Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30164
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_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' . . . 30164 1
3 '2D 1H-15N HSQC' . . . 30164 1
6 '2D 1H-13C HSQC' . . . 30164 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 30164 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 ASP HA H 1 4.319 0.000 . . . . . . A 1 ASP HA . 30164 1
2 . 1 . 1 1 1 ASP HB2 H 1 2.946 0.000 . . . . . . A 1 ASP HB2 . 30164 1
3 . 1 . 1 1 1 ASP HB3 H 1 2.751 0.000 . . . . . . A 1 ASP HB3 . 30164 1
4 . 1 . 1 1 1 ASP CA C 13 52.997 0.000 . . . . . . A 1 ASP CA . 30164 1
5 . 1 . 1 1 1 ASP CB C 13 40.789 0.000 . . . . . . A 1 ASP CB . 30164 1
6 . 1 . 1 2 2 CYS H H 1 8.632 0.000 . . . . . . A 2 CYS H . 30164 1
7 . 1 . 1 2 2 CYS HA H 1 4.610 0.002 . . . . . . A 2 CYS HA . 30164 1
8 . 1 . 1 2 2 CYS HB2 H 1 3.030 0.006 . . . . . . A 2 CYS HB2 . 30164 1
9 . 1 . 1 2 2 CYS HB3 H 1 2.696 0.005 . . . . . . A 2 CYS HB3 . 30164 1
10 . 1 . 1 2 2 CYS CA C 13 54.571 0.000 . . . . . . A 2 CYS CA . 30164 1
11 . 1 . 1 2 2 CYS CB C 13 41.488 0.000 . . . . . . A 2 CYS CB . 30164 1
12 . 1 . 1 2 2 CYS N N 15 117.848 0.000 . . . . . . A 2 CYS N . 30164 1
13 . 1 . 1 3 3 ARG H H 1 8.844 0.005 . . . . . . A 3 ARG H . 30164 1
14 . 1 . 1 3 3 ARG HA H 1 4.451 0.002 . . . . . . A 3 ARG HA . 30164 1
15 . 1 . 1 3 3 ARG HB2 H 1 1.959 0.005 . . . . . . A 3 ARG HB2 . 30164 1
16 . 1 . 1 3 3 ARG HB3 H 1 1.959 0.005 . . . . . . A 3 ARG HB3 . 30164 1
17 . 1 . 1 3 3 ARG HG2 H 1 1.811 0.003 . . . . . . A 3 ARG HG2 . 30164 1
18 . 1 . 1 3 3 ARG HG3 H 1 1.755 0.000 . . . . . . A 3 ARG HG3 . 30164 1
19 . 1 . 1 3 3 ARG HD2 H 1 3.273 0.000 . . . . . . A 3 ARG HD2 . 30164 1
20 . 1 . 1 3 3 ARG HD3 H 1 3.273 0.000 . . . . . . A 3 ARG HD3 . 30164 1
21 . 1 . 1 3 3 ARG HE H 1 7.235 0.000 . . . . . . A 3 ARG HE . 30164 1
22 . 1 . 1 3 3 ARG CA C 13 56.155 0.000 . . . . . . A 3 ARG CA . 30164 1
23 . 1 . 1 3 3 ARG CB C 13 32.014 0.009 . . . . . . A 3 ARG CB . 30164 1
24 . 1 . 1 3 3 ARG CG C 13 28.008 0.000 . . . . . . A 3 ARG CG . 30164 1
25 . 1 . 1 3 3 ARG N N 15 120.762 0.000 . . . . . . A 3 ARG N . 30164 1
26 . 1 . 1 4 4 TYR H H 1 8.193 0.005 . . . . . . A 4 TYR H . 30164 1
27 . 1 . 1 4 4 TYR HA H 1 4.259 0.000 . . . . . . A 4 TYR HA . 30164 1
28 . 1 . 1 4 4 TYR HB2 H 1 3.300 0.000 . . . . . . A 4 TYR HB2 . 30164 1
29 . 1 . 1 4 4 TYR HB3 H 1 2.785 0.000 . . . . . . A 4 TYR HB3 . 30164 1
30 . 1 . 1 4 4 TYR HD1 H 1 7.145 0.000 . . . . . . A 4 TYR HD1 . 30164 1
31 . 1 . 1 4 4 TYR HD2 H 1 7.145 0.000 . . . . . . A 4 TYR HD2 . 30164 1
32 . 1 . 1 4 4 TYR HE1 H 1 6.893 0.006 . . . . . . A 4 TYR HE1 . 30164 1
33 . 1 . 1 4 4 TYR HE2 H 1 6.893 0.006 . . . . . . A 4 TYR HE2 . 30164 1
34 . 1 . 1 4 4 TYR CA C 13 56.672 0.000 . . . . . . A 4 TYR CA . 30164 1
35 . 1 . 1 4 4 TYR CB C 13 38.460 0.000 . . . . . . A 4 TYR CB . 30164 1
36 . 1 . 1 4 4 TYR N N 15 120.274 0.000 . . . . . . A 4 TYR N . 30164 1
37 . 1 . 1 5 5 MET H H 1 7.693 0.004 . . . . . . A 5 MET H . 30164 1
38 . 1 . 1 5 5 MET HA H 1 3.522 0.001 . . . . . . A 5 MET HA . 30164 1
39 . 1 . 1 5 5 MET HB2 H 1 1.654 0.002 . . . . . . A 5 MET HB2 . 30164 1
40 . 1 . 1 5 5 MET HB3 H 1 1.565 0.000 . . . . . . A 5 MET HB3 . 30164 1
41 . 1 . 1 5 5 MET HG2 H 1 1.875 0.003 . . . . . . A 5 MET HG2 . 30164 1
42 . 1 . 1 5 5 MET HG3 H 1 1.724 0.006 . . . . . . A 5 MET HG3 . 30164 1
43 . 1 . 1 5 5 MET HE1 H 1 1.828 0.000 . . . . . . A 5 MET HE1 . 30164 1
44 . 1 . 1 5 5 MET HE2 H 1 1.828 0.000 . . . . . . A 5 MET HE2 . 30164 1
45 . 1 . 1 5 5 MET HE3 H 1 1.828 0.000 . . . . . . A 5 MET HE3 . 30164 1
46 . 1 . 1 5 5 MET CA C 13 57.480 0.000 . . . . . . A 5 MET CA . 30164 1
47 . 1 . 1 5 5 MET CB C 13 31.945 0.000 . . . . . . A 5 MET CB . 30164 1
48 . 1 . 1 5 5 MET CG C 13 31.035 0.000 . . . . . . A 5 MET CG . 30164 1
49 . 1 . 1 5 5 MET N N 15 119.249 0.000 . . . . . . A 5 MET N . 30164 1
50 . 1 . 1 6 6 PHE H H 1 8.985 0.003 . . . . . . A 6 PHE H . 30164 1
51 . 1 . 1 6 6 PHE HA H 1 3.761 0.005 . . . . . . A 6 PHE HA . 30164 1
52 . 1 . 1 6 6 PHE HB2 H 1 3.462 0.000 . . . . . . A 6 PHE HB2 . 30164 1
53 . 1 . 1 6 6 PHE HB3 H 1 3.146 0.000 . . . . . . A 6 PHE HB3 . 30164 1
54 . 1 . 1 6 6 PHE HD1 H 1 6.670 0.003 . . . . . . A 6 PHE HD1 . 30164 1
55 . 1 . 1 6 6 PHE HD2 H 1 6.670 0.003 . . . . . . A 6 PHE HD2 . 30164 1
56 . 1 . 1 6 6 PHE HE1 H 1 7.293 0.002 . . . . . . A 6 PHE HE1 . 30164 1
57 . 1 . 1 6 6 PHE HE2 H 1 7.293 0.002 . . . . . . A 6 PHE HE2 . 30164 1
58 . 1 . 1 6 6 PHE CA C 13 60.682 0.000 . . . . . . A 6 PHE CA . 30164 1
59 . 1 . 1 6 6 PHE CB C 13 35.953 0.000 . . . . . . A 6 PHE CB . 30164 1
60 . 1 . 1 6 6 PHE N N 15 120.686 0.000 . . . . . . A 6 PHE N . 30164 1
61 . 1 . 1 7 7 GLY H H 1 8.979 0.003 . . . . . . A 7 GLY H . 30164 1
62 . 1 . 1 7 7 GLY HA2 H 1 3.507 0.003 . . . . . . A 7 GLY HA2 . 30164 1
63 . 1 . 1 7 7 GLY HA3 H 1 4.242 0.000 . . . . . . A 7 GLY HA3 . 30164 1
64 . 1 . 1 7 7 GLY CA C 13 44.934 0.000 . . . . . . A 7 GLY CA . 30164 1
65 . 1 . 1 7 7 GLY N N 15 109.979 0.000 . . . . . . A 7 GLY N . 30164 1
66 . 1 . 1 8 8 ASP H H 1 8.595 0.000 . . . . . . A 8 ASP H . 30164 1
67 . 1 . 1 8 8 ASP HA H 1 4.922 0.000 . . . . . . A 8 ASP HA . 30164 1
68 . 1 . 1 8 8 ASP HB2 H 1 2.878 0.000 . . . . . . A 8 ASP HB2 . 30164 1
69 . 1 . 1 8 8 ASP HB3 H 1 2.727 0.000 . . . . . . A 8 ASP HB3 . 30164 1
70 . 1 . 1 8 8 ASP CA C 13 54.726 0.000 . . . . . . A 8 ASP CA . 30164 1
71 . 1 . 1 8 8 ASP CB C 13 40.133 0.000 . . . . . . A 8 ASP CB . 30164 1
72 . 1 . 1 8 8 ASP N N 15 121.953 0.000 . . . . . . A 8 ASP N . 30164 1
73 . 1 . 1 9 9 CYS H H 1 7.833 0.000 . . . . . . A 9 CYS H . 30164 1
74 . 1 . 1 9 9 CYS HA H 1 4.841 0.000 . . . . . . A 9 CYS HA . 30164 1
75 . 1 . 1 9 9 CYS HB2 H 1 3.175 0.002 . . . . . . A 9 CYS HB2 . 30164 1
76 . 1 . 1 9 9 CYS HB3 H 1 3.175 0.002 . . . . . . A 9 CYS HB3 . 30164 1
77 . 1 . 1 9 9 CYS CA C 13 54.109 0.000 . . . . . . A 9 CYS CA . 30164 1
78 . 1 . 1 9 9 CYS CB C 13 46.852 0.000 . . . . . . A 9 CYS CB . 30164 1
79 . 1 . 1 9 9 CYS N N 15 114.087 0.000 . . . . . . A 9 CYS N . 30164 1
80 . 1 . 1 10 10 GLU H H 1 9.236 0.000 . . . . . . A 10 GLU H . 30164 1
81 . 1 . 1 10 10 GLU HA H 1 4.457 0.007 . . . . . . A 10 GLU HA . 30164 1
82 . 1 . 1 10 10 GLU HB2 H 1 2.119 0.000 . . . . . . A 10 GLU HB2 . 30164 1
83 . 1 . 1 10 10 GLU HB3 H 1 1.907 0.000 . . . . . . A 10 GLU HB3 . 30164 1
84 . 1 . 1 10 10 GLU HG2 H 1 2.389 0.000 . . . . . . A 10 GLU HG2 . 30164 1
85 . 1 . 1 10 10 GLU HG3 H 1 2.389 0.000 . . . . . . A 10 GLU HG3 . 30164 1
86 . 1 . 1 10 10 GLU CA C 13 55.289 0.000 . . . . . . A 10 GLU CA . 30164 1
87 . 1 . 1 10 10 GLU CB C 13 31.407 0.000 . . . . . . A 10 GLU CB . 30164 1
88 . 1 . 1 10 10 GLU CG C 13 34.021 0.000 . . . . . . A 10 GLU CG . 30164 1
89 . 1 . 1 10 10 GLU N N 15 115.511 0.000 . . . . . . A 10 GLU N . 30164 1
90 . 1 . 1 11 11 LYS H H 1 8.050 0.000 . . . . . . A 11 LYS H . 30164 1
91 . 1 . 1 11 11 LYS HA H 1 4.677 0.003 . . . . . . A 11 LYS HA . 30164 1
92 . 1 . 1 11 11 LYS HB2 H 1 1.961 0.005 . . . . . . A 11 LYS HB2 . 30164 1
93 . 1 . 1 11 11 LYS HB3 H 1 1.873 0.000 . . . . . . A 11 LYS HB3 . 30164 1
94 . 1 . 1 11 11 LYS HG2 H 1 1.474 0.000 . . . . . . A 11 LYS HG2 . 30164 1
95 . 1 . 1 11 11 LYS HG3 H 1 1.118 0.000 . . . . . . A 11 LYS HG3 . 30164 1
96 . 1 . 1 11 11 LYS CA C 13 53.829 0.000 . . . . . . A 11 LYS CA . 30164 1
97 . 1 . 1 11 11 LYS CB C 13 35.333 0.000 . . . . . . A 11 LYS CB . 30164 1
98 . 1 . 1 11 11 LYS CG C 13 23.699 0.000 . . . . . . A 11 LYS CG . 30164 1
99 . 1 . 1 11 11 LYS N N 15 117.326 0.000 . . . . . . A 11 LYS N . 30164 1
100 . 1 . 1 12 12 ASP H H 1 9.097 0.000 . . . . . . A 12 ASP H . 30164 1
101 . 1 . 1 12 12 ASP HA H 1 4.082 0.000 . . . . . . A 12 ASP HA . 30164 1
102 . 1 . 1 12 12 ASP HB2 H 1 2.853 0.000 . . . . . . A 12 ASP HB2 . 30164 1
103 . 1 . 1 12 12 ASP HB3 H 1 2.574 0.000 . . . . . . A 12 ASP HB3 . 30164 1
104 . 1 . 1 12 12 ASP CA C 13 59.023 0.000 . . . . . . A 12 ASP CA . 30164 1
105 . 1 . 1 12 12 ASP CB C 13 39.737 0.000 . . . . . . A 12 ASP CB . 30164 1
106 . 1 . 1 12 12 ASP N N 15 123.346 0.000 . . . . . . A 12 ASP N . 30164 1
107 . 1 . 1 13 13 GLU H H 1 8.855 0.000 . . . . . . A 13 GLU H . 30164 1
108 . 1 . 1 13 13 GLU HA H 1 4.156 0.002 . . . . . . A 13 GLU HA . 30164 1
109 . 1 . 1 13 13 GLU HB2 H 1 2.066 0.000 . . . . . . A 13 GLU HB2 . 30164 1
110 . 1 . 1 13 13 GLU HB3 H 1 2.066 0.000 . . . . . . A 13 GLU HB3 . 30164 1
111 . 1 . 1 13 13 GLU HG2 H 1 2.522 0.000 . . . . . . A 13 GLU HG2 . 30164 1
112 . 1 . 1 13 13 GLU HG3 H 1 2.413 0.000 . . . . . . A 13 GLU HG3 . 30164 1
113 . 1 . 1 13 13 GLU CA C 13 58.286 0.000 . . . . . . A 13 GLU CA . 30164 1
114 . 1 . 1 13 13 GLU CB C 13 28.038 0.000 . . . . . . A 13 GLU CB . 30164 1
115 . 1 . 1 13 13 GLU CG C 13 35.261 0.000 . . . . . . A 13 GLU CG . 30164 1
116 . 1 . 1 13 13 GLU N N 15 115.446 0.000 . . . . . . A 13 GLU N . 30164 1
117 . 1 . 1 14 14 ASP H H 1 7.703 0.000 . . . . . . A 14 ASP H . 30164 1
118 . 1 . 1 14 14 ASP HA H 1 4.447 0.000 . . . . . . A 14 ASP HA . 30164 1
119 . 1 . 1 14 14 ASP HB2 H 1 2.988 0.001 . . . . . . A 14 ASP HB2 . 30164 1
120 . 1 . 1 14 14 ASP HB3 H 1 2.871 0.000 . . . . . . A 14 ASP HB3 . 30164 1
121 . 1 . 1 14 14 ASP CA C 13 55.796 0.000 . . . . . . A 14 ASP CA . 30164 1
122 . 1 . 1 14 14 ASP CB C 13 41.778 0.000 . . . . . . A 14 ASP CB . 30164 1
123 . 1 . 1 14 14 ASP N N 15 118.237 0.000 . . . . . . A 14 ASP N . 30164 1
124 . 1 . 1 15 15 CYS H H 1 8.057 0.000 . . . . . . A 15 CYS H . 30164 1
125 . 1 . 1 15 15 CYS HA H 1 5.092 0.000 . . . . . . A 15 CYS HA . 30164 1
126 . 1 . 1 15 15 CYS HB2 H 1 2.968 0.000 . . . . . . A 15 CYS HB2 . 30164 1
127 . 1 . 1 15 15 CYS HB3 H 1 2.741 0.000 . . . . . . A 15 CYS HB3 . 30164 1
128 . 1 . 1 15 15 CYS CA C 13 52.764 0.000 . . . . . . A 15 CYS CA . 30164 1
129 . 1 . 1 15 15 CYS CB C 13 39.487 0.000 . . . . . . A 15 CYS CB . 30164 1
130 . 1 . 1 15 15 CYS N N 15 113.529 0.000 . . . . . . A 15 CYS N . 30164 1
131 . 1 . 1 16 16 CYS H H 1 8.991 0.003 . . . . . . A 16 CYS H . 30164 1
132 . 1 . 1 16 16 CYS HA H 1 4.504 0.000 . . . . . . A 16 CYS HA . 30164 1
133 . 1 . 1 16 16 CYS HB2 H 1 3.232 0.000 . . . . . . A 16 CYS HB2 . 30164 1
134 . 1 . 1 16 16 CYS HB3 H 1 2.051 0.000 . . . . . . A 16 CYS HB3 . 30164 1
135 . 1 . 1 16 16 CYS CA C 13 53.223 0.000 . . . . . . A 16 CYS CA . 30164 1
136 . 1 . 1 16 16 CYS CB C 13 38.962 0.019 . . . . . . A 16 CYS CB . 30164 1
137 . 1 . 1 16 16 CYS N N 15 116.934 0.000 . . . . . . A 16 CYS N . 30164 1
138 . 1 . 1 17 17 LYS H H 1 7.818 0.000 . . . . . . A 17 LYS H . 30164 1
139 . 1 . 1 17 17 LYS HA H 1 3.897 0.000 . . . . . . A 17 LYS HA . 30164 1
140 . 1 . 1 17 17 LYS HB2 H 1 1.658 0.000 . . . . . . A 17 LYS HB2 . 30164 1
141 . 1 . 1 17 17 LYS HB3 H 1 1.507 0.000 . . . . . . A 17 LYS HB3 . 30164 1
142 . 1 . 1 17 17 LYS HG2 H 1 1.220 0.001 . . . . . . A 17 LYS HG2 . 30164 1
143 . 1 . 1 17 17 LYS HG3 H 1 1.015 0.002 . . . . . . A 17 LYS HG3 . 30164 1
144 . 1 . 1 17 17 LYS CA C 13 57.935 0.000 . . . . . . A 17 LYS CA . 30164 1
145 . 1 . 1 17 17 LYS CB C 13 32.252 0.010 . . . . . . A 17 LYS CB . 30164 1
146 . 1 . 1 17 17 LYS CG C 13 24.317 0.000 . . . . . . A 17 LYS CG . 30164 1
147 . 1 . 1 17 17 LYS N N 15 117.028 0.000 . . . . . . A 17 LYS N . 30164 1
148 . 1 . 1 18 18 HIS H H 1 8.534 0.001 . . . . . . A 18 HIS H . 30164 1
149 . 1 . 1 18 18 HIS HA H 1 4.042 0.000 . . . . . . A 18 HIS HA . 30164 1
150 . 1 . 1 18 18 HIS HB2 H 1 3.696 0.001 . . . . . . A 18 HIS HB2 . 30164 1
151 . 1 . 1 18 18 HIS HB3 H 1 3.207 0.000 . . . . . . A 18 HIS HB3 . 30164 1
152 . 1 . 1 18 18 HIS HD2 H 1 7.069 0.000 . . . . . . A 18 HIS HD2 . 30164 1
153 . 1 . 1 18 18 HIS HE1 H 1 7.207 0.002 . . . . . . A 18 HIS HE1 . 30164 1
154 . 1 . 1 18 18 HIS CA C 13 59.114 0.000 . . . . . . A 18 HIS CA . 30164 1
155 . 1 . 1 18 18 HIS CB C 13 27.190 0.000 . . . . . . A 18 HIS CB . 30164 1
156 . 1 . 1 18 18 HIS N N 15 113.613 0.000 . . . . . . A 18 HIS N . 30164 1
157 . 1 . 1 19 19 LEU H H 1 8.091 0.000 . . . . . . A 19 LEU H . 30164 1
158 . 1 . 1 19 19 LEU HA H 1 4.825 0.000 . . . . . . A 19 LEU HA . 30164 1
159 . 1 . 1 19 19 LEU HB2 H 1 2.021 0.000 . . . . . . A 19 LEU HB2 . 30164 1
160 . 1 . 1 19 19 LEU HB3 H 1 1.049 0.000 . . . . . . A 19 LEU HB3 . 30164 1
161 . 1 . 1 19 19 LEU HG H 1 1.204 0.001 . . . . . . A 19 LEU HG . 30164 1
162 . 1 . 1 19 19 LEU HD11 H 1 0.589 0.002 . . . . . . A 19 LEU HD11 . 30164 1
163 . 1 . 1 19 19 LEU HD12 H 1 0.589 0.002 . . . . . . A 19 LEU HD12 . 30164 1
164 . 1 . 1 19 19 LEU HD13 H 1 0.589 0.002 . . . . . . A 19 LEU HD13 . 30164 1
165 . 1 . 1 19 19 LEU HD21 H 1 0.160 0.001 . . . . . . A 19 LEU HD21 . 30164 1
166 . 1 . 1 19 19 LEU HD22 H 1 0.160 0.001 . . . . . . A 19 LEU HD22 . 30164 1
167 . 1 . 1 19 19 LEU HD23 H 1 0.160 0.001 . . . . . . A 19 LEU HD23 . 30164 1
168 . 1 . 1 19 19 LEU CA C 13 54.105 0.000 . . . . . . A 19 LEU CA . 30164 1
169 . 1 . 1 19 19 LEU CG C 13 27.323 0.000 . . . . . . A 19 LEU CG . 30164 1
170 . 1 . 1 19 19 LEU N N 15 118.893 0.000 . . . . . . A 19 LEU N . 30164 1
171 . 1 . 1 20 20 GLY H H 1 8.743 0.000 . . . . . . A 20 GLY H . 30164 1
172 . 1 . 1 20 20 GLY HA2 H 1 3.404 0.000 . . . . . . A 20 GLY HA2 . 30164 1
173 . 1 . 1 20 20 GLY HA3 H 1 4.188 0.003 . . . . . . A 20 GLY HA3 . 30164 1
174 . 1 . 1 20 20 GLY CA C 13 43.116 0.000 . . . . . . A 20 GLY CA . 30164 1
175 . 1 . 1 20 20 GLY N N 15 105.957 0.000 . . . . . . A 20 GLY N . 30164 1
176 . 1 . 1 21 21 CYS H H 1 9.358 0.000 . . . . . . A 21 CYS H . 30164 1
177 . 1 . 1 21 21 CYS HA H 1 4.665 0.000 . . . . . . A 21 CYS HA . 30164 1
178 . 1 . 1 21 21 CYS HB2 H 1 2.626 0.000 . . . . . . A 21 CYS HB2 . 30164 1
179 . 1 . 1 21 21 CYS HB3 H 1 2.470 0.000 . . . . . . A 21 CYS HB3 . 30164 1
180 . 1 . 1 21 21 CYS CA C 13 54.690 0.000 . . . . . . A 21 CYS CA . 30164 1
181 . 1 . 1 21 21 CYS CB C 13 39.334 0.000 . . . . . . A 21 CYS CB . 30164 1
182 . 1 . 1 21 21 CYS N N 15 120.831 0.000 . . . . . . A 21 CYS N . 30164 1
183 . 1 . 1 22 22 LYS H H 1 8.570 0.000 . . . . . . A 22 LYS H . 30164 1
184 . 1 . 1 22 22 LYS HA H 1 4.195 0.000 . . . . . . A 22 LYS HA . 30164 1
185 . 1 . 1 22 22 LYS HB2 H 1 1.714 0.007 . . . . . . A 22 LYS HB2 . 30164 1
186 . 1 . 1 22 22 LYS HB3 H 1 1.489 0.008 . . . . . . A 22 LYS HB3 . 30164 1
187 . 1 . 1 22 22 LYS HG2 H 1 1.438 0.005 . . . . . . A 22 LYS HG2 . 30164 1
188 . 1 . 1 22 22 LYS HG3 H 1 1.375 0.008 . . . . . . A 22 LYS HG3 . 30164 1
189 . 1 . 1 22 22 LYS CA C 13 55.889 0.000 . . . . . . A 22 LYS CA . 30164 1
190 . 1 . 1 22 22 LYS CB C 13 31.312 0.000 . . . . . . A 22 LYS CB . 30164 1
191 . 1 . 1 22 22 LYS CG C 13 24.839 0.000 . . . . . . A 22 LYS CG . 30164 1
192 . 1 . 1 22 22 LYS N N 15 132.183 0.000 . . . . . . A 22 LYS N . 30164 1
193 . 1 . 1 23 23 ARG H H 1 8.424 0.002 . . . . . . A 23 ARG H . 30164 1
194 . 1 . 1 23 23 ARG HA H 1 3.803 0.000 . . . . . . A 23 ARG HA . 30164 1
195 . 1 . 1 23 23 ARG HB2 H 1 1.809 0.003 . . . . . . A 23 ARG HB2 . 30164 1
196 . 1 . 1 23 23 ARG HB3 H 1 1.725 0.000 . . . . . . A 23 ARG HB3 . 30164 1
197 . 1 . 1 23 23 ARG HG2 H 1 1.628 0.007 . . . . . . A 23 ARG HG2 . 30164 1
198 . 1 . 1 23 23 ARG HG3 H 1 1.628 0.007 . . . . . . A 23 ARG HG3 . 30164 1
199 . 1 . 1 23 23 ARG HD2 H 1 3.206 0.000 . . . . . . A 23 ARG HD2 . 30164 1
200 . 1 . 1 23 23 ARG HD3 H 1 3.206 0.000 . . . . . . A 23 ARG HD3 . 30164 1
201 . 1 . 1 23 23 ARG HE H 1 7.260 0.000 . . . . . . A 23 ARG HE . 30164 1
202 . 1 . 1 23 23 ARG CA C 13 59.149 0.000 . . . . . . A 23 ARG CA . 30164 1
203 . 1 . 1 23 23 ARG CB C 13 29.830 0.000 . . . . . . A 23 ARG CB . 30164 1
204 . 1 . 1 23 23 ARG CG C 13 27.543 0.000 . . . . . . A 23 ARG CG . 30164 1
205 . 1 . 1 23 23 ARG N N 15 126.851 0.000 . . . . . . A 23 ARG N . 30164 1
206 . 1 . 1 24 24 LYS H H 1 8.838 0.001 . . . . . . A 24 LYS H . 30164 1
207 . 1 . 1 24 24 LYS HA H 1 4.025 0.000 . . . . . . A 24 LYS HA . 30164 1
208 . 1 . 1 24 24 LYS HB2 H 1 1.904 0.000 . . . . . . A 24 LYS HB2 . 30164 1
209 . 1 . 1 24 24 LYS HB3 H 1 1.904 0.000 . . . . . . A 24 LYS HB3 . 30164 1
210 . 1 . 1 24 24 LYS CA C 13 57.523 0.000 . . . . . . A 24 LYS CA . 30164 1
211 . 1 . 1 24 24 LYS CB C 13 31.880 0.000 . . . . . . A 24 LYS CB . 30164 1
212 . 1 . 1 24 24 LYS CG C 13 25.275 0.000 . . . . . . A 24 LYS CG . 30164 1
213 . 1 . 1 24 24 LYS N N 15 117.429 0.000 . . . . . . A 24 LYS N . 30164 1
214 . 1 . 1 25 25 MET H H 1 7.424 0.001 . . . . . . A 25 MET H . 30164 1
215 . 1 . 1 25 25 MET HA H 1 4.371 0.005 . . . . . . A 25 MET HA . 30164 1
216 . 1 . 1 25 25 MET HB2 H 1 1.830 0.000 . . . . . . A 25 MET HB2 . 30164 1
217 . 1 . 1 25 25 MET HB3 H 1 1.154 0.003 . . . . . . A 25 MET HB3 . 30164 1
218 . 1 . 1 25 25 MET HG2 H 1 2.546 0.002 . . . . . . A 25 MET HG2 . 30164 1
219 . 1 . 1 25 25 MET HG3 H 1 2.403 0.001 . . . . . . A 25 MET HG3 . 30164 1
220 . 1 . 1 25 25 MET HE1 H 1 2.142 0.000 . . . . . . A 25 MET HE1 . 30164 1
221 . 1 . 1 25 25 MET HE2 H 1 2.142 0.000 . . . . . . A 25 MET HE2 . 30164 1
222 . 1 . 1 25 25 MET HE3 H 1 2.142 0.000 . . . . . . A 25 MET HE3 . 30164 1
223 . 1 . 1 25 25 MET CA C 13 55.357 0.000 . . . . . . A 25 MET CA . 30164 1
224 . 1 . 1 25 25 MET CB C 13 32.472 0.000 . . . . . . A 25 MET CB . 30164 1
225 . 1 . 1 25 25 MET CG C 13 32.760 0.000 . . . . . . A 25 MET CG . 30164 1
226 . 1 . 1 25 25 MET N N 15 115.564 0.000 . . . . . . A 25 MET N . 30164 1
227 . 1 . 1 26 26 LYS H H 1 8.060 0.000 . . . . . . A 26 LYS H . 30164 1
228 . 1 . 1 26 26 LYS HA H 1 3.716 0.000 . . . . . . A 26 LYS HA . 30164 1
229 . 1 . 1 26 26 LYS HB2 H 1 2.316 0.000 . . . . . . A 26 LYS HB2 . 30164 1
230 . 1 . 1 26 26 LYS HB3 H 1 2.024 0.005 . . . . . . A 26 LYS HB3 . 30164 1
231 . 1 . 1 26 26 LYS HG2 H 1 1.327 0.000 . . . . . . A 26 LYS HG2 . 30164 1
232 . 1 . 1 26 26 LYS HG3 H 1 1.327 0.000 . . . . . . A 26 LYS HG3 . 30164 1
233 . 1 . 1 26 26 LYS CA C 13 56.944 0.000 . . . . . . A 26 LYS CA . 30164 1
234 . 1 . 1 26 26 LYS CB C 13 28.417 0.025 . . . . . . A 26 LYS CB . 30164 1
235 . 1 . 1 26 26 LYS CG C 13 24.717 0.000 . . . . . . A 26 LYS CG . 30164 1
236 . 1 . 1 26 26 LYS N N 15 118.153 0.000 . . . . . . A 26 LYS N . 30164 1
237 . 1 . 1 27 27 TYR H H 1 6.733 0.000 . . . . . . A 27 TYR H . 30164 1
238 . 1 . 1 27 27 TYR HA H 1 5.632 0.000 . . . . . . A 27 TYR HA . 30164 1
239 . 1 . 1 27 27 TYR HB2 H 1 2.888 0.000 . . . . . . A 27 TYR HB2 . 30164 1
240 . 1 . 1 27 27 TYR HB3 H 1 2.725 0.000 . . . . . . A 27 TYR HB3 . 30164 1
241 . 1 . 1 27 27 TYR HD1 H 1 7.020 0.000 . . . . . . A 27 TYR HD1 . 30164 1
242 . 1 . 1 27 27 TYR HD2 H 1 7.020 0.000 . . . . . . A 27 TYR HD2 . 30164 1
243 . 1 . 1 27 27 TYR HE1 H 1 6.790 0.000 . . . . . . A 27 TYR HE1 . 30164 1
244 . 1 . 1 27 27 TYR HE2 H 1 6.790 0.000 . . . . . . A 27 TYR HE2 . 30164 1
245 . 1 . 1 27 27 TYR CA C 13 55.339 0.000 . . . . . . A 27 TYR CA . 30164 1
246 . 1 . 1 27 27 TYR CB C 13 41.320 0.000 . . . . . . A 27 TYR CB . 30164 1
247 . 1 . 1 27 27 TYR N N 15 110.698 0.000 . . . . . . A 27 TYR N . 30164 1
248 . 1 . 1 28 28 CYS H H 1 8.947 0.000 . . . . . . A 28 CYS H . 30164 1
249 . 1 . 1 28 28 CYS HA H 1 5.045 0.001 . . . . . . A 28 CYS HA . 30164 1
250 . 1 . 1 28 28 CYS HB2 H 1 2.966 0.000 . . . . . . A 28 CYS HB2 . 30164 1
251 . 1 . 1 28 28 CYS HB3 H 1 2.459 0.000 . . . . . . A 28 CYS HB3 . 30164 1
252 . 1 . 1 28 28 CYS CA C 13 55.158 0.000 . . . . . . A 28 CYS CA . 30164 1
253 . 1 . 1 28 28 CYS CB C 13 40.787 0.000 . . . . . . A 28 CYS CB . 30164 1
254 . 1 . 1 28 28 CYS N N 15 119.882 0.000 . . . . . . A 28 CYS N . 30164 1
255 . 1 . 1 29 29 ALA H H 1 9.589 0.000 . . . . . . A 29 ALA H . 30164 1
256 . 1 . 1 29 29 ALA HA H 1 4.756 0.000 . . . . . . A 29 ALA HA . 30164 1
257 . 1 . 1 29 29 ALA HB1 H 1 1.475 0.003 . . . . . . A 29 ALA HB1 . 30164 1
258 . 1 . 1 29 29 ALA HB2 H 1 1.475 0.003 . . . . . . A 29 ALA HB2 . 30164 1
259 . 1 . 1 29 29 ALA HB3 H 1 1.475 0.003 . . . . . . A 29 ALA HB3 . 30164 1
260 . 1 . 1 29 29 ALA CA C 13 52.744 0.000 . . . . . . A 29 ALA CA . 30164 1
261 . 1 . 1 29 29 ALA CB C 13 23.142 0.000 . . . . . . A 29 ALA CB . 30164 1
262 . 1 . 1 29 29 ALA N N 15 125.923 0.000 . . . . . . A 29 ALA N . 30164 1
263 . 1 . 1 30 30 TRP H H 1 7.938 0.001 . . . . . . A 30 TRP H . 30164 1
264 . 1 . 1 30 30 TRP HA H 1 4.559 0.000 . . . . . . A 30 TRP HA . 30164 1
265 . 1 . 1 30 30 TRP HB2 H 1 3.082 0.000 . . . . . . A 30 TRP HB2 . 30164 1
266 . 1 . 1 30 30 TRP HB3 H 1 2.987 0.000 . . . . . . A 30 TRP HB3 . 30164 1
267 . 1 . 1 30 30 TRP HD1 H 1 6.866 0.000 . . . . . . A 30 TRP HD1 . 30164 1
268 . 1 . 1 30 30 TRP HE1 H 1 10.072 0.000 . . . . . . A 30 TRP HE1 . 30164 1
269 . 1 . 1 30 30 TRP HE3 H 1 7.574 0.000 . . . . . . A 30 TRP HE3 . 30164 1
270 . 1 . 1 30 30 TRP HZ3 H 1 7.109 0.004 . . . . . . A 30 TRP HZ3 . 30164 1
271 . 1 . 1 30 30 TRP HH2 H 1 7.343 0.003 . . . . . . A 30 TRP HH2 . 30164 1
272 . 1 . 1 30 30 TRP CA C 13 58.454 0.000 . . . . . . A 30 TRP CA . 30164 1
273 . 1 . 1 30 30 TRP CB C 13 29.677 0.018 . . . . . . A 30 TRP CB . 30164 1
274 . 1 . 1 30 30 TRP N N 15 122.227 0.000 . . . . . . A 30 TRP N . 30164 1
275 . 1 . 1 31 31 ASP H H 1 8.461 0.000 . . . . . . A 31 ASP H . 30164 1
276 . 1 . 1 31 31 ASP HA H 1 4.628 0.000 . . . . . . A 31 ASP HA . 30164 1
277 . 1 . 1 31 31 ASP HB2 H 1 2.507 0.000 . . . . . . A 31 ASP HB2 . 30164 1
278 . 1 . 1 31 31 ASP HB3 H 1 2.507 0.000 . . . . . . A 31 ASP HB3 . 30164 1
279 . 1 . 1 31 31 ASP CA C 13 53.053 0.000 . . . . . . A 31 ASP CA . 30164 1
280 . 1 . 1 31 31 ASP CB C 13 39.725 0.000 . . . . . . A 31 ASP CB . 30164 1
281 . 1 . 1 31 31 ASP N N 15 123.438 0.000 . . . . . . A 31 ASP N . 30164 1
282 . 1 . 1 32 32 PHE H H 1 7.978 0.004 . . . . . . A 32 PHE H . 30164 1
283 . 1 . 1 32 32 PHE HA H 1 4.531 0.000 . . . . . . A 32 PHE HA . 30164 1
284 . 1 . 1 32 32 PHE HB2 H 1 3.035 0.000 . . . . . . A 32 PHE HB2 . 30164 1
285 . 1 . 1 32 32 PHE HB3 H 1 3.035 0.000 . . . . . . A 32 PHE HB3 . 30164 1
286 . 1 . 1 32 32 PHE HD1 H 1 7.254 0.005 . . . . . . A 32 PHE HD1 . 30164 1
287 . 1 . 1 32 32 PHE HD2 H 1 7.254 0.005 . . . . . . A 32 PHE HD2 . 30164 1
288 . 1 . 1 32 32 PHE CA C 13 58.181 0.000 . . . . . . A 32 PHE CA . 30164 1
289 . 1 . 1 32 32 PHE CB C 13 42.003 0.000 . . . . . . A 32 PHE CB . 30164 1
290 . 1 . 1 32 32 PHE N N 15 119.649 0.000 . . . . . . A 32 PHE N . 30164 1
291 . 1 . 1 33 33 THR H H 1 7.970 0.000 . . . . . . A 33 THR H . 30164 1
292 . 1 . 1 33 33 THR HA H 1 4.243 0.000 . . . . . . A 33 THR HA . 30164 1
293 . 1 . 1 33 33 THR HB H 1 4.109 0.003 . . . . . . A 33 THR HB . 30164 1
294 . 1 . 1 33 33 THR HG21 H 1 1.041 0.000 . . . . . . A 33 THR HG21 . 30164 1
295 . 1 . 1 33 33 THR HG22 H 1 1.041 0.000 . . . . . . A 33 THR HG22 . 30164 1
296 . 1 . 1 33 33 THR HG23 H 1 1.041 0.000 . . . . . . A 33 THR HG23 . 30164 1
297 . 1 . 1 33 33 THR CA C 13 62.136 0.000 . . . . . . A 33 THR CA . 30164 1
298 . 1 . 1 33 33 THR CB C 13 69.508 0.000 . . . . . . A 33 THR CB . 30164 1
299 . 1 . 1 33 33 THR N N 15 114.027 0.000 . . . . . . A 33 THR N . 30164 1
300 . 1 . 1 34 34 PHE H H 1 7.942 0.000 . . . . . . A 34 PHE H . 30164 1
301 . 1 . 1 34 34 PHE HA H 1 4.645 0.005 . . . . . . A 34 PHE HA . 30164 1
302 . 1 . 1 34 34 PHE HB2 H 1 3.099 0.000 . . . . . . A 34 PHE HB2 . 30164 1
303 . 1 . 1 34 34 PHE HB3 H 1 2.976 0.000 . . . . . . A 34 PHE HB3 . 30164 1
304 . 1 . 1 34 34 PHE HD1 H 1 7.179 0.007 . . . . . . A 34 PHE HD1 . 30164 1
305 . 1 . 1 34 34 PHE HD2 H 1 7.179 0.007 . . . . . . A 34 PHE HD2 . 30164 1
306 . 1 . 1 34 34 PHE CA C 13 57.465 0.000 . . . . . . A 34 PHE CA . 30164 1
307 . 1 . 1 34 34 PHE CB C 13 39.286 0.022 . . . . . . A 34 PHE CB . 30164 1
308 . 1 . 1 34 34 PHE N N 15 121.026 0.000 . . . . . . A 34 PHE N . 30164 1
309 . 1 . 1 35 35 THR H H 1 7.777 0.002 . . . . . . A 35 THR H . 30164 1
310 . 1 . 1 35 35 THR HA H 1 4.174 0.000 . . . . . . A 35 THR HA . 30164 1
311 . 1 . 1 35 35 THR HB H 1 4.225 0.000 . . . . . . A 35 THR HB . 30164 1
312 . 1 . 1 35 35 THR HG21 H 1 1.138 0.000 . . . . . . A 35 THR HG21 . 30164 1
313 . 1 . 1 35 35 THR HG22 H 1 1.138 0.000 . . . . . . A 35 THR HG22 . 30164 1
314 . 1 . 1 35 35 THR HG23 H 1 1.138 0.000 . . . . . . A 35 THR HG23 . 30164 1
315 . 1 . 1 35 35 THR CA C 13 62.614 0.000 . . . . . . A 35 THR CA . 30164 1
316 . 1 . 1 35 35 THR CB C 13 70.482 0.000 . . . . . . A 35 THR CB . 30164 1
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