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 18820
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.03
_Assigned_chem_shift_list.Chem_shift_13C_err 0.3
_Assigned_chem_shift_list.Chem_shift_15N_err 0.3
_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-15N HSQC' . . . 18820 1
2 '2D 1H-13C HSQC aliphatic' . . . 18820 1
3 '2D 1H-13C HSQC aromatic' . . . 18820 1
4 '3D CBCA(CO)NH' . . . 18820 1
5 '3D HNCACB' . . . 18820 1
6 '3D HNCO' . . . 18820 1
7 '3D HBHA(CO)NH' . . . 18820 1
8 '3D H(CCO)NH' . . . 18820 1
9 '3D HCCH-TOCSY' . . . 18820 1
10 '3D 1H-15N NOESY' . . . 18820 1
11 '3D 1H-13C NOESY aliphatic' . . . 18820 1
12 '3D 1H-13C NOESY aromatic' . . . 18820 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 2 2 ASP H H 1 8.261 0.03 . 1 . . . . 2 ASP H . 18820 1
2 . 1 1 2 2 ASP HA H 1 4.539 0.03 . 1 . . . . 2 ASP HA . 18820 1
3 . 1 1 2 2 ASP HB2 H 1 2.637 0.03 . 1 . . . . 2 ASP HB2 . 18820 1
4 . 1 1 2 2 ASP HB3 H 1 2.703 0.03 . 1 . . . . 2 ASP HB3 . 18820 1
5 . 1 1 2 2 ASP CA C 13 54.600 0.3 . 1 . . . . 2 ASP CA . 18820 1
6 . 1 1 2 2 ASP N N 15 120.863 0.3 . 1 . . . . 2 ASP N . 18820 1
7 . 1 1 3 3 ASP H H 1 8.217 0.001 . 1 . . . . 3 ASP H . 18820 1
8 . 1 1 3 3 ASP HA H 1 4.485 0.03 . 1 . . . . 3 ASP HA . 18820 1
9 . 1 1 3 3 ASP HB2 H 1 2.723 0.03 . 1 . . . . 3 ASP HB2 . 18820 1
10 . 1 1 3 3 ASP HB3 H 1 2.791 0.03 . 1 . . . . 3 ASP HB3 . 18820 1
11 . 1 1 3 3 ASP C C 13 176.840 0.3 . 1 . . . . 3 ASP C . 18820 1
12 . 1 1 3 3 ASP CA C 13 55.243 0.3 . 1 . . . . 3 ASP CA . 18820 1
13 . 1 1 3 3 ASP N N 15 120.099 0.004 . 1 . . . . 3 ASP N . 18820 1
14 . 1 1 4 4 ILE H H 1 7.994 0.005 . 1 . . . . 4 ILE H . 18820 1
15 . 1 1 4 4 ILE HA H 1 3.698 0.03 . 1 . . . . 4 ILE HA . 18820 1
16 . 1 1 4 4 ILE HB H 1 1.870 0.03 . 1 . . . . 4 ILE HB . 18820 1
17 . 1 1 4 4 ILE HG12 H 1 1.626 0.03 . 1 . . . . 4 ILE HG12 . 18820 1
18 . 1 1 4 4 ILE HG13 H 1 1.626 0.03 . 1 . . . . 4 ILE HG13 . 18820 1
19 . 1 1 4 4 ILE HG21 H 1 0.884 0.03 . 1 . . . . 4 ILE HG21 . 18820 1
20 . 1 1 4 4 ILE HG22 H 1 0.884 0.03 . 1 . . . . 4 ILE HG22 . 18820 1
21 . 1 1 4 4 ILE HG23 H 1 0.884 0.03 . 1 . . . . 4 ILE HG23 . 18820 1
22 . 1 1 4 4 ILE HD11 H 1 0.663 0.016 . 1 . . . . 4 ILE HD11 . 18820 1
23 . 1 1 4 4 ILE HD12 H 1 0.663 0.016 . 1 . . . . 4 ILE HD12 . 18820 1
24 . 1 1 4 4 ILE HD13 H 1 0.663 0.016 . 1 . . . . 4 ILE HD13 . 18820 1
25 . 1 1 4 4 ILE C C 13 177.418 0.3 . 1 . . . . 4 ILE C . 18820 1
26 . 1 1 4 4 ILE CA C 13 66.007 0.3 . 1 . . . . 4 ILE CA . 18820 1
27 . 1 1 4 4 ILE CD1 C 13 12.990 0.3 . 1 . . . . 4 ILE CD1 . 18820 1
28 . 1 1 4 4 ILE N N 15 119.232 0.012 . 1 . . . . 4 ILE N . 18820 1
29 . 1 1 5 5 GLU H H 1 8.617 0.004 . 1 . . . . 5 GLU H . 18820 1
30 . 1 1 5 5 GLU HA H 1 3.625 0.03 . 1 . . . . 5 GLU HA . 18820 1
31 . 1 1 5 5 GLU HB2 H 1 1.976 0.03 . 1 . . . . 5 GLU HB2 . 18820 1
32 . 1 1 5 5 GLU HB3 H 1 1.976 0.03 . 1 . . . . 5 GLU HB3 . 18820 1
33 . 1 1 5 5 GLU HG2 H 1 2.108 0.03 . 1 . . . . 5 GLU HG2 . 18820 1
34 . 1 1 5 5 GLU HG3 H 1 2.108 0.03 . 1 . . . . 5 GLU HG3 . 18820 1
35 . 1 1 5 5 GLU C C 13 178.087 0.3 . 1 . . . . 5 GLU C . 18820 1
36 . 1 1 5 5 GLU CA C 13 60.546 0.3 . 1 . . . . 5 GLU CA . 18820 1
37 . 1 1 5 5 GLU N N 15 119.611 0.003 . 1 . . . . 5 GLU N . 18820 1
38 . 1 1 6 6 THR H H 1 8.134 0.003 . 1 . . . . 6 THR H . 18820 1
39 . 1 1 6 6 THR HG21 H 1 1.165 0.03 . 1 . . . . 6 THR HG21 . 18820 1
40 . 1 1 6 6 THR HG22 H 1 1.165 0.03 . 1 . . . . 6 THR HG22 . 18820 1
41 . 1 1 6 6 THR HG23 H 1 1.165 0.03 . 1 . . . . 6 THR HG23 . 18820 1
42 . 1 1 6 6 THR C C 13 176.497 0.3 . 1 . . . . 6 THR C . 18820 1
43 . 1 1 6 6 THR N N 15 115.021 0.008 . 1 . . . . 6 THR N . 18820 1
44 . 1 1 7 7 ARG H H 1 8.014 0.002 . 1 . . . . 7 ARG H . 18820 1
45 . 1 1 7 7 ARG HA H 1 3.910 0.03 . 1 . . . . 7 ARG HA . 18820 1
46 . 1 1 7 7 ARG HB2 H 1 1.858 0.03 . 1 . . . . 7 ARG HB2 . 18820 1
47 . 1 1 7 7 ARG HB3 H 1 2.014 0.03 . 1 . . . . 7 ARG HB3 . 18820 1
48 . 1 1 7 7 ARG HG2 H 1 1.609 0.012 . 1 . . . . 7 ARG HG2 . 18820 1
49 . 1 1 7 7 ARG HG3 H 1 1.621 0.03 . 1 . . . . 7 ARG HG3 . 18820 1
50 . 1 1 7 7 ARG HD2 H 1 2.977 0.03 . 1 . . . . 7 ARG HD2 . 18820 1
51 . 1 1 7 7 ARG HD3 H 1 2.977 0.03 . 1 . . . . 7 ARG HD3 . 18820 1
52 . 1 1 7 7 ARG C C 13 179.530 0.3 . 1 . . . . 7 ARG C . 18820 1
53 . 1 1 7 7 ARG CA C 13 59.869 0.3 . 1 . . . . 7 ARG CA . 18820 1
54 . 1 1 7 7 ARG CG C 13 27.395 0.3 . 1 . . . . 7 ARG CG . 18820 1
55 . 1 1 7 7 ARG N N 15 120.492 0.022 . 1 . . . . 7 ARG N . 18820 1
56 . 1 1 8 8 VAL H H 1 8.929 0.003 . 1 . . . . 8 VAL H . 18820 1
57 . 1 1 8 8 VAL HA H 1 3.564 0.03 . 1 . . . . 8 VAL HA . 18820 1
58 . 1 1 8 8 VAL HB H 1 2.099 0.03 . 1 . . . . 8 VAL HB . 18820 1
59 . 1 1 8 8 VAL HG11 H 1 0.877 0.010 . 1 . . . . 8 VAL HG11 . 18820 1
60 . 1 1 8 8 VAL HG12 H 1 0.877 0.010 . 1 . . . . 8 VAL HG12 . 18820 1
61 . 1 1 8 8 VAL HG13 H 1 0.877 0.010 . 1 . . . . 8 VAL HG13 . 18820 1
62 . 1 1 8 8 VAL HG21 H 1 0.965 0.002 . 1 . . . . 8 VAL HG21 . 18820 1
63 . 1 1 8 8 VAL HG22 H 1 0.965 0.002 . 1 . . . . 8 VAL HG22 . 18820 1
64 . 1 1 8 8 VAL HG23 H 1 0.965 0.002 . 1 . . . . 8 VAL HG23 . 18820 1
65 . 1 1 8 8 VAL C C 13 177.502 0.3 . 1 . . . . 8 VAL C . 18820 1
66 . 1 1 8 8 VAL CA C 13 67.806 0.3 . 1 . . . . 8 VAL CA . 18820 1
67 . 1 1 8 8 VAL CG1 C 13 21.612 0.3 . 1 . . . . 8 VAL CG1 . 18820 1
68 . 1 1 8 8 VAL CG2 C 13 25.113 0.3 . 1 . . . . 8 VAL CG2 . 18820 1
69 . 1 1 8 8 VAL N N 15 119.732 0.015 . 1 . . . . 8 VAL N . 18820 1
70 . 1 1 9 9 ARG H H 1 8.543 0.003 . 1 . . . . 9 ARG H . 18820 1
71 . 1 1 9 9 ARG HA H 1 3.640 0.03 . 1 . . . . 9 ARG HA . 18820 1
72 . 1 1 9 9 ARG HB2 H 1 1.837 0.03 . 1 . . . . 9 ARG HB2 . 18820 1
73 . 1 1 9 9 ARG HB3 H 1 1.914 0.03 . 1 . . . . 9 ARG HB3 . 18820 1
74 . 1 1 9 9 ARG HG2 H 1 1.387 0.03 . 1 . . . . 9 ARG HG2 . 18820 1
75 . 1 1 9 9 ARG HG3 H 1 1.387 0.03 . 1 . . . . 9 ARG HG3 . 18820 1
76 . 1 1 9 9 ARG HD2 H 1 3.185 0.004 . 1 . . . . 9 ARG HD2 . 18820 1
77 . 1 1 9 9 ARG HD3 H 1 3.185 0.004 . 1 . . . . 9 ARG HD3 . 18820 1
78 . 1 1 9 9 ARG C C 13 177.873 0.3 . 1 . . . . 9 ARG C . 18820 1
79 . 1 1 9 9 ARG CA C 13 61.362 0.3 . 1 . . . . 9 ARG CA . 18820 1
80 . 1 1 9 9 ARG CB C 13 30.095 0.012 . 1 . . . . 9 ARG CB . 18820 1
81 . 1 1 9 9 ARG CD C 13 43.537 0.3 . 1 . . . . 9 ARG CD . 18820 1
82 . 1 1 9 9 ARG N N 15 118.632 0.004 . 1 . . . . 9 ARG N . 18820 1
83 . 1 1 10 10 LYS H H 1 7.872 0.001 . 1 . . . . 10 LYS H . 18820 1
84 . 1 1 10 10 LYS HA H 1 3.824 0.03 . 1 . . . . 10 LYS HA . 18820 1
85 . 1 1 10 10 LYS HB2 H 1 1.779 0.03 . 1 . . . . 10 LYS HB2 . 18820 1
86 . 1 1 10 10 LYS HB3 H 1 1.832 0.03 . 1 . . . . 10 LYS HB3 . 18820 1
87 . 1 1 10 10 LYS HG2 H 1 1.367 0.03 . 1 . . . . 10 LYS HG2 . 18820 1
88 . 1 1 10 10 LYS HG3 H 1 1.367 0.03 . 1 . . . . 10 LYS HG3 . 18820 1
89 . 1 1 10 10 LYS HD2 H 1 1.547 0.03 . 1 . . . . 10 LYS HD2 . 18820 1
90 . 1 1 10 10 LYS HD3 H 1 1.547 0.03 . 1 . . . . 10 LYS HD3 . 18820 1
91 . 1 1 10 10 LYS HE2 H 1 2.851 0.03 . 1 . . . . 10 LYS HE2 . 18820 1
92 . 1 1 10 10 LYS HE3 H 1 2.851 0.03 . 1 . . . . 10 LYS HE3 . 18820 1
93 . 1 1 10 10 LYS C C 13 179.354 0.3 . 1 . . . . 10 LYS C . 18820 1
94 . 1 1 10 10 LYS CA C 13 59.943 0.3 . 1 . . . . 10 LYS CA . 18820 1
95 . 1 1 10 10 LYS N N 15 116.357 0.001 . 1 . . . . 10 LYS N . 18820 1
96 . 1 1 11 11 LEU H H 1 7.660 0.002 . 1 . . . . 11 LEU H . 18820 1
97 . 1 1 11 11 LEU HA H 1 4.037 0.03 . 1 . . . . 11 LEU HA . 18820 1
98 . 1 1 11 11 LEU HB3 H 1 1.804 0.03 . 1 . . . . 11 LEU HB3 . 18820 1
99 . 1 1 11 11 LEU HD11 H 1 0.770 0.03 . 1 . . . . 11 LEU HD11 . 18820 1
100 . 1 1 11 11 LEU HD12 H 1 0.770 0.03 . 1 . . . . 11 LEU HD12 . 18820 1
101 . 1 1 11 11 LEU HD13 H 1 0.770 0.03 . 1 . . . . 11 LEU HD13 . 18820 1
102 . 1 1 11 11 LEU C C 13 176.719 0.3 . 1 . . . . 11 LEU C . 18820 1
103 . 1 1 11 11 LEU CA C 13 58.260 0.3 . 1 . . . . 11 LEU CA . 18820 1
104 . 1 1 11 11 LEU CD1 C 13 25.756 0.3 . 1 . . . . 11 LEU CD1 . 18820 1
105 . 1 1 11 11 LEU N N 15 121.320 0.008 . 1 . . . . 11 LEU N . 18820 1
106 . 1 1 12 12 VAL H H 1 8.572 0.002 . 1 . . . . 12 VAL H . 18820 1
107 . 1 1 12 12 VAL HA H 1 3.280 0.03 . 1 . . . . 12 VAL HA . 18820 1
108 . 1 1 12 12 VAL HB H 1 2.190 0.03 . 1 . . . . 12 VAL HB . 18820 1
109 . 1 1 12 12 VAL C C 13 176.958 0.3 . 1 . . . . 12 VAL C . 18820 1
110 . 1 1 12 12 VAL CA C 13 66.887 0.3 . 1 . . . . 12 VAL CA . 18820 1
111 . 1 1 12 12 VAL N N 15 120.228 0.008 . 1 . . . . 12 VAL N . 18820 1
112 . 1 1 13 13 ALA H H 1 8.182 0.002 . 1 . . . . 13 ALA H . 18820 1
113 . 1 1 13 13 ALA HA H 1 3.859 0.03 . 1 . . . . 13 ALA HA . 18820 1
114 . 1 1 13 13 ALA HB1 H 1 1.396 0.03 . 1 . . . . 13 ALA HB1 . 18820 1
115 . 1 1 13 13 ALA HB2 H 1 1.396 0.03 . 1 . . . . 13 ALA HB2 . 18820 1
116 . 1 1 13 13 ALA HB3 H 1 1.396 0.03 . 1 . . . . 13 ALA HB3 . 18820 1
117 . 1 1 13 13 ALA C C 13 179.746 0.3 . 1 . . . . 13 ALA C . 18820 1
118 . 1 1 13 13 ALA CA C 13 55.495 0.3 . 1 . . . . 13 ALA CA . 18820 1
119 . 1 1 13 13 ALA N N 15 121.430 0.001 . 1 . . . . 13 ALA N . 18820 1
120 . 1 1 14 14 ALA H H 1 7.465 0.002 . 1 . . . . 14 ALA H . 18820 1
121 . 1 1 14 14 ALA HA H 1 4.044 0.03 . 1 . . . . 14 ALA HA . 18820 1
122 . 1 1 14 14 ALA HB1 H 1 1.388 0.03 . 1 . . . . 14 ALA HB1 . 18820 1
123 . 1 1 14 14 ALA HB2 H 1 1.388 0.03 . 1 . . . . 14 ALA HB2 . 18820 1
124 . 1 1 14 14 ALA HB3 H 1 1.388 0.03 . 1 . . . . 14 ALA HB3 . 18820 1
125 . 1 1 14 14 ALA C C 13 180.367 0.3 . 1 . . . . 14 ALA C . 18820 1
126 . 1 1 14 14 ALA CA C 13 54.208 0.3 . 1 . . . . 14 ALA CA . 18820 1
127 . 1 1 14 14 ALA N N 15 117.124 0.018 . 1 . . . . 14 ALA N . 18820 1
128 . 1 1 15 15 ARG H H 1 7.913 0.004 . 1 . . . . 15 ARG H . 18820 1
129 . 1 1 15 15 ARG HA H 1 3.867 0.03 . 1 . . . . 15 ARG HA . 18820 1
130 . 1 1 15 15 ARG HB2 H 1 1.196 0.03 . 1 . . . . 15 ARG HB2 . 18820 1
131 . 1 1 15 15 ARG HB3 H 1 1.360 0.03 . 1 . . . . 15 ARG HB3 . 18820 1
132 . 1 1 15 15 ARG HG2 H 1 1.104 0.03 . 1 . . . . 15 ARG HG2 . 18820 1
133 . 1 1 15 15 ARG HG3 H 1 1.104 0.03 . 1 . . . . 15 ARG HG3 . 18820 1
134 . 1 1 15 15 ARG HD2 H 1 2.896 0.03 . 1 . . . . 15 ARG HD2 . 18820 1
135 . 1 1 15 15 ARG HD3 H 1 2.896 0.03 . 1 . . . . 15 ARG HD3 . 18820 1
136 . 1 1 15 15 ARG C C 13 177.887 0.3 . 1 . . . . 15 ARG C . 18820 1
137 . 1 1 15 15 ARG CA C 13 57.476 0.3 . 1 . . . . 15 ARG CA . 18820 1
138 . 1 1 15 15 ARG N N 15 116.398 0.007 . 1 . . . . 15 ARG N . 18820 1
139 . 1 1 16 16 PHE H H 1 7.744 0.001 . 1 . . . . 16 PHE H . 18820 1
140 . 1 1 16 16 PHE HA H 1 4.800 0.006 . 1 . . . . 16 PHE HA . 18820 1
141 . 1 1 16 16 PHE HB2 H 1 2.305 0.007 . 1 . . . . 16 PHE HB2 . 18820 1
142 . 1 1 16 16 PHE HB3 H 1 3.281 0.004 . 1 . . . . 16 PHE HB3 . 18820 1
143 . 1 1 16 16 PHE HD1 H 1 7.249 0.004 . 3 . . . . 16 PHE HD1 . 18820 1
144 . 1 1 16 16 PHE HD2 H 1 7.249 0.004 . 3 . . . . 16 PHE HD2 . 18820 1
145 . 1 1 16 16 PHE HE1 H 1 6.978 0.002 . 3 . . . . 16 PHE HE1 . 18820 1
146 . 1 1 16 16 PHE HE2 H 1 6.978 0.002 . 3 . . . . 16 PHE HE2 . 18820 1
147 . 1 1 16 16 PHE HZ H 1 6.650 0.003 . 1 . . . . 16 PHE HZ . 18820 1
148 . 1 1 16 16 PHE C C 13 175.630 0.3 . 1 . . . . 16 PHE C . 18820 1
149 . 1 1 16 16 PHE CA C 13 57.430 0.3 . 1 . . . . 16 PHE CA . 18820 1
150 . 1 1 16 16 PHE CD1 C 13 129.877 0.030 . 3 . . . . 16 PHE CD1 . 18820 1
151 . 1 1 16 16 PHE CD2 C 13 129.877 0.030 . 3 . . . . 16 PHE CD2 . 18820 1
152 . 1 1 16 16 PHE CE1 C 13 128.202 0.029 . 3 . . . . 16 PHE CE1 . 18820 1
153 . 1 1 16 16 PHE CE2 C 13 128.202 0.029 . 3 . . . . 16 PHE CE2 . 18820 1
154 . 1 1 16 16 PHE CZ C 13 125.828 0.078 . 1 . . . . 16 PHE CZ . 18820 1
155 . 1 1 16 16 PHE N N 15 113.171 0.014 . 1 . . . . 16 PHE N . 18820 1
156 . 1 1 17 17 GLY H H 1 7.725 0.001 . 1 . . . . 17 GLY H . 18820 1
157 . 1 1 17 17 GLY HA2 H 1 3.827 0.03 . 1 . . . . 17 GLY HA2 . 18820 1
158 . 1 1 17 17 GLY HA3 H 1 3.879 0.03 . 1 . . . . 17 GLY HA3 . 18820 1
159 . 1 1 17 17 GLY C C 13 174.503 0.3 . 1 . . . . 17 GLY C . 18820 1
160 . 1 1 17 17 GLY CA C 13 47.320 0.3 . 1 . . . . 17 GLY CA . 18820 1
161 . 1 1 17 17 GLY N N 15 110.398 0.018 . 1 . . . . 17 GLY N . 18820 1
162 . 1 1 18 18 VAL H H 1 7.347 0.005 . 1 . . . . 18 VAL H . 18820 1
163 . 1 1 18 18 VAL HA H 1 4.457 0.009 . 1 . . . . 18 VAL HA . 18820 1
164 . 1 1 18 18 VAL HB H 1 1.987 0.03 . 1 . . . . 18 VAL HB . 18820 1
165 . 1 1 18 18 VAL HG11 H 1 0.447 0.03 . 1 . . . . 18 VAL HG11 . 18820 1
166 . 1 1 18 18 VAL HG12 H 1 0.447 0.03 . 1 . . . . 18 VAL HG12 . 18820 1
167 . 1 1 18 18 VAL HG13 H 1 0.447 0.03 . 1 . . . . 18 VAL HG13 . 18820 1
168 . 1 1 18 18 VAL HG21 H 1 0.744 0.03 . 1 . . . . 18 VAL HG21 . 18820 1
169 . 1 1 18 18 VAL HG22 H 1 0.744 0.03 . 1 . . . . 18 VAL HG22 . 18820 1
170 . 1 1 18 18 VAL HG23 H 1 0.744 0.03 . 1 . . . . 18 VAL HG23 . 18820 1
171 . 1 1 18 18 VAL C C 13 174.777 0.3 . 1 . . . . 18 VAL C . 18820 1
172 . 1 1 18 18 VAL CA C 13 58.875 0.015 . 1 . . . . 18 VAL CA . 18820 1
173 . 1 1 18 18 VAL N N 15 113.884 0.002 . 1 . . . . 18 VAL N . 18820 1
174 . 1 1 19 19 GLU H H 1 8.599 0.002 . 1 . . . . 19 GLU H . 18820 1
175 . 1 1 19 19 GLU HA H 1 4.196 0.008 . 1 . . . . 19 GLU HA . 18820 1
176 . 1 1 19 19 GLU HB2 H 1 1.866 0.03 . 1 . . . . 19 GLU HB2 . 18820 1
177 . 1 1 19 19 GLU HB3 H 1 2.171 0.03 . 1 . . . . 19 GLU HB3 . 18820 1
178 . 1 1 19 19 GLU HG2 H 1 2.234 0.03 . 1 . . . . 19 GLU HG2 . 18820 1
179 . 1 1 19 19 GLU HG3 H 1 2.333 0.03 . 1 . . . . 19 GLU HG3 . 18820 1
180 . 1 1 19 19 GLU C C 13 178.785 0.3 . 1 . . . . 19 GLU C . 18820 1
181 . 1 1 19 19 GLU CA C 13 56.198 0.127 . 1 . . . . 19 GLU CA . 18820 1
182 . 1 1 19 19 GLU N N 15 121.545 0.006 . 1 . . . . 19 GLU N . 18820 1
183 . 1 1 20 20 GLU H H 1 8.919 0.002 . 1 . . . . 20 GLU H . 18820 1
184 . 1 1 20 20 GLU HA H 1 3.669 0.03 . 1 . . . . 20 GLU HA . 18820 1
185 . 1 1 20 20 GLU HB2 H 1 1.933 0.03 . 1 . . . . 20 GLU HB2 . 18820 1
186 . 1 1 20 20 GLU HG2 H 1 2.223 0.016 . 1 . . . . 20 GLU HG2 . 18820 1
187 . 1 1 20 20 GLU HG3 H 1 2.223 0.016 . 1 . . . . 20 GLU HG3 . 18820 1
188 . 1 1 20 20 GLU C C 13 178.798 0.3 . 1 . . . . 20 GLU C . 18820 1
189 . 1 1 20 20 GLU CA C 13 60.626 0.3 . 1 . . . . 20 GLU CA . 18820 1
190 . 1 1 20 20 GLU CG C 13 37.160 0.3 . 1 . . . . 20 GLU CG . 18820 1
191 . 1 1 20 20 GLU N N 15 122.603 0.003 . 1 . . . . 20 GLU N . 18820 1
192 . 1 1 21 21 CYS H H 1 8.203 0.002 . 1 . . . . 21 CYS H . 18820 1
193 . 1 1 21 21 CYS HA H 1 4.336 0.03 . 1 . . . . 21 CYS HA . 18820 1
194 . 1 1 21 21 CYS HB2 H 1 2.742 0.03 . 1 . . . . 21 CYS HB2 . 18820 1
195 . 1 1 21 21 CYS HB3 H 1 3.144 0.03 . 1 . . . . 21 CYS HB3 . 18820 1
196 . 1 1 21 21 CYS C C 13 174.616 0.3 . 1 . . . . 21 CYS C . 18820 1
197 . 1 1 21 21 CYS CA C 13 58.762 0.3 . 1 . . . . 21 CYS CA . 18820 1
198 . 1 1 21 21 CYS N N 15 113.332 0.004 . 1 . . . . 21 CYS N . 18820 1
199 . 1 1 22 22 ASP H H 1 7.740 0.002 . 1 . . . . 22 ASP H . 18820 1
200 . 1 1 22 22 ASP HA H 1 4.715 0.03 . 1 . . . . 22 ASP HA . 18820 1
201 . 1 1 22 22 ASP HB2 H 1 2.697 0.03 . 1 . . . . 22 ASP HB2 . 18820 1
202 . 1 1 22 22 ASP HB3 H 1 2.829 0.03 . 1 . . . . 22 ASP HB3 . 18820 1
203 . 1 1 22 22 ASP C C 13 175.602 0.3 . 1 . . . . 22 ASP C . 18820 1
204 . 1 1 22 22 ASP CA C 13 57.318 0.3 . 1 . . . . 22 ASP CA . 18820 1
205 . 1 1 22 22 ASP N N 15 121.863 0.002 . 1 . . . . 22 ASP N . 18820 1
206 . 1 1 23 23 ILE H H 1 7.256 0.002 . 1 . . . . 23 ILE H . 18820 1
207 . 1 1 23 23 ILE HA H 1 3.969 0.03 . 1 . . . . 23 ILE HA . 18820 1
208 . 1 1 23 23 ILE HB H 1 1.915 0.03 . 1 . . . . 23 ILE HB . 18820 1
209 . 1 1 23 23 ILE HG12 H 1 1.700 0.03 . 1 . . . . 23 ILE HG12 . 18820 1
210 . 1 1 23 23 ILE HG21 H 1 0.896 0.03 . 1 . . . . 23 ILE HG21 . 18820 1
211 . 1 1 23 23 ILE HG22 H 1 0.896 0.03 . 1 . . . . 23 ILE HG22 . 18820 1
212 . 1 1 23 23 ILE HG23 H 1 0.896 0.03 . 1 . . . . 23 ILE HG23 . 18820 1
213 . 1 1 23 23 ILE HD11 H 1 0.722 0.03 . 1 . . . . 23 ILE HD11 . 18820 1
214 . 1 1 23 23 ILE HD12 H 1 0.722 0.03 . 1 . . . . 23 ILE HD12 . 18820 1
215 . 1 1 23 23 ILE HD13 H 1 0.722 0.03 . 1 . . . . 23 ILE HD13 . 18820 1
216 . 1 1 23 23 ILE C C 13 175.052 0.3 . 1 . . . . 23 ILE C . 18820 1
217 . 1 1 23 23 ILE CA C 13 61.639 0.3 . 1 . . . . 23 ILE CA . 18820 1
218 . 1 1 23 23 ILE N N 15 120.198 0.3 . 1 . . . . 23 ILE N . 18820 1
219 . 1 1 24 24 ARG H H 1 8.819 0.003 . 1 . . . . 24 ARG H . 18820 1
220 . 1 1 24 24 ARG HA H 1 4.688 0.011 . 1 . . . . 24 ARG HA . 18820 1
221 . 1 1 24 24 ARG HB2 H 1 1.745 0.03 . 1 . . . . 24 ARG HB2 . 18820 1
222 . 1 1 24 24 ARG HB3 H 1 1.905 0.03 . 1 . . . . 24 ARG HB3 . 18820 1
223 . 1 1 24 24 ARG HG2 H 1 1.519 0.010 . 1 . . . . 24 ARG HG2 . 18820 1
224 . 1 1 24 24 ARG HG3 H 1 1.519 0.010 . 1 . . . . 24 ARG HG3 . 18820 1
225 . 1 1 24 24 ARG HD2 H 1 3.154 0.03 . 1 . . . . 24 ARG HD2 . 18820 1
226 . 1 1 24 24 ARG HD3 H 1 3.154 0.03 . 1 . . . . 24 ARG HD3 . 18820 1
227 . 1 1 24 24 ARG C C 13 177.214 0.3 . 1 . . . . 24 ARG C . 18820 1
228 . 1 1 24 24 ARG CA C 13 53.531 0.031 . 1 . . . . 24 ARG CA . 18820 1
229 . 1 1 24 24 ARG CG C 13 27.066 0.3 . 1 . . . . 24 ARG CG . 18820 1
230 . 1 1 25 25 LEU H H 1 8.734 0.001 . 1 . . . . 25 LEU H . 18820 1
231 . 1 1 25 25 LEU HA H 1 3.803 0.03 . 1 . . . . 25 LEU HA . 18820 1
232 . 1 1 25 25 LEU HB3 H 1 1.707 0.03 . 1 . . . . 25 LEU HB3 . 18820 1
233 . 1 1 25 25 LEU HD11 H 1 0.671 0.03 . 1 . . . . 25 LEU HD11 . 18820 1
234 . 1 1 25 25 LEU HD12 H 1 0.671 0.03 . 1 . . . . 25 LEU HD12 . 18820 1
235 . 1 1 25 25 LEU HD13 H 1 0.671 0.03 . 1 . . . . 25 LEU HD13 . 18820 1
236 . 1 1 25 25 LEU HD21 H 1 0.835 0.03 . 1 . . . . 25 LEU HD21 . 18820 1
237 . 1 1 25 25 LEU HD22 H 1 0.835 0.03 . 1 . . . . 25 LEU HD22 . 18820 1
238 . 1 1 25 25 LEU HD23 H 1 0.835 0.03 . 1 . . . . 25 LEU HD23 . 18820 1
239 . 1 1 25 25 LEU C C 13 176.835 0.3 . 1 . . . . 25 LEU C . 18820 1
240 . 1 1 25 25 LEU CA C 13 58.052 0.3 . 1 . . . . 25 LEU CA . 18820 1
241 . 1 1 25 25 LEU N N 15 121.724 0.002 . 1 . . . . 25 LEU N . 18820 1
242 . 1 1 26 26 ASP H H 1 7.747 0.002 . 1 . . . . 26 ASP H . 18820 1
243 . 1 1 26 26 ASP HA H 1 4.673 0.03 . 1 . . . . 26 ASP HA . 18820 1
244 . 1 1 26 26 ASP HB2 H 1 2.466 0.03 . 1 . . . . 26 ASP HB2 . 18820 1
245 . 1 1 26 26 ASP HB3 H 1 2.686 0.03 . 1 . . . . 26 ASP HB3 . 18820 1
246 . 1 1 26 26 ASP C C 13 175.843 0.3 . 1 . . . . 26 ASP C . 18820 1
247 . 1 1 26 26 ASP CA C 13 53.284 0.3 . 1 . . . . 26 ASP CA . 18820 1
248 . 1 1 26 26 ASP N N 15 111.104 0.008 . 1 . . . . 26 ASP N . 18820 1
249 . 1 1 27 27 SER H H 1 7.463 0.001 . 1 . . . . 27 SER H . 18820 1
250 . 1 1 27 27 SER HA H 1 3.917 0.03 . 1 . . . . 27 SER HA . 18820 1
251 . 1 1 27 27 SER HB2 H 1 3.355 0.03 . 1 . . . . 27 SER HB2 . 18820 1
252 . 1 1 27 27 SER HB3 H 1 3.733 0.03 . 1 . . . . 27 SER HB3 . 18820 1
253 . 1 1 27 27 SER C C 13 181.269 0.3 . 1 . . . . 27 SER C . 18820 1
254 . 1 1 27 27 SER CA C 13 61.505 0.3 . 1 . . . . 27 SER CA . 18820 1
255 . 1 1 27 27 SER N N 15 117.702 0.001 . 1 . . . . 27 SER N . 18820 1
256 . 1 1 28 28 ASP H H 1 9.134 0.004 . 1 . . . . 28 ASP H . 18820 1
257 . 1 1 28 28 ASP HA H 1 4.580 0.03 . 1 . . . . 28 ASP HA . 18820 1
258 . 1 1 28 28 ASP HB2 H 1 2.196 0.03 . 1 . . . . 28 ASP HB2 . 18820 1
259 . 1 1 28 28 ASP HB3 H 1 2.496 0.03 . 1 . . . . 28 ASP HB3 . 18820 1
260 . 1 1 28 28 ASP C C 13 176.971 0.3 . 1 . . . . 28 ASP C . 18820 1
261 . 1 1 28 28 ASP CA C 13 51.992 0.3 . 1 . . . . 28 ASP CA . 18820 1
262 . 1 1 28 28 ASP N N 15 126.509 0.003 . 1 . . . . 28 ASP N . 18820 1
263 . 1 1 29 29 PHE H H 1 7.523 0.001 . 1 . . . . 29 PHE H . 18820 1
264 . 1 1 29 29 PHE HA H 1 4.026 0.03 . 1 . . . . 29 PHE HA . 18820 1
265 . 1 1 29 29 PHE HB2 H 1 2.735 0.03 . 1 . . . . 29 PHE HB2 . 18820 1
266 . 1 1 29 29 PHE HB3 H 1 2.870 0.03 . 1 . . . . 29 PHE HB3 . 18820 1
267 . 1 1 29 29 PHE HD1 H 1 6.951 0.03 . 3 . . . . 29 PHE HD1 . 18820 1
268 . 1 1 29 29 PHE HD2 H 1 6.951 0.03 . 3 . . . . 29 PHE HD2 . 18820 1
269 . 1 1 29 29 PHE C C 13 176.901 0.3 . 1 . . . . 29 PHE C . 18820 1
270 . 1 1 29 29 PHE CA C 13 60.859 0.3 . 1 . . . . 29 PHE CA . 18820 1
271 . 1 1 29 29 PHE CD1 C 13 129.171 0.3 . 3 . . . . 29 PHE CD1 . 18820 1
272 . 1 1 29 29 PHE CD2 C 13 129.171 0.3 . 3 . . . . 29 PHE CD2 . 18820 1
273 . 1 1 29 29 PHE N N 15 123.963 0.006 . 1 . . . . 29 PHE N . 18820 1
274 . 1 1 30 30 ARG H H 1 8.448 0.002 . 1 . . . . 30 ARG H . 18820 1
275 . 1 1 30 30 ARG HA H 1 4.379 0.03 . 1 . . . . 30 ARG HA . 18820 1
276 . 1 1 30 30 ARG HB2 H 1 1.686 0.03 . 1 . . . . 30 ARG HB2 . 18820 1
277 . 1 1 30 30 ARG HB3 H 1 1.741 0.03 . 1 . . . . 30 ARG HB3 . 18820 1
278 . 1 1 30 30 ARG HG2 H 1 1.539 0.03 . 1 . . . . 30 ARG HG2 . 18820 1
279 . 1 1 30 30 ARG HG3 H 1 1.539 0.03 . 1 . . . . 30 ARG HG3 . 18820 1
280 . 1 1 30 30 ARG HD2 H 1 3.153 0.03 . 1 . . . . 30 ARG HD2 . 18820 1
281 . 1 1 30 30 ARG HD3 H 1 3.153 0.03 . 1 . . . . 30 ARG HD3 . 18820 1
282 . 1 1 30 30 ARG C C 13 178.876 0.3 . 1 . . . . 30 ARG C . 18820 1
283 . 1 1 30 30 ARG CA C 13 58.429 0.3 . 1 . . . . 30 ARG CA . 18820 1
284 . 1 1 30 30 ARG N N 15 116.797 0.3 . 1 . . . . 30 ARG N . 18820 1
285 . 1 1 31 31 ASN H H 1 9.153 0.003 . 1 . . . . 31 ASN H . 18820 1
286 . 1 1 31 31 ASN HA H 1 4.405 0.03 . 1 . . . . 31 ASN HA . 18820 1
287 . 1 1 31 31 ASN HB2 H 1 2.354 0.03 . 1 . . . . 31 ASN HB2 . 18820 1
288 . 1 1 31 31 ASN HB3 H 1 2.585 0.03 . 1 . . . . 31 ASN HB3 . 18820 1
289 . 1 1 31 31 ASN C C 13 176.640 0.3 . 1 . . . . 31 ASN C . 18820 1
290 . 1 1 31 31 ASN CA C 13 55.539 0.3 . 1 . . . . 31 ASN CA . 18820 1
291 . 1 1 31 31 ASN N N 15 117.289 0.003 . 1 . . . . 31 ASN N . 18820 1
292 . 1 1 32 32 ASP H H 1 8.542 0.002 . 1 . . . . 32 ASP H . 18820 1
293 . 1 1 32 32 ASP HA H 1 4.629 0.03 . 1 . . . . 32 ASP HA . 18820 1
294 . 1 1 32 32 ASP HB2 H 1 2.057 0.03 . 1 . . . . 32 ASP HB2 . 18820 1
295 . 1 1 32 32 ASP HB3 H 1 2.096 0.03 . 1 . . . . 32 ASP HB3 . 18820 1
296 . 1 1 32 32 ASP C C 13 177.244 0.3 . 1 . . . . 32 ASP C . 18820 1
297 . 1 1 32 32 ASP CA C 13 56.173 0.3 . 1 . . . . 32 ASP CA . 18820 1
298 . 1 1 32 32 ASP N N 15 116.178 0.002 . 1 . . . . 32 ASP N . 18820 1
299 . 1 1 33 33 PHE H H 1 6.564 0.002 . 1 . . . . 33 PHE H . 18820 1
300 . 1 1 33 33 PHE HA H 1 5.005 0.016 . 1 . . . . 33 PHE HA . 18820 1
301 . 1 1 33 33 PHE HB2 H 1 2.789 0.03 . 1 . . . . 33 PHE HB2 . 18820 1
302 . 1 1 33 33 PHE HB3 H 1 3.054 0.008 . 1 . . . . 33 PHE HB3 . 18820 1
303 . 1 1 33 33 PHE HD1 H 1 6.860 0.003 . 3 . . . . 33 PHE HD1 . 18820 1
304 . 1 1 33 33 PHE HD2 H 1 6.860 0.003 . 3 . . . . 33 PHE HD2 . 18820 1
305 . 1 1 33 33 PHE HE1 H 1 7.004 0.003 . 3 . . . . 33 PHE HE1 . 18820 1
306 . 1 1 33 33 PHE HE2 H 1 7.004 0.003 . 3 . . . . 33 PHE HE2 . 18820 1
307 . 1 1 33 33 PHE C C 13 176.350 0.3 . 1 . . . . 33 PHE C . 18820 1
308 . 1 1 33 33 PHE CA C 13 54.876 0.3 . 1 . . . . 33 PHE CA . 18820 1
309 . 1 1 33 33 PHE CD1 C 13 128.867 0.052 . 3 . . . . 33 PHE CD1 . 18820 1
310 . 1 1 33 33 PHE CD2 C 13 128.867 0.052 . 3 . . . . 33 PHE CD2 . 18820 1
311 . 1 1 33 33 PHE CE1 C 13 128.252 0.3 . 3 . . . . 33 PHE CE1 . 18820 1
312 . 1 1 33 33 PHE CE2 C 13 128.252 0.3 . 3 . . . . 33 PHE CE2 . 18820 1
313 . 1 1 33 33 PHE N N 15 113.668 0.004 . 1 . . . . 33 PHE N . 18820 1
314 . 1 1 34 34 GLY H H 1 7.064 0.002 . 1 . . . . 34 GLY H . 18820 1
315 . 1 1 34 34 GLY HA2 H 1 3.874 0.004 . 1 . . . . 34 GLY HA2 . 18820 1
316 . 1 1 34 34 GLY HA3 H 1 3.905 0.006 . 1 . . . . 34 GLY HA3 . 18820 1
317 . 1 1 34 34 GLY C C 13 174.485 0.3 . 1 . . . . 34 GLY C . 18820 1
318 . 1 1 34 34 GLY CA C 13 46.423 0.033 . 1 . . . . 34 GLY CA . 18820 1
319 . 1 1 35 35 ALA H H 1 7.840 0.003 . 1 . . . . 35 ALA H . 18820 1
320 . 1 1 35 35 ALA HA H 1 4.296 0.03 . 1 . . . . 35 ALA HA . 18820 1
321 . 1 1 35 35 ALA HB1 H 1 1.038 0.03 . 1 . . . . 35 ALA HB1 . 18820 1
322 . 1 1 35 35 ALA HB2 H 1 1.038 0.03 . 1 . . . . 35 ALA HB2 . 18820 1
323 . 1 1 35 35 ALA HB3 H 1 1.038 0.03 . 1 . . . . 35 ALA HB3 . 18820 1
324 . 1 1 35 35 ALA C C 13 177.600 0.3 . 1 . . . . 35 ALA C . 18820 1
325 . 1 1 35 35 ALA CA C 13 52.367 0.3 . 1 . . . . 35 ALA CA . 18820 1
326 . 1 1 35 35 ALA N N 15 122.174 0.3 . 1 . . . . 35 ALA N . 18820 1
327 . 1 1 36 36 GLU H H 1 8.720 0.005 . 1 . . . . 36 GLU H . 18820 1
328 . 1 1 36 36 GLU HA H 1 4.536 0.03 . 1 . . . . 36 GLU HA . 18820 1
329 . 1 1 36 36 GLU HB2 H 1 1.925 0.03 . 1 . . . . 36 GLU HB2 . 18820 1
330 . 1 1 36 36 GLU HB3 H 1 1.925 0.03 . 1 . . . . 36 GLU HB3 . 18820 1
331 . 1 1 36 36 GLU HG2 H 1 2.351 0.03 . 1 . . . . 36 GLU HG2 . 18820 1
332 . 1 1 36 36 GLU HG3 H 1 2.420 0.03 . 1 . . . . 36 GLU HG3 . 18820 1
333 . 1 1 36 36 GLU C C 13 178.239 0.3 . 1 . . . . 36 GLU C . 18820 1
334 . 1 1 36 36 GLU CA C 13 54.915 0.3 . 1 . . . . 36 GLU CA . 18820 1
335 . 1 1 36 36 GLU N N 15 120.694 0.013 . 1 . . . . 36 GLU N . 18820 1
336 . 1 1 37 37 SER H H 1 8.945 0.001 . 1 . . . . 37 SER H . 18820 1
337 . 1 1 37 37 SER HA H 1 4.034 0.03 . 1 . . . . 37 SER HA . 18820 1
338 . 1 1 37 37 SER HB2 H 1 3.911 0.03 . 1 . . . . 37 SER HB2 . 18820 1
339 . 1 1 37 37 SER HB3 H 1 3.911 0.03 . 1 . . . . 37 SER HB3 . 18820 1
340 . 1 1 37 37 SER C C 13 179.310 0.3 . 1 . . . . 37 SER C . 18820 1
341 . 1 1 37 37 SER CA C 13 62.804 0.3 . 1 . . . . 37 SER CA . 18820 1
342 . 1 1 37 37 SER N N 15 118.130 0.002 . 1 . . . . 37 SER N . 18820 1
343 . 1 1 38 38 LEU H H 1 8.576 0.005 . 1 . . . . 38 LEU H . 18820 1
344 . 1 1 38 38 LEU HA H 1 4.053 0.03 . 1 . . . . 38 LEU HA . 18820 1
345 . 1 1 38 38 LEU HB3 H 1 1.605 0.03 . 1 . . . . 38 LEU HB3 . 18820 1
346 . 1 1 38 38 LEU HG H 1 1.536 0.03 . 1 . . . . 38 LEU HG . 18820 1
347 . 1 1 38 38 LEU HD11 H 1 0.823 0.03 . 1 . . . . 38 LEU HD11 . 18820 1
348 . 1 1 38 38 LEU HD12 H 1 0.823 0.03 . 1 . . . . 38 LEU HD12 . 18820 1
349 . 1 1 38 38 LEU HD13 H 1 0.823 0.03 . 1 . . . . 38 LEU HD13 . 18820 1
350 . 1 1 38 38 LEU HD21 H 1 0.809 0.03 . 1 . . . . 38 LEU HD21 . 18820 1
351 . 1 1 38 38 LEU HD22 H 1 0.809 0.03 . 1 . . . . 38 LEU HD22 . 18820 1
352 . 1 1 38 38 LEU HD23 H 1 0.809 0.03 . 1 . . . . 38 LEU HD23 . 18820 1
353 . 1 1 38 38 LEU C C 13 178.728 0.3 . 1 . . . . 38 LEU C . 18820 1
354 . 1 1 38 38 LEU CA C 13 57.964 0.3 . 1 . . . . 38 LEU CA . 18820 1
355 . 1 1 38 38 LEU N N 15 120.235 0.001 . 1 . . . . 38 LEU N . 18820 1
356 . 1 1 39 39 GLU H H 1 7.363 0.001 . 1 . . . . 39 GLU H . 18820 1
357 . 1 1 39 39 GLU HA H 1 4.053 0.03 . 1 . . . . 39 GLU HA . 18820 1
358 . 1 1 39 39 GLU HB2 H 1 2.008 0.03 . 1 . . . . 39 GLU HB2 . 18820 1
359 . 1 1 39 39 GLU HB3 H 1 2.008 0.03 . 1 . . . . 39 GLU HB3 . 18820 1
360 . 1 1 39 39 GLU HG2 H 1 2.283 0.03 . 1 . . . . 39 GLU HG2 . 18820 1
361 . 1 1 39 39 GLU HG3 H 1 2.283 0.03 . 1 . . . . 39 GLU HG3 . 18820 1
362 . 1 1 39 39 GLU C C 13 179.478 0.3 . 1 . . . . 39 GLU C . 18820 1
363 . 1 1 39 39 GLU CA C 13 58.860 0.3 . 1 . . . . 39 GLU CA . 18820 1
364 . 1 1 39 39 GLU N N 15 116.966 0.017 . 1 . . . . 39 GLU N . 18820 1
365 . 1 1 40 40 VAL H H 1 7.738 0.002 . 1 . . . . 40 VAL H . 18820 1
366 . 1 1 40 40 VAL HA H 1 3.385 0.03 . 1 . . . . 40 VAL HA . 18820 1
367 . 1 1 40 40 VAL HB H 1 2.248 0.03 . 1 . . . . 40 VAL HB . 18820 1
368 . 1 1 40 40 VAL HG11 H 1 0.880 0.03 . 1 . . . . 40 VAL HG11 . 18820 1
369 . 1 1 40 40 VAL HG12 H 1 0.880 0.03 . 1 . . . . 40 VAL HG12 . 18820 1
370 . 1 1 40 40 VAL HG13 H 1 0.880 0.03 . 1 . . . . 40 VAL HG13 . 18820 1
371 . 1 1 40 40 VAL HG21 H 1 0.843 0.03 . 1 . . . . 40 VAL HG21 . 18820 1
372 . 1 1 40 40 VAL HG22 H 1 0.843 0.03 . 1 . . . . 40 VAL HG22 . 18820 1
373 . 1 1 40 40 VAL HG23 H 1 0.843 0.03 . 1 . . . . 40 VAL HG23 . 18820 1
374 . 1 1 40 40 VAL CA C 13 67.482 0.3 . 1 . . . . 40 VAL CA . 18820 1
375 . 1 1 40 40 VAL CB C 13 31.156 0.3 . 1 . . . . 40 VAL CB . 18820 1
376 . 1 1 40 40 VAL N N 15 121.055 0.010 . 1 . . . . 40 VAL N . 18820 1
377 . 1 1 41 41 VAL H H 1 7.815 0.002 . 1 . . . . 41 VAL H . 18820 1
378 . 1 1 41 41 VAL HA H 1 3.431 0.03 . 1 . . . . 41 VAL HA . 18820 1
379 . 1 1 41 41 VAL HB H 1 2.149 0.03 . 1 . . . . 41 VAL HB . 18820 1
380 . 1 1 41 41 VAL HG11 H 1 0.862 0.003 . 1 . . . . 41 VAL HG11 . 18820 1
381 . 1 1 41 41 VAL HG12 H 1 0.862 0.003 . 1 . . . . 41 VAL HG12 . 18820 1
382 . 1 1 41 41 VAL HG13 H 1 0.862 0.003 . 1 . . . . 41 VAL HG13 . 18820 1
383 . 1 1 41 41 VAL HG21 H 1 0.959 0.002 . 1 . . . . 41 VAL HG21 . 18820 1
384 . 1 1 41 41 VAL HG22 H 1 0.959 0.002 . 1 . . . . 41 VAL HG22 . 18820 1
385 . 1 1 41 41 VAL HG23 H 1 0.959 0.002 . 1 . . . . 41 VAL HG23 . 18820 1
386 . 1 1 41 41 VAL C C 13 178.639 0.3 . 1 . . . . 41 VAL C . 18820 1
387 . 1 1 41 41 VAL CA C 13 67.344 0.3 . 1 . . . . 41 VAL CA . 18820 1
388 . 1 1 41 41 VAL CB C 13 31.237 0.3 . 1 . . . . 41 VAL CB . 18820 1
389 . 1 1 41 41 VAL CG1 C 13 22.864 0.3 . 1 . . . . 41 VAL CG1 . 18820 1
390 . 1 1 41 41 VAL CG2 C 13 21.236 0.3 . 1 . . . . 41 VAL CG2 . 18820 1
391 . 1 1 41 41 VAL N N 15 120.191 0.029 . 1 . . . . 41 VAL N . 18820 1
392 . 1 1 42 42 GLU H H 1 7.900 0.001 . 1 . . . . 42 GLU H . 18820 1
393 . 1 1 42 42 GLU HA H 1 3.911 0.03 . 1 . . . . 42 GLU HA . 18820 1
394 . 1 1 42 42 GLU HB2 H 1 1.916 0.03 . 1 . . . . 42 GLU HB2 . 18820 1
395 . 1 1 42 42 GLU HB3 H 1 2.018 0.03 . 1 . . . . 42 GLU HB3 . 18820 1
396 . 1 1 42 42 GLU HG2 H 1 2.135 0.03 . 1 . . . . 42 GLU HG2 . 18820 1
397 . 1 1 42 42 GLU HG3 H 1 2.452 0.03 . 1 . . . . 42 GLU HG3 . 18820 1
398 . 1 1 42 42 GLU C C 13 179.546 0.3 . 1 . . . . 42 GLU C . 18820 1
399 . 1 1 42 42 GLU CA C 13 59.606 0.3 . 1 . . . . 42 GLU CA . 18820 1
400 . 1 1 42 42 GLU N N 15 117.819 0.001 . 1 . . . . 42 GLU N . 18820 1
401 . 1 1 43 43 LEU H H 1 7.780 0.001 . 1 . . . . 43 LEU H . 18820 1
402 . 1 1 43 43 LEU HA H 1 3.870 0.03 . 1 . . . . 43 LEU HA . 18820 1
403 . 1 1 43 43 LEU HB2 H 1 2.065 0.03 . 1 . . . . 43 LEU HB2 . 18820 1
404 . 1 1 43 43 LEU HB3 H 1 2.065 0.03 . 1 . . . . 43 LEU HB3 . 18820 1
405 . 1 1 43 43 LEU HG H 1 1.335 0.03 . 1 . . . . 43 LEU HG . 18820 1
406 . 1 1 43 43 LEU HD11 H 1 1.258 0.03 . 1 . . . . 43 LEU HD11 . 18820 1
407 . 1 1 43 43 LEU HD12 H 1 1.258 0.03 . 1 . . . . 43 LEU HD12 . 18820 1
408 . 1 1 43 43 LEU HD13 H 1 1.258 0.03 . 1 . . . . 43 LEU HD13 . 18820 1
409 . 1 1 43 43 LEU HD21 H 1 0.551 0.03 . 1 . . . . 43 LEU HD21 . 18820 1
410 . 1 1 43 43 LEU HD22 H 1 0.551 0.03 . 1 . . . . 43 LEU HD22 . 18820 1
411 . 1 1 43 43 LEU HD23 H 1 0.551 0.03 . 1 . . . . 43 LEU HD23 . 18820 1
412 . 1 1 43 43 LEU C C 13 177.949 0.3 . 1 . . . . 43 LEU C . 18820 1
413 . 1 1 43 43 LEU CA C 13 58.046 0.3 . 1 . . . . 43 LEU CA . 18820 1
414 . 1 1 43 43 LEU N N 15 122.727 0.001 . 1 . . . . 43 LEU N . 18820 1
415 . 1 1 44 44 VAL H H 1 8.409 0.001 . 1 . . . . 44 VAL H . 18820 1
416 . 1 1 44 44 VAL HA H 1 3.309 0.03 . 1 . . . . 44 VAL HA . 18820 1
417 . 1 1 44 44 VAL HB H 1 2.216 0.03 . 1 . . . . 44 VAL HB . 18820 1
418 . 1 1 44 44 VAL HG11 H 1 0.789 0.03 . 1 . . . . 44 VAL HG11 . 18820 1
419 . 1 1 44 44 VAL HG12 H 1 0.789 0.03 . 1 . . . . 44 VAL HG12 . 18820 1
420 . 1 1 44 44 VAL HG13 H 1 0.789 0.03 . 1 . . . . 44 VAL HG13 . 18820 1
421 . 1 1 44 44 VAL HG21 H 1 0.905 0.03 . 1 . . . . 44 VAL HG21 . 18820 1
422 . 1 1 44 44 VAL HG22 H 1 0.905 0.03 . 1 . . . . 44 VAL HG22 . 18820 1
423 . 1 1 44 44 VAL HG23 H 1 0.905 0.03 . 1 . . . . 44 VAL HG23 . 18820 1
424 . 1 1 44 44 VAL C C 13 178.212 0.3 . 1 . . . . 44 VAL C . 18820 1
425 . 1 1 44 44 VAL CA C 13 68.024 0.3 . 1 . . . . 44 VAL CA . 18820 1
426 . 1 1 44 44 VAL N N 15 120.857 0.002 . 1 . . . . 44 VAL N . 18820 1
427 . 1 1 45 45 MET H H 1 8.283 0.005 . 1 . . . . 45 MET H . 18820 1
428 . 1 1 45 45 MET HA H 1 4.329 0.03 . 1 . . . . 45 MET HA . 18820 1
429 . 1 1 45 45 MET HE1 H 1 2.535 0.03 . 1 . . . . 45 MET HE1 . 18820 1
430 . 1 1 45 45 MET HE2 H 1 2.535 0.03 . 1 . . . . 45 MET HE2 . 18820 1
431 . 1 1 45 45 MET HE3 H 1 2.535 0.03 . 1 . . . . 45 MET HE3 . 18820 1
432 . 1 1 45 45 MET C C 13 179.462 0.3 . 1 . . . . 45 MET C . 18820 1
433 . 1 1 45 45 MET CA C 13 58.925 0.3 . 1 . . . . 45 MET CA . 18820 1
434 . 1 1 45 45 MET N N 15 118.250 0.013 . 1 . . . . 45 MET N . 18820 1
435 . 1 1 46 46 ALA H H 1 7.996 0.002 . 1 . . . . 46 ALA H . 18820 1
436 . 1 1 46 46 ALA HA H 1 4.189 0.03 . 1 . . . . 46 ALA HA . 18820 1
437 . 1 1 46 46 ALA HB1 H 1 1.508 0.03 . 1 . . . . 46 ALA HB1 . 18820 1
438 . 1 1 46 46 ALA HB2 H 1 1.508 0.03 . 1 . . . . 46 ALA HB2 . 18820 1
439 . 1 1 46 46 ALA HB3 H 1 1.508 0.03 . 1 . . . . 46 ALA HB3 . 18820 1
440 . 1 1 46 46 ALA C C 13 181.108 0.3 . 1 . . . . 46 ALA C . 18820 1
441 . 1 1 46 46 ALA CA C 13 54.861 0.3 . 1 . . . . 46 ALA CA . 18820 1
442 . 1 1 46 46 ALA N N 15 123.810 0.003 . 1 . . . . 46 ALA N . 18820 1
443 . 1 1 47 47 LEU H H 1 8.548 0.002 . 1 . . . . 47 LEU H . 18820 1
444 . 1 1 47 47 LEU HA H 1 4.041 0.03 . 1 . . . . 47 LEU HA . 18820 1
445 . 1 1 47 47 LEU HB2 H 1 2.292 0.03 . 1 . . . . 47 LEU HB2 . 18820 1
446 . 1 1 47 47 LEU HB3 H 1 2.292 0.03 . 1 . . . . 47 LEU HB3 . 18820 1
447 . 1 1 47 47 LEU HG H 1 1.331 0.03 . 1 . . . . 47 LEU HG . 18820 1
448 . 1 1 47 47 LEU HD11 H 1 0.912 0.03 . 1 . . . . 47 LEU HD11 . 18820 1
449 . 1 1 47 47 LEU HD12 H 1 0.912 0.03 . 1 . . . . 47 LEU HD12 . 18820 1
450 . 1 1 47 47 LEU HD13 H 1 0.912 0.03 . 1 . . . . 47 LEU HD13 . 18820 1
451 . 1 1 47 47 LEU HD21 H 1 0.727 0.03 . 1 . . . . 47 LEU HD21 . 18820 1
452 . 1 1 47 47 LEU HD22 H 1 0.727 0.03 . 1 . . . . 47 LEU HD22 . 18820 1
453 . 1 1 47 47 LEU HD23 H 1 0.727 0.03 . 1 . . . . 47 LEU HD23 . 18820 1
454 . 1 1 47 47 LEU C C 13 178.999 0.3 . 1 . . . . 47 LEU C . 18820 1
455 . 1 1 47 47 LEU CA C 13 58.114 0.3 . 1 . . . . 47 LEU CA . 18820 1
456 . 1 1 47 47 LEU N N 15 120.851 0.004 . 1 . . . . 47 LEU N . 18820 1
457 . 1 1 48 48 GLU H H 1 8.482 0.002 . 1 . . . . 48 GLU H . 18820 1
458 . 1 1 48 48 GLU HA H 1 3.925 0.03 . 1 . . . . 48 GLU HA . 18820 1
459 . 1 1 48 48 GLU HB2 H 1 2.376 0.008 . 1 . . . . 48 GLU HB2 . 18820 1
460 . 1 1 48 48 GLU HB3 H 1 2.195 0.001 . 1 . . . . 48 GLU HB3 . 18820 1
461 . 1 1 48 48 GLU HG2 H 1 2.689 0.001 . 1 . . . . 48 GLU HG2 . 18820 1
462 . 1 1 48 48 GLU HG3 H 1 2.689 0.001 . 1 . . . . 48 GLU HG3 . 18820 1
463 . 1 1 48 48 GLU C C 13 179.245 0.3 . 1 . . . . 48 GLU C . 18820 1
464 . 1 1 48 48 GLU CA C 13 60.105 0.3 . 1 . . . . 48 GLU CA . 18820 1
465 . 1 1 48 48 GLU CB C 13 29.539 0.017 . 1 . . . . 48 GLU CB . 18820 1
466 . 1 1 48 48 GLU CG C 13 35.989 0.3 . 1 . . . . 48 GLU CG . 18820 1
467 . 1 1 48 48 GLU N N 15 118.844 0.013 . 1 . . . . 48 GLU N . 18820 1
468 . 1 1 49 49 ALA H H 1 7.662 0.001 . 1 . . . . 49 ALA H . 18820 1
469 . 1 1 49 49 ALA HA H 1 4.126 0.03 . 1 . . . . 49 ALA HA . 18820 1
470 . 1 1 49 49 ALA HB1 H 1 1.439 0.03 . 1 . . . . 49 ALA HB1 . 18820 1
471 . 1 1 49 49 ALA HB2 H 1 1.439 0.03 . 1 . . . . 49 ALA HB2 . 18820 1
472 . 1 1 49 49 ALA HB3 H 1 1.439 0.03 . 1 . . . . 49 ALA HB3 . 18820 1
473 . 1 1 49 49 ALA C C 13 180.057 0.3 . 1 . . . . 49 ALA C . 18820 1
474 . 1 1 49 49 ALA CA C 13 54.345 0.3 . 1 . . . . 49 ALA CA . 18820 1
475 . 1 1 49 49 ALA N N 15 119.853 0.007 . 1 . . . . 49 ALA N . 18820 1
476 . 1 1 50 50 GLU H H 1 8.011 0.004 . 1 . . . . 50 GLU H . 18820 1
477 . 1 1 50 50 GLU HA H 1 3.884 0.03 . 1 . . . . 50 GLU HA . 18820 1
478 . 1 1 50 50 GLU HG2 H 1 1.979 0.03 . 1 . . . . 50 GLU HG2 . 18820 1
479 . 1 1 50 50 GLU HG3 H 1 1.979 0.03 . 1 . . . . 50 GLU HG3 . 18820 1
480 . 1 1 50 50 GLU C C 13 177.397 0.3 . 1 . . . . 50 GLU C . 18820 1
481 . 1 1 50 50 GLU CA C 13 58.141 0.3 . 1 . . . . 50 GLU CA . 18820 1
482 . 1 1 50 50 GLU N N 15 118.582 0.004 . 1 . . . . 50 GLU N . 18820 1
483 . 1 1 51 51 PHE H H 1 7.914 0.004 . 1 . . . . 51 PHE H . 18820 1
484 . 1 1 51 51 PHE HA H 1 4.421 0.03 . 1 . . . . 51 PHE HA . 18820 1
485 . 1 1 51 51 PHE HB2 H 1 2.684 0.03 . 1 . . . . 51 PHE HB2 . 18820 1
486 . 1 1 51 51 PHE HB3 H 1 3.223 0.03 . 1 . . . . 51 PHE HB3 . 18820 1
487 . 1 1 51 51 PHE HD1 H 1 7.518 0.002 . 3 . . . . 51 PHE HD1 . 18820 1
488 . 1 1 51 51 PHE HD2 H 1 7.518 0.002 . 3 . . . . 51 PHE HD2 . 18820 1
489 . 1 1 51 51 PHE HE1 H 1 7.034 0.005 . 3 . . . . 51 PHE HE1 . 18820 1
490 . 1 1 51 51 PHE HE2 H 1 7.034 0.005 . 3 . . . . 51 PHE HE2 . 18820 1
491 . 1 1 51 51 PHE C C 13 175.832 0.3 . 1 . . . . 51 PHE C . 18820 1
492 . 1 1 51 51 PHE CA C 13 58.752 0.3 . 1 . . . . 51 PHE CA . 18820 1
493 . 1 1 51 51 PHE CD1 C 13 130.197 0.3 . 3 . . . . 51 PHE CD1 . 18820 1
494 . 1 1 51 51 PHE CD2 C 13 130.197 0.3 . 3 . . . . 51 PHE CD2 . 18820 1
495 . 1 1 51 51 PHE CE1 C 13 128.427 0.007 . 3 . . . . 51 PHE CE1 . 18820 1
496 . 1 1 51 51 PHE CE2 C 13 128.427 0.007 . 3 . . . . 51 PHE CE2 . 18820 1
497 . 1 1 51 51 PHE N N 15 111.941 0.3 . 1 . . . . 51 PHE N . 18820 1
498 . 1 1 52 52 GLY H H 1 7.972 0.002 . 1 . . . . 52 GLY H . 18820 1
499 . 1 1 52 52 GLY HA2 H 1 3.880 0.03 . 1 . . . . 52 GLY HA2 . 18820 1
500 . 1 1 52 52 GLY HA3 H 1 3.909 0.03 . 1 . . . . 52 GLY HA3 . 18820 1
501 . 1 1 52 52 GLY C C 13 174.613 0.3 . 1 . . . . 52 GLY C . 18820 1
502 . 1 1 52 52 GLY CA C 13 47.169 0.3 . 1 . . . . 52 GLY CA . 18820 1
503 . 1 1 52 52 GLY N N 15 110.865 0.006 . 1 . . . . 52 GLY N . 18820 1
504 . 1 1 53 53 VAL H H 1 7.432 0.001 . 1 . . . . 53 VAL H . 18820 1
505 . 1 1 53 53 VAL HB H 1 2.038 0.03 . 1 . . . . 53 VAL HB . 18820 1
506 . 1 1 53 53 VAL C C 13 173.936 0.3 . 1 . . . . 53 VAL C . 18820 1
507 . 1 1 53 53 VAL N N 15 111.165 0.014 . 1 . . . . 53 VAL N . 18820 1
508 . 1 1 54 54 GLU H H 1 8.265 0.003 . 1 . . . . 54 GLU H . 18820 1
509 . 1 1 54 54 GLU CA C 13 55.252 0.011 . 1 . . . . 54 GLU CA . 18820 1
510 . 1 1 54 54 GLU CB C 13 31.193 0.3 . 1 . . . . 54 GLU CB . 18820 1
511 . 1 1 54 54 GLU N N 15 121.069 0.013 . 1 . . . . 54 GLU N . 18820 1
512 . 1 1 55 55 ILE HA H 1 4.103 0.03 . 1 . . . . 55 ILE HA . 18820 1
513 . 1 1 55 55 ILE HB H 1 1.427 0.03 . 1 . . . . 55 ILE HB . 18820 1
514 . 1 1 55 55 ILE HG21 H 1 0.840 0.03 . 1 . . . . 55 ILE HG21 . 18820 1
515 . 1 1 55 55 ILE HG22 H 1 0.840 0.03 . 1 . . . . 55 ILE HG22 . 18820 1
516 . 1 1 55 55 ILE HG23 H 1 0.840 0.03 . 1 . . . . 55 ILE HG23 . 18820 1
517 . 1 1 55 55 ILE HD11 H 1 0.476 0.03 . 1 . . . . 55 ILE HD11 . 18820 1
518 . 1 1 55 55 ILE HD12 H 1 0.476 0.03 . 1 . . . . 55 ILE HD12 . 18820 1
519 . 1 1 55 55 ILE HD13 H 1 0.476 0.03 . 1 . . . . 55 ILE HD13 . 18820 1
520 . 1 1 55 55 ILE C C 13 174.873 0.3 . 1 . . . . 55 ILE C . 18820 1
521 . 1 1 56 56 ALA H H 1 8.755 0.001 . 1 . . . . 56 ALA H . 18820 1
522 . 1 1 56 56 ALA HA H 1 4.194 0.03 . 1 . . . . 56 ALA HA . 18820 1
523 . 1 1 56 56 ALA HB1 H 1 1.433 0.03 . 1 . . . . 56 ALA HB1 . 18820 1
524 . 1 1 56 56 ALA HB2 H 1 1.433 0.03 . 1 . . . . 56 ALA HB2 . 18820 1
525 . 1 1 56 56 ALA HB3 H 1 1.433 0.03 . 1 . . . . 56 ALA HB3 . 18820 1
526 . 1 1 56 56 ALA C C 13 178.365 0.3 . 1 . . . . 56 ALA C . 18820 1
527 . 1 1 56 56 ALA CA C 13 52.379 0.3 . 1 . . . . 56 ALA CA . 18820 1
528 . 1 1 56 56 ALA N N 15 111.856 0.001 . 1 . . . . 56 ALA N . 18820 1
529 . 1 1 57 57 ASP H H 1 8.658 0.001 . 1 . . . . 57 ASP H . 18820 1
530 . 1 1 57 57 ASP HA H 1 4.241 0.03 . 1 . . . . 57 ASP HA . 18820 1
531 . 1 1 57 57 ASP HB2 H 1 2.562 0.03 . 1 . . . . 57 ASP HB2 . 18820 1
532 . 1 1 57 57 ASP HB3 H 1 2.455 0.03 . 1 . . . . 57 ASP HB3 . 18820 1
533 . 1 1 57 57 ASP N N 15 122.074 0.006 . 1 . . . . 57 ASP N . 18820 1
534 . 1 1 58 58 ASP H H 1 7.161 0.001 . 1 . . . . 58 ASP H . 18820 1
535 . 1 1 58 58 ASP HA H 1 4.196 0.03 . 1 . . . . 58 ASP HA . 18820 1
536 . 1 1 58 58 ASP HB2 H 1 2.528 0.03 . 1 . . . . 58 ASP HB2 . 18820 1
537 . 1 1 58 58 ASP HB3 H 1 2.628 0.03 . 1 . . . . 58 ASP HB3 . 18820 1
538 . 1 1 58 58 ASP C C 13 177.696 0.3 . 1 . . . . 58 ASP C . 18820 1
539 . 1 1 58 58 ASP N N 15 118.507 0.022 . 1 . . . . 58 ASP N . 18820 1
540 . 1 1 59 59 ASP H H 1 8.599 0.001 . 1 . . . . 59 ASP H . 18820 1
541 . 1 1 59 59 ASP HA H 1 4.393 0.03 . 1 . . . . 59 ASP HA . 18820 1
542 . 1 1 59 59 ASP HB2 H 1 2.179 0.03 . 1 . . . . 59 ASP HB2 . 18820 1
543 . 1 1 59 59 ASP HB3 H 1 2.493 0.03 . 1 . . . . 59 ASP HB3 . 18820 1
544 . 1 1 59 59 ASP C C 13 177.892 0.3 . 1 . . . . 59 ASP C . 18820 1
545 . 1 1 59 59 ASP CA C 13 56.227 0.3 . 1 . . . . 59 ASP CA . 18820 1
546 . 1 1 59 59 ASP N N 15 116.425 0.001 . 1 . . . . 59 ASP N . 18820 1
547 . 1 1 60 60 ALA H H 1 8.315 0.003 . 1 . . . . 60 ALA H . 18820 1
548 . 1 1 60 60 ALA HA H 1 3.590 0.03 . 1 . . . . 60 ALA HA . 18820 1
549 . 1 1 60 60 ALA HB1 H 1 1.295 0.03 . 1 . . . . 60 ALA HB1 . 18820 1
550 . 1 1 60 60 ALA HB2 H 1 1.295 0.03 . 1 . . . . 60 ALA HB2 . 18820 1
551 . 1 1 60 60 ALA HB3 H 1 1.295 0.03 . 1 . . . . 60 ALA HB3 . 18820 1
552 . 1 1 60 60 ALA C C 13 179.257 0.3 . 1 . . . . 60 ALA C . 18820 1
553 . 1 1 60 60 ALA CA C 13 55.000 0.3 . 1 . . . . 60 ALA CA . 18820 1
554 . 1 1 60 60 ALA N N 15 122.660 0.001 . 1 . . . . 60 ALA N . 18820 1
555 . 1 1 61 61 GLU H H 1 7.537 0.001 . 1 . . . . 61 GLU H . 18820 1
556 . 1 1 61 61 GLU HA H 1 3.893 0.03 . 1 . . . . 61 GLU HA . 18820 1
557 . 1 1 61 61 GLU HB2 H 1 1.962 0.03 . 1 . . . . 61 GLU HB2 . 18820 1
558 . 1 1 61 61 GLU HB3 H 1 1.962 0.03 . 1 . . . . 61 GLU HB3 . 18820 1
559 . 1 1 61 61 GLU HG2 H 1 2.226 0.03 . 1 . . . . 61 GLU HG2 . 18820 1
560 . 1 1 61 61 GLU HG3 H 1 2.269 0.03 . 1 . . . . 61 GLU HG3 . 18820 1
561 . 1 1 61 61 GLU C C 13 176.823 0.3 . 1 . . . . 61 GLU C . 18820 1
562 . 1 1 61 61 GLU CA C 13 57.825 0.3 . 1 . . . . 61 GLU CA . 18820 1
563 . 1 1 61 61 GLU N N 15 113.551 0.009 . 1 . . . . 61 GLU N . 18820 1
564 . 1 1 62 62 ARG H H 1 7.167 0.002 . 1 . . . . 62 ARG H . 18820 1
565 . 1 1 62 62 ARG HA H 1 4.307 0.03 . 1 . . . . 62 ARG HA . 18820 1
566 . 1 1 62 62 ARG HB2 H 1 1.823 0.03 . 1 . . . . 62 ARG HB2 . 18820 1
567 . 1 1 62 62 ARG HB3 H 1 1.951 0.03 . 1 . . . . 62 ARG HB3 . 18820 1
568 . 1 1 62 62 ARG HG2 H 1 1.618 0.03 . 1 . . . . 62 ARG HG2 . 18820 1
569 . 1 1 62 62 ARG HG3 H 1 1.684 0.03 . 1 . . . . 62 ARG HG3 . 18820 1
570 . 1 1 62 62 ARG HD2 H 1 3.187 0.03 . 1 . . . . 62 ARG HD2 . 18820 1
571 . 1 1 62 62 ARG HD3 H 1 3.187 0.03 . 1 . . . . 62 ARG HD3 . 18820 1
572 . 1 1 62 62 ARG C C 13 176.224 0.3 . 1 . . . . 62 ARG C . 18820 1
573 . 1 1 62 62 ARG CA C 13 55.718 0.3 . 1 . . . . 62 ARG CA . 18820 1
574 . 1 1 62 62 ARG N N 15 115.456 0.001 . 1 . . . . 62 ARG N . 18820 1
575 . 1 1 63 63 ILE H H 1 7.182 0.003 . 1 . . . . 63 ILE H . 18820 1
576 . 1 1 63 63 ILE HA H 1 3.726 0.03 . 1 . . . . 63 ILE HA . 18820 1
577 . 1 1 63 63 ILE HB H 1 1.818 0.03 . 1 . . . . 63 ILE HB . 18820 1
578 . 1 1 63 63 ILE HD11 H 1 0.416 0.03 . 1 . . . . 63 ILE HD11 . 18820 1
579 . 1 1 63 63 ILE HD12 H 1 0.416 0.03 . 1 . . . . 63 ILE HD12 . 18820 1
580 . 1 1 63 63 ILE HD13 H 1 0.416 0.03 . 1 . . . . 63 ILE HD13 . 18820 1
581 . 1 1 63 63 ILE C C 13 174.600 0.3 . 1 . . . . 63 ILE C . 18820 1
582 . 1 1 63 63 ILE CA C 13 62.822 0.3 . 1 . . . . 63 ILE CA . 18820 1
583 . 1 1 63 63 ILE N N 15 121.065 0.005 . 1 . . . . 63 ILE N . 18820 1
584 . 1 1 64 64 GLU H H 1 8.830 0.001 . 1 . . . . 64 GLU H . 18820 1
585 . 1 1 64 64 GLU HA H 1 4.519 0.03 . 1 . . . . 64 GLU HA . 18820 1
586 . 1 1 64 64 GLU HB3 H 1 2.154 0.03 . 1 . . . . 64 GLU HB3 . 18820 1
587 . 1 1 64 64 GLU HG2 H 1 2.231 0.03 . 1 . . . . 64 GLU HG2 . 18820 1
588 . 1 1 64 64 GLU HG3 H 1 2.231 0.03 . 1 . . . . 64 GLU HG3 . 18820 1
589 . 1 1 64 64 GLU C C 13 176.676 0.3 . 1 . . . . 64 GLU C . 18820 1
590 . 1 1 64 64 GLU CA C 13 56.889 0.3 . 1 . . . . 64 GLU CA . 18820 1
591 . 1 1 64 64 GLU N N 15 124.553 0.002 . 1 . . . . 64 GLU N . 18820 1
592 . 1 1 65 65 THR H H 1 7.521 0.002 . 1 . . . . 65 THR H . 18820 1
593 . 1 1 65 65 THR HA H 1 4.833 0.03 . 1 . . . . 65 THR HA . 18820 1
594 . 1 1 65 65 THR HB H 1 4.188 0.03 . 1 . . . . 65 THR HB . 18820 1
595 . 1 1 65 65 THR HG21 H 1 0.902 0.03 . 1 . . . . 65 THR HG21 . 18820 1
596 . 1 1 65 65 THR HG22 H 1 0.902 0.03 . 1 . . . . 65 THR HG22 . 18820 1
597 . 1 1 65 65 THR HG23 H 1 0.902 0.03 . 1 . . . . 65 THR HG23 . 18820 1
598 . 1 1 65 65 THR C C 13 174.943 0.3 . 1 . . . . 65 THR C . 18820 1
599 . 1 1 65 65 THR CA C 13 57.939 0.3 . 1 . . . . 65 THR CA . 18820 1
600 . 1 1 65 65 THR CB C 13 73.674 0.3 . 1 . . . . 65 THR CB . 18820 1
601 . 1 1 65 65 THR N N 15 127.033 0.029 . 1 . . . . 65 THR N . 18820 1
602 . 1 1 66 66 VAL H H 1 7.584 0.002 . 1 . . . . 66 VAL H . 18820 1
603 . 1 1 66 66 VAL HA H 1 3.395 0.03 . 1 . . . . 66 VAL HA . 18820 1
604 . 1 1 66 66 VAL HB H 1 2.468 0.03 . 1 . . . . 66 VAL HB . 18820 1
605 . 1 1 66 66 VAL HG11 H 1 0.828 0.03 . 1 . . . . 66 VAL HG11 . 18820 1
606 . 1 1 66 66 VAL HG12 H 1 0.828 0.03 . 1 . . . . 66 VAL HG12 . 18820 1
607 . 1 1 66 66 VAL HG13 H 1 0.828 0.03 . 1 . . . . 66 VAL HG13 . 18820 1
608 . 1 1 66 66 VAL HG21 H 1 1.012 0.03 . 1 . . . . 66 VAL HG21 . 18820 1
609 . 1 1 66 66 VAL HG22 H 1 1.012 0.03 . 1 . . . . 66 VAL HG22 . 18820 1
610 . 1 1 66 66 VAL HG23 H 1 1.012 0.03 . 1 . . . . 66 VAL HG23 . 18820 1
611 . 1 1 66 66 VAL C C 13 177.437 0.3 . 1 . . . . 66 VAL C . 18820 1
612 . 1 1 66 66 VAL CA C 13 67.581 0.3 . 1 . . . . 66 VAL CA . 18820 1
613 . 1 1 66 66 VAL N N 15 120.796 0.001 . 1 . . . . 66 VAL N . 18820 1
614 . 1 1 67 67 ARG H H 1 8.817 0.003 . 1 . . . . 67 ARG H . 18820 1
615 . 1 1 67 67 ARG HA H 1 3.704 0.03 . 1 . . . . 67 ARG HA . 18820 1
616 . 1 1 67 67 ARG HB2 H 1 1.856 0.03 . 1 . . . . 67 ARG HB2 . 18820 1
617 . 1 1 67 67 ARG HB3 H 1 1.856 0.03 . 1 . . . . 67 ARG HB3 . 18820 1
618 . 1 1 67 67 ARG HG2 H 1 1.471 0.03 . 1 . . . . 67 ARG HG2 . 18820 1
619 . 1 1 67 67 ARG HG3 H 1 1.533 0.03 . 1 . . . . 67 ARG HG3 . 18820 1
620 . 1 1 67 67 ARG HD2 H 1 2.937 0.03 . 1 . . . . 67 ARG HD2 . 18820 1
621 . 1 1 67 67 ARG HD3 H 1 3.257 0.03 . 1 . . . . 67 ARG HD3 . 18820 1
622 . 1 1 67 67 ARG C C 13 177.430 0.3 . 1 . . . . 67 ARG C . 18820 1
623 . 1 1 67 67 ARG CA C 13 59.385 0.3 . 1 . . . . 67 ARG CA . 18820 1
624 . 1 1 67 67 ARG N N 15 119.376 0.002 . 1 . . . . 67 ARG N . 18820 1
625 . 1 1 68 68 GLN H H 1 7.613 0.002 . 1 . . . . 68 GLN H . 18820 1
626 . 1 1 68 68 GLN HA H 1 4.075 0.03 . 1 . . . . 68 GLN HA . 18820 1
627 . 1 1 68 68 GLN HB3 H 1 2.000 0.03 . 1 . . . . 68 GLN HB3 . 18820 1
628 . 1 1 68 68 GLN HG2 H 1 2.315 0.03 . 1 . . . . 68 GLN HG2 . 18820 1
629 . 1 1 68 68 GLN HG3 H 1 2.507 0.03 . 1 . . . . 68 GLN HG3 . 18820 1
630 . 1 1 68 68 GLN C C 13 179.220 0.3 . 1 . . . . 68 GLN C . 18820 1
631 . 1 1 68 68 GLN CA C 13 58.406 0.3 . 1 . . . . 68 GLN CA . 18820 1
632 . 1 1 68 68 GLN N N 15 115.902 0.002 . 1 . . . . 68 GLN N . 18820 1
633 . 1 1 69 69 ALA H H 1 7.939 0.002 . 1 . . . . 69 ALA H . 18820 1
634 . 1 1 69 69 ALA HA H 1 3.964 0.03 . 1 . . . . 69 ALA HA . 18820 1
635 . 1 1 69 69 ALA HB1 H 1 1.476 0.03 . 1 . . . . 69 ALA HB1 . 18820 1
636 . 1 1 69 69 ALA HB2 H 1 1.476 0.03 . 1 . . . . 69 ALA HB2 . 18820 1
637 . 1 1 69 69 ALA HB3 H 1 1.476 0.03 . 1 . . . . 69 ALA HB3 . 18820 1
638 . 1 1 69 69 ALA C C 13 178.034 0.3 . 1 . . . . 69 ALA C . 18820 1
639 . 1 1 69 69 ALA CA C 13 55.654 0.3 . 1 . . . . 69 ALA CA . 18820 1
640 . 1 1 69 69 ALA N N 15 122.109 0.3 . 1 . . . . 69 ALA N . 18820 1
641 . 1 1 70 70 ILE H H 1 8.016 0.001 . 1 . . . . 70 ILE H . 18820 1
642 . 1 1 70 70 ILE HA H 1 3.301 0.03 . 1 . . . . 70 ILE HA . 18820 1
643 . 1 1 70 70 ILE HB H 1 1.838 0.03 . 1 . . . . 70 ILE HB . 18820 1
644 . 1 1 70 70 ILE C C 13 177.123 0.3 . 1 . . . . 70 ILE C . 18820 1
645 . 1 1 70 70 ILE CA C 13 66.051 0.3 . 1 . . . . 70 ILE CA . 18820 1
646 . 1 1 70 70 ILE N N 15 117.222 0.006 . 1 . . . . 70 ILE N . 18820 1
647 . 1 1 71 71 ASP H H 1 8.677 0.003 . 1 . . . . 71 ASP H . 18820 1
648 . 1 1 71 71 ASP HA H 1 4.216 0.03 . 1 . . . . 71 ASP HA . 18820 1
649 . 1 1 71 71 ASP HB2 H 1 2.498 0.03 . 1 . . . . 71 ASP HB2 . 18820 1
650 . 1 1 71 71 ASP HB3 H 1 2.551 0.03 . 1 . . . . 71 ASP HB3 . 18820 1
651 . 1 1 71 71 ASP C C 13 179.239 0.3 . 1 . . . . 71 ASP C . 18820 1
652 . 1 1 71 71 ASP CA C 13 57.449 0.3 . 1 . . . . 71 ASP CA . 18820 1
653 . 1 1 71 71 ASP N N 15 119.242 0.001 . 1 . . . . 71 ASP N . 18820 1
654 . 1 1 72 72 TYR H H 1 7.855 0.001 . 1 . . . . 72 TYR H . 18820 1
655 . 1 1 72 72 TYR HA H 1 4.000 0.002 . 1 . . . . 72 TYR HA . 18820 1
656 . 1 1 72 72 TYR HB2 H 1 2.972 0.006 . 1 . . . . 72 TYR HB2 . 18820 1
657 . 1 1 72 72 TYR HB3 H 1 2.991 0.011 . 1 . . . . 72 TYR HB3 . 18820 1
658 . 1 1 72 72 TYR HD1 H 1 6.874 0.003 . 3 . . . . 72 TYR HD1 . 18820 1
659 . 1 1 72 72 TYR HD2 H 1 6.874 0.003 . 3 . . . . 72 TYR HD2 . 18820 1
660 . 1 1 72 72 TYR HE1 H 1 6.544 0.001 . 3 . . . . 72 TYR HE1 . 18820 1
661 . 1 1 72 72 TYR HE2 H 1 6.544 0.001 . 3 . . . . 72 TYR HE2 . 18820 1
662 . 1 1 72 72 TYR C C 13 178.351 0.3 . 1 . . . . 72 TYR C . 18820 1
663 . 1 1 72 72 TYR CA C 13 61.673 0.029 . 1 . . . . 72 TYR CA . 18820 1
664 . 1 1 72 72 TYR CB C 13 38.353 0.3 . 1 . . . . 72 TYR CB . 18820 1
665 . 1 1 72 72 TYR CD1 C 13 130.516 0.030 . 3 . . . . 72 TYR CD1 . 18820 1
666 . 1 1 72 72 TYR CD2 C 13 130.516 0.030 . 3 . . . . 72 TYR CD2 . 18820 1
667 . 1 1 72 72 TYR CE1 C 13 116.071 0.035 . 3 . . . . 72 TYR CE1 . 18820 1
668 . 1 1 72 72 TYR CE2 C 13 116.071 0.035 . 3 . . . . 72 TYR CE2 . 18820 1
669 . 1 1 72 72 TYR N N 15 118.727 0.002 . 1 . . . . 72 TYR N . 18820 1
670 . 1 1 73 73 LEU H H 1 7.869 0.002 . 1 . . . . 73 LEU H . 18820 1
671 . 1 1 73 73 LEU HA H 1 3.707 0.03 . 1 . . . . 73 LEU HA . 18820 1
672 . 1 1 73 73 LEU HB2 H 1 1.743 0.03 . 1 . . . . 73 LEU HB2 . 18820 1
673 . 1 1 73 73 LEU HB3 H 1 1.743 0.03 . 1 . . . . 73 LEU HB3 . 18820 1
674 . 1 1 73 73 LEU HD11 H 1 0.805 0.03 . 1 . . . . 73 LEU HD11 . 18820 1
675 . 1 1 73 73 LEU HD12 H 1 0.805 0.03 . 1 . . . . 73 LEU HD12 . 18820 1
676 . 1 1 73 73 LEU HD13 H 1 0.805 0.03 . 1 . . . . 73 LEU HD13 . 18820 1
677 . 1 1 73 73 LEU HD21 H 1 0.468 0.007 . 1 . . . . 73 LEU HD21 . 18820 1
678 . 1 1 73 73 LEU HD22 H 1 0.468 0.007 . 1 . . . . 73 LEU HD22 . 18820 1
679 . 1 1 73 73 LEU HD23 H 1 0.468 0.007 . 1 . . . . 73 LEU HD23 . 18820 1
680 . 1 1 73 73 LEU C C 13 178.073 0.3 . 1 . . . . 73 LEU C . 18820 1
681 . 1 1 73 73 LEU CA C 13 57.621 0.080 . 1 . . . . 73 LEU CA . 18820 1
682 . 1 1 73 73 LEU CB C 13 41.839 0.3 . 1 . . . . 73 LEU CB . 18820 1
683 . 1 1 73 73 LEU N N 15 120.255 0.009 . 1 . . . . 73 LEU N . 18820 1
684 . 1 1 74 74 GLU H H 1 8.552 0.004 . 1 . . . . 74 GLU H . 18820 1
685 . 1 1 74 74 GLU HA H 1 3.814 0.03 . 1 . . . . 74 GLU HA . 18820 1
686 . 1 1 74 74 GLU HB2 H 1 1.984 0.004 . 1 . . . . 74 GLU HB2 . 18820 1
687 . 1 1 74 74 GLU HB3 H 1 1.984 0.004 . 1 . . . . 74 GLU HB3 . 18820 1
688 . 1 1 74 74 GLU HG2 H 1 2.455 0.03 . 1 . . . . 74 GLU HG2 . 18820 1
689 . 1 1 74 74 GLU HG3 H 1 2.321 0.03 . 1 . . . . 74 GLU HG3 . 18820 1
690 . 1 1 74 74 GLU C C 13 178.168 0.3 . 1 . . . . 74 GLU C . 18820 1
691 . 1 1 74 74 GLU CA C 13 58.904 0.038 . 1 . . . . 74 GLU CA . 18820 1
692 . 1 1 74 74 GLU CB C 13 28.768 0.3 . 1 . . . . 74 GLU CB . 18820 1
693 . 1 1 74 74 GLU CG C 13 35.069 0.004 . 1 . . . . 74 GLU CG . 18820 1
694 . 1 1 74 74 GLU N N 15 117.290 0.014 . 1 . . . . 74 GLU N . 18820 1
695 . 1 1 75 75 GLU H H 1 7.124 0.003 . 1 . . . . 75 GLU H . 18820 1
696 . 1 1 75 75 GLU HA H 1 4.132 0.011 . 1 . . . . 75 GLU HA . 18820 1
697 . 1 1 75 75 GLU HB3 H 1 1.966 0.001 . 1 . . . . 75 GLU HB3 . 18820 1
698 . 1 1 75 75 GLU HG2 H 1 2.245 0.03 . 1 . . . . 75 GLU HG2 . 18820 1
699 . 1 1 75 75 GLU C C 13 176.642 0.3 . 1 . . . . 75 GLU C . 18820 1
700 . 1 1 75 75 GLU CA C 13 56.764 0.064 . 1 . . . . 75 GLU CA . 18820 1
701 . 1 1 75 75 GLU CB C 13 30.053 0.025 . 1 . . . . 75 GLU CB . 18820 1
702 . 1 1 75 75 GLU CG C 13 36.065 0.016 . 1 . . . . 75 GLU CG . 18820 1
703 . 1 1 75 75 GLU N N 15 115.589 0.007 . 1 . . . . 75 GLU N . 18820 1
704 . 1 1 76 76 ALA H H 1 7.488 0.002 . 1 . . . . 76 ALA H . 18820 1
705 . 1 1 76 76 ALA HA H 1 4.130 0.007 . 1 . . . . 76 ALA HA . 18820 1
706 . 1 1 76 76 ALA HB1 H 1 1.163 0.007 . 1 . . . . 76 ALA HB1 . 18820 1
707 . 1 1 76 76 ALA HB2 H 1 1.163 0.007 . 1 . . . . 76 ALA HB2 . 18820 1
708 . 1 1 76 76 ALA HB3 H 1 1.163 0.007 . 1 . . . . 76 ALA HB3 . 18820 1
709 . 1 1 76 76 ALA C C 13 177.811 0.3 . 1 . . . . 76 ALA C . 18820 1
710 . 1 1 76 76 ALA CA C 13 53.105 0.049 . 1 . . . . 76 ALA CA . 18820 1
711 . 1 1 76 76 ALA CB C 13 20.256 0.087 . 1 . . . . 76 ALA CB . 18820 1
712 . 1 1 76 76 ALA N N 15 121.563 0.001 . 1 . . . . 76 ALA N . 18820 1
713 . 1 1 77 77 VAL H H 1 7.885 0.003 . 1 . . . . 77 VAL H . 18820 1
714 . 1 1 77 77 VAL CA C 13 60.724 0.029 . 1 . . . . 77 VAL CA . 18820 1
715 . 1 1 77 77 VAL CB C 13 32.080 0.3 . 1 . . . . 77 VAL CB . 18820 1
716 . 1 1 77 77 VAL N N 15 119.233 0.015 . 1 . . . . 77 VAL N . 18820 1
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save_