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 11483
_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 1H-15N NOESY' . . . 11483 1
2 '3D 1H-13C NOESY' . . . 11483 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 8 8 LYS HA H 1 4.321 0.030 . 1 . . . . 8 LYS HA . 11483 1
2 . 1 1 8 8 LYS HB2 H 1 1.658 0.030 . 1 . . . . 8 LYS HB2 . 11483 1
3 . 1 1 8 8 LYS HB3 H 1 1.658 0.030 . 1 . . . . 8 LYS HB3 . 11483 1
4 . 1 1 8 8 LYS HD2 H 1 1.619 0.030 . 1 . . . . 8 LYS HD2 . 11483 1
5 . 1 1 8 8 LYS HD3 H 1 1.619 0.030 . 1 . . . . 8 LYS HD3 . 11483 1
6 . 1 1 8 8 LYS HE2 H 1 2.942 0.030 . 1 . . . . 8 LYS HE2 . 11483 1
7 . 1 1 8 8 LYS HE3 H 1 2.942 0.030 . 1 . . . . 8 LYS HE3 . 11483 1
8 . 1 1 8 8 LYS HG2 H 1 1.323 0.030 . 2 . . . . 8 LYS HG2 . 11483 1
9 . 1 1 8 8 LYS HG3 H 1 1.231 0.030 . 2 . . . . 8 LYS HG3 . 11483 1
10 . 1 1 8 8 LYS C C 13 176.024 0.300 . 1 . . . . 8 LYS C . 11483 1
11 . 1 1 8 8 LYS CA C 13 56.044 0.300 . 1 . . . . 8 LYS CA . 11483 1
12 . 1 1 8 8 LYS CB C 13 33.063 0.300 . 1 . . . . 8 LYS CB . 11483 1
13 . 1 1 8 8 LYS CD C 13 29.145 0.300 . 1 . . . . 8 LYS CD . 11483 1
14 . 1 1 8 8 LYS CE C 13 42.257 0.300 . 1 . . . . 8 LYS CE . 11483 1
15 . 1 1 8 8 LYS CG C 13 24.872 0.300 . 1 . . . . 8 LYS CG . 11483 1
16 . 1 1 9 9 THR H H 1 7.861 0.030 . 1 . . . . 9 THR H . 11483 1
17 . 1 1 9 9 THR HA H 1 4.373 0.030 . 1 . . . . 9 THR HA . 11483 1
18 . 1 1 9 9 THR HB H 1 3.958 0.030 . 1 . . . . 9 THR HB . 11483 1
19 . 1 1 9 9 THR HG21 H 1 1.036 0.030 . 1 . . . . 9 THR HG2 . 11483 1
20 . 1 1 9 9 THR HG22 H 1 1.036 0.030 . 1 . . . . 9 THR HG2 . 11483 1
21 . 1 1 9 9 THR HG23 H 1 1.036 0.030 . 1 . . . . 9 THR HG2 . 11483 1
22 . 1 1 9 9 THR C C 13 173.462 0.300 . 1 . . . . 9 THR C . 11483 1
23 . 1 1 9 9 THR CA C 13 61.301 0.300 . 1 . . . . 9 THR CA . 11483 1
24 . 1 1 9 9 THR CB C 13 70.567 0.300 . 1 . . . . 9 THR CB . 11483 1
25 . 1 1 9 9 THR CG2 C 13 21.749 0.300 . 1 . . . . 9 THR CG2 . 11483 1
26 . 1 1 9 9 THR N N 15 114.115 0.300 . 1 . . . . 9 THR N . 11483 1
27 . 1 1 10 10 HIS H H 1 8.663 0.030 . 1 . . . . 10 HIS H . 11483 1
28 . 1 1 10 10 HIS HA H 1 4.604 0.030 . 1 . . . . 10 HIS HA . 11483 1
29 . 1 1 10 10 HIS HB2 H 1 2.856 0.030 . 1 . . . . 10 HIS HB2 . 11483 1
30 . 1 1 10 10 HIS HB3 H 1 2.856 0.030 . 1 . . . . 10 HIS HB3 . 11483 1
31 . 1 1 10 10 HIS HD2 H 1 6.580 0.030 . 1 . . . . 10 HIS HD2 . 11483 1
32 . 1 1 10 10 HIS HE1 H 1 7.675 0.030 . 1 . . . . 10 HIS HE1 . 11483 1
33 . 1 1 10 10 HIS C C 13 174.331 0.300 . 1 . . . . 10 HIS C . 11483 1
34 . 1 1 10 10 HIS CA C 13 55.617 0.300 . 1 . . . . 10 HIS CA . 11483 1
35 . 1 1 10 10 HIS CB C 13 31.765 0.300 . 1 . . . . 10 HIS CB . 11483 1
36 . 1 1 10 10 HIS CD2 C 13 119.183 0.300 . 1 . . . . 10 HIS CD2 . 11483 1
37 . 1 1 10 10 HIS CE1 C 13 138.356 0.300 . 1 . . . . 10 HIS CE1 . 11483 1
38 . 1 1 10 10 HIS N N 15 123.605 0.300 . 1 . . . . 10 HIS N . 11483 1
39 . 1 1 11 11 LEU H H 1 8.565 0.030 . 1 . . . . 11 LEU H . 11483 1
40 . 1 1 11 11 LEU HA H 1 4.814 0.030 . 1 . . . . 11 LEU HA . 11483 1
41 . 1 1 11 11 LEU HB2 H 1 1.589 0.030 . 2 . . . . 11 LEU HB2 . 11483 1
42 . 1 1 11 11 LEU HB3 H 1 1.442 0.030 . 2 . . . . 11 LEU HB3 . 11483 1
43 . 1 1 11 11 LEU HD11 H 1 0.803 0.030 . 1 . . . . 11 LEU HD1 . 11483 1
44 . 1 1 11 11 LEU HD12 H 1 0.803 0.030 . 1 . . . . 11 LEU HD1 . 11483 1
45 . 1 1 11 11 LEU HD13 H 1 0.803 0.030 . 1 . . . . 11 LEU HD1 . 11483 1
46 . 1 1 11 11 LEU HD21 H 1 0.756 0.030 . 1 . . . . 11 LEU HD2 . 11483 1
47 . 1 1 11 11 LEU HD22 H 1 0.756 0.030 . 1 . . . . 11 LEU HD2 . 11483 1
48 . 1 1 11 11 LEU HD23 H 1 0.756 0.030 . 1 . . . . 11 LEU HD2 . 11483 1
49 . 1 1 11 11 LEU HG H 1 1.335 0.030 . 1 . . . . 11 LEU HG . 11483 1
50 . 1 1 11 11 LEU C C 13 176.303 0.300 . 1 . . . . 11 LEU C . 11483 1
51 . 1 1 11 11 LEU CA C 13 54.520 0.300 . 1 . . . . 11 LEU CA . 11483 1
52 . 1 1 11 11 LEU CB C 13 45.211 0.300 . 1 . . . . 11 LEU CB . 11483 1
53 . 1 1 11 11 LEU CD1 C 13 25.532 0.300 . 2 . . . . 11 LEU CD1 . 11483 1
54 . 1 1 11 11 LEU CD2 C 13 24.808 0.300 . 2 . . . . 11 LEU CD2 . 11483 1
55 . 1 1 11 11 LEU CG C 13 27.173 0.300 . 1 . . . . 11 LEU CG . 11483 1
56 . 1 1 11 11 LEU N N 15 126.379 0.300 . 1 . . . . 11 LEU N . 11483 1
57 . 1 1 12 12 CYS H H 1 9.231 0.030 . 1 . . . . 12 CYS H . 11483 1
58 . 1 1 12 12 CYS HA H 1 4.517 0.030 . 1 . . . . 12 CYS HA . 11483 1
59 . 1 1 12 12 CYS HB2 H 1 3.450 0.030 . 2 . . . . 12 CYS HB2 . 11483 1
60 . 1 1 12 12 CYS HB3 H 1 2.808 0.030 . 2 . . . . 12 CYS HB3 . 11483 1
61 . 1 1 12 12 CYS C C 13 176.205 0.300 . 1 . . . . 12 CYS C . 11483 1
62 . 1 1 12 12 CYS CA C 13 60.231 0.300 . 1 . . . . 12 CYS CA . 11483 1
63 . 1 1 12 12 CYS CB C 13 29.512 0.300 . 1 . . . . 12 CYS CB . 11483 1
64 . 1 1 12 12 CYS N N 15 126.233 0.300 . 1 . . . . 12 CYS N . 11483 1
65 . 1 1 13 13 ASP HA H 1 4.374 0.030 . 1 . . . . 13 ASP HA . 11483 1
66 . 1 1 13 13 ASP HB2 H 1 2.774 0.030 . 1 . . . . 13 ASP HB2 . 11483 1
67 . 1 1 13 13 ASP HB3 H 1 2.774 0.030 . 1 . . . . 13 ASP HB3 . 11483 1
68 . 1 1 13 13 ASP C C 13 175.923 0.300 . 1 . . . . 13 ASP C . 11483 1
69 . 1 1 13 13 ASP CA C 13 55.701 0.300 . 1 . . . . 13 ASP CA . 11483 1
70 . 1 1 13 13 ASP CB C 13 39.736 0.300 . 1 . . . . 13 ASP CB . 11483 1
71 . 1 1 14 14 MET H H 1 8.863 0.030 . 1 . . . . 14 MET H . 11483 1
72 . 1 1 14 14 MET HA H 1 4.397 0.030 . 1 . . . . 14 MET HA . 11483 1
73 . 1 1 14 14 MET HB2 H 1 1.440 0.030 . 2 . . . . 14 MET HB2 . 11483 1
74 . 1 1 14 14 MET HB3 H 1 1.308 0.030 . 2 . . . . 14 MET HB3 . 11483 1
75 . 1 1 14 14 MET HE1 H 1 1.989 0.030 . 1 . . . . 14 MET HE . 11483 1
76 . 1 1 14 14 MET HE2 H 1 1.989 0.030 . 1 . . . . 14 MET HE . 11483 1
77 . 1 1 14 14 MET HE3 H 1 1.989 0.030 . 1 . . . . 14 MET HE . 11483 1
78 . 1 1 14 14 MET HG2 H 1 2.396 0.030 . 2 . . . . 14 MET HG2 . 11483 1
79 . 1 1 14 14 MET HG3 H 1 2.297 0.030 . 2 . . . . 14 MET HG3 . 11483 1
80 . 1 1 14 14 MET C C 13 176.998 0.300 . 1 . . . . 14 MET C . 11483 1
81 . 1 1 14 14 MET CA C 13 57.341 0.300 . 1 . . . . 14 MET CA . 11483 1
82 . 1 1 14 14 MET CB C 13 32.730 0.300 . 1 . . . . 14 MET CB . 11483 1
83 . 1 1 14 14 MET CE C 13 17.518 0.300 . 1 . . . . 14 MET CE . 11483 1
84 . 1 1 14 14 MET CG C 13 32.593 0.300 . 1 . . . . 14 MET CG . 11483 1
85 . 1 1 14 14 MET N N 15 120.633 0.300 . 1 . . . . 14 MET N . 11483 1
86 . 1 1 15 15 CYS H H 1 8.014 0.030 . 1 . . . . 15 CYS H . 11483 1
87 . 1 1 15 15 CYS HA H 1 5.168 0.030 . 1 . . . . 15 CYS HA . 11483 1
88 . 1 1 15 15 CYS HB2 H 1 3.440 0.030 . 2 . . . . 15 CYS HB2 . 11483 1
89 . 1 1 15 15 CYS HB3 H 1 2.915 0.030 . 2 . . . . 15 CYS HB3 . 11483 1
90 . 1 1 15 15 CYS C C 13 176.183 0.300 . 1 . . . . 15 CYS C . 11483 1
91 . 1 1 15 15 CYS CA C 13 58.610 0.300 . 1 . . . . 15 CYS CA . 11483 1
92 . 1 1 15 15 CYS CB C 13 32.404 0.300 . 1 . . . . 15 CYS CB . 11483 1
93 . 1 1 15 15 CYS N N 15 115.489 0.300 . 1 . . . . 15 CYS N . 11483 1
94 . 1 1 16 16 GLY H H 1 8.325 0.030 . 1 . . . . 16 GLY H . 11483 1
95 . 1 1 16 16 GLY HA2 H 1 4.217 0.030 . 2 . . . . 16 GLY HA2 . 11483 1
96 . 1 1 16 16 GLY HA3 H 1 3.845 0.030 . 2 . . . . 16 GLY HA3 . 11483 1
97 . 1 1 16 16 GLY C C 13 173.669 0.300 . 1 . . . . 16 GLY C . 11483 1
98 . 1 1 16 16 GLY CA C 13 46.324 0.300 . 1 . . . . 16 GLY CA . 11483 1
99 . 1 1 16 16 GLY N N 15 113.286 0.300 . 1 . . . . 16 GLY N . 11483 1
100 . 1 1 17 17 LYS H H 1 7.905 0.030 . 1 . . . . 17 LYS H . 11483 1
101 . 1 1 17 17 LYS HA H 1 4.082 0.030 . 1 . . . . 17 LYS HA . 11483 1
102 . 1 1 17 17 LYS HB2 H 1 1.484 0.030 . 2 . . . . 17 LYS HB2 . 11483 1
103 . 1 1 17 17 LYS HB3 H 1 1.352 0.030 . 2 . . . . 17 LYS HB3 . 11483 1
104 . 1 1 17 17 LYS HD2 H 1 1.608 0.030 . 2 . . . . 17 LYS HD2 . 11483 1
105 . 1 1 17 17 LYS HD3 H 1 1.555 0.030 . 2 . . . . 17 LYS HD3 . 11483 1
106 . 1 1 17 17 LYS HE2 H 1 3.007 0.030 . 1 . . . . 17 LYS HE2 . 11483 1
107 . 1 1 17 17 LYS HE3 H 1 3.007 0.030 . 1 . . . . 17 LYS HE3 . 11483 1
108 . 1 1 17 17 LYS HG2 H 1 1.623 0.030 . 2 . . . . 17 LYS HG2 . 11483 1
109 . 1 1 17 17 LYS HG3 H 1 1.226 0.030 . 2 . . . . 17 LYS HG3 . 11483 1
110 . 1 1 17 17 LYS C C 13 173.998 0.300 . 1 . . . . 17 LYS C . 11483 1
111 . 1 1 17 17 LYS CA C 13 57.834 0.300 . 1 . . . . 17 LYS CA . 11483 1
112 . 1 1 17 17 LYS CB C 13 34.260 0.300 . 1 . . . . 17 LYS CB . 11483 1
113 . 1 1 17 17 LYS CD C 13 29.438 0.300 . 1 . . . . 17 LYS CD . 11483 1
114 . 1 1 17 17 LYS CE C 13 42.288 0.300 . 1 . . . . 17 LYS CE . 11483 1
115 . 1 1 17 17 LYS CG C 13 26.846 0.300 . 1 . . . . 17 LYS CG . 11483 1
116 . 1 1 17 17 LYS N N 15 121.534 0.300 . 1 . . . . 17 LYS N . 11483 1
117 . 1 1 18 18 LYS H H 1 7.743 0.030 . 1 . . . . 18 LYS H . 11483 1
118 . 1 1 18 18 LYS HA H 1 4.862 0.030 . 1 . . . . 18 LYS HA . 11483 1
119 . 1 1 18 18 LYS HB2 H 1 1.482 0.030 . 2 . . . . 18 LYS HB2 . 11483 1
120 . 1 1 18 18 LYS HB3 H 1 1.455 0.030 . 2 . . . . 18 LYS HB3 . 11483 1
121 . 1 1 18 18 LYS HD2 H 1 1.574 0.030 . 1 . . . . 18 LYS HD2 . 11483 1
122 . 1 1 18 18 LYS HD3 H 1 1.574 0.030 . 1 . . . . 18 LYS HD3 . 11483 1
123 . 1 1 18 18 LYS HE2 H 1 2.887 0.030 . 1 . . . . 18 LYS HE2 . 11483 1
124 . 1 1 18 18 LYS HE3 H 1 2.887 0.030 . 1 . . . . 18 LYS HE3 . 11483 1
125 . 1 1 18 18 LYS HG2 H 1 1.344 0.030 . 2 . . . . 18 LYS HG2 . 11483 1
126 . 1 1 18 18 LYS HG3 H 1 1.139 0.030 . 2 . . . . 18 LYS HG3 . 11483 1
127 . 1 1 18 18 LYS C C 13 175.772 0.300 . 1 . . . . 18 LYS C . 11483 1
128 . 1 1 18 18 LYS CA C 13 55.261 0.300 . 1 . . . . 18 LYS CA . 11483 1
129 . 1 1 18 18 LYS CB C 13 35.370 0.300 . 1 . . . . 18 LYS CB . 11483 1
130 . 1 1 18 18 LYS CD C 13 29.487 0.300 . 1 . . . . 18 LYS CD . 11483 1
131 . 1 1 18 18 LYS CE C 13 42.105 0.300 . 1 . . . . 18 LYS CE . 11483 1
132 . 1 1 18 18 LYS CG C 13 25.530 0.300 . 1 . . . . 18 LYS CG . 11483 1
133 . 1 1 18 18 LYS N N 15 118.732 0.300 . 1 . . . . 18 LYS N . 11483 1
134 . 1 1 19 19 PHE H H 1 8.760 0.030 . 1 . . . . 19 PHE H . 11483 1
135 . 1 1 19 19 PHE HA H 1 4.611 0.030 . 1 . . . . 19 PHE HA . 11483 1
136 . 1 1 19 19 PHE HB2 H 1 3.482 0.030 . 2 . . . . 19 PHE HB2 . 11483 1
137 . 1 1 19 19 PHE HB3 H 1 2.638 0.030 . 2 . . . . 19 PHE HB3 . 11483 1
138 . 1 1 19 19 PHE HD1 H 1 7.191 0.030 . 1 . . . . 19 PHE HD1 . 11483 1
139 . 1 1 19 19 PHE HD2 H 1 7.191 0.030 . 1 . . . . 19 PHE HD2 . 11483 1
140 . 1 1 19 19 PHE HE1 H 1 6.723 0.030 . 1 . . . . 19 PHE HE1 . 11483 1
141 . 1 1 19 19 PHE HE2 H 1 6.723 0.030 . 1 . . . . 19 PHE HE2 . 11483 1
142 . 1 1 19 19 PHE HZ H 1 5.959 0.030 . 1 . . . . 19 PHE HZ . 11483 1
143 . 1 1 19 19 PHE C C 13 176.083 0.300 . 1 . . . . 19 PHE C . 11483 1
144 . 1 1 19 19 PHE CA C 13 57.728 0.300 . 1 . . . . 19 PHE CA . 11483 1
145 . 1 1 19 19 PHE CB C 13 43.096 0.300 . 1 . . . . 19 PHE CB . 11483 1
146 . 1 1 19 19 PHE CD1 C 13 132.060 0.300 . 1 . . . . 19 PHE CD1 . 11483 1
147 . 1 1 19 19 PHE CD2 C 13 132.060 0.300 . 1 . . . . 19 PHE CD2 . 11483 1
148 . 1 1 19 19 PHE CE1 C 13 130.652 0.300 . 1 . . . . 19 PHE CE1 . 11483 1
149 . 1 1 19 19 PHE CE2 C 13 130.652 0.300 . 1 . . . . 19 PHE CE2 . 11483 1
150 . 1 1 19 19 PHE CZ C 13 128.348 0.300 . 1 . . . . 19 PHE CZ . 11483 1
151 . 1 1 19 19 PHE N N 15 118.981 0.300 . 1 . . . . 19 PHE N . 11483 1
152 . 1 1 20 20 LYS HA H 1 4.518 0.030 . 1 . . . . 20 LYS HA . 11483 1
153 . 1 1 20 20 LYS HB2 H 1 2.029 0.030 . 2 . . . . 20 LYS HB2 . 11483 1
154 . 1 1 20 20 LYS HB3 H 1 1.946 0.030 . 2 . . . . 20 LYS HB3 . 11483 1
155 . 1 1 20 20 LYS HD2 H 1 1.733 0.030 . 1 . . . . 20 LYS HD2 . 11483 1
156 . 1 1 20 20 LYS HD3 H 1 1.733 0.030 . 1 . . . . 20 LYS HD3 . 11483 1
157 . 1 1 20 20 LYS HE2 H 1 3.002 0.030 . 1 . . . . 20 LYS HE2 . 11483 1
158 . 1 1 20 20 LYS HE3 H 1 3.002 0.030 . 1 . . . . 20 LYS HE3 . 11483 1
159 . 1 1 20 20 LYS HG2 H 1 1.538 0.030 . 1 . . . . 20 LYS HG2 . 11483 1
160 . 1 1 20 20 LYS HG3 H 1 1.538 0.030 . 1 . . . . 20 LYS HG3 . 11483 1
161 . 1 1 20 20 LYS CA C 13 57.376 0.300 . 1 . . . . 20 LYS CA . 11483 1
162 . 1 1 20 20 LYS CB C 13 33.199 0.300 . 1 . . . . 20 LYS CB . 11483 1
163 . 1 1 20 20 LYS CD C 13 29.237 0.300 . 1 . . . . 20 LYS CD . 11483 1
164 . 1 1 20 20 LYS CE C 13 42.043 0.300 . 1 . . . . 20 LYS CE . 11483 1
165 . 1 1 20 20 LYS CG C 13 25.121 0.300 . 1 . . . . 20 LYS CG . 11483 1
166 . 1 1 21 21 SER H H 1 7.503 0.030 . 1 . . . . 21 SER H . 11483 1
167 . 1 1 21 21 SER HA H 1 4.607 0.030 . 1 . . . . 21 SER HA . 11483 1
168 . 1 1 21 21 SER HB2 H 1 4.143 0.030 . 2 . . . . 21 SER HB2 . 11483 1
169 . 1 1 21 21 SER HB3 H 1 3.929 0.030 . 2 . . . . 21 SER HB3 . 11483 1
170 . 1 1 21 21 SER CA C 13 55.873 0.300 . 1 . . . . 21 SER CA . 11483 1
171 . 1 1 21 21 SER CB C 13 66.710 0.300 . 1 . . . . 21 SER CB . 11483 1
172 . 1 1 21 21 SER N N 15 109.947 0.300 . 1 . . . . 21 SER N . 11483 1
173 . 1 1 22 22 LYS H H 1 8.726 0.030 . 1 . . . . 22 LYS H . 11483 1
174 . 1 1 22 22 LYS HA H 1 3.509 0.030 . 1 . . . . 22 LYS HA . 11483 1
175 . 1 1 22 22 LYS HB2 H 1 1.646 0.030 . 1 . . . . 22 LYS HB2 . 11483 1
176 . 1 1 22 22 LYS HB3 H 1 1.646 0.030 . 1 . . . . 22 LYS HB3 . 11483 1
177 . 1 1 22 22 LYS HD2 H 1 1.672 0.030 . 1 . . . . 22 LYS HD2 . 11483 1
178 . 1 1 22 22 LYS HD3 H 1 1.672 0.030 . 1 . . . . 22 LYS HD3 . 11483 1
179 . 1 1 22 22 LYS HE2 H 1 3.003 0.030 . 1 . . . . 22 LYS HE2 . 11483 1
180 . 1 1 22 22 LYS HE3 H 1 3.003 0.030 . 1 . . . . 22 LYS HE3 . 11483 1
181 . 1 1 22 22 LYS HG2 H 1 1.297 0.030 . 2 . . . . 22 LYS HG2 . 11483 1
182 . 1 1 22 22 LYS HG3 H 1 1.230 0.030 . 2 . . . . 22 LYS HG3 . 11483 1
183 . 1 1 22 22 LYS CA C 13 59.217 0.300 . 1 . . . . 22 LYS CA . 11483 1
184 . 1 1 22 22 LYS CB C 13 32.151 0.300 . 1 . . . . 22 LYS CB . 11483 1
185 . 1 1 22 22 LYS CD C 13 29.387 0.300 . 1 . . . . 22 LYS CD . 11483 1
186 . 1 1 22 22 LYS CE C 13 41.956 0.300 . 1 . . . . 22 LYS CE . 11483 1
187 . 1 1 22 22 LYS CG C 13 25.342 0.300 . 1 . . . . 22 LYS CG . 11483 1
188 . 1 1 22 22 LYS N N 15 122.299 0.300 . 1 . . . . 22 LYS N . 11483 1
189 . 1 1 23 23 GLY HA2 H 1 3.912 0.030 . 2 . . . . 23 GLY HA2 . 11483 1
190 . 1 1 23 23 GLY HA3 H 1 3.770 0.030 . 2 . . . . 23 GLY HA3 . 11483 1
191 . 1 1 23 23 GLY C C 13 176.767 0.300 . 1 . . . . 23 GLY C . 11483 1
192 . 1 1 23 23 GLY CA C 13 47.047 0.300 . 1 . . . . 23 GLY CA . 11483 1
193 . 1 1 24 24 THR H H 1 7.642 0.030 . 1 . . . . 24 THR H . 11483 1
194 . 1 1 24 24 THR HA H 1 4.129 0.030 . 1 . . . . 24 THR HA . 11483 1
195 . 1 1 24 24 THR HB H 1 4.269 0.030 . 1 . . . . 24 THR HB . 11483 1
196 . 1 1 24 24 THR HG21 H 1 1.357 0.030 . 1 . . . . 24 THR HG2 . 11483 1
197 . 1 1 24 24 THR HG22 H 1 1.357 0.030 . 1 . . . . 24 THR HG2 . 11483 1
198 . 1 1 24 24 THR HG23 H 1 1.357 0.030 . 1 . . . . 24 THR HG2 . 11483 1
199 . 1 1 24 24 THR C C 13 177.678 0.300 . 1 . . . . 24 THR C . 11483 1
200 . 1 1 24 24 THR CA C 13 64.849 0.300 . 1 . . . . 24 THR CA . 11483 1
201 . 1 1 24 24 THR CB C 13 68.551 0.300 . 1 . . . . 24 THR CB . 11483 1
202 . 1 1 24 24 THR CG2 C 13 23.716 0.300 . 1 . . . . 24 THR CG2 . 11483 1
203 . 1 1 24 24 THR N N 15 115.535 0.300 . 1 . . . . 24 THR N . 11483 1
204 . 1 1 25 25 LEU H H 1 7.407 0.030 . 1 . . . . 25 LEU H . 11483 1
205 . 1 1 25 25 LEU HA H 1 3.271 0.030 . 1 . . . . 25 LEU HA . 11483 1
206 . 1 1 25 25 LEU HB2 H 1 1.950 0.030 . 2 . . . . 25 LEU HB2 . 11483 1
207 . 1 1 25 25 LEU HB3 H 1 1.301 0.030 . 2 . . . . 25 LEU HB3 . 11483 1
208 . 1 1 25 25 LEU HD11 H 1 0.991 0.030 . 1 . . . . 25 LEU HD1 . 11483 1
209 . 1 1 25 25 LEU HD12 H 1 0.991 0.030 . 1 . . . . 25 LEU HD1 . 11483 1
210 . 1 1 25 25 LEU HD13 H 1 0.991 0.030 . 1 . . . . 25 LEU HD1 . 11483 1
211 . 1 1 25 25 LEU HD21 H 1 0.909 0.030 . 1 . . . . 25 LEU HD2 . 11483 1
212 . 1 1 25 25 LEU HD22 H 1 0.909 0.030 . 1 . . . . 25 LEU HD2 . 11483 1
213 . 1 1 25 25 LEU HD23 H 1 0.909 0.030 . 1 . . . . 25 LEU HD2 . 11483 1
214 . 1 1 25 25 LEU HG H 1 1.512 0.030 . 1 . . . . 25 LEU HG . 11483 1
215 . 1 1 25 25 LEU C C 13 177.230 0.300 . 1 . . . . 25 LEU C . 11483 1
216 . 1 1 25 25 LEU CA C 13 58.063 0.300 . 1 . . . . 25 LEU CA . 11483 1
217 . 1 1 25 25 LEU CB C 13 40.799 0.300 . 1 . . . . 25 LEU CB . 11483 1
218 . 1 1 25 25 LEU CD1 C 13 26.909 0.300 . 2 . . . . 25 LEU CD1 . 11483 1
219 . 1 1 25 25 LEU CD2 C 13 22.929 0.300 . 2 . . . . 25 LEU CD2 . 11483 1
220 . 1 1 25 25 LEU CG C 13 27.332 0.300 . 1 . . . . 25 LEU CG . 11483 1
221 . 1 1 25 25 LEU N N 15 124.259 0.300 . 1 . . . . 25 LEU N . 11483 1
222 . 1 1 26 26 LYS H H 1 8.155 0.030 . 1 . . . . 26 LYS H . 11483 1
223 . 1 1 26 26 LYS HA H 1 3.834 0.030 . 1 . . . . 26 LYS HA . 11483 1
224 . 1 1 26 26 LYS HB2 H 1 1.903 0.030 . 1 . . . . 26 LYS HB2 . 11483 1
225 . 1 1 26 26 LYS HB3 H 1 1.903 0.030 . 1 . . . . 26 LYS HB3 . 11483 1
226 . 1 1 26 26 LYS HD2 H 1 1.663 0.030 . 1 . . . . 26 LYS HD2 . 11483 1
227 . 1 1 26 26 LYS HD3 H 1 1.663 0.030 . 1 . . . . 26 LYS HD3 . 11483 1
228 . 1 1 26 26 LYS HE2 H 1 2.949 0.030 . 1 . . . . 26 LYS HE2 . 11483 1
229 . 1 1 26 26 LYS HE3 H 1 2.949 0.030 . 1 . . . . 26 LYS HE3 . 11483 1
230 . 1 1 26 26 LYS HG2 H 1 1.500 0.030 . 2 . . . . 26 LYS HG2 . 11483 1
231 . 1 1 26 26 LYS HG3 H 1 1.326 0.030 . 2 . . . . 26 LYS HG3 . 11483 1
232 . 1 1 26 26 LYS C C 13 179.247 0.300 . 1 . . . . 26 LYS C . 11483 1
233 . 1 1 26 26 LYS CA C 13 60.161 0.300 . 1 . . . . 26 LYS CA . 11483 1
234 . 1 1 26 26 LYS CB C 13 32.115 0.300 . 1 . . . . 26 LYS CB . 11483 1
235 . 1 1 26 26 LYS CD C 13 29.475 0.300 . 1 . . . . 26 LYS CD . 11483 1
236 . 1 1 26 26 LYS CE C 13 42.090 0.300 . 1 . . . . 26 LYS CE . 11483 1
237 . 1 1 26 26 LYS CG C 13 24.907 0.300 . 1 . . . . 26 LYS CG . 11483 1
238 . 1 1 26 26 LYS N N 15 119.316 0.300 . 1 . . . . 26 LYS N . 11483 1
239 . 1 1 27 27 SER H H 1 7.700 0.030 . 1 . . . . 27 SER H . 11483 1
240 . 1 1 27 27 SER HA H 1 4.110 0.030 . 1 . . . . 27 SER HA . 11483 1
241 . 1 1 27 27 SER HB2 H 1 3.838 0.030 . 1 . . . . 27 SER HB2 . 11483 1
242 . 1 1 27 27 SER HB3 H 1 3.838 0.030 . 1 . . . . 27 SER HB3 . 11483 1
243 . 1 1 27 27 SER C C 13 176.600 0.300 . 1 . . . . 27 SER C . 11483 1
244 . 1 1 27 27 SER CA C 13 61.571 0.300 . 1 . . . . 27 SER CA . 11483 1
245 . 1 1 27 27 SER CB C 13 62.554 0.300 . 1 . . . . 27 SER CB . 11483 1
246 . 1 1 27 27 SER N N 15 113.190 0.300 . 1 . . . . 27 SER N . 11483 1
247 . 1 1 28 28 HIS H H 1 7.648 0.030 . 1 . . . . 28 HIS H . 11483 1
248 . 1 1 28 28 HIS HA H 1 4.130 0.030 . 1 . . . . 28 HIS HA . 11483 1
249 . 1 1 28 28 HIS HB2 H 1 2.966 0.030 . 2 . . . . 28 HIS HB2 . 11483 1
250 . 1 1 28 28 HIS HB3 H 1 2.652 0.030 . 2 . . . . 28 HIS HB3 . 11483 1
251 . 1 1 28 28 HIS HD2 H 1 6.810 0.030 . 1 . . . . 28 HIS HD2 . 11483 1
252 . 1 1 28 28 HIS HE1 H 1 7.991 0.030 . 1 . . . . 28 HIS HE1 . 11483 1
253 . 1 1 28 28 HIS C C 13 176.824 0.300 . 1 . . . . 28 HIS C . 11483 1
254 . 1 1 28 28 HIS CA C 13 59.191 0.300 . 1 . . . . 28 HIS CA . 11483 1
255 . 1 1 28 28 HIS CB C 13 27.687 0.300 . 1 . . . . 28 HIS CB . 11483 1
256 . 1 1 28 28 HIS CD2 C 13 127.495 0.300 . 1 . . . . 28 HIS CD2 . 11483 1
257 . 1 1 28 28 HIS CE1 C 13 138.974 0.300 . 1 . . . . 28 HIS CE1 . 11483 1
258 . 1 1 28 28 HIS N N 15 121.808 0.300 . 1 . . . . 28 HIS N . 11483 1
259 . 1 1 29 29 LYS H H 1 8.385 0.030 . 1 . . . . 29 LYS H . 11483 1
260 . 1 1 29 29 LYS HA H 1 3.660 0.030 . 1 . . . . 29 LYS HA . 11483 1
261 . 1 1 29 29 LYS HB2 H 1 1.943 0.030 . 1 . . . . 29 LYS HB2 . 11483 1
262 . 1 1 29 29 LYS HB3 H 1 1.943 0.030 . 1 . . . . 29 LYS HB3 . 11483 1
263 . 1 1 29 29 LYS HD2 H 1 1.884 0.030 . 2 . . . . 29 LYS HD2 . 11483 1
264 . 1 1 29 29 LYS HD3 H 1 1.827 0.030 . 2 . . . . 29 LYS HD3 . 11483 1
265 . 1 1 29 29 LYS HE2 H 1 3.200 0.030 . 2 . . . . 29 LYS HE2 . 11483 1
266 . 1 1 29 29 LYS HE3 H 1 3.094 0.030 . 2 . . . . 29 LYS HE3 . 11483 1
267 . 1 1 29 29 LYS HG2 H 1 1.985 0.030 . 2 . . . . 29 LYS HG2 . 11483 1
268 . 1 1 29 29 LYS HG3 H 1 1.773 0.030 . 2 . . . . 29 LYS HG3 . 11483 1
269 . 1 1 29 29 LYS C C 13 178.954 0.300 . 1 . . . . 29 LYS C . 11483 1
270 . 1 1 29 29 LYS CA C 13 60.443 0.300 . 1 . . . . 29 LYS CA . 11483 1
271 . 1 1 29 29 LYS CB C 13 31.801 0.300 . 1 . . . . 29 LYS CB . 11483 1
272 . 1 1 29 29 LYS CD C 13 29.641 0.300 . 1 . . . . 29 LYS CD . 11483 1
273 . 1 1 29 29 LYS CE C 13 41.926 0.300 . 1 . . . . 29 LYS CE . 11483 1
274 . 1 1 29 29 LYS CG C 13 27.024 0.300 . 1 . . . . 29 LYS CG . 11483 1
275 . 1 1 29 29 LYS N N 15 117.220 0.300 . 1 . . . . 29 LYS N . 11483 1
276 . 1 1 30 30 LEU H H 1 7.227 0.030 . 1 . . . . 30 LEU H . 11483 1
277 . 1 1 30 30 LEU HA H 1 4.121 0.030 . 1 . . . . 30 LEU HA . 11483 1
278 . 1 1 30 30 LEU HB2 H 1 1.786 0.030 . 2 . . . . 30 LEU HB2 . 11483 1
279 . 1 1 30 30 LEU HB3 H 1 1.502 0.030 . 2 . . . . 30 LEU HB3 . 11483 1
280 . 1 1 30 30 LEU HD11 H 1 0.922 0.030 . 1 . . . . 30 LEU HD1 . 11483 1
281 . 1 1 30 30 LEU HD12 H 1 0.922 0.030 . 1 . . . . 30 LEU HD1 . 11483 1
282 . 1 1 30 30 LEU HD13 H 1 0.922 0.030 . 1 . . . . 30 LEU HD1 . 11483 1
283 . 1 1 30 30 LEU HD21 H 1 0.858 0.030 . 1 . . . . 30 LEU HD2 . 11483 1
284 . 1 1 30 30 LEU HD22 H 1 0.858 0.030 . 1 . . . . 30 LEU HD2 . 11483 1
285 . 1 1 30 30 LEU HD23 H 1 0.858 0.030 . 1 . . . . 30 LEU HD2 . 11483 1
286 . 1 1 30 30 LEU HG H 1 1.829 0.030 . 1 . . . . 30 LEU HG . 11483 1
287 . 1 1 30 30 LEU C C 13 178.991 0.300 . 1 . . . . 30 LEU C . 11483 1
288 . 1 1 30 30 LEU CA C 13 57.031 0.300 . 1 . . . . 30 LEU CA . 11483 1
289 . 1 1 30 30 LEU CB C 13 41.639 0.300 . 1 . . . . 30 LEU CB . 11483 1
290 . 1 1 30 30 LEU CD1 C 13 25.199 0.300 . 2 . . . . 30 LEU CD1 . 11483 1
291 . 1 1 30 30 LEU CD2 C 13 22.753 0.300 . 2 . . . . 30 LEU CD2 . 11483 1
292 . 1 1 30 30 LEU CG C 13 26.635 0.300 . 1 . . . . 30 LEU CG . 11483 1
293 . 1 1 30 30 LEU N N 15 118.406 0.300 . 1 . . . . 30 LEU N . 11483 1
294 . 1 1 31 31 LEU H H 1 7.687 0.030 . 1 . . . . 31 LEU H . 11483 1
295 . 1 1 31 31 LEU HA H 1 4.066 0.030 . 1 . . . . 31 LEU HA . 11483 1
296 . 1 1 31 31 LEU HB2 H 1 1.445 0.030 . 2 . . . . 31 LEU HB2 . 11483 1
297 . 1 1 31 31 LEU HB3 H 1 1.266 0.030 . 2 . . . . 31 LEU HB3 . 11483 1
298 . 1 1 31 31 LEU HD11 H 1 0.826 0.030 . 1 . . . . 31 LEU HD1 . 11483 1
299 . 1 1 31 31 LEU HD12 H 1 0.826 0.030 . 1 . . . . 31 LEU HD1 . 11483 1
300 . 1 1 31 31 LEU HD13 H 1 0.826 0.030 . 1 . . . . 31 LEU HD1 . 11483 1
301 . 1 1 31 31 LEU HD21 H 1 0.759 0.030 . 1 . . . . 31 LEU HD2 . 11483 1
302 . 1 1 31 31 LEU HD22 H 1 0.759 0.030 . 1 . . . . 31 LEU HD2 . 11483 1
303 . 1 1 31 31 LEU HD23 H 1 0.759 0.030 . 1 . . . . 31 LEU HD2 . 11483 1
304 . 1 1 31 31 LEU HG H 1 1.618 0.030 . 1 . . . . 31 LEU HG . 11483 1
305 . 1 1 31 31 LEU C C 13 178.992 0.300 . 1 . . . . 31 LEU C . 11483 1
306 . 1 1 31 31 LEU CA C 13 56.195 0.300 . 1 . . . . 31 LEU CA . 11483 1
307 . 1 1 31 31 LEU CB C 13 41.121 0.300 . 1 . . . . 31 LEU CB . 11483 1
308 . 1 1 31 31 LEU CD1 C 13 25.196 0.300 . 2 . . . . 31 LEU CD1 . 11483 1
309 . 1 1 31 31 LEU CD2 C 13 22.756 0.300 . 2 . . . . 31 LEU CD2 . 11483 1
310 . 1 1 31 31 LEU CG C 13 26.705 0.300 . 1 . . . . 31 LEU CG . 11483 1
311 . 1 1 31 31 LEU N N 15 117.712 0.300 . 1 . . . . 31 LEU N . 11483 1
312 . 1 1 32 32 HIS H H 1 7.315 0.030 . 1 . . . . 32 HIS H . 11483 1
313 . 1 1 32 32 HIS HA H 1 4.724 0.030 . 1 . . . . 32 HIS HA . 11483 1
314 . 1 1 32 32 HIS HB2 H 1 3.242 0.030 . 1 . . . . 32 HIS HB2 . 11483 1
315 . 1 1 32 32 HIS HB3 H 1 3.242 0.030 . 1 . . . . 32 HIS HB3 . 11483 1
316 . 1 1 32 32 HIS HD2 H 1 6.598 0.030 . 1 . . . . 32 HIS HD2 . 11483 1
317 . 1 1 32 32 HIS HE1 H 1 8.019 0.030 . 1 . . . . 32 HIS HE1 . 11483 1
318 . 1 1 32 32 HIS C C 13 175.636 0.300 . 1 . . . . 32 HIS C . 11483 1
319 . 1 1 32 32 HIS CA C 13 56.036 0.300 . 1 . . . . 32 HIS CA . 11483 1
320 . 1 1 32 32 HIS CB C 13 29.068 0.300 . 1 . . . . 32 HIS CB . 11483 1
321 . 1 1 32 32 HIS CD2 C 13 127.259 0.300 . 1 . . . . 32 HIS CD2 . 11483 1
322 . 1 1 32 32 HIS CE1 C 13 139.915 0.300 . 1 . . . . 32 HIS CE1 . 11483 1
323 . 1 1 32 32 HIS N N 15 115.827 0.300 . 1 . . . . 32 HIS N . 11483 1
324 . 1 1 33 33 THR H H 1 7.811 0.030 . 1 . . . . 33 THR H . 11483 1
325 . 1 1 33 33 THR HA H 1 4.369 0.030 . 1 . . . . 33 THR HA . 11483 1
326 . 1 1 33 33 THR HB H 1 4.307 0.030 . 1 . . . . 33 THR HB . 11483 1
327 . 1 1 33 33 THR HG21 H 1 1.220 0.030 . 1 . . . . 33 THR HG2 . 11483 1
328 . 1 1 33 33 THR HG22 H 1 1.220 0.030 . 1 . . . . 33 THR HG2 . 11483 1
329 . 1 1 33 33 THR HG23 H 1 1.220 0.030 . 1 . . . . 33 THR HG2 . 11483 1
330 . 1 1 33 33 THR C C 13 174.380 0.300 . 1 . . . . 33 THR C . 11483 1
331 . 1 1 33 33 THR CA C 13 62.047 0.300 . 1 . . . . 33 THR CA . 11483 1
332 . 1 1 33 33 THR CB C 13 69.859 0.300 . 1 . . . . 33 THR CB . 11483 1
333 . 1 1 33 33 THR CG2 C 13 21.583 0.300 . 1 . . . . 33 THR CG2 . 11483 1
334 . 1 1 33 33 THR N N 15 113.102 0.300 . 1 . . . . 33 THR N . 11483 1
335 . 1 1 34 34 ALA H H 1 8.213 0.030 . 1 . . . . 34 ALA H . 11483 1
336 . 1 1 34 34 ALA HA H 1 4.365 0.030 . 1 . . . . 34 ALA HA . 11483 1
337 . 1 1 34 34 ALA HB1 H 1 1.409 0.030 . 1 . . . . 34 ALA HB . 11483 1
338 . 1 1 34 34 ALA HB2 H 1 1.409 0.030 . 1 . . . . 34 ALA HB . 11483 1
339 . 1 1 34 34 ALA HB3 H 1 1.409 0.030 . 1 . . . . 34 ALA HB . 11483 1
340 . 1 1 34 34 ALA C C 13 177.416 0.300 . 1 . . . . 34 ALA C . 11483 1
341 . 1 1 34 34 ALA CA C 13 52.811 0.300 . 1 . . . . 34 ALA CA . 11483 1
342 . 1 1 34 34 ALA CB C 13 19.272 0.300 . 1 . . . . 34 ALA CB . 11483 1
343 . 1 1 34 34 ALA N N 15 125.704 0.300 . 1 . . . . 34 ALA N . 11483 1
344 . 1 1 35 35 ASP H H 1 8.191 0.030 . 1 . . . . 35 ASP H . 11483 1
345 . 1 1 35 35 ASP HA H 1 4.627 0.030 . 1 . . . . 35 ASP HA . 11483 1
346 . 1 1 35 35 ASP HB2 H 1 2.726 0.030 . 2 . . . . 35 ASP HB2 . 11483 1
347 . 1 1 35 35 ASP HB3 H 1 2.603 0.030 . 2 . . . . 35 ASP HB3 . 11483 1
348 . 1 1 35 35 ASP C C 13 175.646 0.300 . 1 . . . . 35 ASP C . 11483 1
349 . 1 1 35 35 ASP CA C 13 54.450 0.300 . 1 . . . . 35 ASP CA . 11483 1
350 . 1 1 35 35 ASP CB C 13 41.384 0.300 . 1 . . . . 35 ASP CB . 11483 1
351 . 1 1 35 35 ASP N N 15 119.361 0.300 . 1 . . . . 35 ASP N . 11483 1
stop_
save_