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 18768
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.01
_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-13C HSQC' . . . 18768 1
3 '2D 1H-1H NOESY' . . . 18768 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.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 4.450 0.01 . 1 . . . . A 1 ASP HA . 18768 1
2 . 1 1 1 1 ASP HB2 H 1 3.126 0.01 . 2 . . . . A 1 ASP HB2 . 18768 1
3 . 1 1 1 1 ASP HB3 H 1 3.037 0.01 . 2 . . . . A 1 ASP HB3 . 18768 1
4 . 1 1 1 1 ASP CA C 13 52.932 0.01 . 1 . . . . A 1 ASP CA . 18768 1
5 . 1 1 1 1 ASP CB C 13 38.066 0.01 . 1 . . . . A 1 ASP CB . 18768 1
6 . 1 1 2 2 THR H H 1 8.563 0.01 . 1 . . . . A 2 THR H . 18768 1
7 . 1 1 2 2 THR HA H 1 4.415 0.01 . 1 . . . . A 2 THR HA . 18768 1
8 . 1 1 2 2 THR HB H 1 4.236 0.01 . 1 . . . . A 2 THR HB . 18768 1
9 . 1 1 2 2 THR HG21 H 1 1.269 0.01 . 1 . . . . A 2 THR HG21 . 18768 1
10 . 1 1 2 2 THR HG22 H 1 1.269 0.01 . 1 . . . . A 2 THR HG22 . 18768 1
11 . 1 1 2 2 THR HG23 H 1 1.269 0.01 . 1 . . . . A 2 THR HG23 . 18768 1
12 . 1 1 2 2 THR CA C 13 62.574 0.01 . 1 . . . . A 2 THR CA . 18768 1
13 . 1 1 2 2 THR CB C 13 70.078 0.01 . 1 . . . . A 2 THR CB . 18768 1
14 . 1 1 2 2 THR CG2 C 13 21.498 0.01 . 1 . . . . A 2 THR CG2 . 18768 1
15 . 1 1 3 3 GLU H H 1 8.275 0.01 . 1 . . . . A 3 GLU H . 18768 1
16 . 1 1 3 3 GLU HA H 1 4.482 0.01 . 1 . . . . A 3 GLU HA . 18768 1
17 . 1 1 3 3 GLU HB2 H 1 2.148 0.01 . 2 . . . . A 3 GLU HB2 . 18768 1
18 . 1 1 3 3 GLU HB3 H 1 2.036 0.01 . 2 . . . . A 3 GLU HB3 . 18768 1
19 . 1 1 3 3 GLU HG2 H 1 2.487 0.01 . 1 . . . . A 3 GLU HG2 . 18768 1
20 . 1 1 3 3 GLU HG3 H 1 2.487 0.01 . 1 . . . . A 3 GLU HG3 . 18768 1
21 . 1 1 3 3 GLU CA C 13 56.132 0.01 . 1 . . . . A 3 GLU CA . 18768 1
22 . 1 1 3 3 GLU CB C 13 29.284 0.01 . 1 . . . . A 3 GLU CB . 18768 1
23 . 1 1 3 3 GLU CG C 13 32.808 0.01 . 1 . . . . A 3 GLU CG . 18768 1
24 . 1 1 4 4 ILE H H 1 8.003 0.01 . 1 . . . . A 4 ILE H . 18768 1
25 . 1 1 4 4 ILE HA H 1 4.211 0.01 . 1 . . . . A 4 ILE HA . 18768 1
26 . 1 1 4 4 ILE HB H 1 1.907 0.01 . 1 . . . . A 4 ILE HB . 18768 1
27 . 1 1 4 4 ILE HG12 H 1 1.542 0.01 . 2 . . . . A 4 ILE HG12 . 18768 1
28 . 1 1 4 4 ILE HG13 H 1 1.223 0.01 . 2 . . . . A 4 ILE HG13 . 18768 1
29 . 1 1 4 4 ILE HG21 H 1 0.963 0.01 . 1 . . . . A 4 ILE HG21 . 18768 1
30 . 1 1 4 4 ILE HG22 H 1 0.963 0.01 . 1 . . . . A 4 ILE HG22 . 18768 1
31 . 1 1 4 4 ILE HG23 H 1 0.963 0.01 . 1 . . . . A 4 ILE HG23 . 18768 1
32 . 1 1 4 4 ILE HD11 H 1 0.910 0.01 . 1 . . . . A 4 ILE HD11 . 18768 1
33 . 1 1 4 4 ILE HD12 H 1 0.910 0.01 . 1 . . . . A 4 ILE HD12 . 18768 1
34 . 1 1 4 4 ILE HD13 H 1 0.910 0.01 . 1 . . . . A 4 ILE HD13 . 18768 1
35 . 1 1 4 4 ILE CA C 13 61.753 0.01 . 1 . . . . A 4 ILE CA . 18768 1
36 . 1 1 4 4 ILE CB C 13 39.574 0.01 . 1 . . . . A 4 ILE CB . 18768 1
37 . 1 1 4 4 ILE CG1 C 13 27.606 0.01 . 1 . . . . A 4 ILE CG1 . 18768 1
38 . 1 1 4 4 ILE CG2 C 13 17.294 0.01 . 1 . . . . A 4 ILE CG2 . 18768 1
39 . 1 1 4 4 ILE CD1 C 13 12.565 0.01 . 1 . . . . A 4 ILE CD1 . 18768 1
40 . 1 1 5 5 ILE H H 1 7.810 0.01 . 1 . . . . A 5 ILE H . 18768 1
41 . 1 1 5 5 ILE HA H 1 4.214 0.01 . 1 . . . . A 5 ILE HA . 18768 1
42 . 1 1 5 5 ILE HB H 1 1.929 0.01 . 1 . . . . A 5 ILE HB . 18768 1
43 . 1 1 5 5 ILE HG12 H 1 1.556 0.01 . 2 . . . . A 5 ILE HG12 . 18768 1
44 . 1 1 5 5 ILE HG13 H 1 1.216 0.01 . 2 . . . . A 5 ILE HG13 . 18768 1
45 . 1 1 5 5 ILE HG21 H 1 0.930 0.01 . 1 . . . . A 5 ILE HG21 . 18768 1
46 . 1 1 5 5 ILE HG22 H 1 0.930 0.01 . 1 . . . . A 5 ILE HG22 . 18768 1
47 . 1 1 5 5 ILE HG23 H 1 0.930 0.01 . 1 . . . . A 5 ILE HG23 . 18768 1
48 . 1 1 5 5 ILE HD11 H 1 0.909 0.01 . 1 . . . . A 5 ILE HD11 . 18768 1
49 . 1 1 5 5 ILE HD12 H 1 0.909 0.01 . 1 . . . . A 5 ILE HD12 . 18768 1
50 . 1 1 5 5 ILE HD13 H 1 0.909 0.01 . 1 . . . . A 5 ILE HD13 . 18768 1
51 . 1 1 5 5 ILE CA C 13 61.756 0.01 . 1 . . . . A 5 ILE CA . 18768 1
52 . 1 1 5 5 ILE CB C 13 39.106 0.01 . 1 . . . . A 5 ILE CB . 18768 1
53 . 1 1 5 5 ILE CG1 C 13 27.606 0.01 . 1 . . . . A 5 ILE CG1 . 18768 1
54 . 1 1 5 5 ILE CG2 C 13 17.303 0.01 . 1 . . . . A 5 ILE CG2 . 18768 1
55 . 1 1 5 5 ILE CD1 C 13 12.557 0.01 . 1 . . . . A 5 ILE CD1 . 18768 1
56 . 1 1 6 6 GLY H H 1 8.225 0.01 . 1 . . . . A 6 GLY H . 18768 1
57 . 1 1 6 6 GLY HA2 H 1 4.003 0.01 . 2 . . . . A 6 GLY HA2 . 18768 1
58 . 1 1 6 6 GLY HA3 H 1 3.933 0.01 . 2 . . . . A 6 GLY HA3 . 18768 1
59 . 1 1 6 6 GLY CA C 13 45.693 0.01 . 1 . . . . A 6 GLY CA . 18768 1
60 . 1 1 7 7 GLY H H 1 8.072 0.01 . 1 . . . . A 7 GLY H . 18768 1
61 . 1 1 7 7 GLY HA2 H 1 3.981 0.01 . 1 . . . . A 7 GLY HA2 . 18768 1
62 . 1 1 7 7 GLY HA3 H 1 3.981 0.01 . 1 . . . . A 7 GLY HA3 . 18768 1
63 . 1 1 7 7 GLY CA C 13 45.509 0.01 . 1 . . . . A 7 GLY CA . 18768 1
64 . 1 1 8 8 LEU H H 1 7.830 0.01 . 1 . . . . A 8 LEU H . 18768 1
65 . 1 1 8 8 LEU HA H 1 4.495 0.01 . 1 . . . . A 8 LEU HA . 18768 1
66 . 1 1 8 8 LEU HB2 H 1 1.694 0.01 . 1 . . . . A 8 LEU HB2 . 18768 1
67 . 1 1 8 8 LEU HB3 H 1 1.694 0.01 . 1 . . . . A 8 LEU HB3 . 18768 1
68 . 1 1 8 8 LEU HD11 H 1 0.973 0.01 . 2 . . . . A 8 LEU HD11 . 18768 1
69 . 1 1 8 8 LEU HD12 H 1 0.973 0.01 . 2 . . . . A 8 LEU HD12 . 18768 1
70 . 1 1 8 8 LEU HD13 H 1 0.973 0.01 . 2 . . . . A 8 LEU HD13 . 18768 1
71 . 1 1 8 8 LEU HD21 H 1 0.934 0.01 . 2 . . . . A 8 LEU HD21 . 18768 1
72 . 1 1 8 8 LEU HD22 H 1 0.934 0.01 . 2 . . . . A 8 LEU HD22 . 18768 1
73 . 1 1 8 8 LEU HD23 H 1 0.934 0.01 . 2 . . . . A 8 LEU HD23 . 18768 1
74 . 1 1 8 8 LEU CA C 13 55.551 0.01 . 1 . . . . A 8 LEU CA . 18768 1
75 . 1 1 8 8 LEU CB C 13 43.092 0.01 . 1 . . . . A 8 LEU CB . 18768 1
76 . 1 1 8 8 LEU CD1 C 13 24.607 0.01 . 2 . . . . A 8 LEU CD1 . 18768 1
77 . 1 1 8 8 LEU CD2 C 13 23.401 0.01 . 2 . . . . A 8 LEU CD2 . 18768 1
78 . 1 1 9 9 THR H H 1 7.950 0.01 . 1 . . . . A 9 THR H . 18768 1
79 . 1 1 9 9 THR HA H 1 4.407 0.01 . 1 . . . . A 9 THR HA . 18768 1
80 . 1 1 9 9 THR HB H 1 4.234 0.01 . 1 . . . . A 9 THR HB . 18768 1
81 . 1 1 9 9 THR HG21 H 1 1.211 0.01 . 1 . . . . A 9 THR HG21 . 18768 1
82 . 1 1 9 9 THR HG22 H 1 1.211 0.01 . 1 . . . . A 9 THR HG22 . 18768 1
83 . 1 1 9 9 THR HG23 H 1 1.211 0.01 . 1 . . . . A 9 THR HG23 . 18768 1
84 . 1 1 9 9 THR CA C 13 61.813 0.01 . 1 . . . . A 9 THR CA . 18768 1
85 . 1 1 9 9 THR CB C 13 70.065 0.01 . 1 . . . . A 9 THR CB . 18768 1
86 . 1 1 9 9 THR CG2 C 13 21.260 0.01 . 1 . . . . A 9 THR CG2 . 18768 1
87 . 1 1 10 10 ILE H H 1 7.704 0.01 . 1 . . . . A 10 ILE H . 18768 1
88 . 1 1 10 10 ILE HA H 1 4.604 0.01 . 1 . . . . A 10 ILE HA . 18768 1
89 . 1 1 10 10 ILE HB H 1 1.907 0.01 . 1 . . . . A 10 ILE HB . 18768 1
90 . 1 1 10 10 ILE HG12 H 1 1.568 0.01 . 2 . . . . A 10 ILE HG12 . 18768 1
91 . 1 1 10 10 ILE HG13 H 1 1.203 0.01 . 2 . . . . A 10 ILE HG13 . 18768 1
92 . 1 1 10 10 ILE HG21 H 1 1.007 0.01 . 1 . . . . A 10 ILE HG21 . 18768 1
93 . 1 1 10 10 ILE HG22 H 1 1.007 0.01 . 1 . . . . A 10 ILE HG22 . 18768 1
94 . 1 1 10 10 ILE HG23 H 1 1.007 0.01 . 1 . . . . A 10 ILE HG23 . 18768 1
95 . 1 1 10 10 ILE HD11 H 1 0.893 0.01 . 1 . . . . A 10 ILE HD11 . 18768 1
96 . 1 1 10 10 ILE HD12 H 1 0.893 0.01 . 1 . . . . A 10 ILE HD12 . 18768 1
97 . 1 1 10 10 ILE HD13 H 1 0.893 0.01 . 1 . . . . A 10 ILE HD13 . 18768 1
98 . 1 1 10 10 ILE CA C 13 58.727 0.01 . 1 . . . . A 10 ILE CA . 18768 1
99 . 1 1 10 10 ILE CB C 13 39.166 0.01 . 1 . . . . A 10 ILE CB . 18768 1
100 . 1 1 10 10 ILE CG1 C 13 27.020 0.01 . 1 . . . . A 10 ILE CG1 . 18768 1
101 . 1 1 10 10 ILE CG2 C 13 17.165 0.01 . 1 . . . . A 10 ILE CG2 . 18768 1
102 . 1 1 10 10 ILE CD1 C 13 12.448 0.01 . 1 . . . . A 10 ILE CD1 . 18768 1
103 . 1 1 11 11 PRO HA H 1 4.699 0.01 . 1 . . . . A 11 PRO HA . 18768 1
104 . 1 1 11 11 PRO HB2 H 1 2.494 0.01 . 2 . . . . A 11 PRO HB2 . 18768 1
105 . 1 1 11 11 PRO HB3 H 1 1.933 0.01 . 2 . . . . A 11 PRO HB3 . 18768 1
106 . 1 1 11 11 PRO HG2 H 1 2.157 0.01 . 1 . . . . A 11 PRO HG2 . 18768 1
107 . 1 1 11 11 PRO HG3 H 1 2.157 0.01 . 1 . . . . A 11 PRO HG3 . 18768 1
108 . 1 1 11 11 PRO HD2 H 1 4.089 0.01 . 2 . . . . A 11 PRO HD2 . 18768 1
109 . 1 1 11 11 PRO HD3 H 1 3.611 0.01 . 2 . . . . A 11 PRO HD3 . 18768 1
110 . 1 1 11 11 PRO CA C 13 62.539 0.01 . 1 . . . . A 11 PRO CA . 18768 1
111 . 1 1 11 11 PRO CB C 13 31.419 0.01 . 1 . . . . A 11 PRO CB . 18768 1
112 . 1 1 11 11 PRO CG C 13 27.742 0.01 . 1 . . . . A 11 PRO CG . 18768 1
113 . 1 1 11 11 PRO CD C 13 50.965 0.01 . 1 . . . . A 11 PRO CD . 18768 1
114 . 1 1 12 12 PRO HA H 1 4.397 0.01 . 1 . . . . A 12 PRO HA . 18768 1
115 . 1 1 12 12 PRO HB2 H 1 2.391 0.01 . 2 . . . . A 12 PRO HB2 . 18768 1
116 . 1 1 12 12 PRO HB3 H 1 2.018 0.01 . 2 . . . . A 12 PRO HB3 . 18768 1
117 . 1 1 12 12 PRO HG2 H 1 2.141 0.01 . 1 . . . . A 12 PRO HG2 . 18768 1
118 . 1 1 12 12 PRO HG3 H 1 2.141 0.01 . 1 . . . . A 12 PRO HG3 . 18768 1
119 . 1 1 12 12 PRO HD2 H 1 3.922 0.01 . 2 . . . . A 12 PRO HD2 . 18768 1
120 . 1 1 12 12 PRO HD3 H 1 3.768 0.01 . 2 . . . . A 12 PRO HD3 . 18768 1
121 . 1 1 12 12 PRO CA C 13 65.575 0.01 . 1 . . . . A 12 PRO CA . 18768 1
122 . 1 1 12 12 PRO CB C 13 31.651 0.01 . 1 . . . . A 12 PRO CB . 18768 1
123 . 1 1 12 12 PRO CG C 13 27.734 0.01 . 1 . . . . A 12 PRO CG . 18768 1
124 . 1 1 12 12 PRO CD C 13 50.630 0.01 . 1 . . . . A 12 PRO CD . 18768 1
125 . 1 1 13 13 VAL H H 1 7.170 0.01 . 1 . . . . A 13 VAL H . 18768 1
126 . 1 1 13 13 VAL HA H 1 3.906 0.01 . 1 . . . . A 13 VAL HA . 18768 1
127 . 1 1 13 13 VAL HB H 1 2.142 0.01 . 1 . . . . A 13 VAL HB . 18768 1
128 . 1 1 13 13 VAL HG11 H 1 1.056 0.01 . 2 . . . . A 13 VAL HG11 . 18768 1
129 . 1 1 13 13 VAL HG12 H 1 1.056 0.01 . 2 . . . . A 13 VAL HG12 . 18768 1
130 . 1 1 13 13 VAL HG13 H 1 1.056 0.01 . 2 . . . . A 13 VAL HG13 . 18768 1
131 . 1 1 13 13 VAL HG21 H 1 1.007 0.01 . 2 . . . . A 13 VAL HG21 . 18768 1
132 . 1 1 13 13 VAL HG22 H 1 1.007 0.01 . 2 . . . . A 13 VAL HG22 . 18768 1
133 . 1 1 13 13 VAL HG23 H 1 1.007 0.01 . 2 . . . . A 13 VAL HG23 . 18768 1
134 . 1 1 13 13 VAL CA C 13 65.526 0.01 . 1 . . . . A 13 VAL CA . 18768 1
135 . 1 1 13 13 VAL CB C 13 32.068 0.01 . 1 . . . . A 13 VAL CB . 18768 1
136 . 1 1 13 13 VAL CG1 C 13 22.370 0.01 . 2 . . . . A 13 VAL CG1 . 18768 1
137 . 1 1 13 13 VAL CG2 C 13 20.465 0.01 . 2 . . . . A 13 VAL CG2 . 18768 1
138 . 1 1 14 14 VAL H H 1 7.270 0.01 . 1 . . . . A 14 VAL H . 18768 1
139 . 1 1 14 14 VAL HA H 1 3.666 0.01 . 1 . . . . A 14 VAL HA . 18768 1
140 . 1 1 14 14 VAL HB H 1 2.147 0.01 . 1 . . . . A 14 VAL HB . 18768 1
141 . 1 1 14 14 VAL HG11 H 1 1.063 0.01 . 2 . . . . A 14 VAL HG11 . 18768 1
142 . 1 1 14 14 VAL HG12 H 1 1.063 0.01 . 2 . . . . A 14 VAL HG12 . 18768 1
143 . 1 1 14 14 VAL HG13 H 1 1.063 0.01 . 2 . . . . A 14 VAL HG13 . 18768 1
144 . 1 1 14 14 VAL HG21 H 1 0.982 0.01 . 2 . . . . A 14 VAL HG21 . 18768 1
145 . 1 1 14 14 VAL HG22 H 1 0.982 0.01 . 2 . . . . A 14 VAL HG22 . 18768 1
146 . 1 1 14 14 VAL HG23 H 1 0.982 0.01 . 2 . . . . A 14 VAL HG23 . 18768 1
147 . 1 1 14 14 VAL CA C 13 66.608 0.01 . 1 . . . . A 14 VAL CA . 18768 1
148 . 1 1 14 14 VAL CB C 13 32.094 0.01 . 1 . . . . A 14 VAL CB . 18768 1
149 . 1 1 14 14 VAL CG1 C 13 21.317 0.01 . 2 . . . . A 14 VAL CG1 . 18768 1
150 . 1 1 14 14 VAL CG2 C 13 21.029 0.01 . 2 . . . . A 14 VAL CG2 . 18768 1
151 . 1 1 15 15 ALA H H 1 7.538 0.01 . 1 . . . . A 15 ALA H . 18768 1
152 . 1 1 15 15 ALA HA H 1 4.014 0.01 . 1 . . . . A 15 ALA HA . 18768 1
153 . 1 1 15 15 ALA HB1 H 1 1.499 0.01 . 1 . . . . A 15 ALA HB1 . 18768 1
154 . 1 1 15 15 ALA HB2 H 1 1.499 0.01 . 1 . . . . A 15 ALA HB2 . 18768 1
155 . 1 1 15 15 ALA HB3 H 1 1.499 0.01 . 1 . . . . A 15 ALA HB3 . 18768 1
156 . 1 1 15 15 ALA CA C 13 54.676 0.01 . 1 . . . . A 15 ALA CA . 18768 1
157 . 1 1 15 15 ALA CB C 13 17.857 0.01 . 1 . . . . A 15 ALA CB . 18768 1
158 . 1 1 16 16 LEU H H 1 7.857 0.01 . 1 . . . . A 16 LEU H . 18768 1
159 . 1 1 16 16 LEU HA H 1 4.159 0.01 . 1 . . . . A 16 LEU HA . 18768 1
160 . 1 1 16 16 LEU HB2 H 1 1.937 0.01 . 2 . . . . A 16 LEU HB2 . 18768 1
161 . 1 1 16 16 LEU HB3 H 1 1.747 0.01 . 2 . . . . A 16 LEU HB3 . 18768 1
162 . 1 1 16 16 LEU HG H 1 1.743 0.01 . 1 . . . . A 16 LEU HG . 18768 1
163 . 1 1 16 16 LEU HD11 H 1 0.950 0.01 . 2 . . . . A 16 LEU HD11 . 18768 1
164 . 1 1 16 16 LEU HD12 H 1 0.950 0.01 . 2 . . . . A 16 LEU HD12 . 18768 1
165 . 1 1 16 16 LEU HD13 H 1 0.950 0.01 . 2 . . . . A 16 LEU HD13 . 18768 1
166 . 1 1 16 16 LEU HD21 H 1 0.920 0.01 . 2 . . . . A 16 LEU HD21 . 18768 1
167 . 1 1 16 16 LEU HD22 H 1 0.920 0.01 . 2 . . . . A 16 LEU HD22 . 18768 1
168 . 1 1 16 16 LEU HD23 H 1 0.920 0.01 . 2 . . . . A 16 LEU HD23 . 18768 1
169 . 1 1 16 16 LEU CA C 13 58.556 0.01 . 1 . . . . A 16 LEU CA . 18768 1
170 . 1 1 16 16 LEU CB C 13 42.076 0.01 . 1 . . . . A 16 LEU CB . 18768 1
171 . 1 1 16 16 LEU CG C 13 27.305 0.01 . 1 . . . . A 16 LEU CG . 18768 1
172 . 1 1 16 16 LEU CD1 C 13 24.256 0.01 . 2 . . . . A 16 LEU CD1 . 18768 1
173 . 1 1 16 16 LEU CD2 C 13 23.326 0.01 . 2 . . . . A 16 LEU CD2 . 18768 1
174 . 1 1 17 17 VAL H H 1 8.136 0.01 . 1 . . . . A 17 VAL H . 18768 1
175 . 1 1 17 17 VAL HA H 1 3.629 0.01 . 1 . . . . A 17 VAL HA . 18768 1
176 . 1 1 17 17 VAL HB H 1 2.383 0.01 . 1 . . . . A 17 VAL HB . 18768 1
177 . 1 1 17 17 VAL HG11 H 1 1.130 0.01 . 2 . . . . A 17 VAL HG11 . 18768 1
178 . 1 1 17 17 VAL HG12 H 1 1.130 0.01 . 2 . . . . A 17 VAL HG12 . 18768 1
179 . 1 1 17 17 VAL HG13 H 1 1.130 0.01 . 2 . . . . A 17 VAL HG13 . 18768 1
180 . 1 1 17 17 VAL HG21 H 1 0.969 0.01 . 2 . . . . A 17 VAL HG21 . 18768 1
181 . 1 1 17 17 VAL HG22 H 1 0.969 0.01 . 2 . . . . A 17 VAL HG22 . 18768 1
182 . 1 1 17 17 VAL HG23 H 1 0.969 0.01 . 2 . . . . A 17 VAL HG23 . 18768 1
183 . 1 1 17 17 VAL CA C 13 67.732 0.01 . 1 . . . . A 17 VAL CA . 18768 1
184 . 1 1 17 17 VAL CB C 13 32.060 0.01 . 1 . . . . A 17 VAL CB . 18768 1
185 . 1 1 17 17 VAL CG1 C 13 22.322 0.01 . 2 . . . . A 17 VAL CG1 . 18768 1
186 . 1 1 17 17 VAL CG2 C 13 20.806 0.01 . 2 . . . . A 17 VAL CG2 . 18768 1
187 . 1 1 18 18 VAL H H 1 8.535 0.01 . 1 . . . . A 18 VAL H . 18768 1
188 . 1 1 18 18 VAL HA H 1 3.645 0.01 . 1 . . . . A 18 VAL HA . 18768 1
189 . 1 1 18 18 VAL HB H 1 2.234 0.01 . 1 . . . . A 18 VAL HB . 18768 1
190 . 1 1 18 18 VAL HG11 H 1 1.103 0.01 . 2 . . . . A 18 VAL HG11 . 18768 1
191 . 1 1 18 18 VAL HG12 H 1 1.103 0.01 . 2 . . . . A 18 VAL HG12 . 18768 1
192 . 1 1 18 18 VAL HG13 H 1 1.103 0.01 . 2 . . . . A 18 VAL HG13 . 18768 1
193 . 1 1 18 18 VAL HG21 H 1 0.978 0.01 . 2 . . . . A 18 VAL HG21 . 18768 1
194 . 1 1 18 18 VAL HG22 H 1 0.978 0.01 . 2 . . . . A 18 VAL HG22 . 18768 1
195 . 1 1 18 18 VAL HG23 H 1 0.978 0.01 . 2 . . . . A 18 VAL HG23 . 18768 1
196 . 1 1 18 18 VAL CA C 13 67.868 0.01 . 1 . . . . A 18 VAL CA . 18768 1
197 . 1 1 18 18 VAL CB C 13 32.143 0.01 . 1 . . . . A 18 VAL CB . 18768 1
198 . 1 1 18 18 VAL CG1 C 13 22.475 0.01 . 2 . . . . A 18 VAL CG1 . 18768 1
199 . 1 1 18 18 VAL CG2 C 13 20.768 0.01 . 2 . . . . A 18 VAL CG2 . 18768 1
200 . 1 1 19 19 MET H H 1 8.788 0.01 . 1 . . . . A 19 MET H . 18768 1
201 . 1 1 19 19 MET HA H 1 4.359 0.01 . 1 . . . . A 19 MET HA . 18768 1
202 . 1 1 19 19 MET HB2 H 1 2.347 0.01 . 2 . . . . A 19 MET HB2 . 18768 1
203 . 1 1 19 19 MET HB3 H 1 2.154 0.01 . 2 . . . . A 19 MET HB3 . 18768 1
204 . 1 1 19 19 MET HG2 H 1 2.828 0.01 . 2 . . . . A 19 MET HG2 . 18768 1
205 . 1 1 19 19 MET HG3 H 1 2.635 0.01 . 2 . . . . A 19 MET HG3 . 18768 1
206 . 1 1 19 19 MET HE1 H 1 2.032 0.01 . 1 . . . . A 19 MET HE1 . 18768 1
207 . 1 1 19 19 MET HE2 H 1 2.032 0.01 . 1 . . . . A 19 MET HE2 . 18768 1
208 . 1 1 19 19 MET HE3 H 1 2.032 0.01 . 1 . . . . A 19 MET HE3 . 18768 1
209 . 1 1 19 19 MET CA C 13 59.102 0.01 . 1 . . . . A 19 MET CA . 18768 1
210 . 1 1 19 19 MET CB C 13 32.616 0.01 . 1 . . . . A 19 MET CB . 18768 1
211 . 1 1 19 19 MET CG C 13 32.723 0.01 . 1 . . . . A 19 MET CG . 18768 1
212 . 1 1 19 19 MET CE C 13 16.244 0.01 . 1 . . . . A 19 MET CE . 18768 1
213 . 1 1 20 20 SER H H 1 8.348 0.01 . 1 . . . . A 20 SER H . 18768 1
214 . 1 1 20 20 SER HA H 1 4.359 0.01 . 1 . . . . A 20 SER HA . 18768 1
215 . 1 1 20 20 SER HB2 H 1 4.165 0.01 . 2 . . . . A 20 SER HB2 . 18768 1
216 . 1 1 20 20 SER HB3 H 1 4.079 0.01 . 2 . . . . A 20 SER HB3 . 18768 1
217 . 1 1 20 20 SER CA C 13 62.184 0.01 . 1 . . . . A 20 SER CA . 18768 1
218 . 1 1 20 20 SER CB C 13 63.202 0.01 . 1 . . . . A 20 SER CB . 18768 1
219 . 1 1 21 21 ARG H H 1 8.134 0.01 . 1 . . . . A 21 ARG H . 18768 1
220 . 1 1 21 21 ARG HA H 1 4.277 0.01 . 1 . . . . A 21 ARG HA . 18768 1
221 . 1 1 21 21 ARG HB2 H 1 2.021 0.01 . 2 . . . . A 21 ARG HB2 . 18768 1
222 . 1 1 21 21 ARG HB3 H 1 1.957 0.01 . 2 . . . . A 21 ARG HB3 . 18768 1
223 . 1 1 21 21 ARG HG2 H 1 1.802 0.01 . 2 . . . . A 21 ARG HG2 . 18768 1
224 . 1 1 21 21 ARG HG3 H 1 1.688 0.01 . 2 . . . . A 21 ARG HG3 . 18768 1
225 . 1 1 21 21 ARG HD2 H 1 3.137 0.01 . 1 . . . . A 21 ARG HD2 . 18768 1
226 . 1 1 21 21 ARG HD3 H 1 3.137 0.01 . 1 . . . . A 21 ARG HD3 . 18768 1
227 . 1 1 21 21 ARG HE H 1 7.041 0.01 . 1 . . . . A 21 ARG HE . 18768 1
228 . 1 1 21 21 ARG CA C 13 58.972 0.01 . 1 . . . . A 21 ARG CA . 18768 1
229 . 1 1 21 21 ARG CB C 13 30.267 0.01 . 1 . . . . A 21 ARG CB . 18768 1
230 . 1 1 21 21 ARG CG C 13 27.612 0.01 . 1 . . . . A 21 ARG CG . 18768 1
231 . 1 1 21 21 ARG CD C 13 43.492 0.01 . 1 . . . . A 21 ARG CD . 18768 1
232 . 1 1 22 22 PHE H H 1 8.414 0.01 . 1 . . . . A 22 PHE H . 18768 1
233 . 1 1 22 22 PHE HA H 1 4.560 0.01 . 1 . . . . A 22 PHE HA . 18768 1
234 . 1 1 22 22 PHE HB2 H 1 3.296 0.01 . 1 . . . . A 22 PHE HB2 . 18768 1
235 . 1 1 22 22 PHE HB3 H 1 3.296 0.01 . 1 . . . . A 22 PHE HB3 . 18768 1
236 . 1 1 22 22 PHE HD1 H 1 7.346 0.01 . 1 . . . . A 22 PHE HD1 . 18768 1
237 . 1 1 22 22 PHE HD2 H 1 7.346 0.01 . 1 . . . . A 22 PHE HD2 . 18768 1
238 . 1 1 22 22 PHE CA C 13 61.080 0.01 . 1 . . . . A 22 PHE CA . 18768 1
239 . 1 1 22 22 PHE CB C 13 39.364 0.01 . 1 . . . . A 22 PHE CB . 18768 1
240 . 1 1 23 23 GLY H H 1 8.452 0.01 . 1 . . . . A 23 GLY H . 18768 1
241 . 1 1 23 23 GLY HA2 H 1 4.035 0.01 . 2 . . . . A 23 GLY HA2 . 18768 1
242 . 1 1 23 23 GLY HA3 H 1 3.901 0.01 . 2 . . . . A 23 GLY HA3 . 18768 1
243 . 1 1 23 23 GLY CA C 13 47.190 0.01 . 1 . . . . A 23 GLY CA . 18768 1
244 . 1 1 24 24 PHE H H 1 8.065 0.01 . 1 . . . . A 24 PHE H . 18768 1
245 . 1 1 24 24 PHE HA H 1 4.341 0.01 . 1 . . . . A 24 PHE HA . 18768 1
246 . 1 1 24 24 PHE HB2 H 1 3.199 0.01 . 2 . . . . A 24 PHE HB2 . 18768 1
247 . 1 1 24 24 PHE HB3 H 1 3.110 0.01 . 2 . . . . A 24 PHE HB3 . 18768 1
248 . 1 1 24 24 PHE HD1 H 1 6.912 0.01 . 1 . . . . A 24 PHE HD1 . 18768 1
249 . 1 1 24 24 PHE HD2 H 1 6.912 0.01 . 1 . . . . A 24 PHE HD2 . 18768 1
250 . 1 1 24 24 PHE HE1 H 1 7.216 0.01 . 1 . . . . A 24 PHE HE1 . 18768 1
251 . 1 1 24 24 PHE HE2 H 1 7.216 0.01 . 1 . . . . A 24 PHE HE2 . 18768 1
252 . 1 1 24 24 PHE CA C 13 61.428 0.01 . 1 . . . . A 24 PHE CA . 18768 1
253 . 1 1 24 24 PHE CB C 13 39.448 0.01 . 1 . . . . A 24 PHE CB . 18768 1
254 . 1 1 25 25 PHE H H 1 8.097 0.01 . 1 . . . . A 25 PHE H . 18768 1
255 . 1 1 25 25 PHE HA H 1 4.234 0.01 . 1 . . . . A 25 PHE HA . 18768 1
256 . 1 1 25 25 PHE HB2 H 1 3.241 0.01 . 2 . . . . A 25 PHE HB2 . 18768 1
257 . 1 1 25 25 PHE HB3 H 1 3.139 0.01 . 2 . . . . A 25 PHE HB3 . 18768 1
258 . 1 1 25 25 PHE HD1 H 1 7.341 0.01 . 1 . . . . A 25 PHE HD1 . 18768 1
259 . 1 1 25 25 PHE HD2 H 1 7.341 0.01 . 1 . . . . A 25 PHE HD2 . 18768 1
260 . 1 1 25 25 PHE CA C 13 61.230 0.01 . 1 . . . . A 25 PHE CA . 18768 1
261 . 1 1 25 25 PHE CB C 13 38.920 0.01 . 1 . . . . A 25 PHE CB . 18768 1
262 . 1 1 26 26 ALA H H 1 8.340 0.01 . 1 . . . . A 26 ALA H . 18768 1
263 . 1 1 26 26 ALA HA H 1 4.018 0.01 . 1 . . . . A 26 ALA HA . 18768 1
264 . 1 1 26 26 ALA HB1 H 1 1.303 0.01 . 1 . . . . A 26 ALA HB1 . 18768 1
265 . 1 1 26 26 ALA HB2 H 1 1.303 0.01 . 1 . . . . A 26 ALA HB2 . 18768 1
266 . 1 1 26 26 ALA HB3 H 1 1.303 0.01 . 1 . . . . A 26 ALA HB3 . 18768 1
267 . 1 1 26 26 ALA CA C 13 55.800 0.01 . 1 . . . . A 26 ALA CA . 18768 1
268 . 1 1 26 26 ALA CB C 13 17.992 0.01 . 1 . . . . A 26 ALA CB . 18768 1
269 . 1 1 27 27 HIS H H 1 7.743 0.01 . 1 . . . . A 27 HIS H . 18768 1
270 . 1 1 27 27 HIS HA H 1 4.472 0.01 . 1 . . . . A 27 HIS HA . 18768 1
271 . 1 1 27 27 HIS HB2 H 1 3.346 0.01 . 2 . . . . A 27 HIS HB2 . 18768 1
272 . 1 1 27 27 HIS HB3 H 1 3.242 0.01 . 2 . . . . A 27 HIS HB3 . 18768 1
273 . 1 1 27 27 HIS HD2 H 1 7.346 0.01 . 1 . . . . A 27 HIS HD2 . 18768 1
274 . 1 1 27 27 HIS HE1 H 1 8.416 0.01 . 1 . . . . A 27 HIS HE1 . 18768 1
275 . 1 1 27 27 HIS CA C 13 57.355 0.01 . 1 . . . . A 27 HIS CA . 18768 1
276 . 1 1 27 27 HIS CB C 13 28.320 0.01 . 1 . . . . A 27 HIS CB . 18768 1
277 . 1 1 28 28 LEU H H 1 7.749 0.01 . 1 . . . . A 28 LEU H . 18768 1
278 . 1 1 28 28 LEU HA H 1 4.285 0.01 . 1 . . . . A 28 LEU HA . 18768 1
279 . 1 1 28 28 LEU HB2 H 1 1.683 0.01 . 2 . . . . A 28 LEU HB2 . 18768 1
280 . 1 1 28 28 LEU HB3 H 1 1.577 0.01 . 2 . . . . A 28 LEU HB3 . 18768 1
281 . 1 1 28 28 LEU HG H 1 1.534 0.01 . 1 . . . . A 28 LEU HG . 18768 1
282 . 1 1 28 28 LEU HD11 H 1 0.839 0.01 . 2 . . . . A 28 LEU HD11 . 18768 1
283 . 1 1 28 28 LEU HD12 H 1 0.839 0.01 . 2 . . . . A 28 LEU HD12 . 18768 1
284 . 1 1 28 28 LEU HD13 H 1 0.839 0.01 . 2 . . . . A 28 LEU HD13 . 18768 1
285 . 1 1 28 28 LEU HD21 H 1 0.790 0.01 . 2 . . . . A 28 LEU HD21 . 18768 1
286 . 1 1 28 28 LEU HD22 H 1 0.790 0.01 . 2 . . . . A 28 LEU HD22 . 18768 1
287 . 1 1 28 28 LEU HD23 H 1 0.790 0.01 . 2 . . . . A 28 LEU HD23 . 18768 1
288 . 1 1 28 28 LEU CA C 13 55.890 0.01 . 1 . . . . A 28 LEU CA . 18768 1
289 . 1 1 28 28 LEU CB C 13 43.092 0.01 . 1 . . . . A 28 LEU CB . 18768 1
290 . 1 1 28 28 LEU CG C 13 27.016 0.01 . 1 . . . . A 28 LEU CG . 18768 1
291 . 1 1 28 28 LEU CD1 C 13 24.821 0.01 . 2 . . . . A 28 LEU CD1 . 18768 1
292 . 1 1 28 28 LEU CD2 C 13 22.885 0.01 . 2 . . . . A 28 LEU CD2 . 18768 1
293 . 1 1 29 29 LEU H H 1 7.406 0.01 . 1 . . . . A 29 LEU H . 18768 1
294 . 1 1 29 29 LEU HA H 1 4.513 0.01 . 1 . . . . A 29 LEU HA . 18768 1
295 . 1 1 29 29 LEU HB2 H 1 1.697 0.01 . 2 . . . . A 29 LEU HB2 . 18768 1
296 . 1 1 29 29 LEU HB3 H 1 1.520 0.01 . 2 . . . . A 29 LEU HB3 . 18768 1
297 . 1 1 29 29 LEU HG H 1 1.759 0.01 . 1 . . . . A 29 LEU HG . 18768 1
298 . 1 1 29 29 LEU HD11 H 1 0.939 0.01 . 2 . . . . A 29 LEU HD11 . 18768 1
299 . 1 1 29 29 LEU HD12 H 1 0.939 0.01 . 2 . . . . A 29 LEU HD12 . 18768 1
300 . 1 1 29 29 LEU HD13 H 1 0.939 0.01 . 2 . . . . A 29 LEU HD13 . 18768 1
301 . 1 1 29 29 LEU HD21 H 1 0.907 0.01 . 2 . . . . A 29 LEU HD21 . 18768 1
302 . 1 1 29 29 LEU HD22 H 1 0.907 0.01 . 2 . . . . A 29 LEU HD22 . 18768 1
303 . 1 1 29 29 LEU HD23 H 1 0.907 0.01 . 2 . . . . A 29 LEU HD23 . 18768 1
304 . 1 1 29 29 LEU CA C 13 54.236 0.01 . 1 . . . . A 29 LEU CA . 18768 1
305 . 1 1 29 29 LEU CB C 13 41.844 0.01 . 1 . . . . A 29 LEU CB . 18768 1
306 . 1 1 29 29 LEU CG C 13 27.349 0.01 . 1 . . . . A 29 LEU CG . 18768 1
307 . 1 1 29 29 LEU CD1 C 13 24.970 0.01 . 2 . . . . A 29 LEU CD1 . 18768 1
308 . 1 1 29 29 LEU CD2 C 13 22.819 0.01 . 2 . . . . A 29 LEU CD2 . 18768 1
309 . 1 1 30 30 PRO HA H 1 4.447 0.01 . 1 . . . . A 30 PRO HA . 18768 1
310 . 1 1 30 30 PRO HB2 H 1 2.296 0.01 . 2 . . . . A 30 PRO HB2 . 18768 1
311 . 1 1 30 30 PRO HB3 H 1 1.942 0.01 . 2 . . . . A 30 PRO HB3 . 18768 1
312 . 1 1 30 30 PRO HG2 H 1 2.082 0.01 . 2 . . . . A 30 PRO HG2 . 18768 1
313 . 1 1 30 30 PRO HG3 H 1 2.040 0.01 . 2 . . . . A 30 PRO HG3 . 18768 1
314 . 1 1 30 30 PRO HD2 H 1 3.842 0.01 . 2 . . . . A 30 PRO HD2 . 18768 1
315 . 1 1 30 30 PRO HD3 H 1 3.584 0.01 . 2 . . . . A 30 PRO HD3 . 18768 1
316 . 1 1 30 30 PRO CA C 13 63.810 0.01 . 1 . . . . A 30 PRO CA . 18768 1
317 . 1 1 30 30 PRO CB C 13 31.840 0.01 . 1 . . . . A 30 PRO CB . 18768 1
318 . 1 1 30 30 PRO CG C 13 27.571 0.01 . 1 . . . . A 30 PRO CG . 18768 1
319 . 1 1 30 30 PRO CD C 13 50.692 0.01 . 1 . . . . A 30 PRO CD . 18768 1
320 . 1 1 31 31 ARG H H 1 7.969 0.01 . 1 . . . . A 31 ARG H . 18768 1
321 . 1 1 31 31 ARG HA H 1 4.348 0.01 . 1 . . . . A 31 ARG HA . 18768 1
322 . 1 1 31 31 ARG HB2 H 1 1.927 0.01 . 2 . . . . A 31 ARG HB2 . 18768 1
323 . 1 1 31 31 ARG HB3 H 1 1.813 0.01 . 2 . . . . A 31 ARG HB3 . 18768 1
324 . 1 1 31 31 ARG HG2 H 1 1.688 0.01 . 1 . . . . A 31 ARG HG2 . 18768 1
325 . 1 1 31 31 ARG HG3 H 1 1.688 0.01 . 1 . . . . A 31 ARG HG3 . 18768 1
326 . 1 1 31 31 ARG HD2 H 1 3.232 0.01 . 1 . . . . A 31 ARG HD2 . 18768 1
327 . 1 1 31 31 ARG HD3 H 1 3.232 0.01 . 1 . . . . A 31 ARG HD3 . 18768 1
328 . 1 1 31 31 ARG HE H 1 7.203 0.01 . 1 . . . . A 31 ARG HE . 18768 1
329 . 1 1 31 31 ARG CA C 13 55.787 0.01 . 1 . . . . A 31 ARG CA . 18768 1
330 . 1 1 31 31 ARG CB C 13 31.380 0.01 . 1 . . . . A 31 ARG CB . 18768 1
331 . 1 1 31 31 ARG CG C 13 27.357 0.01 . 1 . . . . A 31 ARG CG . 18768 1
332 . 1 1 31 31 ARG CD C 13 43.492 0.01 . 1 . . . . A 31 ARG CD . 18768 1
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