Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30720
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_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-1H TOCSY' . . . 30720 1
2 '2D 1H-1H NOESY' . . . 30720 1
3 '2D 1H-15N HSQC' . . . 30720 1
4 '2D 1H-1H NOESY' . . . 30720 1
5 '2D 1H-13C HSQC aliphatic' . . . 30720 1
6 '2D 1H-1H ECOSY' . . . 30720 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 LYS HA H 1 4.167 0.002 . 1 . . . . A 1 LYS HA . 30720 1
2 . 1 . 1 1 1 LYS HB2 H 1 1.980 0.003 . 2 . . . . A 1 LYS HB2 . 30720 1
3 . 1 . 1 1 1 LYS HB3 H 1 1.980 0.003 . 2 . . . . A 1 LYS HB3 . 30720 1
4 . 1 . 1 1 1 LYS HG2 H 1 1.510 0.001 . 2 . . . . A 1 LYS HG2 . 30720 1
5 . 1 . 1 1 1 LYS HG3 H 1 1.510 0.001 . 2 . . . . A 1 LYS HG3 . 30720 1
6 . 1 . 1 1 1 LYS HD2 H 1 1.722 0.000 . 2 . . . . A 1 LYS HD2 . 30720 1
7 . 1 . 1 1 1 LYS HD3 H 1 1.722 0.000 . 2 . . . . A 1 LYS HD3 . 30720 1
8 . 1 . 1 1 1 LYS HE2 H 1 3.020 0.001 . 2 . . . . A 1 LYS HE2 . 30720 1
9 . 1 . 1 1 1 LYS HE3 H 1 3.020 0.001 . 2 . . . . A 1 LYS HE3 . 30720 1
10 . 1 . 1 1 1 LYS HZ1 H 1 7.560 0.001 . 1 . . . . A 1 LYS HZ1 . 30720 1
11 . 1 . 1 1 1 LYS HZ2 H 1 7.560 0.001 . 1 . . . . A 1 LYS HZ2 . 30720 1
12 . 1 . 1 1 1 LYS HZ3 H 1 7.560 0.001 . 1 . . . . A 1 LYS HZ3 . 30720 1
13 . 1 . 1 1 1 LYS CA C 13 55.884 0.000 . 1 . . . . A 1 LYS CA . 30720 1
14 . 1 . 1 1 1 LYS CB C 13 33.301 0.000 . 1 . . . . A 1 LYS CB . 30720 1
15 . 1 . 1 1 1 LYS CG C 13 24.355 0.000 . 1 . . . . A 1 LYS CG . 30720 1
16 . 1 . 1 1 1 LYS CD C 13 29.300 0.000 . 1 . . . . A 1 LYS CD . 30720 1
17 . 1 . 1 2 2 THR H H 1 8.537 0.002 . 1 . . . . A 2 THR H . 30720 1
18 . 1 . 1 2 2 THR HA H 1 5.157 0.007 . 1 . . . . A 2 THR HA . 30720 1
19 . 1 . 1 2 2 THR HB H 1 4.078 0.003 . 1 . . . . A 2 THR HB . 30720 1
20 . 1 . 1 2 2 THR HG21 H 1 1.093 0.003 . 0 . . . . A 2 THR HG21 . 30720 1
21 . 1 . 1 2 2 THR HG22 H 1 1.093 0.003 . 0 . . . . A 2 THR HG22 . 30720 1
22 . 1 . 1 2 2 THR HG23 H 1 1.093 0.003 . 0 . . . . A 2 THR HG23 . 30720 1
23 . 1 . 1 2 2 THR CA C 13 60.985 0.000 . 1 . . . . A 2 THR CA . 30720 1
24 . 1 . 1 2 2 THR CB C 13 69.663 0.000 . 1 . . . . A 2 THR CB . 30720 1
25 . 1 . 1 2 2 THR CG2 C 13 21.403 0.000 . 1 . . . . A 2 THR CG2 . 30720 1
26 . 1 . 1 2 2 THR N N 15 114.708 0.000 . 1 . . . . A 2 THR N . 30720 1
27 . 1 . 1 3 3 CYS H H 1 9.039 0.003 . 1 . . . . A 3 CYS H . 30720 1
28 . 1 . 1 3 3 CYS HA H 1 5.076 0.003 . 1 . . . . A 3 CYS HA . 30720 1
29 . 1 . 1 3 3 CYS HB2 H 1 2.996 0.005 . 2 . . . . A 3 CYS HB2 . 30720 1
30 . 1 . 1 3 3 CYS HB3 H 1 2.825 0.005 . 2 . . . . A 3 CYS HB3 . 30720 1
31 . 1 . 1 3 3 CYS CA C 13 58.011 0.000 . 1 . . . . A 3 CYS CA . 30720 1
32 . 1 . 1 3 3 CYS CB C 13 40.305 0.053 . 1 . . . . A 3 CYS CB . 30720 1
33 . 1 . 1 3 3 CYS N N 15 120.438 0.000 . 1 . . . . A 3 CYS N . 30720 1
34 . 1 . 1 4 4 GLU H H 1 8.695 0.002 . 1 . . . . A 4 GLU H . 30720 1
35 . 1 . 1 4 4 GLU HA H 1 5.534 0.002 . 1 . . . . A 4 GLU HA . 30720 1
36 . 1 . 1 4 4 GLU HB2 H 1 2.065 0.002 . 2 . . . . A 4 GLU HB2 . 30720 1
37 . 1 . 1 4 4 GLU HB3 H 1 1.811 0.004 . 2 . . . . A 4 GLU HB3 . 30720 1
38 . 1 . 1 4 4 GLU HG2 H 1 2.287 0.004 . 2 . . . . A 4 GLU HG2 . 30720 1
39 . 1 . 1 4 4 GLU HG3 H 1 2.216 0.003 . 2 . . . . A 4 GLU HG3 . 30720 1
40 . 1 . 1 4 4 GLU CA C 13 54.953 0.000 . 1 . . . . A 4 GLU CA . 30720 1
41 . 1 . 1 4 4 GLU CB C 13 32.676 0.021 . 1 . . . . A 4 GLU CB . 30720 1
42 . 1 . 1 4 4 GLU CG C 13 37.702 0.034 . 1 . . . . A 4 GLU CG . 30720 1
43 . 1 . 1 4 4 GLU N N 15 122.784 0.000 . 1 . . . . A 4 GLU N . 30720 1
44 . 1 . 1 5 5 ASN H H 1 9.146 0.003 . 1 . . . . A 5 ASN H . 30720 1
45 . 1 . 1 5 5 ASN HA H 1 5.270 0.002 . 1 . . . . A 5 ASN HA . 30720 1
46 . 1 . 1 5 5 ASN HB2 H 1 2.714 0.003 . 2 . . . . A 5 ASN HB2 . 30720 1
47 . 1 . 1 5 5 ASN HB3 H 1 2.538 0.003 . 2 . . . . A 5 ASN HB3 . 30720 1
48 . 1 . 1 5 5 ASN HD21 H 1 7.696 0.003 . 2 . . . . A 5 ASN HD21 . 30720 1
49 . 1 . 1 5 5 ASN HD22 H 1 6.804 0.006 . 2 . . . . A 5 ASN HD22 . 30720 1
50 . 1 . 1 5 5 ASN CA C 13 52.233 0.000 . 1 . . . . A 5 ASN CA . 30720 1
51 . 1 . 1 5 5 ASN CB C 13 43.431 0.010 . 1 . . . . A 5 ASN CB . 30720 1
52 . 1 . 1 5 5 ASN N N 15 122.064 0.000 . 1 . . . . A 5 ASN N . 30720 1
53 . 1 . 1 5 5 ASN ND2 N 15 112.080 0.004 . 1 . . . . A 5 ASN ND2 . 30720 1
54 . 1 . 1 6 6 LEU H H 1 8.230 0.002 . 1 . . . . A 6 LEU H . 30720 1
55 . 1 . 1 6 6 LEU HA H 1 3.076 0.002 . 1 . . . . A 6 LEU HA . 30720 1
56 . 1 . 1 6 6 LEU HB2 H 1 0.973 0.004 . 2 . . . . A 6 LEU HB2 . 30720 1
57 . 1 . 1 6 6 LEU HB3 H 1 0.842 0.007 . 2 . . . . A 6 LEU HB3 . 30720 1
58 . 1 . 1 6 6 LEU HG H 1 0.219 0.002 . 1 . . . . A 6 LEU HG . 30720 1
59 . 1 . 1 6 6 LEU HD11 H 1 0.438 0.001 . 0 . . . . A 6 LEU HD11 . 30720 1
60 . 1 . 1 6 6 LEU HD12 H 1 0.438 0.001 . 0 . . . . A 6 LEU HD12 . 30720 1
61 . 1 . 1 6 6 LEU HD13 H 1 0.438 0.001 . 0 . . . . A 6 LEU HD13 . 30720 1
62 . 1 . 1 6 6 LEU HD21 H 1 0.026 0.004 . 0 . . . . A 6 LEU HD21 . 30720 1
63 . 1 . 1 6 6 LEU HD22 H 1 0.026 0.004 . 0 . . . . A 6 LEU HD22 . 30720 1
64 . 1 . 1 6 6 LEU HD23 H 1 0.026 0.004 . 0 . . . . A 6 LEU HD23 . 30720 1
65 . 1 . 1 6 6 LEU CA C 13 55.891 0.000 . 1 . . . . A 6 LEU CA . 30720 1
66 . 1 . 1 6 6 LEU CB C 13 42.210 0.026 . 1 . . . . A 6 LEU CB . 30720 1
67 . 1 . 1 6 6 LEU CG C 13 26.558 0.000 . 1 . . . . A 6 LEU CG . 30720 1
68 . 1 . 1 6 6 LEU CD1 C 13 24.647 0.000 . 2 . . . . A 6 LEU CD1 . 30720 1
69 . 1 . 1 6 6 LEU CD2 C 13 24.237 0.000 . 2 . . . . A 6 LEU CD2 . 30720 1
70 . 1 . 1 7 7 ALA H H 1 8.591 0.001 . 1 . . . . A 7 ALA H . 30720 1
71 . 1 . 1 7 7 ALA HA H 1 4.427 0.004 . 1 . . . . A 7 ALA HA . 30720 1
72 . 1 . 1 7 7 ALA HB1 H 1 1.298 0.007 . 0 . . . . A 7 ALA HB1 . 30720 1
73 . 1 . 1 7 7 ALA HB2 H 1 1.298 0.007 . 0 . . . . A 7 ALA HB2 . 30720 1
74 . 1 . 1 7 7 ALA HB3 H 1 1.298 0.007 . 0 . . . . A 7 ALA HB3 . 30720 1
75 . 1 . 1 7 7 ALA CA C 13 51.683 0.000 . 1 . . . . A 7 ALA CA . 30720 1
76 . 1 . 1 7 7 ALA CB C 13 19.538 0.000 . 1 . . . . A 7 ALA CB . 30720 1
77 . 1 . 1 8 8 ASP H H 1 9.151 0.002 . 1 . . . . A 8 ASP H . 30720 1
78 . 1 . 1 8 8 ASP HA H 1 4.505 0.003 . 1 . . . . A 8 ASP HA . 30720 1
79 . 1 . 1 8 8 ASP HB2 H 1 2.734 0.006 . 2 . . . . A 8 ASP HB2 . 30720 1
80 . 1 . 1 8 8 ASP HB3 H 1 2.734 0.006 . 2 . . . . A 8 ASP HB3 . 30720 1
81 . 1 . 1 8 8 ASP CA C 13 56.121 0.000 . 1 . . . . A 8 ASP CA . 30720 1
82 . 1 . 1 8 8 ASP CB C 13 41.000 0.000 . 1 . . . . A 8 ASP CB . 30720 1
83 . 1 . 1 8 8 ASP N N 15 124.794 0.000 . 1 . . . . A 8 ASP N . 30720 1
84 . 1 . 1 9 9 THR H H 1 8.175 0.002 . 1 . . . . A 9 THR H . 30720 1
85 . 1 . 1 9 9 THR HA H 1 4.354 0.002 . 1 . . . . A 9 THR HA . 30720 1
86 . 1 . 1 9 9 THR HB H 1 4.585 0.003 . 1 . . . . A 9 THR HB . 30720 1
87 . 1 . 1 9 9 THR HG21 H 1 1.156 0.003 . 0 . . . . A 9 THR HG21 . 30720 1
88 . 1 . 1 9 9 THR HG22 H 1 1.156 0.003 . 0 . . . . A 9 THR HG22 . 30720 1
89 . 1 . 1 9 9 THR HG23 H 1 1.156 0.003 . 0 . . . . A 9 THR HG23 . 30720 1
90 . 1 . 1 9 9 THR CA C 13 60.995 0.000 . 1 . . . . A 9 THR CA . 30720 1
91 . 1 . 1 9 9 THR CB C 13 69.138 0.006 . 1 . . . . A 9 THR CB . 30720 1
92 . 1 . 1 9 9 THR CG2 C 13 21.953 0.000 . 1 . . . . A 9 THR CG2 . 30720 1
93 . 1 . 1 10 10 TYR H H 1 7.041 0.002 . 1 . . . . A 10 TYR H . 30720 1
94 . 1 . 1 10 10 TYR HA H 1 3.674 0.003 . 1 . . . . A 10 TYR HA . 30720 1
95 . 1 . 1 10 10 TYR HB2 H 1 2.815 0.001 . 2 . . . . A 10 TYR HB2 . 30720 1
96 . 1 . 1 10 10 TYR HB3 H 1 1.590 0.002 . 2 . . . . A 10 TYR HB3 . 30720 1
97 . 1 . 1 10 10 TYR HD1 H 1 6.625 0.003 . 3 . . . . A 10 TYR HD1 . 30720 1
98 . 1 . 1 10 10 TYR HD2 H 1 6.625 0.003 . 3 . . . . A 10 TYR HD2 . 30720 1
99 . 1 . 1 10 10 TYR HE1 H 1 6.424 0.002 . 3 . . . . A 10 TYR HE1 . 30720 1
100 . 1 . 1 10 10 TYR HE2 H 1 6.424 0.002 . 3 . . . . A 10 TYR HE2 . 30720 1
101 . 1 . 1 10 10 TYR CA C 13 58.647 0.000 . 1 . . . . A 10 TYR CA . 30720 1
102 . 1 . 1 10 10 TYR CB C 13 38.930 0.011 . 1 . . . . A 10 TYR CB . 30720 1
103 . 1 . 1 11 11 LYS H H 1 7.946 0.003 . 1 . . . . A 11 LYS H . 30720 1
104 . 1 . 1 11 11 LYS HA H 1 4.316 0.003 . 1 . . . . A 11 LYS HA . 30720 1
105 . 1 . 1 11 11 LYS HB2 H 1 1.600 0.022 . 2 . . . . A 11 LYS HB2 . 30720 1
106 . 1 . 1 11 11 LYS HB3 H 1 1.551 0.012 . 2 . . . . A 11 LYS HB3 . 30720 1
107 . 1 . 1 11 11 LYS HG2 H 1 1.328 0.006 . 2 . . . . A 11 LYS HG2 . 30720 1
108 . 1 . 1 11 11 LYS HG3 H 1 1.227 0.002 . 2 . . . . A 11 LYS HG3 . 30720 1
109 . 1 . 1 11 11 LYS HD2 H 1 1.570 0.005 . 2 . . . . A 11 LYS HD2 . 30720 1
110 . 1 . 1 11 11 LYS HD3 H 1 1.570 0.005 . 2 . . . . A 11 LYS HD3 . 30720 1
111 . 1 . 1 11 11 LYS HE2 H 1 2.935 0.007 . 2 . . . . A 11 LYS HE2 . 30720 1
112 . 1 . 1 11 11 LYS HE3 H 1 2.935 0.007 . 2 . . . . A 11 LYS HE3 . 30720 1
113 . 1 . 1 11 11 LYS HZ1 H 1 7.476 0.002 . 1 . . . . A 11 LYS HZ1 . 30720 1
114 . 1 . 1 11 11 LYS HZ2 H 1 7.476 0.002 . 1 . . . . A 11 LYS HZ2 . 30720 1
115 . 1 . 1 11 11 LYS HZ3 H 1 7.476 0.002 . 1 . . . . A 11 LYS HZ3 . 30720 1
116 . 1 . 1 11 11 LYS CA C 13 57.389 0.000 . 1 . . . . A 11 LYS CA . 30720 1
117 . 1 . 1 11 11 LYS CB C 13 33.246 0.050 . 1 . . . . A 11 LYS CB . 30720 1
118 . 1 . 1 11 11 LYS CG C 13 24.462 0.000 . 1 . . . . A 11 LYS CG . 30720 1
119 . 1 . 1 11 11 LYS CD C 13 28.655 0.000 . 1 . . . . A 11 LYS CD . 30720 1
120 . 1 . 1 11 11 LYS CE C 13 41.839 0.000 . 1 . . . . A 11 LYS CE . 30720 1
121 . 1 . 1 11 11 LYS N N 15 129.964 0.000 . 1 . . . . A 11 LYS N . 30720 1
122 . 1 . 1 12 12 GLY H H 1 8.281 0.005 . 1 . . . . A 12 GLY H . 30720 1
123 . 1 . 1 12 12 GLY HA2 H 1 4.124 0.002 . 2 . . . . A 12 GLY HA2 . 30720 1
124 . 1 . 1 12 12 GLY HA3 H 1 3.871 0.005 . 2 . . . . A 12 GLY HA3 . 30720 1
125 . 1 . 1 12 12 GLY CA C 13 44.267 0.011 . 1 . . . . A 12 GLY CA . 30720 1
126 . 1 . 1 12 12 GLY N N 15 111.854 0.000 . 1 . . . . A 12 GLY N . 30720 1
127 . 1 . 1 13 13 PRO HA H 1 4.399 0.002 . 1 . . . . A 13 PRO HA . 30720 1
128 . 1 . 1 13 13 PRO HB2 H 1 1.944 0.001 . 2 . . . . A 13 PRO HB2 . 30720 1
129 . 1 . 1 13 13 PRO HB3 H 1 1.049 0.003 . 2 . . . . A 13 PRO HB3 . 30720 1
130 . 1 . 1 13 13 PRO HG2 H 1 1.945 0.001 . 2 . . . . A 13 PRO HG2 . 30720 1
131 . 1 . 1 13 13 PRO HG3 H 1 1.945 0.001 . 2 . . . . A 13 PRO HG3 . 30720 1
132 . 1 . 1 13 13 PRO HD2 H 1 3.551 0.001 . 2 . . . . A 13 PRO HD2 . 30720 1
133 . 1 . 1 13 13 PRO HD3 H 1 3.551 0.001 . 2 . . . . A 13 PRO HD3 . 30720 1
134 . 1 . 1 13 13 PRO CA C 13 62.504 0.000 . 1 . . . . A 13 PRO CA . 30720 1
135 . 1 . 1 13 13 PRO CB C 13 31.706 0.005 . 1 . . . . A 13 PRO CB . 30720 1
136 . 1 . 1 13 13 PRO CG C 13 27.656 0.000 . 1 . . . . A 13 PRO CG . 30720 1
137 . 1 . 1 13 13 PRO CD C 13 49.227 0.000 . 1 . . . . A 13 PRO CD . 30720 1
138 . 1 . 1 14 14 CYS H H 1 8.221 0.001 . 1 . . . . A 14 CYS H . 30720 1
139 . 1 . 1 14 14 CYS HA H 1 4.746 0.009 . 1 . . . . A 14 CYS HA . 30720 1
140 . 1 . 1 14 14 CYS HB2 H 1 3.020 0.004 . 2 . . . . A 14 CYS HB2 . 30720 1
141 . 1 . 1 14 14 CYS HB3 H 1 1.848 0.004 . 2 . . . . A 14 CYS HB3 . 30720 1
142 . 1 . 1 14 14 CYS CA C 13 56.390 0.000 . 1 . . . . A 14 CYS CA . 30720 1
143 . 1 . 1 14 14 CYS CB C 13 33.422 0.047 . 1 . . . . A 14 CYS CB . 30720 1
144 . 1 . 1 15 15 PHE H H 1 8.659 0.002 . 1 . . . . A 15 PHE H . 30720 1
145 . 1 . 1 15 15 PHE HA H 1 5.016 0.002 . 1 . . . . A 15 PHE HA . 30720 1
146 . 1 . 1 15 15 PHE HB2 H 1 3.365 0.007 . 2 . . . . A 15 PHE HB2 . 30720 1
147 . 1 . 1 15 15 PHE HB3 H 1 3.039 0.005 . 2 . . . . A 15 PHE HB3 . 30720 1
148 . 1 . 1 15 15 PHE HD1 H 1 7.328 0.001 . 3 . . . . A 15 PHE HD1 . 30720 1
149 . 1 . 1 15 15 PHE HD2 H 1 7.328 0.001 . 3 . . . . A 15 PHE HD2 . 30720 1
150 . 1 . 1 15 15 PHE HE1 H 1 7.167 0.000 . 3 . . . . A 15 PHE HE1 . 30720 1
151 . 1 . 1 15 15 PHE HE2 H 1 7.167 0.000 . 3 . . . . A 15 PHE HE2 . 30720 1
152 . 1 . 1 15 15 PHE CA C 13 57.886 0.000 . 1 . . . . A 15 PHE CA . 30720 1
153 . 1 . 1 15 15 PHE CB C 13 40.958 0.004 . 1 . . . . A 15 PHE CB . 30720 1
154 . 1 . 1 16 16 THR H H 1 8.050 0.004 . 1 . . . . A 16 THR H . 30720 1
155 . 1 . 1 16 16 THR HA H 1 4.749 0.005 . 1 . . . . A 16 THR HA . 30720 1
156 . 1 . 1 16 16 THR HB H 1 4.330 0.005 . 1 . . . . A 16 THR HB . 30720 1
157 . 1 . 1 16 16 THR HG21 H 1 1.324 0.001 . 0 . . . . A 16 THR HG21 . 30720 1
158 . 1 . 1 16 16 THR HG22 H 1 1.324 0.001 . 0 . . . . A 16 THR HG22 . 30720 1
159 . 1 . 1 16 16 THR HG23 H 1 1.324 0.001 . 0 . . . . A 16 THR HG23 . 30720 1
160 . 1 . 1 16 16 THR CA C 13 59.446 0.000 . 1 . . . . A 16 THR CA . 30720 1
161 . 1 . 1 16 16 THR CB C 13 70.230 0.000 . 1 . . . . A 16 THR CB . 30720 1
162 . 1 . 1 16 16 THR CG2 C 13 22.095 0.000 . 1 . . . . A 16 THR CG2 . 30720 1
163 . 1 . 1 17 17 THR H H 1 9.322 0.002 . 1 . . . . A 17 THR H . 30720 1
164 . 1 . 1 17 17 THR HA H 1 4.240 0.004 . 1 . . . . A 17 THR HA . 30720 1
165 . 1 . 1 17 17 THR HB H 1 4.243 0.006 . 1 . . . . A 17 THR HB . 30720 1
166 . 1 . 1 17 17 THR HG21 H 1 1.436 0.000 . 0 . . . . A 17 THR HG21 . 30720 1
167 . 1 . 1 17 17 THR HG22 H 1 1.436 0.000 . 0 . . . . A 17 THR HG22 . 30720 1
168 . 1 . 1 17 17 THR HG23 H 1 1.436 0.000 . 0 . . . . A 17 THR HG23 . 30720 1
169 . 1 . 1 17 17 THR CA C 13 67.397 0.000 . 1 . . . . A 17 THR CA . 30720 1
170 . 1 . 1 17 17 THR CB C 13 69.355 0.000 . 1 . . . . A 17 THR CB . 30720 1
171 . 1 . 1 17 17 THR CG2 C 13 21.971 0.000 . 1 . . . . A 17 THR CG2 . 30720 1
172 . 1 . 1 17 17 THR N N 15 127.803 0.000 . 1 . . . . A 17 THR N . 30720 1
173 . 1 . 1 18 18 GLY H H 1 9.210 0.001 . 1 . . . . A 18 GLY H . 30720 1
174 . 1 . 1 18 18 GLY HA2 H 1 4.046 0.002 . 2 . . . . A 18 GLY HA2 . 30720 1
175 . 1 . 1 18 18 GLY HA3 H 1 3.969 0.004 . 2 . . . . A 18 GLY HA3 . 30720 1
176 . 1 . 1 18 18 GLY CA C 13 47.417 0.012 . 1 . . . . A 18 GLY CA . 30720 1
177 . 1 . 1 18 18 GLY N N 15 109.666 0.000 . 1 . . . . A 18 GLY N . 30720 1
178 . 1 . 1 19 19 SER H H 1 7.532 0.004 . 1 . . . . A 19 SER H . 30720 1
179 . 1 . 1 19 19 SER HA H 1 4.575 0.004 . 1 . . . . A 19 SER HA . 30720 1
180 . 1 . 1 19 19 SER HB2 H 1 4.231 0.001 . 2 . . . . A 19 SER HB2 . 30720 1
181 . 1 . 1 19 19 SER HB3 H 1 4.231 0.001 . 2 . . . . A 19 SER HB3 . 30720 1
182 . 1 . 1 19 19 SER CA C 13 60.798 0.000 . 1 . . . . A 19 SER CA . 30720 1
183 . 1 . 1 19 19 SER CB C 13 62.612 0.000 . 1 . . . . A 19 SER CB . 30720 1
184 . 1 . 1 19 19 SER N N 15 115.361 0.000 . 1 . . . . A 19 SER N . 30720 1
185 . 1 . 1 20 20 CYS H H 1 7.300 0.002 . 1 . . . . A 20 CYS H . 30720 1
186 . 1 . 1 20 20 CYS HA H 1 4.493 0.003 . 1 . . . . A 20 CYS HA . 30720 1
187 . 1 . 1 20 20 CYS HB2 H 1 2.927 0.004 . 2 . . . . A 20 CYS HB2 . 30720 1
188 . 1 . 1 20 20 CYS HB3 H 1 2.607 0.002 . 2 . . . . A 20 CYS HB3 . 30720 1
189 . 1 . 1 20 20 CYS CA C 13 56.850 0.000 . 1 . . . . A 20 CYS CA . 30720 1
190 . 1 . 1 20 20 CYS CB C 13 36.565 0.041 . 1 . . . . A 20 CYS CB . 30720 1
191 . 1 . 1 21 21 ASP H H 1 9.031 0.001 . 1 . . . . A 21 ASP H . 30720 1
192 . 1 . 1 21 21 ASP HA H 1 4.102 0.004 . 1 . . . . A 21 ASP HA . 30720 1
193 . 1 . 1 21 21 ASP HB2 H 1 3.048 0.002 . 2 . . . . A 21 ASP HB2 . 30720 1
194 . 1 . 1 21 21 ASP HB3 H 1 2.766 0.009 . 2 . . . . A 21 ASP HB3 . 30720 1
195 . 1 . 1 21 21 ASP CA C 13 58.875 0.000 . 1 . . . . A 21 ASP CA . 30720 1
196 . 1 . 1 21 21 ASP CB C 13 41.974 0.000 . 1 . . . . A 21 ASP CB . 30720 1
197 . 1 . 1 21 21 ASP N N 15 122.393 0.000 . 1 . . . . A 21 ASP N . 30720 1
198 . 1 . 1 22 22 ASP H H 1 8.233 0.001 . 1 . . . . A 22 ASP H . 30720 1
199 . 1 . 1 22 22 ASP HA H 1 4.319 0.003 . 1 . . . . A 22 ASP HA . 30720 1
200 . 1 . 1 22 22 ASP HB2 H 1 2.953 0.004 . 2 . . . . A 22 ASP HB2 . 30720 1
201 . 1 . 1 22 22 ASP HB3 H 1 2.851 0.006 . 2 . . . . A 22 ASP HB3 . 30720 1
202 . 1 . 1 22 22 ASP CA C 13 55.643 0.000 . 1 . . . . A 22 ASP CA . 30720 1
203 . 1 . 1 22 22 ASP CB C 13 41.363 0.017 . 1 . . . . A 22 ASP CB . 30720 1
204 . 1 . 1 23 23 HIS H H 1 8.000 0.002 . 1 . . . . A 23 HIS H . 30720 1
205 . 1 . 1 23 23 HIS HA H 1 4.183 0.005 . 1 . . . . A 23 HIS HA . 30720 1
206 . 1 . 1 23 23 HIS HB2 H 1 3.751 0.005 . 2 . . . . A 23 HIS HB2 . 30720 1
207 . 1 . 1 23 23 HIS HB3 H 1 3.618 0.002 . 2 . . . . A 23 HIS HB3 . 30720 1
208 . 1 . 1 23 23 HIS HD2 H 1 6.833 0.003 . 1 . . . . A 23 HIS HD2 . 30720 1
209 . 1 . 1 23 23 HIS HE1 H 1 8.177 0.000 . 1 . . . . A 23 HIS HE1 . 30720 1
210 . 1 . 1 23 23 HIS CA C 13 60.819 0.000 . 1 . . . . A 23 HIS CA . 30720 1
211 . 1 . 1 23 23 HIS CB C 13 30.179 0.026 . 1 . . . . A 23 HIS CB . 30720 1
212 . 1 . 1 24 24 CYS H H 1 9.386 0.001 . 1 . . . . A 24 CYS H . 30720 1
213 . 1 . 1 24 24 CYS HA H 1 3.946 0.003 . 1 . . . . A 24 CYS HA . 30720 1
214 . 1 . 1 24 24 CYS HB2 H 1 2.659 0.002 . 2 . . . . A 24 CYS HB2 . 30720 1
215 . 1 . 1 24 24 CYS HB3 H 1 2.545 0.003 . 2 . . . . A 24 CYS HB3 . 30720 1
216 . 1 . 1 24 24 CYS CA C 13 59.458 0.000 . 1 . . . . A 24 CYS CA . 30720 1
217 . 1 . 1 24 24 CYS CB C 13 37.829 0.025 . 1 . . . . A 24 CYS CB . 30720 1
218 . 1 . 1 24 24 CYS N N 15 119.353 0.000 . 1 . . . . A 24 CYS N . 30720 1
219 . 1 . 1 25 25 LYS H H 1 8.372 0.004 . 1 . . . . A 25 LYS H . 30720 1
220 . 1 . 1 25 25 LYS HA H 1 4.280 0.004 . 1 . . . . A 25 LYS HA . 30720 1
221 . 1 . 1 25 25 LYS HB2 H 1 1.698 0.001 . 2 . . . . A 25 LYS HB2 . 30720 1
222 . 1 . 1 25 25 LYS HB3 H 1 1.623 0.007 . 2 . . . . A 25 LYS HB3 . 30720 1
223 . 1 . 1 25 25 LYS HG2 H 1 1.338 0.005 . 2 . . . . A 25 LYS HG2 . 30720 1
224 . 1 . 1 25 25 LYS HG3 H 1 1.260 0.006 . 2 . . . . A 25 LYS HG3 . 30720 1
225 . 1 . 1 25 25 LYS HD2 H 1 1.622 0.007 . 2 . . . . A 25 LYS HD2 . 30720 1
226 . 1 . 1 25 25 LYS HD3 H 1 1.622 0.006 . 2 . . . . A 25 LYS HD3 . 30720 1
227 . 1 . 1 25 25 LYS HE2 H 1 3.131 0.007 . 2 . . . . A 25 LYS HE2 . 30720 1
228 . 1 . 1 25 25 LYS HE3 H 1 3.011 0.001 . 2 . . . . A 25 LYS HE3 . 30720 1
229 . 1 . 1 25 25 LYS CA C 13 59.307 0.000 . 1 . . . . A 25 LYS CA . 30720 1
230 . 1 . 1 25 25 LYS CB C 13 34.191 0.002 . 1 . . . . A 25 LYS CB . 30720 1
231 . 1 . 1 25 25 LYS CG C 13 25.758 0.017 . 1 . . . . A 25 LYS CG . 30720 1
232 . 1 . 1 25 25 LYS CD C 13 28.039 0.000 . 1 . . . . A 25 LYS CD . 30720 1
233 . 1 . 1 25 25 LYS CE C 13 41.650 0.000 . 1 . . . . A 25 LYS CE . 30720 1
234 . 1 . 1 25 25 LYS N N 15 117.690 0.000 . 1 . . . . A 25 LYS N . 30720 1
235 . 1 . 1 26 26 ASN H H 1 8.592 0.001 . 1 . . . . A 26 ASN H . 30720 1
236 . 1 . 1 26 26 ASN HA H 1 4.659 0.006 . 1 . . . . A 26 ASN HA . 30720 1
237 . 1 . 1 26 26 ASN HB2 H 1 2.854 0.004 . 2 . . . . A 26 ASN HB2 . 30720 1
238 . 1 . 1 26 26 ASN HB3 H 1 2.729 0.003 . 2 . . . . A 26 ASN HB3 . 30720 1
239 . 1 . 1 26 26 ASN HD21 H 1 7.844 0.001 . 2 . . . . A 26 ASN HD21 . 30720 1
240 . 1 . 1 26 26 ASN HD22 H 1 7.125 0.000 . 2 . . . . A 26 ASN HD22 . 30720 1
241 . 1 . 1 26 26 ASN CA C 13 55.477 0.000 . 1 . . . . A 26 ASN CA . 30720 1
242 . 1 . 1 26 26 ASN CB C 13 39.077 0.000 . 1 . . . . A 26 ASN CB . 30720 1
243 . 1 . 1 27 27 LYS H H 1 7.790 0.002 . 1 . . . . A 27 LYS H . 30720 1
244 . 1 . 1 27 27 LYS HA H 1 4.397 0.003 . 1 . . . . A 27 LYS HA . 30720 1
245 . 1 . 1 27 27 LYS HB2 H 1 1.545 0.011 . 2 . . . . A 27 LYS HB2 . 30720 1
246 . 1 . 1 27 27 LYS HB3 H 1 1.439 0.013 . 2 . . . . A 27 LYS HB3 . 30720 1
247 . 1 . 1 27 27 LYS HG2 H 1 1.339 0.003 . 2 . . . . A 27 LYS HG2 . 30720 1
248 . 1 . 1 27 27 LYS HG3 H 1 1.339 0.003 . 2 . . . . A 27 LYS HG3 . 30720 1
249 . 1 . 1 27 27 LYS HD2 H 1 1.614 0.008 . 2 . . . . A 27 LYS HD2 . 30720 1
250 . 1 . 1 27 27 LYS HD3 H 1 1.457 0.010 . 2 . . . . A 27 LYS HD3 . 30720 1
251 . 1 . 1 27 27 LYS HE2 H 1 2.995 0.001 . 2 . . . . A 27 LYS HE2 . 30720 1
252 . 1 . 1 27 27 LYS HE3 H 1 2.995 0.001 . 2 . . . . A 27 LYS HE3 . 30720 1
253 . 1 . 1 27 27 LYS CA C 13 56.279 0.000 . 1 . . . . A 27 LYS CA . 30720 1
254 . 1 . 1 27 27 LYS CB C 13 31.276 0.001 . 1 . . . . A 27 LYS CB . 30720 1
255 . 1 . 1 27 27 LYS CG C 13 24.631 0.000 . 1 . . . . A 27 LYS CG . 30720 1
256 . 1 . 1 27 27 LYS CD C 13 26.363 0.054 . 1 . . . . A 27 LYS CD . 30720 1
257 . 1 . 1 28 28 GLU H H 1 6.882 0.001 . 1 . . . . A 28 GLU H . 30720 1
258 . 1 . 1 28 28 GLU HA H 1 4.363 0.005 . 1 . . . . A 28 GLU HA . 30720 1
259 . 1 . 1 28 28 GLU HB2 H 1 2.439 0.005 . 2 . . . . A 28 GLU HB2 . 30720 1
260 . 1 . 1 28 28 GLU HB3 H 1 2.217 0.006 . 2 . . . . A 28 GLU HB3 . 30720 1
261 . 1 . 1 28 28 GLU HG2 H 1 2.078 0.009 . 2 . . . . A 28 GLU HG2 . 30720 1
262 . 1 . 1 28 28 GLU HG3 H 1 2.052 0.012 . 2 . . . . A 28 GLU HG3 . 30720 1
263 . 1 . 1 28 28 GLU CA C 13 56.280 0.000 . 1 . . . . A 28 GLU CA . 30720 1
264 . 1 . 1 28 28 GLU CB C 13 28.828 0.006 . 1 . . . . A 28 GLU CB . 30720 1
265 . 1 . 1 28 28 GLU CG C 13 35.370 0.000 . 1 . . . . A 28 GLU CG . 30720 1
266 . 1 . 1 29 29 HIS H H 1 6.451 0.001 . 1 . . . . A 29 HIS H . 30720 1
267 . 1 . 1 29 29 HIS HA H 1 4.654 0.004 . 1 . . . . A 29 HIS HA . 30720 1
268 . 1 . 1 29 29 HIS HB2 H 1 3.507 0.005 . 2 . . . . A 29 HIS HB2 . 30720 1
269 . 1 . 1 29 29 HIS HB3 H 1 3.404 0.005 . 2 . . . . A 29 HIS HB3 . 30720 1
270 . 1 . 1 29 29 HIS HD2 H 1 7.162 0.001 . 1 . . . . A 29 HIS HD2 . 30720 1
271 . 1 . 1 29 29 HIS HE1 H 1 8.567 0.000 . 1 . . . . A 29 HIS HE1 . 30720 1
272 . 1 . 1 29 29 HIS CA C 13 55.300 0.000 . 1 . . . . A 29 HIS CA . 30720 1
273 . 1 . 1 29 29 HIS CB C 13 25.283 0.025 . 1 . . . . A 29 HIS CB . 30720 1
274 . 1 . 1 30 30 LEU H H 1 8.569 0.005 . 1 . . . . A 30 LEU H . 30720 1
275 . 1 . 1 30 30 LEU HA H 1 4.944 0.004 . 1 . . . . A 30 LEU HA . 30720 1
276 . 1 . 1 30 30 LEU HB2 H 1 1.907 0.001 . 2 . . . . A 30 LEU HB2 . 30720 1
277 . 1 . 1 30 30 LEU HB3 H 1 1.391 0.006 . 2 . . . . A 30 LEU HB3 . 30720 1
278 . 1 . 1 30 30 LEU HG H 1 1.749 0.003 . 1 . . . . A 30 LEU HG . 30720 1
279 . 1 . 1 30 30 LEU HD11 H 1 0.975 0.006 . 0 . . . . A 30 LEU HD11 . 30720 1
280 . 1 . 1 30 30 LEU HD12 H 1 0.975 0.006 . 0 . . . . A 30 LEU HD12 . 30720 1
281 . 1 . 1 30 30 LEU HD13 H 1 0.975 0.006 . 0 . . . . A 30 LEU HD13 . 30720 1
282 . 1 . 1 30 30 LEU HD21 H 1 0.972 0.006 . 0 . . . . A 30 LEU HD21 . 30720 1
283 . 1 . 1 30 30 LEU HD22 H 1 0.972 0.006 . 0 . . . . A 30 LEU HD22 . 30720 1
284 . 1 . 1 30 30 LEU HD23 H 1 0.972 0.006 . 0 . . . . A 30 LEU HD23 . 30720 1
285 . 1 . 1 30 30 LEU CA C 13 53.252 0.000 . 1 . . . . A 30 LEU CA . 30720 1
286 . 1 . 1 30 30 LEU CB C 13 40.883 0.026 . 1 . . . . A 30 LEU CB . 30720 1
287 . 1 . 1 30 30 LEU CG C 13 26.643 0.000 . 1 . . . . A 30 LEU CG . 30720 1
288 . 1 . 1 30 30 LEU CD1 C 13 22.440 0.000 . 2 . . . . A 30 LEU CD1 . 30720 1
289 . 1 . 1 30 30 LEU CD2 C 13 26.401 0.000 . 2 . . . . A 30 LEU CD2 . 30720 1
290 . 1 . 1 30 30 LEU N N 15 119.876 0.000 . 1 . . . . A 30 LEU N . 30720 1
291 . 1 . 1 31 31 ARG H H 1 8.127 0.002 . 1 . . . . A 31 ARG H . 30720 1
292 . 1 . 1 31 31 ARG HA H 1 4.112 0.003 . 1 . . . . A 31 ARG HA . 30720 1
293 . 1 . 1 31 31 ARG HB2 H 1 1.803 0.004 . 2 . . . . A 31 ARG HB2 . 30720 1
294 . 1 . 1 31 31 ARG HB3 H 1 1.687 0.002 . 2 . . . . A 31 ARG HB3 . 30720 1
295 . 1 . 1 31 31 ARG HG2 H 1 1.689 0.003 . 2 . . . . A 31 ARG HG2 . 30720 1
296 . 1 . 1 31 31 ARG HG3 H 1 1.619 0.000 . 2 . . . . A 31 ARG HG3 . 30720 1
297 . 1 . 1 31 31 ARG HD2 H 1 3.251 0.004 . 2 . . . . A 31 ARG HD2 . 30720 1
298 . 1 . 1 31 31 ARG HD3 H 1 2.890 0.005 . 2 . . . . A 31 ARG HD3 . 30720 1
299 . 1 . 1 31 31 ARG HE H 1 7.243 0.001 . 1 . . . . A 31 ARG HE . 30720 1
300 . 1 . 1 31 31 ARG CA C 13 59.457 0.000 . 1 . . . . A 31 ARG CA . 30720 1
301 . 1 . 1 31 31 ARG CB C 13 31.452 0.016 . 1 . . . . A 31 ARG CB . 30720 1
302 . 1 . 1 31 31 ARG CG C 13 27.254 0.005 . 1 . . . . A 31 ARG CG . 30720 1
303 . 1 . 1 31 31 ARG CD C 13 43.296 0.055 . 1 . . . . A 31 ARG CD . 30720 1
304 . 1 . 1 31 31 ARG N N 15 116.703 0.000 . 1 . . . . A 31 ARG N . 30720 1
305 . 1 . 1 32 32 SER H H 1 7.554 0.002 . 1 . . . . A 32 SER H . 30720 1
306 . 1 . 1 32 32 SER HA H 1 4.667 0.004 . 1 . . . . A 32 SER HA . 30720 1
307 . 1 . 1 32 32 SER HB2 H 1 4.068 0.013 . 2 . . . . A 32 SER HB2 . 30720 1
308 . 1 . 1 32 32 SER HB3 H 1 4.033 0.008 . 2 . . . . A 32 SER HB3 . 30720 1
309 . 1 . 1 32 32 SER CA C 13 57.712 0.000 . 1 . . . . A 32 SER CA . 30720 1
310 . 1 . 1 32 32 SER CB C 13 64.143 0.000 . 1 . . . . A 32 SER CB . 30720 1
311 . 1 . 1 33 33 GLY H H 1 9.586 0.002 . 1 . . . . A 33 GLY H . 30720 1
312 . 1 . 1 33 33 GLY HA2 H 1 5.355 0.002 . 2 . . . . A 33 GLY HA2 . 30720 1
313 . 1 . 1 33 33 GLY HA3 H 1 4.069 0.006 . 2 . . . . A 33 GLY HA3 . 30720 1
314 . 1 . 1 33 33 GLY CA C 13 46.834 0.062 . 1 . . . . A 33 GLY CA . 30720 1
315 . 1 . 1 33 33 GLY N N 15 109.498 0.000 . 1 . . . . A 33 GLY N . 30720 1
316 . 1 . 1 34 34 ARG H H 1 8.800 0.003 . 1 . . . . A 34 ARG H . 30720 1
317 . 1 . 1 34 34 ARG HA H 1 4.775 0.005 . 1 . . . . A 34 ARG HA . 30720 1
318 . 1 . 1 34 34 ARG HB2 H 1 1.913 0.003 . 2 . . . . A 34 ARG HB2 . 30720 1
319 . 1 . 1 34 34 ARG HB3 H 1 1.740 0.001 . 2 . . . . A 34 ARG HB3 . 30720 1
320 . 1 . 1 34 34 ARG HG2 H 1 1.671 0.005 . 2 . . . . A 34 ARG HG2 . 30720 1
321 . 1 . 1 34 34 ARG HG3 H 1 1.254 0.004 . 2 . . . . A 34 ARG HG3 . 30720 1
322 . 1 . 1 34 34 ARG HD2 H 1 2.877 0.000 . 2 . . . . A 34 ARG HD2 . 30720 1
323 . 1 . 1 34 34 ARG HD3 H 1 2.877 0.000 . 2 . . . . A 34 ARG HD3 . 30720 1
324 . 1 . 1 34 34 ARG CA C 13 54.798 0.000 . 1 . . . . A 34 ARG CA . 30720 1
325 . 1 . 1 34 34 ARG CB C 13 32.377 0.030 . 1 . . . . A 34 ARG CB . 30720 1
326 . 1 . 1 34 34 ARG N N 15 115.321 0.000 . 1 . . . . A 34 ARG N . 30720 1
327 . 1 . 1 35 35 CYS H H 1 8.111 0.004 . 1 . . . . A 35 CYS H . 30720 1
328 . 1 . 1 35 35 CYS HA H 1 5.677 0.004 . 1 . . . . A 35 CYS HA . 30720 1
329 . 1 . 1 35 35 CYS HB2 H 1 3.036 0.008 . 2 . . . . A 35 CYS HB2 . 30720 1
330 . 1 . 1 35 35 CYS HB3 H 1 2.515 0.002 . 2 . . . . A 35 CYS HB3 . 30720 1
331 . 1 . 1 35 35 CYS CA C 13 52.049 0.000 . 1 . . . . A 35 CYS CA . 30720 1
332 . 1 . 1 35 35 CYS CB C 13 36.146 0.027 . 1 . . . . A 35 CYS CB . 30720 1
333 . 1 . 1 35 35 CYS N N 15 119.868 0.000 . 1 . . . . A 35 CYS N . 30720 1
334 . 1 . 1 36 36 ARG H H 1 7.914 0.003 . 1 . . . . A 36 ARG H . 30720 1
335 . 1 . 1 36 36 ARG HA H 1 4.687 0.005 . 1 . . . . A 36 ARG HA . 30720 1
336 . 1 . 1 36 36 ARG HB2 H 1 1.922 0.003 . 2 . . . . A 36 ARG HB2 . 30720 1
337 . 1 . 1 36 36 ARG HB3 H 1 1.822 0.003 . 2 . . . . A 36 ARG HB3 . 30720 1
338 . 1 . 1 36 36 ARG HG2 H 1 1.292 0.003 . 2 . . . . A 36 ARG HG2 . 30720 1
339 . 1 . 1 36 36 ARG HG3 H 1 0.972 0.003 . 2 . . . . A 36 ARG HG3 . 30720 1
340 . 1 . 1 36 36 ARG CA C 13 55.711 0.000 . 1 . . . . A 36 ARG CA . 30720 1
341 . 1 . 1 37 37 ASP H H 1 8.422 0.001 . 1 . . . . A 37 ASP H . 30720 1
342 . 1 . 1 37 37 ASP HA H 1 4.108 0.000 . 1 . . . . A 37 ASP HA . 30720 1
343 . 1 . 1 37 37 ASP HB2 H 1 2.724 0.002 . 2 . . . . A 37 ASP HB2 . 30720 1
344 . 1 . 1 37 37 ASP HB3 H 1 2.724 0.002 . 2 . . . . A 37 ASP HB3 . 30720 1
345 . 1 . 1 37 37 ASP CA C 13 55.438 0.000 . 1 . . . . A 37 ASP CA . 30720 1
346 . 1 . 1 37 37 ASP CB C 13 41.005 0.000 . 1 . . . . A 37 ASP CB . 30720 1
347 . 1 . 1 38 38 ASP H H 1 7.881 0.004 . 1 . . . . A 38 ASP H . 30720 1
348 . 1 . 1 38 38 ASP HA H 1 4.338 0.005 . 1 . . . . A 38 ASP HA . 30720 1
349 . 1 . 1 38 38 ASP HB2 H 1 3.068 0.007 . 2 . . . . A 38 ASP HB2 . 30720 1
350 . 1 . 1 38 38 ASP HB3 H 1 2.679 0.003 . 2 . . . . A 38 ASP HB3 . 30720 1
351 . 1 . 1 38 38 ASP CA C 13 52.872 0.000 . 1 . . . . A 38 ASP CA . 30720 1
352 . 1 . 1 38 38 ASP CB C 13 39.892 0.007 . 1 . . . . A 38 ASP CB . 30720 1
353 . 1 . 1 39 39 PHE H H 1 8.390 0.001 . 1 . . . . A 39 PHE H . 30720 1
354 . 1 . 1 39 39 PHE HA H 1 4.198 0.002 . 1 . . . . A 39 PHE HA . 30720 1
355 . 1 . 1 39 39 PHE HB2 H 1 3.310 0.004 . 2 . . . . A 39 PHE HB2 . 30720 1
356 . 1 . 1 39 39 PHE HB3 H 1 3.100 0.006 . 2 . . . . A 39 PHE HB3 . 30720 1
357 . 1 . 1 39 39 PHE HD1 H 1 7.171 0.001 . 3 . . . . A 39 PHE HD1 . 30720 1
358 . 1 . 1 39 39 PHE HD2 H 1 7.171 0.001 . 3 . . . . A 39 PHE HD2 . 30720 1
359 . 1 . 1 39 39 PHE HE1 H 1 7.427 0.000 . 3 . . . . A 39 PHE HE1 . 30720 1
360 . 1 . 1 39 39 PHE HE2 H 1 7.427 0.000 . 3 . . . . A 39 PHE HE2 . 30720 1
361 . 1 . 1 39 39 PHE CA C 13 59.572 0.000 . 1 . . . . A 39 PHE CA . 30720 1
362 . 1 . 1 39 39 PHE CB C 13 35.718 0.012 . 1 . . . . A 39 PHE CB . 30720 1
363 . 1 . 1 40 40 ARG H H 1 8.325 0.006 . 1 . . . . A 40 ARG H . 30720 1
364 . 1 . 1 40 40 ARG HA H 1 4.821 0.011 . 1 . . . . A 40 ARG HA . 30720 1
365 . 1 . 1 40 40 ARG HB2 H 1 1.992 0.004 . 2 . . . . A 40 ARG HB2 . 30720 1
366 . 1 . 1 40 40 ARG HB3 H 1 1.474 0.001 . 2 . . . . A 40 ARG HB3 . 30720 1
367 . 1 . 1 40 40 ARG HG2 H 1 1.590 0.003 . 2 . . . . A 40 ARG HG2 . 30720 1
368 . 1 . 1 40 40 ARG HG3 H 1 1.590 0.003 . 2 . . . . A 40 ARG HG3 . 30720 1
369 . 1 . 1 40 40 ARG HE H 1 7.131 0.000 . 1 . . . . A 40 ARG HE . 30720 1
370 . 1 . 1 40 40 ARG CA C 13 53.556 0.000 . 1 . . . . A 40 ARG CA . 30720 1
371 . 1 . 1 40 40 ARG N N 15 119.188 0.000 . 1 . . . . A 40 ARG N . 30720 1
372 . 1 . 1 41 41 CYS H H 1 8.741 0.002 . 1 . . . . A 41 CYS H . 30720 1
373 . 1 . 1 41 41 CYS HA H 1 4.995 0.002 . 1 . . . . A 41 CYS HA . 30720 1
374 . 1 . 1 41 41 CYS HB2 H 1 1.926 0.004 . 2 . . . . A 41 CYS HB2 . 30720 1
375 . 1 . 1 41 41 CYS HB3 H 1 1.673 0.007 . 2 . . . . A 41 CYS HB3 . 30720 1
376 . 1 . 1 41 41 CYS CA C 13 54.037 0.000 . 1 . . . . A 41 CYS CA . 30720 1
377 . 1 . 1 41 41 CYS CB C 13 35.460 0.024 . 1 . . . . A 41 CYS CB . 30720 1
378 . 1 . 1 41 41 CYS N N 15 119.660 0.000 . 1 . . . . A 41 CYS N . 30720 1
379 . 1 . 1 42 42 TRP H H 1 8.919 0.006 . 1 . . . . A 42 TRP H . 30720 1
380 . 1 . 1 42 42 TRP HA H 1 4.836 0.008 . 1 . . . . A 42 TRP HA . 30720 1
381 . 1 . 1 42 42 TRP HB2 H 1 2.915 0.006 . 2 . . . . A 42 TRP HB2 . 30720 1
382 . 1 . 1 42 42 TRP HB3 H 1 2.915 0.006 . 2 . . . . A 42 TRP HB3 . 30720 1
383 . 1 . 1 42 42 TRP HD1 H 1 6.969 0.001 . 1 . . . . A 42 TRP HD1 . 30720 1
384 . 1 . 1 42 42 TRP HE3 H 1 7.303 0.000 . 1 . . . . A 42 TRP HE3 . 30720 1
385 . 1 . 1 42 42 TRP CA C 13 56.381 0.000 . 1 . . . . A 42 TRP CA . 30720 1
386 . 1 . 1 42 42 TRP CB C 13 30.211 0.000 . 1 . . . . A 42 TRP CB . 30720 1
387 . 1 . 1 43 43 CYS H H 1 9.365 0.004 . 1 . . . . A 43 CYS H . 30720 1
388 . 1 . 1 43 43 CYS HA H 1 5.976 0.004 . 1 . . . . A 43 CYS HA . 30720 1
389 . 1 . 1 43 43 CYS HB2 H 1 3.223 0.004 . 2 . . . . A 43 CYS HB2 . 30720 1
390 . 1 . 1 43 43 CYS HB3 H 1 2.942 0.003 . 2 . . . . A 43 CYS HB3 . 30720 1
391 . 1 . 1 43 43 CYS CA C 13 51.489 0.000 . 1 . . . . A 43 CYS CA . 30720 1
392 . 1 . 1 43 43 CYS CB C 13 39.269 0.003 . 1 . . . . A 43 CYS CB . 30720 1
393 . 1 . 1 43 43 CYS N N 15 120.756 0.000 . 1 . . . . A 43 CYS N . 30720 1
394 . 1 . 1 44 44 THR H H 1 9.084 0.002 . 1 . . . . A 44 THR H . 30720 1
395 . 1 . 1 44 44 THR HA H 1 5.219 0.004 . 1 . . . . A 44 THR HA . 30720 1
396 . 1 . 1 44 44 THR HB H 1 4.077 0.004 . 1 . . . . A 44 THR HB . 30720 1
397 . 1 . 1 44 44 THR HG21 H 1 1.086 0.003 . 0 . . . . A 44 THR HG21 . 30720 1
398 . 1 . 1 44 44 THR HG22 H 1 1.086 0.003 . 0 . . . . A 44 THR HG22 . 30720 1
399 . 1 . 1 44 44 THR HG23 H 1 1.086 0.003 . 0 . . . . A 44 THR HG23 . 30720 1
400 . 1 . 1 44 44 THR CA C 13 62.882 0.000 . 1 . . . . A 44 THR CA . 30720 1
401 . 1 . 1 44 44 THR CB C 13 70.993 0.000 . 1 . . . . A 44 THR CB . 30720 1
402 . 1 . 1 44 44 THR CG2 C 13 21.416 0.000 . 1 . . . . A 44 THR CG2 . 30720 1
403 . 1 . 1 44 44 THR N N 15 120.339 0.000 . 1 . . . . A 44 THR N . 30720 1
404 . 1 . 1 45 45 LYS H H 1 9.170 0.002 . 1 . . . . A 45 LYS H . 30720 1
405 . 1 . 1 45 45 LYS HA H 1 4.999 0.005 . 1 . . . . A 45 LYS HA . 30720 1
406 . 1 . 1 45 45 LYS HB2 H 1 2.104 0.006 . 2 . . . . A 45 LYS HB2 . 30720 1
407 . 1 . 1 45 45 LYS HB3 H 1 1.855 0.006 . 2 . . . . A 45 LYS HB3 . 30720 1
408 . 1 . 1 45 45 LYS HG2 H 1 1.611 0.004 . 2 . . . . A 45 LYS HG2 . 30720 1
409 . 1 . 1 45 45 LYS HG3 H 1 1.253 0.007 . 2 . . . . A 45 LYS HG3 . 30720 1
410 . 1 . 1 45 45 LYS HD2 H 1 1.702 0.004 . 2 . . . . A 45 LYS HD2 . 30720 1
411 . 1 . 1 45 45 LYS HD3 H 1 1.702 0.004 . 2 . . . . A 45 LYS HD3 . 30720 1
412 . 1 . 1 45 45 LYS HE2 H 1 2.986 0.003 . 2 . . . . A 45 LYS HE2 . 30720 1
413 . 1 . 1 45 45 LYS HE3 H 1 2.986 0.003 . 2 . . . . A 45 LYS HE3 . 30720 1
414 . 1 . 1 45 45 LYS HZ1 H 1 7.620 0.002 . 1 . . . . A 45 LYS HZ1 . 30720 1
415 . 1 . 1 45 45 LYS HZ2 H 1 7.620 0.002 . 1 . . . . A 45 LYS HZ2 . 30720 1
416 . 1 . 1 45 45 LYS HZ3 H 1 7.620 0.002 . 1 . . . . A 45 LYS HZ3 . 30720 1
417 . 1 . 1 45 45 LYS CA C 13 53.333 0.000 . 1 . . . . A 45 LYS CA . 30720 1
418 . 1 . 1 45 45 LYS CB C 13 37.740 0.003 . 1 . . . . A 45 LYS CB . 30720 1
419 . 1 . 1 45 45 LYS CG C 13 23.160 0.035 . 1 . . . . A 45 LYS CG . 30720 1
420 . 1 . 1 45 45 LYS CD C 13 29.352 0.000 . 1 . . . . A 45 LYS CD . 30720 1
421 . 1 . 1 45 45 LYS N N 15 123.465 0.000 . 1 . . . . A 45 LYS N . 30720 1
422 . 1 . 1 46 46 ASN H H 1 8.922 0.003 . 1 . . . . A 46 ASN H . 30720 1
423 . 1 . 1 46 46 ASN HA H 1 5.049 0.004 . 1 . . . . A 46 ASN HA . 30720 1
424 . 1 . 1 46 46 ASN HB2 H 1 2.935 0.009 . 2 . . . . A 46 ASN HB2 . 30720 1
425 . 1 . 1 46 46 ASN HB3 H 1 2.736 0.004 . 2 . . . . A 46 ASN HB3 . 30720 1
426 . 1 . 1 46 46 ASN HD21 H 1 7.667 0.001 . 2 . . . . A 46 ASN HD21 . 30720 1
427 . 1 . 1 46 46 ASN HD22 H 1 7.049 0.002 . 2 . . . . A 46 ASN HD22 . 30720 1
428 . 1 . 1 46 46 ASN CA C 13 54.027 0.000 . 1 . . . . A 46 ASN CA . 30720 1
429 . 1 . 1 46 46 ASN CB C 13 38.462 0.007 . 1 . . . . A 46 ASN CB . 30720 1
430 . 1 . 1 47 47 CYS H H 1 8.413 0.004 . 1 . . . . A 47 CYS H . 30720 1
431 . 1 . 1 47 47 CYS HA H 1 4.638 0.004 . 1 . . . . A 47 CYS HA . 30720 1
432 . 1 . 1 47 47 CYS HB2 H 1 3.333 0.003 . 2 . . . . A 47 CYS HB2 . 30720 1
433 . 1 . 1 47 47 CYS HB3 H 1 3.196 0.002 . 2 . . . . A 47 CYS HB3 . 30720 1
434 . 1 . 1 47 47 CYS CA C 13 56.304 0.000 . 1 . . . . A 47 CYS CA . 30720 1
435 . 1 . 1 47 47 CYS CB C 13 43.408 0.009 . 1 . . . . A 47 CYS CB . 30720 1
436 . 1 . 1 47 47 CYS N N 15 125.615 0.000 . 1 . . . . A 47 CYS N . 30720 1
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