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 17540
_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-1H NOESY' . . . 17540 1
2 '2D 1H-1H TOCSY' . . . 17540 1
5 '2D 1H-15N HSQC' . . . 17540 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 ASP H H 1 7.991 0.114 . 1 . . . . 170 ASP HN . 17540 1
2 . 1 1 1 1 ASP HA H 1 4.222 0.000 . 1 . . . . 170 ASP HA . 17540 1
3 . 1 1 1 1 ASP HB2 H 1 2.513 0.000 . 2 . . . . 170 ASP HB2 . 17540 1
4 . 1 1 1 1 ASP HB3 H 1 2.376 0.000 . 2 . . . . 170 ASP HB3 . 17540 1
5 . 1 1 1 1 ASP CA C 13 51.651 0.000 . 1 . . . . 170 ASP CA . 17540 1
6 . 1 1 1 1 ASP CB C 13 37.525 0.000 . 1 . . . . 170 ASP CB . 17540 1
7 . 1 1 1 1 ASP N N 15 116.906 2.367 . 1 . . . . 170 ASP N . 17540 1
8 . 1 1 2 2 VAL H H 1 7.178 0.000 . 1 . . . . 171 VAL HN . 17540 1
9 . 1 1 2 2 VAL HA H 1 4.021 0.000 . 1 . . . . 171 VAL HA . 17540 1
10 . 1 1 2 2 VAL HB H 1 1.779 0.000 . 1 . . . . 171 VAL HB . 17540 1
11 . 1 1 2 2 VAL HG11 H 1 0.776 0.000 . 2 . . . . 171 VAL HG12 . 17540 1
12 . 1 1 2 2 VAL HG12 H 1 0.776 0.000 . 2 . . . . 171 VAL HG12 . 17540 1
13 . 1 1 2 2 VAL HG13 H 1 0.776 0.000 . 2 . . . . 171 VAL HG12 . 17540 1
14 . 1 1 2 2 VAL HG21 H 1 0.753 0.004 . 2 . . . . 171 VAL HG22 . 17540 1
15 . 1 1 2 2 VAL HG22 H 1 0.753 0.004 . 2 . . . . 171 VAL HG22 . 17540 1
16 . 1 1 2 2 VAL HG23 H 1 0.753 0.004 . 2 . . . . 171 VAL HG22 . 17540 1
17 . 1 1 3 3 PRO HA H 1 4.134 0.000 . 1 . . . . 172 PRO HA . 17540 1
18 . 1 1 3 3 PRO HB2 H 1 1.764 0.004 . 2 . . . . 172 PRO HB2 . 17540 1
19 . 1 1 3 3 PRO HB3 H 1 1.617 0.004 . 2 . . . . 172 PRO HB3 . 17540 1
20 . 1 1 3 3 PRO HG2 H 1 2.099 0.001 . 2 . . . . 172 PRO HG2 . 17540 1
21 . 1 1 3 3 PRO HD2 H 1 3.797 0.000 . 2 . . . . 172 PRO HD2 . 17540 1
22 . 1 1 3 3 PRO HD3 H 1 3.435 0.000 . 2 . . . . 172 PRO HD3 . 17540 1
23 . 1 1 3 3 PRO CA C 13 60.697 0.000 . 1 . . . . 172 PRO CA . 17540 1
24 . 1 1 3 3 PRO CB C 13 29.940 0.000 . 1 . . . . 172 PRO CB . 17540 1
25 . 1 1 4 4 LEU H H 1 8.385 0.000 . 1 . . . . 173 LEU HN . 17540 1
26 . 1 1 4 4 LEU HA H 1 4.008 0.000 . 1 . . . . 173 LEU HA . 17540 1
27 . 1 1 4 4 LEU HB2 H 1 1.620 0.000 . 2 . . . . 173 LEU HB2 . 17540 1
28 . 1 1 4 4 LEU HB3 H 1 1.555 0.000 . 2 . . . . 173 LEU HB3 . 17540 1
29 . 1 1 4 4 LEU HG H 1 1.285 0.000 . 1 . . . . 173 LEU HG . 17540 1
30 . 1 1 4 4 LEU HD11 H 1 0.907 0.001 . 2 . . . . 173 LEU HD12 . 17540 1
31 . 1 1 4 4 LEU HD12 H 1 0.907 0.001 . 2 . . . . 173 LEU HD12 . 17540 1
32 . 1 1 4 4 LEU HD13 H 1 0.907 0.001 . 2 . . . . 173 LEU HD12 . 17540 1
33 . 1 1 4 4 LEU HD21 H 1 0.667 0.001 . 2 . . . . 173 LEU HD22 . 17540 1
34 . 1 1 4 4 LEU HD22 H 1 0.667 0.001 . 2 . . . . 173 LEU HD22 . 17540 1
35 . 1 1 4 4 LEU HD23 H 1 0.667 0.001 . 2 . . . . 173 LEU HD22 . 17540 1
36 . 1 1 4 4 LEU CA C 13 50.677 0.000 . 1 . . . . 173 LEU CA . 17540 1
37 . 1 1 4 4 LEU CB C 13 38.569 0.000 . 1 . . . . 173 LEU CB . 17540 1
38 . 1 1 4 4 LEU N N 15 121.868 0.000 . 1 . . . . 173 LEU N . 17540 1
39 . 1 1 5 5 PRO HA H 1 4.270 0.000 . 1 . . . . 174 PRO HA . 17540 1
40 . 1 1 5 5 PRO HB2 H 1 1.365 0.000 . 2 . . . . 174 PRO HB2 . 17540 1
41 . 1 1 5 5 PRO HB3 H 1 1.292 0.000 . 2 . . . . 174 PRO HB3 . 17540 1
42 . 1 1 5 5 PRO HG2 H 1 1.772 0.000 . 2 . . . . 174 PRO HG2 . 17540 1
43 . 1 1 5 5 PRO HG3 H 1 1.620 0.000 . 2 . . . . 174 PRO HG3 . 17540 1
44 . 1 1 5 5 PRO HD2 H 1 3.147 0.000 . 2 . . . . 174 PRO HD2 . 17540 1
45 . 1 1 5 5 PRO HD3 H 1 2.694 0.001 . 2 . . . . 174 PRO HD3 . 17540 1
46 . 1 1 5 5 PRO CB C 13 44.125 15.428 . 1 . . . . 174 PRO CB . 17540 1
47 . 1 1 6 6 ALA H H 1 8.264 0.002 . 1 . . . . 175 ALA HN . 17540 1
48 . 1 1 6 6 ALA HA H 1 3.986 0.000 . 1 . . . . 175 ALA HA . 17540 1
49 . 1 1 6 6 ALA HB1 H 1 1.209 0.000 . 1 . . . . 175 ALA HB2 . 17540 1
50 . 1 1 6 6 ALA HB2 H 1 1.209 0.000 . 1 . . . . 175 ALA HB2 . 17540 1
51 . 1 1 6 6 ALA HB3 H 1 1.209 0.000 . 1 . . . . 175 ALA HB2 . 17540 1
52 . 1 1 6 6 ALA CA C 13 51.341 0.034 . 1 . . . . 175 ALA CA . 17540 1
53 . 1 1 6 6 ALA CB C 13 15.435 0.069 . 1 . . . . 175 ALA CB . 17540 1
54 . 1 1 6 6 ALA N N 15 123.489 0.000 . 1 . . . . 175 ALA N . 17540 1
55 . 1 1 7 7 GLY H H 1 8.639 0.002 . 1 . . . . 176 GLY HN . 17540 1
56 . 1 1 7 7 GLY HA2 H 1 3.389 0.000 . 2 . . . . 176 GLY HA2 . 17540 1
57 . 1 1 7 7 GLY HA3 H 1 4.020 0.000 . 2 . . . . 176 GLY HA3 . 17540 1
58 . 1 1 7 7 GLY CA C 13 42.648 0.206 . 1 . . . . 176 GLY CA . 17540 1
59 . 1 1 7 7 GLY N N 15 110.098 0.000 . 1 . . . . 176 GLY N . 17540 1
60 . 1 1 8 8 TRP H H 1 7.566 0.003 . 1 . . . . 177 TRP HN . 17540 1
61 . 1 1 8 8 TRP HA H 1 5.507 0.000 . 1 . . . . 177 TRP HA . 17540 1
62 . 1 1 8 8 TRP HB2 H 1 3.089 0.001 . 2 . . . . 177 TRP HB2 . 17540 1
63 . 1 1 8 8 TRP HB3 H 1 2.862 0.001 . 2 . . . . 177 TRP HB3 . 17540 1
64 . 1 1 8 8 TRP HD1 H 1 6.869 0.000 . 1 . . . . 177 TRP HD1 . 17540 1
65 . 1 1 8 8 TRP HE1 H 1 10.225 0.000 . 1 . . . . 177 TRP HE1 . 17540 1
66 . 1 1 8 8 TRP HE3 H 1 6.651 0.003 . 1 . . . . 177 TRP HE3 . 17540 1
67 . 1 1 8 8 TRP HZ2 H 1 7.257 0.000 . 1 . . . . 177 TRP HZ2 . 17540 1
68 . 1 1 8 8 TRP HZ3 H 1 6.965 0.003 . 1 . . . . 177 TRP HZ3 . 17540 1
69 . 1 1 8 8 TRP HH2 H 1 7.202 0.003 . 1 . . . . 177 TRP HH2 . 17540 1
70 . 1 1 8 8 TRP CA C 13 53.649 0.143 . 1 . . . . 177 TRP CA . 17540 1
71 . 1 1 8 8 TRP CB C 13 29.715 0.000 . 1 . . . . 177 TRP CB . 17540 1
72 . 1 1 8 8 TRP N N 15 117.088 0.000 . 1 . . . . 177 TRP N . 17540 1
73 . 1 1 9 9 GLU H H 1 9.269 0.000 . 1 . . . . 178 GLU HN . 17540 1
74 . 1 1 9 9 GLU HA H 1 4.527 0.000 . 1 . . . . 178 GLU HA . 17540 1
75 . 1 1 9 9 GLU HB2 H 1 1.958 0.000 . 2 . . . . 178 GLU HB2 . 17540 1
76 . 1 1 9 9 GLU HB3 H 1 1.855 0.000 . 2 . . . . 178 GLU HB3 . 17540 1
77 . 1 1 9 9 GLU HG2 H 1 2.178 0.000 . 2 . . . . 178 GLU HG2 . 17540 1
78 . 1 1 9 9 GLU HG3 H 1 2.028 0.000 . 2 . . . . 178 GLU HG3 . 17540 1
79 . 1 1 9 9 GLU CA C 13 52.752 0.000 . 1 . . . . 178 GLU CA . 17540 1
80 . 1 1 9 9 GLU CB C 13 32.709 0.000 . 1 . . . . 178 GLU CB . 17540 1
81 . 1 1 9 9 GLU N N 15 121.774 0.000 . 1 . . . . 178 GLU N . 17540 1
82 . 1 1 10 10 MET H H 1 8.886 0.000 . 1 . . . . 179 MET HN . 17540 1
83 . 1 1 10 10 MET HA H 1 4.228 0.000 . 1 . . . . 179 MET HA . 17540 1
84 . 1 1 10 10 MET HB2 H 1 1.788 0.085 . 2 . . . . 179 MET HB2 . 17540 1
85 . 1 1 10 10 MET HB3 H 1 1.629 0.059 . 2 . . . . 179 MET HB3 . 17540 1
86 . 1 1 10 10 MET HG2 H 1 2.192 0.000 . 2 . . . . 179 MET HG2 . 17540 1
87 . 1 1 10 10 MET CA C 13 52.513 0.108 . 1 . . . . 179 MET CA . 17540 1
88 . 1 1 10 10 MET CB C 13 33.063 0.036 . 1 . . . . 179 MET CB . 17540 1
89 . 1 1 10 10 MET N N 15 125.905 0.000 . 1 . . . . 179 MET N . 17540 1
90 . 1 1 11 11 ALA H H 1 8.269 0.001 . 1 . . . . 180 ALA HN . 17540 1
91 . 1 1 11 11 ALA HA H 1 4.150 0.000 . 1 . . . . 180 ALA HA . 17540 1
92 . 1 1 11 11 ALA HB1 H 1 0.336 0.000 . 1 . . . . 180 ALA HB2 . 17540 1
93 . 1 1 11 11 ALA HB2 H 1 0.336 0.000 . 1 . . . . 180 ALA HB2 . 17540 1
94 . 1 1 11 11 ALA HB3 H 1 0.336 0.000 . 1 . . . . 180 ALA HB2 . 17540 1
95 . 1 1 11 11 ALA CA C 13 48.066 0.065 . 1 . . . . 180 ALA CA . 17540 1
96 . 1 1 11 11 ALA CB C 13 19.591 0.102 . 1 . . . . 180 ALA CB . 17540 1
97 . 1 1 11 11 ALA N N 15 130.249 0.000 . 1 . . . . 180 ALA N . 17540 1
98 . 1 1 12 12 LYS H H 1 7.941 0.000 . 1 . . . . 181 LYS HN . 17540 1
99 . 1 1 12 12 LYS HA H 1 5.245 0.007 . 1 . . . . 181 LYS HA . 17540 1
100 . 1 1 12 12 LYS HB2 H 1 1.344 0.006 . 2 . . . . 181 LYS HB2 . 17540 1
101 . 1 1 12 12 LYS HB3 H 1 1.367 0.000 . 2 . . . . 181 LYS HB3 . 17540 1
102 . 1 1 12 12 LYS HG2 H 1 1.424 0.009 . 2 . . . . 181 LYS HG2 . 17540 1
103 . 1 1 12 12 LYS HG3 H 1 0.961 0.000 . 2 . . . . 181 LYS HG3 . 17540 1
104 . 1 1 12 12 LYS HD2 H 1 1.089 0.000 . 2 . . . . 181 LYS HD2 . 17540 1
105 . 1 1 12 12 LYS HD3 H 1 0.963 0.003 . 2 . . . . 181 LYS HD3 . 17540 1
106 . 1 1 12 12 LYS HE2 H 1 2.641 0.000 . 2 . . . . 181 LYS HE2 . 17540 1
107 . 1 1 12 12 LYS CA C 13 51.873 0.163 . 1 . . . . 181 LYS CA . 17540 1
108 . 1 1 12 12 LYS CB C 13 34.238 0.032 . 1 . . . . 181 LYS CB . 17540 1
109 . 1 1 12 12 LYS N N 15 115.539 0.000 . 1 . . . . 181 LYS N . 17540 1
110 . 1 1 13 13 THR H H 1 9.140 0.000 . 1 . . . . 182 THR HN . 17540 1
111 . 1 1 13 13 THR HA H 1 4.232 0.000 . 1 . . . . 182 THR HA . 17540 1
112 . 1 1 13 13 THR HG1 H 1 4.762 0.000 . 1 . . . . 182 THR HG1 . 17540 1
113 . 1 1 13 13 THR HG21 H 1 1.345 0.000 . 1 . . . . 182 THR HG22 . 17540 1
114 . 1 1 13 13 THR HG22 H 1 1.345 0.000 . 1 . . . . 182 THR HG22 . 17540 1
115 . 1 1 13 13 THR HG23 H 1 1.345 0.000 . 1 . . . . 182 THR HG22 . 17540 1
116 . 1 1 13 13 THR CA C 13 58.608 0.000 . 1 . . . . 182 THR CA . 17540 1
117 . 1 1 13 13 THR CB C 13 69.085 0.000 . 1 . . . . 182 THR CB . 17540 1
118 . 1 1 13 13 THR N N 15 113.631 0.000 . 1 . . . . 182 THR N . 17540 1
119 . 1 1 14 14 SER H H 1 8.473 0.000 . 1 . . . . 183 SER HN . 17540 1
120 . 1 1 14 14 SER HA H 1 4.065 0.000 . 1 . . . . 183 SER HA . 17540 1
121 . 1 1 14 14 SER HB2 H 1 3.864 0.000 . 2 . . . . 183 SER HB2 . 17540 1
122 . 1 1 14 14 SER HB3 H 1 3.803 0.000 . 2 . . . . 183 SER HB3 . 17540 1
123 . 1 1 14 14 SER CA C 13 55.875 0.000 . 1 . . . . 183 SER CA . 17540 1
124 . 1 1 14 14 SER CB C 13 61.537 0.000 . 1 . . . . 183 SER CB . 17540 1
125 . 1 1 15 15 SER H H 1 8.219 0.000 . 1 . . . . 184 SER HN . 17540 1
126 . 1 1 15 15 SER HA H 1 4.405 0.000 . 1 . . . . 184 SER HA . 17540 1
127 . 1 1 15 15 SER HB2 H 1 3.896 0.001 . 2 . . . . 184 SER HB2 . 17540 1
128 . 1 1 15 15 SER HB3 H 1 3.654 0.002 . 2 . . . . 184 SER HB3 . 17540 1
129 . 1 1 15 15 SER CA C 13 55.972 0.097 . 1 . . . . 184 SER CA . 17540 1
130 . 1 1 15 15 SER CB C 13 61.114 0.032 . 1 . . . . 184 SER CB . 17540 1
131 . 1 1 15 15 SER N N 15 117.908 0.000 . 1 . . . . 184 SER N . 17540 1
132 . 1 1 16 16 GLY H H 1 7.972 0.000 . 1 . . . . 185 GLY HN . 17540 1
133 . 1 1 16 16 GLY HA2 H 1 3.382 0.000 . 2 . . . . 185 GLY HA2 . 17540 1
134 . 1 1 16 16 GLY HA3 H 1 4.104 0.008 . 2 . . . . 185 GLY HA3 . 17540 1
135 . 1 1 16 16 GLY CA C 13 42.827 0.097 . 1 . . . . 185 GLY CA . 17540 1
136 . 1 1 16 16 GLY N N 15 110.557 0.000 . 1 . . . . 185 GLY N . 17540 1
137 . 1 1 17 17 GLN H H 1 7.394 0.000 . 1 . . . . 186 GLN HN . 17540 1
138 . 1 1 17 17 GLN HA H 1 4.221 0.000 . 1 . . . . 186 GLN HA . 17540 1
139 . 1 1 17 17 GLN HB2 H 1 2.093 0.001 . 2 . . . . 186 GLN HB2 . 17540 1
140 . 1 1 17 17 GLN HB3 H 1 2.049 0.000 . 2 . . . . 186 GLN HB3 . 17540 1
141 . 1 1 17 17 GLN HG2 H 1 2.191 0.000 . 2 . . . . 186 GLN HG2 . 17540 1
142 . 1 1 17 17 GLN HG3 H 1 2.123 0.000 . 2 . . . . 186 GLN HG3 . 17540 1
143 . 1 1 17 17 GLN HE21 H 1 7.299 0.000 . 2 . . . . 186 GLN HE21 . 17540 1
144 . 1 1 17 17 GLN HE22 H 1 6.446 0.000 . 2 . . . . 186 GLN HE22 . 17540 1
145 . 1 1 17 17 GLN CA C 13 53.435 0.163 . 1 . . . . 186 GLN CA . 17540 1
146 . 1 1 17 17 GLN CB C 13 26.429 0.163 . 1 . . . . 186 GLN CB . 17540 1
147 . 1 1 17 17 GLN N N 15 120.665 0.000 . 1 . . . . 186 GLN N . 17540 1
148 . 1 1 18 18 ARG H H 1 8.807 0.000 . 1 . . . . 187 ARG HN . 17540 1
149 . 1 1 18 18 ARG HA H 1 4.239 0.002 . 1 . . . . 187 ARG HA . 17540 1
150 . 1 1 18 18 ARG HB2 H 1 1.613 0.004 . 2 . . . . 187 ARG HB2 . 17540 1
151 . 1 1 18 18 ARG HB3 H 1 1.536 0.062 . 2 . . . . 187 ARG HB3 . 17540 1
152 . 1 1 18 18 ARG HG2 H 1 1.463 0.009 . 2 . . . . 187 ARG HG2 . 17540 1
153 . 1 1 18 18 ARG HG3 H 1 1.224 0.000 . 2 . . . . 187 ARG HG3 . 17540 1
154 . 1 1 18 18 ARG CA C 13 53.858 0.000 . 1 . . . . 187 ARG CA . 17540 1
155 . 1 1 18 18 ARG CB C 13 28.804 0.000 . 1 . . . . 187 ARG CB . 17540 1
156 . 1 1 18 18 ARG N N 15 126.673 0.000 . 1 . . . . 187 ARG N . 17540 1
157 . 1 1 19 19 TYR H H 1 8.616 0.004 . 1 . . . . 188 TYR HN . 17540 1
158 . 1 1 19 19 TYR HA H 1 4.467 0.000 . 1 . . . . 188 TYR HA . 17540 1
159 . 1 1 19 19 TYR HB2 H 1 2.424 0.005 . 2 . . . . 188 TYR HB2 . 17540 1
160 . 1 1 19 19 TYR HB3 H 1 2.152 0.003 . 2 . . . . 188 TYR HB3 . 17540 1
161 . 1 1 19 19 TYR HD2 H 1 6.513 0.000 . 3 . . . . 188 TYR HD2 . 17540 1
162 . 1 1 19 19 TYR HE2 H 1 6.102 0.003 . 3 . . . . 188 TYR HE2 . 17540 1
163 . 1 1 19 19 TYR CA C 13 53.305 0.097 . 1 . . . . 188 TYR CA . 17540 1
164 . 1 1 19 19 TYR CB C 13 37.297 0.097 . 1 . . . . 188 TYR CB . 17540 1
165 . 1 1 19 19 TYR N N 15 120.212 0.000 . 1 . . . . 188 TYR N . 17540 1
166 . 1 1 20 20 PHE H H 1 8.851 0.001 . 1 . . . . 189 PHE HN . 17540 1
167 . 1 1 20 20 PHE HA H 1 5.102 0.000 . 1 . . . . 189 PHE HA . 17540 1
168 . 1 1 20 20 PHE HB2 H 1 2.975 0.000 . 2 . . . . 189 PHE HB2 . 17540 1
169 . 1 1 20 20 PHE HB3 H 1 2.849 0.002 . 2 . . . . 189 PHE HB3 . 17540 1
170 . 1 1 20 20 PHE HD2 H 1 6.799 0.000 . 3 . . . . 189 PHE HD2 . 17540 1
171 . 1 1 20 20 PHE HE2 H 1 7.005 0.001 . 3 . . . . 189 PHE HE2 . 17540 1
172 . 1 1 20 20 PHE HZ H 1 7.203 0.002 . 1 . . . . 189 PHE HZ . 17540 1
173 . 1 1 20 20 PHE CA C 13 54.899 0.065 . 1 . . . . 189 PHE CA . 17540 1
174 . 1 1 20 20 PHE CB C 13 39.216 0.000 . 1 . . . . 189 PHE CB . 17540 1
175 . 1 1 20 20 PHE N N 15 115.961 0.000 . 1 . . . . 189 PHE N . 17540 1
176 . 1 1 21 21 LEU H H 1 9.285 0.002 . 1 . . . . 190 LEU HN . 17540 1
177 . 1 1 21 21 LEU HA H 1 4.531 0.000 . 1 . . . . 190 LEU HA . 17540 1
178 . 1 1 21 21 LEU HB2 H 1 1.082 0.000 . 2 . . . . 190 LEU HB2 . 17540 1
179 . 1 1 21 21 LEU HB3 H 1 1.055 0.000 . 2 . . . . 190 LEU HB3 . 17540 1
180 . 1 1 21 21 LEU HG H 1 0.885 0.000 . 1 . . . . 190 LEU HG . 17540 1
181 . 1 1 21 21 LEU HD11 H 1 0.495 0.000 . 2 . . . . 190 LEU HD12 . 17540 1
182 . 1 1 21 21 LEU HD12 H 1 0.495 0.000 . 2 . . . . 190 LEU HD12 . 17540 1
183 . 1 1 21 21 LEU HD13 H 1 0.495 0.000 . 2 . . . . 190 LEU HD12 . 17540 1
184 . 1 1 21 21 LEU HD21 H 1 0.391 0.000 . 2 . . . . 190 LEU HD22 . 17540 1
185 . 1 1 21 21 LEU HD22 H 1 0.391 0.000 . 2 . . . . 190 LEU HD22 . 17540 1
186 . 1 1 21 21 LEU HD23 H 1 0.391 0.000 . 2 . . . . 190 LEU HD22 . 17540 1
187 . 1 1 21 21 LEU CA C 13 58.153 0.000 . 1 . . . . 190 LEU CA . 17540 1
188 . 1 1 21 21 LEU CB C 13 39.802 0.000 . 1 . . . . 190 LEU CB . 17540 1
189 . 1 1 21 21 LEU N N 15 123.131 0.000 . 1 . . . . 190 LEU N . 17540 1
190 . 1 1 22 22 ASN H H 1 8.273 0.000 . 1 . . . . 191 ASN HN . 17540 1
191 . 1 1 22 22 ASN HA H 1 3.691 0.000 . 1 . . . . 191 ASN HA . 17540 1
192 . 1 1 22 22 ASN HB2 H 1 2.361 0.000 . 2 . . . . 191 ASN HB2 . 17540 1
193 . 1 1 22 22 ASN HB3 H 1 0.019 0.000 . 2 . . . . 191 ASN HB3 . 17540 1
194 . 1 1 22 22 ASN HD21 H 1 6.436 0.000 . 2 . . . . 191 ASN HD21 . 17540 1
195 . 1 1 22 22 ASN HD22 H 1 5.636 0.000 . 2 . . . . 191 ASN HD22 . 17540 1
196 . 1 1 22 22 ASN N N 15 124.516 0.000 . 1 . . . . 191 ASN N . 17540 1
197 . 1 1 23 23 HIS H H 1 8.502 0.000 . 1 . . . . 192 HIS HN . 17540 1
198 . 1 1 23 23 HIS HA H 1 4.076 0.000 . 1 . . . . 192 HIS HA . 17540 1
199 . 1 1 23 23 HIS HB2 H 1 2.859 0.000 . 2 . . . . 192 HIS HB2 . 17540 1
200 . 1 1 23 23 HIS HD1 H 1 6.592 0.000 . 1 . . . . 192 HIS HD1 . 17540 1
201 . 1 1 23 23 HIS HE1 H 1 7.525 0.000 . 1 . . . . 192 HIS HE1 . 17540 1
202 . 1 1 24 24 ILE H H 1 8.024 0.000 . 1 . . . . 193 ILE HN . 17540 1
203 . 1 1 24 24 ILE HA H 1 3.611 0.000 . 1 . . . . 193 ILE HA . 17540 1
204 . 1 1 24 24 ILE HB H 1 1.780 0.000 . 1 . . . . 193 ILE HB . 17540 1
205 . 1 1 24 24 ILE HG21 H 1 1.303 0.000 . 1 . . . . 193 ILE HG21 . 17540 1
206 . 1 1 24 24 ILE HG22 H 1 0.969 0.000 . 1 . . . . 193 ILE HG22 . 17540 1
207 . 1 1 24 24 ILE HG23 H 1 0.627 0.000 . 1 . . . . 193 ILE HG22 . 17540 1
208 . 1 1 24 24 ILE HD11 H 1 0.965 0.000 . 1 . . . . 193 ILE HD12 . 17540 1
209 . 1 1 24 24 ILE HD12 H 1 0.965 0.000 . 1 . . . . 193 ILE HD12 . 17540 1
210 . 1 1 24 24 ILE HD13 H 1 0.965 0.000 . 1 . . . . 193 ILE HD12 . 17540 1
211 . 1 1 24 24 ILE CA C 13 60.821 0.000 . 1 . . . . 193 ILE CA . 17540 1
212 . 1 1 24 24 ILE CB C 13 34.205 0.000 . 1 . . . . 193 ILE CB . 17540 1
213 . 1 1 25 25 ASP H H 1 6.873 0.000 . 1 . . . . 194 ASP HN . 17540 1
214 . 1 1 25 25 ASP HA H 1 4.352 0.000 . 1 . . . . 194 ASP HA . 17540 1
215 . 1 1 25 25 ASP HB2 H 1 2.345 0.005 . 2 . . . . 194 ASP HB2 . 17540 1
216 . 1 1 25 25 ASP HB3 H 1 2.188 0.004 . 2 . . . . 194 ASP HB3 . 17540 1
217 . 1 1 25 25 ASP CA C 13 50.507 0.162 . 1 . . . . 194 ASP CA . 17540 1
218 . 1 1 25 25 ASP CB C 13 38.760 0.066 . 1 . . . . 194 ASP CB . 17540 1
219 . 1 1 25 25 ASP N N 15 116.653 0.000 . 1 . . . . 194 ASP N . 17540 1
220 . 1 1 26 26 GLN H H 1 7.575 0.000 . 1 . . . . 195 GLN HN . 17540 1
221 . 1 1 26 26 GLN HA H 1 3.620 0.001 . 1 . . . . 195 GLN HA . 17540 1
222 . 1 1 26 26 GLN HB2 H 1 1.985 0.004 . 2 . . . . 195 GLN HB2 . 17540 1
223 . 1 1 26 26 GLN HG2 H 1 2.078 0.000 . 2 . . . . 195 GLN HG2 . 17540 1
224 . 1 1 26 26 GLN HE21 H 1 7.380 0.000 . 2 . . . . 195 GLN HE21 . 17540 1
225 . 1 1 26 26 GLN HE22 H 1 6.671 0.000 . 2 . . . . 195 GLN HE22 . 17540 1
226 . 1 1 26 26 GLN CA C 13 53.955 0.163 . 1 . . . . 195 GLN CA . 17540 1
227 . 1 1 26 26 GLN CB C 13 21.841 0.260 . 1 . . . . 195 GLN CB . 17540 1
228 . 1 1 26 26 GLN N N 15 115.219 0.000 . 1 . . . . 195 GLN N . 17540 1
229 . 1 1 27 27 THR H H 1 7.632 0.003 . 1 . . . . 196 THR HN . 17540 1
230 . 1 1 27 27 THR HA H 1 4.413 0.003 . 1 . . . . 196 THR HA . 17540 1
231 . 1 1 27 27 THR HB H 1 3.930 0.001 . 1 . . . . 196 THR HB . 17540 1
232 . 1 1 27 27 THR HG21 H 1 0.865 0.003 . 1 . . . . 196 THR HG22 . 17540 1
233 . 1 1 27 27 THR HG22 H 1 0.865 0.003 . 1 . . . . 196 THR HG22 . 17540 1
234 . 1 1 27 27 THR HG23 H 1 0.865 0.003 . 1 . . . . 196 THR HG22 . 17540 1
235 . 1 1 27 27 THR CA C 13 56.981 0.000 . 1 . . . . 196 THR CA . 17540 1
236 . 1 1 27 27 THR CB C 13 70.290 0.032 . 1 . . . . 196 THR CB . 17540 1
237 . 1 1 27 27 THR N N 15 108.818 0.000 . 1 . . . . 196 THR N . 17540 1
238 . 1 1 28 28 THR H H 1 8.056 0.000 . 1 . . . . 197 THR HN . 17540 1
239 . 1 1 28 28 THR HA H 1 5.298 0.000 . 1 . . . . 197 THR HA . 17540 1
240 . 1 1 28 28 THR HB H 1 3.747 0.000 . 1 . . . . 197 THR HB . 17540 1
241 . 1 1 28 28 THR HG21 H 1 0.897 0.000 . 1 . . . . 197 THR HG22 . 17540 1
242 . 1 1 28 28 THR HG22 H 1 0.897 0.000 . 1 . . . . 197 THR HG22 . 17540 1
243 . 1 1 28 28 THR HG23 H 1 0.897 0.000 . 1 . . . . 197 THR HG22 . 17540 1
244 . 1 1 28 28 THR CA C 13 56.851 0.000 . 1 . . . . 197 THR CA . 17540 1
245 . 1 1 28 28 THR CB C 13 70.029 0.163 . 1 . . . . 197 THR CB . 17540 1
246 . 1 1 28 28 THR N N 15 108.934 0.000 . 1 . . . . 197 THR N . 17540 1
247 . 1 1 29 29 THR H H 1 9.007 0.000 . 1 . . . . 198 THR HN . 17540 1
248 . 1 1 29 29 THR HA H 1 4.633 0.000 . 1 . . . . 198 THR HA . 17540 1
249 . 1 1 29 29 THR HB H 1 4.528 0.000 . 1 . . . . 198 THR HB . 17540 1
250 . 1 1 29 29 THR HG21 H 1 1.361 0.000 . 1 . . . . 198 THR HG22 . 17540 1
251 . 1 1 29 29 THR HG22 H 1 1.361 0.000 . 1 . . . . 198 THR HG22 . 17540 1
252 . 1 1 29 29 THR HG23 H 1 1.361 0.000 . 1 . . . . 198 THR HG22 . 17540 1
253 . 1 1 29 29 THR CA C 13 56.981 0.130 . 1 . . . . 198 THR CA . 17540 1
254 . 1 1 29 29 THR CB C 13 66.514 0.032 . 1 . . . . 198 THR CB . 17540 1
255 . 1 1 29 29 THR N N 15 113.003 0.000 . 1 . . . . 198 THR N . 17540 1
256 . 1 1 30 30 TRP H H 1 8.685 0.000 . 1 . . . . 199 TRP HN . 17540 1
257 . 1 1 30 30 TRP HA H 1 4.886 0.000 . 1 . . . . 199 TRP HA . 17540 1
258 . 1 1 30 30 TRP HB2 H 1 3.476 0.000 . 2 . . . . 199 TRP HB2 . 17540 1
259 . 1 1 30 30 TRP HB3 H 1 2.987 0.000 . 2 . . . . 199 TRP HB3 . 17540 1
260 . 1 1 30 30 TRP HD1 H 1 7.185 0.008 . 1 . . . . 199 TRP HD1 . 17540 1
261 . 1 1 30 30 TRP HE1 H 1 10.046 0.000 . 1 . . . . 199 TRP HE1 . 17540 1
262 . 1 1 30 30 TRP HE3 H 1 7.953 0.000 . 1 . . . . 199 TRP HE3 . 17540 1
263 . 1 1 30 30 TRP HZ2 H 1 7.146 0.000 . 1 . . . . 199 TRP HZ2 . 17540 1
264 . 1 1 30 30 TRP HZ3 H 1 6.664 0.000 . 1 . . . . 199 TRP HZ3 . 17540 1
265 . 1 1 30 30 TRP HH2 H 1 6.796 0.000 . 1 . . . . 199 TRP HH2 . 17540 1
266 . 1 1 30 30 TRP CA C 13 55.485 0.000 . 1 . . . . 199 TRP CA . 17540 1
267 . 1 1 30 30 TRP CB C 13 28.902 0.033 . 1 . . . . 199 TRP CB . 17540 1
268 . 1 1 30 30 TRP N N 15 125.589 0.000 . 1 . . . . 199 TRP N . 17540 1
269 . 1 1 31 31 GLN H H 1 8.453 0.000 . 1 . . . . 200 GLN HN . 17540 1
270 . 1 1 31 31 GLN HA H 1 4.017 0.000 . 1 . . . . 200 GLN HA . 17540 1
271 . 1 1 31 31 GLN HB2 H 1 1.893 0.000 . 2 . . . . 200 GLN HB2 . 17540 1
272 . 1 1 31 31 GLN HB3 H 1 1.813 0.000 . 2 . . . . 200 GLN HB3 . 17540 1
273 . 1 1 31 31 GLN HG2 H 1 2.064 0.000 . 2 . . . . 200 GLN HG2 . 17540 1
274 . 1 1 31 31 GLN HG3 H 1 1.954 0.000 . 2 . . . . 200 GLN HG3 . 17540 1
275 . 1 1 31 31 GLN HE21 H 1 7.004 0.000 . 2 . . . . 200 GLN HE21 . 17540 1
276 . 1 1 31 31 GLN HE22 H 1 6.802 0.000 . 2 . . . . 200 GLN HE22 . 17540 1
277 . 1 1 31 31 GLN CB C 13 40.452 13.406 . 1 . . . . 200 GLN CB . 17540 1
278 . 1 1 31 31 GLN N N 15 119.992 0.000 . 1 . . . . 200 GLN N . 17540 1
279 . 1 1 32 32 ASP H H 1 8.417 0.000 . 1 . . . . 201 ASP HN . 17540 1
280 . 1 1 32 32 ASP HA H 1 2.364 0.000 . 1 . . . . 201 ASP HA . 17540 1
281 . 1 1 32 32 ASP HB2 H 1 2.061 0.000 . 2 . . . . 201 ASP HB2 . 17540 1
282 . 1 1 32 32 ASP HB3 H 1 1.963 0.000 . 2 . . . . 201 ASP HB3 . 17540 1
283 . 1 1 32 32 ASP CA C 13 51.320 0.000 . 1 . . . . 201 ASP CA . 17540 1
284 . 1 1 32 32 ASP CB C 13 35.897 0.000 . 1 . . . . 201 ASP CB . 17540 1
285 . 1 1 32 32 ASP N N 15 119.992 0.000 . 1 . . . . 201 ASP N . 17540 1
286 . 1 1 33 33 PRO HA H 1 3.786 0.003 . 1 . . . . 202 PRO HA . 17540 1
287 . 1 1 33 33 PRO HB2 H 1 0.335 0.007 . 2 . . . . 202 PRO HB2 . 17540 1
288 . 1 1 33 33 PRO HB3 H 1 0.124 0.000 . 2 . . . . 202 PRO HB3 . 17540 1
289 . 1 1 33 33 PRO HG2 H 1 0.647 0.000 . 2 . . . . 202 PRO HG2 . 17540 1
290 . 1 1 33 33 PRO HG3 H 1 0.583 0.001 . 2 . . . . 202 PRO HG3 . 17540 1
291 . 1 1 33 33 PRO HD2 H 1 2.372 0.000 . 2 . . . . 202 PRO HD2 . 17540 1
292 . 1 1 33 33 PRO HD3 H 1 2.249 0.000 . 2 . . . . 202 PRO HD3 . 17540 1
293 . 1 1 33 33 PRO CA C 13 59.975 0.000 . 1 . . . . 202 PRO CA . 17540 1
294 . 1 1 33 33 PRO CB C 13 30.106 0.000 . 1 . . . . 202 PRO CB . 17540 1
295 . 1 1 34 34 ARG H H 1 8.351 0.000 . 1 . . . . 203 ARG HN . 17540 1
296 . 1 1 34 34 ARG HA H 1 3.718 0.000 . 1 . . . . 203 ARG HA . 17540 1
297 . 1 1 34 34 ARG HB2 H 1 1.614 0.002 . 2 . . . . 203 ARG HB2 . 17540 1
298 . 1 1 34 34 ARG HB3 H 1 1.553 0.000 . 2 . . . . 203 ARG HB3 . 17540 1
299 . 1 1 34 34 ARG HG2 H 1 1.473 0.000 . 2 . . . . 203 ARG HG2 . 17540 1
300 . 1 1 34 34 ARG HG3 H 1 0.971 0.000 . 2 . . . . 203 ARG HG3 . 17540 1
301 . 1 1 34 34 ARG HD2 H 1 2.764 0.004 . 2 . . . . 203 ARG HD2 . 17540 1
302 . 1 1 34 34 ARG HD3 H 1 2.478 0.005 . 2 . . . . 203 ARG HD3 . 17540 1
303 . 1 1 34 34 ARG HE H 1 8.739 0.000 . 1 . . . . 203 ARG HE . 17540 1
304 . 1 1 34 34 ARG CA C 13 53.337 0.000 . 1 . . . . 203 ARG CA . 17540 1
305 . 1 1 34 34 ARG CB C 13 26.592 0.000 . 1 . . . . 203 ARG CB . 17540 1
306 . 1 1 34 34 ARG N N 15 124.821 0.000 . 1 . . . . 203 ARG N . 17540 1
307 . 1 1 35 35 LYS H H 1 6.954 0.000 . 1 . . . . 204 LYS HN . 17540 1
308 . 1 1 35 35 LYS HA H 1 3.735 0.000 . 1 . . . . 204 LYS HA . 17540 1
309 . 1 1 35 35 LYS HB2 H 1 1.535 0.000 . 2 . . . . 204 LYS HB2 . 17540 1
310 . 1 1 35 35 LYS HG2 H 1 1.370 0.000 . 2 . . . . 204 LYS HG2 . 17540 1
311 . 1 1 35 35 LYS HD2 H 1 1.065 0.000 . 2 . . . . 204 LYS HD2 . 17540 1
312 . 1 1 35 35 LYS CA C 13 55.420 0.000 . 1 . . . . 204 LYS CA . 17540 1
313 . 1 1 35 35 LYS CB C 13 29.780 0.000 . 1 . . . . 204 LYS CB . 17540 1
314 . 1 1 36 36 ALA H H 1 7.594 0.000 . 1 . . . . 205 ALA HN . 17540 1
315 . 1 1 36 36 ALA HA H 1 3.762 0.000 . 1 . . . . 205 ALA HA . 17540 1
316 . 1 1 36 36 ALA HB1 H 1 0.487 0.000 . 1 . . . . 205 ALA HB2 . 17540 1
317 . 1 1 36 36 ALA HB2 H 1 0.487 0.000 . 1 . . . . 205 ALA HB2 . 17540 1
318 . 1 1 36 36 ALA HB3 H 1 0.487 0.000 . 1 . . . . 205 ALA HB2 . 17540 1
319 . 1 1 36 36 ALA CA C 13 50.799 0.130 . 1 . . . . 205 ALA CA . 17540 1
320 . 1 1 36 36 ALA CB C 13 16.180 0.000 . 1 . . . . 205 ALA CB . 17540 1
321 . 1 1 36 36 ALA N N 15 122.425 0.000 . 1 . . . . 205 ALA N . 17540 1
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