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 18500
_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 0.02
_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
3 '2D 1H-1H NOESY' . . . 18500 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 GLY HA2 H 1 3.854 0.02 . 2 . . . A 280 GLY HA2 . 18500 1
2 . 1 1 1 1 GLY HA3 H 1 3.782 0.02 . 2 . . . A 280 GLY HA3 . 18500 1
3 . 1 1 1 1 GLY H H 1 8.122 0.02 . 1 . . . A 280 GLY H1 . 18500 1
4 . 1 1 2 2 PRO HA H 1 3.960 0.02 . 1 . . . A 281 PRO HA . 18500 1
5 . 1 1 3 3 LEU H H 1 7.607 0.02 . 1 . . . A 282 LEU H . 18500 1
6 . 1 1 3 3 LEU HA H 1 4.301 0.02 . 1 . . . A 282 LEU HA . 18500 1
7 . 1 1 3 3 LEU HB2 H 1 1.179 0.02 . 2 . . . A 282 LEU HB2 . 18500 1
8 . 1 1 3 3 LEU HB3 H 1 0.824 0.02 . 2 . . . A 282 LEU HB3 . 18500 1
9 . 1 1 3 3 LEU HG H 1 0.858 0.02 . 1 . . . A 282 LEU HG . 18500 1
10 . 1 1 3 3 LEU HD11 H 1 0.591 0.02 . 2 . . . A 282 LEU HD11 . 18500 1
11 . 1 1 3 3 LEU HD12 H 1 0.591 0.02 . 2 . . . A 282 LEU HD12 . 18500 1
12 . 1 1 3 3 LEU HD13 H 1 0.591 0.02 . 2 . . . A 282 LEU HD13 . 18500 1
13 . 1 1 3 3 LEU HD21 H 1 0.557 0.02 . 2 . . . A 282 LEU HD21 . 18500 1
14 . 1 1 3 3 LEU HD22 H 1 0.557 0.02 . 2 . . . A 282 LEU HD22 . 18500 1
15 . 1 1 3 3 LEU HD23 H 1 0.557 0.02 . 2 . . . A 282 LEU HD23 . 18500 1
16 . 1 1 4 4 PRO HA H 1 4.499 0.02 . 1 . . . A 283 PRO HA . 18500 1
17 . 1 1 4 4 PRO HB2 H 1 2.192 0.02 . 2 . . . A 283 PRO HB2 . 18500 1
18 . 1 1 4 4 PRO HB3 H 1 1.681 0.02 . 2 . . . A 283 PRO HB3 . 18500 1
19 . 1 1 4 4 PRO HG2 H 1 1.456 0.02 . 2 . . . A 283 PRO HG2 . 18500 1
20 . 1 1 4 4 PRO HG3 H 1 1.060 0.02 . 2 . . . A 283 PRO HG3 . 18500 1
21 . 1 1 4 4 PRO HD2 H 1 3.668 0.02 . 2 . . . A 283 PRO HD2 . 18500 1
22 . 1 1 4 4 PRO HD3 H 1 3.467 0.02 . 2 . . . A 283 PRO HD3 . 18500 1
23 . 1 1 5 5 PRO HA H 1 4.249 0.02 . 1 . . . A 284 PRO HA . 18500 1
24 . 1 1 5 5 PRO HB2 H 1 2.190 0.02 . 2 . . . A 284 PRO HB2 . 18500 1
25 . 1 1 5 5 PRO HB3 H 1 1.876 0.02 . 2 . . . A 284 PRO HB3 . 18500 1
26 . 1 1 5 5 PRO HG2 H 1 1.247 0.02 . 2 . . . A 284 PRO HG2 . 18500 1
27 . 1 1 5 5 PRO HG3 H 1 1.853 0.02 . 2 . . . A 284 PRO HG3 . 18500 1
28 . 1 1 5 5 PRO HD2 H 1 3.456 0.02 . 2 . . . A 284 PRO HD2 . 18500 1
29 . 1 1 5 5 PRO HD3 H 1 3.327 0.02 . 2 . . . A 284 PRO HD3 . 18500 1
30 . 1 1 6 6 GLY H H 1 8.834 0.02 . 1 . . . A 285 GLY H . 18500 1
31 . 1 1 6 6 GLY HA2 H 1 3.593 0.02 . 2 . . . A 285 GLY HA2 . 18500 1
32 . 1 1 6 6 GLY HA3 H 1 4.056 0.02 . 2 . . . A 285 GLY HA3 . 18500 1
33 . 1 1 7 7 TRP H H 1 7.512 0.02 . 1 . . . A 286 TRP H . 18500 1
34 . 1 1 7 7 TRP HA H 1 5.823 0.02 . 1 . . . A 286 TRP HA . 18500 1
35 . 1 1 7 7 TRP HB2 H 1 3.063 0.02 . 2 . . . A 286 TRP HB2 . 18500 1
36 . 1 1 7 7 TRP HB3 H 1 2.869 0.02 . 2 . . . A 286 TRP HB3 . 18500 1
37 . 1 1 7 7 TRP HD1 H 1 6.861 0.02 . 1 . . . A 286 TRP HD1 . 18500 1
38 . 1 1 7 7 TRP HE1 H 1 9.993 0.02 . 1 . . . A 286 TRP HE1 . 18500 1
39 . 1 1 7 7 TRP HE3 H 1 6.998 0.02 . 1 . . . A 286 TRP HE3 . 18500 1
40 . 1 1 7 7 TRP HZ2 H 1 7.157 0.02 . 1 . . . A 286 TRP HZ2 . 18500 1
41 . 1 1 7 7 TRP HZ3 H 1 6.819 0.02 . 1 . . . A 286 TRP HZ3 . 18500 1
42 . 1 1 7 7 TRP HH2 H 1 6.464 0.02 . 1 . . . A 286 TRP HH2 . 18500 1
43 . 1 1 8 8 GLU H H 1 9.279 0.02 . 1 . . . A 287 GLU H . 18500 1
44 . 1 1 8 8 GLU HA H 1 4.565 0.02 . 1 . . . A 287 GLU HA . 18500 1
45 . 1 1 8 8 GLU HB2 H 1 1.852 0.02 . 2 . . . A 287 GLU HB2 . 18500 1
46 . 1 1 8 8 GLU HB3 H 1 1.780 0.02 . 2 . . . A 287 GLU HB3 . 18500 1
47 . 1 1 8 8 GLU HG2 H 1 2.459 0.02 . 2 . . . A 287 GLU HG2 . 18500 1
48 . 1 1 8 8 GLU HG3 H 1 1.985 0.02 . 2 . . . A 287 GLU HG3 . 18500 1
49 . 1 1 9 9 VAL H H 1 8.343 0.02 . 1 . . . A 288 VAL H . 18500 1
50 . 1 1 9 9 VAL HA H 1 4.342 0.02 . 1 . . . A 288 VAL HA . 18500 1
51 . 1 1 9 9 VAL HB H 1 1.597 0.02 . 1 . . . A 288 VAL HB . 18500 1
52 . 1 1 9 9 VAL HG11 H 1 0.599 0.02 . 2 . . . A 288 VAL HG11 . 18500 1
53 . 1 1 9 9 VAL HG12 H 1 0.599 0.02 . 2 . . . A 288 VAL HG12 . 18500 1
54 . 1 1 9 9 VAL HG13 H 1 0.599 0.02 . 2 . . . A 288 VAL HG13 . 18500 1
55 . 1 1 9 9 VAL HG21 H 1 0.561 0.02 . 2 . . . A 288 VAL HG21 . 18500 1
56 . 1 1 9 9 VAL HG22 H 1 0.561 0.02 . 2 . . . A 288 VAL HG22 . 18500 1
57 . 1 1 9 9 VAL HG23 H 1 0.561 0.02 . 2 . . . A 288 VAL HG23 . 18500 1
58 . 1 1 10 10 ARG H H 1 8.146 0.02 . 1 . . . A 289 ARG H . 18500 1
59 . 1 1 10 10 ARG HA H 1 4.246 0.02 . 1 . . . A 289 ARG HA . 18500 1
60 . 1 1 10 10 ARG HB2 H 1 1.208 0.02 . 2 . . . A 289 ARG HB2 . 18500 1
61 . 1 1 10 10 ARG HB3 H 1 0.583 0.02 . 2 . . . A 289 ARG HB3 . 18500 1
62 . 1 1 10 10 ARG HG2 H 1 0.833 0.02 . 2 . . . A 289 ARG HG2 . 18500 1
63 . 1 1 10 10 ARG HG3 H 1 -0.102 0.02 . 2 . . . A 289 ARG HG3 . 18500 1
64 . 1 1 10 10 ARG HD2 H 1 3.037 0.02 . 2 . . . A 289 ARG HD2 . 18500 1
65 . 1 1 10 10 ARG HD3 H 1 2.842 0.02 . 2 . . . A 289 ARG HD3 . 18500 1
66 . 1 1 11 11 SER H H 1 7.932 0.02 . 1 . . . A 290 SER H . 18500 1
67 . 1 1 11 11 SER HA H 1 5.389 0.02 . 1 . . . A 290 SER HA . 18500 1
68 . 1 1 11 11 SER HB2 H 1 3.419 0.02 . 2 . . . A 290 SER HB2 . 18500 1
69 . 1 1 11 11 SER HB3 H 1 3.366 0.02 . 2 . . . A 290 SER HB3 . 18500 1
70 . 1 1 12 12 THR H H 1 9.241 0.02 . 1 . . . A 291 THR H . 18500 1
71 . 1 1 12 12 THR HA H 1 4.539 0.02 . 1 . . . A 291 THR HA . 18500 1
72 . 1 1 12 12 THR HG21 H 1 1.232 0.02 . 1 . . . A 291 THR HG21 . 18500 1
73 . 1 1 12 12 THR HG22 H 1 1.232 0.02 . 1 . . . A 291 THR HG22 . 18500 1
74 . 1 1 12 12 THR HG23 H 1 1.232 0.02 . 1 . . . A 291 THR HG23 . 18500 1
75 . 1 1 13 13 VAL H H 1 8.922 0.02 . 1 . . . A 292 VAL H . 18500 1
76 . 1 1 13 13 VAL HA H 1 3.754 0.02 . 1 . . . A 292 VAL HA . 18500 1
77 . 1 1 13 13 VAL HB H 1 1.999 0.02 . 1 . . . A 292 VAL HB . 18500 1
78 . 1 1 13 13 VAL HG11 H 1 0.855 0.02 . 2 . . . A 292 VAL HG11 . 18500 1
79 . 1 1 13 13 VAL HG12 H 1 0.855 0.02 . 2 . . . A 292 VAL HG12 . 18500 1
80 . 1 1 13 13 VAL HG13 H 1 0.855 0.02 . 2 . . . A 292 VAL HG13 . 18500 1
81 . 1 1 13 13 VAL HG21 H 1 0.819 0.02 . 2 . . . A 292 VAL HG21 . 18500 1
82 . 1 1 13 13 VAL HG22 H 1 0.819 0.02 . 2 . . . A 292 VAL HG22 . 18500 1
83 . 1 1 13 13 VAL HG23 H 1 0.819 0.02 . 2 . . . A 292 VAL HG23 . 18500 1
84 . 1 1 14 14 SER H H 1 8.371 0.02 . 1 . . . A 293 SER H . 18500 1
85 . 1 1 14 14 SER HA H 1 4.232 0.02 . 1 . . . A 293 SER HA . 18500 1
86 . 1 1 14 14 SER HB2 H 1 4.078 0.02 . 2 . . . A 293 SER HB2 . 18500 1
87 . 1 1 15 15 GLY H H 1 7.875 0.02 . 1 . . . A 294 GLY H . 18500 1
88 . 1 1 15 15 GLY HA2 H 1 3.463 0.02 . 2 . . . A 294 GLY HA2 . 18500 1
89 . 1 1 15 15 GLY HA3 H 1 4.101 0.02 . 2 . . . A 294 GLY HA3 . 18500 1
90 . 1 1 16 16 ARG H H 1 7.416 0.02 . 1 . . . A 295 ARG H . 18500 1
91 . 1 1 16 16 ARG HA H 1 4.220 0.02 . 1 . . . A 295 ARG HA . 18500 1
92 . 1 1 16 16 ARG HB2 H 1 1.442 0.02 . 2 . . . A 295 ARG HB2 . 18500 1
93 . 1 1 16 16 ARG HB3 H 1 1.214 0.02 . 2 . . . A 295 ARG HB3 . 18500 1
94 . 1 1 16 16 ARG HG2 H 1 1.798 0.02 . 2 . . . A 295 ARG HG2 . 18500 1
95 . 1 1 16 16 ARG HG3 H 1 1.569 0.02 . 2 . . . A 295 ARG HG3 . 18500 1
96 . 1 1 16 16 ARG HD2 H 1 2.746 0.02 . 2 . . . A 295 ARG HD2 . 18500 1
97 . 1 1 16 16 ARG HD3 H 1 2.568 0.02 . 2 . . . A 295 ARG HD3 . 18500 1
98 . 1 1 17 17 ILE H H 1 8.385 0.02 . 1 . . . A 296 ILE H . 18500 1
99 . 1 1 17 17 ILE HA H 1 4.406 0.02 . 1 . . . A 296 ILE HA . 18500 1
100 . 1 1 17 17 ILE HB H 1 1.571 0.02 . 1 . . . A 296 ILE HB . 18500 1
101 . 1 1 17 17 ILE HG12 H 1 1.353 0.02 . 2 . . . A 296 ILE HG12 . 18500 1
102 . 1 1 17 17 ILE HG13 H 1 0.798 0.02 . 2 . . . A 296 ILE HG13 . 18500 1
103 . 1 1 17 17 ILE HG21 H 1 0.617 0.02 . 1 . . . A 296 ILE HG21 . 18500 1
104 . 1 1 17 17 ILE HG22 H 1 0.617 0.02 . 1 . . . A 296 ILE HG22 . 18500 1
105 . 1 1 17 17 ILE HG23 H 1 0.617 0.02 . 1 . . . A 296 ILE HG23 . 18500 1
106 . 1 1 17 17 ILE HD11 H 1 0.421 0.02 . 1 . . . A 296 ILE HD11 . 18500 1
107 . 1 1 17 17 ILE HD12 H 1 0.421 0.02 . 1 . . . A 296 ILE HD12 . 18500 1
108 . 1 1 17 17 ILE HD13 H 1 0.421 0.02 . 1 . . . A 296 ILE HD13 . 18500 1
109 . 1 1 18 18 TYR H H 1 8.638 0.02 . 1 . . . A 297 TYR H . 18500 1
110 . 1 1 18 18 TYR HA H 1 4.679 0.02 . 1 . . . A 297 TYR HA . 18500 1
111 . 1 1 18 18 TYR HB2 H 1 2.696 0.02 . 2 . . . A 297 TYR HB2 . 18500 1
112 . 1 1 18 18 TYR HB3 H 1 2.331 0.02 . 2 . . . A 297 TYR HB3 . 18500 1
113 . 1 1 18 18 TYR HD1 H 1 6.611 0.02 . 3 . . . A 297 TYR HD1 . 18500 1
114 . 1 1 18 18 TYR HE1 H 1 6.112 0.02 . 3 . . . A 297 TYR HE1 . 18500 1
115 . 1 1 19 19 PHE H H 1 8.897 0.02 . 1 . . . A 298 PHE H . 18500 1
116 . 1 1 19 19 PHE HA H 1 4.965 0.02 . 1 . . . A 298 PHE HA . 18500 1
117 . 1 1 19 19 PHE HB2 H 1 3.082 0.02 . 2 . . . A 298 PHE HB2 . 18500 1
118 . 1 1 19 19 PHE HB3 H 1 2.866 0.02 . 2 . . . A 298 PHE HB3 . 18500 1
119 . 1 1 19 19 PHE HD1 H 1 7.164 0.02 . 3 . . . A 298 PHE HD1 . 18500 1
120 . 1 1 19 19 PHE HE1 H 1 7.119 0.02 . 3 . . . A 298 PHE HE1 . 18500 1
121 . 1 1 19 19 PHE HZ H 1 6.997 0.02 . 1 . . . A 298 PHE HZ . 18500 1
122 . 1 1 20 20 VAL H H 1 9.228 0.02 . 1 . . . A 299 VAL H . 18500 1
123 . 1 1 20 20 VAL HA H 1 4.105 0.02 . 1 . . . A 299 VAL HA . 18500 1
124 . 1 1 20 20 VAL HB H 1 1.529 0.02 . 1 . . . A 299 VAL HB . 18500 1
125 . 1 1 20 20 VAL HG11 H 1 0.466 0.02 . 2 . . . A 299 VAL HG11 . 18500 1
126 . 1 1 20 20 VAL HG12 H 1 0.466 0.02 . 2 . . . A 299 VAL HG12 . 18500 1
127 . 1 1 20 20 VAL HG13 H 1 0.466 0.02 . 2 . . . A 299 VAL HG13 . 18500 1
128 . 1 1 20 20 VAL HG21 H 1 0.133 0.02 . 2 . . . A 299 VAL HG21 . 18500 1
129 . 1 1 20 20 VAL HG22 H 1 0.133 0.02 . 2 . . . A 299 VAL HG22 . 18500 1
130 . 1 1 20 20 VAL HG23 H 1 0.133 0.02 . 2 . . . A 299 VAL HG23 . 18500 1
131 . 1 1 21 21 ASP H H 1 7.999 0.02 . 1 . . . A 300 ASP H . 18500 1
132 . 1 1 21 21 ASP HA H 1 3.312 0.02 . 1 . . . A 300 ASP HA . 18500 1
133 . 1 1 21 21 ASP HB2 H 1 2.025 0.02 . 2 . . . A 300 ASP HB2 . 18500 1
134 . 1 1 21 21 ASP HB3 H 1 -0.226 0.02 . 2 . . . A 300 ASP HB3 . 18500 1
135 . 1 1 22 22 HIS H H 1 8.519 0.02 . 1 . . . A 301 HIS H . 18500 1
136 . 1 1 22 22 HIS HA H 1 4.136 0.02 . 1 . . . A 301 HIS HA . 18500 1
137 . 1 1 22 22 HIS HB2 H 1 3.084 0.02 . 2 . . . A 301 HIS HB2 . 18500 1
138 . 1 1 22 22 HIS HB3 H 1 2.829 0.02 . 2 . . . A 301 HIS HB3 . 18500 1
139 . 1 1 22 22 HIS HD1 H 1 7.144 0.02 . 1 . . . A 301 HIS HD1 . 18500 1
140 . 1 1 22 22 HIS HD2 H 1 6.667 0.02 . 1 . . . A 301 HIS HD2 . 18500 1
141 . 1 1 22 22 HIS HE1 H 1 7.513 0.02 . 1 . . . A 301 HIS HE1 . 18500 1
142 . 1 1 23 23 ASN H H 1 8.259 0.02 . 1 . . . A 302 ASN H . 18500 1
143 . 1 1 23 23 ASN HA H 1 4.180 0.02 . 1 . . . A 302 ASN HA . 18500 1
144 . 1 1 23 23 ASN HB2 H 1 2.821 0.02 . 2 . . . A 302 ASN HB2 . 18500 1
145 . 1 1 23 23 ASN HB3 H 1 2.387 0.02 . 2 . . . A 302 ASN HB3 . 18500 1
146 . 1 1 23 23 ASN HD21 H 1 7.421 0.02 . 2 . . . A 302 ASN HD21 . 18500 1
147 . 1 1 23 23 ASN HD22 H 1 6.430 0.02 . 2 . . . A 302 ASN HD22 . 18500 1
148 . 1 1 24 24 ASN H H 1 6.616 0.02 . 1 . . . A 303 ASN H . 18500 1
149 . 1 1 24 24 ASN HA H 1 4.411 0.02 . 1 . . . A 303 ASN HA . 18500 1
150 . 1 1 24 24 ASN HB2 H 1 2.399 0.02 . 2 . . . A 303 ASN HB2 . 18500 1
151 . 1 1 24 24 ASN HB3 H 1 2.004 0.02 . 2 . . . A 303 ASN HB3 . 18500 1
152 . 1 1 24 24 ASN HD21 H 1 8.248 0.02 . 2 . . . A 303 ASN HD21 . 18500 1
153 . 1 1 24 24 ASN HD22 H 1 6.763 0.02 . 2 . . . A 303 ASN HD22 . 18500 1
154 . 1 1 25 25 ARG H H 1 7.958 0.02 . 1 . . . A 304 ARG H . 18500 1
155 . 1 1 25 25 ARG HA H 1 1.995 0.02 . 1 . . . A 304 ARG HA . 18500 1
156 . 1 1 25 25 ARG HB2 H 1 1.633 0.02 . 2 . . . A 304 ARG HB2 . 18500 1
157 . 1 1 25 25 ARG HG2 H 1 0.857 0.02 . 2 . . . A 304 ARG HG2 . 18500 1
158 . 1 1 25 25 ARG HG3 H 1 0.808 0.02 . 2 . . . A 304 ARG HG3 . 18500 1
159 . 1 1 25 25 ARG HD2 H 1 2.836 0.02 . 2 . . . A 304 ARG HD2 . 18500 1
160 . 1 1 26 26 THR H H 1 6.815 0.02 . 1 . . . A 305 THR H . 18500 1
161 . 1 1 26 26 THR HA H 1 4.531 0.02 . 1 . . . A 305 THR HA . 18500 1
162 . 1 1 26 26 THR HB H 1 3.945 0.02 . 1 . . . A 305 THR HB . 18500 1
163 . 1 1 26 26 THR HG21 H 1 0.748 0.02 . 1 . . . A 305 THR HG21 . 18500 1
164 . 1 1 26 26 THR HG22 H 1 0.748 0.02 . 1 . . . A 305 THR HG22 . 18500 1
165 . 1 1 26 26 THR HG23 H 1 0.748 0.02 . 1 . . . A 305 THR HG23 . 18500 1
166 . 1 1 27 27 THR H H 1 7.982 0.02 . 1 . . . A 306 THR H . 18500 1
167 . 1 1 27 27 THR HA H 1 5.280 0.02 . 1 . . . A 306 THR HA . 18500 1
168 . 1 1 27 27 THR HB H 1 3.910 0.02 . 1 . . . A 306 THR HB . 18500 1
169 . 1 1 27 27 THR HG21 H 1 0.957 0.02 . 1 . . . A 306 THR HG21 . 18500 1
170 . 1 1 27 27 THR HG22 H 1 0.957 0.02 . 1 . . . A 306 THR HG22 . 18500 1
171 . 1 1 27 27 THR HG23 H 1 0.957 0.02 . 1 . . . A 306 THR HG23 . 18500 1
172 . 1 1 28 28 GLN H H 1 8.973 0.02 . 1 . . . A 307 GLN H . 18500 1
173 . 1 1 28 28 GLN HA H 1 4.654 0.02 . 1 . . . A 307 GLN HA . 18500 1
174 . 1 1 28 28 GLN HB2 H 1 2.280 0.02 . 2 . . . A 307 GLN HB2 . 18500 1
175 . 1 1 28 28 GLN HB3 H 1 2.027 0.02 . 2 . . . A 307 GLN HB3 . 18500 1
176 . 1 1 28 28 GLN HG2 H 1 2.617 0.02 . 2 . . . A 307 GLN HG2 . 18500 1
177 . 1 1 28 28 GLN HG3 H 1 2.396 0.02 . 2 . . . A 307 GLN HG3 . 18500 1
178 . 1 1 29 29 PHE H H 1 9.263 0.02 . 1 . . . A 308 PHE H . 18500 1
179 . 1 1 29 29 PHE HA H 1 4.887 0.02 . 1 . . . A 308 PHE HA . 18500 1
180 . 1 1 29 29 PHE HB2 H 1 3.357 0.02 . 2 . . . A 308 PHE HB2 . 18500 1
181 . 1 1 29 29 PHE HB3 H 1 2.773 0.02 . 2 . . . A 308 PHE HB3 . 18500 1
182 . 1 1 29 29 PHE HD2 H 1 7.428 0.02 . 3 . . . A 308 PHE HD2 . 18500 1
183 . 1 1 29 29 PHE HE2 H 1 6.914 0.02 . 3 . . . A 308 PHE HE2 . 18500 1
184 . 1 1 30 30 THR H H 1 7.231 0.02 . 1 . . . A 309 THR H . 18500 1
185 . 1 1 30 30 THR HA H 1 4.123 0.02 . 1 . . . A 309 THR HA . 18500 1
186 . 1 1 30 30 THR HB H 1 3.751 0.02 . 1 . . . A 309 THR HB . 18500 1
187 . 1 1 30 30 THR HG21 H 1 0.938 0.02 . 1 . . . A 309 THR HG21 . 18500 1
188 . 1 1 30 30 THR HG22 H 1 0.938 0.02 . 1 . . . A 309 THR HG22 . 18500 1
189 . 1 1 30 30 THR HG23 H 1 0.938 0.02 . 1 . . . A 309 THR HG23 . 18500 1
190 . 1 1 31 31 ASP H H 1 8.346 0.02 . 1 . . . A 310 ASP H . 18500 1
191 . 1 1 31 31 ASP HA H 1 2.514 0.02 . 1 . . . A 310 ASP HA . 18500 1
192 . 1 1 31 31 ASP HB2 H 1 2.351 0.02 . 2 . . . A 310 ASP HB2 . 18500 1
193 . 1 1 31 31 ASP HB3 H 1 1.971 0.02 . 2 . . . A 310 ASP HB3 . 18500 1
194 . 1 1 32 32 PRO HA H 1 3.696 0.02 . 1 . . . A 311 PRO HA . 18500 1
195 . 1 1 32 32 PRO HB2 H 1 0.689 0.02 . 2 . . . A 311 PRO HB2 . 18500 1
196 . 1 1 32 32 PRO HB3 H 1 0.577 0.02 . 2 . . . A 311 PRO HB3 . 18500 1
197 . 1 1 32 32 PRO HG2 H 1 0.285 0.02 . 2 . . . A 311 PRO HG2 . 18500 1
198 . 1 1 32 32 PRO HG3 H 1 -0.031 0.02 . 2 . . . A 311 PRO HG3 . 18500 1
199 . 1 1 32 32 PRO HD2 H 1 2.352 0.02 . 2 . . . A 311 PRO HD2 . 18500 1
200 . 1 1 33 33 ARG H H 1 8.394 0.02 . 1 . . . A 312 ARG H . 18500 1
201 . 1 1 33 33 ARG HA H 1 3.675 0.02 . 1 . . . A 312 ARG HA . 18500 1
202 . 1 1 33 33 ARG HB2 H 1 0.897 0.02 . 2 . . . A 312 ARG HB2 . 18500 1
203 . 1 1 33 33 ARG HB3 H 1 0.883 0.02 . 2 . . . A 312 ARG HB3 . 18500 1
204 . 1 1 33 33 ARG HG2 H 1 1.565 0.02 . 2 . . . A 312 ARG HG2 . 18500 1
205 . 1 1 33 33 ARG HG3 H 1 1.458 0.02 . 2 . . . A 312 ARG HG3 . 18500 1
206 . 1 1 33 33 ARG HD2 H 1 2.539 0.02 . 2 . . . A 312 ARG HD2 . 18500 1
207 . 1 1 33 33 ARG HE H 1 8.632 0.02 . 1 . . . A 312 ARG HE . 18500 1
208 . 1 1 34 34 LEU H H 1 6.912 0.02 . 1 . . . A 313 LEU H . 18500 1
209 . 1 1 34 34 LEU HA H 1 3.952 0.02 . 1 . . . A 313 LEU HA . 18500 1
210 . 1 1 34 34 LEU HB2 H 1 1.240 0.02 . 2 . . . A 313 LEU HB2 . 18500 1
211 . 1 1 34 34 LEU HB3 H 1 1.167 0.02 . 2 . . . A 313 LEU HB3 . 18500 1
212 . 1 1 34 34 LEU HG H 1 1.357 0.02 . 1 . . . A 313 LEU HG . 18500 1
213 . 1 1 34 34 LEU HD11 H 1 0.683 0.02 . 2 . . . A 313 LEU HD11 . 18500 1
214 . 1 1 34 34 LEU HD12 H 1 0.683 0.02 . 2 . . . A 313 LEU HD12 . 18500 1
215 . 1 1 34 34 LEU HD13 H 1 0.683 0.02 . 2 . . . A 313 LEU HD13 . 18500 1
216 . 1 1 34 34 LEU HD21 H 1 0.547 0.02 . 2 . . . A 313 LEU HD21 . 18500 1
217 . 1 1 34 34 LEU HD22 H 1 0.547 0.02 . 2 . . . A 313 LEU HD22 . 18500 1
218 . 1 1 34 34 LEU HD23 H 1 0.547 0.02 . 2 . . . A 313 LEU HD23 . 18500 1
219 . 1 1 35 35 HIS H H 1 7.599 0.02 . 1 . . . A 314 HIS H . 18500 1
220 . 1 1 35 35 HIS HA H 1 4.140 0.02 . 1 . . . A 314 HIS HA . 18500 1
221 . 1 1 35 35 HIS HB2 H 1 2.927 0.02 . 2 . . . A 314 HIS HB2 . 18500 1
222 . 1 1 35 35 HIS HB3 H 1 2.766 0.02 . 2 . . . A 314 HIS HB3 . 18500 1
223 . 2 2 1 1 GLU HA H 1 4.109 0.02 . 1 . . . B 203 GLU HA . 18500 1
224 . 2 2 1 1 GLU HB2 H 1 1.789 0.02 . 2 . . . B 203 GLU HB2 . 18500 1
225 . 2 2 1 1 GLU HB3 H 1 1.711 0.02 . 2 . . . B 203 GLU HB3 . 18500 1
226 . 2 2 1 1 GLU HG2 H 1 2.011 0.02 . 2 . . . B 203 GLU HG2 . 18500 1
227 . 2 2 1 1 GLU H H 1 8.279 0.02 . 1 . . . B 203 GLU H1 . 18500 1
228 . 2 2 2 2 LEU H H 1 8.250 0.02 . 1 . . . B 204 LEU H . 18500 1
229 . 2 2 2 2 LEU HA H 1 3.973 0.02 . 1 . . . B 204 LEU HA . 18500 1
230 . 2 2 2 2 LEU HB2 H 1 1.411 0.02 . 2 . . . B 204 LEU HB2 . 18500 1
231 . 2 2 2 2 LEU HB3 H 1 1.344 0.02 . 2 . . . B 204 LEU HB3 . 18500 1
232 . 2 2 2 2 LEU HG H 1 0.998 0.02 . 1 . . . B 204 LEU HG . 18500 1
233 . 2 2 3 3 GLU H H 1 8.198 0.02 . 1 . . . B 205 GLU H . 18500 1
234 . 2 2 3 3 GLU HA H 1 4.109 0.02 . 1 . . . B 205 GLU HA . 18500 1
235 . 2 2 3 3 GLU HB2 H 1 1.777 0.02 . 2 . . . B 205 GLU HB2 . 18500 1
236 . 2 2 3 3 GLU HB3 H 1 1.633 0.02 . 2 . . . B 205 GLU HB3 . 18500 1
237 . 2 2 3 3 GLU HG2 H 1 2.033 0.02 . 2 . . . B 205 GLU HG2 . 18500 1
238 . 2 2 4 4 SER H H 1 8.238 0.02 . 1 . . . B 206 SER H . 18500 1
239 . 2 2 4 4 SER HA H 1 4.506 0.02 . 1 . . . B 206 SER HA . 18500 1
240 . 2 2 4 4 SER HB2 H 1 3.861 0.02 . 2 . . . B 206 SER HB2 . 18500 1
241 . 2 2 4 4 SER HB3 H 1 3.802 0.02 . 2 . . . B 206 SER HB3 . 18500 1
242 . 2 2 5 5 PRO HA H 1 4.485 0.02 . 1 . . . B 207 PRO HA . 18500 1
243 . 2 2 5 5 PRO HB2 H 1 3.028 0.02 . 2 . . . B 207 PRO HB2 . 18500 1
244 . 2 2 5 5 PRO HG2 H 1 1.795 0.02 . 2 . . . B 207 PRO HG2 . 18500 1
245 . 2 2 5 5 PRO HD2 H 1 3.166 0.02 . 2 . . . B 207 PRO HD2 . 18500 1
246 . 2 2 5 5 PRO HD3 H 1 3.372 0.02 . 2 . . . B 207 PRO HD3 . 18500 1
247 . 2 2 6 6 PRO HA H 1 4.475 0.02 . 1 . . . B 208 PRO HA . 18500 1
248 . 2 2 6 6 PRO HB2 H 1 0.965 0.02 . 2 . . . B 208 PRO HB2 . 18500 1
249 . 2 2 6 6 PRO HB3 H 1 0.327 0.02 . 2 . . . B 208 PRO HB3 . 18500 1
250 . 2 2 6 6 PRO HD2 H 1 2.095 0.02 . 2 . . . B 208 PRO HD2 . 18500 1
251 . 2 2 6 6 PRO HD3 H 1 1.658 0.02 . 2 . . . B 208 PRO HD3 . 18500 1
252 . 2 2 7 7 PRO HA H 1 4.642 0.02 . 1 . . . B 209 PRO HA . 18500 1
253 . 2 2 7 7 PRO HB2 H 1 2.116 0.02 . 2 . . . B 209 PRO HB2 . 18500 1
254 . 2 2 7 7 PRO HG2 H 1 1.775 0.02 . 2 . . . B 209 PRO HG2 . 18500 1
255 . 2 2 7 7 PRO HG3 H 1 0.894 0.02 . 2 . . . B 209 PRO HG3 . 18500 1
256 . 2 2 7 7 PRO HD2 H 1 3.582 0.02 . 2 . . . B 209 PRO HD2 . 18500 1
257 . 2 2 7 7 PRO HD3 H 1 3.364 0.02 . 2 . . . B 209 PRO HD3 . 18500 1
258 . 2 2 8 8 PRO HD2 H 1 3.518 0.02 . 2 . . . B 210 PRO HD2 . 18500 1
259 . 2 2 8 8 PRO HD3 H 1 3.359 0.02 . 2 . . . B 210 PRO HD3 . 18500 1
260 . 2 2 9 9 TYR H H 1 8.240 0.02 . 1 . . . B 211 TYR H . 18500 1
261 . 2 2 9 9 TYR HA H 1 3.551 0.02 . 1 . . . B 211 TYR HA . 18500 1
262 . 2 2 9 9 TYR HB2 H 1 2.905 0.02 . 2 . . . B 211 TYR HB2 . 18500 1
263 . 2 2 9 9 TYR HB3 H 1 2.817 0.02 . 2 . . . B 211 TYR HB3 . 18500 1
264 . 2 2 9 9 TYR HD1 H 1 6.558 0.02 . 3 . . . B 211 TYR HD1 . 18500 1
265 . 2 2 9 9 TYR HD2 H 1 6.558 0.02 . 3 . . . B 211 TYR HD2 . 18500 1
266 . 2 2 9 9 TYR HE1 H 1 6.166 0.02 . 3 . . . B 211 TYR HE1 . 18500 1
267 . 2 2 9 9 TYR HE2 H 1 6.166 0.02 . 3 . . . B 211 TYR HE2 . 18500 1
268 . 2 2 10 10 SER H H 1 8.116 0.02 . 1 . . . B 212 SER H . 18500 1
269 . 2 2 10 10 SER HA H 1 3.873 0.02 . 1 . . . B 212 SER HA . 18500 1
270 . 2 2 10 10 SER HB2 H 1 3.791 0.02 . 2 . . . B 212 SER HB2 . 18500 1
271 . 2 2 10 10 SER HB3 H 1 3.361 0.02 . 2 . . . B 212 SER HB3 . 18500 1
272 . 2 2 11 11 ARG HA H 1 3.852 0.02 . 1 . . . B 213 ARG HA . 18500 1
273 . 2 2 11 11 ARG HE H 1 7.596 0.02 . 1 . . . B 213 ARG HE . 18500 1
274 . 2 2 12 12 TYR HA H 1 4.443 0.02 . 1 . . . B 214 TYR HA . 18500 1
275 . 2 2 12 12 TYR HB2 H 1 2.086 0.02 . 2 . . . B 214 TYR HB2 . 18500 1
276 . 2 2 12 12 TYR HD1 H 1 6.925 0.02 . 3 . . . B 214 TYR HD1 . 18500 1
277 . 2 2 12 12 TYR HD2 H 1 6.925 0.02 . 3 . . . B 214 TYR HD2 . 18500 1
278 . 2 2 12 12 TYR HE1 H 1 6.548 0.02 . 3 . . . B 214 TYR HE1 . 18500 1
279 . 2 2 12 12 TYR HE2 H 1 6.548 0.02 . 3 . . . B 214 TYR HE2 . 18500 1
280 . 2 2 13 13 PRO HD2 H 1 3.526 0.02 . 2 . . . B 215 PRO HD2 . 18500 1
281 . 2 2 13 13 PRO HD3 H 1 3.358 0.02 . 2 . . . B 215 PRO HD3 . 18500 1
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