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 34070
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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 NOESY' . . . 34070 1
2 '2D 1H-1H NOESY' . . . 34070 1
3 '2D 1H-1H TOCSY' . . . 34070 1
4 '2D 1H-1H TOCSY' . . . 34070 1
5 '2D 1H-15N HSQC' . . . 34070 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 GLY HA2 H 1 3.942 0.005 . 2 . . . A 1 GLY HA2 . 34070 1
2 . 1 1 1 1 GLY HA3 H 1 3.942 0.005 . 2 . . . A 1 GLY HA3 . 34070 1
3 . 1 1 2 2 ILE H H 1 8.414 0.001 . 1 . . . A 2 ILE H . 34070 1
4 . 1 1 2 2 ILE HA H 1 3.946 0.001 . 1 . . . A 2 ILE HA . 34070 1
5 . 1 1 2 2 ILE HB H 1 1.321 0.015 . 1 . . . A 2 ILE HB . 34070 1
6 . 1 1 2 2 ILE HG12 H 1 1.181 0.011 . 2 . . . A 2 ILE HG12 . 34070 1
7 . 1 1 2 2 ILE HG13 H 1 0.930 0.001 . 2 . . . A 2 ILE HG13 . 34070 1
8 . 1 1 2 2 ILE HG21 H 1 0.739 0.001 . 1 . . . A 2 ILE HG21 . 34070 1
9 . 1 1 2 2 ILE HG22 H 1 0.739 0.001 . 1 . . . A 2 ILE HG22 . 34070 1
10 . 1 1 2 2 ILE HG23 H 1 0.739 0.001 . 1 . . . A 2 ILE HG23 . 34070 1
11 . 1 1 2 2 ILE HD11 H 1 0.649 0.002 . 1 . . . A 2 ILE HD11 . 34070 1
12 . 1 1 2 2 ILE HD12 H 1 0.649 0.002 . 1 . . . A 2 ILE HD12 . 34070 1
13 . 1 1 2 2 ILE HD13 H 1 0.649 0.002 . 1 . . . A 2 ILE HD13 . 34070 1
14 . 1 1 3 3 VAL H H 1 7.961 0.001 . 1 . . . A 3 VAL H . 34070 1
15 . 1 1 3 3 VAL HA H 1 3.643 0.001 . 1 . . . A 3 VAL HA . 34070 1
16 . 1 1 3 3 VAL HB H 1 1.976 0.003 . 1 . . . A 3 VAL HB . 34070 1
17 . 1 1 3 3 VAL HG11 H 1 0.924 0.002 . 1 . . . A 3 VAL HG11 . 34070 1
18 . 1 1 3 3 VAL HG12 H 1 0.924 0.002 . 1 . . . A 3 VAL HG12 . 34070 1
19 . 1 1 3 3 VAL HG13 H 1 0.924 0.002 . 1 . . . A 3 VAL HG13 . 34070 1
20 . 1 1 3 3 VAL HG21 H 1 0.872 0.002 . 1 . . . A 3 VAL HG21 . 34070 1
21 . 1 1 3 3 VAL HG22 H 1 0.872 0.002 . 1 . . . A 3 VAL HG22 . 34070 1
22 . 1 1 3 3 VAL HG23 H 1 0.872 0.002 . 1 . . . A 3 VAL HG23 . 34070 1
23 . 1 1 4 4 GLU H H 1 8.072 0.005 . 1 . . . A 4 GLU H . 34070 1
24 . 1 1 4 4 GLU HA H 1 4.201 0.001 . 1 . . . A 4 GLU HA . 34070 1
25 . 1 1 4 4 GLU HB2 H 1 2.056 0.000 . 2 . . . A 4 GLU HB2 . 34070 1
26 . 1 1 4 4 GLU HB3 H 1 1.980 0.004 . 2 . . . A 4 GLU HB3 . 34070 1
27 . 1 1 4 4 GLU HG2 H 1 2.466 0.003 . 2 . . . A 4 GLU HG2 . 34070 1
28 . 1 1 5 5 GLN H H 1 8.235 0.002 . 1 . . . A 5 GLN H . 34070 1
29 . 1 1 5 5 GLN HA H 1 4.003 0.002 . 1 . . . A 5 GLN HA . 34070 1
30 . 1 1 5 5 GLN HB2 H 1 2.067 0.006 . 2 . . . A 5 GLN HB2 . 34070 1
31 . 1 1 5 5 GLN HB3 H 1 2.002 0.001 . 2 . . . A 5 GLN HB3 . 34070 1
32 . 1 1 5 5 GLN HG2 H 1 2.425 0.001 . 2 . . . A 5 GLN HG2 . 34070 1
33 . 1 1 5 5 GLN HG3 H 1 2.344 0.001 . 2 . . . A 5 GLN HG3 . 34070 1
34 . 1 1 5 5 GLN HE21 H 1 7.431 0.004 . 2 . . . A 5 GLN HE21 . 34070 1
35 . 1 1 5 5 GLN HE22 H 1 6.773 0.000 . 2 . . . A 5 GLN HE22 . 34070 1
36 . 1 1 6 6 CYS H H 1 8.158 0.002 . 1 . . . A 6 CYS H . 34070 1
37 . 1 1 6 6 CYS HA H 1 4.834 0.009 . 1 . . . A 6 CYS HA . 34070 1
38 . 1 1 6 6 CYS HB2 H 1 3.280 0.002 . 2 . . . A 6 CYS HB2 . 34070 1
39 . 1 1 6 6 CYS HB3 H 1 2.821 0.001 . 2 . . . A 6 CYS HB3 . 34070 1
40 . 1 1 7 7 CYS H H 1 8.252 0.002 . 1 . . . A 7 CYS H . 34070 1
41 . 1 1 7 7 CYS HA H 1 4.782 0.001 . 1 . . . A 7 CYS HA . 34070 1
42 . 1 1 7 7 CYS HB2 H 1 3.722 0.001 . 2 . . . A 7 CYS HB2 . 34070 1
43 . 1 1 7 7 CYS HB3 H 1 3.279 0.002 . 2 . . . A 7 CYS HB3 . 34070 1
44 . 1 1 8 8 THR H H 1 8.077 0.001 . 1 . . . A 8 THR H . 34070 1
45 . 1 1 8 8 THR HA H 1 4.012 0.001 . 1 . . . A 8 THR HA . 34070 1
46 . 1 1 8 8 THR HB H 1 4.346 0.002 . 1 . . . A 8 THR HB . 34070 1
47 . 1 1 8 8 THR HG21 H 1 1.210 0.001 . 1 . . . A 8 THR HG21 . 34070 1
48 . 1 1 8 8 THR HG22 H 1 1.210 0.001 . 1 . . . A 8 THR HG22 . 34070 1
49 . 1 1 8 8 THR HG23 H 1 1.210 0.001 . 1 . . . A 8 THR HG23 . 34070 1
50 . 1 1 9 9 SER H H 1 7.374 0.003 . 1 . . . A 9 SER H . 34070 1
51 . 1 1 9 9 SER HA H 1 4.705 0.009 . 1 . . . A 9 SER HA . 34070 1
52 . 1 1 9 9 SER HB2 H 1 3.999 0.006 . 2 . . . A 9 SER HB2 . 34070 1
53 . 1 1 9 9 SER HB3 H 1 3.833 0.002 . 2 . . . A 9 SER HB3 . 34070 1
54 . 1 1 10 10 ILE H H 1 7.767 0.001 . 1 . . . A 10 ILE H . 34070 1
55 . 1 1 10 10 ILE HA H 1 4.412 0.000 . 1 . . . A 10 ILE HA . 34070 1
56 . 1 1 10 10 ILE HB H 1 1.548 0.004 . 1 . . . A 10 ILE HB . 34070 1
57 . 1 1 10 10 ILE HG12 H 1 1.089 0.015 . 2 . . . A 10 ILE HG12 . 34070 1
58 . 1 1 10 10 ILE HG13 H 1 0.495 0.001 . 2 . . . A 10 ILE HG13 . 34070 1
59 . 1 1 10 10 ILE HG21 H 1 0.634 0.001 . 1 . . . A 10 ILE HG21 . 34070 1
60 . 1 1 10 10 ILE HG22 H 1 0.634 0.001 . 1 . . . A 10 ILE HG22 . 34070 1
61 . 1 1 10 10 ILE HG23 H 1 0.634 0.001 . 1 . . . A 10 ILE HG23 . 34070 1
62 . 1 1 10 10 ILE HD11 H 1 0.505 0.023 . 1 . . . A 10 ILE HD11 . 34070 1
63 . 1 1 10 10 ILE HD12 H 1 0.505 0.023 . 1 . . . A 10 ILE HD12 . 34070 1
64 . 1 1 10 10 ILE HD13 H 1 0.505 0.023 . 1 . . . A 10 ILE HD13 . 34070 1
65 . 1 1 11 11 CYS H H 1 9.460 0.001 . 1 . . . A 11 CYS H . 34070 1
66 . 1 1 11 11 CYS HA H 1 5.024 0.004 . 1 . . . A 11 CYS HA . 34070 1
67 . 1 1 11 11 CYS HB2 H 1 3.263 0.007 . 2 . . . A 11 CYS HB2 . 34070 1
68 . 1 1 11 11 CYS HB3 H 1 3.110 0.001 . 2 . . . A 11 CYS HB3 . 34070 1
69 . 1 1 12 12 SER H H 1 8.654 0.002 . 1 . . . A 12 SER H . 34070 1
70 . 1 1 12 12 SER HA H 1 4.562 0.002 . 1 . . . A 12 SER HA . 34070 1
71 . 1 1 12 12 SER HB2 H 1 4.279 0.000 . 2 . . . A 12 SER HB2 . 34070 1
72 . 1 1 12 12 SER HB3 H 1 3.943 0.002 . 2 . . . A 12 SER HB3 . 34070 1
73 . 1 1 13 13 LEU H H 1 8.521 0.001 . 1 . . . A 13 LEU H . 34070 1
74 . 1 1 13 13 LEU HA H 1 3.879 0.044 . 1 . . . A 13 LEU HA . 34070 1
75 . 1 1 13 13 LEU HB2 H 1 1.375 0.003 . 2 . . . A 13 LEU HB2 . 34070 1
76 . 1 1 13 13 LEU HB3 H 1 1.455 0.001 . 2 . . . A 13 LEU HB3 . 34070 1
77 . 1 1 13 13 LEU HG H 1 1.423 0.000 . 1 . . . A 13 LEU HG . 34070 1
78 . 1 1 13 13 LEU HD11 H 1 0.803 0.002 . 1 . . . A 13 LEU HD11 . 34070 1
79 . 1 1 13 13 LEU HD12 H 1 0.803 0.002 . 1 . . . A 13 LEU HD12 . 34070 1
80 . 1 1 13 13 LEU HD13 H 1 0.803 0.002 . 1 . . . A 13 LEU HD13 . 34070 1
81 . 1 1 13 13 LEU HD21 H 1 0.752 0.002 . 1 . . . A 13 LEU HD21 . 34070 1
82 . 1 1 13 13 LEU HD22 H 1 0.752 0.002 . 1 . . . A 13 LEU HD22 . 34070 1
83 . 1 1 13 13 LEU HD23 H 1 0.752 0.002 . 1 . . . A 13 LEU HD23 . 34070 1
84 . 1 1 14 14 TYR H H 1 7.486 0.001 . 1 . . . A 14 TYR H . 34070 1
85 . 1 1 14 14 TYR HA H 1 4.106 0.002 . 1 . . . A 14 TYR HA . 34070 1
86 . 1 1 14 14 TYR HB2 H 1 2.942 0.008 . 2 . . . A 14 TYR HB2 . 34070 1
87 . 1 1 14 14 TYR HB3 H 1 2.903 0.002 . 2 . . . A 14 TYR HB3 . 34070 1
88 . 1 1 14 14 TYR HD1 H 1 7.041 0.003 . 3 . . . A 14 TYR HD1 . 34070 1
89 . 1 1 14 14 TYR HD2 H 1 7.041 0.003 . 3 . . . A 14 TYR HD2 . 34070 1
90 . 1 1 14 14 TYR HE1 H 1 6.814 0.003 . 3 . . . A 14 TYR HE1 . 34070 1
91 . 1 1 14 14 TYR HE2 H 1 6.814 0.003 . 3 . . . A 14 TYR HE2 . 34070 1
92 . 1 1 15 15 GLN H H 1 7.500 0.002 . 1 . . . A 15 GLN H . 34070 1
93 . 1 1 15 15 GLN HA H 1 3.935 0.005 . 1 . . . A 15 GLN HA . 34070 1
94 . 1 1 15 15 GLN HB3 H 1 1.978 0.003 . 2 . . . A 15 GLN HB3 . 34070 1
95 . 1 1 15 15 GLN HG2 H 1 2.411 0.005 . 2 . . . A 15 GLN HG2 . 34070 1
96 . 1 1 15 15 GLN HG3 H 1 2.326 0.015 . 2 . . . A 15 GLN HG3 . 34070 1
97 . 1 1 15 15 GLN HE21 H 1 7.043 0.002 . 2 . . . A 15 GLN HE21 . 34070 1
98 . 1 1 15 15 GLN HE22 H 1 6.885 0.000 . 2 . . . A 15 GLN HE22 . 34070 1
99 . 1 1 16 16 LEU H H 1 7.935 0.002 . 1 . . . A 16 LEU H . 34070 1
100 . 1 1 16 16 LEU HA H 1 4.109 0.001 . 1 . . . A 16 LEU HA . 34070 1
101 . 1 1 16 16 LEU HB2 H 1 1.560 0.005 . 2 . . . A 16 LEU HB2 . 34070 1
102 . 1 1 16 16 LEU HB3 H 1 1.869 0.004 . 2 . . . A 16 LEU HB3 . 34070 1
103 . 1 1 16 16 LEU HG H 1 1.705 0.002 . 1 . . . A 16 LEU HG . 34070 1
104 . 1 1 16 16 LEU HD11 H 1 0.804 0.004 . 1 . . . A 16 LEU HD11 . 34070 1
105 . 1 1 16 16 LEU HD12 H 1 0.804 0.004 . 1 . . . A 16 LEU HD12 . 34070 1
106 . 1 1 16 16 LEU HD13 H 1 0.804 0.004 . 1 . . . A 16 LEU HD13 . 34070 1
107 . 1 1 16 16 LEU HD21 H 1 0.758 0.009 . 1 . . . A 16 LEU HD21 . 34070 1
108 . 1 1 16 16 LEU HD22 H 1 0.758 0.009 . 1 . . . A 16 LEU HD22 . 34070 1
109 . 1 1 16 16 LEU HD23 H 1 0.758 0.009 . 1 . . . A 16 LEU HD23 . 34070 1
110 . 1 1 17 17 GLU HA H 1 4.089 0.003 . 1 . . . A 17 GLU HA . 34070 1
111 . 1 1 17 17 GLU HB2 H 1 2.062 0.004 . 2 . . . A 17 GLU HB2 . 34070 1
112 . 1 1 17 17 GLU HG2 H 1 2.510 0.000 . 2 . . . A 17 GLU HG2 . 34070 1
113 . 1 1 17 17 GLU HG3 H 1 2.295 0.002 . 2 . . . A 17 GLU HG3 . 34070 1
114 . 1 1 18 18 ASN H H 1 7.476 0.001 . 1 . . . A 18 ASN H . 34070 1
115 . 1 1 18 18 ASN HA H 1 4.395 0.003 . 1 . . . A 18 ASN HA . 34070 1
116 . 1 1 18 18 ASN HB2 H 1 2.574 0.004 . 2 . . . A 18 ASN HB2 . 34070 1
117 . 1 1 18 18 ASN HB3 H 1 2.492 0.004 . 2 . . . A 18 ASN HB3 . 34070 1
118 . 1 1 18 18 ASN HD21 H 1 7.133 0.002 . 2 . . . A 18 ASN HD21 . 34070 1
119 . 1 1 18 18 ASN HD22 H 1 6.348 0.001 . 2 . . . A 18 ASN HD22 . 34070 1
120 . 1 1 19 19 TYR H H 1 7.853 0.001 . 1 . . . A 19 TYR H . 34070 1
121 . 1 1 19 19 TYR HA H 1 4.356 0.010 . 1 . . . A 19 TYR HA . 34070 1
122 . 1 1 19 19 TYR HB2 H 1 3.270 0.001 . 2 . . . A 19 TYR HB2 . 34070 1
123 . 1 1 19 19 TYR HB3 H 1 2.964 0.002 . 2 . . . A 19 TYR HB3 . 34070 1
124 . 1 1 19 19 TYR HD1 H 1 7.251 0.001 . 3 . . . A 19 TYR HD1 . 34070 1
125 . 1 1 19 19 TYR HD2 H 1 7.251 0.001 . 3 . . . A 19 TYR HD2 . 34070 1
126 . 1 1 19 19 TYR HE1 H 1 6.735 0.001 . 3 . . . A 19 TYR HE1 . 34070 1
127 . 1 1 19 19 TYR HE2 H 1 6.735 0.001 . 3 . . . A 19 TYR HE2 . 34070 1
128 . 1 1 20 20 CYS H H 1 7.550 0.001 . 1 . . . A 20 CYS H . 34070 1
129 . 1 1 20 20 CYS HA H 1 4.620 0.004 . 1 . . . A 20 CYS HA . 34070 1
130 . 1 1 20 20 CYS HB2 H 1 3.178 0.003 . 2 . . . A 20 CYS HB2 . 34070 1
131 . 1 1 20 20 CYS HB3 H 1 2.808 0.001 . 2 . . . A 20 CYS HB3 . 34070 1
132 . 1 1 21 21 ASN H H 1 8.003 0.003 . 1 . . . A 21 ASN H . 34070 1
133 . 1 1 21 21 ASN HA H 1 4.739 0.002 . 1 . . . A 21 ASN HA . 34070 1
134 . 1 1 21 21 ASN HB2 H 1 2.814 0.006 . 2 . . . A 21 ASN HB2 . 34070 1
135 . 1 1 21 21 ASN HB3 H 1 2.644 0.004 . 2 . . . A 21 ASN HB3 . 34070 1
136 . 1 1 21 21 ASN HD21 H 1 7.444 0.001 . 2 . . . A 21 ASN HD21 . 34070 1
137 . 1 1 21 21 ASN HD22 H 1 6.664 0.000 . 2 . . . A 21 ASN HD22 . 34070 1
138 . 1 1 22 22 SER H H 1 7.900 0.001 . 1 . . . A 22 SER H . 34070 1
139 . 1 1 22 22 SER HA H 1 4.444 0.003 . 1 . . . A 22 SER HA . 34070 1
140 . 1 1 22 22 SER HB2 H 1 3.932 0.004 . 2 . . . A 22 SER HB2 . 34070 1
141 . 1 1 22 22 SER HB3 H 1 3.875 0.003 . 2 . . . A 22 SER HB3 . 34070 1
142 . 2 2 1 1 PHE HA H 1 4.261 0.003 . 1 . . . B 1 PHE HA . 34070 1
143 . 2 2 1 1 PHE HB2 H 1 3.151 0.002 . 2 . . . B 1 PHE HB2 . 34070 1
144 . 2 2 1 1 PHE HD1 H 1 7.245 0.003 . 3 . . . B 1 PHE HD1 . 34070 1
145 . 2 2 1 1 PHE HD2 H 1 7.245 0.003 . 3 . . . B 1 PHE HD2 . 34070 1
146 . 2 2 1 1 PHE HZ H 1 7.328 0.001 . 1 . . . B 1 PHE HZ . 34070 1
147 . 2 2 2 2 VAL H H 1 8.060 0.003 . 1 . . . B 2 VAL H . 34070 1
148 . 2 2 2 2 VAL HA H 1 4.079 0.005 . 1 . . . B 2 VAL HA . 34070 1
149 . 2 2 2 2 VAL HB H 1 1.902 0.004 . 1 . . . B 2 VAL HB . 34070 1
150 . 2 2 2 2 VAL HG11 H 1 0.852 0.002 . 1 . . . B 2 VAL HG11 . 34070 1
151 . 2 2 2 2 VAL HG12 H 1 0.852 0.002 . 1 . . . B 2 VAL HG12 . 34070 1
152 . 2 2 2 2 VAL HG13 H 1 0.852 0.002 . 1 . . . B 2 VAL HG13 . 34070 1
153 . 2 2 2 2 VAL HG21 H 1 0.859 0.009 . 1 . . . B 2 VAL HG21 . 34070 1
154 . 2 2 2 2 VAL HG22 H 1 0.859 0.009 . 1 . . . B 2 VAL HG22 . 34070 1
155 . 2 2 2 2 VAL HG23 H 1 0.859 0.009 . 1 . . . B 2 VAL HG23 . 34070 1
156 . 2 2 3 3 LYS H H 1 8.192 0.002 . 1 . . . B 3 LYS H . 34070 1
157 . 2 2 3 3 LYS HA H 1 4.238 0.006 . 1 . . . B 3 LYS HA . 34070 1
158 . 2 2 3 3 LYS HB3 H 1 1.648 0.002 . 2 . . . B 3 LYS HB3 . 34070 1
159 . 2 2 3 3 LYS HG2 H 1 1.473 0.004 . 2 . . . B 3 LYS HG2 . 34070 1
160 . 2 2 3 3 LYS HG3 H 1 1.375 0.006 . 2 . . . B 3 LYS HG3 . 34070 1
161 . 2 2 3 3 LYS HD2 H 1 1.637 0.004 . 2 . . . B 3 LYS HD2 . 34070 1
162 . 2 2 3 3 LYS HD3 H 1 1.637 0.004 . 2 . . . B 3 LYS HD3 . 34070 1
163 . 2 2 3 3 LYS HE2 H 1 2.915 0.005 . 2 . . . B 3 LYS HE2 . 34070 1
164 . 2 2 3 3 LYS HE3 H 1 2.915 0.005 . 2 . . . B 3 LYS HE3 . 34070 1
165 . 2 2 4 4 GLN H H 1 8.092 0.002 . 1 . . . B 4 GLN H . 34070 1
166 . 2 2 4 4 GLN HA H 1 4.485 0.000 . 1 . . . B 4 GLN HA . 34070 1
167 . 2 2 4 4 GLN HB2 H 1 2.024 0.004 . 2 . . . B 4 GLN HB2 . 34070 1
168 . 2 2 4 4 GLN HB3 H 1 1.940 0.003 . 2 . . . B 4 GLN HB3 . 34070 1
169 . 2 2 4 4 GLN HG2 H 1 2.231 0.002 . 2 . . . B 4 GLN HG2 . 34070 1
170 . 2 2 4 4 GLN HG3 H 1 2.224 0.002 . 2 . . . B 4 GLN HG3 . 34070 1
171 . 2 2 4 4 GLN HE21 H 1 7.338 0.001 . 2 . . . B 4 GLN HE21 . 34070 1
172 . 2 2 4 4 GLN HE22 H 1 6.647 0.001 . 2 . . . B 4 GLN HE22 . 34070 1
173 . 2 2 5 5 HIS H H 1 8.570 0.001 . 1 . . . B 5 HIS H . 34070 1
174 . 2 2 5 5 HIS HA H 1 4.497 0.023 . 1 . . . B 5 HIS HA . 34070 1
175 . 2 2 5 5 HIS HB2 H 1 3.518 0.005 . 2 . . . B 5 HIS HB2 . 34070 1
176 . 2 2 5 5 HIS HB3 H 1 3.180 0.001 . 2 . . . B 5 HIS HB3 . 34070 1
177 . 2 2 5 5 HIS HD2 H 1 7.357 0.001 . 1 . . . B 5 HIS HD2 . 34070 1
178 . 2 2 5 5 HIS HE1 H 1 8.496 0.001 . 1 . . . B 5 HIS HE1 . 34070 1
179 . 2 2 6 6 LEU H H 1 8.942 0.002 . 1 . . . B 6 LEU H . 34070 1
180 . 2 2 6 6 LEU HA H 1 4.480 0.002 . 1 . . . B 6 LEU HA . 34070 1
181 . 2 2 6 6 LEU HB2 H 1 1.694 0.001 . 2 . . . B 6 LEU HB2 . 34070 1
182 . 2 2 6 6 LEU HB3 H 1 0.913 0.014 . 2 . . . B 6 LEU HB3 . 34070 1
183 . 2 2 6 6 LEU HG H 1 1.555 0.004 . 1 . . . B 6 LEU HG . 34070 1
184 . 2 2 6 6 LEU HD11 H 1 0.850 0.001 . 1 . . . B 6 LEU HD11 . 34070 1
185 . 2 2 6 6 LEU HD12 H 1 0.850 0.001 . 1 . . . B 6 LEU HD12 . 34070 1
186 . 2 2 6 6 LEU HD13 H 1 0.850 0.001 . 1 . . . B 6 LEU HD13 . 34070 1
187 . 2 2 6 6 LEU HD21 H 1 0.712 0.004 . 1 . . . B 6 LEU HD21 . 34070 1
188 . 2 2 6 6 LEU HD22 H 1 0.712 0.004 . 1 . . . B 6 LEU HD22 . 34070 1
189 . 2 2 6 6 LEU HD23 H 1 0.712 0.004 . 1 . . . B 6 LEU HD23 . 34070 1
190 . 2 2 7 7 CYS H H 1 8.217 0.001 . 1 . . . B 7 CYS H . 34070 1
191 . 2 2 7 7 CYS HA H 1 4.925 0.001 . 1 . . . B 7 CYS HA . 34070 1
192 . 2 2 7 7 CYS HB2 H 1 3.200 0.007 . 2 . . . B 7 CYS HB2 . 34070 1
193 . 2 2 7 7 CYS HB3 H 1 2.931 0.002 . 2 . . . B 7 CYS HB3 . 34070 1
194 . 2 2 8 8 GLY H H 1 8.959 0.006 . 1 . . . B 8 GLY H . 34070 1
195 . 2 2 8 8 GLY HA2 H 1 3.965 0.000 . 2 . . . B 8 GLY HA2 . 34070 1
196 . 2 2 8 8 GLY HA3 H 1 3.781 0.003 . 2 . . . B 8 GLY HA3 . 34070 1
197 . 2 2 9 9 SER H H 1 8.968 0.001 . 1 . . . B 9 SER H . 34070 1
198 . 2 2 9 9 SER HA H 1 4.064 0.001 . 1 . . . B 9 SER HA . 34070 1
199 . 2 2 9 9 SER HB2 H 1 3.846 0.002 . 2 . . . B 9 SER HB2 . 34070 1
200 . 2 2 9 9 SER HB3 H 1 3.846 0.002 . 2 . . . B 9 SER HB3 . 34070 1
201 . 2 2 10 10 HIS H H 1 7.952 0.001 . 1 . . . B 10 HIS H . 34070 1
202 . 2 2 10 10 HIS HA H 1 4.474 0.001 . 1 . . . B 10 HIS HA . 34070 1
203 . 2 2 10 10 HIS HB2 H 1 3.525 0.005 . 2 . . . B 10 HIS HB2 . 34070 1
204 . 2 2 10 10 HIS HB3 H 1 3.242 0.008 . 2 . . . B 10 HIS HB3 . 34070 1
205 . 2 2 10 10 HIS HD2 H 1 7.430 0.000 . 1 . . . B 10 HIS HD2 . 34070 1
206 . 2 2 10 10 HIS HE1 H 1 8.637 0.000 . 1 . . . B 10 HIS HE1 . 34070 1
207 . 2 2 11 11 LEU H H 1 7.013 0.001 . 1 . . . B 11 LEU H . 34070 1
208 . 2 2 11 11 LEU HA H 1 3.981 0.003 . 1 . . . B 11 LEU HA . 34070 1
209 . 2 2 11 11 LEU HB2 H 1 1.862 0.001 . 2 . . . B 11 LEU HB2 . 34070 1
210 . 2 2 11 11 LEU HB3 H 1 1.178 0.003 . 2 . . . B 11 LEU HB3 . 34070 1
211 . 2 2 11 11 LEU HG H 1 1.335 0.005 . 1 . . . B 11 LEU HG . 34070 1
212 . 2 2 11 11 LEU HD11 H 1 0.797 0.005 . 1 . . . B 11 LEU HD11 . 34070 1
213 . 2 2 11 11 LEU HD12 H 1 0.797 0.005 . 1 . . . B 11 LEU HD12 . 34070 1
214 . 2 2 11 11 LEU HD13 H 1 0.797 0.005 . 1 . . . B 11 LEU HD13 . 34070 1
215 . 2 2 11 11 LEU HD21 H 1 0.725 0.003 . 1 . . . B 11 LEU HD21 . 34070 1
216 . 2 2 11 11 LEU HD22 H 1 0.725 0.003 . 1 . . . B 11 LEU HD22 . 34070 1
217 . 2 2 11 11 LEU HD23 H 1 0.725 0.003 . 1 . . . B 11 LEU HD23 . 34070 1
218 . 2 2 12 12 VAL H H 1 7.248 0.001 . 1 . . . B 12 VAL H . 34070 1
219 . 2 2 12 12 VAL HA H 1 3.358 0.003 . 1 . . . B 12 VAL HA . 34070 1
220 . 2 2 12 12 VAL HB H 1 2.040 0.006 . 1 . . . B 12 VAL HB . 34070 1
221 . 2 2 12 12 VAL HG11 H 1 0.949 0.003 . 1 . . . B 12 VAL HG11 . 34070 1
222 . 2 2 12 12 VAL HG12 H 1 0.949 0.003 . 1 . . . B 12 VAL HG12 . 34070 1
223 . 2 2 12 12 VAL HG13 H 1 0.949 0.003 . 1 . . . B 12 VAL HG13 . 34070 1
224 . 2 2 12 12 VAL HG21 H 1 0.907 0.001 . 1 . . . B 12 VAL HG21 . 34070 1
225 . 2 2 12 12 VAL HG22 H 1 0.907 0.001 . 1 . . . B 12 VAL HG22 . 34070 1
226 . 2 2 12 12 VAL HG23 H 1 0.907 0.001 . 1 . . . B 12 VAL HG23 . 34070 1
227 . 2 2 13 13 GLU H H 1 7.955 0.001 . 1 . . . B 13 GLU H . 34070 1
228 . 2 2 13 13 GLU HA H 1 4.055 0.003 . 1 . . . B 13 GLU HA . 34070 1
229 . 2 2 13 13 GLU HB2 H 1 2.128 0.003 . 2 . . . B 13 GLU HB2 . 34070 1
230 . 2 2 13 13 GLU HB3 H 1 2.051 0.005 . 2 . . . B 13 GLU HB3 . 34070 1
231 . 2 2 13 13 GLU HG2 H 1 2.504 0.006 . 2 . . . B 13 GLU HG2 . 34070 1
232 . 2 2 14 14 ALA H H 1 7.729 0.001 . 1 . . . B 14 ALA H . 34070 1
233 . 2 2 14 14 ALA HA H 1 4.060 0.003 . 1 . . . B 14 ALA HA . 34070 1
234 . 2 2 14 14 ALA HB1 H 1 1.455 0.001 . 1 . . . B 14 ALA HB1 . 34070 1
235 . 2 2 14 14 ALA HB2 H 1 1.455 0.001 . 1 . . . B 14 ALA HB2 . 34070 1
236 . 2 2 14 14 ALA HB3 H 1 1.455 0.001 . 1 . . . B 14 ALA HB3 . 34070 1
237 . 2 2 15 15 LEU H H 1 8.084 0.001 . 1 . . . B 15 LEU H . 34070 1
238 . 2 2 15 15 LEU HA H 1 3.923 0.001 . 1 . . . B 15 LEU HA . 34070 1
239 . 2 2 15 15 LEU HB2 H 1 1.545 0.003 . 2 . . . B 15 LEU HB2 . 34070 1
240 . 2 2 15 15 LEU HB3 H 1 1.130 0.002 . 2 . . . B 15 LEU HB3 . 34070 1
241 . 2 2 15 15 LEU HD11 H 1 0.696 0.006 . 1 . . . B 15 LEU HD11 . 34070 1
242 . 2 2 15 15 LEU HD12 H 1 0.696 0.006 . 1 . . . B 15 LEU HD12 . 34070 1
243 . 2 2 15 15 LEU HD13 H 1 0.696 0.006 . 1 . . . B 15 LEU HD13 . 34070 1
244 . 2 2 15 15 LEU HD21 H 1 0.554 0.001 . 1 . . . B 15 LEU HD21 . 34070 1
245 . 2 2 15 15 LEU HD22 H 1 0.554 0.001 . 1 . . . B 15 LEU HD22 . 34070 1
246 . 2 2 15 15 LEU HD23 H 1 0.554 0.001 . 1 . . . B 15 LEU HD23 . 34070 1
247 . 2 2 16 16 TYR H H 1 8.176 0.002 . 1 . . . B 16 TYR H . 34070 1
248 . 2 2 16 16 TYR HA H 1 4.182 0.001 . 1 . . . B 16 TYR HA . 34070 1
249 . 2 2 16 16 TYR HB2 H 1 3.102 0.001 . 2 . . . B 16 TYR HB2 . 34070 1
250 . 2 2 16 16 TYR HB3 H 1 3.102 0.001 . 2 . . . B 16 TYR HB3 . 34070 1
251 . 2 2 16 16 TYR HD1 H 1 7.083 0.001 . 3 . . . B 16 TYR HD1 . 34070 1
252 . 2 2 16 16 TYR HD2 H 1 7.083 0.001 . 3 . . . B 16 TYR HD2 . 34070 1
253 . 2 2 16 16 TYR HE1 H 1 6.734 0.002 . 3 . . . B 16 TYR HE1 . 34070 1
254 . 2 2 16 16 TYR HE2 H 1 6.734 0.002 . 3 . . . B 16 TYR HE2 . 34070 1
255 . 2 2 17 17 LEU H H 1 7.918 0.004 . 1 . . . B 17 LEU H . 34070 1
256 . 2 2 17 17 LEU HA H 1 4.046 0.002 . 1 . . . B 17 LEU HA . 34070 1
257 . 2 2 17 17 LEU HB2 H 1 1.881 0.007 . 2 . . . B 17 LEU HB2 . 34070 1
258 . 2 2 17 17 LEU HB3 H 1 1.615 0.004 . 2 . . . B 17 LEU HB3 . 34070 1
259 . 2 2 17 17 LEU HG H 1 1.867 0.000 . 1 . . . B 17 LEU HG . 34070 1
260 . 2 2 17 17 LEU HD11 H 1 0.935 0.003 . 1 . . . B 17 LEU HD11 . 34070 1
261 . 2 2 17 17 LEU HD12 H 1 0.935 0.003 . 1 . . . B 17 LEU HD12 . 34070 1
262 . 2 2 17 17 LEU HD13 H 1 0.935 0.003 . 1 . . . B 17 LEU HD13 . 34070 1
263 . 2 2 17 17 LEU HD21 H 1 0.908 0.002 . 1 . . . B 17 LEU HD21 . 34070 1
264 . 2 2 17 17 LEU HD22 H 1 0.908 0.002 . 1 . . . B 17 LEU HD22 . 34070 1
265 . 2 2 17 17 LEU HD23 H 1 0.908 0.002 . 1 . . . B 17 LEU HD23 . 34070 1
266 . 2 2 18 18 VAL H H 1 8.418 0.002 . 1 . . . B 18 VAL H . 34070 1
267 . 2 2 18 18 VAL HA H 1 3.821 0.001 . 1 . . . B 18 VAL HA . 34070 1
268 . 2 2 18 18 VAL HB H 1 2.080 0.001 . 1 . . . B 18 VAL HB . 34070 1
269 . 2 2 18 18 VAL HG11 H 1 0.993 0.001 . 1 . . . B 18 VAL HG11 . 34070 1
270 . 2 2 18 18 VAL HG12 H 1 0.993 0.001 . 1 . . . B 18 VAL HG12 . 34070 1
271 . 2 2 18 18 VAL HG13 H 1 0.993 0.001 . 1 . . . B 18 VAL HG13 . 34070 1
272 . 2 2 18 18 VAL HG21 H 1 0.857 0.001 . 1 . . . B 18 VAL HG21 . 34070 1
273 . 2 2 18 18 VAL HG22 H 1 0.857 0.001 . 1 . . . B 18 VAL HG22 . 34070 1
274 . 2 2 18 18 VAL HG23 H 1 0.857 0.001 . 1 . . . B 18 VAL HG23 . 34070 1
275 . 2 2 19 19 CYS H H 1 8.628 0.003 . 1 . . . B 19 CYS H . 34070 1
276 . 2 2 19 19 CYS HA H 1 4.702 0.003 . 1 . . . B 19 CYS HA . 34070 1
277 . 2 2 19 19 CYS HB2 H 1 3.183 0.001 . 2 . . . B 19 CYS HB2 . 34070 1
278 . 2 2 19 19 CYS HB3 H 1 2.926 0.005 . 2 . . . B 19 CYS HB3 . 34070 1
279 . 2 2 20 20 GLY H H 1 7.766 0.001 . 1 . . . B 20 GLY H . 34070 1
280 . 2 2 20 20 GLY HA2 H 1 3.874 0.001 . 2 . . . B 20 GLY HA2 . 34070 1
281 . 2 2 20 20 GLY HA3 H 1 3.874 0.001 . 2 . . . B 20 GLY HA3 . 34070 1
282 . 2 2 21 21 GLU H H 1 8.126 0.001 . 1 . . . B 21 GLU H . 34070 1
283 . 2 2 21 21 GLU HA H 1 4.193 0.002 . 1 . . . B 21 GLU HA . 34070 1
284 . 2 2 21 21 GLU HB2 H 1 2.134 0.001 . 2 . . . B 21 GLU HB2 . 34070 1
285 . 2 2 21 21 GLU HB3 H 1 2.049 0.002 . 2 . . . B 21 GLU HB3 . 34070 1
286 . 2 2 21 21 GLU HG2 H 1 2.479 0.060 . 2 . . . B 21 GLU HG2 . 34070 1
287 . 2 2 21 21 GLU HG3 H 1 2.446 0.001 . 2 . . . B 21 GLU HG3 . 34070 1
288 . 2 2 22 22 ARG H H 1 7.862 0.001 . 1 . . . B 22 ARG H . 34070 1
289 . 2 2 22 22 ARG HA H 1 4.183 0.002 . 1 . . . B 22 ARG HA . 34070 1
290 . 2 2 22 22 ARG HB2 H 1 1.898 0.004 . 2 . . . B 22 ARG HB2 . 34070 1
291 . 2 2 22 22 ARG HB3 H 1 1.844 0.003 . 2 . . . B 22 ARG HB3 . 34070 1
292 . 2 2 22 22 ARG HG2 H 1 1.679 0.005 . 2 . . . B 22 ARG HG2 . 34070 1
293 . 2 2 22 22 ARG HG3 H 1 1.679 0.005 . 2 . . . B 22 ARG HG3 . 34070 1
294 . 2 2 22 22 ARG HD2 H 1 3.186 0.003 . 2 . . . B 22 ARG HD2 . 34070 1
295 . 2 2 22 22 ARG HD3 H 1 3.186 0.003 . 2 . . . B 22 ARG HD3 . 34070 1
296 . 2 2 22 22 ARG HE H 1 7.147 0.002 . 1 . . . B 22 ARG HE . 34070 1
297 . 2 2 23 23 GLY H H 1 7.786 0.001 . 1 . . . B 23 GLY H . 34070 1
298 . 2 2 23 23 GLY HA2 H 1 3.887 0.001 . 2 . . . B 23 GLY HA2 . 34070 1
299 . 2 2 23 23 GLY HA3 H 1 3.789 0.008 . 2 . . . B 23 GLY HA3 . 34070 1
300 . 2 2 24 24 PHE H H 1 7.678 0.001 . 1 . . . B 24 PHE H . 34070 1
301 . 2 2 24 24 PHE HA H 1 4.631 0.000 . 1 . . . B 24 PHE HA . 34070 1
302 . 2 2 24 24 PHE HB2 H 1 2.984 0.006 . 2 . . . B 24 PHE HB2 . 34070 1
303 . 2 2 24 24 PHE HB3 H 1 2.868 0.004 . 2 . . . B 24 PHE HB3 . 34070 1
304 . 2 2 24 24 PHE HD1 H 1 6.984 0.002 . 3 . . . B 24 PHE HD1 . 34070 1
305 . 2 2 24 24 PHE HD2 H 1 6.984 0.002 . 3 . . . B 24 PHE HD2 . 34070 1
306 . 2 2 24 24 PHE HE1 H 1 7.149 0.000 . 3 . . . B 24 PHE HE1 . 34070 1
307 . 2 2 24 24 PHE HE2 H 1 7.149 0.000 . 3 . . . B 24 PHE HE2 . 34070 1
308 . 2 2 25 25 PHE H H 1 7.978 0.001 . 1 . . . B 25 PHE H . 34070 1
309 . 2 2 25 25 PHE HA H 1 4.565 0.002 . 1 . . . B 25 PHE HA . 34070 1
310 . 2 2 25 25 PHE HB2 H 1 3.066 0.002 . 2 . . . B 25 PHE HB2 . 34070 1
311 . 2 2 25 25 PHE HB3 H 1 2.944 0.005 . 2 . . . B 25 PHE HB3 . 34070 1
312 . 2 2 25 25 PHE HD1 H 1 7.173 0.001 . 3 . . . B 25 PHE HD1 . 34070 1
313 . 2 2 25 25 PHE HD2 H 1 7.173 0.001 . 3 . . . B 25 PHE HD2 . 34070 1
314 . 2 2 25 25 PHE HE1 H 1 7.275 0.001 . 3 . . . B 25 PHE HE1 . 34070 1
315 . 2 2 25 25 PHE HE2 H 1 7.275 0.001 . 3 . . . B 25 PHE HE2 . 34070 1
316 . 2 2 26 26 TYR H H 1 7.796 0.002 . 1 . . . B 26 TYR H . 34070 1
317 . 2 2 26 26 TYR HA H 1 4.563 0.005 . 1 . . . B 26 TYR HA . 34070 1
318 . 2 2 26 26 TYR HB2 H 1 2.941 0.006 . 2 . . . B 26 TYR HB2 . 34070 1
319 . 2 2 26 26 TYR HB3 H 1 2.898 0.002 . 2 . . . B 26 TYR HB3 . 34070 1
320 . 2 2 26 26 TYR HD1 H 1 7.036 0.004 . 3 . . . B 26 TYR HD1 . 34070 1
321 . 2 2 26 26 TYR HD2 H 1 7.036 0.004 . 3 . . . B 26 TYR HD2 . 34070 1
322 . 2 2 26 26 TYR HE1 H 1 6.756 0.002 . 3 . . . B 26 TYR HE1 . 34070 1
323 . 2 2 26 26 TYR HE2 H 1 6.756 0.002 . 3 . . . B 26 TYR HE2 . 34070 1
324 . 2 2 27 27 THR H H 1 7.690 0.001 . 1 . . . B 27 THR H . 34070 1
325 . 2 2 27 27 THR HA H 1 4.551 0.009 . 1 . . . B 27 THR HA . 34070 1
326 . 2 2 27 27 THR HB H 1 4.068 0.002 . 1 . . . B 27 THR HB . 34070 1
327 . 2 2 27 27 THR HG21 H 1 1.163 0.001 . 1 . . . B 27 THR HG21 . 34070 1
328 . 2 2 27 27 THR HG22 H 1 1.163 0.001 . 1 . . . B 27 THR HG22 . 34070 1
329 . 2 2 27 27 THR HG23 H 1 1.163 0.001 . 1 . . . B 27 THR HG23 . 34070 1
330 . 2 2 28 28 PRO HB2 H 1 2.238 0.002 . 2 . . . B 28 PRO HB2 . 34070 1
331 . 2 2 28 28 PRO HB3 H 1 1.899 0.004 . 2 . . . B 28 PRO HB3 . 34070 1
332 . 2 2 28 28 PRO HG3 H 1 1.942 0.001 . 2 . . . B 28 PRO HG3 . 34070 1
333 . 2 2 28 28 PRO HD2 H 1 3.638 0.001 . 2 . . . B 28 PRO HD2 . 34070 1
334 . 2 2 28 28 PRO HD3 H 1 3.638 0.001 . 2 . . . B 28 PRO HD3 . 34070 1
335 . 2 2 29 29 LYS H H 1 8.135 0.003 . 1 . . . B 29 LYS H . 34070 1
336 . 2 2 29 29 LYS HA H 1 4.315 0.003 . 1 . . . B 29 LYS HA . 34070 1
337 . 2 2 29 29 LYS HB2 H 1 1.817 0.001 . 2 . . . B 29 LYS HB2 . 34070 1
338 . 2 2 29 29 LYS HB3 H 1 1.719 0.002 . 2 . . . B 29 LYS HB3 . 34070 1
339 . 2 2 29 29 LYS HG2 H 1 1.433 0.002 . 2 . . . B 29 LYS HG2 . 34070 1
340 . 2 2 29 29 LYS HG3 H 1 1.433 0.002 . 2 . . . B 29 LYS HG3 . 34070 1
341 . 2 2 29 29 LYS HE2 H 1 2.929 0.003 . 2 . . . B 29 LYS HE2 . 34070 1
342 . 2 2 29 29 LYS HE3 H 1 2.929 0.003 . 2 . . . B 29 LYS HE3 . 34070 1
343 . 2 2 30 30 THR H H 1 7.878 0.001 . 1 . . . B 30 THR H . 34070 1
344 . 2 2 30 30 THR HA H 1 4.290 0.009 . 1 . . . B 30 THR HA . 34070 1
345 . 2 2 30 30 THR HG21 H 1 1.178 0.001 . 1 . . . B 30 THR HG21 . 34070 1
346 . 2 2 30 30 THR HG22 H 1 1.178 0.001 . 1 . . . B 30 THR HG22 . 34070 1
347 . 2 2 30 30 THR HG23 H 1 1.178 0.001 . 1 . . . B 30 THR HG23 . 34070 1
348 . 2 2 31 31 ARG H H 1 8.104 0.000 . 1 . . . B 31 ARG H . 34070 1
349 . 2 2 31 31 ARG HA H 1 4.326 0.001 . 1 . . . B 31 ARG HA . 34070 1
350 . 2 2 31 31 ARG HB2 H 1 1.882 0.003 . 2 . . . B 31 ARG HB2 . 34070 1
351 . 2 2 31 31 ARG HB3 H 1 1.750 0.000 . 2 . . . B 31 ARG HB3 . 34070 1
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