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 30935
_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 TOCSY' . . . 30935 1
2 '2D NOESY' . . . 30935 1
3 '2D 1H-15N HSQC' . . . 30935 1
4 '2D TOCSY' . . . 30935 1
5 '2D 1H-13C HSQC aliphatic' . . . 30935 1
6 '2D 1H-1H ECOSY' . . . 30935 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 ASN HA H 1 4.380 0.001 . 1 . . . . A 1 ASN HA . 30935 1
2 . 1 . 1 1 1 ASN HB2 H 1 2.995 0.001 . 2 . . . . A 1 ASN HB2 . 30935 1
3 . 1 . 1 1 1 ASN HB3 H 1 2.941 0.003 . 2 . . . . A 1 ASN HB3 . 30935 1
4 . 1 . 1 1 1 ASN CA C 13 52.565 0.000 . 1 . . . . A 1 ASN CA . 30935 1
5 . 1 . 1 1 1 ASN CB C 13 37.632 0.014 . 1 . . . . A 1 ASN CB . 30935 1
6 . 1 . 1 2 2 GLY H H 1 8.655 0.002 . 1 . . . . A 2 GLY H . 30935 1
7 . 1 . 1 2 2 GLY HA2 H 1 4.028 0.004 . 2 . . . . A 2 GLY HA2 . 30935 1
8 . 1 . 1 2 2 GLY HA3 H 1 3.993 0.004 . 2 . . . . A 2 GLY HA3 . 30935 1
9 . 1 . 1 2 2 GLY CA C 13 44.747 0.009 . 1 . . . . A 2 GLY CA . 30935 1
10 . 1 . 1 2 2 GLY N N 15 109.532 0.000 . 1 . . . . A 2 GLY N . 30935 1
11 . 1 . 1 3 3 LEU H H 1 8.288 0.002 . 1 . . . . A 3 LEU H . 30935 1
12 . 1 . 1 3 3 LEU HA H 1 4.618 0.004 . 1 . . . . A 3 LEU HA . 30935 1
13 . 1 . 1 3 3 LEU HB2 H 1 1.599 0.002 . 2 . . . . A 3 LEU HB2 . 30935 1
14 . 1 . 1 3 3 LEU HB3 H 1 1.433 0.002 . 2 . . . . A 3 LEU HB3 . 30935 1
15 . 1 . 1 3 3 LEU HG H 1 1.678 0.001 . 1 . . . . A 3 LEU HG . 30935 1
16 . 1 . 1 3 3 LEU HD11 H 1 0.925 0.003 . . . . . . A 3 LEU HD11 . 30935 1
17 . 1 . 1 3 3 LEU HD12 H 1 0.925 0.003 . . . . . . A 3 LEU HD12 . 30935 1
18 . 1 . 1 3 3 LEU HD13 H 1 0.925 0.003 . . . . . . A 3 LEU HD13 . 30935 1
19 . 1 . 1 3 3 LEU HD21 H 1 0.921 0.002 . . . . . . A 3 LEU HD21 . 30935 1
20 . 1 . 1 3 3 LEU HD22 H 1 0.921 0.002 . . . . . . A 3 LEU HD22 . 30935 1
21 . 1 . 1 3 3 LEU HD23 H 1 0.921 0.002 . . . . . . A 3 LEU HD23 . 30935 1
22 . 1 . 1 3 3 LEU CA C 13 52.985 0.000 . 1 . . . . A 3 LEU CA . 30935 1
23 . 1 . 1 3 3 LEU CB C 13 41.810 0.007 . 1 . . . . A 3 LEU CB . 30935 1
24 . 1 . 1 3 3 LEU CG C 13 27.064 0.000 . 1 . . . . A 3 LEU CG . 30935 1
25 . 1 . 1 3 3 LEU CD1 C 13 25.256 0.000 . 2 . . . . A 3 LEU CD1 . 30935 1
26 . 1 . 1 3 3 LEU CD2 C 13 23.159 0.000 . 2 . . . . A 3 LEU CD2 . 30935 1
27 . 1 . 1 3 3 LEU N N 15 123.090 0.000 . 1 . . . . A 3 LEU N . 30935 1
28 . 1 . 1 4 4 PRO HA H 1 4.464 0.003 . 1 . . . . A 4 PRO HA . 30935 1
29 . 1 . 1 4 4 PRO HB2 H 1 2.278 0.002 . 2 . . . . A 4 PRO HB2 . 30935 1
30 . 1 . 1 4 4 PRO HB3 H 1 1.861 0.006 . 2 . . . . A 4 PRO HB3 . 30935 1
31 . 1 . 1 4 4 PRO HG2 H 1 2.039 0.005 . 2 . . . . A 4 PRO HG2 . 30935 1
32 . 1 . 1 4 4 PRO HG3 H 1 2.039 0.005 . 2 . . . . A 4 PRO HG3 . 30935 1
33 . 1 . 1 4 4 PRO HD2 H 1 3.861 0.001 . 2 . . . . A 4 PRO HD2 . 30935 1
34 . 1 . 1 4 4 PRO HD3 H 1 3.598 0.003 . 2 . . . . A 4 PRO HD3 . 30935 1
35 . 1 . 1 4 4 PRO CA C 13 62.899 0.000 . 1 . . . . A 4 PRO CA . 30935 1
36 . 1 . 1 4 4 PRO CB C 13 31.854 0.019 . 1 . . . . A 4 PRO CB . 30935 1
37 . 1 . 1 4 4 PRO CD C 13 50.575 0.001 . 1 . . . . A 4 PRO CD . 30935 1
38 . 1 . 1 5 5 VAL H H 1 8.255 0.003 . 1 . . . . A 5 VAL H . 30935 1
39 . 1 . 1 5 5 VAL HA H 1 4.106 0.007 . 1 . . . . A 5 VAL HA . 30935 1
40 . 1 . 1 5 5 VAL HB H 1 2.128 0.009 . 1 . . . . A 5 VAL HB . 30935 1
41 . 1 . 1 5 5 VAL HG11 H 1 0.963 0.004 . . . . . . A 5 VAL HG11 . 30935 1
42 . 1 . 1 5 5 VAL HG12 H 1 0.963 0.004 . . . . . . A 5 VAL HG12 . 30935 1
43 . 1 . 1 5 5 VAL HG13 H 1 0.963 0.004 . . . . . . A 5 VAL HG13 . 30935 1
44 . 1 . 1 5 5 VAL HG21 H 1 0.963 0.004 . . . . . . A 5 VAL HG21 . 30935 1
45 . 1 . 1 5 5 VAL HG22 H 1 0.963 0.004 . . . . . . A 5 VAL HG22 . 30935 1
46 . 1 . 1 5 5 VAL HG23 H 1 0.963 0.004 . . . . . . A 5 VAL HG23 . 30935 1
47 . 1 . 1 5 5 VAL CA C 13 62.188 0.000 . 1 . . . . A 5 VAL CA . 30935 1
48 . 1 . 1 5 5 VAL CB C 13 32.590 0.000 . 1 . . . . A 5 VAL CB . 30935 1
49 . 1 . 1 5 5 VAL CG1 C 13 21.361 0.000 . 2 . . . . A 5 VAL CG1 . 30935 1
50 . 1 . 1 5 5 VAL CG2 C 13 21.361 0.000 . 2 . . . . A 5 VAL CG2 . 30935 1
51 . 1 . 1 5 5 VAL N N 15 120.081 0.000 . 1 . . . . A 5 VAL N . 30935 1
52 . 1 . 1 6 6 CYS H H 1 8.510 0.002 . 1 . . . . A 6 CYS H . 30935 1
53 . 1 . 1 6 6 CYS HA H 1 4.891 0.008 . 1 . . . . A 6 CYS HA . 30935 1
54 . 1 . 1 6 6 CYS HB2 H 1 2.871 0.002 . 2 . . . . A 6 CYS HB2 . 30935 1
55 . 1 . 1 6 6 CYS HB3 H 1 2.816 0.002 . 2 . . . . A 6 CYS HB3 . 30935 1
56 . 1 . 1 6 6 CYS CB C 13 41.090 0.010 . 1 . . . . A 6 CYS CB . 30935 1
57 . 1 . 1 6 6 CYS N N 15 121.453 0.000 . 1 . . . . A 6 CYS N . 30935 1
58 . 1 . 1 7 7 GLY H H 1 8.096 0.003 . 1 . . . . A 7 GLY H . 30935 1
59 . 1 . 1 7 7 GLY HA2 H 1 4.058 0.003 . 2 . . . . A 7 GLY HA2 . 30935 1
60 . 1 . 1 7 7 GLY HA3 H 1 3.803 0.001 . 2 . . . . A 7 GLY HA3 . 30935 1
61 . 1 . 1 7 7 GLY CA C 13 45.882 0.055 . 1 . . . . A 7 GLY CA . 30935 1
62 . 1 . 1 7 7 GLY N N 15 108.638 0.000 . 1 . . . . A 7 GLY N . 30935 1
63 . 1 . 1 8 8 GLU H H 1 8.110 0.004 . 1 . . . . A 8 GLU H . 30935 1
64 . 1 . 1 8 8 GLU HA H 1 4.478 0.006 . 1 . . . . A 8 GLU HA . 30935 1
65 . 1 . 1 8 8 GLU HB2 H 1 2.170 0.002 . 2 . . . . A 8 GLU HB2 . 30935 1
66 . 1 . 1 8 8 GLU HB3 H 1 2.062 0.001 . 2 . . . . A 8 GLU HB3 . 30935 1
67 . 1 . 1 8 8 GLU HG2 H 1 2.544 0.005 . 2 . . . . A 8 GLU HG2 . 30935 1
68 . 1 . 1 8 8 GLU HG3 H 1 2.500 0.008 . 2 . . . . A 8 GLU HG3 . 30935 1
69 . 1 . 1 8 8 GLU CA C 13 55.757 0.000 . 1 . . . . A 8 GLU CA . 30935 1
70 . 1 . 1 8 8 GLU CB C 13 30.299 0.014 . 1 . . . . A 8 GLU CB . 30935 1
71 . 1 . 1 8 8 GLU CG C 13 35.120 0.000 . 1 . . . . A 8 GLU CG . 30935 1
72 . 1 . 1 9 9 THR H H 1 8.327 0.002 . 1 . . . . A 9 THR H . 30935 1
73 . 1 . 1 9 9 THR HA H 1 4.535 0.003 . 1 . . . . A 9 THR HA . 30935 1
74 . 1 . 1 9 9 THR HB H 1 4.238 0.005 . 1 . . . . A 9 THR HB . 30935 1
75 . 1 . 1 9 9 THR HG21 H 1 1.235 0.004 . . . . . . A 9 THR HG21 . 30935 1
76 . 1 . 1 9 9 THR HG22 H 1 1.235 0.004 . . . . . . A 9 THR HG22 . 30935 1
77 . 1 . 1 9 9 THR HG23 H 1 1.235 0.004 . . . . . . A 9 THR HG23 . 30935 1
78 . 1 . 1 9 9 THR CA C 13 61.377 0.000 . 1 . . . . A 9 THR CA . 30935 1
79 . 1 . 1 9 9 THR CB C 13 70.151 0.000 . 1 . . . . A 9 THR CB . 30935 1
80 . 1 . 1 9 9 THR CG2 C 13 21.614 0.000 . 1 . . . . A 9 THR CG2 . 30935 1
81 . 1 . 1 9 9 THR N N 15 113.690 0.000 . 1 . . . . A 9 THR N . 30935 1
82 . 1 . 1 10 10 CYS H H 1 8.277 0.002 . 1 . . . . A 10 CYS H . 30935 1
83 . 1 . 1 10 10 CYS HA H 1 4.756 0.008 . 1 . . . . A 10 CYS HA . 30935 1
84 . 1 . 1 10 10 CYS HB2 H 1 3.123 0.001 . 2 . . . . A 10 CYS HB2 . 30935 1
85 . 1 . 1 10 10 CYS HB3 H 1 3.123 0.001 . 2 . . . . A 10 CYS HB3 . 30935 1
86 . 1 . 1 10 10 CYS CA C 13 55.323 0.000 . 1 . . . . A 10 CYS CA . 30935 1
87 . 1 . 1 10 10 CYS CB C 13 46.297 0.002 . 1 . . . . A 10 CYS CB . 30935 1
88 . 1 . 1 10 10 CYS N N 15 119.440 0.000 . 1 . . . . A 10 CYS N . 30935 1
89 . 1 . 1 11 11 VAL H H 1 8.514 0.001 . 1 . . . . A 11 VAL H . 30935 1
90 . 1 . 1 11 11 VAL HA H 1 4.055 0.004 . 1 . . . . A 11 VAL HA . 30935 1
91 . 1 . 1 11 11 VAL HB H 1 2.016 0.004 . 1 . . . . A 11 VAL HB . 30935 1
92 . 1 . 1 11 11 VAL HG11 H 1 0.978 0.007 . . . . . . A 11 VAL HG11 . 30935 1
93 . 1 . 1 11 11 VAL HG12 H 1 0.978 0.007 . . . . . . A 11 VAL HG12 . 30935 1
94 . 1 . 1 11 11 VAL HG13 H 1 0.978 0.007 . . . . . . A 11 VAL HG13 . 30935 1
95 . 1 . 1 11 11 VAL HG21 H 1 0.978 0.008 . . . . . . A 11 VAL HG21 . 30935 1
96 . 1 . 1 11 11 VAL HG22 H 1 0.978 0.008 . . . . . . A 11 VAL HG22 . 30935 1
97 . 1 . 1 11 11 VAL HG23 H 1 0.978 0.008 . . . . . . A 11 VAL HG23 . 30935 1
98 . 1 . 1 11 11 VAL CA C 13 64.053 0.000 . 1 . . . . A 11 VAL CA . 30935 1
99 . 1 . 1 11 11 VAL CB C 13 32.335 0.000 . 1 . . . . A 11 VAL CB . 30935 1
100 . 1 . 1 11 11 VAL CG1 C 13 21.017 0.000 . 2 . . . . A 11 VAL CG1 . 30935 1
101 . 1 . 1 11 11 VAL CG2 C 13 21.017 0.000 . 2 . . . . A 11 VAL CG2 . 30935 1
102 . 1 . 1 11 11 VAL N N 15 123.553 0.000 . 1 . . . . A 11 VAL N . 30935 1
103 . 1 . 1 12 12 GLY H H 1 8.981 0.001 . 1 . . . . A 12 GLY H . 30935 1
104 . 1 . 1 12 12 GLY HA2 H 1 4.102 0.002 . 2 . . . . A 12 GLY HA2 . 30935 1
105 . 1 . 1 12 12 GLY HA3 H 1 3.905 0.004 . 2 . . . . A 12 GLY HA3 . 30935 1
106 . 1 . 1 12 12 GLY CA C 13 46.194 0.000 . 1 . . . . A 12 GLY CA . 30935 1
107 . 1 . 1 12 12 GLY N N 15 114.080 0.000 . 1 . . . . A 12 GLY N . 30935 1
108 . 1 . 1 13 13 GLY H H 1 8.422 0.001 . 1 . . . . A 13 GLY H . 30935 1
109 . 1 . 1 13 13 GLY HA2 H 1 4.338 0.001 . 2 . . . . A 13 GLY HA2 . 30935 1
110 . 1 . 1 13 13 GLY HA3 H 1 4.010 0.002 . 2 . . . . A 13 GLY HA3 . 30935 1
111 . 1 . 1 13 13 GLY CA C 13 45.423 0.000 . 1 . . . . A 13 GLY CA . 30935 1
112 . 1 . 1 13 13 GLY N N 15 106.465 0.000 . 1 . . . . A 13 GLY N . 30935 1
113 . 1 . 1 14 14 THR H H 1 7.821 0.003 . 1 . . . . A 14 THR H . 30935 1
114 . 1 . 1 14 14 THR HA H 1 4.739 0.008 . 1 . . . . A 14 THR HA . 30935 1
115 . 1 . 1 14 14 THR HB H 1 4.142 0.001 . 1 . . . . A 14 THR HB . 30935 1
116 . 1 . 1 14 14 THR HG21 H 1 1.174 0.004 . . . . . . A 14 THR HG21 . 30935 1
117 . 1 . 1 14 14 THR HG22 H 1 1.174 0.004 . . . . . . A 14 THR HG22 . 30935 1
118 . 1 . 1 14 14 THR HG23 H 1 1.174 0.004 . . . . . . A 14 THR HG23 . 30935 1
119 . 1 . 1 14 14 THR CA C 13 60.560 0.000 . 1 . . . . A 14 THR CA . 30935 1
120 . 1 . 1 14 14 THR CB C 13 71.466 0.000 . 1 . . . . A 14 THR CB . 30935 1
121 . 1 . 1 14 14 THR CG2 C 13 21.143 0.000 . 1 . . . . A 14 THR CG2 . 30935 1
122 . 1 . 1 14 14 THR N N 15 113.205 0.000 . 1 . . . . A 14 THR N . 30935 1
123 . 1 . 1 15 15 CYS H H 1 8.692 0.001 . 1 . . . . A 15 CYS H . 30935 1
124 . 1 . 1 15 15 CYS HA H 1 4.818 0.002 . 1 . . . . A 15 CYS HA . 30935 1
125 . 1 . 1 15 15 CYS HB2 H 1 3.229 0.001 . 2 . . . . A 15 CYS HB2 . 30935 1
126 . 1 . 1 15 15 CYS HB3 H 1 2.797 0.002 . 2 . . . . A 15 CYS HB3 . 30935 1
127 . 1 . 1 15 15 CYS CA C 13 55.550 0.000 . 1 . . . . A 15 CYS CA . 30935 1
128 . 1 . 1 15 15 CYS CB C 13 44.980 0.030 . 1 . . . . A 15 CYS CB . 30935 1
129 . 1 . 1 15 15 CYS N N 15 121.204 0.000 . 1 . . . . A 15 CYS N . 30935 1
130 . 1 . 1 16 16 ASN H H 1 9.015 0.007 . 1 . . . . A 16 ASN H . 30935 1
131 . 1 . 1 16 16 ASN HA H 1 4.628 0.004 . 1 . . . . A 16 ASN HA . 30935 1
132 . 1 . 1 16 16 ASN HB2 H 1 2.819 0.003 . 2 . . . . A 16 ASN HB2 . 30935 1
133 . 1 . 1 16 16 ASN HB3 H 1 2.819 0.003 . 2 . . . . A 16 ASN HB3 . 30935 1
134 . 1 . 1 16 16 ASN HD21 H 1 7.637 0.005 . 2 . . . . A 16 ASN HD21 . 30935 1
135 . 1 . 1 16 16 ASN HD22 H 1 6.879 0.007 . 2 . . . . A 16 ASN HD22 . 30935 1
136 . 1 . 1 16 16 ASN CA C 13 54.448 0.000 . 1 . . . . A 16 ASN CA . 30935 1
137 . 1 . 1 16 16 ASN CB C 13 39.387 0.000 . 1 . . . . A 16 ASN CB . 30935 1
138 . 1 . 1 16 16 ASN N N 15 121.458 0.000 . 1 . . . . A 16 ASN N . 30935 1
139 . 1 . 1 16 16 ASN ND2 N 15 112.679 0.017 . 1 . . . . A 16 ASN ND2 . 30935 1
140 . 1 . 1 17 17 THR H H 1 8.104 0.006 . 1 . . . . A 17 THR H . 30935 1
141 . 1 . 1 17 17 THR HA H 1 4.539 0.002 . 1 . . . . A 17 THR HA . 30935 1
142 . 1 . 1 17 17 THR HB H 1 4.056 0.003 . 1 . . . . A 17 THR HB . 30935 1
143 . 1 . 1 17 17 THR HG21 H 1 1.271 0.002 . . . . . . A 17 THR HG21 . 30935 1
144 . 1 . 1 17 17 THR HG22 H 1 1.271 0.002 . . . . . . A 17 THR HG22 . 30935 1
145 . 1 . 1 17 17 THR HG23 H 1 1.271 0.002 . . . . . . A 17 THR HG23 . 30935 1
146 . 1 . 1 17 17 THR CA C 13 61.170 0.000 . 1 . . . . A 17 THR CA . 30935 1
147 . 1 . 1 17 17 THR CB C 13 69.823 0.000 . 1 . . . . A 17 THR CB . 30935 1
148 . 1 . 1 17 17 THR CG2 C 13 21.569 0.000 . 1 . . . . A 17 THR CG2 . 30935 1
149 . 1 . 1 18 18 PRO HA H 1 4.289 0.002 . 1 . . . . A 18 PRO HA . 30935 1
150 . 1 . 1 18 18 PRO HB2 H 1 2.330 0.003 . 2 . . . . A 18 PRO HB2 . 30935 1
151 . 1 . 1 18 18 PRO HB3 H 1 1.898 0.003 . 2 . . . . A 18 PRO HB3 . 30935 1
152 . 1 . 1 18 18 PRO HG2 H 1 2.136 0.000 . 2 . . . . A 18 PRO HG2 . 30935 1
153 . 1 . 1 18 18 PRO HG3 H 1 2.000 0.002 . 2 . . . . A 18 PRO HG3 . 30935 1
154 . 1 . 1 18 18 PRO HD2 H 1 4.136 0.001 . 2 . . . . A 18 PRO HD2 . 30935 1
155 . 1 . 1 18 18 PRO HD3 H 1 3.715 0.003 . 2 . . . . A 18 PRO HD3 . 30935 1
156 . 1 . 1 18 18 PRO CA C 13 64.035 0.000 . 1 . . . . A 18 PRO CA . 30935 1
157 . 1 . 1 18 18 PRO CB C 13 31.898 0.000 . 1 . . . . A 18 PRO CB . 30935 1
158 . 1 . 1 18 18 PRO CG C 13 27.654 0.069 . 1 . . . . A 18 PRO CG . 30935 1
159 . 1 . 1 18 18 PRO CD C 13 51.746 0.006 . 1 . . . . A 18 PRO CD . 30935 1
160 . 1 . 1 19 19 GLY H H 1 8.709 0.002 . 1 . . . . A 19 GLY H . 30935 1
161 . 1 . 1 19 19 GLY HA2 H 1 4.243 0.007 . 2 . . . . A 19 GLY HA2 . 30935 1
162 . 1 . 1 19 19 GLY HA3 H 1 3.648 0.002 . 2 . . . . A 19 GLY HA3 . 30935 1
163 . 1 . 1 19 19 GLY CA C 13 44.977 0.009 . 1 . . . . A 19 GLY CA . 30935 1
164 . 1 . 1 19 19 GLY N N 15 111.338 0.000 . 1 . . . . A 19 GLY N . 30935 1
165 . 1 . 1 20 20 CYS H H 1 7.660 0.003 . 1 . . . . A 20 CYS H . 30935 1
166 . 1 . 1 20 20 CYS HA H 1 5.119 0.002 . 1 . . . . A 20 CYS HA . 30935 1
167 . 1 . 1 20 20 CYS HB2 H 1 3.102 0.002 . 2 . . . . A 20 CYS HB2 . 30935 1
168 . 1 . 1 20 20 CYS HB3 H 1 2.733 0.004 . 2 . . . . A 20 CYS HB3 . 30935 1
169 . 1 . 1 20 20 CYS CA C 13 55.192 0.000 . 1 . . . . A 20 CYS CA . 30935 1
170 . 1 . 1 20 20 CYS CB C 13 44.053 0.000 . 1 . . . . A 20 CYS CB . 30935 1
171 . 1 . 1 20 20 CYS N N 15 117.704 0.000 . 1 . . . . A 20 CYS N . 30935 1
172 . 1 . 1 21 21 LYS H H 1 9.732 0.002 . 1 . . . . A 21 LYS H . 30935 1
173 . 1 . 1 21 21 LYS HA H 1 4.623 0.004 . 1 . . . . A 21 LYS HA . 30935 1
174 . 1 . 1 21 21 LYS HB2 H 1 1.751 0.002 . 2 . . . . A 21 LYS HB2 . 30935 1
175 . 1 . 1 21 21 LYS HB3 H 1 1.751 0.002 . 2 . . . . A 21 LYS HB3 . 30935 1
176 . 1 . 1 21 21 LYS HG2 H 1 1.390 0.002 . 2 . . . . A 21 LYS HG2 . 30935 1
177 . 1 . 1 21 21 LYS HG3 H 1 1.284 0.004 . 2 . . . . A 21 LYS HG3 . 30935 1
178 . 1 . 1 21 21 LYS HD2 H 1 1.608 0.005 . 2 . . . . A 21 LYS HD2 . 30935 1
179 . 1 . 1 21 21 LYS HD3 H 1 1.608 0.005 . 2 . . . . A 21 LYS HD3 . 30935 1
180 . 1 . 1 21 21 LYS HE2 H 1 2.916 0.005 . 2 . . . . A 21 LYS HE2 . 30935 1
181 . 1 . 1 21 21 LYS HE3 H 1 2.916 0.004 . 2 . . . . A 21 LYS HE3 . 30935 1
182 . 1 . 1 21 21 LYS CA C 13 54.420 0.000 . 1 . . . . A 21 LYS CA . 30935 1
183 . 1 . 1 21 21 LYS CB C 13 35.070 0.000 . 1 . . . . A 21 LYS CB . 30935 1
184 . 1 . 1 21 21 LYS CG C 13 24.106 0.014 . 1 . . . . A 21 LYS CG . 30935 1
185 . 1 . 1 21 21 LYS CD C 13 29.146 0.000 . 1 . . . . A 21 LYS CD . 30935 1
186 . 1 . 1 21 21 LYS CE C 13 41.922 0.000 . 1 . . . . A 21 LYS CE . 30935 1
187 . 1 . 1 21 21 LYS N N 15 123.126 0.000 . 1 . . . . A 21 LYS N . 30935 1
188 . 1 . 1 22 22 CYS H H 1 9.087 0.002 . 1 . . . . A 22 CYS H . 30935 1
189 . 1 . 1 22 22 CYS HA H 1 4.575 0.004 . 1 . . . . A 22 CYS HA . 30935 1
190 . 1 . 1 22 22 CYS HB2 H 1 3.111 0.004 . 2 . . . . A 22 CYS HB2 . 30935 1
191 . 1 . 1 22 22 CYS HB3 H 1 2.834 0.006 . 2 . . . . A 22 CYS HB3 . 30935 1
192 . 1 . 1 22 22 CYS CA C 13 56.666 0.000 . 1 . . . . A 22 CYS CA . 30935 1
193 . 1 . 1 22 22 CYS CB C 13 41.049 0.014 . 1 . . . . A 22 CYS CB . 30935 1
194 . 1 . 1 22 22 CYS N N 15 122.196 0.000 . 1 . . . . A 22 CYS N . 30935 1
195 . 1 . 1 23 23 SER H H 1 8.960 0.002 . 1 . . . . A 23 SER H . 30935 1
196 . 1 . 1 23 23 SER HA H 1 4.724 0.005 . 1 . . . . A 23 SER HA . 30935 1
197 . 1 . 1 23 23 SER HB2 H 1 3.879 0.004 . 2 . . . . A 23 SER HB2 . 30935 1
198 . 1 . 1 23 23 SER HB3 H 1 3.798 0.004 . 2 . . . . A 23 SER HB3 . 30935 1
199 . 1 . 1 23 23 SER CA C 13 56.537 0.000 . 1 . . . . A 23 SER CA . 30935 1
200 . 1 . 1 23 23 SER CB C 13 61.838 0.010 . 1 . . . . A 23 SER CB . 30935 1
201 . 1 . 1 23 23 SER N N 15 131.115 0.000 . 1 . . . . A 23 SER N . 30935 1
202 . 1 . 1 24 24 TRP H H 1 8.225 0.003 . 1 . . . . A 24 TRP H . 30935 1
203 . 1 . 1 24 24 TRP HA H 1 4.148 0.001 . 1 . . . . A 24 TRP HA . 30935 1
204 . 1 . 1 24 24 TRP HB2 H 1 3.282 0.002 . 2 . . . . A 24 TRP HB2 . 30935 1
205 . 1 . 1 24 24 TRP HB3 H 1 3.282 0.002 . 2 . . . . A 24 TRP HB3 . 30935 1
206 . 1 . 1 24 24 TRP HD1 H 1 7.273 0.000 . 1 . . . . A 24 TRP HD1 . 30935 1
207 . 1 . 1 24 24 TRP HE1 H 1 10.341 0.001 . 1 . . . . A 24 TRP HE1 . 30935 1
208 . 1 . 1 24 24 TRP HE3 H 1 7.556 0.000 . 1 . . . . A 24 TRP HE3 . 30935 1
209 . 1 . 1 24 24 TRP CA C 13 58.824 0.000 . 1 . . . . A 24 TRP CA . 30935 1
210 . 1 . 1 24 24 TRP CB C 13 29.821 0.000 . 1 . . . . A 24 TRP CB . 30935 1
211 . 1 . 1 24 24 TRP N N 15 123.969 0.000 . 1 . . . . A 24 TRP N . 30935 1
212 . 1 . 1 25 25 PRO HA H 1 3.381 0.003 . 1 . . . . A 25 PRO HA . 30935 1
213 . 1 . 1 25 25 PRO HB2 H 1 1.730 0.003 . 2 . . . . A 25 PRO HB2 . 30935 1
214 . 1 . 1 25 25 PRO HB3 H 1 0.056 0.003 . 2 . . . . A 25 PRO HB3 . 30935 1
215 . 1 . 1 25 25 PRO HG2 H 1 1.471 0.004 . 2 . . . . A 25 PRO HG2 . 30935 1
216 . 1 . 1 25 25 PRO HG3 H 1 1.377 0.002 . 2 . . . . A 25 PRO HG3 . 30935 1
217 . 1 . 1 25 25 PRO HD2 H 1 3.313 0.003 . 2 . . . . A 25 PRO HD2 . 30935 1
218 . 1 . 1 25 25 PRO HD3 H 1 3.211 0.003 . 2 . . . . A 25 PRO HD3 . 30935 1
219 . 1 . 1 25 25 PRO CA C 13 64.833 0.000 . 1 . . . . A 25 PRO CA . 30935 1
220 . 1 . 1 25 25 PRO CB C 13 32.554 0.014 . 1 . . . . A 25 PRO CB . 30935 1
221 . 1 . 1 25 25 PRO CG C 13 24.188 0.000 . 1 . . . . A 25 PRO CG . 30935 1
222 . 1 . 1 25 25 PRO CD C 13 49.105 0.011 . 1 . . . . A 25 PRO CD . 30935 1
223 . 1 . 1 26 26 VAL H H 1 8.160 0.002 . 1 . . . . A 26 VAL H . 30935 1
224 . 1 . 1 26 26 VAL HA H 1 4.487 0.004 . 1 . . . . A 26 VAL HA . 30935 1
225 . 1 . 1 26 26 VAL HB H 1 1.969 0.005 . 1 . . . . A 26 VAL HB . 30935 1
226 . 1 . 1 26 26 VAL HG11 H 1 0.803 0.005 . . . . . . A 26 VAL HG11 . 30935 1
227 . 1 . 1 26 26 VAL HG12 H 1 0.803 0.005 . . . . . . A 26 VAL HG12 . 30935 1
228 . 1 . 1 26 26 VAL HG13 H 1 0.803 0.005 . . . . . . A 26 VAL HG13 . 30935 1
229 . 1 . 1 26 26 VAL HG21 H 1 0.802 0.003 . . . . . . A 26 VAL HG21 . 30935 1
230 . 1 . 1 26 26 VAL HG22 H 1 0.802 0.003 . . . . . . A 26 VAL HG22 . 30935 1
231 . 1 . 1 26 26 VAL HG23 H 1 0.802 0.003 . . . . . . A 26 VAL HG23 . 30935 1
232 . 1 . 1 26 26 VAL CA C 13 61.247 0.000 . 1 . . . . A 26 VAL CA . 30935 1
233 . 1 . 1 26 26 VAL CB C 13 35.435 0.000 . 1 . . . . A 26 VAL CB . 30935 1
234 . 1 . 1 26 26 VAL CG1 C 13 21.569 0.000 . 2 . . . . A 26 VAL CG1 . 30935 1
235 . 1 . 1 26 26 VAL CG2 C 13 19.948 0.000 . 2 . . . . A 26 VAL CG2 . 30935 1
236 . 1 . 1 26 26 VAL N N 15 123.107 0.000 . 1 . . . . A 26 VAL N . 30935 1
237 . 1 . 1 27 27 CYS H H 1 8.390 0.001 . 1 . . . . A 27 CYS H . 30935 1
238 . 1 . 1 27 27 CYS HA H 1 5.219 0.005 . 1 . . . . A 27 CYS HA . 30935 1
239 . 1 . 1 27 27 CYS HB2 H 1 3.384 0.002 . 2 . . . . A 27 CYS HB2 . 30935 1
240 . 1 . 1 27 27 CYS HB3 H 1 2.698 0.005 . 2 . . . . A 27 CYS HB3 . 30935 1
241 . 1 . 1 27 27 CYS CA C 13 56.855 0.000 . 1 . . . . A 27 CYS CA . 30935 1
242 . 1 . 1 27 27 CYS CB C 13 45.635 0.002 . 1 . . . . A 27 CYS CB . 30935 1
243 . 1 . 1 27 27 CYS N N 15 121.815 0.000 . 1 . . . . A 27 CYS N . 30935 1
244 . 1 . 1 28 28 THR H H 1 9.739 0.004 . 1 . . . . A 28 THR H . 30935 1
245 . 1 . 1 28 28 THR HA H 1 4.813 0.002 . 1 . . . . A 28 THR HA . 30935 1
246 . 1 . 1 28 28 THR HB H 1 4.274 0.002 . 1 . . . . A 28 THR HB . 30935 1
247 . 1 . 1 28 28 THR HG21 H 1 1.182 0.003 . . . . . . A 28 THR HG21 . 30935 1
248 . 1 . 1 28 28 THR HG22 H 1 1.182 0.003 . . . . . . A 28 THR HG22 . 30935 1
249 . 1 . 1 28 28 THR HG23 H 1 1.182 0.003 . . . . . . A 28 THR HG23 . 30935 1
250 . 1 . 1 28 28 THR CA C 13 60.295 0.000 . 1 . . . . A 28 THR CA . 30935 1
251 . 1 . 1 28 28 THR CB C 13 71.960 0.000 . 1 . . . . A 28 THR CB . 30935 1
252 . 1 . 1 28 28 THR CG2 C 13 20.569 0.000 . 1 . . . . A 28 THR CG2 . 30935 1
253 . 1 . 1 28 28 THR N N 15 118.750 0.000 . 1 . . . . A 28 THR N . 30935 1
254 . 1 . 1 29 29 ARG H H 1 8.232 0.001 . 1 . . . . A 29 ARG H . 30935 1
255 . 1 . 1 29 29 ARG HA H 1 4.526 0.004 . 1 . . . . A 29 ARG HA . 30935 1
256 . 1 . 1 29 29 ARG HB2 H 1 1.921 0.002 . 2 . . . . A 29 ARG HB2 . 30935 1
257 . 1 . 1 29 29 ARG HB3 H 1 1.747 0.004 . 2 . . . . A 29 ARG HB3 . 30935 1
258 . 1 . 1 29 29 ARG HG2 H 1 1.666 0.003 . 2 . . . . A 29 ARG HG2 . 30935 1
259 . 1 . 1 29 29 ARG HG3 H 1 1.666 0.003 . 2 . . . . A 29 ARG HG3 . 30935 1
260 . 1 . 1 29 29 ARG HD2 H 1 3.212 0.003 . 2 . . . . A 29 ARG HD2 . 30935 1
261 . 1 . 1 29 29 ARG HD3 H 1 3.212 0.003 . 2 . . . . A 29 ARG HD3 . 30935 1
262 . 1 . 1 29 29 ARG HE H 1 7.230 0.000 . 1 . . . . A 29 ARG HE . 30935 1
263 . 1 . 1 29 29 ARG CA C 13 57.725 0.000 . 1 . . . . A 29 ARG CA . 30935 1
264 . 1 . 1 29 29 ARG CB C 13 31.210 0.008 . 1 . . . . A 29 ARG CB . 30935 1
265 . 1 . 1 29 29 ARG CG C 13 27.917 0.000 . 1 . . . . A 29 ARG CG . 30935 1
266 . 1 . 1 29 29 ARG CD C 13 43.580 0.000 . 1 . . . . A 29 ARG CD . 30935 1
267 . 1 . 1 29 29 ARG N N 15 125.742 0.000 . 1 . . . . A 29 ARG N . 30935 1
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