Content for NMR-STAR saveframe, "1H"
save_1H
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode 1H
_Assigned_chem_shift_list.Entry_ID 19880
_Assigned_chem_shift_list.ID 3
_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 0.02
_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
3 '2D 1H-1H TOCSY' . . . 19880 3
4 '2D DQF-COSY' . . . 19880 3
5 '2D 1H-1H NOESY' . . . 19880 3
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 PCA CA C 13 59.693 0.300 . . . . . A 1 PCA CA . 19880 3
2 . 1 1 1 1 PCA CB C 13 28.065 0.300 . . . . . A 1 PCA CB . 19880 3
3 . 1 1 1 1 PCA CG C 13 32.002 0.300 . . . . . A 1 PCA CG . 19880 3
4 . 1 1 1 1 PCA H H 1 7.887 0.020 . . . . . A 1 PCA H . 19880 3
5 . 1 1 1 1 PCA HA H 1 4.282 0.020 . . . . . A 1 PCA HA . 19880 3
6 . 1 1 1 1 PCA HB2 H 1 1.997 0.020 . . . . . A 1 PCA HB2 . 19880 3
7 . 1 1 1 1 PCA HB3 H 1 2.471 0.020 . . . . . A 1 PCA HB3 . 19880 3
8 . 1 1 1 1 PCA N N 15 125.290 0.300 . . . . . A 1 PCA N . 19880 3
9 . 1 1 1 1 PCA HG2 H 1 2.320 0.020 . . . . . A 1 PCA QG . 19880 3
10 . 1 1 1 1 PCA HG3 H 1 2.320 0.020 . . . . . A 1 PCA QG . 19880 3
11 . 1 1 2 2 ASN H H 1 8.648 0.020 . . . . . A 2 ASN H . 19880 3
12 . 1 1 2 2 ASN HA H 1 4.761 0.020 . . . . . A 2 ASN HA . 19880 3
13 . 1 1 2 2 ASN HB2 H 1 2.771 0.020 . . . . . A 2 ASN HB2 . 19880 3
14 . 1 1 2 2 ASN HB3 H 1 2.640 0.020 . . . . . A 2 ASN HB3 . 19880 3
15 . 1 1 2 2 ASN HD21 H 1 7.554 0.020 . . . . . A 2 ASN HD21 . 19880 3
16 . 1 1 2 2 ASN HD22 H 1 6.870 0.020 . . . . . A 2 ASN HD22 . 19880 3
17 . 1 1 2 2 ASN CA C 13 52.630 0.300 . . . . . A 2 ASN CA . 19880 3
18 . 1 1 2 2 ASN CB C 13 38.266 0.300 . . . . . A 2 ASN CB . 19880 3
19 . 1 1 2 2 ASN N N 15 120.329 0.300 . . . . . A 2 ASN N . 19880 3
20 . 1 1 2 2 ASN ND2 N 15 113.032 0.300 . . . . . A 2 ASN ND2 . 19880 3
21 . 1 1 3 3 CYS H H 1 7.950 0.020 . . . . . A 3 CYS H . 19880 3
22 . 1 1 3 3 CYS HA H 1 4.820 0.020 . . . . . A 3 CYS HA . 19880 3
23 . 1 1 3 3 CYS HB2 H 1 3.004 0.020 . . . . . A 3 CYS HB2 . 19880 3
24 . 1 1 3 3 CYS HB3 H 1 3.048 0.020 . . . . . A 3 CYS HB3 . 19880 3
25 . 1 1 3 3 CYS CA C 13 52.700 0.300 . . . . . A 3 CYS CA . 19880 3
26 . 1 1 3 3 CYS CB C 13 46.651 0.300 . . . . . A 3 CYS CB . 19880 3
27 . 1 1 3 3 CYS N N 15 117.561 0.300 . . . . . A 3 CYS N . 19880 3
28 . 1 1 4 4 PRO HA H 1 4.505 0.020 . . . . . A 4 PRO HA . 19880 3
29 . 1 1 4 4 PRO HB2 H 1 2.258 0.020 . . . . . A 4 PRO HB2 . 19880 3
30 . 1 1 4 4 PRO HB3 H 1 1.733 0.020 . . . . . A 4 PRO HB3 . 19880 3
31 . 1 1 4 4 PRO HG2 H 1 2.075 0.020 . . . . . A 4 PRO HG2 . 19880 3
32 . 1 1 4 4 PRO HG3 H 1 2.031 0.020 . . . . . A 4 PRO HG3 . 19880 3
33 . 1 1 4 4 PRO HD2 H 1 3.992 0.020 . . . . . A 4 PRO HD2 . 19880 3
34 . 1 1 4 4 PRO HD3 H 1 3.605 0.020 . . . . . A 4 PRO HD3 . 19880 3
35 . 1 1 4 4 PRO CA C 13 63.730 0.300 . . . . . A 4 PRO CA . 19880 3
36 . 1 1 4 4 PRO CB C 13 33.299 0.300 . . . . . A 4 PRO CB . 19880 3
37 . 1 1 4 4 PRO CG C 13 27.361 0.300 . . . . . A 4 PRO CG . 19880 3
38 . 1 1 4 4 PRO CD C 13 51.069 0.300 . . . . . A 4 PRO CD . 19880 3
39 . 1 1 5 5 THR H H 1 8.529 0.020 . . . . . A 5 THR H . 19880 3
40 . 1 1 5 5 THR HA H 1 4.814 0.020 . . . . . A 5 THR HA . 19880 3
41 . 1 1 5 5 THR HB H 1 3.917 0.020 . . . . . A 5 THR HB . 19880 3
42 . 1 1 5 5 THR HG21 H 1 1.108 0.020 . . . . . A 5 THR HG21 . 19880 3
43 . 1 1 5 5 THR HG22 H 1 1.108 0.020 . . . . . A 5 THR HG22 . 19880 3
44 . 1 1 5 5 THR HG23 H 1 1.108 0.020 . . . . . A 5 THR HG23 . 19880 3
45 . 1 1 5 5 THR CA C 13 61.618 0.300 . . . . . A 5 THR CA . 19880 3
46 . 1 1 5 5 THR CB C 13 70.257 0.300 . . . . . A 5 THR CB . 19880 3
47 . 1 1 5 5 THR CG2 C 13 21.027 0.300 . . . . . A 5 THR CG2 . 19880 3
48 . 1 1 5 5 THR N N 15 118.207 0.300 . . . . . A 5 THR N . 19880 3
49 . 1 1 6 6 ARG H H 1 7.663 0.020 . . . . . A 6 ARG H . 19880 3
50 . 1 1 6 6 ARG HA H 1 4.528 0.020 . . . . . A 6 ARG HA . 19880 3
51 . 1 1 6 6 ARG HB2 H 1 1.122 0.020 . . . . . A 6 ARG HB2 . 19880 3
52 . 1 1 6 6 ARG HB3 H 1 0.437 0.020 . . . . . A 6 ARG HB3 . 19880 3
53 . 1 1 6 6 ARG HG2 H 1 1.358 0.020 . . . . . A 6 ARG HG2 . 19880 3
54 . 1 1 6 6 ARG HG3 H 1 1.255 0.020 . . . . . A 6 ARG HG3 . 19880 3
55 . 1 1 6 6 ARG HD2 H 1 3.086 0.020 . . . . . A 6 ARG HD2 . 19880 3
56 . 1 1 6 6 ARG HD3 H 1 3.036 0.020 . . . . . A 6 ARG HD3 . 19880 3
57 . 1 1 6 6 ARG HE H 1 7.281 0.020 . . . . . A 6 ARG HE . 19880 3
58 . 1 1 6 6 ARG CA C 13 54.931 0.300 . . . . . A 6 ARG CA . 19880 3
59 . 1 1 6 6 ARG CB C 13 32.752 0.300 . . . . . A 6 ARG CB . 19880 3
60 . 1 1 6 6 ARG CG C 13 28.575 0.300 . . . . . A 6 ARG CG . 19880 3
61 . 1 1 6 6 ARG CD C 13 43.309 0.300 . . . . . A 6 ARG CD . 19880 3
62 . 1 1 6 6 ARG N N 15 123.211 0.300 . . . . . A 6 ARG N . 19880 3
63 . 1 1 6 6 ARG NE N 15 85.585 0.300 . . . . . A 6 ARG NE . 19880 3
64 . 1 1 7 7 ARG H H 1 8.450 0.020 . . . . . A 7 ARG H . 19880 3
65 . 1 1 7 7 ARG HA H 1 4.666 0.020 . . . . . A 7 ARG HA . 19880 3
66 . 1 1 7 7 ARG HB2 H 1 1.760 0.020 . . . . . A 7 ARG HB2 . 19880 3
67 . 1 1 7 7 ARG HB3 H 1 1.563 0.020 . . . . . A 7 ARG HB3 . 19880 3
68 . 1 1 7 7 ARG HG2 H 1 1.487 0.020 . . . . . A 7 ARG HG2 . 19880 3
69 . 1 1 7 7 ARG HG3 H 1 1.405 0.020 . . . . . A 7 ARG HG3 . 19880 3
70 . 1 1 7 7 ARG HD2 H 1 3.103 0.020 . . . . . A 7 ARG HD2 . 19880 3
71 . 1 1 7 7 ARG HD3 H 1 3.065 0.020 . . . . . A 7 ARG HD3 . 19880 3
72 . 1 1 7 7 ARG HE H 1 7.707 0.020 . . . . . A 7 ARG HE . 19880 3
73 . 1 1 7 7 ARG CA C 13 54.415 0.300 . . . . . A 7 ARG CA . 19880 3
74 . 1 1 7 7 ARG CB C 13 32.673 0.300 . . . . . A 7 ARG CB . 19880 3
75 . 1 1 7 7 ARG CG C 13 26.698 0.300 . . . . . A 7 ARG CG . 19880 3
76 . 1 1 7 7 ARG CD C 13 42.612 0.300 . . . . . A 7 ARG CD . 19880 3
77 . 1 1 7 7 ARG N N 15 121.558 0.300 . . . . . A 7 ARG N . 19880 3
78 . 1 1 7 7 ARG NE N 15 84.680 0.300 . . . . . A 7 ARG NE . 19880 3
79 . 1 1 8 8 GLY H H 1 9.384 0.020 . . . . . A 8 GLY H . 19880 3
80 . 1 1 8 8 GLY HA3 H 1 3.912 0.020 . . . . . A 8 GLY HA3 . 19880 3
81 . 1 1 8 8 GLY CA C 13 46.653 0.300 . . . . . A 8 GLY CA . 19880 3
82 . 1 1 8 8 GLY N N 15 111.006 0.300 . . . . . A 8 GLY N . 19880 3
83 . 1 1 9 9 LEU H H 1 8.221 0.020 . . . . . A 9 LEU H . 19880 3
84 . 1 1 9 9 LEU HA H 1 3.880 0.020 . . . . . A 9 LEU HA . 19880 3
85 . 1 1 9 9 LEU HB2 H 1 1.546 0.020 . . . . . A 9 LEU HB2 . 19880 3
86 . 1 1 9 9 LEU HB3 H 1 0.959 0.020 . . . . . A 9 LEU HB3 . 19880 3
87 . 1 1 9 9 LEU HG H 1 1.117 0.020 . . . . . A 9 LEU HG . 19880 3
88 . 1 1 9 9 LEU HD11 H 1 0.529 0.020 . . . . . A 9 LEU HD11 . 19880 3
89 . 1 1 9 9 LEU HD12 H 1 0.529 0.020 . . . . . A 9 LEU HD12 . 19880 3
90 . 1 1 9 9 LEU HD13 H 1 0.529 0.020 . . . . . A 9 LEU HD13 . 19880 3
91 . 1 1 9 9 LEU HD21 H 1 0.444 0.020 . . . . . A 9 LEU HD21 . 19880 3
92 . 1 1 9 9 LEU HD22 H 1 0.444 0.020 . . . . . A 9 LEU HD22 . 19880 3
93 . 1 1 9 9 LEU HD23 H 1 0.444 0.020 . . . . . A 9 LEU HD23 . 19880 3
94 . 1 1 9 9 LEU CA C 13 57.754 0.300 . . . . . A 9 LEU CA . 19880 3
95 . 1 1 9 9 LEU CB C 13 42.770 0.300 . . . . . A 9 LEU CB . 19880 3
96 . 1 1 9 9 LEU CG C 13 26.773 0.300 . . . . . A 9 LEU CG . 19880 3
97 . 1 1 9 9 LEU CD1 C 13 22.657 0.300 . . . . . A 9 LEU CD1 . 19880 3
98 . 1 1 9 9 LEU CD2 C 13 27.242 0.300 . . . . . A 9 LEU CD2 . 19880 3
99 . 1 1 9 9 LEU N N 15 119.202 0.300 . . . . . A 9 LEU N . 19880 3
100 . 1 1 10 10 CYS H H 1 9.286 0.020 . . . . . A 10 CYS H . 19880 3
101 . 1 1 10 10 CYS HA H 1 3.890 0.020 . . . . . A 10 CYS HA . 19880 3
102 . 1 1 10 10 CYS HB2 H 1 3.171 0.020 . . . . . A 10 CYS HB2 . 19880 3
103 . 1 1 10 10 CYS HB3 H 1 2.784 0.020 . . . . . A 10 CYS HB3 . 19880 3
104 . 1 1 10 10 CYS CA C 13 61.378 0.300 . . . . . A 10 CYS CA . 19880 3
105 . 1 1 10 10 CYS CB C 13 42.589 0.300 . . . . . A 10 CYS CB . 19880 3
106 . 1 1 10 10 CYS N N 15 115.050 0.300 . . . . . A 10 CYS N . 19880 3
107 . 1 1 11 11 VAL H H 1 7.315 0.020 . . . . . A 11 VAL H . 19880 3
108 . 1 1 11 11 VAL HA H 1 3.765 0.020 . . . . . A 11 VAL HA . 19880 3
109 . 1 1 11 11 VAL HB H 1 2.092 0.020 . . . . . A 11 VAL HB . 19880 3
110 . 1 1 11 11 VAL HG11 H 1 0.827 0.020 . . . . . A 11 VAL HG11 . 19880 3
111 . 1 1 11 11 VAL HG12 H 1 0.827 0.020 . . . . . A 11 VAL HG12 . 19880 3
112 . 1 1 11 11 VAL HG13 H 1 0.827 0.020 . . . . . A 11 VAL HG13 . 19880 3
113 . 1 1 11 11 VAL HG21 H 1 0.912 0.020 . . . . . A 11 VAL HG21 . 19880 3
114 . 1 1 11 11 VAL HG22 H 1 0.912 0.020 . . . . . A 11 VAL HG22 . 19880 3
115 . 1 1 11 11 VAL HG23 H 1 0.912 0.020 . . . . . A 11 VAL HG23 . 19880 3
116 . 1 1 11 11 VAL CA C 13 64.508 0.300 . . . . . A 11 VAL CA . 19880 3
117 . 1 1 11 11 VAL CB C 13 32.598 0.300 . . . . . A 11 VAL CB . 19880 3
118 . 1 1 11 11 VAL CG1 C 13 21.029 0.300 . . . . . A 11 VAL CG1 . 19880 3
119 . 1 1 11 11 VAL CG2 C 13 21.916 0.300 . . . . . A 11 VAL CG2 . 19880 3
120 . 1 1 11 11 VAL N N 15 117.792 0.300 . . . . . A 11 VAL N . 19880 3
121 . 1 1 12 12 THR H H 1 8.200 0.020 . . . . . A 12 THR H . 19880 3
122 . 1 1 12 12 THR HA H 1 4.044 0.020 . . . . . A 12 THR HA . 19880 3
123 . 1 1 12 12 THR HB H 1 4.124 0.020 . . . . . A 12 THR HB . 19880 3
124 . 1 1 12 12 THR HG21 H 1 1.153 0.020 . . . . . A 12 THR HG21 . 19880 3
125 . 1 1 12 12 THR HG22 H 1 1.153 0.020 . . . . . A 12 THR HG22 . 19880 3
126 . 1 1 12 12 THR HG23 H 1 1.153 0.020 . . . . . A 12 THR HG23 . 19880 3
127 . 1 1 12 12 THR CA C 13 63.575 0.300 . . . . . A 12 THR CA . 19880 3
128 . 1 1 12 12 THR CB C 13 69.400 0.300 . . . . . A 12 THR CB . 19880 3
129 . 1 1 12 12 THR CG2 C 13 21.751 0.300 . . . . . A 12 THR CG2 . 19880 3
130 . 1 1 12 12 THR N N 15 109.816 0.300 . . . . . A 12 THR N . 19880 3
131 . 1 1 13 13 SER H H 1 7.517 0.020 . . . . . A 13 SER H . 19880 3
132 . 1 1 13 13 SER HA H 1 4.607 0.020 . . . . . A 13 SER HA . 19880 3
133 . 1 1 13 13 SER HB2 H 1 3.665 0.020 . . . . . A 13 SER HB2 . 19880 3
134 . 1 1 13 13 SER HB3 H 1 3.598 0.020 . . . . . A 13 SER HB3 . 19880 3
135 . 1 1 13 13 SER CA C 13 59.460 0.300 . . . . . A 13 SER CA . 19880 3
136 . 1 1 13 13 SER CB C 13 64.586 0.300 . . . . . A 13 SER CB . 19880 3
137 . 1 1 13 13 SER N N 15 114.455 0.300 . . . . . A 13 SER N . 19880 3
138 . 1 1 14 14 GLY H H 1 8.382 0.020 . . . . . A 14 GLY H . 19880 3
139 . 1 1 14 14 GLY HA2 H 1 4.466 0.020 . . . . . A 14 GLY HA2 . 19880 3
140 . 1 1 14 14 GLY HA3 H 1 3.901 0.020 . . . . . A 14 GLY HA3 . 19880 3
141 . 1 1 14 14 GLY CA C 13 44.324 0.300 . . . . . A 14 GLY CA . 19880 3
142 . 1 1 14 14 GLY N N 15 109.125 0.300 . . . . . A 14 GLY N . 19880 3
143 . 1 1 15 15 LEU H H 1 8.468 0.020 . . . . . A 15 LEU H . 19880 3
144 . 1 1 15 15 LEU HA H 1 3.936 0.020 . . . . . A 15 LEU HA . 19880 3
145 . 1 1 15 15 LEU HB2 H 1 1.693 0.020 . . . . . A 15 LEU HB2 . 19880 3
146 . 1 1 15 15 LEU HB3 H 1 1.444 0.020 . . . . . A 15 LEU HB3 . 19880 3
147 . 1 1 15 15 LEU HG H 1 1.303 0.020 . . . . . A 15 LEU HG . 19880 3
148 . 1 1 15 15 LEU HD11 H 1 0.856 0.020 . . . . . A 15 LEU HD11 . 19880 3
149 . 1 1 15 15 LEU HD12 H 1 0.856 0.020 . . . . . A 15 LEU HD12 . 19880 3
150 . 1 1 15 15 LEU HD13 H 1 0.856 0.020 . . . . . A 15 LEU HD13 . 19880 3
151 . 1 1 15 15 LEU HD21 H 1 0.766 0.020 . . . . . A 15 LEU HD21 . 19880 3
152 . 1 1 15 15 LEU HD22 H 1 0.766 0.020 . . . . . A 15 LEU HD22 . 19880 3
153 . 1 1 15 15 LEU HD23 H 1 0.766 0.020 . . . . . A 15 LEU HD23 . 19880 3
154 . 1 1 15 15 LEU CA C 13 57.986 0.300 . . . . . A 15 LEU CA . 19880 3
155 . 1 1 15 15 LEU CB C 13 41.526 0.300 . . . . . A 15 LEU CB . 19880 3
156 . 1 1 15 15 LEU CG C 13 27.317 0.300 . . . . . A 15 LEU CG . 19880 3
157 . 1 1 15 15 LEU CD1 C 13 25.765 0.300 . . . . . A 15 LEU CD1 . 19880 3
158 . 1 1 15 15 LEU CD2 C 13 22.851 0.300 . . . . . A 15 LEU CD2 . 19880 3
159 . 1 1 15 15 LEU N N 15 120.782 0.300 . . . . . A 15 LEU N . 19880 3
160 . 1 1 16 16 THR H H 1 8.468 0.020 . . . . . A 16 THR H . 19880 3
161 . 1 1 16 16 THR HA H 1 3.597 0.020 . . . . . A 16 THR HA . 19880 3
162 . 1 1 16 16 THR HB H 1 4.013 0.020 . . . . . A 16 THR HB . 19880 3
163 . 1 1 16 16 THR HG21 H 1 1.069 0.020 . . . . . A 16 THR HG21 . 19880 3
164 . 1 1 16 16 THR HG22 H 1 1.069 0.020 . . . . . A 16 THR HG22 . 19880 3
165 . 1 1 16 16 THR HG23 H 1 1.069 0.020 . . . . . A 16 THR HG23 . 19880 3
166 . 1 1 16 16 THR CA C 13 67.196 0.300 . . . . . A 16 THR CA . 19880 3
167 . 1 1 16 16 THR CB C 13 68.003 0.300 . . . . . A 16 THR CB . 19880 3
168 . 1 1 16 16 THR CG2 C 13 21.841 0.300 . . . . . A 16 THR CG2 . 19880 3
169 . 1 1 16 16 THR N N 15 115.887 0.300 . . . . . A 16 THR N . 19880 3
170 . 1 1 17 17 ALA H H 1 7.609 0.020 . . . . . A 17 ALA H . 19880 3
171 . 1 1 17 17 ALA HA H 1 4.014 0.020 . . . . . A 17 ALA HA . 19880 3
172 . 1 1 17 17 ALA HB1 H 1 1.321 0.020 . . . . . A 17 ALA HB1 . 19880 3
173 . 1 1 17 17 ALA HB2 H 1 1.321 0.020 . . . . . A 17 ALA HB2 . 19880 3
174 . 1 1 17 17 ALA HB3 H 1 1.321 0.020 . . . . . A 17 ALA HB3 . 19880 3
175 . 1 1 17 17 ALA CA C 13 54.841 0.300 . . . . . A 17 ALA CA . 19880 3
176 . 1 1 17 17 ALA CB C 13 18.931 0.300 . . . . . A 17 ALA CB . 19880 3
177 . 1 1 17 17 ALA N N 15 122.643 0.300 . . . . . A 17 ALA N . 19880 3
178 . 1 1 18 18 CYS H H 1 7.645 0.020 . . . . . A 18 CYS H . 19880 3
179 . 1 1 18 18 CYS HA H 1 4.249 0.020 . . . . . A 18 CYS HA . 19880 3
180 . 1 1 18 18 CYS HB2 H 1 2.870 0.020 . . . . . A 18 CYS HB2 . 19880 3
181 . 1 1 18 18 CYS HB3 H 1 2.666 0.020 . . . . . A 18 CYS HB3 . 19880 3
182 . 1 1 18 18 CYS CA C 13 58.453 0.300 . . . . . A 18 CYS CA . 19880 3
183 . 1 1 18 18 CYS CB C 13 37.646 0.300 . . . . . A 18 CYS CB . 19880 3
184 . 1 1 18 18 CYS N N 15 118.252 0.300 . . . . . A 18 CYS N . 19880 3
185 . 1 1 19 19 ARG H H 1 9.074 0.020 . . . . . A 19 ARG H . 19880 3
186 . 1 1 19 19 ARG HA H 1 3.475 0.020 . . . . . A 19 ARG HA . 19880 3
187 . 1 1 19 19 ARG HB2 H 1 1.763 0.020 . . . . . A 19 ARG HB2 . 19880 3
188 . 1 1 19 19 ARG HB3 H 1 1.608 0.020 . . . . . A 19 ARG HB3 . 19880 3
189 . 1 1 19 19 ARG HG2 H 1 1.353 0.020 . . . . . A 19 ARG HG2 . 19880 3
190 . 1 1 19 19 ARG HG3 H 1 1.353 0.020 . . . . . A 19 ARG HG3 . 19880 3
191 . 1 1 19 19 ARG HD2 H 1 3.130 0.020 . . . . . A 19 ARG HD2 . 19880 3
192 . 1 1 19 19 ARG HD3 H 1 3.089 0.020 . . . . . A 19 ARG HD3 . 19880 3
193 . 1 1 19 19 ARG HE H 1 6.966 0.020 . . . . . A 19 ARG HE . 19880 3
194 . 1 1 19 19 ARG CA C 13 60.552 0.300 . . . . . A 19 ARG CA . 19880 3
195 . 1 1 19 19 ARG CB C 13 29.801 0.300 . . . . . A 19 ARG CB . 19880 3
196 . 1 1 19 19 ARG CG C 13 28.713 0.300 . . . . . A 19 ARG CG . 19880 3
197 . 1 1 19 19 ARG CD C 13 43.699 0.300 . . . . . A 19 ARG CD . 19880 3
198 . 1 1 19 19 ARG N N 15 120.422 0.300 . . . . . A 19 ARG N . 19880 3
199 . 1 1 19 19 ARG NE N 15 83.508 0.300 . . . . . A 19 ARG NE . 19880 3
200 . 1 1 20 20 ASN H H 1 8.411 0.020 . . . . . A 20 ASN H . 19880 3
201 . 1 1 20 20 ASN HA H 1 4.212 0.020 . . . . . A 20 ASN HA . 19880 3
202 . 1 1 20 20 ASN HB2 H 1 2.696 0.020 . . . . . A 20 ASN HB2 . 19880 3
203 . 1 1 20 20 ASN HB3 H 1 2.696 0.020 . . . . . A 20 ASN HB3 . 19880 3
204 . 1 1 20 20 ASN HD21 H 1 7.546 0.020 . . . . . A 20 ASN HD21 . 19880 3
205 . 1 1 20 20 ASN HD22 H 1 6.802 0.020 . . . . . A 20 ASN HD22 . 19880 3
206 . 1 1 20 20 ASN CA C 13 55.611 0.300 . . . . . A 20 ASN CA . 19880 3
207 . 1 1 20 20 ASN CB C 13 37.255 0.300 . . . . . A 20 ASN CB . 19880 3
208 . 1 1 20 20 ASN N N 15 117.466 0.300 . . . . . A 20 ASN N . 19880 3
209 . 1 1 20 20 ASN ND2 N 15 111.471 0.300 . . . . . A 20 ASN ND2 . 19880 3
210 . 1 1 21 21 HIS H H 1 7.827 0.020 . . . . . A 21 HIS H . 19880 3
211 . 1 1 21 21 HIS HA H 1 4.174 0.020 . . . . . A 21 HIS HA . 19880 3
212 . 1 1 21 21 HIS HB2 H 1 3.030 0.020 . . . . . A 21 HIS HB2 . 19880 3
213 . 1 1 21 21 HIS HB3 H 1 2.858 0.020 . . . . . A 21 HIS HB3 . 19880 3
214 . 1 1 21 21 HIS HD2 H 1 6.572 0.020 . . . . . A 21 HIS HD2 . 19880 3
215 . 1 1 21 21 HIS HE1 H 1 7.485 0.020 . . . . . A 21 HIS HE1 . 19880 3
216 . 1 1 21 21 HIS CA C 13 59.154 0.300 . . . . . A 21 HIS CA . 19880 3
217 . 1 1 21 21 HIS CB C 13 31.588 0.300 . . . . . A 21 HIS CB . 19880 3
218 . 1 1 21 21 HIS CD2 C 13 118.691 0.300 . . . . . A 21 HIS CD2 . 19880 3
219 . 1 1 21 21 HIS CE1 C 13 137.934 0.300 . . . . . A 21 HIS CE1 . 19880 3
220 . 1 1 21 21 HIS N N 15 120.420 0.300 . . . . . A 21 HIS N . 19880 3
221 . 1 1 22 22 CYS H H 1 8.500 0.020 . . . . . A 22 CYS H . 19880 3
222 . 1 1 22 22 CYS HA H 1 3.159 0.020 . . . . . A 22 CYS HA . 19880 3
223 . 1 1 22 22 CYS HB2 H 1 2.488 0.020 . . . . . A 22 CYS HB2 . 19880 3
224 . 1 1 22 22 CYS HB3 H 1 2.353 0.020 . . . . . A 22 CYS HB3 . 19880 3
225 . 1 1 22 22 CYS CA C 13 58.221 0.300 . . . . . A 22 CYS CA . 19880 3
226 . 1 1 22 22 CYS CB C 13 37.178 0.300 . . . . . A 22 CYS CB . 19880 3
227 . 1 1 22 22 CYS N N 15 117.510 0.300 . . . . . A 22 CYS N . 19880 3
228 . 1 1 23 23 ARG H H 1 7.985 0.020 . . . . . A 23 ARG H . 19880 3
229 . 1 1 23 23 ARG HA H 1 4.667 0.020 . . . . . A 23 ARG HA . 19880 3
230 . 1 1 23 23 ARG HB2 H 1 1.946 0.020 . . . . . A 23 ARG HB2 . 19880 3
231 . 1 1 23 23 ARG HB3 H 1 1.592 0.020 . . . . . A 23 ARG HB3 . 19880 3
232 . 1 1 23 23 ARG HG2 H 1 1.494 0.020 . . . . . A 23 ARG HG2 . 19880 3
233 . 1 1 23 23 ARG HG3 H 1 1.379 0.020 . . . . . A 23 ARG HG3 . 19880 3
234 . 1 1 23 23 ARG HD2 H 1 3.004 0.020 . . . . . A 23 ARG HD2 . 19880 3
235 . 1 1 23 23 ARG HD3 H 1 2.938 0.020 . . . . . A 23 ARG HD3 . 19880 3
236 . 1 1 23 23 ARG HE H 1 6.676 0.020 . . . . . A 23 ARG HE . 19880 3
237 . 1 1 23 23 ARG CA C 13 57.028 0.300 . . . . . A 23 ARG CA . 19880 3
238 . 1 1 23 23 ARG CB C 13 30.655 0.300 . . . . . A 23 ARG CB . 19880 3
239 . 1 1 23 23 ARG CG C 13 27.939 0.300 . . . . . A 23 ARG CG . 19880 3
240 . 1 1 23 23 ARG CD C 13 43.732 0.300 . . . . . A 23 ARG CD . 19880 3
241 . 1 1 23 23 ARG N N 15 116.564 0.300 . . . . . A 23 ARG N . 19880 3
242 . 1 1 23 23 ARG NE N 15 83.674 0.300 . . . . . A 23 ARG NE . 19880 3
243 . 1 1 24 24 SER H H 1 7.430 0.020 . . . . . A 24 SER H . 19880 3
244 . 1 1 24 24 SER HA H 1 4.552 0.020 . . . . . A 24 SER HA . 19880 3
245 . 1 1 24 24 SER HB2 H 1 3.980 0.020 . . . . . A 24 SER HB2 . 19880 3
246 . 1 1 24 24 SER HB3 H 1 3.980 0.020 . . . . . A 24 SER HB3 . 19880 3
247 . 1 1 24 24 SER CA C 13 57.592 0.300 . . . . . A 24 SER CA . 19880 3
248 . 1 1 24 24 SER CB C 13 65.284 0.300 . . . . . A 24 SER CB . 19880 3
249 . 1 1 24 24 SER N N 15 116.727 0.300 . . . . . A 24 SER N . 19880 3
250 . 1 1 25 25 CYS H H 1 8.992 0.020 . . . . . A 25 CYS H . 19880 3
251 . 1 1 25 25 CYS HA H 1 4.636 0.020 . . . . . A 25 CYS HA . 19880 3
252 . 1 1 25 25 CYS HB2 H 1 2.949 0.020 . . . . . A 25 CYS HB2 . 19880 3
253 . 1 1 25 25 CYS HB3 H 1 2.808 0.020 . . . . . A 25 CYS HB3 . 19880 3
254 . 1 1 25 25 CYS CA C 13 56.614 0.300 . . . . . A 25 CYS CA . 19880 3
255 . 1 1 25 25 CYS CB C 13 39.273 0.300 . . . . . A 25 CYS CB . 19880 3
256 . 1 1 25 25 CYS N N 15 121.909 0.300 . . . . . A 25 CYS N . 19880 3
257 . 1 1 26 26 HIS H H 1 9.256 0.020 . . . . . A 26 HIS H . 19880 3
258 . 1 1 26 26 HIS HA H 1 4.952 0.020 . . . . . A 26 HIS HA . 19880 3
259 . 1 1 26 26 HIS HB2 H 1 3.068 0.020 . . . . . A 26 HIS HB2 . 19880 3
260 . 1 1 26 26 HIS HB3 H 1 2.576 0.020 . . . . . A 26 HIS HB3 . 19880 3
261 . 1 1 26 26 HIS HD2 H 1 6.858 0.020 . . . . . A 26 HIS HD2 . 19880 3
262 . 1 1 26 26 HIS HE1 H 1 8.304 0.020 . . . . . A 26 HIS HE1 . 19880 3
263 . 1 1 26 26 HIS HE2 H 1 12.811 0.020 . . . . . A 26 HIS HE2 . 19880 3
264 . 1 1 26 26 HIS CA C 13 54.722 0.300 . . . . . A 26 HIS CA . 19880 3
265 . 1 1 26 26 HIS CB C 13 32.100 0.300 . . . . . A 26 HIS CB . 19880 3
266 . 1 1 26 26 HIS CD2 C 13 119.631 0.300 . . . . . A 26 HIS CD2 . 19880 3
267 . 1 1 26 26 HIS CE1 C 13 134.996 0.300 . . . . . A 26 HIS CE1 . 19880 3
268 . 1 1 26 26 HIS N N 15 126.609 0.300 . . . . . A 26 HIS N . 19880 3
269 . 1 1 26 26 HIS NE2 N 15 178.216 0.300 . . . . . A 26 HIS NE2 . 19880 3
270 . 1 1 27 27 ARG H H 1 8.312 0.020 . . . . . A 27 ARG H . 19880 3
271 . 1 1 27 27 ARG HA H 1 4.022 0.020 . . . . . A 27 ARG HA . 19880 3
272 . 1 1 27 27 ARG HB2 H 1 1.874 0.020 . . . . . A 27 ARG HB2 . 19880 3
273 . 1 1 27 27 ARG HB3 H 1 1.461 0.020 . . . . . A 27 ARG HB3 . 19880 3
274 . 1 1 27 27 ARG HG2 H 1 1.619 0.020 . . . . . A 27 ARG HG2 . 19880 3
275 . 1 1 27 27 ARG HG3 H 1 1.485 0.020 . . . . . A 27 ARG HG3 . 19880 3
276 . 1 1 27 27 ARG HD2 H 1 3.034 0.020 . . . . . A 27 ARG HD2 . 19880 3
277 . 1 1 27 27 ARG HD3 H 1 3.034 0.020 . . . . . A 27 ARG HD3 . 19880 3
278 . 1 1 27 27 ARG HE H 1 7.062 0.020 . . . . . A 27 ARG HE . 19880 3
279 . 1 1 27 27 ARG CA C 13 57.477 0.300 . . . . . A 27 ARG CA . 19880 3
280 . 1 1 27 27 ARG CB C 13 29.880 0.300 . . . . . A 27 ARG CB . 19880 3
281 . 1 1 27 27 ARG CG C 13 26.774 0.300 . . . . . A 27 ARG CG . 19880 3
282 . 1 1 27 27 ARG CD C 13 42.692 0.300 . . . . . A 27 ARG CD . 19880 3
283 . 1 1 27 27 ARG N N 15 122.033 0.300 . . . . . A 27 ARG N . 19880 3
284 . 1 1 27 27 ARG NE N 15 84.548 0.300 . . . . . A 27 ARG NE . 19880 3
285 . 1 1 28 28 GLY H H 1 8.494 0.020 . . . . . A 28 GLY H . 19880 3
286 . 1 1 28 28 GLY HA2 H 1 4.674 0.020 . . . . . A 28 GLY HA2 . 19880 3
287 . 1 1 28 28 GLY HA3 H 1 3.639 0.020 . . . . . A 28 GLY HA3 . 19880 3
288 . 1 1 28 28 GLY CA C 13 43.972 0.300 . . . . . A 28 GLY CA . 19880 3
289 . 1 1 28 28 GLY N N 15 119.213 0.300 . . . . . A 28 GLY N . 19880 3
290 . 1 1 29 29 ASP H H 1 8.633 0.020 . . . . . A 29 ASP H . 19880 3
291 . 1 1 29 29 ASP HA H 1 4.264 0.020 . . . . . A 29 ASP HA . 19880 3
292 . 1 1 29 29 ASP HB2 H 1 2.670 0.020 . . . . . A 29 ASP HB2 . 19880 3
293 . 1 1 29 29 ASP HB3 H 1 2.566 0.020 . . . . . A 29 ASP HB3 . 19880 3
294 . 1 1 29 29 ASP CA C 13 57.446 0.300 . . . . . A 29 ASP CA . 19880 3
295 . 1 1 29 29 ASP CB C 13 40.438 0.300 . . . . . A 29 ASP CB . 19880 3
296 . 1 1 29 29 ASP N N 15 121.258 0.300 . . . . . A 29 ASP N . 19880 3
297 . 1 1 30 30 VAL H H 1 8.031 0.020 . . . . . A 30 VAL H . 19880 3
298 . 1 1 30 30 VAL HA H 1 4.223 0.020 . . . . . A 30 VAL HA . 19880 3
299 . 1 1 30 30 VAL HB H 1 2.100 0.020 . . . . . A 30 VAL HB . 19880 3
300 . 1 1 30 30 VAL HG11 H 1 0.697 0.020 . . . . . A 30 VAL HG11 . 19880 3
301 . 1 1 30 30 VAL HG12 H 1 0.697 0.020 . . . . . A 30 VAL HG12 . 19880 3
302 . 1 1 30 30 VAL HG13 H 1 0.697 0.020 . . . . . A 30 VAL HG13 . 19880 3
303 . 1 1 30 30 VAL HG21 H 1 0.777 0.020 . . . . . A 30 VAL HG21 . 19880 3
304 . 1 1 30 30 VAL HG22 H 1 0.777 0.020 . . . . . A 30 VAL HG22 . 19880 3
305 . 1 1 30 30 VAL HG23 H 1 0.777 0.020 . . . . . A 30 VAL HG23 . 19880 3
306 . 1 1 30 30 VAL CA C 13 61.407 0.300 . . . . . A 30 VAL CA . 19880 3
307 . 1 1 30 30 VAL CB C 13 32.905 0.300 . . . . . A 30 VAL CB . 19880 3
308 . 1 1 30 30 VAL CG1 C 13 19.476 0.300 . . . . . A 30 VAL CG1 . 19880 3
309 . 1 1 30 30 VAL CG2 C 13 21.104 0.300 . . . . . A 30 VAL CG2 . 19880 3
310 . 1 1 30 30 VAL N N 15 112.703 0.300 . . . . . A 30 VAL N . 19880 3
311 . 1 1 31 31 GLY H H 1 7.517 0.020 . . . . . A 31 GLY H . 19880 3
312 . 1 1 31 31 GLY HA2 H 1 4.049 0.020 . . . . . A 31 GLY HA2 . 19880 3
313 . 1 1 31 31 GLY HA3 H 1 3.667 0.020 . . . . . A 31 GLY HA3 . 19880 3
314 . 1 1 31 31 GLY CA C 13 44.366 0.300 . . . . . A 31 GLY CA . 19880 3
315 . 1 1 31 31 GLY N N 15 109.481 0.300 . . . . . A 31 GLY N . 19880 3
316 . 1 1 32 32 CYS H H 1 8.554 0.020 . . . . . A 32 CYS H . 19880 3
317 . 1 1 32 32 CYS HA H 1 4.938 0.020 . . . . . A 32 CYS HA . 19880 3
318 . 1 1 32 32 CYS HB2 H 1 2.838 0.020 . . . . . A 32 CYS HB2 . 19880 3
319 . 1 1 32 32 CYS HB3 H 1 2.838 0.020 . . . . . A 32 CYS HB3 . 19880 3
320 . 1 1 32 32 CYS CA C 13 54.181 0.300 . . . . . A 32 CYS CA . 19880 3
321 . 1 1 32 32 CYS CB C 13 41.296 0.300 . . . . . A 32 CYS CB . 19880 3
322 . 1 1 32 32 CYS N N 15 121.673 0.300 . . . . . A 32 CYS N . 19880 3
323 . 1 1 33 33 VAL H H 1 9.025 0.020 . . . . . A 33 VAL H . 19880 3
324 . 1 1 33 33 VAL HA H 1 4.795 0.020 . . . . . A 33 VAL HA . 19880 3
325 . 1 1 33 33 VAL HB H 1 1.612 0.020 . . . . . A 33 VAL HB . 19880 3
326 . 1 1 33 33 VAL HG11 H 1 0.316 0.020 . . . . . A 33 VAL HG11 . 19880 3
327 . 1 1 33 33 VAL HG12 H 1 0.316 0.020 . . . . . A 33 VAL HG12 . 19880 3
328 . 1 1 33 33 VAL HG13 H 1 0.316 0.020 . . . . . A 33 VAL HG13 . 19880 3
329 . 1 1 33 33 VAL HG21 H 1 0.549 0.020 . . . . . A 33 VAL HG21 . 19880 3
330 . 1 1 33 33 VAL HG22 H 1 0.549 0.020 . . . . . A 33 VAL HG22 . 19880 3
331 . 1 1 33 33 VAL HG23 H 1 0.549 0.020 . . . . . A 33 VAL HG23 . 19880 3
332 . 1 1 33 33 VAL CA C 13 59.311 0.300 . . . . . A 33 VAL CA . 19880 3
333 . 1 1 33 33 VAL CB C 13 36.480 0.300 . . . . . A 33 VAL CB . 19880 3
334 . 1 1 33 33 VAL CG1 C 13 17.690 0.300 . . . . . A 33 VAL CG1 . 19880 3
335 . 1 1 33 33 VAL CG2 C 13 22.504 0.300 . . . . . A 33 VAL CG2 . 19880 3
336 . 1 1 33 33 VAL N N 15 119.401 0.300 . . . . . A 33 VAL N . 19880 3
337 . 1 1 34 34 ARG H H 1 8.347 0.020 . . . . . A 34 ARG H . 19880 3
338 . 1 1 34 34 ARG HA H 1 4.699 0.020 . . . . . A 34 ARG HA . 19880 3
339 . 1 1 34 34 ARG HB2 H 1 1.484 0.020 . . . . . A 34 ARG HB2 . 19880 3
340 . 1 1 34 34 ARG HB3 H 1 1.484 0.020 . . . . . A 34 ARG HB3 . 19880 3
341 . 1 1 34 34 ARG HG2 H 1 1.441 0.020 . . . . . A 34 ARG HG2 . 19880 3
342 . 1 1 34 34 ARG HG3 H 1 1.261 0.020 . . . . . A 34 ARG HG3 . 19880 3
343 . 1 1 34 34 ARG HD2 H 1 3.070 0.020 . . . . . A 34 ARG HD2 . 19880 3
344 . 1 1 34 34 ARG HD3 H 1 3.070 0.020 . . . . . A 34 ARG HD3 . 19880 3
345 . 1 1 34 34 ARG HE H 1 7.186 0.020 . . . . . A 34 ARG HE . 19880 3
346 . 1 1 34 34 ARG CA C 13 55.192 0.300 . . . . . A 34 ARG CA . 19880 3
347 . 1 1 34 34 ARG CB C 13 33.138 0.300 . . . . . A 34 ARG CB . 19880 3
348 . 1 1 34 34 ARG CG C 13 27.205 0.300 . . . . . A 34 ARG CG . 19880 3
349 . 1 1 34 34 ARG CD C 13 43.821 0.300 . . . . . A 34 ARG CD . 19880 3
350 . 1 1 34 34 ARG N N 15 120.394 0.300 . . . . . A 34 ARG N . 19880 3
351 . 1 1 34 34 ARG NE N 15 84.450 0.300 . . . . . A 34 ARG NE . 19880 3
352 . 1 1 35 35 CYS H H 1 8.557 0.020 . . . . . A 35 CYS H . 19880 3
353 . 1 1 35 35 CYS HA H 1 6.036 0.020 . . . . . A 35 CYS HA . 19880 3
354 . 1 1 35 35 CYS HB2 H 1 3.485 0.020 . . . . . A 35 CYS HB2 . 19880 3
355 . 1 1 35 35 CYS HB3 H 1 2.602 0.020 . . . . . A 35 CYS HB3 . 19880 3
356 . 1 1 35 35 CYS CA C 13 55.277 0.300 . . . . . A 35 CYS CA . 19880 3
357 . 1 1 35 35 CYS CB C 13 44.553 0.300 . . . . . A 35 CYS CB . 19880 3
358 . 1 1 35 35 CYS N N 15 118.098 0.300 . . . . . A 35 CYS N . 19880 3
359 . 1 1 36 36 SER H H 1 7.680 0.020 . . . . . A 36 SER H . 19880 3
360 . 1 1 36 36 SER HA H 1 4.326 0.020 . . . . . A 36 SER HA . 19880 3
361 . 1 1 36 36 SER HB2 H 1 3.723 0.020 . . . . . A 36 SER HB2 . 19880 3
362 . 1 1 36 36 SER HB3 H 1 3.684 0.020 . . . . . A 36 SER HB3 . 19880 3
363 . 1 1 36 36 SER CA C 13 60.945 0.300 . . . . . A 36 SER CA . 19880 3
364 . 1 1 36 36 SER CB C 13 64.743 0.300 . . . . . A 36 SER CB . 19880 3
365 . 1 1 36 36 SER N N 15 114.009 0.300 . . . . . A 36 SER N . 19880 3
366 . 1 1 37 37 ASN H H 1 7.755 0.020 . . . . . A 37 ASN H . 19880 3
367 . 1 1 37 37 ASN HA H 1 4.408 0.020 . . . . . A 37 ASN HA . 19880 3
368 . 1 1 37 37 ASN HB2 H 1 2.715 0.020 . . . . . A 37 ASN HB2 . 19880 3
369 . 1 1 37 37 ASN HB3 H 1 2.494 0.020 . . . . . A 37 ASN HB3 . 19880 3
370 . 1 1 37 37 ASN HD21 H 1 7.734 0.020 . . . . . A 37 ASN HD21 . 19880 3
371 . 1 1 37 37 ASN HD22 H 1 7.123 0.020 . . . . . A 37 ASN HD22 . 19880 3
372 . 1 1 37 37 ASN CA C 13 52.086 0.300 . . . . . A 37 ASN CA . 19880 3
373 . 1 1 37 37 ASN CB C 13 41.374 0.300 . . . . . A 37 ASN CB . 19880 3
374 . 1 1 37 37 ASN N N 15 117.050 0.300 . . . . . A 37 ASN N . 19880 3
375 . 1 1 37 37 ASN ND2 N 15 113.245 0.300 . . . . . A 37 ASN ND2 . 19880 3
376 . 1 1 38 38 ALA H H 1 9.325 0.020 . . . . . A 38 ALA H . 19880 3
377 . 1 1 38 38 ALA HA H 1 5.162 0.020 . . . . . A 38 ALA HA . 19880 3
378 . 1 1 38 38 ALA HB1 H 1 1.237 0.020 . . . . . A 38 ALA HB1 . 19880 3
379 . 1 1 38 38 ALA HB2 H 1 1.237 0.020 . . . . . A 38 ALA HB2 . 19880 3
380 . 1 1 38 38 ALA HB3 H 1 1.237 0.020 . . . . . A 38 ALA HB3 . 19880 3
381 . 1 1 38 38 ALA CA C 13 52.134 0.300 . . . . . A 38 ALA CA . 19880 3
382 . 1 1 38 38 ALA CB C 13 19.193 0.300 . . . . . A 38 ALA CB . 19880 3
383 . 1 1 38 38 ALA N N 15 123.735 0.300 . . . . . A 38 ALA N . 19880 3
384 . 1 1 39 39 GLN H H 1 8.745 0.020 . . . . . A 39 GLN H . 19880 3
385 . 1 1 39 39 GLN HA H 1 4.313 0.020 . . . . . A 39 GLN HA . 19880 3
386 . 1 1 39 39 GLN HB2 H 1 2.217 0.020 . . . . . A 39 GLN HB2 . 19880 3
387 . 1 1 39 39 GLN HB3 H 1 2.106 0.020 . . . . . A 39 GLN HB3 . 19880 3
388 . 1 1 39 39 GLN HG2 H 1 1.799 0.020 . . . . . A 39 GLN HG2 . 19880 3
389 . 1 1 39 39 GLN HG3 H 1 1.584 0.020 . . . . . A 39 GLN HG3 . 19880 3
390 . 1 1 39 39 GLN HE21 H 1 7.272 0.020 . . . . . A 39 GLN HE21 . 19880 3
391 . 1 1 39 39 GLN HE22 H 1 6.713 0.020 . . . . . A 39 GLN HE22 . 19880 3
392 . 1 1 39 39 GLN CA C 13 54.749 0.300 . . . . . A 39 GLN CA . 19880 3
393 . 1 1 39 39 GLN CB C 13 33.817 0.300 . . . . . A 39 GLN CB . 19880 3
394 . 1 1 39 39 GLN CG C 13 33.684 0.300 . . . . . A 39 GLN CG . 19880 3
395 . 1 1 39 39 GLN N N 15 116.531 0.300 . . . . . A 39 GLN N . 19880 3
396 . 1 1 39 39 GLN NE2 N 15 110.797 0.300 . . . . . A 39 GLN NE2 . 19880 3
397 . 1 1 40 40 CYS H H 1 8.537 0.020 . . . . . A 40 CYS H . 19880 3
398 . 1 1 40 40 CYS HA H 1 5.549 0.020 . . . . . A 40 CYS HA . 19880 3
399 . 1 1 40 40 CYS HB2 H 1 3.271 0.020 . . . . . A 40 CYS HB2 . 19880 3
400 . 1 1 40 40 CYS HB3 H 1 2.691 0.020 . . . . . A 40 CYS HB3 . 19880 3
401 . 1 1 40 40 CYS CA C 13 54.413 0.300 . . . . . A 40 CYS CA . 19880 3
402 . 1 1 40 40 CYS CB C 13 40.902 0.300 . . . . . A 40 CYS CB . 19880 3
403 . 1 1 40 40 CYS N N 15 122.074 0.300 . . . . . A 40 CYS N . 19880 3
404 . 1 1 41 41 THR H H 1 9.779 0.020 . . . . . A 41 THR H . 19880 3
405 . 1 1 41 41 THR HA H 1 4.641 0.020 . . . . . A 41 THR HA . 19880 3
406 . 1 1 41 41 THR HB H 1 4.254 0.020 . . . . . A 41 THR HB . 19880 3
407 . 1 1 41 41 THR HG21 H 1 1.016 0.020 . . . . . A 41 THR HG21 . 19880 3
408 . 1 1 41 41 THR HG22 H 1 1.016 0.020 . . . . . A 41 THR HG22 . 19880 3
409 . 1 1 41 41 THR HG23 H 1 1.016 0.020 . . . . . A 41 THR HG23 . 19880 3
410 . 1 1 41 41 THR CA C 13 60.550 0.300 . . . . . A 41 THR CA . 19880 3
411 . 1 1 41 41 THR CB C 13 71.033 0.300 . . . . . A 41 THR CB . 19880 3
412 . 1 1 41 41 THR CG2 C 13 21.495 0.300 . . . . . A 41 THR CG2 . 19880 3
413 . 1 1 41 41 THR N N 15 117.753 0.300 . . . . . A 41 THR N . 19880 3
414 . 1 1 42 42 GLY H H 1 8.251 0.020 . . . . . A 42 GLY H . 19880 3
415 . 1 1 42 42 GLY HA2 H 1 4.401 0.020 . . . . . A 42 GLY HA2 . 19880 3
416 . 1 1 42 42 GLY HA3 H 1 3.714 0.020 . . . . . A 42 GLY HA3 . 19880 3
417 . 1 1 42 42 GLY CA C 13 44.015 0.300 . . . . . A 42 GLY CA . 19880 3
418 . 1 1 42 42 GLY N N 15 105.809 0.300 . . . . . A 42 GLY N . 19880 3
419 . 1 1 43 43 PHE H H 1 8.710 0.020 . . . . . A 43 PHE H . 19880 3
420 . 1 1 43 43 PHE HA H 1 4.298 0.020 . . . . . A 43 PHE HA . 19880 3
421 . 1 1 43 43 PHE HB2 H 1 3.095 0.020 . . . . . A 43 PHE HB2 . 19880 3
422 . 1 1 43 43 PHE HB3 H 1 2.837 0.020 . . . . . A 43 PHE HB3 . 19880 3
423 . 1 1 43 43 PHE HD1 H 1 7.171 0.020 . . . . . A 43 PHE HD1 . 19880 3
424 . 1 1 43 43 PHE HD2 H 1 7.171 0.020 . . . . . A 43 PHE HD2 . 19880 3
425 . 1 1 43 43 PHE HE1 H 1 7.264 0.020 . . . . . A 43 PHE HE1 . 19880 3
426 . 1 1 43 43 PHE HE2 H 1 7.264 0.020 . . . . . A 43 PHE HE2 . 19880 3
427 . 1 1 43 43 PHE HZ H 1 7.214 0.020 . . . . . A 43 PHE HZ . 19880 3
428 . 1 1 43 43 PHE CA C 13 60.196 0.300 . . . . . A 43 PHE CA . 19880 3
429 . 1 1 43 43 PHE CB C 13 38.650 0.300 . . . . . A 43 PHE CB . 19880 3
430 . 1 1 43 43 PHE CD1 C 13 131.577 0.300 . . . . . A 43 PHE CD1 . 19880 3
431 . 1 1 43 43 PHE CE1 C 13 131.537 0.300 . . . . . A 43 PHE CE1 . 19880 3
432 . 1 1 43 43 PHE CZ C 13 129.967 0.300 . . . . . A 43 PHE CZ . 19880 3
433 . 1 1 43 43 PHE N N 15 123.293 0.300 . . . . . A 43 PHE N . 19880 3
434 . 1 1 44 44 LEU H H 1 8.734 0.020 . . . . . A 44 LEU H . 19880 3
435 . 1 1 44 44 LEU HA H 1 3.848 0.020 . . . . . A 44 LEU HA . 19880 3
436 . 1 1 44 44 LEU HB2 H 1 1.518 0.020 . . . . . A 44 LEU HB2 . 19880 3
437 . 1 1 44 44 LEU HB3 H 1 1.387 0.020 . . . . . A 44 LEU HB3 . 19880 3
438 . 1 1 44 44 LEU HG H 1 1.239 0.020 . . . . . A 44 LEU HG . 19880 3
439 . 1 1 44 44 LEU HD11 H 1 0.619 0.020 . . . . . A 44 LEU HD11 . 19880 3
440 . 1 1 44 44 LEU HD12 H 1 0.619 0.020 . . . . . A 44 LEU HD12 . 19880 3
441 . 1 1 44 44 LEU HD13 H 1 0.619 0.020 . . . . . A 44 LEU HD13 . 19880 3
442 . 1 1 44 44 LEU HD21 H 1 0.508 0.020 . . . . . A 44 LEU HD21 . 19880 3
443 . 1 1 44 44 LEU HD22 H 1 0.508 0.020 . . . . . A 44 LEU HD22 . 19880 3
444 . 1 1 44 44 LEU HD23 H 1 0.508 0.020 . . . . . A 44 LEU HD23 . 19880 3
445 . 1 1 44 44 LEU CB C 13 40.386 0.300 . . . . . A 44 LEU CB . 19880 3
446 . 1 1 44 44 LEU CG C 13 27.472 0.300 . . . . . A 44 LEU CG . 19880 3
447 . 1 1 44 44 LEU CD1 C 13 25.609 0.300 . . . . . A 44 LEU CD1 . 19880 3
448 . 1 1 44 44 LEU CD2 C 13 22.119 0.300 . . . . . A 44 LEU CD2 . 19880 3
449 . 1 1 44 44 LEU N N 15 120.771 0.300 . . . . . A 44 LEU N . 19880 3
450 . 1 1 45 45 GLY H H 1 7.831 0.020 . . . . . A 45 GLY H . 19880 3
451 . 1 1 45 45 GLY HA2 H 1 3.563 0.020 . . . . . A 45 GLY HA2 . 19880 3
452 . 1 1 45 45 GLY HA3 H 1 3.162 0.020 . . . . . A 45 GLY HA3 . 19880 3
453 . 1 1 45 45 GLY CA C 13 47.311 0.300 . . . . . A 45 GLY CA . 19880 3
454 . 1 1 45 45 GLY N N 15 107.545 0.300 . . . . . A 45 GLY N . 19880 3
455 . 1 1 46 46 THR H H 1 6.820 0.020 . . . . . A 46 THR H . 19880 3
456 . 1 1 46 46 THR HA H 1 3.901 0.020 . . . . . A 46 THR HA . 19880 3
457 . 1 1 46 46 THR HB H 1 4.269 0.020 . . . . . A 46 THR HB . 19880 3
458 . 1 1 46 46 THR HG21 H 1 1.011 0.020 . . . . . A 46 THR HG21 . 19880 3
459 . 1 1 46 46 THR HG22 H 1 1.011 0.020 . . . . . A 46 THR HG22 . 19880 3
460 . 1 1 46 46 THR HG23 H 1 1.011 0.020 . . . . . A 46 THR HG23 . 19880 3
461 . 1 1 46 46 THR CA C 13 62.180 0.300 . . . . . A 46 THR CA . 19880 3
462 . 1 1 46 46 THR CB C 13 70.021 0.300 . . . . . A 46 THR CB . 19880 3
463 . 1 1 46 46 THR CG2 C 13 21.959 0.300 . . . . . A 46 THR CG2 . 19880 3
464 . 1 1 46 46 THR N N 15 104.485 0.300 . . . . . A 46 THR N . 19880 3
465 . 1 1 47 47 THR H H 1 8.745 0.020 . . . . . A 47 THR H . 19880 3
466 . 1 1 47 47 THR HA H 1 4.371 0.020 . . . . . A 47 THR HA . 19880 3
467 . 1 1 47 47 THR HB H 1 3.760 0.020 . . . . . A 47 THR HB . 19880 3
468 . 1 1 47 47 THR HG21 H 1 1.010 0.020 . . . . . A 47 THR HG21 . 19880 3
469 . 1 1 47 47 THR HG22 H 1 1.010 0.020 . . . . . A 47 THR HG22 . 19880 3
470 . 1 1 47 47 THR HG23 H 1 1.010 0.020 . . . . . A 47 THR HG23 . 19880 3
471 . 1 1 47 47 THR CA C 13 62.843 0.300 . . . . . A 47 THR CA . 19880 3
472 . 1 1 47 47 THR CB C 13 70.176 0.300 . . . . . A 47 THR CB . 19880 3
473 . 1 1 47 47 THR CG2 C 13 21.391 0.300 . . . . . A 47 THR CG2 . 19880 3
474 . 1 1 47 47 THR N N 15 123.300 0.300 . . . . . A 47 THR N . 19880 3
475 . 1 1 48 48 CYS H H 1 9.265 0.020 . . . . . A 48 CYS H . 19880 3
476 . 1 1 48 48 CYS HA H 1 4.967 0.020 . . . . . A 48 CYS HA . 19880 3
477 . 1 1 48 48 CYS HB2 H 1 2.998 0.020 . . . . . A 48 CYS HB2 . 19880 3
478 . 1 1 48 48 CYS HB3 H 1 2.921 0.020 . . . . . A 48 CYS HB3 . 19880 3
479 . 1 1 48 48 CYS CA C 13 55.984 0.300 . . . . . A 48 CYS CA . 19880 3
480 . 1 1 48 48 CYS CB C 13 36.282 0.300 . . . . . A 48 CYS CB . 19880 3
481 . 1 1 48 48 CYS N N 15 128.024 0.300 . . . . . A 48 CYS N . 19880 3
482 . 1 1 49 49 THR H H 1 9.174 0.020 . . . . . A 49 THR H . 19880 3
483 . 1 1 49 49 THR HA H 1 4.364 0.020 . . . . . A 49 THR HA . 19880 3
484 . 1 1 49 49 THR HB H 1 3.873 0.020 . . . . . A 49 THR HB . 19880 3
485 . 1 1 49 49 THR HG21 H 1 1.061 0.020 . . . . . A 49 THR HG21 . 19880 3
486 . 1 1 49 49 THR HG22 H 1 1.061 0.020 . . . . . A 49 THR HG22 . 19880 3
487 . 1 1 49 49 THR HG23 H 1 1.061 0.020 . . . . . A 49 THR HG23 . 19880 3
488 . 1 1 49 49 THR CA C 13 61.871 0.300 . . . . . A 49 THR CA . 19880 3
489 . 1 1 49 49 THR CB C 13 69.789 0.300 . . . . . A 49 THR CB . 19880 3
490 . 1 1 49 49 THR CG2 C 13 21.671 0.300 . . . . . A 49 THR CG2 . 19880 3
491 . 1 1 49 49 THR N N 15 131.810 0.300 . . . . . A 49 THR N . 19880 3
492 . 1 1 50 50 CYS H H 1 8.856 0.020 . . . . . A 50 CYS H . 19880 3
493 . 1 1 50 50 CYS HA H 1 5.027 0.020 . . . . . A 50 CYS HA . 19880 3
494 . 1 1 50 50 CYS HB2 H 1 2.879 0.020 . . . . . A 50 CYS HB2 . 19880 3
495 . 1 1 50 50 CYS HB3 H 1 3.157 0.020 . . . . . A 50 CYS HB3 . 19880 3
496 . 1 1 50 50 CYS CA C 13 51.880 0.300 . . . . . A 50 CYS CA . 19880 3
497 . 1 1 50 50 CYS CB C 13 34.934 0.300 . . . . . A 50 CYS CB . 19880 3
498 . 1 1 50 50 CYS N N 15 123.835 0.300 . . . . . A 50 CYS N . 19880 3
499 . 1 1 51 51 ILE H H 1 8.096 0.020 . . . . . A 51 ILE H . 19880 3
500 . 1 1 51 51 ILE HA H 1 4.141 0.020 . . . . . A 51 ILE HA . 19880 3
501 . 1 1 51 51 ILE HB H 1 1.066 0.020 . . . . . A 51 ILE HB . 19880 3
502 . 1 1 51 51 ILE HG12 H 1 1.220 0.020 . . . . . A 51 ILE HG12 . 19880 3
503 . 1 1 51 51 ILE HG13 H 1 1.015 0.020 . . . . . A 51 ILE HG13 . 19880 3
504 . 1 1 51 51 ILE HG21 H 1 1.011 0.020 . . . . . A 51 ILE HG21 . 19880 3
505 . 1 1 51 51 ILE HG22 H 1 1.011 0.020 . . . . . A 51 ILE HG22 . 19880 3
506 . 1 1 51 51 ILE HG23 H 1 1.011 0.020 . . . . . A 51 ILE HG23 . 19880 3
507 . 1 1 51 51 ILE HD11 H 1 0.526 0.020 . . . . . A 51 ILE HD11 . 19880 3
508 . 1 1 51 51 ILE HD12 H 1 0.526 0.020 . . . . . A 51 ILE HD12 . 19880 3
509 . 1 1 51 51 ILE HD13 H 1 0.526 0.020 . . . . . A 51 ILE HD13 . 19880 3
510 . 1 1 51 51 ILE CA C 13 59.619 0.300 . . . . . A 51 ILE CA . 19880 3
511 . 1 1 51 51 ILE CB C 13 39.380 0.300 . . . . . A 51 ILE CB . 19880 3
512 . 1 1 51 51 ILE CG1 C 13 26.813 0.300 . . . . . A 51 ILE CG1 . 19880 3
513 . 1 1 51 51 ILE CG2 C 13 16.136 0.300 . . . . . A 51 ILE CG2 . 19880 3
514 . 1 1 51 51 ILE CD1 C 13 11.167 0.300 . . . . . A 51 ILE CD1 . 19880 3
515 . 1 1 51 51 ILE N N 15 123.986 0.300 . . . . . A 51 ILE N . 19880 3
516 . 1 1 52 52 ASN H H 1 8.329 0.020 . . . . . A 52 ASN H . 19880 3
517 . 1 1 52 52 ASN HA H 1 4.716 0.020 . . . . . A 52 ASN HA . 19880 3
518 . 1 1 52 52 ASN HB2 H 1 2.655 0.020 . . . . . A 52 ASN HB2 . 19880 3
519 . 1 1 52 52 ASN HB3 H 1 2.525 0.020 . . . . . A 52 ASN HB3 . 19880 3
520 . 1 1 52 52 ASN HD21 H 1 7.435 0.020 . . . . . A 52 ASN HD21 . 19880 3
521 . 1 1 52 52 ASN HD22 H 1 6.760 0.020 . . . . . A 52 ASN HD22 . 19880 3
522 . 1 1 52 52 ASN CA C 13 52.891 0.300 . . . . . A 52 ASN CA . 19880 3
523 . 1 1 52 52 ASN CB C 13 37.913 0.300 . . . . . A 52 ASN CB . 19880 3
524 . 1 1 52 52 ASN N N 15 126.122 0.300 . . . . . A 52 ASN N . 19880 3
525 . 1 1 52 52 ASN ND2 N 15 111.646 0.300 . . . . . A 52 ASN ND2 . 19880 3
526 . 1 1 53 53 PRO HA H 1 4.307 0.020 . . . . . A 53 PRO HA . 19880 3
527 . 1 1 53 53 PRO HB2 H 1 2.396 0.020 . . . . . A 53 PRO HB2 . 19880 3
528 . 1 1 53 53 PRO HB3 H 1 1.983 0.020 . . . . . A 53 PRO HB3 . 19880 3
529 . 1 1 53 53 PRO HG2 H 1 1.915 0.020 . . . . . A 53 PRO HG2 . 19880 3
530 . 1 1 53 53 PRO HG3 H 1 1.792 0.020 . . . . . A 53 PRO HG3 . 19880 3
531 . 1 1 53 53 PRO HD2 H 1 3.578 0.020 . . . . . A 53 PRO HD2 . 19880 3
532 . 1 1 53 53 PRO HD3 H 1 3.503 0.020 . . . . . A 53 PRO HD3 . 19880 3
533 . 1 1 53 53 PRO CA C 13 63.033 0.300 . . . . . A 53 PRO CA . 19880 3
534 . 1 1 53 53 PRO CB C 13 35.860 0.300 . . . . . A 53 PRO CB . 19880 3
535 . 1 1 53 53 PRO CG C 13 25.454 0.300 . . . . . A 53 PRO CG . 19880 3
536 . 1 1 53 53 PRO CD C 13 51.623 0.300 . . . . . A 53 PRO CD . 19880 3
537 . 1 1 54 54 CYS H H 1 8.870 0.020 . . . . . A 54 CYS H . 19880 3
538 . 1 1 54 54 CYS HA H 1 5.736 0.020 . . . . . A 54 CYS HA . 19880 3
539 . 1 1 54 54 CYS HB2 H 1 3.068 0.020 . . . . . A 54 CYS HB2 . 19880 3
540 . 1 1 54 54 CYS HB3 H 1 2.647 0.020 . . . . . A 54 CYS HB3 . 19880 3
541 . 1 1 54 54 CYS CA C 13 54.150 0.300 . . . . . A 54 CYS CA . 19880 3
542 . 1 1 54 54 CYS CB C 13 46.154 0.300 . . . . . A 54 CYS CB . 19880 3
543 . 1 1 54 54 CYS N N 15 123.090 0.300 . . . . . A 54 CYS N . 19880 3
544 . 1 1 55 55 PRO HA H 1 4.280 0.020 . . . . . A 55 PRO HA . 19880 3
545 . 1 1 55 55 PRO HB2 H 1 2.151 0.020 . . . . . A 55 PRO HB2 . 19880 3
546 . 1 1 55 55 PRO HB3 H 1 1.879 0.020 . . . . . A 55 PRO HB3 . 19880 3
547 . 1 1 55 55 PRO HG2 H 1 1.875 0.020 . . . . . A 55 PRO HG2 . 19880 3
548 . 1 1 55 55 PRO HG3 H 1 1.772 0.020 . . . . . A 55 PRO HG3 . 19880 3
549 . 1 1 55 55 PRO HD2 H 1 4.219 0.020 . . . . . A 55 PRO HD2 . 19880 3
550 . 1 1 55 55 PRO HD3 H 1 3.014 0.020 . . . . . A 55 PRO HD3 . 19880 3
551 . 1 1 55 55 PRO CA C 13 62.258 0.300 . . . . . A 55 PRO CA . 19880 3
552 . 1 1 55 55 PRO CB C 13 32.450 0.300 . . . . . A 55 PRO CB . 19880 3
553 . 1 1 55 55 PRO CG C 13 27.369 0.300 . . . . . A 55 PRO CG . 19880 3
554 . 1 1 55 55 PRO CD C 13 50.457 0.300 . . . . . A 55 PRO CD . 19880 3
555 . 1 1 56 56 ARG H H 1 7.888 0.020 . . . . . A 56 ARG H . 19880 3
556 . 1 1 56 56 ARG HA H 1 4.485 0.020 . . . . . A 56 ARG HA . 19880 3
557 . 1 1 56 56 ARG HB2 H 1 1.805 0.020 . . . . . A 56 ARG HB2 . 19880 3
558 . 1 1 56 56 ARG HB3 H 1 1.662 0.020 . . . . . A 56 ARG HB3 . 19880 3
559 . 1 1 56 56 ARG HG2 H 1 1.680 0.020 . . . . . A 56 ARG HG2 . 19880 3
560 . 1 1 56 56 ARG HG3 H 1 1.566 0.020 . . . . . A 56 ARG HG3 . 19880 3
561 . 1 1 56 56 ARG HD2 H 1 3.103 0.020 . . . . . A 56 ARG HD2 . 19880 3
562 . 1 1 56 56 ARG HD3 H 1 3.103 0.020 . . . . . A 56 ARG HD3 . 19880 3
563 . 1 1 56 56 ARG HE H 1 7.149 0.020 . . . . . A 56 ARG HE . 19880 3
564 . 1 1 56 56 ARG CA C 13 56.121 0.300 . . . . . A 56 ARG CA . 19880 3
565 . 1 1 56 56 ARG CB C 13 30.539 0.300 . . . . . A 56 ARG CB . 19880 3
566 . 1 1 56 56 ARG CG C 13 27.355 0.300 . . . . . A 56 ARG CG . 19880 3
567 . 1 1 56 56 ARG CD C 13 42.891 0.300 . . . . . A 56 ARG CD . 19880 3
568 . 1 1 56 56 ARG N N 15 117.289 0.300 . . . . . A 56 ARG N . 19880 3
569 . 1 1 56 56 ARG NE N 15 84.459 0.300 . . . . . A 56 ARG NE . 19880 3
570 . 1 1 57 57 CYS H H 1 7.776 0.020 . . . . . A 57 CYS H . 19880 3
571 . 1 1 57 57 CYS HA H 1 4.397 0.020 . . . . . A 57 CYS HA . 19880 3
572 . 1 1 57 57 CYS HB2 H 1 3.051 0.020 . . . . . A 57 CYS HB2 . 19880 3
573 . 1 1 57 57 CYS HB3 H 1 3.156 0.020 . . . . . A 57 CYS HB3 . 19880 3
574 . 1 1 57 57 CYS CA C 13 56.590 0.300 . . . . . A 57 CYS CA . 19880 3
575 . 1 1 57 57 CYS CB C 13 47.191 0.300 . . . . . A 57 CYS CB . 19880 3
576 . 1 1 57 57 CYS N N 15 124.031 0.300 . . . . . A 57 CYS N . 19880 3
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