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 27451
_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 '3D HNCO' . . . 27451 1
2 '3D HNCA' . . . 27451 1
3 '3D HN(CO)CA' . . . 27451 1
4 '3D HNCACB' . . . 27451 1
5 '3D CBCA(CO)NH' . . . 27451 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.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 THR H H 1 8.653 0.02 . 1 . . . . . 2 THR H . 27451 1
2 . 1 1 2 2 THR C C 13 175.365 0.20 . 1 . . . . . 2 THR C . 27451 1
3 . 1 1 2 2 THR CA C 13 61.882 0.02 . 1 . . . . . 2 THR CA . 27451 1
4 . 1 1 2 2 THR CB C 13 70.716 0.02 . 1 . . . . . 2 THR CB . 27451 1
5 . 1 1 2 2 THR N N 15 113.913 0.20 . 1 . . . . . 2 THR N . 27451 1
6 . 1 1 3 3 LYS H H 1 8.798 0.02 . 1 . . . . . 3 LYS H . 27451 1
7 . 1 1 3 3 LYS C C 13 178.714 0.20 . 1 . . . . . 3 LYS C . 27451 1
8 . 1 1 3 3 LYS CA C 13 59.174 0.02 . 1 . . . . . 3 LYS CA . 27451 1
9 . 1 1 3 3 LYS CB C 13 32.167 0.02 . 1 . . . . . 3 LYS CB . 27451 1
10 . 1 1 3 3 LYS N N 15 122.186 0.20 . 1 . . . . . 3 LYS N . 27451 1
11 . 1 1 4 4 GLN H H 1 8.403 0.02 . 1 . . . . . 4 GLN H . 27451 1
12 . 1 1 4 4 GLN C C 13 178.530 0.20 . 1 . . . . . 4 GLN C . 27451 1
13 . 1 1 4 4 GLN CA C 13 59.082 0.02 . 1 . . . . . 4 GLN CA . 27451 1
14 . 1 1 4 4 GLN CB C 13 28.599 0.02 . 1 . . . . . 4 GLN CB . 27451 1
15 . 1 1 4 4 GLN N N 15 119.349 0.20 . 1 . . . . . 4 GLN N . 27451 1
16 . 1 1 5 5 GLU H H 1 7.881 0.02 . 1 . . . . . 5 GLU H . 27451 1
17 . 1 1 5 5 GLU C C 13 177.767 0.20 . 1 . . . . . 5 GLU C . 27451 1
18 . 1 1 5 5 GLU CA C 13 58.946 0.02 . 1 . . . . . 5 GLU CA . 27451 1
19 . 1 1 5 5 GLU CB C 13 29.140 0.02 . 1 . . . . . 5 GLU CB . 27451 1
20 . 1 1 5 5 GLU N N 15 121.516 0.20 . 1 . . . . . 5 GLU N . 27451 1
21 . 1 1 6 6 LYS H H 1 8.100 0.02 . 1 . . . . . 6 LYS H . 27451 1
22 . 1 1 6 6 LYS C C 13 178.854 0.20 . 1 . . . . . 6 LYS C . 27451 1
23 . 1 1 6 6 LYS CA C 13 58.692 0.02 . 1 . . . . . 6 LYS CA . 27451 1
24 . 1 1 6 6 LYS CB C 13 31.914 0.02 . 1 . . . . . 6 LYS CB . 27451 1
25 . 1 1 6 6 LYS N N 15 118.976 0.20 . 1 . . . . . 6 LYS N . 27451 1
26 . 1 1 7 7 THR H H 1 8.144 0.02 . 1 . . . . . 7 THR H . 27451 1
27 . 1 1 7 7 THR C C 13 176.115 0.20 . 1 . . . . . 7 THR C . 27451 1
28 . 1 1 7 7 THR CA C 13 65.947 0.02 . 1 . . . . . 7 THR CA . 27451 1
29 . 1 1 7 7 THR CB C 13 68.882 0.02 . 1 . . . . . 7 THR CB . 27451 1
30 . 1 1 7 7 THR N N 15 116.032 0.20 . 1 . . . . . 7 THR N . 27451 1
31 . 1 1 8 8 ALA H H 1 7.783 0.02 . 1 . . . . . 8 ALA H . 27451 1
32 . 1 1 8 8 ALA C C 13 178.531 0.20 . 1 . . . . . 8 ALA C . 27451 1
33 . 1 1 8 8 ALA CA C 13 55.464 0.02 . 1 . . . . . 8 ALA CA . 27451 1
34 . 1 1 8 8 ALA CB C 13 17.139 0.02 . 1 . . . . . 8 ALA CB . 27451 1
35 . 1 1 8 8 ALA N N 15 123.765 0.20 . 1 . . . . . 8 ALA N . 27451 1
36 . 1 1 9 9 LEU H H 1 7.963 0.02 . 1 . . . . . 9 LEU H . 27451 1
37 . 1 1 9 9 LEU C C 13 178.328 0.20 . 1 . . . . . 9 LEU C . 27451 1
38 . 1 1 9 9 LEU CA C 13 58.555 0.02 . 1 . . . . . 9 LEU CA . 27451 1
39 . 1 1 9 9 LEU CB C 13 42.093 0.02 . 1 . . . . . 9 LEU CB . 27451 1
40 . 1 1 9 9 LEU N N 15 118.559 0.20 . 1 . . . . . 9 LEU N . 27451 1
41 . 1 1 10 10 ASN H H 1 8.554 0.02 . 1 . . . . . 10 ASN H . 27451 1
42 . 1 1 10 10 ASN C C 13 178.815 0.20 . 1 . . . . . 10 ASN C . 27451 1
43 . 1 1 10 10 ASN CA C 13 56.148 0.02 . 1 . . . . . 10 ASN CA . 27451 1
44 . 1 1 10 10 ASN CB C 13 37.917 0.02 . 1 . . . . . 10 ASN CB . 27451 1
45 . 1 1 10 10 ASN N N 15 117.715 0.20 . 1 . . . . . 10 ASN N . 27451 1
46 . 1 1 11 11 MET H H 1 8.626 0.02 . 1 . . . . . 11 MET H . 27451 1
47 . 1 1 11 11 MET C C 13 178.099 0.20 . 1 . . . . . 11 MET C . 27451 1
48 . 1 1 11 11 MET CA C 13 59.768 0.02 . 1 . . . . . 11 MET CA . 27451 1
49 . 1 1 11 11 MET CB C 13 33.815 0.02 . 1 . . . . . 11 MET CB . 27451 1
50 . 1 1 11 11 MET N N 15 120.426 0.20 . 1 . . . . . 11 MET N . 27451 1
51 . 1 1 12 12 ALA H H 1 8.476 0.02 . 1 . . . . . 12 ALA H . 27451 1
52 . 1 1 12 12 ALA C C 13 179.945 0.20 . 1 . . . . . 12 ALA C . 27451 1
53 . 1 1 12 12 ALA CA C 13 55.601 0.02 . 1 . . . . . 12 ALA CA . 27451 1
54 . 1 1 12 12 ALA CB C 13 17.884 0.02 . 1 . . . . . 12 ALA CB . 27451 1
55 . 1 1 12 12 ALA N N 15 121.646 0.20 . 1 . . . . . 12 ALA N . 27451 1
56 . 1 1 13 13 ARG H H 1 8.490 0.02 . 1 . . . . . 13 ARG H . 27451 1
57 . 1 1 13 13 ARG C C 13 178.363 0.20 . 1 . . . . . 13 ARG C . 27451 1
58 . 1 1 13 13 ARG CA C 13 59.961 0.02 . 1 . . . . . 13 ARG CA . 27451 1
59 . 1 1 13 13 ARG CB C 13 30.628 0.02 . 1 . . . . . 13 ARG CB . 27451 1
60 . 1 1 13 13 ARG N N 15 120.374 0.20 . 1 . . . . . 13 ARG N . 27451 1
61 . 1 1 14 14 PHE H H 1 8.484 0.02 . 1 . . . . . 14 PHE H . 27451 1
62 . 1 1 14 14 PHE C C 13 178.208 0.20 . 1 . . . . . 14 PHE C . 27451 1
63 . 1 1 14 14 PHE CA C 13 60.572 0.02 . 1 . . . . . 14 PHE CA . 27451 1
64 . 1 1 14 14 PHE CB C 13 39.379 0.02 . 1 . . . . . 14 PHE CB . 27451 1
65 . 1 1 14 14 PHE N N 15 121.752 0.20 . 1 . . . . . 14 PHE N . 27451 1
66 . 1 1 15 15 ILE H H 1 8.780 0.02 . 1 . . . . . 15 ILE H . 27451 1
67 . 1 1 15 15 ILE C C 13 176.902 0.20 . 1 . . . . . 15 ILE C . 27451 1
68 . 1 1 15 15 ILE CA C 13 66.184 0.02 . 1 . . . . . 15 ILE CA . 27451 1
69 . 1 1 15 15 ILE CB C 13 38.294 0.02 . 1 . . . . . 15 ILE CB . 27451 1
70 . 1 1 15 15 ILE N N 15 119.991 0.20 . 1 . . . . . 15 ILE N . 27451 1
71 . 1 1 16 16 ARG H H 1 7.377 0.02 . 1 . . . . . 16 ARG H . 27451 1
72 . 1 1 16 16 ARG C C 13 177.279 0.20 . 1 . . . . . 16 ARG C . 27451 1
73 . 1 1 16 16 ARG CA C 13 60.719 0.02 . 1 . . . . . 16 ARG CA . 27451 1
74 . 1 1 16 16 ARG CB C 13 30.321 0.02 . 1 . . . . . 16 ARG CB . 27451 1
75 . 1 1 16 16 ARG N N 15 117.660 0.20 . 1 . . . . . 16 ARG N . 27451 1
76 . 1 1 17 17 SER H H 1 7.816 0.02 . 1 . . . . . 17 SER H . 27451 1
77 . 1 1 17 17 SER C C 13 177.145 0.20 . 1 . . . . . 17 SER C . 27451 1
78 . 1 1 17 17 SER CA C 13 61.529 0.02 . 1 . . . . . 17 SER CA . 27451 1
79 . 1 1 17 17 SER CB C 13 63.041 0.02 . 1 . . . . . 17 SER CB . 27451 1
80 . 1 1 17 17 SER N N 15 113.561 0.20 . 1 . . . . . 17 SER N . 27451 1
81 . 1 1 18 18 GLN H H 1 8.513 0.02 . 1 . . . . . 18 GLN H . 27451 1
82 . 1 1 18 18 GLN C C 13 178.682 0.20 . 1 . . . . . 18 GLN C . 27451 1
83 . 1 1 18 18 GLN CA C 13 58.546 0.02 . 1 . . . . . 18 GLN CA . 27451 1
84 . 1 1 18 18 GLN CB C 13 28.898 0.02 . 1 . . . . . 18 GLN CB . 27451 1
85 . 1 1 18 18 GLN N N 15 122.427 0.20 . 1 . . . . . 18 GLN N . 27451 1
86 . 1 1 19 19 VAL H H 1 8.371 0.02 . 1 . . . . . 19 VAL H . 27451 1
87 . 1 1 19 19 VAL C C 13 177.042 0.20 . 1 . . . . . 19 VAL C . 27451 1
88 . 1 1 19 19 VAL CA C 13 66.526 0.02 . 1 . . . . . 19 VAL CA . 27451 1
89 . 1 1 19 19 VAL CB C 13 31.205 0.02 . 1 . . . . . 19 VAL CB . 27451 1
90 . 1 1 19 19 VAL N N 15 118.810 0.20 . 1 . . . . . 19 VAL N . 27451 1
91 . 1 1 20 20 LEU H H 1 7.514 0.02 . 1 . . . . . 20 LEU H . 27451 1
92 . 1 1 20 20 LEU C C 13 178.983 0.20 . 1 . . . . . 20 LEU C . 27451 1
93 . 1 1 20 20 LEU CA C 13 58.274 0.02 . 1 . . . . . 20 LEU CA . 27451 1
94 . 1 1 20 20 LEU CB C 13 41.014 0.02 . 1 . . . . . 20 LEU CB . 27451 1
95 . 1 1 20 20 LEU N N 15 120.605 0.20 . 1 . . . . . 20 LEU N . 27451 1
96 . 1 1 21 21 THR H H 1 7.929 0.02 . 1 . . . . . 21 THR H . 27451 1
97 . 1 1 21 21 THR C C 13 176.234 0.20 . 1 . . . . . 21 THR C . 27451 1
98 . 1 1 21 21 THR CA C 13 66.668 0.02 . 1 . . . . . 21 THR CA . 27451 1
99 . 1 1 21 21 THR CB C 13 68.382 0.02 . 1 . . . . . 21 THR CB . 27451 1
100 . 1 1 21 21 THR N N 15 117.131 0.20 . 1 . . . . . 21 THR N . 27451 1
101 . 1 1 22 22 LEU H H 1 8.202 0.02 . 1 . . . . . 22 LEU H . 27451 1
102 . 1 1 22 22 LEU C C 13 177.550 0.20 . 1 . . . . . 22 LEU C . 27451 1
103 . 1 1 22 22 LEU CA C 13 58.009 0.02 . 1 . . . . . 22 LEU CA . 27451 1
104 . 1 1 22 22 LEU CB C 13 40.742 0.02 . 1 . . . . . 22 LEU CB . 27451 1
105 . 1 1 22 22 LEU N N 15 123.280 0.20 . 1 . . . . . 22 LEU N . 27451 1
106 . 1 1 23 23 LEU H H 1 8.712 0.02 . 1 . . . . . 23 LEU H . 27451 1
107 . 1 1 23 23 LEU C C 13 177.895 0.20 . 1 . . . . . 23 LEU C . 27451 1
108 . 1 1 23 23 LEU CA C 13 59.343 0.02 . 1 . . . . . 23 LEU CA . 27451 1
109 . 1 1 23 23 LEU CB C 13 42.107 0.02 . 1 . . . . . 23 LEU CB . 27451 1
110 . 1 1 23 23 LEU N N 15 121.837 0.20 . 1 . . . . . 23 LEU N . 27451 1
111 . 1 1 24 24 GLU H H 1 7.827 0.02 . 1 . . . . . 24 GLU H . 27451 1
112 . 1 1 24 24 GLU C C 13 179.797 0.20 . 1 . . . . . 24 GLU C . 27451 1
113 . 1 1 24 24 GLU CA C 13 59.568 0.02 . 1 . . . . . 24 GLU CA . 27451 1
114 . 1 1 24 24 GLU CB C 13 29.107 0.02 . 1 . . . . . 24 GLU CB . 27451 1
115 . 1 1 24 24 GLU N N 15 118.128 0.20 . 1 . . . . . 24 GLU N . 27451 1
116 . 1 1 25 25 LYS H H 1 8.011 0.02 . 1 . . . . . 25 LYS H . 27451 1
117 . 1 1 25 25 LYS C C 13 179.654 0.20 . 1 . . . . . 25 LYS C . 27451 1
118 . 1 1 25 25 LYS CA C 13 58.488 0.02 . 1 . . . . . 25 LYS CA . 27451 1
119 . 1 1 25 25 LYS CB C 13 31.287 0.02 . 1 . . . . . 25 LYS CB . 27451 1
120 . 1 1 25 25 LYS N N 15 119.782 0.20 . 1 . . . . . 25 LYS N . 27451 1
121 . 1 1 26 26 LEU H H 1 8.921 0.02 . 1 . . . . . 26 LEU H . 27451 1
122 . 1 1 26 26 LEU C C 13 179.134 0.20 . 1 . . . . . 26 LEU C . 27451 1
123 . 1 1 26 26 LEU CA C 13 57.925 0.02 . 1 . . . . . 26 LEU CA . 27451 1
124 . 1 1 26 26 LEU CB C 13 41.039 0.02 . 1 . . . . . 26 LEU CB . 27451 1
125 . 1 1 26 26 LEU N N 15 119.368 0.20 . 1 . . . . . 26 LEU N . 27451 1
126 . 1 1 27 27 ASN H H 1 8.359 0.02 . 1 . . . . . 27 ASN H . 27451 1
127 . 1 1 27 27 ASN C C 13 179.242 0.20 . 1 . . . . . 27 ASN C . 27451 1
128 . 1 1 27 27 ASN CA C 13 56.118 0.02 . 1 . . . . . 27 ASN CA . 27451 1
129 . 1 1 27 27 ASN CB C 13 38.216 0.02 . 1 . . . . . 27 ASN CB . 27451 1
130 . 1 1 27 27 ASN N N 15 118.681 0.20 . 1 . . . . . 27 ASN N . 27451 1
131 . 1 1 28 28 GLU H H 1 7.973 0.02 . 1 . . . . . 28 GLU H . 27451 1
132 . 1 1 28 28 GLU C C 13 177.827 0.20 . 1 . . . . . 28 GLU C . 27451 1
133 . 1 1 28 28 GLU CA C 13 58.864 0.02 . 1 . . . . . 28 GLU CA . 27451 1
134 . 1 1 28 28 GLU CB C 13 29.667 0.02 . 1 . . . . . 28 GLU CB . 27451 1
135 . 1 1 28 28 GLU N N 15 121.797 0.20 . 1 . . . . . 28 GLU N . 27451 1
136 . 1 1 29 29 LEU H H 1 7.345 0.02 . 1 . . . . . 29 LEU H . 27451 1
137 . 1 1 29 29 LEU C C 13 175.627 0.20 . 1 . . . . . 29 LEU C . 27451 1
138 . 1 1 29 29 LEU CA C 13 54.631 0.02 . 1 . . . . . 29 LEU CA . 27451 1
139 . 1 1 29 29 LEU CB C 13 43.249 0.02 . 1 . . . . . 29 LEU CB . 27451 1
140 . 1 1 29 29 LEU N N 15 118.234 0.20 . 1 . . . . . 29 LEU N . 27451 1
141 . 1 1 30 30 ASP H H 1 8.100 0.02 . 1 . . . . . 30 ASP H . 27451 1
142 . 1 1 30 30 ASP C C 13 175.150 0.20 . 1 . . . . . 30 ASP C . 27451 1
143 . 1 1 30 30 ASP CA C 13 55.223 0.02 . 1 . . . . . 30 ASP CA . 27451 1
144 . 1 1 30 30 ASP CB C 13 38.980 0.02 . 1 . . . . . 30 ASP CB . 27451 1
145 . 1 1 30 30 ASP N N 15 118.176 0.20 . 1 . . . . . 30 ASP N . 27451 1
146 . 1 1 31 31 ALA H H 1 7.988 0.02 . 1 . . . . . 31 ALA H . 27451 1
147 . 1 1 31 31 ALA C C 13 176.714 0.20 . 1 . . . . . 31 ALA C . 27451 1
148 . 1 1 31 31 ALA CA C 13 50.129 0.02 . 1 . . . . . 31 ALA CA . 27451 1
149 . 1 1 31 31 ALA CB C 13 17.138 0.02 . 1 . . . . . 31 ALA CB . 27451 1
150 . 1 1 31 31 ALA N N 15 123.213 0.20 . 1 . . . . . 31 ALA N . 27451 1
151 . 1 1 32 32 ASP H H 1 7.953 0.02 . 1 . . . . . 32 ASP H . 27451 1
152 . 1 1 32 32 ASP C C 13 178.027 0.20 . 1 . . . . . 32 ASP C . 27451 1
153 . 1 1 32 32 ASP CA C 13 58.408 0.02 . 1 . . . . . 32 ASP CA . 27451 1
154 . 1 1 32 32 ASP CB C 13 40.487 0.02 . 1 . . . . . 32 ASP CB . 27451 1
155 . 1 1 32 32 ASP N N 15 121.612 0.20 . 1 . . . . . 32 ASP N . 27451 1
156 . 1 1 33 33 GLU H H 1 8.903 0.02 . 1 . . . . . 33 GLU H . 27451 1
157 . 1 1 33 33 GLU C C 13 178.699 0.20 . 1 . . . . . 33 GLU C . 27451 1
158 . 1 1 33 33 GLU CA C 13 59.608 0.02 . 1 . . . . . 33 GLU CA . 27451 1
159 . 1 1 33 33 GLU CB C 13 28.926 0.02 . 1 . . . . . 33 GLU CB . 27451 1
160 . 1 1 33 33 GLU N N 15 119.567 0.20 . 1 . . . . . 33 GLU N . 27451 1
161 . 1 1 34 34 GLN H H 1 7.293 0.02 . 1 . . . . . 34 GLN H . 27451 1
162 . 1 1 34 34 GLN C C 13 177.316 0.20 . 1 . . . . . 34 GLN C . 27451 1
163 . 1 1 34 34 GLN CA C 13 60.542 0.02 . 1 . . . . . 34 GLN CA . 27451 1
164 . 1 1 34 34 GLN CB C 13 27.521 0.02 . 1 . . . . . 34 GLN CB . 27451 1
165 . 1 1 34 34 GLN N N 15 117.724 0.20 . 1 . . . . . 34 GLN N . 27451 1
166 . 1 1 35 35 ALA H H 1 8.879 0.02 . 1 . . . . . 35 ALA H . 27451 1
167 . 1 1 35 35 ALA C C 13 178.932 0.20 . 1 . . . . . 35 ALA C . 27451 1
168 . 1 1 35 35 ALA CA C 13 55.511 0.02 . 1 . . . . . 35 ALA CA . 27451 1
169 . 1 1 35 35 ALA CB C 13 17.689 0.02 . 1 . . . . . 35 ALA CB . 27451 1
170 . 1 1 35 35 ALA N N 15 123.928 0.20 . 1 . . . . . 35 ALA N . 27451 1
171 . 1 1 36 36 ASP H H 1 8.025 0.02 . 1 . . . . . 36 ASP H . 27451 1
172 . 1 1 36 36 ASP C C 13 179.707 0.20 . 1 . . . . . 36 ASP C . 27451 1
173 . 1 1 36 36 ASP CA C 13 57.624 0.02 . 1 . . . . . 36 ASP CA . 27451 1
174 . 1 1 36 36 ASP CB C 13 40.355 0.02 . 1 . . . . . 36 ASP CB . 27451 1
175 . 1 1 36 36 ASP N N 15 118.146 0.20 . 1 . . . . . 36 ASP N . 27451 1
176 . 1 1 37 37 ILE H H 1 7.320 0.02 . 1 . . . . . 37 ILE H . 27451 1
177 . 1 1 37 37 ILE C C 13 178.744 0.20 . 1 . . . . . 37 ILE C . 27451 1
178 . 1 1 37 37 ILE CA C 13 64.890 0.02 . 1 . . . . . 37 ILE CA . 27451 1
179 . 1 1 37 37 ILE CB C 13 38.106 0.02 . 1 . . . . . 37 ILE CB . 27451 1
180 . 1 1 37 37 ILE N N 15 120.063 0.20 . 1 . . . . . 37 ILE N . 27451 1
181 . 1 1 38 38 ALA H H 1 8.762 0.02 . 1 . . . . . 38 ALA H . 27451 1
182 . 1 1 38 38 ALA C C 13 178.724 0.20 . 1 . . . . . 38 ALA C . 27451 1
183 . 1 1 38 38 ALA CA C 13 55.722 0.02 . 1 . . . . . 38 ALA CA . 27451 1
184 . 1 1 38 38 ALA CB C 13 17.754 0.02 . 1 . . . . . 38 ALA CB . 27451 1
185 . 1 1 38 38 ALA N N 15 123.125 0.20 . 1 . . . . . 38 ALA N . 27451 1
186 . 1 1 39 39 GLU H H 1 8.708 0.02 . 1 . . . . . 39 GLU H . 27451 1
187 . 1 1 39 39 GLU C C 13 178.466 0.20 . 1 . . . . . 39 GLU C . 27451 1
188 . 1 1 39 39 GLU CA C 13 60.022 0.02 . 1 . . . . . 39 GLU CA . 27451 1
189 . 1 1 39 39 GLU CB C 13 28.965 0.02 . 1 . . . . . 39 GLU CB . 27451 1
190 . 1 1 39 39 GLU N N 15 120.179 0.20 . 1 . . . . . 39 GLU N . 27451 1
191 . 1 1 40 40 SER H H 1 7.389 0.02 . 1 . . . . . 40 SER H . 27451 1
192 . 1 1 40 40 SER C C 13 178.375 0.20 . 1 . . . . . 40 SER C . 27451 1
193 . 1 1 40 40 SER CA C 13 61.474 0.02 . 1 . . . . . 40 SER CA . 27451 1
194 . 1 1 40 40 SER CB C 13 63.100 0.02 . 1 . . . . . 40 SER CB . 27451 1
195 . 1 1 40 40 SER N N 15 115.253 0.20 . 1 . . . . . 40 SER N . 27451 1
196 . 1 1 41 41 VAL H H 1 8.704 0.02 . 1 . . . . . 41 VAL H . 27451 1
197 . 1 1 41 41 VAL C C 13 177.417 0.20 . 1 . . . . . 41 VAL C . 27451 1
198 . 1 1 41 41 VAL CA C 13 67.310 0.02 . 1 . . . . . 41 VAL CA . 27451 1
199 . 1 1 41 41 VAL CB C 13 29.820 0.02 . 1 . . . . . 41 VAL CB . 27451 1
200 . 1 1 41 41 VAL N N 15 122.009 0.20 . 1 . . . . . 41 VAL N . 27451 1
201 . 1 1 42 42 HIS H H 1 9.030 0.02 . 1 . . . . . 42 HIS H . 27451 1
202 . 1 1 42 42 HIS C C 13 175.985 0.20 . 1 . . . . . 42 HIS C . 27451 1
203 . 1 1 42 42 HIS CA C 13 61.116 0.02 . 1 . . . . . 42 HIS CA . 27451 1
204 . 1 1 42 42 HIS CB C 13 27.842 0.02 . 1 . . . . . 42 HIS CB . 27451 1
205 . 1 1 42 42 HIS N N 15 121.012 0.20 . 1 . . . . . 42 HIS N . 27451 1
206 . 1 1 43 43 ASP H H 1 8.292 0.02 . 1 . . . . . 43 ASP H . 27451 1
207 . 1 1 43 43 ASP C C 13 179.003 0.20 . 1 . . . . . 43 ASP C . 27451 1
208 . 1 1 43 43 ASP CA C 13 57.641 0.02 . 1 . . . . . 43 ASP CA . 27451 1
209 . 1 1 43 43 ASP CB C 13 40.092 0.02 . 1 . . . . . 43 ASP CB . 27451 1
210 . 1 1 43 43 ASP N N 15 120.593 0.20 . 1 . . . . . 43 ASP N . 27451 1
211 . 1 1 44 44 HIS H H 1 8.088 0.02 . 1 . . . . . 44 HIS H . 27451 1
212 . 1 1 44 44 HIS C C 13 176.958 0.20 . 1 . . . . . 44 HIS C . 27451 1
213 . 1 1 44 44 HIS CA C 13 58.000 0.02 . 1 . . . . . 44 HIS CA . 27451 1
214 . 1 1 44 44 HIS CB C 13 30.120 0.02 . 1 . . . . . 44 HIS CB . 27451 1
215 . 1 1 44 44 HIS N N 15 119.983 0.20 . 1 . . . . . 44 HIS N . 27451 1
216 . 1 1 45 45 ALA H H 1 9.451 0.02 . 1 . . . . . 45 ALA H . 27451 1
217 . 1 1 45 45 ALA C C 13 180.349 0.20 . 1 . . . . . 45 ALA C . 27451 1
218 . 1 1 45 45 ALA CA C 13 54.870 0.02 . 1 . . . . . 45 ALA CA . 27451 1
219 . 1 1 45 45 ALA CB C 13 16.972 0.02 . 1 . . . . . 45 ALA CB . 27451 1
220 . 1 1 45 45 ALA N N 15 122.840 0.20 . 1 . . . . . 45 ALA N . 27451 1
221 . 1 1 46 46 ASP H H 1 8.688 0.02 . 1 . . . . . 46 ASP H . 27451 1
222 . 1 1 46 46 ASP C C 13 177.350 0.20 . 1 . . . . . 46 ASP C . 27451 1
223 . 1 1 46 46 ASP CA C 13 58.194 0.02 . 1 . . . . . 46 ASP CA . 27451 1
224 . 1 1 46 46 ASP CB C 13 41.728 0.02 . 1 . . . . . 46 ASP CB . 27451 1
225 . 1 1 46 46 ASP N N 15 122.377 0.20 . 1 . . . . . 46 ASP N . 27451 1
226 . 1 1 47 47 GLU H H 1 7.773 0.02 . 1 . . . . . 47 GLU H . 27451 1
227 . 1 1 47 47 GLU C C 13 179.671 0.20 . 1 . . . . . 47 GLU C . 27451 1
228 . 1 1 47 47 GLU CA C 13 59.818 0.02 . 1 . . . . . 47 GLU CA . 27451 1
229 . 1 1 47 47 GLU CB C 13 29.064 0.02 . 1 . . . . . 47 GLU CB . 27451 1
230 . 1 1 47 47 GLU N N 15 120.877 0.20 . 1 . . . . . 47 GLU N . 27451 1
231 . 1 1 48 48 LEU H H 1 8.230 0.02 . 1 . . . . . 48 LEU H . 27451 1
232 . 1 1 48 48 LEU C C 13 177.217 0.20 . 1 . . . . . 48 LEU C . 27451 1
233 . 1 1 48 48 LEU CA C 13 58.244 0.02 . 1 . . . . . 48 LEU CA . 27451 1
234 . 1 1 48 48 LEU CB C 13 41.025 0.02 . 1 . . . . . 48 LEU CB . 27451 1
235 . 1 1 48 48 LEU N N 15 119.856 0.20 . 1 . . . . . 48 LEU N . 27451 1
236 . 1 1 49 49 TYR H H 1 8.459 0.02 . 1 . . . . . 49 TYR H . 27451 1
237 . 1 1 49 49 TYR C C 13 175.862 0.20 . 1 . . . . . 49 TYR C . 27451 1
238 . 1 1 49 49 TYR CA C 13 61.673 0.02 . 1 . . . . . 49 TYR CA . 27451 1
239 . 1 1 49 49 TYR CB C 13 38.000 0.02 . 1 . . . . . 49 TYR CB . 27451 1
240 . 1 1 49 49 TYR N N 15 119.327 0.20 . 1 . . . . . 49 TYR N . 27451 1
241 . 1 1 50 50 ARG H H 1 8.606 0.02 . 1 . . . . . 50 ARG H . 27451 1
242 . 1 1 50 50 ARG C C 13 179.015 0.20 . 1 . . . . . 50 ARG C . 27451 1
243 . 1 1 50 50 ARG CA C 13 60.214 0.02 . 1 . . . . . 50 ARG CA . 27451 1
244 . 1 1 50 50 ARG CB C 13 29.957 0.02 . 1 . . . . . 50 ARG CB . 27451 1
245 . 1 1 50 50 ARG N N 15 117.055 0.20 . 1 . . . . . 50 ARG N . 27451 1
246 . 1 1 51 51 SER H H 1 7.947 0.02 . 1 . . . . . 51 SER H . 27451 1
247 . 1 1 51 51 SER C C 13 178.328 0.20 . 1 . . . . . 51 SER C . 27451 1
248 . 1 1 51 51 SER CA C 13 61.283 0.02 . 1 . . . . . 51 SER CA . 27451 1
249 . 1 1 51 51 SER CB C 13 64.070 0.02 . 1 . . . . . 51 SER CB . 27451 1
250 . 1 1 51 51 SER N N 15 114.664 0.20 . 1 . . . . . 51 SER N . 27451 1
251 . 1 1 52 52 VAL H H 1 8.477 0.02 . 1 . . . . . 52 VAL H . 27451 1
252 . 1 1 52 52 VAL C C 13 177.168 0.20 . 1 . . . . . 52 VAL C . 27451 1
253 . 1 1 52 52 VAL CA C 13 66.789 0.02 . 1 . . . . . 52 VAL CA . 27451 1
254 . 1 1 52 52 VAL CB C 13 31.563 0.02 . 1 . . . . . 52 VAL CB . 27451 1
255 . 1 1 52 52 VAL N N 15 120.001 0.20 . 1 . . . . . 52 VAL N . 27451 1
256 . 1 1 53 53 LEU H H 1 8.716 0.02 . 1 . . . . . 53 LEU H . 27451 1
257 . 1 1 53 53 LEU C C 13 179.353 0.20 . 1 . . . . . 53 LEU C . 27451 1
258 . 1 1 53 53 LEU CA C 13 58.187 0.02 . 1 . . . . . 53 LEU CA . 27451 1
259 . 1 1 53 53 LEU CB C 13 41.800 0.02 . 1 . . . . . 53 LEU CB . 27451 1
260 . 1 1 53 53 LEU N N 15 122.523 0.20 . 1 . . . . . 53 LEU N . 27451 1
261 . 1 1 54 54 ALA H H 1 7.752 0.02 . 1 . . . . . 54 ALA H . 27451 1
262 . 1 1 54 54 ALA C C 13 178.857 0.20 . 1 . . . . . 54 ALA C . 27451 1
263 . 1 1 54 54 ALA CA C 13 54.530 0.02 . 1 . . . . . 54 ALA CA . 27451 1
264 . 1 1 54 54 ALA CB C 13 17.910 0.02 . 1 . . . . . 54 ALA CB . 27451 1
265 . 1 1 54 54 ALA N N 15 120.363 0.20 . 1 . . . . . 54 ALA N . 27451 1
266 . 1 1 55 55 ARG H H 1 7.265 0.02 . 1 . . . . . 55 ARG H . 27451 1
267 . 1 1 55 55 ARG C C 13 177.640 0.20 . 1 . . . . . 55 ARG C . 27451 1
268 . 1 1 55 55 ARG CA C 13 57.609 0.02 . 1 . . . . . 55 ARG CA . 27451 1
269 . 1 1 55 55 ARG CB C 13 30.724 0.02 . 1 . . . . . 55 ARG CB . 27451 1
270 . 1 1 55 55 ARG N N 15 116.544 0.20 . 1 . . . . . 55 ARG N . 27451 1
271 . 1 1 56 56 PHE H H 1 8.316 0.02 . 1 . . . . . 56 PHE H . 27451 1
272 . 1 1 56 56 PHE C C 13 176.787 0.20 . 1 . . . . . 56 PHE C . 27451 1
273 . 1 1 56 56 PHE CA C 13 56.822 0.02 . 1 . . . . . 56 PHE CA . 27451 1
274 . 1 1 56 56 PHE CB C 13 40.368 0.02 . 1 . . . . . 56 PHE CB . 27451 1
275 . 1 1 56 56 PHE N N 15 114.345 0.20 . 1 . . . . . 56 PHE N . 27451 1
276 . 1 1 57 57 GLY H H 1 8.243 0.02 . 1 . . . . . 57 GLY H . 27451 1
277 . 1 1 57 57 GLY C C 13 172.435 0.20 . 1 . . . . . 57 GLY C . 27451 1
278 . 1 1 57 57 GLY CA C 13 45.357 0.02 . 1 . . . . . 57 GLY CA . 27451 1
279 . 1 1 57 57 GLY N N 15 109.418 0.20 . 1 . . . . . 57 GLY N . 27451 1
280 . 1 1 58 58 ASP H H 1 8.239 0.02 . 1 . . . . . 58 ASP H . 27451 1
281 . 1 1 58 58 ASP C C 13 176.297 0.20 . 1 . . . . . 58 ASP C . 27451 1
282 . 1 1 58 58 ASP CA C 13 53.778 0.02 . 1 . . . . . 58 ASP CA . 27451 1
283 . 1 1 58 58 ASP CB C 13 41.929 0.02 . 1 . . . . . 58 ASP CB . 27451 1
284 . 1 1 58 58 ASP N N 15 118.819 0.20 . 1 . . . . . 58 ASP N . 27451 1
285 . 1 1 59 59 ASP H H 1 8.464 0.02 . 1 . . . . . 59 ASP H . 27451 1
286 . 1 1 59 59 ASP C C 13 177.036 0.20 . 1 . . . . . 59 ASP C . 27451 1
287 . 1 1 59 59 ASP CA C 13 54.576 0.02 . 1 . . . . . 59 ASP CA . 27451 1
288 . 1 1 59 59 ASP CB C 13 41.128 0.02 . 1 . . . . . 59 ASP CB . 27451 1
289 . 1 1 59 59 ASP N N 15 121.529 0.20 . 1 . . . . . 59 ASP N . 27451 1
290 . 1 1 60 60 GLY H H 1 8.454 0.02 . 1 . . . . . 60 GLY H . 27451 1
291 . 1 1 60 60 GLY C C 13 174.406 0.20 . 1 . . . . . 60 GLY C . 27451 1
292 . 1 1 60 60 GLY CA C 13 45.665 0.02 . 1 . . . . . 60 GLY CA . 27451 1
293 . 1 1 60 60 GLY N N 15 109.236 0.20 . 1 . . . . . 60 GLY N . 27451 1
294 . 1 1 61 61 GLU H H 1 8.178 0.02 . 1 . . . . . 61 GLU H . 27451 1
295 . 1 1 61 61 GLU C C 13 176.134 0.20 . 1 . . . . . 61 GLU C . 27451 1
296 . 1 1 61 61 GLU CA C 13 56.689 0.02 . 1 . . . . . 61 GLU CA . 27451 1
297 . 1 1 61 61 GLU CB C 13 30.277 0.02 . 1 . . . . . 61 GLU CB . 27451 1
298 . 1 1 61 61 GLU N N 15 120.170 0.20 . 1 . . . . . 61 GLU N . 27451 1
299 . 1 1 62 62 ASN H H 1 8.482 0.02 . 1 . . . . . 62 ASN H . 27451 1
300 . 1 1 62 62 ASN C C 13 173.932 0.20 . 1 . . . . . 62 ASN C . 27451 1
301 . 1 1 62 62 ASN CA C 13 53.315 0.02 . 1 . . . . . 62 ASN CA . 27451 1
302 . 1 1 62 62 ASN CB C 13 39.060 0.02 . 1 . . . . . 62 ASN CB . 27451 1
303 . 1 1 62 62 ASN N N 15 119.832 0.20 . 1 . . . . . 62 ASN N . 27451 1
304 . 1 1 63 63 LEU H H 1 7.784 0.02 . 1 . . . . . 63 LEU H . 27451 1
305 . 1 1 63 63 LEU CA C 13 56.879 0.02 . 1 . . . . . 63 LEU CA . 27451 1
306 . 1 1 63 63 LEU CB C 13 43.365 0.02 . 1 . . . . . 63 LEU CB . 27451 1
307 . 1 1 63 63 LEU N N 15 111.377 0.20 . 1 . . . . . 63 LEU N . 27451 1
stop_
save_