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 19666
_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 .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 19666 1
2 '2D 1H-13C HSQC' . . . 19666 1
3 '3D HNCO' . . . 19666 1
5 '3D HBHA(CO)NH' . . . 19666 1
6 '3D CBCA(CO)NH' . . . 19666 1
7 '3D 1H-13C NOESY aliphatic' . . . 19666 1
8 '3D 1H-13C NOESY aromatic' . . . 19666 1
9 '3D 1H-15N NOESY' . . . 19666 1
10 '4D HCC(CO)NH' . . . 19666 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 SER HA H 1 4.127 0.03 . 1 . . . A 1 SER HA . 19666 1
2 . 1 1 1 1 SER HB2 H 1 3.967 0.03 . 2 . . . A 1 SER HB2 . 19666 1
3 . 1 1 1 1 SER HB3 H 1 3.926 0.03 . 2 . . . A 1 SER HB3 . 19666 1
4 . 1 1 1 1 SER C C 13 170.428 0.30 . 1 . . . A 1 SER C . 19666 1
5 . 1 1 1 1 SER CA C 13 57.404 0.30 . 1 . . . A 1 SER CA . 19666 1
6 . 1 1 1 1 SER CB C 13 63.183 0.30 . 1 . . . A 1 SER CB . 19666 1
7 . 1 1 2 2 ALA H H 1 8.421 0.03 . 1 . . . A 2 ALA H . 19666 1
8 . 1 1 2 2 ALA HA H 1 4.227 0.03 . 1 . . . A 2 ALA HA . 19666 1
9 . 1 1 2 2 ALA HB1 H 1 0.757 0.03 . 1 . . . A 2 ALA HB1 . 19666 1
10 . 1 1 2 2 ALA HB2 H 1 0.757 0.03 . 1 . . . A 2 ALA HB2 . 19666 1
11 . 1 1 2 2 ALA HB3 H 1 0.757 0.03 . 1 . . . A 2 ALA HB3 . 19666 1
12 . 1 1 2 2 ALA C C 13 176.106 0.30 . 1 . . . A 2 ALA C . 19666 1
13 . 1 1 2 2 ALA CA C 13 52.504 0.30 . 1 . . . A 2 ALA CA . 19666 1
14 . 1 1 2 2 ALA CB C 13 19.016 0.30 . 1 . . . A 2 ALA CB . 19666 1
15 . 1 1 2 2 ALA N N 15 124.746 0.30 . 1 . . . A 2 ALA N . 19666 1
16 . 1 1 3 3 LYS H H 1 8.275 0.03 . 1 . . . A 3 LYS H . 19666 1
17 . 1 1 3 3 LYS HA H 1 4.336 0.03 . 1 . . . A 3 LYS HA . 19666 1
18 . 1 1 3 3 LYS HB2 H 1 1.701 0.03 . 1 . . . A 3 LYS HB2 . 19666 1
19 . 1 1 3 3 LYS HB3 H 1 1.701 0.03 . 1 . . . A 3 LYS HB3 . 19666 1
20 . 1 1 3 3 LYS HG2 H 1 1.394 0.03 . 2 . . . A 3 LYS HG2 . 19666 1
21 . 1 1 3 3 LYS HG3 H 1 1.327 0.03 . 2 . . . A 3 LYS HG3 . 19666 1
22 . 1 1 3 3 LYS HD2 H 1 1.639 0.03 . 1 . . . A 3 LYS HD2 . 19666 1
23 . 1 1 3 3 LYS HD3 H 1 1.639 0.03 . 1 . . . A 3 LYS HD3 . 19666 1
24 . 1 1 3 3 LYS HE2 H 1 2.995 0.03 . 1 . . . A 3 LYS HE2 . 19666 1
25 . 1 1 3 3 LYS HE3 H 1 2.995 0.03 . 1 . . . A 3 LYS HE3 . 19666 1
26 . 1 1 3 3 LYS C C 13 175.343 0.30 . 1 . . . A 3 LYS C . 19666 1
27 . 1 1 3 3 LYS CA C 13 54.848 0.30 . 1 . . . A 3 LYS CA . 19666 1
28 . 1 1 3 3 LYS CB C 13 34.392 0.30 . 1 . . . A 3 LYS CB . 19666 1
29 . 1 1 3 3 LYS CG C 13 24.055 0.30 . 1 . . . A 3 LYS CG . 19666 1
30 . 1 1 3 3 LYS CD C 13 29.210 0.30 . 1 . . . A 3 LYS CD . 19666 1
31 . 1 1 3 3 LYS CE C 13 42.113 0.30 . 1 . . . A 3 LYS CE . 19666 1
32 . 1 1 3 3 LYS N N 15 120.527 0.30 . 1 . . . A 3 LYS N . 19666 1
33 . 1 1 4 4 ASP H H 1 8.288 0.03 . 1 . . . A 4 ASP H . 19666 1
34 . 1 1 4 4 ASP HA H 1 4.377 0.03 . 1 . . . A 4 ASP HA . 19666 1
35 . 1 1 4 4 ASP HB2 H 1 2.548 0.03 . 1 . . . A 4 ASP HB2 . 19666 1
36 . 1 1 4 4 ASP HB3 H 1 2.548 0.03 . 1 . . . A 4 ASP HB3 . 19666 1
37 . 1 1 4 4 ASP C C 13 177.084 0.30 . 1 . . . A 4 ASP C . 19666 1
38 . 1 1 4 4 ASP CA C 13 55.908 0.30 . 1 . . . A 4 ASP CA . 19666 1
39 . 1 1 4 4 ASP CB C 13 41.206 0.30 . 1 . . . A 4 ASP CB . 19666 1
40 . 1 1 4 4 ASP N N 15 120.351 0.30 . 1 . . . A 4 ASP N . 19666 1
41 . 1 1 5 5 GLY H H 1 8.823 0.03 . 1 . . . A 5 GLY H . 19666 1
42 . 1 1 5 5 GLY HA2 H 1 4.249 0.03 . 2 . . . A 5 GLY HA2 . 19666 1
43 . 1 1 5 5 GLY HA3 H 1 3.644 0.03 . 2 . . . A 5 GLY HA3 . 19666 1
44 . 1 1 5 5 GLY C C 13 174.205 0.30 . 1 . . . A 5 GLY C . 19666 1
45 . 1 1 5 5 GLY CA C 13 45.496 0.30 . 1 . . . A 5 GLY CA . 19666 1
46 . 1 1 5 5 GLY N N 15 113.320 0.30 . 1 . . . A 5 GLY N . 19666 1
47 . 1 1 6 6 ASP H H 1 8.291 0.03 . 1 . . . A 6 ASP H . 19666 1
48 . 1 1 6 6 ASP HA H 1 4.641 0.03 . 1 . . . A 6 ASP HA . 19666 1
49 . 1 1 6 6 ASP HB2 H 1 2.810 0.03 . 2 . . . A 6 ASP HB2 . 19666 1
50 . 1 1 6 6 ASP HB3 H 1 2.657 0.03 . 2 . . . A 6 ASP HB3 . 19666 1
51 . 1 1 6 6 ASP C C 13 175.139 0.30 . 1 . . . A 6 ASP C . 19666 1
52 . 1 1 6 6 ASP CA C 13 55.022 0.30 . 1 . . . A 6 ASP CA . 19666 1
53 . 1 1 6 6 ASP CB C 13 41.095 0.30 . 1 . . . A 6 ASP CB . 19666 1
54 . 1 1 6 6 ASP N N 15 121.054 0.30 . 1 . . . A 6 ASP N . 19666 1
55 . 1 1 7 7 VAL H H 1 8.242 0.03 . 1 . . . A 7 VAL H . 19666 1
56 . 1 1 7 7 VAL HA H 1 5.505 0.03 . 1 . . . A 7 VAL HA . 19666 1
57 . 1 1 7 7 VAL HB H 1 2.113 0.03 . 1 . . . A 7 VAL HB . 19666 1
58 . 1 1 7 7 VAL HG11 H 1 0.943 0.03 . 1 . . . A 7 VAL HG11 . 19666 1
59 . 1 1 7 7 VAL HG12 H 1 0.943 0.03 . 1 . . . A 7 VAL HG12 . 19666 1
60 . 1 1 7 7 VAL HG13 H 1 0.943 0.03 . 1 . . . A 7 VAL HG13 . 19666 1
61 . 1 1 7 7 VAL HG21 H 1 0.886 0.03 . 1 . . . A 7 VAL HG21 . 19666 1
62 . 1 1 7 7 VAL HG22 H 1 0.886 0.03 . 1 . . . A 7 VAL HG22 . 19666 1
63 . 1 1 7 7 VAL HG23 H 1 0.886 0.03 . 1 . . . A 7 VAL HG23 . 19666 1
64 . 1 1 7 7 VAL C C 13 175.917 0.30 . 1 . . . A 7 VAL C . 19666 1
65 . 1 1 7 7 VAL CA C 13 59.486 0.30 . 1 . . . A 7 VAL CA . 19666 1
66 . 1 1 7 7 VAL CB C 13 37.503 0.30 . 1 . . . A 7 VAL CB . 19666 1
67 . 1 1 7 7 VAL CG1 C 13 22.387 0.30 . 1 . . . A 7 VAL CG1 . 19666 1
68 . 1 1 7 7 VAL CG2 C 13 17.855 0.30 . 1 . . . A 7 VAL CG2 . 19666 1
69 . 1 1 7 7 VAL N N 15 110.156 0.30 . 1 . . . A 7 VAL N . 19666 1
70 . 1 1 8 8 GLU H H 1 8.428 0.03 . 1 . . . A 8 GLU H . 19666 1
71 . 1 1 8 8 GLU HA H 1 4.708 0.03 . 1 . . . A 8 GLU HA . 19666 1
72 . 1 1 8 8 GLU HB2 H 1 1.820 0.03 . 2 . . . A 8 GLU HB2 . 19666 1
73 . 1 1 8 8 GLU HB3 H 1 1.537 0.03 . 2 . . . A 8 GLU HB3 . 19666 1
74 . 1 1 8 8 GLU HG2 H 1 1.932 0.03 . 1 . . . A 8 GLU HG2 . 19666 1
75 . 1 1 8 8 GLU HG3 H 1 1.932 0.03 . 1 . . . A 8 GLU HG3 . 19666 1
76 . 1 1 8 8 GLU C C 13 175.138 0.30 . 1 . . . A 8 GLU C . 19666 1
77 . 1 1 8 8 GLU CA C 13 55.018 0.30 . 1 . . . A 8 GLU CA . 19666 1
78 . 1 1 8 8 GLU CB C 13 32.660 0.30 . 1 . . . A 8 GLU CB . 19666 1
79 . 1 1 8 8 GLU CG C 13 35.205 0.30 . 1 . . . A 8 GLU CG . 19666 1
80 . 1 1 8 8 GLU N N 15 119.824 0.30 . 1 . . . A 8 GLU N . 19666 1
81 . 1 1 9 9 GLY H H 1 8.498 0.03 . 1 . . . A 9 GLY H . 19666 1
82 . 1 1 9 9 GLY HA2 H 1 4.051 0.03 . 1 . . . A 9 GLY HA2 . 19666 1
83 . 1 1 9 9 GLY HA3 H 1 4.051 0.03 . 1 . . . A 9 GLY HA3 . 19666 1
84 . 1 1 9 9 GLY CA C 13 44.687 0.30 . 1 . . . A 9 GLY CA . 19666 1
85 . 1 1 9 9 GLY N N 15 112.265 0.30 . 1 . . . A 9 GLY N . 19666 1
86 . 1 1 10 10 PRO HA H 1 4.453 0.03 . 1 . . . A 10 PRO HA . 19666 1
87 . 1 1 10 10 PRO HB2 H 1 2.289 0.03 . 2 . . . A 10 PRO HB2 . 19666 1
88 . 1 1 10 10 PRO HB3 H 1 1.894 0.03 . 2 . . . A 10 PRO HB3 . 19666 1
89 . 1 1 10 10 PRO HG2 H 1 2.020 0.03 . 2 . . . A 10 PRO HG2 . 19666 1
90 . 1 1 10 10 PRO HG3 H 1 1.931 0.03 . 2 . . . A 10 PRO HG3 . 19666 1
91 . 1 1 10 10 PRO HD2 H 1 3.654 0.03 . 1 . . . A 10 PRO HD2 . 19666 1
92 . 1 1 10 10 PRO HD3 H 1 3.654 0.03 . 1 . . . A 10 PRO HD3 . 19666 1
93 . 1 1 10 10 PRO C C 13 175.902 0.30 . 1 . . . A 10 PRO C . 19666 1
94 . 1 1 10 10 PRO CA C 13 62.256 0.30 . 1 . . . A 10 PRO CA . 19666 1
95 . 1 1 10 10 PRO CB C 13 32.312 0.30 . 1 . . . A 10 PRO CB . 19666 1
96 . 1 1 10 10 PRO CG C 13 27.345 0.30 . 1 . . . A 10 PRO CG . 19666 1
97 . 1 1 10 10 PRO CD C 13 49.584 0.30 . 1 . . . A 10 PRO CD . 19666 1
98 . 1 1 11 11 ALA H H 1 8.424 0.03 . 1 . . . A 11 ALA H . 19666 1
99 . 1 1 11 11 ALA HA H 1 4.161 0.03 . 1 . . . A 11 ALA HA . 19666 1
100 . 1 1 11 11 ALA HB1 H 1 1.366 0.03 . 1 . . . A 11 ALA HB1 . 19666 1
101 . 1 1 11 11 ALA HB2 H 1 1.366 0.03 . 1 . . . A 11 ALA HB2 . 19666 1
102 . 1 1 11 11 ALA HB3 H 1 1.366 0.03 . 1 . . . A 11 ALA HB3 . 19666 1
103 . 1 1 11 11 ALA C C 13 179.442 0.30 . 1 . . . A 11 ALA C . 19666 1
104 . 1 1 11 11 ALA CA C 13 53.666 0.30 . 1 . . . A 11 ALA CA . 19666 1
105 . 1 1 11 11 ALA CB C 13 17.902 0.30 . 1 . . . A 11 ALA CB . 19666 1
106 . 1 1 11 11 ALA N N 15 123.340 0.30 . 1 . . . A 11 ALA N . 19666 1
107 . 1 1 12 12 GLY H H 1 8.795 0.03 . 1 . . . A 12 GLY H . 19666 1
108 . 1 1 12 12 GLY HA2 H 1 4.168 0.03 . 2 . . . A 12 GLY HA2 . 19666 1
109 . 1 1 12 12 GLY HA3 H 1 3.691 0.03 . 2 . . . A 12 GLY HA3 . 19666 1
110 . 1 1 12 12 GLY C C 13 174.908 0.30 . 1 . . . A 12 GLY C . 19666 1
111 . 1 1 12 12 GLY CA C 13 45.155 0.30 . 1 . . . A 12 GLY CA . 19666 1
112 . 1 1 12 12 GLY N N 15 111.386 0.30 . 1 . . . A 12 GLY N . 19666 1
113 . 1 1 13 13 CYS H H 1 8.051 0.03 . 1 . . . A 13 CYS H . 19666 1
114 . 1 1 13 13 CYS HA H 1 4.575 0.03 . 1 . . . A 13 CYS HA . 19666 1
115 . 1 1 13 13 CYS HB2 H 1 3.162 0.03 . 2 . . . A 13 CYS HB2 . 19666 1
116 . 1 1 13 13 CYS HB3 H 1 3.135 0.03 . 2 . . . A 13 CYS HB3 . 19666 1
117 . 1 1 13 13 CYS C C 13 173.390 0.30 . 1 . . . A 13 CYS C . 19666 1
118 . 1 1 13 13 CYS CA C 13 55.412 0.30 . 1 . . . A 13 CYS CA . 19666 1
119 . 1 1 13 13 CYS CB C 13 40.858 0.30 . 1 . . . A 13 CYS CB . 19666 1
120 . 1 1 13 13 CYS N N 15 118.593 0.30 . 1 . . . A 13 CYS N . 19666 1
121 . 1 1 14 14 LYS H H 1 8.661 0.03 . 1 . . . A 14 LYS H . 19666 1
122 . 1 1 14 14 LYS HA H 1 4.413 0.03 . 1 . . . A 14 LYS HA . 19666 1
123 . 1 1 14 14 LYS HB2 H 1 1.715 0.03 . 2 . . . A 14 LYS HB2 . 19666 1
124 . 1 1 14 14 LYS HB3 H 1 1.595 0.03 . 2 . . . A 14 LYS HB3 . 19666 1
125 . 1 1 14 14 LYS HG2 H 1 1.629 0.03 . 2 . . . A 14 LYS HG2 . 19666 1
126 . 1 1 14 14 LYS HG3 H 1 1.332 0.03 . 2 . . . A 14 LYS HG3 . 19666 1
127 . 1 1 14 14 LYS HD2 H 1 1.819 0.03 . 2 . . . A 14 LYS HD2 . 19666 1
128 . 1 1 14 14 LYS HD3 H 1 1.571 0.03 . 2 . . . A 14 LYS HD3 . 19666 1
129 . 1 1 14 14 LYS HE2 H 1 2.974 0.03 . 2 . . . A 14 LYS HE2 . 19666 1
130 . 1 1 14 14 LYS HE3 H 1 2.924 0.03 . 2 . . . A 14 LYS HE3 . 19666 1
131 . 1 1 14 14 LYS C C 13 174.523 0.30 . 1 . . . A 14 LYS C . 19666 1
132 . 1 1 14 14 LYS CA C 13 56.695 0.30 . 1 . . . A 14 LYS CA . 19666 1
133 . 1 1 14 14 LYS CB C 13 34.840 0.30 . 1 . . . A 14 LYS CB . 19666 1
134 . 1 1 14 14 LYS CG C 13 26.406 0.30 . 1 . . . A 14 LYS CG . 19666 1
135 . 1 1 14 14 LYS CD C 13 28.750 0.30 . 1 . . . A 14 LYS CD . 19666 1
136 . 1 1 14 14 LYS CE C 13 42.812 0.30 . 1 . . . A 14 LYS CE . 19666 1
137 . 1 1 14 14 LYS N N 15 120.527 0.30 . 1 . . . A 14 LYS N . 19666 1
138 . 1 1 15 15 LYS H H 1 7.335 0.03 . 1 . . . A 15 LYS H . 19666 1
139 . 1 1 15 15 LYS HA H 1 4.045 0.03 . 1 . . . A 15 LYS HA . 19666 1
140 . 1 1 15 15 LYS HB2 H 1 2.136 0.03 . 2 . . . A 15 LYS HB2 . 19666 1
141 . 1 1 15 15 LYS HB3 H 1 1.555 0.03 . 2 . . . A 15 LYS HB3 . 19666 1
142 . 1 1 15 15 LYS HG2 H 1 1.615 0.03 . 2 . . . A 15 LYS HG2 . 19666 1
143 . 1 1 15 15 LYS HG3 H 1 1.143 0.03 . 2 . . . A 15 LYS HG3 . 19666 1
144 . 1 1 15 15 LYS HD2 H 1 1.686 0.03 . 2 . . . A 15 LYS HD2 . 19666 1
145 . 1 1 15 15 LYS HD3 H 1 1.596 0.03 . 2 . . . A 15 LYS HD3 . 19666 1
146 . 1 1 15 15 LYS HE2 H 1 2.952 0.03 . 1 . . . A 15 LYS HE2 . 19666 1
147 . 1 1 15 15 LYS HE3 H 1 2.952 0.03 . 1 . . . A 15 LYS HE3 . 19666 1
148 . 1 1 15 15 LYS C C 13 174.446 0.30 . 1 . . . A 15 LYS C . 19666 1
149 . 1 1 15 15 LYS CA C 13 55.806 0.30 . 1 . . . A 15 LYS CA . 19666 1
150 . 1 1 15 15 LYS CB C 13 34.975 0.30 . 1 . . . A 15 LYS CB . 19666 1
151 . 1 1 15 15 LYS CG C 13 26.930 0.30 . 1 . . . A 15 LYS CG . 19666 1
152 . 1 1 15 15 LYS CD C 13 29.724 0.30 . 1 . . . A 15 LYS CD . 19666 1
153 . 1 1 15 15 LYS CE C 13 42.349 0.30 . 1 . . . A 15 LYS CE . 19666 1
154 . 1 1 15 15 LYS N N 15 120.000 0.30 . 1 . . . A 15 LYS N . 19666 1
155 . 1 1 16 16 TYR H H 1 9.183 0.03 . 1 . . . A 16 TYR H . 19666 1
156 . 1 1 16 16 TYR HA H 1 3.609 0.03 . 1 . . . A 16 TYR HA . 19666 1
157 . 1 1 16 16 TYR HB2 H 1 2.748 0.03 . 2 . . . A 16 TYR HB2 . 19666 1
158 . 1 1 16 16 TYR HB3 H 1 2.602 0.03 . 2 . . . A 16 TYR HB3 . 19666 1
159 . 1 1 16 16 TYR HD1 H 1 6.809 0.03 . 1 . . . A 16 TYR HD1 . 19666 1
160 . 1 1 16 16 TYR HD2 H 1 6.809 0.03 . 1 . . . A 16 TYR HD2 . 19666 1
161 . 1 1 16 16 TYR HE1 H 1 7.121 0.03 . 1 . . . A 16 TYR HE1 . 19666 1
162 . 1 1 16 16 TYR HE2 H 1 7.121 0.03 . 1 . . . A 16 TYR HE2 . 19666 1
163 . 1 1 16 16 TYR C C 13 176.146 0.30 . 1 . . . A 16 TYR C . 19666 1
164 . 1 1 16 16 TYR CA C 13 59.985 0.30 . 1 . . . A 16 TYR CA . 19666 1
165 . 1 1 16 16 TYR CB C 13 39.182 0.30 . 1 . . . A 16 TYR CB . 19666 1
166 . 1 1 16 16 TYR CD1 C 13 133.203 0.30 . 1 . . . A 16 TYR CD1 . 19666 1
167 . 1 1 16 16 TYR CD2 C 13 133.203 0.30 . 1 . . . A 16 TYR CD2 . 19666 1
168 . 1 1 16 16 TYR CE1 C 13 118.160 0.30 . 1 . . . A 16 TYR CE1 . 19666 1
169 . 1 1 16 16 TYR CE2 C 13 118.160 0.30 . 1 . . . A 16 TYR CE2 . 19666 1
170 . 1 1 16 16 TYR N N 15 118.242 0.30 . 1 . . . A 16 TYR N . 19666 1
171 . 1 1 17 17 ASP H H 1 9.185 0.03 . 1 . . . A 17 ASP H . 19666 1
172 . 1 1 17 17 ASP HA H 1 4.089 0.03 . 1 . . . A 17 ASP HA . 19666 1
173 . 1 1 17 17 ASP HB2 H 1 2.911 0.03 . 2 . . . A 17 ASP HB2 . 19666 1
174 . 1 1 17 17 ASP HB3 H 1 2.510 0.03 . 2 . . . A 17 ASP HB3 . 19666 1
175 . 1 1 17 17 ASP C C 13 174.793 0.30 . 1 . . . A 17 ASP C . 19666 1
176 . 1 1 17 17 ASP CA C 13 55.382 0.30 . 1 . . . A 17 ASP CA . 19666 1
177 . 1 1 17 17 ASP CB C 13 39.934 0.30 . 1 . . . A 17 ASP CB . 19666 1
178 . 1 1 17 17 ASP N N 15 123.164 0.30 . 1 . . . A 17 ASP N . 19666 1
179 . 1 1 18 18 VAL H H 1 7.873 0.03 . 1 . . . A 18 VAL H . 19666 1
180 . 1 1 18 18 VAL HA H 1 3.969 0.03 . 1 . . . A 18 VAL HA . 19666 1
181 . 1 1 18 18 VAL HB H 1 2.278 0.03 . 1 . . . A 18 VAL HB . 19666 1
182 . 1 1 18 18 VAL HG11 H 1 0.825 0.03 . 2 . . . A 18 VAL HG11 . 19666 1
183 . 1 1 18 18 VAL HG12 H 1 0.825 0.03 . 2 . . . A 18 VAL HG12 . 19666 1
184 . 1 1 18 18 VAL HG13 H 1 0.825 0.03 . 2 . . . A 18 VAL HG13 . 19666 1
185 . 1 1 18 18 VAL HG21 H 1 1.157 0.03 . 2 . . . A 18 VAL HG21 . 19666 1
186 . 1 1 18 18 VAL HG22 H 1 1.157 0.03 . 2 . . . A 18 VAL HG22 . 19666 1
187 . 1 1 18 18 VAL HG23 H 1 1.157 0.03 . 2 . . . A 18 VAL HG23 . 19666 1
188 . 1 1 18 18 VAL C C 13 175.615 0.30 . 1 . . . A 18 VAL C . 19666 1
189 . 1 1 18 18 VAL CA C 13 62.527 0.30 . 1 . . . A 18 VAL CA . 19666 1
190 . 1 1 18 18 VAL CB C 13 31.705 0.30 . 1 . . . A 18 VAL CB . 19666 1
191 . 1 1 18 18 VAL CG1 C 13 22.655 0.30 . 1 . . . A 18 VAL CG1 . 19666 1
192 . 1 1 18 18 VAL CG2 C 13 21.259 0.30 . 1 . . . A 18 VAL CG2 . 19666 1
193 . 1 1 18 18 VAL N N 15 121.230 0.30 . 1 . . . A 18 VAL N . 19666 1
194 . 1 1 19 19 GLU H H 1 8.437 0.03 . 1 . . . A 19 GLU H . 19666 1
195 . 1 1 19 19 GLU HA H 1 4.851 0.03 . 1 . . . A 19 GLU HA . 19666 1
196 . 1 1 19 19 GLU HB2 H 1 2.030 0.03 . 2 . . . A 19 GLU HB2 . 19666 1
197 . 1 1 19 19 GLU HB3 H 1 1.989 0.03 . 2 . . . A 19 GLU HB3 . 19666 1
198 . 1 1 19 19 GLU HG2 H 1 2.480 0.03 . 2 . . . A 19 GLU HG2 . 19666 1
199 . 1 1 19 19 GLU HG3 H 1 2.298 0.03 . 2 . . . A 19 GLU HG3 . 19666 1
200 . 1 1 19 19 GLU C C 13 175.883 0.30 . 1 . . . A 19 GLU C . 19666 1
201 . 1 1 19 19 GLU CA C 13 57.427 0.30 . 1 . . . A 19 GLU CA . 19666 1
202 . 1 1 19 19 GLU CB C 13 29.543 0.30 . 1 . . . A 19 GLU CB . 19666 1
203 . 1 1 19 19 GLU CG C 13 36.243 0.30 . 1 . . . A 19 GLU CG . 19666 1
204 . 1 1 19 19 GLU N N 15 126.328 0.30 . 1 . . . A 19 GLU N . 19666 1
205 . 1 1 20 20 CYS H H 1 8.357 0.03 . 1 . . . A 20 CYS H . 19666 1
206 . 1 1 20 20 CYS HA H 1 4.920 0.03 . 1 . . . A 20 CYS HA . 19666 1
207 . 1 1 20 20 CYS HB2 H 1 3.303 0.03 . 2 . . . A 20 CYS HB2 . 19666 1
208 . 1 1 20 20 CYS HB3 H 1 2.938 0.03 . 2 . . . A 20 CYS HB3 . 19666 1
209 . 1 1 20 20 CYS C C 13 172.746 0.30 . 1 . . . A 20 CYS C . 19666 1
210 . 1 1 20 20 CYS CA C 13 53.849 0.30 . 1 . . . A 20 CYS CA . 19666 1
211 . 1 1 20 20 CYS CB C 13 45.604 0.30 . 1 . . . A 20 CYS CB . 19666 1
212 . 1 1 20 20 CYS N N 15 117.715 0.30 . 1 . . . A 20 CYS N . 19666 1
213 . 1 1 21 21 ASP H H 1 8.077 0.03 . 1 . . . A 21 ASP H . 19666 1
214 . 1 1 21 21 ASP HA H 1 4.780 0.03 . 1 . . . A 21 ASP HA . 19666 1
215 . 1 1 21 21 ASP HB2 H 1 2.926 0.03 . 2 . . . A 21 ASP HB2 . 19666 1
216 . 1 1 21 21 ASP HB3 H 1 2.685 0.03 . 2 . . . A 21 ASP HB3 . 19666 1
217 . 1 1 21 21 ASP C C 13 175.903 0.30 . 1 . . . A 21 ASP C . 19666 1
218 . 1 1 21 21 ASP CA C 13 53.839 0.30 . 1 . . . A 21 ASP CA . 19666 1
219 . 1 1 21 21 ASP N N 15 119.297 0.30 . 1 . . . A 21 ASP N . 19666 1
220 . 1 1 22 22 SER H H 1 8.477 0.03 . 1 . . . A 22 SER H . 19666 1
221 . 1 1 22 22 SER HA H 1 4.066 0.03 . 1 . . . A 22 SER HA . 19666 1
222 . 1 1 22 22 SER HB2 H 1 3.823 0.03 . 2 . . . A 22 SER HB2 . 19666 1
223 . 1 1 22 22 SER HB3 H 1 3.808 0.03 . 2 . . . A 22 SER HB3 . 19666 1
224 . 1 1 22 22 SER C C 13 175.610 0.30 . 1 . . . A 22 SER C . 19666 1
225 . 1 1 22 22 SER CA C 13 59.986 0.30 . 1 . . . A 22 SER CA . 19666 1
226 . 1 1 22 22 SER CB C 13 63.377 0.30 . 1 . . . A 22 SER CB . 19666 1
227 . 1 1 22 22 SER N N 15 113.751 0.30 . 1 . . . A 22 SER N . 19666 1
228 . 1 1 23 23 GLY H H 1 8.666 0.03 . 1 . . . A 23 GLY H . 19666 1
229 . 1 1 23 23 GLY HA2 H 1 4.188 0.03 . 2 . . . A 23 GLY HA2 . 19666 1
230 . 1 1 23 23 GLY HA3 H 1 3.897 0.03 . 2 . . . A 23 GLY HA3 . 19666 1
231 . 1 1 23 23 GLY C C 13 175.341 0.30 . 1 . . . A 23 GLY C . 19666 1
232 . 1 1 23 23 GLY CA C 13 45.625 0.30 . 1 . . . A 23 GLY CA . 19666 1
233 . 1 1 23 23 GLY N N 15 112.441 0.30 . 1 . . . A 23 GLY N . 19666 1
234 . 1 1 24 24 GLU H H 1 7.852 0.03 . 1 . . . A 24 GLU H . 19666 1
235 . 1 1 24 24 GLU HA H 1 4.320 0.03 . 1 . . . A 24 GLU HA . 19666 1
236 . 1 1 24 24 GLU HB2 H 1 2.180 0.03 . 1 . . . A 24 GLU HB2 . 19666 1
237 . 1 1 24 24 GLU HB3 H 1 2.180 0.03 . 1 . . . A 24 GLU HB3 . 19666 1
238 . 1 1 24 24 GLU HG2 H 1 2.262 0.03 . 2 . . . A 24 GLU HG2 . 19666 1
239 . 1 1 24 24 GLU HG3 H 1 2.203 0.03 . 2 . . . A 24 GLU HG3 . 19666 1
240 . 1 1 24 24 GLU CA C 13 56.875 0.30 . 1 . . . A 24 GLU CA . 19666 1
241 . 1 1 24 24 GLU CB C 13 32.969 0.30 . 1 . . . A 24 GLU CB . 19666 1
242 . 1 1 24 24 GLU CG C 13 36.719 0.30 . 1 . . . A 24 GLU CG . 19666 1
243 . 1 1 24 24 GLU N N 15 115.429 0.30 . 1 . . . A 24 GLU N . 19666 1
244 . 1 1 25 25 CYS HA H 1 4.880 0.03 . 1 . . . A 25 CYS HA . 19666 1
245 . 1 1 25 25 CYS HB2 H 1 2.923 0.03 . 2 . . . A 25 CYS HB2 . 19666 1
246 . 1 1 25 25 CYS HB3 H 1 2.865 0.03 . 2 . . . A 25 CYS HB3 . 19666 1
247 . 1 1 25 25 CYS C C 13 175.605 0.30 . 1 . . . A 25 CYS C . 19666 1
248 . 1 1 25 25 CYS CA C 13 56.417 0.30 . 1 . . . A 25 CYS CA . 19666 1
249 . 1 1 25 25 CYS CB C 13 40.007 0.30 . 1 . . . A 25 CYS CB . 19666 1
250 . 1 1 26 26 CYS H H 1 9.987 0.03 . 1 . . . A 26 CYS H . 19666 1
251 . 1 1 26 26 CYS HA H 1 4.569 0.03 . 1 . . . A 26 CYS HA . 19666 1
252 . 1 1 26 26 CYS HB2 H 1 3.473 0.03 . 2 . . . A 26 CYS HB2 . 19666 1
253 . 1 1 26 26 CYS HB3 H 1 2.275 0.03 . 2 . . . A 26 CYS HB3 . 19666 1
254 . 1 1 26 26 CYS C C 13 172.335 0.30 . 1 . . . A 26 CYS C . 19666 1
255 . 1 1 26 26 CYS CA C 13 55.441 0.30 . 1 . . . A 26 CYS CA . 19666 1
256 . 1 1 26 26 CYS CB C 13 38.977 0.30 . 1 . . . A 26 CYS CB . 19666 1
257 . 1 1 26 26 CYS N N 15 122.988 0.30 . 1 . . . A 26 CYS N . 19666 1
258 . 1 1 27 27 GLN H H 1 8.129 0.03 . 1 . . . A 27 GLN H . 19666 1
259 . 1 1 27 27 GLN HA H 1 4.156 0.03 . 1 . . . A 27 GLN HA . 19666 1
260 . 1 1 27 27 GLN HB2 H 1 2.106 0.03 . 2 . . . A 27 GLN HB2 . 19666 1
261 . 1 1 27 27 GLN HB3 H 1 2.056 0.03 . 2 . . . A 27 GLN HB3 . 19666 1
262 . 1 1 27 27 GLN HG2 H 1 2.546 0.03 . 1 . . . A 27 GLN HG2 . 19666 1
263 . 1 1 27 27 GLN HG3 H 1 2.546 0.03 . 1 . . . A 27 GLN HG3 . 19666 1
264 . 1 1 27 27 GLN HE21 H 1 7.753 0.03 . 2 . . . A 27 GLN HE21 . 19666 1
265 . 1 1 27 27 GLN HE22 H 1 6.836 0.03 . 2 . . . A 27 GLN HE22 . 19666 1
266 . 1 1 27 27 GLN C C 13 178.958 0.30 . 1 . . . A 27 GLN C . 19666 1
267 . 1 1 27 27 GLN CA C 13 59.397 0.30 . 1 . . . A 27 GLN CA . 19666 1
268 . 1 1 27 27 GLN CB C 13 29.134 0.30 . 1 . . . A 27 GLN CB . 19666 1
269 . 1 1 27 27 GLN CG C 13 34.519 0.30 . 1 . . . A 27 GLN CG . 19666 1
270 . 1 1 27 27 GLN N N 15 119.472 0.30 . 1 . . . A 27 GLN N . 19666 1
271 . 1 1 27 27 GLN NE2 N 15 112.265 0.30 . 1 . . . A 27 GLN NE2 . 19666 1
272 . 1 1 28 28 LYS H H 1 7.945 0.03 . 1 . . . A 28 LYS H . 19666 1
273 . 1 1 28 28 LYS HA H 1 5.398 0.03 . 1 . . . A 28 LYS HA . 19666 1
274 . 1 1 28 28 LYS HB2 H 1 1.916 0.03 . 2 . . . A 28 LYS HB2 . 19666 1
275 . 1 1 28 28 LYS HB3 H 1 1.596 0.03 . 2 . . . A 28 LYS HB3 . 19666 1
276 . 1 1 28 28 LYS HG2 H 1 1.327 0.03 . 1 . . . A 28 LYS HG2 . 19666 1
277 . 1 1 28 28 LYS HG3 H 1 1.327 0.03 . 1 . . . A 28 LYS HG3 . 19666 1
278 . 1 1 28 28 LYS HD2 H 1 1.340 0.03 . 2 . . . A 28 LYS HD2 . 19666 1
279 . 1 1 28 28 LYS HD3 H 1 1.421 0.03 . 2 . . . A 28 LYS HD3 . 19666 1
280 . 1 1 28 28 LYS HE2 H 1 2.779 0.03 . 2 . . . A 28 LYS HE2 . 19666 1
281 . 1 1 28 28 LYS HE3 H 1 2.630 0.03 . 2 . . . A 28 LYS HE3 . 19666 1
282 . 1 1 28 28 LYS C C 13 174.506 0.30 . 1 . . . A 28 LYS C . 19666 1
283 . 1 1 28 28 LYS CA C 13 54.717 0.30 . 1 . . . A 28 LYS CA . 19666 1
284 . 1 1 28 28 LYS CB C 13 40.222 0.30 . 1 . . . A 28 LYS CB . 19666 1
285 . 1 1 28 28 LYS CG C 13 25.475 0.30 . 1 . . . A 28 LYS CG . 19666 1
286 . 1 1 28 28 LYS CD C 13 30.169 0.30 . 1 . . . A 28 LYS CD . 19666 1
287 . 1 1 28 28 LYS CE C 13 41.872 0.30 . 1 . . . A 28 LYS CE . 19666 1
288 . 1 1 28 28 LYS N N 15 111.211 0.30 . 1 . . . A 28 LYS N . 19666 1
289 . 1 1 29 29 GLN H H 1 9.096 0.03 . 1 . . . A 29 GLN H . 19666 1
290 . 1 1 29 29 GLN HA H 1 5.273 0.03 . 1 . . . A 29 GLN HA . 19666 1
291 . 1 1 29 29 GLN HB2 H 1 2.198 0.03 . 2 . . . A 29 GLN HB2 . 19666 1
292 . 1 1 29 29 GLN HB3 H 1 1.429 0.03 . 2 . . . A 29 GLN HB3 . 19666 1
293 . 1 1 29 29 GLN HG2 H 1 2.437 0.03 . 2 . . . A 29 GLN HG2 . 19666 1
294 . 1 1 29 29 GLN HG3 H 1 1.820 0.03 . 2 . . . A 29 GLN HG3 . 19666 1
295 . 1 1 29 29 GLN HE21 H 1 7.334 0.03 . 2 . . . A 29 GLN HE21 . 19666 1
296 . 1 1 29 29 GLN HE22 H 1 6.970 0.03 . 2 . . . A 29 GLN HE22 . 19666 1
297 . 1 1 29 29 GLN C C 13 173.392 0.30 . 1 . . . A 29 GLN C . 19666 1
298 . 1 1 29 29 GLN CA C 13 54.499 0.30 . 1 . . . A 29 GLN CA . 19666 1
299 . 1 1 29 29 GLN CB C 13 32.993 0.30 . 1 . . . A 29 GLN CB . 19666 1
300 . 1 1 29 29 GLN CG C 13 32.969 0.30 . 1 . . . A 29 GLN CG . 19666 1
301 . 1 1 29 29 GLN N N 15 120.527 0.30 . 1 . . . A 29 GLN N . 19666 1
302 . 1 1 29 29 GLN NE2 N 15 107.578 0.30 . 1 . . . A 29 GLN NE2 . 19666 1
303 . 1 1 30 30 TYR H H 1 8.378 0.03 . 1 . . . A 30 TYR H . 19666 1
304 . 1 1 30 30 TYR HA H 1 3.824 0.03 . 1 . . . A 30 TYR HA . 19666 1
305 . 1 1 30 30 TYR HB2 H 1 2.350 0.03 . 2 . . . A 30 TYR HB2 . 19666 1
306 . 1 1 30 30 TYR HB3 H 1 0.279 0.03 . 2 . . . A 30 TYR HB3 . 19666 1
307 . 1 1 30 30 TYR HD1 H 1 5.519 0.03 . 1 . . . A 30 TYR HD1 . 19666 1
308 . 1 1 30 30 TYR HD2 H 1 5.519 0.03 . 1 . . . A 30 TYR HD2 . 19666 1
309 . 1 1 30 30 TYR HE1 H 1 6.301 0.03 . 1 . . . A 30 TYR HE1 . 19666 1
310 . 1 1 30 30 TYR HE2 H 1 6.301 0.03 . 1 . . . A 30 TYR HE2 . 19666 1
311 . 1 1 30 30 TYR C C 13 173.213 0.30 . 1 . . . A 30 TYR C . 19666 1
312 . 1 1 30 30 TYR CA C 13 58.018 0.30 . 1 . . . A 30 TYR CA . 19666 1
313 . 1 1 30 30 TYR CB C 13 35.574 0.30 . 1 . . . A 30 TYR CB . 19666 1
314 . 1 1 30 30 TYR CD1 C 13 132.383 0.30 . 1 . . . A 30 TYR CD1 . 19666 1
315 . 1 1 30 30 TYR CD2 C 13 132.383 0.30 . 1 . . . A 30 TYR CD2 . 19666 1
316 . 1 1 30 30 TYR CE1 C 13 116.797 0.30 . 1 . . . A 30 TYR CE1 . 19666 1
317 . 1 1 30 30 TYR CE2 C 13 116.797 0.30 . 1 . . . A 30 TYR CE2 . 19666 1
318 . 1 1 30 30 TYR N N 15 130.371 0.30 . 1 . . . A 30 TYR N . 19666 1
319 . 1 1 31 31 LEU H H 1 8.015 0.03 . 1 . . . A 31 LEU H . 19666 1
320 . 1 1 31 31 LEU HA H 1 3.855 0.03 . 1 . . . A 31 LEU HA . 19666 1
321 . 1 1 31 31 LEU HB2 H 1 0.545 0.03 . 2 . . . A 31 LEU HB2 . 19666 1
322 . 1 1 31 31 LEU HB3 H 1 0.142 0.03 . 2 . . . A 31 LEU HB3 . 19666 1
323 . 1 1 31 31 LEU HG H 1 0.234 0.03 . 1 . . . A 31 LEU HG . 19666 1
324 . 1 1 31 31 LEU HD11 H 1 -0.049 0.03 . 1 . . . A 31 LEU HD11 . 19666 1
325 . 1 1 31 31 LEU HD12 H 1 -0.049 0.03 . 1 . . . A 31 LEU HD12 . 19666 1
326 . 1 1 31 31 LEU HD13 H 1 -0.049 0.03 . 1 . . . A 31 LEU HD13 . 19666 1
327 . 1 1 31 31 LEU HD21 H 1 -0.285 0.03 . 1 . . . A 31 LEU HD21 . 19666 1
328 . 1 1 31 31 LEU HD22 H 1 -0.285 0.03 . 1 . . . A 31 LEU HD22 . 19666 1
329 . 1 1 31 31 LEU HD23 H 1 -0.285 0.03 . 1 . . . A 31 LEU HD23 . 19666 1
330 . 1 1 31 31 LEU C C 13 174.716 0.30 . 1 . . . A 31 LEU C . 19666 1
331 . 1 1 31 31 LEU CA C 13 52.890 0.30 . 1 . . . A 31 LEU CA . 19666 1
332 . 1 1 31 31 LEU CB C 13 46.322 0.30 . 1 . . . A 31 LEU CB . 19666 1
333 . 1 1 31 31 LEU CG C 13 25.938 0.30 . 1 . . . A 31 LEU CG . 19666 1
334 . 1 1 31 31 LEU CD1 C 13 24.531 0.30 . 1 . . . A 31 LEU CD1 . 19666 1
335 . 1 1 31 31 LEU CD2 C 13 23.594 0.30 . 1 . . . A 31 LEU CD2 . 19666 1
336 . 1 1 31 31 LEU N N 15 132.129 0.30 . 1 . . . A 31 LEU N . 19666 1
337 . 1 1 32 32 TRP H H 1 8.835 0.03 . 1 . . . A 32 TRP H . 19666 1
338 . 1 1 32 32 TRP HA H 1 3.674 0.03 . 1 . . . A 32 TRP HA . 19666 1
339 . 1 1 32 32 TRP HB2 H 1 3.239 0.03 . 2 . . . A 32 TRP HB2 . 19666 1
340 . 1 1 32 32 TRP HB3 H 1 2.922 0.03 . 2 . . . A 32 TRP HB3 . 19666 1
341 . 1 1 32 32 TRP HD1 H 1 6.982 0.03 . 1 . . . A 32 TRP HD1 . 19666 1
342 . 1 1 32 32 TRP HE1 H 1 9.916 0.03 . 1 . . . A 32 TRP HE1 . 19666 1
343 . 1 1 32 32 TRP HE3 H 1 7.007 0.03 . 1 . . . A 32 TRP HE3 . 19666 1
344 . 1 1 32 32 TRP HZ2 H 1 7.124 0.03 . 1 . . . A 32 TRP HZ2 . 19666 1
345 . 1 1 32 32 TRP HZ3 H 1 6.764 0.03 . 1 . . . A 32 TRP HZ3 . 19666 1
346 . 1 1 32 32 TRP HH2 H 1 6.870 0.03 . 1 . . . A 32 TRP HH2 . 19666 1
347 . 1 1 32 32 TRP C C 13 176.444 0.30 . 1 . . . A 32 TRP C . 19666 1
348 . 1 1 32 32 TRP CA C 13 57.808 0.30 . 1 . . . A 32 TRP CA . 19666 1
349 . 1 1 32 32 TRP CB C 13 24.551 0.30 . 1 . . . A 32 TRP CB . 19666 1
350 . 1 1 32 32 TRP CD1 C 13 125.963 0.30 . 1 . . . A 32 TRP CD1 . 19666 1
351 . 1 1 32 32 TRP CE3 C 13 120.004 0.30 . 1 . . . A 32 TRP CE3 . 19666 1
352 . 1 1 32 32 TRP CZ2 C 13 114.077 0.30 . 1 . . . A 32 TRP CZ2 . 19666 1
353 . 1 1 32 32 TRP CZ3 C 13 121.607 0.30 . 1 . . . A 32 TRP CZ3 . 19666 1
354 . 1 1 32 32 TRP CH2 C 13 118.252 0.30 . 1 . . . A 32 TRP CH2 . 19666 1
355 . 1 1 32 32 TRP N N 15 126.855 0.30 . 1 . . . A 32 TRP N . 19666 1
356 . 1 1 32 32 TRP NE1 N 15 129.375 0.30 . 1 . . . A 32 TRP NE1 . 19666 1
357 . 1 1 33 33 TYR H H 1 8.021 0.03 . 1 . . . A 33 TYR H . 19666 1
358 . 1 1 33 33 TYR HA H 1 3.441 0.03 . 1 . . . A 33 TYR HA . 19666 1
359 . 1 1 33 33 TYR HB2 H 1 3.259 0.03 . 2 . . . A 33 TYR HB2 . 19666 1
360 . 1 1 33 33 TYR HB3 H 1 3.115 0.03 . 2 . . . A 33 TYR HB3 . 19666 1
361 . 1 1 33 33 TYR HD1 H 1 7.029 0.03 . 1 . . . A 33 TYR HD1 . 19666 1
362 . 1 1 33 33 TYR HD2 H 1 7.029 0.03 . 1 . . . A 33 TYR HD2 . 19666 1
363 . 1 1 33 33 TYR HE1 H 1 6.812 0.03 . 1 . . . A 33 TYR HE1 . 19666 1
364 . 1 1 33 33 TYR HE2 H 1 6.812 0.03 . 1 . . . A 33 TYR HE2 . 19666 1
365 . 1 1 33 33 TYR C C 13 173.802 0.30 . 1 . . . A 33 TYR C . 19666 1
366 . 1 1 33 33 TYR CA C 13 59.804 0.30 . 1 . . . A 33 TYR CA . 19666 1
367 . 1 1 33 33 TYR CB C 13 35.213 0.30 . 1 . . . A 33 TYR CB . 19666 1
368 . 1 1 33 33 TYR CD1 C 13 133.223 0.30 . 1 . . . A 33 TYR CD1 . 19666 1
369 . 1 1 33 33 TYR CD2 C 13 133.223 0.30 . 1 . . . A 33 TYR CD2 . 19666 1
370 . 1 1 33 33 TYR CE1 C 13 117.891 0.30 . 1 . . . A 33 TYR CE1 . 19666 1
371 . 1 1 33 33 TYR CE2 C 13 117.891 0.30 . 1 . . . A 33 TYR CE2 . 19666 1
372 . 1 1 33 33 TYR N N 15 109.453 0.30 . 1 . . . A 33 TYR N . 19666 1
373 . 1 1 34 34 LYS H H 1 6.799 0.03 . 1 . . . A 34 LYS H . 19666 1
374 . 1 1 34 34 LYS HA H 1 4.415 0.03 . 1 . . . A 34 LYS HA . 19666 1
375 . 1 1 34 34 LYS HB2 H 1 1.705 0.03 . 2 . . . A 34 LYS HB2 . 19666 1
376 . 1 1 34 34 LYS HB3 H 1 1.563 0.03 . 2 . . . A 34 LYS HB3 . 19666 1
377 . 1 1 34 34 LYS HG2 H 1 1.428 0.03 . 1 . . . A 34 LYS HG2 . 19666 1
378 . 1 1 34 34 LYS HG3 H 1 1.428 0.03 . 1 . . . A 34 LYS HG3 . 19666 1
379 . 1 1 34 34 LYS HD2 H 1 1.689 0.03 . 1 . . . A 34 LYS HD2 . 19666 1
380 . 1 1 34 34 LYS HD3 H 1 1.689 0.03 . 1 . . . A 34 LYS HD3 . 19666 1
381 . 1 1 34 34 LYS HE2 H 1 3.072 0.03 . 1 . . . A 34 LYS HE2 . 19666 1
382 . 1 1 34 34 LYS HE3 H 1 3.072 0.03 . 1 . . . A 34 LYS HE3 . 19666 1
383 . 1 1 34 34 LYS C C 13 174.545 0.30 . 1 . . . A 34 LYS C . 19666 1
384 . 1 1 34 34 LYS CA C 13 55.268 0.30 . 1 . . . A 34 LYS CA . 19666 1
385 . 1 1 34 34 LYS CB C 13 37.142 0.30 . 1 . . . A 34 LYS CB . 19666 1
386 . 1 1 34 34 LYS CG C 13 25.000 0.30 . 1 . . . A 34 LYS CG . 19666 1
387 . 1 1 34 34 LYS CD C 13 29.681 0.30 . 1 . . . A 34 LYS CD . 19666 1
388 . 1 1 34 34 LYS CE C 13 42.274 0.30 . 1 . . . A 34 LYS CE . 19666 1
389 . 1 1 34 34 LYS N N 15 116.660 0.30 . 1 . . . A 34 LYS N . 19666 1
390 . 1 1 35 35 TRP H H 1 8.786 0.03 . 1 . . . A 35 TRP H . 19666 1
391 . 1 1 35 35 TRP HA H 1 4.565 0.03 . 1 . . . A 35 TRP HA . 19666 1
392 . 1 1 35 35 TRP HB2 H 1 3.210 0.03 . 2 . . . A 35 TRP HB2 . 19666 1
393 . 1 1 35 35 TRP HB3 H 1 2.882 0.03 . 2 . . . A 35 TRP HB3 . 19666 1
394 . 1 1 35 35 TRP HD1 H 1 7.472 0.03 . 1 . . . A 35 TRP HD1 . 19666 1
395 . 1 1 35 35 TRP HE1 H 1 10.121 0.03 . 1 . . . A 35 TRP HE1 . 19666 1
396 . 1 1 35 35 TRP HE3 H 1 7.047 0.03 . 1 . . . A 35 TRP HE3 . 19666 1
397 . 1 1 35 35 TRP HZ2 H 1 7.425 0.03 . 1 . . . A 35 TRP HZ2 . 19666 1
398 . 1 1 35 35 TRP HZ3 H 1 6.660 0.03 . 1 . . . A 35 TRP HZ3 . 19666 1
399 . 1 1 35 35 TRP HH2 H 1 6.915 0.03 . 1 . . . A 35 TRP HH2 . 19666 1
400 . 1 1 35 35 TRP C C 13 176.720 0.30 . 1 . . . A 35 TRP C . 19666 1
401 . 1 1 35 35 TRP CA C 13 58.264 0.30 . 1 . . . A 35 TRP CA . 19666 1
402 . 1 1 35 35 TRP CB C 13 29.346 0.30 . 1 . . . A 35 TRP CB . 19666 1
403 . 1 1 35 35 TRP CD1 C 13 127.315 0.30 . 1 . . . A 35 TRP CD1 . 19666 1
404 . 1 1 35 35 TRP CE3 C 13 118.711 0.30 . 1 . . . A 35 TRP CE3 . 19666 1
405 . 1 1 35 35 TRP CZ2 C 13 115.430 0.30 . 1 . . . A 35 TRP CZ2 . 19666 1
406 . 1 1 35 35 TRP CZ3 C 13 121.967 0.30 . 1 . . . A 35 TRP CZ3 . 19666 1
407 . 1 1 35 35 TRP CH2 C 13 124.561 0.30 . 1 . . . A 35 TRP CH2 . 19666 1
408 . 1 1 35 35 TRP N N 15 122.637 0.30 . 1 . . . A 35 TRP N . 19666 1
409 . 1 1 35 35 TRP NE1 N 15 130.078 0.30 . 1 . . . A 35 TRP NE1 . 19666 1
410 . 1 1 36 36 ARG H H 1 9.128 0.03 . 1 . . . A 36 ARG H . 19666 1
411 . 1 1 36 36 ARG HA H 1 5.133 0.03 . 1 . . . A 36 ARG HA . 19666 1
412 . 1 1 36 36 ARG HB2 H 1 1.963 0.03 . 2 . . . A 36 ARG HB2 . 19666 1
413 . 1 1 36 36 ARG HB3 H 1 1.637 0.03 . 2 . . . A 36 ARG HB3 . 19666 1
414 . 1 1 36 36 ARG HG2 H 1 1.750 0.03 . 2 . . . A 36 ARG HG2 . 19666 1
415 . 1 1 36 36 ARG HG3 H 1 1.617 0.03 . 2 . . . A 36 ARG HG3 . 19666 1
416 . 1 1 36 36 ARG HD2 H 1 3.562 0.03 . 2 . . . A 36 ARG HD2 . 19666 1
417 . 1 1 36 36 ARG HD3 H 1 2.793 0.03 . 2 . . . A 36 ARG HD3 . 19666 1
418 . 1 1 36 36 ARG HE H 1 7.398 0.03 . 1 . . . A 36 ARG HE . 19666 1
419 . 1 1 36 36 ARG CA C 13 53.125 0.30 . 1 . . . A 36 ARG CA . 19666 1
420 . 1 1 36 36 ARG CB C 13 31.094 0.30 . 1 . . . A 36 ARG CB . 19666 1
421 . 1 1 36 36 ARG CG C 13 28.750 0.30 . 1 . . . A 36 ARG CG . 19666 1
422 . 1 1 36 36 ARG CD C 13 43.281 0.30 . 1 . . . A 36 ARG CD . 19666 1
423 . 1 1 36 36 ARG N N 15 125.976 0.30 . 1 . . . A 36 ARG N . 19666 1
424 . 1 1 36 36 ARG NE N 15 88.186 0.30 . 1 . . . A 36 ARG NE . 19666 1
425 . 1 1 37 37 PRO HA H 1 5.364 0.03 . 1 . . . A 37 PRO HA . 19666 1
426 . 1 1 37 37 PRO HB2 H 1 2.380 0.03 . 2 . . . A 37 PRO HB2 . 19666 1
427 . 1 1 37 37 PRO HB3 H 1 1.979 0.03 . 2 . . . A 37 PRO HB3 . 19666 1
428 . 1 1 37 37 PRO HG2 H 1 2.335 0.03 . 2 . . . A 37 PRO HG2 . 19666 1
429 . 1 1 37 37 PRO HG3 H 1 1.986 0.03 . 2 . . . A 37 PRO HG3 . 19666 1
430 . 1 1 37 37 PRO HD2 H 1 4.022 0.03 . 2 . . . A 37 PRO HD2 . 19666 1
431 . 1 1 37 37 PRO HD3 H 1 3.922 0.03 . 2 . . . A 37 PRO HD3 . 19666 1
432 . 1 1 37 37 PRO C C 13 175.961 0.30 . 1 . . . A 37 PRO C . 19666 1
433 . 1 1 37 37 PRO CA C 13 62.020 0.30 . 1 . . . A 37 PRO CA . 19666 1
434 . 1 1 37 37 PRO CB C 13 32.149 0.30 . 1 . . . A 37 PRO CB . 19666 1
435 . 1 1 37 37 PRO CG C 13 27.813 0.30 . 1 . . . A 37 PRO CG . 19666 1
436 . 1 1 37 37 PRO CD C 13 51.250 0.30 . 1 . . . A 37 PRO CD . 19666 1
437 . 1 1 38 38 LEU H H 1 7.047 0.03 . 1 . . . A 38 LEU H . 19666 1
438 . 1 1 38 38 LEU HA H 1 5.613 0.03 . 1 . . . A 38 LEU HA . 19666 1
439 . 1 1 38 38 LEU HB2 H 1 2.423 0.03 . 2 . . . A 38 LEU HB2 . 19666 1
440 . 1 1 38 38 LEU HB3 H 1 1.010 0.03 . 2 . . . A 38 LEU HB3 . 19666 1
441 . 1 1 38 38 LEU HG H 1 1.514 0.03 . 1 . . . A 38 LEU HG . 19666 1
442 . 1 1 38 38 LEU HD11 H 1 0.941 0.03 . 1 . . . A 38 LEU HD11 . 19666 1
443 . 1 1 38 38 LEU HD12 H 1 0.941 0.03 . 1 . . . A 38 LEU HD12 . 19666 1
444 . 1 1 38 38 LEU HD13 H 1 0.941 0.03 . 1 . . . A 38 LEU HD13 . 19666 1
445 . 1 1 38 38 LEU HD21 H 1 0.714 0.03 . 1 . . . A 38 LEU HD21 . 19666 1
446 . 1 1 38 38 LEU HD22 H 1 0.714 0.03 . 1 . . . A 38 LEU HD22 . 19666 1
447 . 1 1 38 38 LEU HD23 H 1 0.714 0.03 . 1 . . . A 38 LEU HD23 . 19666 1
448 . 1 1 38 38 LEU C C 13 177.828 0.30 . 1 . . . A 38 LEU C . 19666 1
449 . 1 1 38 38 LEU CA C 13 52.488 0.30 . 1 . . . A 38 LEU CA . 19666 1
450 . 1 1 38 38 LEU CB C 13 45.969 0.30 . 1 . . . A 38 LEU CB . 19666 1
451 . 1 1 38 38 LEU CG C 13 27.344 0.30 . 1 . . . A 38 LEU CG . 19666 1
452 . 1 1 38 38 LEU CD1 C 13 26.406 0.30 . 1 . . . A 38 LEU CD1 . 19666 1
453 . 1 1 38 38 LEU CD2 C 13 23.125 0.30 . 1 . . . A 38 LEU CD2 . 19666 1
454 . 1 1 38 38 LEU N N 15 116.660 0.30 . 1 . . . A 38 LEU N . 19666 1
455 . 1 1 39 39 ASP H H 1 9.136 0.03 . 1 . . . A 39 ASP H . 19666 1
456 . 1 1 39 39 ASP HA H 1 4.665 0.03 . 1 . . . A 39 ASP HA . 19666 1
457 . 1 1 39 39 ASP HB2 H 1 2.740 0.03 . 2 . . . A 39 ASP HB2 . 19666 1
458 . 1 1 39 39 ASP HB3 H 1 2.388 0.03 . 2 . . . A 39 ASP HB3 . 19666 1
459 . 1 1 39 39 ASP C C 13 173.855 0.30 . 1 . . . A 39 ASP C . 19666 1
460 . 1 1 39 39 ASP CA C 13 53.115 0.30 . 1 . . . A 39 ASP CA . 19666 1
461 . 1 1 39 39 ASP CB C 13 44.870 0.30 . 1 . . . A 39 ASP CB . 19666 1
462 . 1 1 39 39 ASP N N 15 117.187 0.30 . 1 . . . A 39 ASP N . 19666 1
463 . 1 1 40 40 CYS H H 1 8.704 0.03 . 1 . . . A 40 CYS H . 19666 1
464 . 1 1 40 40 CYS HA H 1 4.645 0.03 . 1 . . . A 40 CYS HA . 19666 1
465 . 1 1 40 40 CYS HB2 H 1 3.010 0.03 . 2 . . . A 40 CYS HB2 . 19666 1
466 . 1 1 40 40 CYS HB3 H 1 2.877 0.03 . 2 . . . A 40 CYS HB3 . 19666 1
467 . 1 1 40 40 CYS C C 13 173.638 0.30 . 1 . . . A 40 CYS C . 19666 1
468 . 1 1 40 40 CYS CA C 13 56.149 0.30 . 1 . . . A 40 CYS CA . 19666 1
469 . 1 1 40 40 CYS CB C 13 38.887 0.30 . 1 . . . A 40 CYS CB . 19666 1
470 . 1 1 40 40 CYS N N 15 122.812 0.30 . 1 . . . A 40 CYS N . 19666 1
471 . 1 1 41 41 ARG H H 1 8.742 0.03 . 1 . . . A 41 ARG H . 19666 1
472 . 1 1 41 41 ARG HA H 1 4.686 0.03 . 1 . . . A 41 ARG HA . 19666 1
473 . 1 1 41 41 ARG HB2 H 1 1.826 0.03 . 2 . . . A 41 ARG HB2 . 19666 1
474 . 1 1 41 41 ARG HB3 H 1 1.731 0.03 . 2 . . . A 41 ARG HB3 . 19666 1
475 . 1 1 41 41 ARG HG2 H 1 1.639 0.03 . 2 . . . A 41 ARG HG2 . 19666 1
476 . 1 1 41 41 ARG HG3 H 1 1.444 0.03 . 2 . . . A 41 ARG HG3 . 19666 1
477 . 1 1 41 41 ARG HD2 H 1 3.211 0.03 . 2 . . . A 41 ARG HD2 . 19666 1
478 . 1 1 41 41 ARG HD3 H 1 3.139 0.03 . 2 . . . A 41 ARG HD3 . 19666 1
479 . 1 1 41 41 ARG HE H 1 7.519 0.03 . 1 . . . A 41 ARG HE . 19666 1
480 . 1 1 41 41 ARG C C 13 175.082 0.30 . 1 . . . A 41 ARG C . 19666 1
481 . 1 1 41 41 ARG CA C 13 54.050 0.30 . 1 . . . A 41 ARG CA . 19666 1
482 . 1 1 41 41 ARG CB C 13 32.462 0.30 . 1 . . . A 41 ARG CB . 19666 1
483 . 1 1 41 41 ARG CG C 13 26.410 0.30 . 1 . . . A 41 ARG CG . 19666 1
484 . 1 1 41 41 ARG CD C 13 42.809 0.30 . 1 . . . A 41 ARG CD . 19666 1
485 . 1 1 41 41 ARG N N 15 131.953 0.30 . 1 . . . A 41 ARG N . 19666 1
486 . 1 1 41 41 ARG NE N 15 84.436 0.30 . 1 . . . A 41 ARG NE . 19666 1
487 . 1 1 42 42 CYS H H 1 8.945 0.03 . 1 . . . A 42 CYS H . 19666 1
488 . 1 1 42 42 CYS HA H 1 5.216 0.03 . 1 . . . A 42 CYS HA . 19666 1
489 . 1 1 42 42 CYS HB2 H 1 2.918 0.03 . 2 . . . A 42 CYS HB2 . 19666 1
490 . 1 1 42 42 CYS HB3 H 1 2.833 0.03 . 2 . . . A 42 CYS HB3 . 19666 1
491 . 1 1 42 42 CYS C C 13 174.439 0.30 . 1 . . . A 42 CYS C . 19666 1
492 . 1 1 42 42 CYS CA C 13 55.531 0.30 . 1 . . . A 42 CYS CA . 19666 1
493 . 1 1 42 42 CYS CB C 13 44.384 0.30 . 1 . . . A 42 CYS CB . 19666 1
494 . 1 1 42 42 CYS N N 15 123.340 0.30 . 1 . . . A 42 CYS N . 19666 1
495 . 1 1 43 43 LEU H H 1 8.722 0.03 . 1 . . . A 43 LEU H . 19666 1
496 . 1 1 43 43 LEU HA H 1 4.544 0.03 . 1 . . . A 43 LEU HA . 19666 1
497 . 1 1 43 43 LEU HB2 H 1 1.755 0.03 . 2 . . . A 43 LEU HB2 . 19666 1
498 . 1 1 43 43 LEU HB3 H 1 1.591 0.03 . 2 . . . A 43 LEU HB3 . 19666 1
499 . 1 1 43 43 LEU HG H 1 1.676 0.03 . 1 . . . A 43 LEU HG . 19666 1
500 . 1 1 43 43 LEU HD11 H 1 0.850 0.03 . 2 . . . A 43 LEU HD11 . 19666 1
501 . 1 1 43 43 LEU HD12 H 1 0.850 0.03 . 2 . . . A 43 LEU HD12 . 19666 1
502 . 1 1 43 43 LEU HD13 H 1 0.850 0.03 . 2 . . . A 43 LEU HD13 . 19666 1
503 . 1 1 43 43 LEU HD21 H 1 0.843 0.03 . 2 . . . A 43 LEU HD21 . 19666 1
504 . 1 1 43 43 LEU HD22 H 1 0.843 0.03 . 2 . . . A 43 LEU HD22 . 19666 1
505 . 1 1 43 43 LEU HD23 H 1 0.843 0.03 . 2 . . . A 43 LEU HD23 . 19666 1
506 . 1 1 43 43 LEU C C 13 176.723 0.30 . 1 . . . A 43 LEU C . 19666 1
507 . 1 1 43 43 LEU CA C 13 54.458 0.30 . 1 . . . A 43 LEU CA . 19666 1
508 . 1 1 43 43 LEU CB C 13 43.516 0.30 . 1 . . . A 43 LEU CB . 19666 1
509 . 1 1 43 43 LEU CG C 13 26.912 0.30 . 1 . . . A 43 LEU CG . 19666 1
510 . 1 1 43 43 LEU CD1 C 13 25.072 0.30 . 1 . . . A 43 LEU CD1 . 19666 1
511 . 1 1 43 43 LEU CD2 C 13 23.623 0.30 . 1 . . . A 43 LEU CD2 . 19666 1
512 . 1 1 43 43 LEU N N 15 125.976 0.30 . 1 . . . A 43 LEU N . 19666 1
513 . 1 1 44 44 LYS H H 1 8.577 0.03 . 1 . . . A 44 LYS H . 19666 1
514 . 1 1 44 44 LYS HA H 1 4.521 0.03 . 1 . . . A 44 LYS HA . 19666 1
515 . 1 1 44 44 LYS HB2 H 1 1.875 0.03 . 2 . . . A 44 LYS HB2 . 19666 1
516 . 1 1 44 44 LYS HB3 H 1 1.714 0.03 . 2 . . . A 44 LYS HB3 . 19666 1
517 . 1 1 44 44 LYS HG2 H 1 1.455 0.03 . 2 . . . A 44 LYS HG2 . 19666 1
518 . 1 1 44 44 LYS HG3 H 1 1.369 0.03 . 2 . . . A 44 LYS HG3 . 19666 1
519 . 1 1 44 44 LYS HD2 H 1 1.640 0.03 . 2 . . . A 44 LYS HD2 . 19666 1
520 . 1 1 44 44 LYS HD3 H 1 1.570 0.03 . 2 . . . A 44 LYS HD3 . 19666 1
521 . 1 1 44 44 LYS HE2 H 1 2.948 0.03 . 1 . . . A 44 LYS HE2 . 19666 1
522 . 1 1 44 44 LYS HE3 H 1 2.948 0.03 . 1 . . . A 44 LYS HE3 . 19666 1
523 . 1 1 44 44 LYS C C 13 176.254 0.30 . 1 . . . A 44 LYS C . 19666 1
524 . 1 1 44 44 LYS CA C 13 56.395 0.30 . 1 . . . A 44 LYS CA . 19666 1
525 . 1 1 44 44 LYS CB C 13 33.171 0.30 . 1 . . . A 44 LYS CB . 19666 1
526 . 1 1 44 44 LYS CG C 13 24.961 0.30 . 1 . . . A 44 LYS CG . 19666 1
527 . 1 1 44 44 LYS CD C 13 29.176 0.30 . 1 . . . A 44 LYS CD . 19666 1
528 . 1 1 44 44 LYS CE C 13 41.875 0.30 . 1 . . . A 44 LYS CE . 19666 1
529 . 1 1 44 44 LYS N N 15 122.285 0.30 . 1 . . . A 44 LYS N . 19666 1
530 . 1 1 45 45 SER H H 1 8.254 0.03 . 1 . . . A 45 SER H . 19666 1
531 . 1 1 45 45 SER HA H 1 4.562 0.03 . 1 . . . A 45 SER HA . 19666 1
532 . 1 1 45 45 SER HB2 H 1 3.811 0.03 . 2 . . . A 45 SER HB2 . 19666 1
533 . 1 1 45 45 SER HB3 H 1 3.701 0.03 . 2 . . . A 45 SER HB3 . 19666 1
534 . 1 1 45 45 SER C C 13 174.264 0.30 . 1 . . . A 45 SER C . 19666 1
535 . 1 1 45 45 SER CA C 13 57.318 0.30 . 1 . . . A 45 SER CA . 19666 1
536 . 1 1 45 45 SER CB C 13 64.221 0.30 . 1 . . . A 45 SER CB . 19666 1
537 . 1 1 45 45 SER N N 15 117.715 0.30 . 1 . . . A 45 SER N . 19666 1
538 . 1 1 46 46 GLY H H 1 8.405 0.03 . 1 . . . A 46 GLY H . 19666 1
539 . 1 1 46 46 GLY HA2 H 1 3.960 0.03 . 2 . . . A 46 GLY HA2 . 19666 1
540 . 1 1 46 46 GLY HA3 H 1 3.746 0.03 . 2 . . . A 46 GLY HA3 . 19666 1
541 . 1 1 46 46 GLY C C 13 174.068 0.30 . 1 . . . A 46 GLY C . 19666 1
542 . 1 1 46 46 GLY CA C 13 45.310 0.30 . 1 . . . A 46 GLY CA . 19666 1
543 . 1 1 46 46 GLY N N 15 111.386 0.30 . 1 . . . A 46 GLY N . 19666 1
544 . 1 1 47 47 PHE H H 1 8.362 0.03 . 1 . . . A 47 PHE H . 19666 1
545 . 1 1 47 47 PHE HA H 1 4.364 0.03 . 1 . . . A 47 PHE HA . 19666 1
546 . 1 1 47 47 PHE HB2 H 1 2.836 0.03 . 2 . . . A 47 PHE HB2 . 19666 1
547 . 1 1 47 47 PHE HB3 H 1 2.714 0.03 . 2 . . . A 47 PHE HB3 . 19666 1
548 . 1 1 47 47 PHE HD1 H 1 7.008 0.03 . 1 . . . A 47 PHE HD1 . 19666 1
549 . 1 1 47 47 PHE HD2 H 1 7.008 0.03 . 1 . . . A 47 PHE HD2 . 19666 1
550 . 1 1 47 47 PHE HE1 H 1 7.390 0.03 . 1 . . . A 47 PHE HE1 . 19666 1
551 . 1 1 47 47 PHE HE2 H 1 7.390 0.03 . 1 . . . A 47 PHE HE2 . 19666 1
552 . 1 1 47 47 PHE HZ H 1 7.366 0.03 . 1 . . . A 47 PHE HZ . 19666 1
553 . 1 1 47 47 PHE C C 13 176.313 0.30 . 1 . . . A 47 PHE C . 19666 1
554 . 1 1 47 47 PHE CA C 13 58.892 0.30 . 1 . . . A 47 PHE CA . 19666 1
555 . 1 1 47 47 PHE CB C 13 39.249 0.30 . 1 . . . A 47 PHE CB . 19666 1
556 . 1 1 47 47 PHE CD1 C 13 133.323 0.30 . 1 . . . A 47 PHE CD1 . 19666 1
557 . 1 1 47 47 PHE CD2 C 13 133.323 0.30 . 1 . . . A 47 PHE CD2 . 19666 1
558 . 1 1 47 47 PHE CE1 C 13 131.621 0.30 . 1 . . . A 47 PHE CE1 . 19666 1
559 . 1 1 47 47 PHE CE2 C 13 131.621 0.30 . 1 . . . A 47 PHE CE2 . 19666 1
560 . 1 1 47 47 PHE CZ C 13 129.505 0.30 . 1 . . . A 47 PHE CZ . 19666 1
561 . 1 1 47 47 PHE N N 15 120.703 0.30 . 1 . . . A 47 PHE N . 19666 1
562 . 1 1 48 48 PHE H H 1 8.316 0.03 . 1 . . . A 48 PHE H . 19666 1
563 . 1 1 48 48 PHE HA H 1 4.670 0.03 . 1 . . . A 48 PHE HA . 19666 1
564 . 1 1 48 48 PHE HB2 H 1 3.336 0.03 . 2 . . . A 48 PHE HB2 . 19666 1
565 . 1 1 48 48 PHE HB3 H 1 3.007 0.03 . 2 . . . A 48 PHE HB3 . 19666 1
566 . 1 1 48 48 PHE HD1 H 1 7.280 0.03 . 1 . . . A 48 PHE HD1 . 19666 1
567 . 1 1 48 48 PHE HD2 H 1 7.280 0.03 . 1 . . . A 48 PHE HD2 . 19666 1
568 . 1 1 48 48 PHE HE1 H 1 7.006 0.03 . 1 . . . A 48 PHE HE1 . 19666 1
569 . 1 1 48 48 PHE HE2 H 1 7.006 0.03 . 1 . . . A 48 PHE HE2 . 19666 1
570 . 1 1 48 48 PHE C C 13 175.325 0.30 . 1 . . . A 48 PHE C . 19666 1
571 . 1 1 48 48 PHE CA C 13 57.687 0.30 . 1 . . . A 48 PHE CA . 19666 1
572 . 1 1 48 48 PHE CB C 13 39.669 0.30 . 1 . . . A 48 PHE CB . 19666 1
573 . 1 1 48 48 PHE CD1 C 13 131.562 0.30 . 1 . . . A 48 PHE CD1 . 19666 1
574 . 1 1 48 48 PHE CD2 C 13 131.562 0.30 . 1 . . . A 48 PHE CD2 . 19666 1
575 . 1 1 48 48 PHE CE1 C 13 131.289 0.30 . 1 . . . A 48 PHE CE1 . 19666 1
576 . 1 1 48 48 PHE CE2 C 13 131.289 0.30 . 1 . . . A 48 PHE CE2 . 19666 1
577 . 1 1 48 48 PHE N N 15 117.363 0.30 . 1 . . . A 48 PHE N . 19666 1
578 . 1 1 49 49 SER H H 1 7.831 0.03 . 1 . . . A 49 SER H . 19666 1
579 . 1 1 49 49 SER HA H 1 4.498 0.03 . 1 . . . A 49 SER HA . 19666 1
580 . 1 1 49 49 SER HB2 H 1 3.822 0.03 . 2 . . . A 49 SER HB2 . 19666 1
581 . 1 1 49 49 SER HB3 H 1 3.825 0.03 . 2 . . . A 49 SER HB3 . 19666 1
582 . 1 1 49 49 SER C C 13 174.190 0.30 . 1 . . . A 49 SER C . 19666 1
583 . 1 1 49 49 SER CA C 13 58.441 0.30 . 1 . . . A 49 SER CA . 19666 1
584 . 1 1 49 49 SER CB C 13 64.234 0.30 . 1 . . . A 49 SER CB . 19666 1
585 . 1 1 49 49 SER N N 15 114.726 0.30 . 1 . . . A 49 SER N . 19666 1
586 . 1 1 50 50 SER H H 1 8.396 0.03 . 1 . . . A 50 SER H . 19666 1
587 . 1 1 50 50 SER HA H 1 4.682 0.03 . 1 . . . A 50 SER HA . 19666 1
588 . 1 1 50 50 SER HB2 H 1 3.799 0.03 . 2 . . . A 50 SER HB2 . 19666 1
589 . 1 1 50 50 SER HB3 H 1 3.770 0.03 . 2 . . . A 50 SER HB3 . 19666 1
590 . 1 1 50 50 SER C C 13 173.200 0.30 . 1 . . . A 50 SER C . 19666 1
591 . 1 1 50 50 SER CA C 13 58.394 0.30 . 1 . . . A 50 SER CA . 19666 1
592 . 1 1 50 50 SER CB C 13 64.843 0.30 . 1 . . . A 50 SER CB . 19666 1
593 . 1 1 50 50 SER N N 15 117.363 0.30 . 1 . . . A 50 SER N . 19666 1
594 . 1 1 51 51 LYS H H 1 8.453 0.03 . 1 . . . A 51 LYS H . 19666 1
595 . 1 1 51 51 LYS HA H 1 4.528 0.03 . 1 . . . A 51 LYS HA . 19666 1
596 . 1 1 51 51 LYS HB2 H 1 1.781 0.03 . 2 . . . A 51 LYS HB2 . 19666 1
597 . 1 1 51 51 LYS HB3 H 1 1.741 0.03 . 2 . . . A 51 LYS HB3 . 19666 1
598 . 1 1 51 51 LYS HG2 H 1 1.350 0.03 . 2 . . . A 51 LYS HG2 . 19666 1
599 . 1 1 51 51 LYS HG3 H 1 1.296 0.03 . 2 . . . A 51 LYS HG3 . 19666 1
600 . 1 1 51 51 LYS HD2 H 1 1.565 0.03 . 1 . . . A 51 LYS HD2 . 19666 1
601 . 1 1 51 51 LYS HD3 H 1 1.565 0.03 . 1 . . . A 51 LYS HD3 . 19666 1
602 . 1 1 51 51 LYS HE2 H 1 2.838 0.03 . 1 . . . A 51 LYS HE2 . 19666 1
603 . 1 1 51 51 LYS HE3 H 1 2.838 0.03 . 1 . . . A 51 LYS HE3 . 19666 1
604 . 1 1 51 51 LYS C C 13 175.239 0.30 . 1 . . . A 51 LYS C . 19666 1
605 . 1 1 51 51 LYS CA C 13 55.759 0.30 . 1 . . . A 51 LYS CA . 19666 1
606 . 1 1 51 51 LYS CB C 13 34.450 0.30 . 1 . . . A 51 LYS CB . 19666 1
607 . 1 1 51 51 LYS CG C 13 24.538 0.30 . 1 . . . A 51 LYS CG . 19666 1
608 . 1 1 51 51 LYS CD C 13 29.219 0.30 . 1 . . . A 51 LYS CD . 19666 1
609 . 1 1 51 51 LYS CE C 13 42.036 0.30 . 1 . . . A 51 LYS CE . 19666 1
610 . 1 1 51 51 LYS N N 15 122.812 0.30 . 1 . . . A 51 LYS N . 19666 1
611 . 1 1 52 52 CYS H H 1 8.828 0.03 . 1 . . . A 52 CYS H . 19666 1
612 . 1 1 52 52 CYS HA H 1 5.525 0.03 . 1 . . . A 52 CYS HA . 19666 1
613 . 1 1 52 52 CYS HB2 H 1 3.493 0.03 . 2 . . . A 52 CYS HB2 . 19666 1
614 . 1 1 52 52 CYS HB3 H 1 2.677 0.03 . 2 . . . A 52 CYS HB3 . 19666 1
615 . 1 1 52 52 CYS C C 13 174.345 0.30 . 1 . . . A 52 CYS C . 19666 1
616 . 1 1 52 52 CYS CA C 13 55.786 0.30 . 1 . . . A 52 CYS CA . 19666 1
617 . 1 1 52 52 CYS CB C 13 47.500 0.30 . 1 . . . A 52 CYS CB . 19666 1
618 . 1 1 52 52 CYS N N 15 124.922 0.30 . 1 . . . A 52 CYS N . 19666 1
619 . 1 1 53 53 VAL H H 1 8.625 0.03 . 1 . . . A 53 VAL H . 19666 1
620 . 1 1 53 53 VAL HA H 1 5.011 0.03 . 1 . . . A 53 VAL HA . 19666 1
621 . 1 1 53 53 VAL HB H 1 1.558 0.03 . 1 . . . A 53 VAL HB . 19666 1
622 . 1 1 53 53 VAL HG11 H 1 0.617 0.03 . 1 . . . A 53 VAL HG11 . 19666 1
623 . 1 1 53 53 VAL HG12 H 1 0.617 0.03 . 1 . . . A 53 VAL HG12 . 19666 1
624 . 1 1 53 53 VAL HG13 H 1 0.617 0.03 . 1 . . . A 53 VAL HG13 . 19666 1
625 . 1 1 53 53 VAL HG21 H 1 0.668 0.03 . 1 . . . A 53 VAL HG21 . 19666 1
626 . 1 1 53 53 VAL HG22 H 1 0.668 0.03 . 1 . . . A 53 VAL HG22 . 19666 1
627 . 1 1 53 53 VAL HG23 H 1 0.668 0.03 . 1 . . . A 53 VAL HG23 . 19666 1
628 . 1 1 53 53 VAL C C 13 176.396 0.30 . 1 . . . A 53 VAL C . 19666 1
629 . 1 1 53 53 VAL CA C 13 59.190 0.30 . 1 . . . A 53 VAL CA . 19666 1
630 . 1 1 53 53 VAL CB C 13 37.293 0.30 . 1 . . . A 53 VAL CB . 19666 1
631 . 1 1 53 53 VAL CG1 C 13 21.935 0.30 . 1 . . . A 53 VAL CG1 . 19666 1
632 . 1 1 53 53 VAL CG2 C 13 18.750 0.30 . 1 . . . A 53 VAL CG2 . 19666 1
633 . 1 1 53 53 VAL N N 15 117.187 0.30 . 1 . . . A 53 VAL N . 19666 1
634 . 1 1 54 54 CYS H H 1 8.072 0.03 . 1 . . . A 54 CYS H . 19666 1
635 . 1 1 54 54 CYS HA H 1 5.012 0.03 . 1 . . . A 54 CYS HA . 19666 1
636 . 1 1 54 54 CYS HB2 H 1 3.416 0.03 . 2 . . . A 54 CYS HB2 . 19666 1
637 . 1 1 54 54 CYS HB3 H 1 2.515 0.03 . 2 . . . A 54 CYS HB3 . 19666 1
638 . 1 1 54 54 CYS C C 13 175.637 0.30 . 1 . . . A 54 CYS C . 19666 1
639 . 1 1 54 54 CYS CA C 13 55.432 0.30 . 1 . . . A 54 CYS CA . 19666 1
640 . 1 1 54 54 CYS CB C 13 40.268 0.30 . 1 . . . A 54 CYS CB . 19666 1
641 . 1 1 54 54 CYS N N 15 120.703 0.30 . 1 . . . A 54 CYS N . 19666 1
642 . 1 1 55 55 ARG H H 1 9.378 0.03 . 1 . . . A 55 ARG H . 19666 1
643 . 1 1 55 55 ARG HA H 1 4.853 0.03 . 1 . . . A 55 ARG HA . 19666 1
644 . 1 1 55 55 ARG HB2 H 1 2.087 0.03 . 2 . . . A 55 ARG HB2 . 19666 1
645 . 1 1 55 55 ARG HB3 H 1 1.681 0.03 . 2 . . . A 55 ARG HB3 . 19666 1
646 . 1 1 55 55 ARG HG2 H 1 1.707 0.03 . 2 . . . A 55 ARG HG2 . 19666 1
647 . 1 1 55 55 ARG HG3 H 1 1.640 0.03 . 2 . . . A 55 ARG HG3 . 19666 1
648 . 1 1 55 55 ARG HD2 H 1 3.202 0.03 . 2 . . . A 55 ARG HD2 . 19666 1
649 . 1 1 55 55 ARG HD3 H 1 3.097 0.03 . 2 . . . A 55 ARG HD3 . 19666 1
650 . 1 1 55 55 ARG HE H 1 7.228 0.03 . 1 . . . A 55 ARG HE . 19666 1
651 . 1 1 55 55 ARG C C 13 174.029 0.30 . 1 . . . A 55 ARG C . 19666 1
652 . 1 1 55 55 ARG CA C 13 53.194 0.30 . 1 . . . A 55 ARG CA . 19666 1
653 . 1 1 55 55 ARG CB C 13 35.049 0.30 . 1 . . . A 55 ARG CB . 19666 1
654 . 1 1 55 55 ARG CG C 13 26.416 0.30 . 1 . . . A 55 ARG CG . 19666 1
655 . 1 1 55 55 ARG CD C 13 42.802 0.30 . 1 . . . A 55 ARG CD . 19666 1
656 . 1 1 55 55 ARG N N 15 124.922 0.30 . 1 . . . A 55 ARG N . 19666 1
657 . 1 1 55 55 ARG NE N 15 83.967 0.30 . 1 . . . A 55 ARG NE . 19666 1
658 . 1 1 56 56 ASP H H 1 9.693 0.03 . 1 . . . A 56 ASP H . 19666 1
659 . 1 1 56 56 ASP HA H 1 5.244 0.03 . 1 . . . A 56 ASP HA . 19666 1
660 . 1 1 56 56 ASP HB2 H 1 2.747 0.03 . 2 . . . A 56 ASP HB2 . 19666 1
661 . 1 1 56 56 ASP HB3 H 1 2.303 0.03 . 2 . . . A 56 ASP HB3 . 19666 1
662 . 1 1 56 56 ASP C C 13 175.192 0.30 . 1 . . . A 56 ASP C . 19666 1
663 . 1 1 56 56 ASP CA C 13 53.525 0.30 . 1 . . . A 56 ASP CA . 19666 1
664 . 1 1 56 56 ASP CB C 13 39.655 0.30 . 1 . . . A 56 ASP CB . 19666 1
665 . 1 1 56 56 ASP N N 15 117.011 0.30 . 1 . . . A 56 ASP N . 19666 1
666 . 1 1 57 57 VAL H H 1 7.849 0.03 . 1 . . . A 57 VAL H . 19666 1
667 . 1 1 57 57 VAL HA H 1 4.183 0.03 . 1 . . . A 57 VAL HA . 19666 1
668 . 1 1 57 57 VAL HB H 1 2.149 0.03 . 1 . . . A 57 VAL HB . 19666 1
669 . 1 1 57 57 VAL HG11 H 1 0.735 0.03 . 2 . . . A 57 VAL HG11 . 19666 1
670 . 1 1 57 57 VAL HG12 H 1 0.735 0.03 . 2 . . . A 57 VAL HG12 . 19666 1
671 . 1 1 57 57 VAL HG13 H 1 0.735 0.03 . 2 . . . A 57 VAL HG13 . 19666 1
672 . 1 1 57 57 VAL HG21 H 1 0.872 0.03 . 2 . . . A 57 VAL HG21 . 19666 1
673 . 1 1 57 57 VAL HG22 H 1 0.872 0.03 . 2 . . . A 57 VAL HG22 . 19666 1
674 . 1 1 57 57 VAL HG23 H 1 0.872 0.03 . 2 . . . A 57 VAL HG23 . 19666 1
675 . 1 1 57 57 VAL CA C 13 62.968 0.30 . 1 . . . A 57 VAL CA . 19666 1
676 . 1 1 57 57 VAL CB C 13 33.906 0.30 . 1 . . . A 57 VAL CB . 19666 1
677 . 1 1 57 57 VAL CG1 C 13 19.844 0.30 . 1 . . . A 57 VAL CG1 . 19666 1
678 . 1 1 57 57 VAL CG2 C 13 22.188 0.30 . 1 . . . A 57 VAL CG2 . 19666 1
679 . 1 1 57 57 VAL N N 15 123.164 0.30 . 1 . . . A 57 VAL N . 19666 1
stop_
save_