . 26720 1
256 . 1 . 1 63 63 LYS H H 1 8.063 0.020 . 1 . . . . . 63 LYS H . 26720 1
257 . 1 . 1 63 63 LYS C C 13 173.885 0.3 . 1 . . . . . 63 LYS C . 26720 1
258 . 1 . 1 63 63 LYS CA C 13 53.456 0.3 . 1 . . . . . 63 LYS CA . 26720 1
259 . 1 . 1 63 63 LYS CB C 13 29.658 0.3 . 1 . . . . . 63 LYS CB . 26720 1
260 . 1 . 1 63 63 LYS N N 15 123.774 0.3 . 1 . . . . . 63 LYS N . 26720 1
261 . 1 . 1 64 64 LYS H H 1 8.159 0.020 . 1 . . . . . 64 LYS H . 26720 1
262 . 1 . 1 64 64 LYS C C 13 174.434 0.3 . 1 . . . . . 64 LYS C . 26720 1
263 . 1 . 1 64 64 LYS CA C 13 53.879 0.3 . 1 . . . . . 64 LYS CA . 26720 1
264 . 1 . 1 64 64 LYS CB C 13 29.806 0.3 . 1 . . . . . 64 LYS CB . 26720 1
265 . 1 . 1 64 64 LYS N N 15 122.392 0.3 . 1 . . . . . 64 LYS N . 26720 1
266 . 1 . 1 65 65 GLY H H 1 8.303 0.020 . 1 . . . . . 65 GLY H . 26720 1
267 . 1 . 1 65 65 GLY C C 13 171.243 0.3 . 1 . . . . . 65 GLY C . 26720 1
268 . 1 . 1 65 65 GLY CA C 13 42.170 0.3 . 1 . . . . . 65 GLY CA . 26720 1
269 . 1 . 1 65 65 GLY N N 15 110.124 0.3 . 1 . . . . . 65 GLY N . 26720 1
270 . 1 . 1 66 66 SER H H 1 8.022 0.020 . 1 . . . . . 66 SER H . 26720 1
271 . 1 . 1 66 66 SER C C 13 171.670 0.3 . 1 . . . . . 66 SER C . 26720 1
272 . 1 . 1 66 66 SER CA C 13 55.477 0.3 . 1 . . . . . 66 SER CA . 26720 1
273 . 1 . 1 66 66 SER CB C 13 60.984 0.3 . 1 . . . . . 66 SER CB . 26720 1
274 . 1 . 1 66 66 SER N N 15 115.607 0.3 . 1 . . . . . 66 SER N . 26720 1
275 . 1 . 1 67 67 ARG H H 1 8.280 0.020 . 1 . . . . . 67 ARG H . 26720 1
276 . 1 . 1 67 67 ARG C C 13 173.456 0.3 . 1 . . . . . 67 ARG C . 26720 1
277 . 1 . 1 67 67 ARG CA C 13 53.152 0.3 . 1 . . . . . 67 ARG CA . 26720 1
278 . 1 . 1 67 67 ARG CB C 13 27.738 0.3 . 1 . . . . . 67 ARG CB . 26720 1
279 . 1 . 1 67 67 ARG N N 15 122.992 0.3 . 1 . . . . . 67 ARG N . 26720 1
280 . 1 . 1 68 68 ARG H H 1 8.315 0.020 . 1 . . . . . 68 ARG H . 26720 1
281 . 1 . 1 68 68 ARG C C 13 173.556 0.3 . 1 . . . . . 68 ARG C . 26720 1
282 . 1 . 1 68 68 ARG CA C 13 53.006 0.3 . 1 . . . . . 68 ARG CA . 26720 1
283 . 1 . 1 68 68 ARG CB C 13 27.702 0.3 . 1 . . . . . 68 ARG CB . 26720 1
284 . 1 . 1 68 68 ARG N N 15 122.968 0.3 . 1 . . . . . 68 ARG N . 26720 1
285 . 1 . 1 69 69 SER H H 1 8.359 0.020 . 1 . . . . . 69 SER H . 26720 1
286 . 1 . 1 69 69 SER C C 13 171.921 0.3 . 1 . . . . . 69 SER C . 26720 1
287 . 1 . 1 69 69 SER CA C 13 55.375 0.3 . 1 . . . . . 69 SER CA . 26720 1
288 . 1 . 1 69 69 SER CB C 13 60.894 0.3 . 1 . . . . . 69 SER CB . 26720 1
289 . 1 . 1 69 69 SER N N 15 117.562 0.3 . 1 . . . . . 69 SER N . 26720 1
290 . 1 . 1 70 70 SER H H 1 8.581 0.020 . 1 . . . . . 70 SER H . 26720 1
291 . 1 . 1 70 70 SER C C 13 172.269 0.3 . 1 . . . . . 70 SER C . 26720 1
292 . 1 . 1 70 70 SER CA C 13 55.735 0.3 . 1 . . . . . 70 SER CA . 26720 1
293 . 1 . 1 70 70 SER CB C 13 61.062 0.3 . 1 . . . . . 70 SER CB . 26720 1
294 . 1 . 1 70 70 SER N N 15 118.914 0.3 . 1 . . . . . 70 SER N . 26720 1
295 . 1 . 1 71 71 GLY H H 1 8.421 0.020 . 1 . . . . . 71 GLY H . 26720 1
296 . 1 . 1 71 71 GLY C C 13 171.161 0.3 . 1 . . . . . 71 GLY C . 26720 1
297 . 1 . 1 71 71 GLY CA C 13 42.354 0.3 . 1 . . . . . 71 GLY CA . 26720 1
298 . 1 . 1 71 71 GLY N N 15 111.174 0.3 . 1 . . . . . 71 GLY N . 26720 1
299 . 1 . 1 72 72 SER H H 1 8.039 0.020 . 1 . . . . . 72 SER H . 26720 1
300 . 1 . 1 72 72 SER C C 13 171.233 0.3 . 1 . . . . . 72 SER C . 26720 1
301 . 1 . 1 72 72 SER CA C 13 55.069 0.3 . 1 . . . . . 72 SER CA . 26720 1
302 . 1 . 1 72 72 SER CB C 13 61.119 0.3 . 1 . . . . . 72 SER CB . 26720 1
303 . 1 . 1 72 72 SER N N 15 115.203 0.3 . 1 . . . . . 72 SER N . 26720 1
304 . 1 . 1 73 73 SER H H 1 8.544 0.020 . 1 . . . . . 73 SER H . 26720 1
305 . 1 . 1 73 73 SER C C 13 169.836 0.3 . 1 . . . . . 73 SER C . 26720 1
306 . 1 . 1 73 73 SER CA C 13 53.069 0.3 . 1 . . . . . 73 SER CA . 26720 1
307 . 1 . 1 73 73 SER CB C 13 61.739 0.3 . 1 . . . . . 73 SER CB . 26720 1
308 . 1 . 1 73 73 SER N N 15 119.891 0.3 . 1 . . . . . 73 SER N . 26720 1
309 . 1 . 1 75 75 THR H H 1 7.981 0.020 . 1 . . . . . 75 THR H . 26720 1
310 . 1 . 1 75 75 THR C C 13 171.663 0.3 . 1 . . . . . 75 THR C . 26720 1
311 . 1 . 1 75 75 THR CA C 13 59.555 0.3 . 1 . . . . . 75 THR CA . 26720 1
312 . 1 . 1 75 75 THR CB C 13 66.410 0.3 . 1 . . . . . 75 THR CB . 26720 1
313 . 1 . 1 75 75 THR N N 15 114.725 0.3 . 1 . . . . . 75 THR N . 26720 1
314 . 1 . 1 76 76 ARG H H 1 8.151 0.020 . 1 . . . . . 76 ARG H . 26720 1
315 . 1 . 1 76 76 ARG C C 13 173.037 0.3 . 1 . . . . . 76 ARG C . 26720 1
316 . 1 . 1 76 76 ARG CA C 13 52.884 0.3 . 1 . . . . . 76 ARG CA . 26720 1
317 . 1 . 1 76 76 ARG CB C 13 27.665 0.3 . 1 . . . . . 76 ARG CB . 26720 1
318 . 1 . 1 76 76 ARG N N 15 123.920 0.3 . 1 . . . . . 76 ARG N . 26720 1
319 . 1 . 1 77 77 HIS H H 1 8.281 0.020 . 1 . . . . . 77 HIS H . 26720 1
320 . 1 . 1 77 77 HIS C C 13 172.360 0.3 . 1 . . . . . 77 HIS C . 26720 1
321 . 1 . 1 77 77 HIS CA C 13 52.751 0.3 . 1 . . . . . 77 HIS CA . 26720 1
322 . 1 . 1 77 77 HIS CB C 13 27.319 0.3 . 1 . . . . . 77 HIS CB . 26720 1
323 . 1 . 1 77 77 HIS N N 15 120.733 0.3 . 1 . . . . . 77 HIS N . 26720 1
324 . 1 . 1 78 78 THR H H 1 8.057 0.020 . 1 . . . . . 78 THR H . 26720 1
325 . 1 . 1 78 78 THR C C 13 171.545 0.3 . 1 . . . . . 78 THR C . 26720 1
326 . 1 . 1 78 78 THR CA C 13 58.743 0.3 . 1 . . . . . 78 THR CA . 26720 1
327 . 1 . 1 78 78 THR CB C 13 66.843 0.3 . 1 . . . . . 78 THR CB . 26720 1
328 . 1 . 1 78 78 THR N N 15 115.911 0.3 . 1 . . . . . 78 THR N . 26720 1
329 . 1 . 1 79 79 THR H H 1 8.110 0.020 . 1 . . . . . 79 THR H . 26720 1
330 . 1 . 1 79 79 THR C C 13 171.264 0.3 . 1 . . . . . 79 THR C . 26720 1
331 . 1 . 1 79 79 THR CA C 13 59.016 0.3 . 1 . . . . . 79 THR CA . 26720 1
332 . 1 . 1 79 79 THR CB C 13 66.997 0.3 . 1 . . . . . 79 THR CB . 26720 1
333 . 1 . 1 79 79 THR N N 15 117.523 0.3 . 1 . . . . . 79 THR N . 26720 1
334 . 1 . 1 80 80 ARG H H 1 8.251 0.020 . 1 . . . . . 80 ARG H . 26720 1
335 . 1 . 1 80 80 ARG C C 13 173.039 0.3 . 1 . . . . . 80 ARG C . 26720 1
336 . 1 . 1 80 80 ARG CA C 13 52.985 0.3 . 1 . . . . . 80 ARG CA . 26720 1
337 . 1 . 1 80 80 ARG CB C 13 27.831 0.3 . 1 . . . . . 80 ARG CB . 26720 1
338 . 1 . 1 80 80 ARG N N 15 124.750 0.3 . 1 . . . . . 80 ARG N . 26720 1
339 . 1 . 1 81 81 VAL H H 1 8.174 0.020 . 1 . . . . . 81 VAL H . 26720 1
340 . 1 . 1 81 81 VAL C C 13 173.101 0.3 . 1 . . . . . 81 VAL C . 26720 1
341 . 1 . 1 81 81 VAL CA C 13 59.424 0.3 . 1 . . . . . 81 VAL CA . 26720 1
342 . 1 . 1 81 81 VAL CB C 13 29.665 0.3 . 1 . . . . . 81 VAL CB . 26720 1
343 . 1 . 1 81 81 VAL N N 15 122.895 0.3 . 1 . . . . . 81 VAL N . 26720 1
344 . 1 . 1 82 82 CYS H H 1 8.366 0.020 . 1 . . . . . 82 CYS H . 26720 1
345 . 1 . 1 82 82 CYS C C 13 170.758 0.3 . 1 . . . . . 82 CYS C . 26720 1
346 . 1 . 1 82 82 CYS CA C 13 55.538 0.3 . 1 . . . . . 82 CYS CA . 26720 1
347 . 1 . 1 82 82 CYS CB C 13 25.165 0.3 . 1 . . . . . 82 CYS CB . 26720 1
348 . 1 . 1 82 82 CYS N N 15 124.612 0.3 . 1 . . . . . 82 CYS N . 26720 1
349 . 1 . 1 83 83 VAL H H 1 7.687 0.020 . 1 . . . . . 83 VAL H . 26720 1
350 . 1 . 1 83 83 VAL C C 13 178.050 0.3 . 1 . . . . . 83 VAL C . 26720 1
351 . 1 . 1 83 83 VAL CA C 13 60.812 0.3 . 1 . . . . . 83 VAL CA . 26720 1
352 . 1 . 1 83 83 VAL CB C 13 30.105 0.3 . 1 . . . . . 83 VAL CB . 26720 1
353 . 1 . 1 83 83 VAL N N 15 126.521 0.3 . 1 . . . . . 83 VAL N . 26720 1
stop_
save_