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 30242
_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 $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 '3D 1H-15N NOESY' . . . 30242 1
2 '3D 1H-13C NOESY' . . . 30242 1
3 '3D HNCO' . . . 30242 1
4 '3D HNCA' . . . 30242 1
5 '3D CBCA(CO)NH' . . . 30242 1
6 '2D 1H-13C HSQC' . . . 30242 1
7 '2D 1H-15N HSQC' . . . 30242 1
8 '3D HBHA(CO)NH' . . . 30242 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 THR HA H 1 3.569 0.04 . 1 . . . A 1 THR HA . 30242 1
2 . 1 1 1 1 THR HB H 1 3.631 0.04 . 1 . . . A 1 THR HB . 30242 1
3 . 1 1 1 1 THR HG21 H 1 0.971 0.04 . 1 . . . A 1 THR HG21 . 30242 1
4 . 1 1 1 1 THR HG22 H 1 0.971 0.04 . 1 . . . A 1 THR HG22 . 30242 1
5 . 1 1 1 1 THR HG23 H 1 0.971 0.04 . 1 . . . A 1 THR HG23 . 30242 1
6 . 1 1 1 1 THR CA C 13 62.379 0.40 . 1 . . . A 1 THR CA . 30242 1
7 . 1 1 1 1 THR CB C 13 71.059 0.40 . 1 . . . A 1 THR CB . 30242 1
8 . 1 1 1 1 THR CG2 C 13 21.733 0.40 . 1 . . . A 1 THR CG2 . 30242 1
9 . 1 1 2 2 GLN HA H 1 4.086 0.04 . 1 . . . A 2 GLN HA . 30242 1
10 . 1 1 2 2 GLN HB2 H 1 0.132 0.04 . 2 . . . A 2 GLN HB2 . 30242 1
11 . 1 1 2 2 GLN HB3 H 1 0.841 0.04 . 2 . . . A 2 GLN HB3 . 30242 1
12 . 1 1 2 2 GLN HG2 H 1 1.715 0.04 . 2 . . . A 2 GLN HG2 . 30242 1
13 . 1 1 2 2 GLN HG3 H 1 1.715 0.04 . 2 . . . A 2 GLN HG3 . 30242 1
14 . 1 1 2 2 GLN C C 13 173.066 0.40 . 1 . . . A 2 GLN C . 30242 1
15 . 1 1 2 2 GLN CA C 13 54.297 0.40 . 1 . . . A 2 GLN CA . 30242 1
16 . 1 1 2 2 GLN CB C 13 30.514 0.40 . 1 . . . A 2 GLN CB . 30242 1
17 . 1 1 2 2 GLN CG C 13 34.079 0.40 . 1 . . . A 2 GLN CG . 30242 1
18 . 1 1 3 3 THR H H 1 7.712 0.04 . 1 . . . A 3 THR H . 30242 1
19 . 1 1 3 3 THR HA H 1 5.452 0.04 . 1 . . . A 3 THR HA . 30242 1
20 . 1 1 3 3 THR HB H 1 3.703 0.04 . 1 . . . A 3 THR HB . 30242 1
21 . 1 1 3 3 THR HG21 H 1 0.908 0.04 . 1 . . . A 3 THR HG21 . 30242 1
22 . 1 1 3 3 THR HG22 H 1 0.908 0.04 . 1 . . . A 3 THR HG22 . 30242 1
23 . 1 1 3 3 THR HG23 H 1 0.908 0.04 . 1 . . . A 3 THR HG23 . 30242 1
24 . 1 1 3 3 THR C C 13 173.133 0.40 . 1 . . . A 3 THR C . 30242 1
25 . 1 1 3 3 THR CA C 13 60.232 0.40 . 1 . . . A 3 THR CA . 30242 1
26 . 1 1 3 3 THR CB C 13 71.752 0.40 . 1 . . . A 3 THR CB . 30242 1
27 . 1 1 3 3 THR CG2 C 13 20.297 0.40 . 1 . . . A 3 THR CG2 . 30242 1
28 . 1 1 3 3 THR N N 15 112.539 0.40 . 1 . . . A 3 THR N . 30242 1
29 . 1 1 4 4 GLN H H 1 9.109 0.04 . 1 . . . A 4 GLN H . 30242 1
30 . 1 1 4 4 GLN HA H 1 4.428 0.04 . 1 . . . A 4 GLN HA . 30242 1
31 . 1 1 4 4 GLN HB2 H 1 1.885 0.04 . 2 . . . A 4 GLN HB2 . 30242 1
32 . 1 1 4 4 GLN HB3 H 1 2.132 0.04 . 2 . . . A 4 GLN HB3 . 30242 1
33 . 1 1 4 4 GLN HG2 H 1 1.964 0.04 . 2 . . . A 4 GLN HG2 . 30242 1
34 . 1 1 4 4 GLN HG3 H 1 2.120 0.04 . 2 . . . A 4 GLN HG3 . 30242 1
35 . 1 1 4 4 GLN C C 13 173.066 0.40 . 1 . . . A 4 GLN C . 30242 1
36 . 1 1 4 4 GLN CA C 13 55.422 0.40 . 1 . . . A 4 GLN CA . 30242 1
37 . 1 1 4 4 GLN CB C 13 32.661 0.40 . 1 . . . A 4 GLN CB . 30242 1
38 . 1 1 4 4 GLN CG C 13 34.025 0.40 . 1 . . . A 4 GLN CG . 30242 1
39 . 1 1 4 4 GLN N N 15 125.603 0.40 . 1 . . . A 4 GLN N . 30242 1
40 . 1 1 5 5 GLU H H 1 8.268 0.04 . 1 . . . A 5 GLU H . 30242 1
41 . 1 1 5 5 GLU HA H 1 5.263 0.04 . 1 . . . A 5 GLU HA . 30242 1
42 . 1 1 5 5 GLU HB2 H 1 1.760 0.04 . 2 . . . A 5 GLU HB2 . 30242 1
43 . 1 1 5 5 GLU HB3 H 1 1.760 0.04 . 2 . . . A 5 GLU HB3 . 30242 1
44 . 1 1 5 5 GLU HG2 H 1 1.966 0.04 . 2 . . . A 5 GLU HG2 . 30242 1
45 . 1 1 5 5 GLU HG3 H 1 2.076 0.04 . 2 . . . A 5 GLU HG3 . 30242 1
46 . 1 1 5 5 GLU C C 13 175.087 0.40 . 1 . . . A 5 GLU C . 30242 1
47 . 1 1 5 5 GLU CA C 13 54.836 0.40 . 1 . . . A 5 GLU CA . 30242 1
48 . 1 1 5 5 GLU CB C 13 32.907 0.40 . 1 . . . A 5 GLU CB . 30242 1
49 . 1 1 5 5 GLU CG C 13 37.064 0.40 . 1 . . . A 5 GLU CG . 30242 1
50 . 1 1 5 5 GLU N N 15 123.204 0.40 . 1 . . . A 5 GLU N . 30242 1
51 . 1 1 6 6 PHE H H 1 9.310 0.04 . 1 . . . A 6 PHE H . 30242 1
52 . 1 1 6 6 PHE HA H 1 4.870 0.04 . 1 . . . A 6 PHE HA . 30242 1
53 . 1 1 6 6 PHE HB2 H 1 2.727 0.04 . 2 . . . A 6 PHE HB2 . 30242 1
54 . 1 1 6 6 PHE HB3 H 1 3.349 0.04 . 2 . . . A 6 PHE HB3 . 30242 1
55 . 1 1 6 6 PHE HD1 H 1 7.156 0.04 . 3 . . . A 6 PHE HD1 . 30242 1
56 . 1 1 6 6 PHE HD2 H 1 7.156 0.04 . 3 . . . A 6 PHE HD2 . 30242 1
57 . 1 1 6 6 PHE HE1 H 1 7.091 0.04 . 3 . . . A 6 PHE HE1 . 30242 1
58 . 1 1 6 6 PHE HE2 H 1 7.091 0.04 . 3 . . . A 6 PHE HE2 . 30242 1
59 . 1 1 6 6 PHE HZ H 1 6.995 0.04 . 1 . . . A 6 PHE HZ . 30242 1
60 . 1 1 6 6 PHE CA C 13 56.736 0.40 . 1 . . . A 6 PHE CA . 30242 1
61 . 1 1 6 6 PHE CB C 13 44.285 0.40 . 1 . . . A 6 PHE CB . 30242 1
62 . 1 1 6 6 PHE CD1 C 13 132.101 0.40 . 3 . . . A 6 PHE CD1 . 30242 1
63 . 1 1 6 6 PHE CD2 C 13 132.104 0.40 . 3 . . . A 6 PHE CD2 . 30242 1
64 . 1 1 6 6 PHE CE1 C 13 130.943 0.40 . 3 . . . A 6 PHE CE1 . 30242 1
65 . 1 1 6 6 PHE CE2 C 13 130.943 0.40 . 3 . . . A 6 PHE CE2 . 30242 1
66 . 1 1 6 6 PHE CZ C 13 129.785 0.40 . 1 . . . A 6 PHE CZ . 30242 1
67 . 1 1 6 6 PHE N N 15 119.712 0.40 . 1 . . . A 6 PHE N . 30242 1
68 . 1 1 9 9 GLU HA H 1 2.066 0.04 . 1 . . . A 9 GLU HA . 30242 1
69 . 1 1 9 9 GLU HB2 H 1 0.696 0.04 . 2 . . . A 9 GLU HB2 . 30242 1
70 . 1 1 9 9 GLU HB3 H 1 1.150 0.04 . 2 . . . A 9 GLU HB3 . 30242 1
71 . 1 1 9 9 GLU HG2 H 1 1.511 0.04 . 2 . . . A 9 GLU HG2 . 30242 1
72 . 1 1 9 9 GLU HG3 H 1 1.511 0.04 . 2 . . . A 9 GLU HG3 . 30242 1
73 . 1 1 9 9 GLU C C 13 177.278 0.40 . 1 . . . A 9 GLU C . 30242 1
74 . 1 1 9 9 GLU CA C 13 58.497 0.40 . 1 . . . A 9 GLU CA . 30242 1
75 . 1 1 9 9 GLU CB C 13 29.258 0.40 . 1 . . . A 9 GLU CB . 30242 1
76 . 1 1 9 9 GLU CG C 13 35.670 0.40 . 1 . . . A 9 GLU CG . 30242 1
77 . 1 1 10 10 GLU H H 1 8.242 0.04 . 1 . . . A 10 GLU H . 30242 1
78 . 1 1 10 10 GLU HA H 1 3.554 0.04 . 1 . . . A 10 GLU HA . 30242 1
79 . 1 1 10 10 GLU HB2 H 1 1.755 0.04 . 2 . . . A 10 GLU HB2 . 30242 1
80 . 1 1 10 10 GLU HB3 H 1 1.900 0.04 . 2 . . . A 10 GLU HB3 . 30242 1
81 . 1 1 10 10 GLU HG2 H 1 2.042 0.04 . 2 . . . A 10 GLU HG2 . 30242 1
82 . 1 1 10 10 GLU HG3 H 1 2.042 0.04 . 2 . . . A 10 GLU HG3 . 30242 1
83 . 1 1 10 10 GLU C C 13 179.839 0.40 . 1 . . . A 10 GLU C . 30242 1
84 . 1 1 10 10 GLU CA C 13 60.184 0.40 . 1 . . . A 10 GLU CA . 30242 1
85 . 1 1 10 10 GLU CB C 13 28.504 0.40 . 1 . . . A 10 GLU CB . 30242 1
86 . 1 1 10 10 GLU CG C 13 36.340 0.40 . 1 . . . A 10 GLU CG . 30242 1
87 . 1 1 10 10 GLU N N 15 118.739 0.40 . 1 . . . A 10 GLU N . 30242 1
88 . 1 1 11 11 GLU H H 1 7.966 0.04 . 1 . . . A 11 GLU H . 30242 1
89 . 1 1 11 11 GLU HA H 1 3.615 0.04 . 1 . . . A 11 GLU HA . 30242 1
90 . 1 1 11 11 GLU HB2 H 1 1.792 0.04 . 2 . . . A 11 GLU HB2 . 30242 1
91 . 1 1 11 11 GLU HB3 H 1 1.792 0.04 . 2 . . . A 11 GLU HB3 . 30242 1
92 . 1 1 11 11 GLU HG2 H 1 2.146 0.04 . 2 . . . A 11 GLU HG2 . 30242 1
93 . 1 1 11 11 GLU HG3 H 1 2.394 0.04 . 2 . . . A 11 GLU HG3 . 30242 1
94 . 1 1 11 11 GLU C C 13 178.558 0.40 . 1 . . . A 11 GLU C . 30242 1
95 . 1 1 11 11 GLU CA C 13 59.011 0.40 . 1 . . . A 11 GLU CA . 30242 1
96 . 1 1 11 11 GLU CB C 13 30.083 0.40 . 1 . . . A 11 GLU CB . 30242 1
97 . 1 1 11 11 GLU CG C 13 37.339 0.40 . 1 . . . A 11 GLU CG . 30242 1
98 . 1 1 11 11 GLU N N 15 118.264 0.40 . 1 . . . A 11 GLU N . 30242 1
99 . 1 1 12 12 ALA H H 1 6.558 0.04 . 1 . . . A 12 ALA H . 30242 1
100 . 1 1 12 12 ALA HA H 1 2.877 0.04 . 1 . . . A 12 ALA HA . 30242 1
101 . 1 1 12 12 ALA HB1 H 1 1.047 0.04 . 1 . . . A 12 ALA HB1 . 30242 1
102 . 1 1 12 12 ALA HB2 H 1 1.047 0.04 . 1 . . . A 12 ALA HB2 . 30242 1
103 . 1 1 12 12 ALA HB3 H 1 1.047 0.04 . 1 . . . A 12 ALA HB3 . 30242 1
104 . 1 1 12 12 ALA CA C 13 54.286 0.40 . 1 . . . A 12 ALA CA . 30242 1
105 . 1 1 12 12 ALA CB C 13 18.000 0.40 . 1 . . . A 12 ALA CB . 30242 1
106 . 1 1 12 12 ALA N N 15 121.945 0.40 . 1 . . . A 12 ALA N . 30242 1
107 . 1 1 13 13 ARG H H 1 8.348 0.04 . 1 . . . A 13 ARG H . 30242 1
108 . 1 1 13 13 ARG HA H 1 3.991 0.04 . 1 . . . A 13 ARG HA . 30242 1
109 . 1 1 13 13 ARG HB2 H 1 1.635 0.04 . 2 . . . A 13 ARG HB2 . 30242 1
110 . 1 1 13 13 ARG HB3 H 1 1.747 0.04 . 2 . . . A 13 ARG HB3 . 30242 1
111 . 1 1 13 13 ARG HG2 H 1 1.527 0.04 . 2 . . . A 13 ARG HG2 . 30242 1
112 . 1 1 13 13 ARG HG3 H 1 1.527 0.04 . 2 . . . A 13 ARG HG3 . 30242 1
113 . 1 1 13 13 ARG HD2 H 1 2.883 0.04 . 2 . . . A 13 ARG HD2 . 30242 1
114 . 1 1 13 13 ARG HD3 H 1 2.976 0.04 . 2 . . . A 13 ARG HD3 . 30242 1
115 . 1 1 13 13 ARG C C 13 179.603 0.40 . 1 . . . A 13 ARG C . 30242 1
116 . 1 1 13 13 ARG CA C 13 56.953 0.40 . 1 . . . A 13 ARG CA . 30242 1
117 . 1 1 13 13 ARG CB C 13 28.396 0.40 . 1 . . . A 13 ARG CB . 30242 1
118 . 1 1 13 13 ARG CG C 13 26.733 0.40 . 1 . . . A 13 ARG CG . 30242 1
119 . 1 1 13 13 ARG CD C 13 42.358 0.40 . 1 . . . A 13 ARG CD . 30242 1
120 . 1 1 13 13 ARG N N 15 115.390 0.40 . 1 . . . A 13 ARG N . 30242 1
121 . 1 1 14 14 LYS H H 1 7.643 0.04 . 1 . . . A 14 LYS H . 30242 1
122 . 1 1 14 14 LYS HA H 1 3.801 0.04 . 1 . . . A 14 LYS HA . 30242 1
123 . 1 1 14 14 LYS HB2 H 1 1.642 0.04 . 2 . . . A 14 LYS HB2 . 30242 1
124 . 1 1 14 14 LYS HB3 H 1 1.676 0.04 . 2 . . . A 14 LYS HB3 . 30242 1
125 . 1 1 14 14 LYS HG2 H 1 1.181 0.04 . 2 . . . A 14 LYS HG2 . 30242 1
126 . 1 1 14 14 LYS HG3 H 1 1.383 0.04 . 2 . . . A 14 LYS HG3 . 30242 1
127 . 1 1 14 14 LYS HD2 H 1 1.510 0.04 . 2 . . . A 14 LYS HD2 . 30242 1
128 . 1 1 14 14 LYS HD3 H 1 1.510 0.04 . 2 . . . A 14 LYS HD3 . 30242 1
129 . 1 1 14 14 LYS HE2 H 1 2.786 0.04 . 2 . . . A 14 LYS HE2 . 30242 1
130 . 1 1 14 14 LYS HE3 H 1 2.786 0.04 . 2 . . . A 14 LYS HE3 . 30242 1
131 . 1 1 14 14 LYS C C 13 178.457 0.40 . 1 . . . A 14 LYS C . 30242 1
132 . 1 1 14 14 LYS CA C 13 59.717 0.40 . 1 . . . A 14 LYS CA . 30242 1
133 . 1 1 14 14 LYS CB C 13 32.153 0.40 . 1 . . . A 14 LYS CB . 30242 1
134 . 1 1 14 14 LYS CG C 13 25.056 0.40 . 1 . . . A 14 LYS CG . 30242 1
135 . 1 1 14 14 LYS CD C 13 29.341 0.40 . 1 . . . A 14 LYS CD . 30242 1
136 . 1 1 14 14 LYS CE C 13 41.927 0.40 . 1 . . . A 14 LYS CE . 30242 1
137 . 1 1 14 14 LYS N N 15 122.492 0.40 . 1 . . . A 14 LYS N . 30242 1
138 . 1 1 15 15 ALA H H 1 7.071 0.04 . 1 . . . A 15 ALA H . 30242 1
139 . 1 1 15 15 ALA HA H 1 3.894 0.04 . 1 . . . A 15 ALA HA . 30242 1
140 . 1 1 15 15 ALA HB1 H 1 1.181 0.04 . 1 . . . A 15 ALA HB1 . 30242 1
141 . 1 1 15 15 ALA HB2 H 1 1.181 0.04 . 1 . . . A 15 ALA HB2 . 30242 1
142 . 1 1 15 15 ALA HB3 H 1 1.181 0.04 . 1 . . . A 15 ALA HB3 . 30242 1
143 . 1 1 15 15 ALA C C 13 179.400 0.40 . 1 . . . A 15 ALA C . 30242 1
144 . 1 1 15 15 ALA CA C 13 54.764 0.40 . 1 . . . A 15 ALA CA . 30242 1
145 . 1 1 15 15 ALA CB C 13 17.892 0.40 . 1 . . . A 15 ALA CB . 30242 1
146 . 1 1 15 15 ALA N N 15 122.040 0.40 . 1 . . . A 15 ALA N . 30242 1
147 . 1 1 16 16 GLU H H 1 8.246 0.04 . 1 . . . A 16 GLU H . 30242 1
148 . 1 1 16 16 GLU HA H 1 3.505 0.04 . 1 . . . A 16 GLU HA . 30242 1
149 . 1 1 16 16 GLU HB2 H 1 1.705 0.04 . 2 . . . A 16 GLU HB2 . 30242 1
150 . 1 1 16 16 GLU HB3 H 1 2.248 0.04 . 2 . . . A 16 GLU HB3 . 30242 1
151 . 1 1 16 16 GLU HG2 H 1 1.912 0.04 . 2 . . . A 16 GLU HG2 . 30242 1
152 . 1 1 16 16 GLU HG3 H 1 1.912 0.04 . 2 . . . A 16 GLU HG3 . 30242 1
153 . 1 1 16 16 GLU C C 13 177.177 0.40 . 1 . . . A 16 GLU C . 30242 1
154 . 1 1 16 16 GLU CA C 13 59.538 0.40 . 1 . . . A 16 GLU CA . 30242 1
155 . 1 1 16 16 GLU CB C 13 29.605 0.40 . 1 . . . A 16 GLU CB . 30242 1
156 . 1 1 16 16 GLU CG C 13 35.419 0.40 . 1 . . . A 16 GLU CG . 30242 1
157 . 1 1 16 16 GLU N N 15 118.311 0.40 . 1 . . . A 16 GLU N . 30242 1
158 . 1 1 17 17 LYS H H 1 7.740 0.04 . 1 . . . A 17 LYS H . 30242 1
159 . 1 1 17 17 LYS HA H 1 3.722 0.04 . 1 . . . A 17 LYS HA . 30242 1
160 . 1 1 17 17 LYS HB2 H 1 1.764 0.04 . 2 . . . A 17 LYS HB2 . 30242 1
161 . 1 1 17 17 LYS HB3 H 1 1.764 0.04 . 2 . . . A 17 LYS HB3 . 30242 1
162 . 1 1 17 17 LYS HG2 H 1 1.249 0.04 . 2 . . . A 17 LYS HG2 . 30242 1
163 . 1 1 17 17 LYS HG3 H 1 1.437 0.04 . 2 . . . A 17 LYS HG3 . 30242 1
164 . 1 1 17 17 LYS HD2 H 1 1.513 0.04 . 2 . . . A 17 LYS HD2 . 30242 1
165 . 1 1 17 17 LYS HD3 H 1 1.513 0.04 . 2 . . . A 17 LYS HD3 . 30242 1
166 . 1 1 17 17 LYS HE2 H 1 2.809 0.04 . 2 . . . A 17 LYS HE2 . 30242 1
167 . 1 1 17 17 LYS HE3 H 1 2.809 0.04 . 2 . . . A 17 LYS HE3 . 30242 1
168 . 1 1 17 17 LYS C C 13 179.367 0.40 . 1 . . . A 17 LYS C . 30242 1
169 . 1 1 17 17 LYS CA C 13 59.747 0.40 . 1 . . . A 17 LYS CA . 30242 1
170 . 1 1 17 17 LYS CB C 13 32.248 0.40 . 1 . . . A 17 LYS CB . 30242 1
171 . 1 1 17 17 LYS CG C 13 25.029 0.40 . 1 . . . A 17 LYS CG . 30242 1
172 . 1 1 17 17 LYS CD C 13 29.297 0.40 . 1 . . . A 17 LYS CD . 30242 1
173 . 1 1 17 17 LYS CE C 13 41.867 0.40 . 1 . . . A 17 LYS CE . 30242 1
174 . 1 1 17 17 LYS N N 15 117.765 0.40 . 1 . . . A 17 LYS N . 30242 1
175 . 1 1 18 18 GLU H H 1 7.448 0.04 . 1 . . . A 18 GLU H . 30242 1
176 . 1 1 18 18 GLU HA H 1 3.850 0.04 . 1 . . . A 18 GLU HA . 30242 1
177 . 1 1 18 18 GLU HB2 H 1 1.878 0.04 . 2 . . . A 18 GLU HB2 . 30242 1
178 . 1 1 18 18 GLU HB3 H 1 1.878 0.04 . 2 . . . A 18 GLU HB3 . 30242 1
179 . 1 1 18 18 GLU HG2 H 1 2.181 0.04 . 2 . . . A 18 GLU HG2 . 30242 1
180 . 1 1 18 18 GLU HG3 H 1 2.181 0.04 . 2 . . . A 18 GLU HG3 . 30242 1
181 . 1 1 18 18 GLU C C 13 179.299 0.40 . 1 . . . A 18 GLU C . 30242 1
182 . 1 1 18 18 GLU CA C 13 58.832 0.40 . 1 . . . A 18 GLU CA . 30242 1
183 . 1 1 18 18 GLU CB C 13 29.066 0.40 . 1 . . . A 18 GLU CB . 30242 1
184 . 1 1 18 18 GLU CG C 13 35.622 0.40 . 1 . . . A 18 GLU CG . 30242 1
185 . 1 1 18 18 GLU N N 15 118.620 0.40 . 1 . . . A 18 GLU N . 30242 1
186 . 1 1 19 19 LEU H H 1 7.970 0.04 . 1 . . . A 19 LEU H . 30242 1
187 . 1 1 19 19 LEU HA H 1 3.725 0.04 . 1 . . . A 19 LEU HA . 30242 1
188 . 1 1 19 19 LEU HB2 H 1 0.607 0.04 . 2 . . . A 19 LEU HB2 . 30242 1
189 . 1 1 19 19 LEU HB3 H 1 1.521 0.04 . 2 . . . A 19 LEU HB3 . 30242 1
190 . 1 1 19 19 LEU HG H 1 1.146 0.04 . 1 . . . A 19 LEU HG . 30242 1
191 . 1 1 19 19 LEU HD11 H 1 -0.284 0.04 . 2 . . . A 19 LEU HD11 . 30242 1
192 . 1 1 19 19 LEU HD12 H 1 -0.284 0.04 . 2 . . . A 19 LEU HD12 . 30242 1
193 . 1 1 19 19 LEU HD13 H 1 -0.284 0.04 . 2 . . . A 19 LEU HD13 . 30242 1
194 . 1 1 19 19 LEU HD21 H 1 -0.276 0.04 . 2 . . . A 19 LEU HD21 . 30242 1
195 . 1 1 19 19 LEU HD22 H 1 -0.276 0.04 . 2 . . . A 19 LEU HD22 . 30242 1
196 . 1 1 19 19 LEU HD23 H 1 -0.276 0.04 . 2 . . . A 19 LEU HD23 . 30242 1
197 . 1 1 19 19 LEU C C 13 179.872 0.40 . 1 . . . A 19 LEU C . 30242 1
198 . 1 1 19 19 LEU CA C 13 57.317 0.40 . 1 . . . A 19 LEU CA . 30242 1
199 . 1 1 19 19 LEU CB C 13 42.615 0.40 . 1 . . . A 19 LEU CB . 30242 1
200 . 1 1 19 19 LEU CG C 13 26.398 0.40 . 1 . . . A 19 LEU CG . 30242 1
201 . 1 1 19 19 LEU CD1 C 13 25.489 0.40 . 2 . . . A 19 LEU CD1 . 30242 1
202 . 1 1 19 19 LEU CD2 C 13 20.979 0.40 . 2 . . . A 19 LEU CD2 . 30242 1
203 . 1 1 19 19 LEU N N 15 120.425 0.40 . 1 . . . A 19 LEU N . 30242 1
204 . 1 1 20 20 ARG H H 1 8.336 0.04 . 1 . . . A 20 ARG H . 30242 1
205 . 1 1 20 20 ARG HA H 1 4.038 0.04 . 1 . . . A 20 ARG HA . 30242 1
206 . 1 1 20 20 ARG HG2 H 1 1.590 0.04 . 2 . . . A 20 ARG HG2 . 30242 1
207 . 1 1 20 20 ARG HG3 H 1 1.766 0.04 . 2 . . . A 20 ARG HG3 . 30242 1
208 . 1 1 20 20 ARG HD2 H 1 3.127 0.04 . 2 . . . A 20 ARG HD2 . 30242 1
209 . 1 1 20 20 ARG HD3 H 1 3.127 0.04 . 2 . . . A 20 ARG HD3 . 30242 1
210 . 1 1 20 20 ARG CA C 13 59.298 0.40 . 1 . . . A 20 ARG CA . 30242 1
211 . 1 1 20 20 ARG CG C 13 28.289 0.40 . 1 . . . A 20 ARG CG . 30242 1
212 . 1 1 20 20 ARG CD C 13 42.992 0.40 . 1 . . . A 20 ARG CD . 30242 1
213 . 1 1 20 20 ARG N N 15 119.135 0.40 . 1 . . . A 20 ARG N . 30242 1
214 . 1 1 21 21 LYS HA H 1 4.009 0.04 . 1 . . . A 21 LYS HA . 30242 1
215 . 1 1 21 21 LYS HB2 H 1 1.858 0.04 . 2 . . . A 21 LYS HB2 . 30242 1
216 . 1 1 21 21 LYS HB3 H 1 1.858 0.04 . 2 . . . A 21 LYS HB3 . 30242 1
217 . 1 1 21 21 LYS HG2 H 1 1.366 0.04 . 2 . . . A 21 LYS HG2 . 30242 1
218 . 1 1 21 21 LYS HG3 H 1 1.519 0.04 . 2 . . . A 21 LYS HG3 . 30242 1
219 . 1 1 21 21 LYS HD2 H 1 1.528 0.04 . 2 . . . A 21 LYS HD2 . 30242 1
220 . 1 1 21 21 LYS HD3 H 1 1.573 0.04 . 2 . . . A 21 LYS HD3 . 30242 1
221 . 1 1 21 21 LYS HE2 H 1 2.808 0.04 . 2 . . . A 21 LYS HE2 . 30242 1
222 . 1 1 21 21 LYS HE3 H 1 2.848 0.04 . 2 . . . A 21 LYS HE3 . 30242 1
223 . 1 1 21 21 LYS CA C 13 58.916 0.40 . 1 . . . A 21 LYS CA . 30242 1
224 . 1 1 21 21 LYS CB C 13 32.129 0.40 . 1 . . . A 21 LYS CB . 30242 1
225 . 1 1 21 21 LYS CG C 13 25.035 0.40 . 1 . . . A 21 LYS CG . 30242 1
226 . 1 1 21 21 LYS CD C 13 29.330 0.40 . 1 . . . A 21 LYS CD . 30242 1
227 . 1 1 21 21 LYS CE C 13 41.879 0.40 . 1 . . . A 21 LYS CE . 30242 1
228 . 1 1 25 25 ARG HA H 1 4.366 0.04 . 1 . . . A 25 ARG HA . 30242 1
229 . 1 1 25 25 ARG HB2 H 1 1.765 0.04 . 2 . . . A 25 ARG HB2 . 30242 1
230 . 1 1 25 25 ARG HB3 H 1 1.860 0.04 . 2 . . . A 25 ARG HB3 . 30242 1
231 . 1 1 25 25 ARG HG2 H 1 1.500 0.04 . 2 . . . A 25 ARG HG2 . 30242 1
232 . 1 1 25 25 ARG HG3 H 1 1.637 0.04 . 2 . . . A 25 ARG HG3 . 30242 1
233 . 1 1 25 25 ARG HD2 H 1 3.136 0.04 . 2 . . . A 25 ARG HD2 . 30242 1
234 . 1 1 25 25 ARG HD3 H 1 3.136 0.04 . 2 . . . A 25 ARG HD3 . 30242 1
235 . 1 1 25 25 ARG C C 13 175.424 0.40 . 1 . . . A 25 ARG C . 30242 1
236 . 1 1 25 25 ARG CA C 13 56.349 0.40 . 1 . . . A 25 ARG CA . 30242 1
237 . 1 1 25 25 ARG CB C 13 30.059 0.40 . 1 . . . A 25 ARG CB . 30242 1
238 . 1 1 25 25 ARG CG C 13 27.050 0.40 . 1 . . . A 25 ARG CG . 30242 1
239 . 1 1 25 25 ARG CD C 13 43.303 0.40 . 1 . . . A 25 ARG CD . 30242 1
240 . 1 1 26 26 VAL H H 1 8.099 0.04 . 1 . . . A 26 VAL H . 30242 1
241 . 1 1 26 26 VAL HA H 1 5.183 0.04 . 1 . . . A 26 VAL HA . 30242 1
242 . 1 1 26 26 VAL HB H 1 1.818 0.04 . 1 . . . A 26 VAL HB . 30242 1
243 . 1 1 26 26 VAL HG11 H 1 0.782 0.04 . 2 . . . A 26 VAL HG11 . 30242 1
244 . 1 1 26 26 VAL HG12 H 1 0.782 0.04 . 2 . . . A 26 VAL HG12 . 30242 1
245 . 1 1 26 26 VAL HG13 H 1 0.782 0.04 . 2 . . . A 26 VAL HG13 . 30242 1
246 . 1 1 26 26 VAL HG21 H 1 0.888 0.04 . 2 . . . A 26 VAL HG21 . 30242 1
247 . 1 1 26 26 VAL HG22 H 1 0.888 0.04 . 2 . . . A 26 VAL HG22 . 30242 1
248 . 1 1 26 26 VAL HG23 H 1 0.888 0.04 . 2 . . . A 26 VAL HG23 . 30242 1
249 . 1 1 26 26 VAL C C 13 174.885 0.40 . 1 . . . A 26 VAL C . 30242 1
250 . 1 1 26 26 VAL CA C 13 60.363 0.40 . 1 . . . A 26 VAL CA . 30242 1
251 . 1 1 26 26 VAL CB C 13 34.845 0.40 . 1 . . . A 26 VAL CB . 30242 1
252 . 1 1 26 26 VAL CG1 C 13 23.073 0.40 . 2 . . . A 26 VAL CG1 . 30242 1
253 . 1 1 26 26 VAL CG2 C 13 21.984 0.40 . 2 . . . A 26 VAL CG2 . 30242 1
254 . 1 1 26 26 VAL N N 15 124.415 0.40 . 1 . . . A 26 VAL N . 30242 1
255 . 1 1 27 27 THR H H 1 9.218 0.04 . 1 . . . A 27 THR H . 30242 1
256 . 1 1 27 27 THR HA H 1 4.633 0.04 . 1 . . . A 27 THR HA . 30242 1
257 . 1 1 27 27 THR HB H 1 3.907 0.04 . 1 . . . A 27 THR HB . 30242 1
258 . 1 1 27 27 THR HG21 H 1 1.127 0.04 . 1 . . . A 27 THR HG21 . 30242 1
259 . 1 1 27 27 THR HG22 H 1 1.127 0.04 . 1 . . . A 27 THR HG22 . 30242 1
260 . 1 1 27 27 THR HG23 H 1 1.127 0.04 . 1 . . . A 27 THR HG23 . 30242 1
261 . 1 1 27 27 THR C C 13 173.167 0.40 . 1 . . . A 27 THR C . 30242 1
262 . 1 1 27 27 THR CA C 13 61.320 0.40 . 1 . . . A 27 THR CA . 30242 1
263 . 1 1 27 27 THR CB C 13 71.525 0.40 . 1 . . . A 27 THR CB . 30242 1
264 . 1 1 27 27 THR CG2 C 13 21.529 0.40 . 1 . . . A 27 THR CG2 . 30242 1
265 . 1 1 27 27 THR N N 15 122.230 0.40 . 1 . . . A 27 THR N . 30242 1
266 . 1 1 28 28 VAL H H 1 8.854 0.04 . 1 . . . A 28 VAL H . 30242 1
267 . 1 1 28 28 VAL HA H 1 5.236 0.04 . 1 . . . A 28 VAL HA . 30242 1
268 . 1 1 28 28 VAL HB H 1 1.985 0.04 . 1 . . . A 28 VAL HB . 30242 1
269 . 1 1 28 28 VAL HG11 H 1 0.859 0.04 . 2 . . . A 28 VAL HG11 . 30242 1
270 . 1 1 28 28 VAL HG12 H 1 0.859 0.04 . 2 . . . A 28 VAL HG12 . 30242 1
271 . 1 1 28 28 VAL HG13 H 1 0.859 0.04 . 2 . . . A 28 VAL HG13 . 30242 1
272 . 1 1 28 28 VAL HG21 H 1 0.951 0.04 . 2 . . . A 28 VAL HG21 . 30242 1
273 . 1 1 28 28 VAL HG22 H 1 0.951 0.04 . 2 . . . A 28 VAL HG22 . 30242 1
274 . 1 1 28 28 VAL HG23 H 1 0.951 0.04 . 2 . . . A 28 VAL HG23 . 30242 1
275 . 1 1 28 28 VAL C C 13 175.795 0.40 . 1 . . . A 28 VAL C . 30242 1
276 . 1 1 28 28 VAL CA C 13 61.284 0.40 . 1 . . . A 28 VAL CA . 30242 1
277 . 1 1 28 28 VAL CB C 13 33.517 0.40 . 1 . . . A 28 VAL CB . 30242 1
278 . 1 1 28 28 VAL CG1 C 13 21.601 0.40 . 2 . . . A 28 VAL CG1 . 30242 1
279 . 1 1 28 28 VAL CG2 C 13 21.535 0.40 . 2 . . . A 28 VAL CG2 . 30242 1
280 . 1 1 28 28 VAL N N 15 127.741 0.40 . 1 . . . A 28 VAL N . 30242 1
281 . 1 1 29 29 THR H H 1 9.227 0.04 . 1 . . . A 29 THR H . 30242 1
282 . 1 1 29 29 THR HA H 1 4.620 0.04 . 1 . . . A 29 THR HA . 30242 1
283 . 1 1 29 29 THR HB H 1 3.984 0.04 . 1 . . . A 29 THR HB . 30242 1
284 . 1 1 29 29 THR HG21 H 1 1.041 0.04 . 1 . . . A 29 THR HG21 . 30242 1
285 . 1 1 29 29 THR HG22 H 1 1.041 0.04 . 1 . . . A 29 THR HG22 . 30242 1
286 . 1 1 29 29 THR HG23 H 1 1.041 0.04 . 1 . . . A 29 THR HG23 . 30242 1
287 . 1 1 29 29 THR CA C 13 59.729 0.40 . 1 . . . A 29 THR CA . 30242 1
288 . 1 1 29 29 THR CB C 13 71.896 0.40 . 1 . . . A 29 THR CB . 30242 1
289 . 1 1 29 29 THR CG2 C 13 22.415 0.40 . 1 . . . A 29 THR CG2 . 30242 1
290 . 1 1 29 29 THR N N 15 120.211 0.40 . 1 . . . A 29 THR N . 30242 1
291 . 1 1 31 31 GLU HA H 1 4.279 0.04 . 1 . . . A 31 GLU HA . 30242 1
292 . 1 1 31 31 GLU HG2 H 1 2.101 0.04 . 2 . . . A 31 GLU HG2 . 30242 1
293 . 1 1 31 31 GLU HG3 H 1 2.252 0.04 . 2 . . . A 31 GLU HG3 . 30242 1
294 . 1 1 31 31 GLU CA C 13 55.482 0.40 . 1 . . . A 31 GLU CA . 30242 1
295 . 1 1 31 31 GLU CG C 13 36.185 0.40 . 1 . . . A 31 GLU CG . 30242 1
296 . 1 1 33 33 GLY HA2 H 1 3.450 0.04 . 2 . . . A 33 GLY HA2 . 30242 1
297 . 1 1 33 33 GLY HA3 H 1 4.006 0.04 . 2 . . . A 33 GLY HA3 . 30242 1
298 . 1 1 33 33 GLY CA C 13 45.385 0.40 . 1 . . . A 33 GLY CA . 30242 1
299 . 1 1 36 36 ARG HA H 1 5.118 0.04 . 1 . . . A 36 ARG HA . 30242 1
300 . 1 1 36 36 ARG HB2 H 1 1.536 0.04 . 2 . . . A 36 ARG HB2 . 30242 1
301 . 1 1 36 36 ARG HB3 H 1 1.693 0.04 . 2 . . . A 36 ARG HB3 . 30242 1
302 . 1 1 36 36 ARG HG2 H 1 1.311 0.04 . 2 . . . A 36 ARG HG2 . 30242 1
303 . 1 1 36 36 ARG HG3 H 1 1.376 0.04 . 2 . . . A 36 ARG HG3 . 30242 1
304 . 1 1 36 36 ARG HD2 H 1 2.805 0.04 . 2 . . . A 36 ARG HD2 . 30242 1
305 . 1 1 36 36 ARG HD3 H 1 3.042 0.04 . 2 . . . A 36 ARG HD3 . 30242 1
306 . 1 1 36 36 ARG C C 13 174.649 0.40 . 1 . . . A 36 ARG C . 30242 1
307 . 1 1 36 36 ARG CA C 13 55.099 0.40 . 1 . . . A 36 ARG CA . 30242 1
308 . 1 1 36 36 ARG CB C 13 32.865 0.40 . 1 . . . A 36 ARG CB . 30242 1
309 . 1 1 36 36 ARG CG C 13 27.547 0.40 . 1 . . . A 36 ARG CG . 30242 1
310 . 1 1 36 36 ARG CD C 13 43.088 0.40 . 1 . . . A 36 ARG CD . 30242 1
311 . 1 1 37 37 VAL H H 1 9.265 0.04 . 1 . . . A 37 VAL H . 30242 1
312 . 1 1 37 37 VAL HA H 1 4.956 0.04 . 1 . . . A 37 VAL HA . 30242 1
313 . 1 1 37 37 VAL HB H 1 2.273 0.04 . 1 . . . A 37 VAL HB . 30242 1
314 . 1 1 37 37 VAL HG11 H 1 1.135 0.04 . 2 . . . A 37 VAL HG11 . 30242 1
315 . 1 1 37 37 VAL HG12 H 1 1.135 0.04 . 2 . . . A 37 VAL HG12 . 30242 1
316 . 1 1 37 37 VAL HG13 H 1 1.135 0.04 . 2 . . . A 37 VAL HG13 . 30242 1
317 . 1 1 37 37 VAL HG21 H 1 0.870 0.04 . 2 . . . A 37 VAL HG21 . 30242 1
318 . 1 1 37 37 VAL HG22 H 1 0.870 0.04 . 2 . . . A 37 VAL HG22 . 30242 1
319 . 1 1 37 37 VAL HG23 H 1 0.870 0.04 . 2 . . . A 37 VAL HG23 . 30242 1
320 . 1 1 37 37 VAL C C 13 174.784 0.40 . 1 . . . A 37 VAL C . 30242 1
321 . 1 1 37 37 VAL CA C 13 61.416 0.40 . 1 . . . A 37 VAL CA . 30242 1
322 . 1 1 37 37 VAL CB C 13 33.888 0.40 . 1 . . . A 37 VAL CB . 30242 1
323 . 1 1 37 37 VAL CG1 C 13 22.965 0.40 . 2 . . . A 37 VAL CG1 . 30242 1
324 . 1 1 37 37 VAL CG2 C 13 22.020 0.40 . 2 . . . A 37 VAL CG2 . 30242 1
325 . 1 1 37 37 VAL N N 15 127.408 0.40 . 1 . . . A 37 VAL N . 30242 1
326 . 1 1 38 38 THR H H 1 8.949 0.04 . 1 . . . A 38 THR H . 30242 1
327 . 1 1 38 38 THR HA H 1 5.524 0.04 . 1 . . . A 38 THR HA . 30242 1
328 . 1 1 38 38 THR HB H 1 3.850 0.04 . 1 . . . A 38 THR HB . 30242 1
329 . 1 1 38 38 THR HG21 H 1 1.058 0.04 . 1 . . . A 38 THR HG21 . 30242 1
330 . 1 1 38 38 THR HG22 H 1 1.058 0.04 . 1 . . . A 38 THR HG22 . 30242 1
331 . 1 1 38 38 THR HG23 H 1 1.058 0.04 . 1 . . . A 38 THR HG23 . 30242 1
332 . 1 1 38 38 THR C C 13 173.470 0.40 . 1 . . . A 38 THR C . 30242 1
333 . 1 1 38 38 THR CA C 13 61.105 0.40 . 1 . . . A 38 THR CA . 30242 1
334 . 1 1 38 38 THR CB C 13 71.310 0.40 . 1 . . . A 38 THR CB . 30242 1
335 . 1 1 38 38 THR CG2 C 13 21.469 0.40 . 1 . . . A 38 THR CG2 . 30242 1
336 . 1 1 38 38 THR N N 15 123.679 0.40 . 1 . . . A 38 THR N . 30242 1
337 . 1 1 39 39 TRP H H 1 9.052 0.04 . 1 . . . A 39 TRP H . 30242 1
338 . 1 1 39 39 TRP HA H 1 5.831 0.04 . 1 . . . A 39 TRP HA . 30242 1
339 . 1 1 39 39 TRP HB2 H 1 3.094 0.04 . 2 . . . A 39 TRP HB2 . 30242 1
340 . 1 1 39 39 TRP HB3 H 1 3.094 0.04 . 2 . . . A 39 TRP HB3 . 30242 1
341 . 1 1 39 39 TRP HD1 H 1 6.845 0.04 . 1 . . . A 39 TRP HD1 . 30242 1
342 . 1 1 39 39 TRP HE1 H 1 9.898 0.04 . 1 . . . A 39 TRP HE1 . 30242 1
343 . 1 1 39 39 TRP C C 13 172.830 0.40 . 1 . . . A 39 TRP C . 30242 1
344 . 1 1 39 39 TRP CA C 13 56.116 0.40 . 1 . . . A 39 TRP CA . 30242 1
345 . 1 1 39 39 TRP CB C 13 34.211 0.40 . 1 . . . A 39 TRP CB . 30242 1
346 . 1 1 39 39 TRP CD1 C 13 127.219 0.40 . 1 . . . A 39 TRP CD1 . 30242 1
347 . 1 1 39 39 TRP N N 15 125.674 0.40 . 1 . . . A 39 TRP N . 30242 1
348 . 1 1 39 39 TRP NE1 N 15 129.043 0.40 . 1 . . . A 39 TRP NE1 . 30242 1
349 . 1 1 40 40 ASP H H 1 8.139 0.04 . 1 . . . A 40 ASP H . 30242 1
350 . 1 1 40 40 ASP HA H 1 4.407 0.04 . 1 . . . A 40 ASP HA . 30242 1
351 . 1 1 40 40 ASP HB2 H 1 2.578 0.04 . 2 . . . A 40 ASP HB2 . 30242 1
352 . 1 1 40 40 ASP HB3 H 1 2.620 0.04 . 2 . . . A 40 ASP HB3 . 30242 1
353 . 1 1 40 40 ASP CA C 13 55.661 0.40 . 1 . . . A 40 ASP CA . 30242 1
354 . 1 1 40 40 ASP CB C 13 43.817 0.40 . 1 . . . A 40 ASP CB . 30242 1
355 . 1 1 40 40 ASP N N 15 123.822 0.40 . 1 . . . A 40 ASP N . 30242 1
stop_
save_