Content for NMR-STAR saveframe, "Lunasin16-43_pH65"
save_Lunasin16-43_pH65
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode Lunasin16-43_pH65
_Assigned_chem_shift_list.Entry_ID 26820
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $pH65
_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
6 '2D 1H-15N HSQC' . . . 26820 2
10 '2D 1H-13C HSQC aliphatic' . . . 26820 2
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 2 2 VAL H H 1 8.460 0.020 . 1 . . . . 2 VAL H . 26820 2
2 . 1 1 2 2 VAL HA H 1 4.142 0.020 . 1 . . . . 2 VAL HA . 26820 2
3 . 1 1 2 2 VAL HB H 1 2.047 0.020 . 1 . . . . 2 VAL HB . 26820 2
4 . 1 1 2 2 VAL HG11 H 1 0.905 0.020 . 1 . . . . 2 VAL QG1 . 26820 2
5 . 1 1 2 2 VAL HG12 H 1 0.905 0.020 . 1 . . . . 2 VAL QG1 . 26820 2
6 . 1 1 2 2 VAL HG13 H 1 0.905 0.020 . 1 . . . . 2 VAL QG1 . 26820 2
7 . 1 1 2 2 VAL HG21 H 1 0.905 0.020 . 1 . . . . 2 VAL QG2 . 26820 2
8 . 1 1 2 2 VAL HG22 H 1 0.905 0.020 . 1 . . . . 2 VAL QG2 . 26820 2
9 . 1 1 2 2 VAL HG23 H 1 0.905 0.020 . 1 . . . . 2 VAL QG2 . 26820 2
10 . 1 1 2 2 VAL CA C 13 62.276 0.3 . 1 . . . . 2 VAL CA . 26820 2
11 . 1 1 2 2 VAL CB C 13 32.962 0.3 . 1 . . . . 2 VAL CB . 26820 2
12 . 1 1 2 2 VAL CG1 C 13 21.054 0.3 . 1 . . . . 2 VAL CG1 . 26820 2
13 . 1 1 2 2 VAL CG2 C 13 20.179 0.3 . 1 . . . . 2 VAL CG2 . 26820 2
14 . 1 1 2 2 VAL N N 15 118.837 0.3 . 1 . . . . 2 VAL N . 26820 2
15 . 1 1 3 3 ASN H H 1 8.614 0.020 . 1 . . . . 3 ASN H . 26820 2
16 . 1 1 3 3 ASN HA H 1 4.720 0.020 . 1 . . . . 3 ASN HA . 26820 2
17 . 1 1 3 3 ASN HB2 H 1 2.810 0.020 . 2 . . . . 3 ASN HB2 . 26820 2
18 . 1 1 3 3 ASN HB3 H 1 2.700 0.020 . 2 . . . . 3 ASN HB3 . 26820 2
19 . 1 1 3 3 ASN HD21 H 1 7.595 0.020 . 1 . . . . 3 ASN HD21 . 26820 2
20 . 1 1 3 3 ASN HD22 H 1 6.906 0.020 . 1 . . . . 3 ASN HD22 . 26820 2
21 . 1 1 3 3 ASN CA C 13 53.084 0.3 . 1 . . . . 3 ASN CA . 26820 2
22 . 1 1 3 3 ASN CB C 13 38.921 0.3 . 1 . . . . 3 ASN CB . 26820 2
23 . 1 1 3 3 ASN N N 15 122.813 0.3 . 1 . . . . 3 ASN N . 26820 2
24 . 1 1 3 3 ASN ND2 N 15 113.086 0.3 . 1 . . . . 3 ASN ND2 . 26820 2
25 . 1 1 4 4 LEU H H 1 8.410 0.020 . 1 . . . . 4 LEU H . 26820 2
26 . 1 1 4 4 LEU HA H 1 4.389 0.020 . 1 . . . . 4 LEU HA . 26820 2
27 . 1 1 4 4 LEU HB2 H 1 1.621 0.020 . 2 . . . . 4 LEU HB2 . 26820 2
28 . 1 1 4 4 LEU HB3 H 1 1.600 0.020 . 2 . . . . 4 LEU HB3 . 26820 2
29 . 1 1 4 4 LEU HG H 1 1.576 0.020 . 1 . . . . 4 LEU HG . 26820 2
30 . 1 1 4 4 LEU HD11 H 1 0.890 0.020 . 2 . . . . 4 LEU QD1 . 26820 2
31 . 1 1 4 4 LEU HD12 H 1 0.890 0.020 . 2 . . . . 4 LEU QD1 . 26820 2
32 . 1 1 4 4 LEU HD13 H 1 0.890 0.020 . 2 . . . . 4 LEU QD1 . 26820 2
33 . 1 1 4 4 LEU HD21 H 1 0.827 0.020 . 2 . . . . 4 LEU QD2 . 26820 2
34 . 1 1 4 4 LEU HD22 H 1 0.827 0.020 . 2 . . . . 4 LEU QD2 . 26820 2
35 . 1 1 4 4 LEU HD23 H 1 0.827 0.020 . 2 . . . . 4 LEU QD2 . 26820 2
36 . 1 1 4 4 LEU CA C 13 55.129 0.3 . 1 . . . . 4 LEU CA . 26820 2
37 . 1 1 4 4 LEU CB C 13 42.586 0.3 . 1 . . . . 4 LEU CB . 26820 2
38 . 1 1 4 4 LEU CG C 13 26.948 0.3 . 1 . . . . 4 LEU CG . 26820 2
39 . 1 1 4 4 LEU CD1 C 13 25.097 0.3 . 1 . . . . 4 LEU CD1 . 26820 2
40 . 1 1 4 4 LEU CD2 C 13 23.268 0.3 . 1 . . . . 4 LEU CD2 . 26820 2
41 . 1 1 4 4 LEU N N 15 123.493 0.3 . 1 . . . . 4 LEU N . 26820 2
42 . 1 1 5 5 THR H H 1 8.269 0.020 . 1 . . . . 5 THR H . 26820 2
43 . 1 1 5 5 THR HA H 1 4.570 0.020 . 1 . . . . 5 THR HA . 26820 2
44 . 1 1 5 5 THR HB H 1 4.204 0.020 . 1 . . . . 5 THR HB . 26820 2
45 . 1 1 5 5 THR HG21 H 1 1.224 0.020 . 1 . . . . 5 THR QG2 . 26820 2
46 . 1 1 5 5 THR HG22 H 1 1.224 0.020 . 1 . . . . 5 THR QG2 . 26820 2
47 . 1 1 5 5 THR HG23 H 1 1.224 0.020 . 1 . . . . 5 THR QG2 . 26820 2
48 . 1 1 5 5 THR CA C 13 59.926 0.3 . 1 . . . . 5 THR CA . 26820 2
49 . 1 1 5 5 THR CB C 13 69.556 0.3 . 1 . . . . 5 THR CB . 26820 2
50 . 1 1 5 5 THR CG2 C 13 21.507 0.3 . 1 . . . . 5 THR CG2 . 26820 2
51 . 1 1 5 5 THR N N 15 117.158 0.3 . 1 . . . . 5 THR N . 26820 2
52 . 1 1 6 6 PRO HA H 1 4.376 0.020 . 1 . . . . 6 PRO HA . 26820 2
53 . 1 1 6 6 PRO HB2 H 1 2.291 0.020 . 2 . . . . 6 PRO HB2 . 26820 2
54 . 1 1 6 6 PRO HB3 H 1 1.921 0.020 . 2 . . . . 6 PRO HB3 . 26820 2
55 . 1 1 6 6 PRO HG2 H 1 2.052 0.020 . 2 . . . . 6 PRO HG2 . 26820 2
56 . 1 1 6 6 PRO HG3 H 1 1.973 0.020 . 2 . . . . 6 PRO HG3 . 26820 2
57 . 1 1 6 6 PRO HD2 H 1 3.821 0.020 . 2 . . . . 6 PRO HD2 . 26820 2
58 . 1 1 6 6 PRO HD3 H 1 3.700 0.020 . 2 . . . . 6 PRO HD3 . 26820 2
59 . 1 1 6 6 PRO CA C 13 63.727 0.3 . 1 . . . . 6 PRO CA . 26820 2
60 . 1 1 6 6 PRO CB C 13 32.126 0.3 . 1 . . . . 6 PRO CB . 26820 2
61 . 1 1 6 6 PRO CG C 13 27.545 0.3 . 1 . . . . 6 PRO CG . 26820 2
62 . 1 1 6 6 PRO CD C 13 51.009 0.3 . 1 . . . . 6 PRO CD . 26820 2
63 . 1 1 7 7 CYS H H 1 8.420 0.020 . 1 . . . . 7 CYS H . 26820 2
64 . 1 1 7 7 CYS HA H 1 4.428 0.020 . 1 . . . . 7 CYS HA . 26820 2
65 . 1 1 7 7 CYS HB2 H 1 2.910 0.020 . 1 . . . . 7 CYS HB2 . 26820 2
66 . 1 1 7 7 CYS HB3 H 1 2.910 0.020 . 1 . . . . 7 CYS HB3 . 26820 2
67 . 1 1 7 7 CYS CA C 13 58.848 0.3 . 1 . . . . 7 CYS CA . 26820 2
68 . 1 1 7 7 CYS CB C 13 27.967 0.3 . 1 . . . . 7 CYS CB . 26820 2
69 . 1 1 7 7 CYS N N 15 119.247 0.3 . 1 . . . . 7 CYS N . 26820 2
70 . 1 1 8 8 GLU H H 1 8.410 0.020 . 1 . . . . 8 GLU H . 26820 2
71 . 1 1 8 8 GLU HA H 1 4.214 0.020 . 1 . . . . 8 GLU HA . 26820 2
72 . 1 1 8 8 GLU HB2 H 1 1.994 0.020 . 2 . . . . 8 GLU HB2 . 26820 2
73 . 1 1 8 8 GLU HB3 H 1 1.944 0.020 . 2 . . . . 8 GLU HB3 . 26820 2
74 . 1 1 8 8 GLU HG2 H 1 2.261 0.020 . 1 . . . . 8 GLU HG2 . 26820 2
75 . 1 1 8 8 GLU HG3 H 1 2.261 0.020 . 1 . . . . 8 GLU HG3 . 26820 2
76 . 1 1 8 8 GLU CA C 13 56.978 0.3 . 1 . . . . 8 GLU CA . 26820 2
77 . 1 1 8 8 GLU CB C 13 30.411 0.3 . 1 . . . . 8 GLU CB . 26820 2
78 . 1 1 8 8 GLU CG C 13 36.364 0.3 . 1 . . . . 8 GLU CG . 26820 2
79 . 1 1 8 8 GLU N N 15 123.868 0.3 . 1 . . . . 8 GLU N . 26820 2
80 . 1 1 9 9 LYS H H 1 8.296 0.020 . 1 . . . . 9 LYS H . 26820 2
81 . 1 1 9 9 LYS HA H 1 4.192 0.020 . 1 . . . . 9 LYS HA . 26820 2
82 . 1 1 9 9 LYS HB2 H 1 1.725 0.020 . 2 . . . . 9 LYS HB2 . 26820 2
83 . 1 1 9 9 LYS HB3 H 1 1.709 0.020 . 2 . . . . 9 LYS HB3 . 26820 2
84 . 1 1 9 9 LYS HG2 H 1 1.388 0.020 . 2 . . . . 9 LYS HG2 . 26820 2
85 . 1 1 9 9 LYS HG3 H 1 1.324 0.020 . 2 . . . . 9 LYS HG3 . 26820 2
86 . 1 1 9 9 LYS HD2 H 1 1.630 0.020 . 1 . . . . 9 LYS HD2 . 26820 2
87 . 1 1 9 9 LYS HD3 H 1 1.630 0.020 . 1 . . . . 9 LYS HD3 . 26820 2
88 . 1 1 9 9 LYS HE2 H 1 2.947 0.020 . 1 . . . . 9 LYS HE2 . 26820 2
89 . 1 1 9 9 LYS HE3 H 1 2.947 0.020 . 1 . . . . 9 LYS HE3 . 26820 2
90 . 1 1 9 9 LYS CA C 13 56.849 0.3 . 1 . . . . 9 LYS CA . 26820 2
91 . 1 1 9 9 LYS CB C 13 33.147 0.3 . 1 . . . . 9 LYS CB . 26820 2
92 . 1 1 9 9 LYS CG C 13 24.846 0.3 . 1 . . . . 9 LYS CG . 26820 2
93 . 1 1 9 9 LYS CD C 13 29.202 0.3 . 1 . . . . 9 LYS CD . 26820 2
94 . 1 1 9 9 LYS CE C 13 42.129 0.3 . 1 . . . . 9 LYS CE . 26820 2
95 . 1 1 9 9 LYS N N 15 122.055 0.3 . 1 . . . . 9 LYS N . 26820 2
96 . 1 1 10 10 HIS H H 1 8.452 0.020 . 1 . . . . 10 HIS H . 26820 2
97 . 1 1 10 10 HIS HA H 1 4.640 0.020 . 1 . . . . 10 HIS HA . 26820 2
98 . 1 1 10 10 HIS HB2 H 1 3.191 0.020 . 2 . . . . 10 HIS HB2 . 26820 2
99 . 1 1 10 10 HIS HB3 H 1 3.127 0.020 . 2 . . . . 10 HIS HB3 . 26820 2
100 . 1 1 10 10 HIS HD1 H 1 7.150 0.020 . 1 . . . . 10 HIS HD1 . 26820 2
101 . 1 1 10 10 HIS HE1 H 1 8.080 0.020 . 1 . . . . 10 HIS HE1 . 26820 2
102 . 1 1 10 10 HIS CA C 13 55.900 0.3 . 1 . . . . 10 HIS CA . 26820 2
103 . 1 1 10 10 HIS CB C 13 29.573 0.3 . 1 . . . . 10 HIS CB . 26820 2
104 . 1 1 10 10 HIS CD2 C 13 120.013 0.3 . 1 . . . . 10 HIS CD2 . 26820 2
105 . 1 1 10 10 HIS N N 15 120.001 0.3 . 1 . . . . 10 HIS N . 26820 2
106 . 1 1 11 11 ILE H H 1 8.078 0.020 . 1 . . . . 11 ILE H . 26820 2
107 . 1 1 11 11 ILE HA H 1 4.060 0.020 . 1 . . . . 11 ILE HA . 26820 2
108 . 1 1 11 11 ILE HB H 1 1.835 0.020 . 1 . . . . 11 ILE HB . 26820 2
109 . 1 1 11 11 ILE HG12 H 1 1.433 0.020 . 2 . . . . 11 ILE HG12 . 26820 2
110 . 1 1 11 11 ILE HG13 H 1 1.143 0.020 . 2 . . . . 11 ILE HG13 . 26820 2
111 . 1 1 11 11 ILE HG21 H 1 0.870 0.020 . 1 . . . . 11 ILE QG2 . 26820 2
112 . 1 1 11 11 ILE HG22 H 1 0.870 0.020 . 1 . . . . 11 ILE QG2 . 26820 2
113 . 1 1 11 11 ILE HG23 H 1 0.870 0.020 . 1 . . . . 11 ILE QG2 . 26820 2
114 . 1 1 11 11 ILE HD11 H 1 0.830 0.020 . 1 . . . . 11 ILE QD1 . 26820 2
115 . 1 1 11 11 ILE HD12 H 1 0.830 0.020 . 1 . . . . 11 ILE QD1 . 26820 2
116 . 1 1 11 11 ILE HD13 H 1 0.830 0.020 . 1 . . . . 11 ILE QD1 . 26820 2
117 . 1 1 11 11 ILE CA C 13 61.648 0.3 . 1 . . . . 11 ILE CA . 26820 2
118 . 1 1 11 11 ILE CB C 13 38.563 0.3 . 1 . . . . 11 ILE CB . 26820 2
119 . 1 1 11 11 ILE CG1 C 13 27.427 0.3 . 1 . . . . 11 ILE CG1 . 26820 2
120 . 1 1 11 11 ILE CG2 C 13 17.514 0.3 . 1 . . . . 11 ILE CG2 . 26820 2
121 . 1 1 11 11 ILE CD1 C 13 12.860 0.3 . 1 . . . . 11 ILE CD1 . 26820 2
122 . 1 1 11 11 ILE N N 15 122.277 0.3 . 1 . . . . 11 ILE N . 26820 2
123 . 1 1 12 12 MET H H 1 8.381 0.020 . 1 . . . . 12 MET H . 26820 2
124 . 1 1 12 12 MET HA H 1 4.423 0.020 . 1 . . . . 12 MET HA . 26820 2
125 . 1 1 12 12 MET HB2 H 1 2.067 0.020 . 2 . . . . 12 MET HB2 . 26820 2
126 . 1 1 12 12 MET HB3 H 1 1.998 0.020 . 2 . . . . 12 MET HB3 . 26820 2
127 . 1 1 12 12 MET HG2 H 1 2.593 0.020 . 2 . . . . 12 MET HG2 . 26820 2
128 . 1 1 12 12 MET HG3 H 1 2.519 0.020 . 2 . . . . 12 MET HG3 . 26820 2
129 . 1 1 12 12 MET HE1 H 1 2.082 0.020 . 1 . . . . 12 MET QE . 26820 2
130 . 1 1 12 12 MET HE2 H 1 2.082 0.020 . 1 . . . . 12 MET QE . 26820 2
131 . 1 1 12 12 MET HE3 H 1 2.082 0.020 . 1 . . . . 12 MET QE . 26820 2
132 . 1 1 12 12 MET CA C 13 55.703 0.3 . 1 . . . . 12 MET CA . 26820 2
133 . 1 1 12 12 MET CB C 13 32.762 0.3 . 1 . . . . 12 MET CB . 26820 2
134 . 1 1 12 12 MET CG C 13 32.022 0.3 . 1 . . . . 12 MET CG . 26820 2
135 . 1 1 12 12 MET CE C 13 16.942 0.3 . 1 . . . . 12 MET CE . 26820 2
136 . 1 1 12 12 MET N N 15 123.671 0.3 . 1 . . . . 12 MET N . 26820 2
137 . 1 1 13 13 GLU H H 1 8.323 0.020 . 1 . . . . 13 GLU H . 26820 2
138 . 1 1 13 13 GLU HA H 1 4.215 0.020 . 1 . . . . 13 GLU HA . 26820 2
139 . 1 1 13 13 GLU HB2 H 1 1.992 0.020 . 2 . . . . 13 GLU HB2 . 26820 2
140 . 1 1 13 13 GLU HB3 H 1 1.931 0.020 . 2 . . . . 13 GLU HB3 . 26820 2
141 . 1 1 13 13 GLU HG2 H 1 2.229 0.020 . 1 . . . . 13 GLU HG2 . 26820 2
142 . 1 1 13 13 GLU HG3 H 1 2.229 0.020 . 1 . . . . 13 GLU HG3 . 26820 2
143 . 1 1 13 13 GLU CA C 13 56.829 0.3 . 1 . . . . 13 GLU CA . 26820 2
144 . 1 1 13 13 GLU CB C 13 30.364 0.3 . 1 . . . . 13 GLU CB . 26820 2
145 . 1 1 13 13 GLU CG C 13 36.310 0.3 . 1 . . . . 13 GLU CG . 26820 2
146 . 1 1 13 13 GLU N N 15 122.082 0.3 . 1 . . . . 13 GLU N . 26820 2
147 . 1 1 14 14 LYS H H 1 8.253 0.020 . 1 . . . . 14 LYS H . 26820 2
148 . 1 1 14 14 LYS HA H 1 4.282 0.020 . 1 . . . . 14 LYS HA . 26820 2
149 . 1 1 14 14 LYS HB2 H 1 1.789 0.020 . 2 . . . . 14 LYS HB2 . 26820 2
150 . 1 1 14 14 LYS HB3 H 1 1.741 0.020 . 2 . . . . 14 LYS HB3 . 26820 2
151 . 1 1 14 14 LYS HG2 H 1 1.406 0.020 . 2 . . . . 14 LYS HG2 . 26820 2
152 . 1 1 14 14 LYS HG3 H 1 1.364 0.020 . 2 . . . . 14 LYS HG3 . 26820 2
153 . 1 1 14 14 LYS HD2 H 1 1.653 0.020 . 1 . . . . 14 LYS HD2 . 26820 2
154 . 1 1 14 14 LYS HD3 H 1 1.653 0.020 . 1 . . . . 14 LYS HD3 . 26820 2
155 . 1 1 14 14 LYS HE2 H 1 2.971 0.020 . 1 . . . . 14 LYS HE2 . 26820 2
156 . 1 1 14 14 LYS HE3 H 1 2.971 0.020 . 1 . . . . 14 LYS HE3 . 26820 2
157 . 1 1 14 14 LYS CA C 13 56.478 0.3 . 1 . . . . 14 LYS CA . 26820 2
158 . 1 1 14 14 LYS CB C 13 32.963 0.3 . 1 . . . . 14 LYS CB . 26820 2
159 . 1 1 14 14 LYS CG C 13 24.802 0.3 . 1 . . . . 14 LYS CG . 26820 2
160 . 1 1 14 14 LYS CD C 13 29.154 0.3 . 1 . . . . 14 LYS CD . 26820 2
161 . 1 1 14 14 LYS CE C 13 42.167 0.3 . 1 . . . . 14 LYS CE . 26820 2
162 . 1 1 14 14 LYS N N 15 122.561 0.3 . 1 . . . . 14 LYS N . 26820 2
163 . 1 1 15 15 ILE H H 1 8.229 0.020 . 1 . . . . 15 ILE H . 26820 2
164 . 1 1 15 15 ILE HA H 1 4.102 0.020 . 1 . . . . 15 ILE HA . 26820 2
165 . 1 1 15 15 ILE HB H 1 1.830 0.020 . 1 . . . . 15 ILE HB . 26820 2
166 . 1 1 15 15 ILE HG12 H 1 1.467 0.020 . 2 . . . . 15 ILE HG12 . 26820 2
167 . 1 1 15 15 ILE HG13 H 1 1.176 0.020 . 2 . . . . 15 ILE HG13 . 26820 2
168 . 1 1 15 15 ILE HG21 H 1 0.879 0.020 . 1 . . . . 15 ILE QG2 . 26820 2
169 . 1 1 15 15 ILE HG22 H 1 0.879 0.020 . 1 . . . . 15 ILE QG2 . 26820 2
170 . 1 1 15 15 ILE HG23 H 1 0.879 0.020 . 1 . . . . 15 ILE QG2 . 26820 2
171 . 1 1 15 15 ILE HD11 H 1 0.832 0.020 . 1 . . . . 15 ILE QD1 . 26820 2
172 . 1 1 15 15 ILE HD12 H 1 0.832 0.020 . 1 . . . . 15 ILE QD1 . 26820 2
173 . 1 1 15 15 ILE HD13 H 1 0.832 0.020 . 1 . . . . 15 ILE QD1 . 26820 2
174 . 1 1 15 15 ILE CA C 13 61.341 0.3 . 1 . . . . 15 ILE CA . 26820 2
175 . 1 1 15 15 ILE CB C 13 38.642 0.3 . 1 . . . . 15 ILE CB . 26820 2
176 . 1 1 15 15 ILE CG1 C 13 27.462 0.3 . 1 . . . . 15 ILE CG1 . 26820 2
177 . 1 1 15 15 ILE CG2 C 13 17.451 0.3 . 1 . . . . 15 ILE CG2 . 26820 2
178 . 1 1 15 15 ILE CD1 C 13 12.791 0.3 . 1 . . . . 15 ILE CD1 . 26820 2
179 . 1 1 15 15 ILE N N 15 122.922 0.3 . 1 . . . . 15 ILE N . 26820 2
180 . 1 1 16 16 GLN H H 1 8.461 0.020 . 1 . . . . 16 GLN H . 26820 2
181 . 1 1 16 16 GLN HA H 1 4.289 0.020 . 1 . . . . 16 GLN HA . 26820 2
182 . 1 1 16 16 GLN HB2 H 1 2.089 0.020 . 2 . . . . 16 GLN HB2 . 26820 2
183 . 1 1 16 16 GLN HB3 H 1 1.999 0.020 . 2 . . . . 16 GLN HB3 . 26820 2
184 . 1 1 16 16 GLN HG2 H 1 2.376 0.020 . 1 . . . . 16 GLN HG2 . 26820 2
185 . 1 1 16 16 GLN HG3 H 1 2.376 0.020 . 1 . . . . 16 GLN HG3 . 26820 2
186 . 1 1 16 16 GLN HE21 H 1 7.554 0.020 . 1 . . . . 16 GLN HE21 . 26820 2
187 . 1 1 16 16 GLN HE22 H 1 6.859 0.020 . 1 . . . . 16 GLN HE22 . 26820 2
188 . 1 1 16 16 GLN CA C 13 56.273 0.3 . 1 . . . . 16 GLN CA . 26820 2
189 . 1 1 16 16 GLN CB C 13 29.368 0.3 . 1 . . . . 16 GLN CB . 26820 2
190 . 1 1 16 16 GLN CG C 13 33.844 0.3 . 1 . . . . 16 GLN CG . 26820 2
191 . 1 1 16 16 GLN N N 15 124.464 0.3 . 1 . . . . 16 GLN N . 26820 2
192 . 1 1 16 16 GLN NE2 N 15 112.475 0.3 . 1 . . . . 16 GLN NE2 . 26820 2
193 . 1 1 17 17 GLY H H 1 8.501 0.020 . 1 . . . . 17 GLY H . 26820 2
194 . 1 1 17 17 GLY HA2 H 1 3.969 0.020 . 2 . . . . 17 GLY HA2 . 26820 2
195 . 1 1 17 17 GLY HA3 H 1 3.952 0.020 . 2 . . . . 17 GLY HA3 . 26820 2
196 . 1 1 17 17 GLY CA C 13 45.367 0.3 . 1 . . . . 17 GLY CA . 26820 2
197 . 1 1 17 17 GLY N N 15 110.919 0.3 . 1 . . . . 17 GLY N . 26820 2
198 . 1 1 18 18 ARG H H 1 8.253 0.020 . 1 . . . . 18 ARG H . 26820 2
199 . 1 1 18 18 ARG HA H 1 4.377 0.020 . 1 . . . . 18 ARG HA . 26820 2
200 . 1 1 18 18 ARG HB2 H 1 1.902 0.020 . 2 . . . . 18 ARG HB2 . 26820 2
201 . 1 1 18 18 ARG HB3 H 1 1.764 0.020 . 2 . . . . 18 ARG HB3 . 26820 2
202 . 1 1 18 18 ARG HG2 H 1 1.628 0.020 . 1 . . . . 18 ARG HG2 . 26820 2
203 . 1 1 18 18 ARG HG3 H 1 1.628 0.020 . 1 . . . . 18 ARG HG3 . 26820 2
204 . 1 1 18 18 ARG HD2 H 1 3.185 0.020 . 1 . . . . 18 ARG HD2 . 26820 2
205 . 1 1 18 18 ARG HD3 H 1 3.185 0.020 . 1 . . . . 18 ARG HD3 . 26820 2
206 . 1 1 18 18 ARG HE H 1 7.351 0.020 . 1 . . . . 18 ARG HE . 26820 2
207 . 1 1 18 18 ARG CA C 13 56.140 0.3 . 1 . . . . 18 ARG CA . 26820 2
208 . 1 1 18 18 ARG CB C 13 31.060 0.3 . 1 . . . . 18 ARG CB . 26820 2
209 . 1 1 18 18 ARG CG C 13 27.065 0.3 . 1 . . . . 18 ARG CG . 26820 2
210 . 1 1 18 18 ARG CD C 13 43.377 0.3 . 1 . . . . 18 ARG CD . 26820 2
211 . 1 1 18 18 ARG CZ C 13 113.281 0.3 . 1 . . . . 18 ARG CZ . 26820 2
212 . 1 1 18 18 ARG N N 15 120.690 0.3 . 1 . . . . 18 ARG N . 26820 2
213 . 1 1 18 18 ARG NE N 15 84.873 0.3 . 1 . . . . 18 ARG NE . 26820 2
214 . 1 1 19 19 GLY H H 1 8.644 0.020 . 1 . . . . 19 GLY H . 26820 2
215 . 1 1 19 19 GLY HA2 H 1 3.930 0.020 . 2 . . . . 19 GLY HA2 . 26820 2
216 . 1 1 19 19 GLY HA3 H 1 4.018 0.020 . 2 . . . . 19 GLY HA3 . 26820 2
217 . 1 1 19 19 GLY CA C 13 45.308 0.3 . 1 . . . . 19 GLY CA . 26820 2
218 . 1 1 19 19 GLY N N 15 110.800 0.3 . 1 . . . . 19 GLY N . 26820 2
219 . 1 1 20 20 ASP H H 1 8.334 0.020 . 1 . . . . 20 ASP H . 26820 2
220 . 1 1 20 20 ASP HA H 1 4.575 0.020 . 1 . . . . 20 ASP HA . 26820 2
221 . 1 1 20 20 ASP HB2 H 1 2.691 0.020 . 2 . . . . 20 ASP HB2 . 26820 2
222 . 1 1 20 20 ASP HB3 H 1 2.575 0.020 . 2 . . . . 20 ASP HB3 . 26820 2
223 . 1 1 20 20 ASP CA C 13 54.776 0.3 . 1 . . . . 20 ASP CA . 26820 2
224 . 1 1 20 20 ASP CB C 13 41.386 0.3 . 1 . . . . 20 ASP CB . 26820 2
225 . 1 1 20 20 ASP N N 15 120.589 0.3 . 1 . . . . 20 ASP N . 26820 2
226 . 1 1 21 21 ASP H H 1 8.321 0.020 . 1 . . . . 21 ASP H . 26820 2
227 . 1 1 21 21 ASP HA H 1 4.601 0.020 . 1 . . . . 21 ASP HA . 26820 2
228 . 1 1 21 21 ASP HB2 H 1 2.694 0.020 . 1 . . . . 21 ASP HB2 . 26820 2
229 . 1 1 21 21 ASP HB3 H 1 2.578 0.020 . 1 . . . . 21 ASP HB3 . 26820 2
230 . 1 1 21 21 ASP CA C 13 54.335 0.3 . 1 . . . . 21 ASP CA . 26820 2
231 . 1 1 21 21 ASP CB C 13 41.377 0.3 . 1 . . . . 21 ASP CB . 26820 2
232 . 1 1 21 21 ASP N N 15 119.376 0.3 . 1 . . . . 21 ASP N . 26820 2
233 . 1 1 22 22 ASP H H 1 8.269 0.020 . 1 . . . . 22 ASP H . 26820 2
234 . 1 1 22 22 ASP HA H 1 4.585 0.020 . 1 . . . . 22 ASP HA . 26820 2
235 . 1 1 22 22 ASP HB2 H 1 2.696 0.020 . 2 . . . . 22 ASP HB2 . 26820 2
236 . 1 1 22 22 ASP HB3 H 1 2.580 0.020 . 2 . . . . 22 ASP HB3 . 26820 2
237 . 1 1 22 22 ASP CA C 13 54.345 0.3 . 1 . . . . 22 ASP CA . 26820 2
238 . 1 1 22 22 ASP CB C 13 41.376 0.3 . 1 . . . . 22 ASP CB . 26820 2
239 . 1 1 22 22 ASP N N 15 120.826 0.3 . 1 . . . . 22 ASP N . 26820 2
240 . 1 1 23 23 ASP H H 1 8.134 0.020 . 1 . . . . 23 ASP H . 26820 2
241 . 1 1 23 23 ASP HA H 1 4.577 0.020 . 1 . . . . 23 ASP HA . 26820 2
242 . 1 1 23 23 ASP HB2 H 1 2.704 0.020 . 2 . . . . 23 ASP HB2 . 26820 2
243 . 1 1 23 23 ASP HB3 H 1 2.576 0.020 . 2 . . . . 23 ASP HB3 . 26820 2
244 . 1 1 23 23 ASP CA C 13 54.345 0.3 . 1 . . . . 23 ASP CA . 26820 2
245 . 1 1 23 23 ASP CB C 13 41.374 0.3 . 1 . . . . 23 ASP CB . 26820 2
246 . 1 1 23 23 ASP N N 15 120.360 0.3 . 1 . . . . 23 ASP N . 26820 2
247 . 1 1 24 24 ASP H H 1 8.316 0.020 . 1 . . . . 24 ASP H . 26820 2
248 . 1 1 24 24 ASP HA H 1 4.600 0.020 . 1 . . . . 24 ASP HA . 26820 2
249 . 1 1 24 24 ASP HB2 H 1 2.697 0.020 . 2 . . . . 24 ASP HB2 . 26820 2
250 . 1 1 24 24 ASP HB3 H 1 2.577 0.020 . 2 . . . . 24 ASP HB3 . 26820 2
251 . 1 1 24 24 ASP CA C 13 54.345 0.3 . 1 . . . . 24 ASP CA . 26820 2
252 . 1 1 24 24 ASP CB C 13 41.385 0.3 . 1 . . . . 24 ASP CB . 26820 2
253 . 1 1 24 24 ASP N N 15 120.806 0.3 . 1 . . . . 24 ASP N . 26820 2
254 . 1 1 25 25 ASP H H 1 8.316 0.020 . 1 . . . . 25 ASP H . 26820 2
255 . 1 1 25 25 ASP HA H 1 4.600 0.020 . 1 . . . . 25 ASP HA . 26820 2
256 . 1 1 25 25 ASP HB2 H 1 2.697 0.020 . 2 . . . . 25 ASP HB2 . 26820 2
257 . 1 1 25 25 ASP HB3 H 1 2.577 0.020 . 2 . . . . 25 ASP HB3 . 26820 2
258 . 1 1 25 25 ASP CA C 13 54.345 0.3 . 1 . . . . 25 ASP CA . 26820 2
259 . 1 1 25 25 ASP CB C 13 41.385 0.3 . 1 . . . . 25 ASP CB . 26820 2
260 . 1 1 25 25 ASP N N 15 120.806 0.3 . 1 . . . . 25 ASP N . 26820 2
261 . 1 1 26 26 ASP H H 1 8.316 0.020 . 1 . . . . 26 ASP H . 26820 2
262 . 1 1 26 26 ASP HA H 1 4.600 0.020 . 1 . . . . 26 ASP HA . 26820 2
263 . 1 1 26 26 ASP HB2 H 1 2.697 0.020 . 2 . . . . 26 ASP HB2 . 26820 2
264 . 1 1 26 26 ASP HB3 H 1 2.577 0.020 . 2 . . . . 26 ASP HB3 . 26820 2
265 . 1 1 26 26 ASP CA C 13 54.345 0.3 . 1 . . . . 26 ASP CA . 26820 2
266 . 1 1 26 26 ASP CB C 13 41.385 0.3 . 1 . . . . 26 ASP CB . 26820 2
267 . 1 1 26 26 ASP N N 15 120.806 0.3 . 1 . . . . 26 ASP N . 26820 2
268 . 1 1 27 27 ASP H H 1 8.308 0.020 . 1 . . . . 27 ASP H . 26820 2
269 . 1 1 27 27 ASP HA H 1 4.635 0.020 . 1 . . . . 27 ASP HA . 26820 2
270 . 1 1 27 27 ASP HB2 H 1 2.696 0.020 . 2 . . . . 27 ASP HB2 . 26820 2
271 . 1 1 27 27 ASP HB3 H 1 2.579 0.020 . 2 . . . . 27 ASP HB3 . 26820 2
272 . 1 1 27 27 ASP CA C 13 54.316 0.3 . 1 . . . . 27 ASP CA . 26820 2
273 . 1 1 27 27 ASP CB C 13 41.207 0.3 . 1 . . . . 27 ASP CB . 26820 2
274 . 1 1 27 27 ASP N N 15 121.345 0.3 . 1 . . . . 27 ASP N . 26820 2
275 . 1 1 28 28 ASP H H 1 7.954 0.020 . 1 . . . . 28 ASP H . 26820 2
276 . 1 1 28 28 ASP HA H 1 4.354 0.020 . 1 . . . . 28 ASP HA . 26820 2
277 . 1 1 28 28 ASP HB2 H 1 2.636 0.020 . 2 . . . . 28 ASP HB2 . 26820 2
278 . 1 1 28 28 ASP HB3 H 1 2.557 0.020 . 2 . . . . 28 ASP HB3 . 26820 2
279 . 1 1 28 28 ASP CA C 13 55.905 0.3 . 1 . . . . 28 ASP CA . 26820 2
280 . 1 1 28 28 ASP CB C 13 42.121 0.3 . 1 . . . . 28 ASP CB . 26820 2
281 . 1 1 28 28 ASP N N 15 125.908 0.3 . 1 . . . . 28 ASP N . 26820 2
stop_
save_