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 30481
_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 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
;
Assignments made at 298 K (with and without 10% w/v glycerol )
were transferred to
spectra at 285 K and with 10% glycerol
;
_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 '3D 1H-15N NOESY' . . . 30481 1
2 '3D 1H-13C NOESY' . . . 30481 1
3 '3D HCCH-TOCSY' . . . 30481 1
4 '3D HNCA' . . . 30481 1
5 '3D HNCACB' . . . 30481 1
6 '2D 1H-15N HSQC' . . . 30481 1
7 '2D 1H-15N HSQC' . . . 30481 1
8 '2D 1H-13C HSQC aliphatic' . . . 30481 1
9 '2D 1H-13C HSQC aliphatic' . . . 30481 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.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 GLY HA2 H 1 3.563 0.02 . 2 . . . . A 1 GLY HA2 . 30481 1
2 . 1 1 1 1 GLY HA3 H 1 3.441 0.02 . 2 . . . . A 1 GLY HA3 . 30481 1
3 . 1 1 1 1 GLY CA C 13 43.701 0.3 . 1 . . . . A 1 GLY CA . 30481 1
4 . 1 1 2 2 ILE HA H 1 3.778 0.02 . 1 . . . . A 2 ILE HA . 30481 1
5 . 1 1 2 2 ILE HB H 1 1.576 0.02 . 1 . . . . A 2 ILE HB . 30481 1
6 . 1 1 2 2 ILE HG12 H 1 1.183 0.02 . 2 . . . . A 2 ILE HG12 . 30481 1
7 . 1 1 2 2 ILE HG13 H 1 1.095 0.02 . 2 . . . . A 2 ILE HG13 . 30481 1
8 . 1 1 2 2 ILE HG21 H 1 0.654 0.02 . 1 . . . . A 2 ILE HG21 . 30481 1
9 . 1 1 2 2 ILE HG22 H 1 0.654 0.02 . 1 . . . . A 2 ILE HG22 . 30481 1
10 . 1 1 2 2 ILE HG23 H 1 0.654 0.02 . 1 . . . . A 2 ILE HG23 . 30481 1
11 . 1 1 2 2 ILE HD11 H 1 0.602 0.02 . 1 . . . . A 2 ILE HD11 . 30481 1
12 . 1 1 2 2 ILE HD12 H 1 0.602 0.02 . 1 . . . . A 2 ILE HD12 . 30481 1
13 . 1 1 2 2 ILE HD13 H 1 0.602 0.02 . 1 . . . . A 2 ILE HD13 . 30481 1
14 . 1 1 2 2 ILE CA C 13 62.491 0.3 . 1 . . . . A 2 ILE CA . 30481 1
15 . 1 1 2 2 ILE CB C 13 38.354 0.3 . 1 . . . . A 2 ILE CB . 30481 1
16 . 1 1 2 2 ILE CG1 C 13 27.964 0.3 . 1 . . . . A 2 ILE CG1 . 30481 1
17 . 1 1 2 2 ILE CG2 C 13 16.93 0.3 . 1 . . . . A 2 ILE CG2 . 30481 1
18 . 1 1 2 2 ILE CD1 C 13 12.776 0.3 . 1 . . . . A 2 ILE CD1 . 30481 1
19 . 1 1 3 3 GLY H H 1 8.564 0.02 . 1 . . . . A 3 GLY H . 30481 1
20 . 1 1 3 3 GLY HA2 H 1 3.436 0.02 . 1 . . . . A 3 GLY HA2 . 30481 1
21 . 1 1 3 3 GLY HA3 H 1 3.558 0.02 . 1 . . . . A 3 GLY HA3 . 30481 1
22 . 1 1 3 3 GLY CA C 13 46.954 0.3 . 1 . . . . A 3 GLY CA . 30481 1
23 . 1 1 3 3 GLY N N 15 109.085 0.3 . 1 . . . . A 3 GLY N . 30481 1
24 . 1 1 4 4 ALA H H 1 7.628 0.02 . 1 . . . . A 4 ALA H . 30481 1
25 . 1 1 4 4 ALA HA H 1 3.828 0.02 . 1 . . . . A 4 ALA HA . 30481 1
26 . 1 1 4 4 ALA HB1 H 1 1.204 0.02 . 1 . . . . A 4 ALA HB1 . 30481 1
27 . 1 1 4 4 ALA HB2 H 1 1.204 0.02 . 1 . . . . A 4 ALA HB2 . 30481 1
28 . 1 1 4 4 ALA HB3 H 1 1.204 0.02 . 1 . . . . A 4 ALA HB3 . 30481 1
29 . 1 1 4 4 ALA CA C 13 54.764 0.3 . 1 . . . . A 4 ALA CA . 30481 1
30 . 1 1 4 4 ALA CB C 13 17.948 0.3 . 1 . . . . A 4 ALA CB . 30481 1
31 . 1 1 4 4 ALA N N 15 122.773 0.3 . 1 . . . . A 4 ALA N . 30481 1
32 . 1 1 5 5 VAL H H 1 7.177 0.02 . 1 . . . . A 5 VAL H . 30481 1
33 . 1 1 5 5 VAL HA H 1 3.289 0.02 . 1 . . . . A 5 VAL HA . 30481 1
34 . 1 1 5 5 VAL HB H 1 1.954 0.02 . 1 . . . . A 5 VAL HB . 30481 1
35 . 1 1 5 5 VAL HG11 H 1 0.624 0.02 . 1 . . . . A 5 VAL HG11 . 30481 1
36 . 1 1 5 5 VAL HG12 H 1 0.624 0.02 . 1 . . . . A 5 VAL HG12 . 30481 1
37 . 1 1 5 5 VAL HG13 H 1 0.624 0.02 . 1 . . . . A 5 VAL HG13 . 30481 1
38 . 1 1 5 5 VAL HG21 H 1 0.637 0.02 . 1 . . . . A 5 VAL HG21 . 30481 1
39 . 1 1 5 5 VAL HG22 H 1 0.637 0.02 . 1 . . . . A 5 VAL HG22 . 30481 1
40 . 1 1 5 5 VAL HG23 H 1 0.637 0.02 . 1 . . . . A 5 VAL HG23 . 30481 1
41 . 1 1 5 5 VAL CA C 13 66.128 0.3 . 1 . . . . A 5 VAL CA . 30481 1
42 . 1 1 5 5 VAL CB C 13 31.704 0.3 . 1 . . . . A 5 VAL CB . 30481 1
43 . 1 1 5 5 VAL CG1 C 13 20.174 0.3 . 1 . . . . A 5 VAL CG1 . 30481 1
44 . 1 1 5 5 VAL CG2 C 13 20.417 0.3 . 1 . . . . A 5 VAL CG2 . 30481 1
45 . 1 1 5 5 VAL N N 15 117.444 0.3 . 1 . . . . A 5 VAL N . 30481 1
46 . 1 1 6 6 LEU H H 1 8.083 0.02 . 1 . . . . A 6 LEU H . 30481 1
47 . 1 1 6 6 LEU HA H 1 3.765 0.02 . 1 . . . . A 6 LEU HA . 30481 1
48 . 1 1 6 6 LEU HB2 H 1 1.206 0.02 . 1 . . . . A 6 LEU HB2 . 30481 1
49 . 1 1 6 6 LEU HB3 H 1 1.56 0.02 . 1 . . . . A 6 LEU HB3 . 30481 1
50 . 1 1 6 6 LEU HG H 1 1.514 0.02 . 1 . . . . A 6 LEU HG . 30481 1
51 . 1 1 6 6 LEU HD11 H 1 0.564 0.02 . 1 . . . . A 6 LEU HD11 . 30481 1
52 . 1 1 6 6 LEU HD12 H 1 0.564 0.02 . 1 . . . . A 6 LEU HD12 . 30481 1
53 . 1 1 6 6 LEU HD13 H 1 0.564 0.02 . 1 . . . . A 6 LEU HD13 . 30481 1
54 . 1 1 6 6 LEU HD21 H 1 0.556 0.02 . 1 . . . . A 6 LEU HD21 . 30481 1
55 . 1 1 6 6 LEU HD22 H 1 0.556 0.02 . 1 . . . . A 6 LEU HD22 . 30481 1
56 . 1 1 6 6 LEU HD23 H 1 0.556 0.02 . 1 . . . . A 6 LEU HD23 . 30481 1
57 . 1 1 6 6 LEU CA C 13 57.885 0.3 . 1 . . . . A 6 LEU CA . 30481 1
58 . 1 1 6 6 LEU CB C 13 41.627 0.3 . 1 . . . . A 6 LEU CB . 30481 1
59 . 1 1 6 6 LEU CG C 13 26.525 0.3 . 1 . . . . A 6 LEU CG . 30481 1
60 . 1 1 6 6 LEU CD1 C 13 24.606 0.3 . 1 . . . . A 6 LEU CD1 . 30481 1
61 . 1 1 6 6 LEU CD2 C 13 24.54 0.3 . 1 . . . . A 6 LEU CD2 . 30481 1
62 . 1 1 6 6 LEU N N 15 117.746 0.3 . 1 . . . . A 6 LEU N . 30481 1
63 . 1 1 7 7 LYS H H 1 7.739 0.02 . 1 . . . . A 7 LYS H . 30481 1
64 . 1 1 7 7 LYS HA H 1 3.671 0.02 . 1 . . . . A 7 LYS HA . 30481 1
65 . 1 1 7 7 LYS HB2 H 1 1.669 0.02 . 2 . . . . A 7 LYS HB2 . 30481 1
66 . 1 1 7 7 LYS HB3 H 1 1.669 0.02 . 2 . . . . A 7 LYS HB3 . 30481 1
67 . 1 1 7 7 LYS HG2 H 1 1.093 0.02 . 2 . . . . A 7 LYS HG2 . 30481 1
68 . 1 1 7 7 LYS HG3 H 1 1.093 0.02 . 2 . . . . A 7 LYS HG3 . 30481 1
69 . 1 1 7 7 LYS HD2 H 1 1.362 0.02 . 2 . . . . A 7 LYS HD2 . 30481 1
70 . 1 1 7 7 LYS HD3 H 1 1.362 0.02 . 2 . . . . A 7 LYS HD3 . 30481 1
71 . 1 1 7 7 LYS HE2 H 1 2.612 0.02 . 2 . . . . A 7 LYS HE2 . 30481 1
72 . 1 1 7 7 LYS HE3 H 1 2.612 0.02 . 2 . . . . A 7 LYS HE3 . 30481 1
73 . 1 1 7 7 LYS CA C 13 59.631 0.3 . 1 . . . . A 7 LYS CA . 30481 1
74 . 1 1 7 7 LYS CB C 13 31.958 0.3 . 1 . . . . A 7 LYS CB . 30481 1
75 . 1 1 7 7 LYS CG C 13 25.221 0.3 . 1 . . . . A 7 LYS CG . 30481 1
76 . 1 1 7 7 LYS CD C 13 29.084 0.3 . 1 . . . . A 7 LYS CD . 30481 1
77 . 1 1 7 7 LYS CE C 13 41.844 0.3 . 1 . . . . A 7 LYS CE . 30481 1
78 . 1 1 7 7 LYS N N 15 119.79 0.3 . 1 . . . . A 7 LYS N . 30481 1
79 . 1 1 8 8 VAL H H 1 7.578 0.02 . 1 . . . . A 8 VAL H . 30481 1
80 . 1 1 8 8 VAL HA H 1 3.281 0.02 . 1 . . . . A 8 VAL HA . 30481 1
81 . 1 1 8 8 VAL HB H 1 2.017 0.02 . 1 . . . . A 8 VAL HB . 30481 1
82 . 1 1 8 8 VAL HG11 H 1 0.774 0.02 . 1 . . . . A 8 VAL HG11 . 30481 1
83 . 1 1 8 8 VAL HG12 H 1 0.774 0.02 . 1 . . . . A 8 VAL HG12 . 30481 1
84 . 1 1 8 8 VAL HG13 H 1 0.774 0.02 . 1 . . . . A 8 VAL HG13 . 30481 1
85 . 1 1 8 8 VAL HG21 H 1 0.724 0.02 . 1 . . . . A 8 VAL HG21 . 30481 1
86 . 1 1 8 8 VAL HG22 H 1 0.724 0.02 . 1 . . . . A 8 VAL HG22 . 30481 1
87 . 1 1 8 8 VAL HG23 H 1 0.724 0.02 . 1 . . . . A 8 VAL HG23 . 30481 1
88 . 1 1 8 8 VAL CA C 13 66.308 0.3 . 1 . . . . A 8 VAL CA . 30481 1
89 . 1 1 8 8 VAL CB C 13 31.612 0.3 . 1 . . . . A 8 VAL CB . 30481 1
90 . 1 1 8 8 VAL CG1 C 13 21.884 0.3 . 1 . . . . A 8 VAL CG1 . 30481 1
91 . 1 1 8 8 VAL CG2 C 13 21.541 0.3 . 1 . . . . A 8 VAL CG2 . 30481 1
92 . 1 1 8 8 VAL N N 15 120.557 0.3 . 1 . . . . A 8 VAL N . 30481 1
93 . 1 1 9 9 LEU H H 1 8.292 0.02 . 1 . . . . A 9 LEU H . 30481 1
94 . 1 1 9 9 LEU HA H 1 3.782 0.02 . 1 . . . . A 9 LEU HA . 30481 1
95 . 1 1 9 9 LEU HB2 H 1 1.585 0.02 . 2 . . . . A 9 LEU HB2 . 30481 1
96 . 1 1 9 9 LEU HB3 H 1 1.235 0.02 . 2 . . . . A 9 LEU HB3 . 30481 1
97 . 1 1 9 9 LEU HG H 1 1.594 0.02 . 1 . . . . A 9 LEU HG . 30481 1
98 . 1 1 9 9 LEU HD11 H 1 0.536 0.02 . 1 . . . . A 9 LEU HD11 . 30481 1
99 . 1 1 9 9 LEU HD12 H 1 0.536 0.02 . 1 . . . . A 9 LEU HD12 . 30481 1
100 . 1 1 9 9 LEU HD13 H 1 0.536 0.02 . 1 . . . . A 9 LEU HD13 . 30481 1
101 . 1 1 9 9 LEU HD21 H 1 0.536 0.02 . 1 . . . . A 9 LEU HD21 . 30481 1
102 . 1 1 9 9 LEU HD22 H 1 0.536 0.02 . 1 . . . . A 9 LEU HD22 . 30481 1
103 . 1 1 9 9 LEU HD23 H 1 0.536 0.02 . 1 . . . . A 9 LEU HD23 . 30481 1
104 . 1 1 9 9 LEU CA C 13 57.983 0.3 . 1 . . . . A 9 LEU CA . 30481 1
105 . 1 1 9 9 LEU CB C 13 41.878 0.3 . 1 . . . . A 9 LEU CB . 30481 1
106 . 1 1 9 9 LEU CG C 13 26.191 0.3 . 1 . . . . A 9 LEU CG . 30481 1
107 . 1 1 9 9 LEU CD1 C 13 21.925 0.3 . 1 . . . . A 9 LEU CD1 . 30481 1
108 . 1 1 9 9 LEU CD2 C 13 21.717 0.3 . 1 . . . . A 9 LEU CD2 . 30481 1
109 . 1 1 9 9 LEU N N 15 118.727 0.3 . 1 . . . . A 9 LEU N . 30481 1
110 . 1 1 10 10 THR H H 1 7.871 0.02 . 1 . . . . A 10 THR H . 30481 1
111 . 1 1 10 10 THR HA H 1 3.875 0.02 . 1 . . . . A 10 THR HA . 30481 1
112 . 1 1 10 10 THR HB H 1 4.03 0.02 . 1 . . . . A 10 THR HB . 30481 1
113 . 1 1 10 10 THR HG21 H 1 1.02 0.02 . 1 . . . . A 10 THR HG21 . 30481 1
114 . 1 1 10 10 THR HG22 H 1 1.02 0.02 . 1 . . . . A 10 THR HG22 . 30481 1
115 . 1 1 10 10 THR HG23 H 1 1.02 0.02 . 1 . . . . A 10 THR HG23 . 30481 1
116 . 1 1 10 10 THR CA C 13 64.204 0.3 . 1 . . . . A 10 THR CA . 30481 1
117 . 1 1 10 10 THR CB C 13 69.612 0.3 . 1 . . . . A 10 THR CB . 30481 1
118 . 1 1 10 10 THR CG2 C 13 21.098 0.3 . 1 . . . . A 10 THR CG2 . 30481 1
119 . 1 1 10 10 THR N N 15 106.6 0.3 . 1 . . . . A 10 THR N . 30481 1
120 . 1 1 11 11 THR H H 1 7.425 0.02 . 1 . . . . A 11 THR H . 30481 1
121 . 1 1 11 11 THR HA H 1 4.07 0.02 . 1 . . . . A 11 THR HA . 30481 1
122 . 1 1 11 11 THR HB H 1 4.006 0.02 . 1 . . . . A 11 THR HB . 30481 1
123 . 1 1 11 11 THR HG21 H 1 1.022 0.02 . 1 . . . . A 11 THR HG21 . 30481 1
124 . 1 1 11 11 THR HG22 H 1 1.022 0.02 . 1 . . . . A 11 THR HG22 . 30481 1
125 . 1 1 11 11 THR HG23 H 1 1.022 0.02 . 1 . . . . A 11 THR HG23 . 30481 1
126 . 1 1 11 11 THR CA C 13 64.075 0.3 . 1 . . . . A 11 THR CA . 30481 1
127 . 1 1 11 11 THR CB C 13 69.979 0.3 . 1 . . . . A 11 THR CB . 30481 1
128 . 1 1 11 11 THR CG2 C 13 20.702 0.3 . 1 . . . . A 11 THR CG2 . 30481 1
129 . 1 1 11 11 THR N N 15 113.319 0.3 . 1 . . . . A 11 THR N . 30481 1
130 . 1 1 12 12 GLY H H 1 7.997 0.02 . 1 . . . . A 12 GLY H . 30481 1
131 . 1 1 12 12 GLY HA2 H 1 3.818 0.02 . 2 . . . . A 12 GLY HA2 . 30481 1
132 . 1 1 12 12 GLY HA3 H 1 3.663 0.02 . 2 . . . . A 12 GLY HA3 . 30481 1
133 . 1 1 12 12 GLY CA C 13 45.759 0.3 . 1 . . . . A 12 GLY CA . 30481 1
134 . 1 1 12 12 GLY N N 15 109.013 0.3 . 1 . . . . A 12 GLY N . 30481 1
135 . 1 1 13 13 LEU H H 1 8.109 0.02 . 1 . . . . A 13 LEU H . 30481 1
136 . 1 1 13 13 LEU HA H 1 4.098 0.02 . 1 . . . . A 13 LEU HA . 30481 1
137 . 1 1 13 13 LEU HB2 H 1 1.515 0.02 . 1 . . . . A 13 LEU HB2 . 30481 1
138 . 1 1 13 13 LEU HB3 H 1 1.442 0.02 . 1 . . . . A 13 LEU HB3 . 30481 1
139 . 1 1 13 13 LEU HG H 1 1.413 0.02 . 1 . . . . A 13 LEU HG . 30481 1
140 . 1 1 13 13 LEU HD11 H 1 0.675 0.02 . 2 . . . . A 13 LEU HD11 . 30481 1
141 . 1 1 13 13 LEU HD12 H 1 0.675 0.02 . 2 . . . . A 13 LEU HD12 . 30481 1
142 . 1 1 13 13 LEU HD13 H 1 0.675 0.02 . 2 . . . . A 13 LEU HD13 . 30481 1
143 . 1 1 13 13 LEU HD21 H 1 0.621 0.02 . 2 . . . . A 13 LEU HD21 . 30481 1
144 . 1 1 13 13 LEU HD22 H 1 0.621 0.02 . 2 . . . . A 13 LEU HD22 . 30481 1
145 . 1 1 13 13 LEU HD23 H 1 0.621 0.02 . 2 . . . . A 13 LEU HD23 . 30481 1
146 . 1 1 13 13 LEU CA C 13 58.803 0.3 . 1 . . . . A 13 LEU CA . 30481 1
147 . 1 1 13 13 LEU CB C 13 39.611 0.3 . 1 . . . . A 13 LEU CB . 30481 1
148 . 1 1 13 13 LEU CG C 13 26.845 0.3 . 1 . . . . A 13 LEU CG . 30481 1
149 . 1 1 13 13 LEU CD1 C 13 23.793 0.3 . 1 . . . . A 13 LEU CD1 . 30481 1
150 . 1 1 13 13 LEU CD2 C 13 23.735 0.3 . 1 . . . . A 13 LEU CD2 . 30481 1
151 . 1 1 13 13 LEU N N 15 121.397 0.3 . 1 . . . . A 13 LEU N . 30481 1
152 . 1 1 14 14 PRO HA H 1 3.902 0.02 . 1 . . . . A 14 PRO HA . 30481 1
153 . 1 1 14 14 PRO HB2 H 1 1.529 0.02 . 1 . . . . A 14 PRO HB2 . 30481 1
154 . 1 1 14 14 PRO HB3 H 1 2.025 0.02 . 1 . . . . A 14 PRO HB3 . 30481 1
155 . 1 1 14 14 PRO HG2 H 1 1.605 0.02 . 1 . . . . A 14 PRO HG2 . 30481 1
156 . 1 1 14 14 PRO HG3 H 1 1.874 0.02 . 1 . . . . A 14 PRO HG3 . 30481 1
157 . 1 1 14 14 PRO HD2 H 1 3.449 0.02 . 1 . . . . A 14 PRO HD2 . 30481 1
158 . 1 1 14 14 PRO HD3 H 1 3.301 0.02 . 1 . . . . A 14 PRO HD3 . 30481 1
159 . 1 1 14 14 PRO CA C 13 66.485 0.3 . 1 . . . . A 14 PRO CA . 30481 1
160 . 1 1 14 14 PRO CB C 13 30.788 0.3 . 1 . . . . A 14 PRO CB . 30481 1
161 . 1 1 14 14 PRO CG C 13 28.192 0.3 . 1 . . . . A 14 PRO CG . 30481 1
162 . 1 1 14 14 PRO CD C 13 49.822 0.3 . 1 . . . . A 14 PRO CD . 30481 1
163 . 1 1 15 15 ALA H H 1 7.131 0.02 . 1 . . . . A 15 ALA H . 30481 1
164 . 1 1 15 15 ALA HA H 1 3.871 0.02 . 1 . . . . A 15 ALA HA . 30481 1
165 . 1 1 15 15 ALA HB1 H 1 1.21 0.02 . 1 . . . . A 15 ALA HB1 . 30481 1
166 . 1 1 15 15 ALA HB2 H 1 1.21 0.02 . 1 . . . . A 15 ALA HB2 . 30481 1
167 . 1 1 15 15 ALA HB3 H 1 1.21 0.02 . 1 . . . . A 15 ALA HB3 . 30481 1
168 . 1 1 15 15 ALA CA C 13 54.572 0.3 . 1 . . . . A 15 ALA CA . 30481 1
169 . 1 1 15 15 ALA CB C 13 17.737 0.3 . 1 . . . . A 15 ALA CB . 30481 1
170 . 1 1 15 15 ALA N N 15 118.587 0.3 . 1 . . . . A 15 ALA N . 30481 1
171 . 1 1 16 16 LEU H H 1 7.654 0.02 . 1 . . . . A 16 LEU H . 30481 1
172 . 1 1 16 16 LEU HA H 1 3.959 0.02 . 1 . . . . A 16 LEU HA . 30481 1
173 . 1 1 16 16 LEU HB2 H 1 1.758 0.02 . 1 . . . . A 16 LEU HB2 . 30481 1
174 . 1 1 16 16 LEU HB3 H 1 1.311 0.02 . 1 . . . . A 16 LEU HB3 . 30481 1
175 . 1 1 16 16 LEU HG H 1 1.401 0.02 . 1 . . . . A 16 LEU HG . 30481 1
176 . 1 1 16 16 LEU HD11 H 1 0.657 0.02 . 2 . . . . A 16 LEU HD11 . 30481 1
177 . 1 1 16 16 LEU HD12 H 1 0.657 0.02 . 2 . . . . A 16 LEU HD12 . 30481 1
178 . 1 1 16 16 LEU HD13 H 1 0.657 0.02 . 2 . . . . A 16 LEU HD13 . 30481 1
179 . 1 1 16 16 LEU HD21 H 1 0.649 0.02 . 2 . . . . A 16 LEU HD21 . 30481 1
180 . 1 1 16 16 LEU HD22 H 1 0.649 0.02 . 2 . . . . A 16 LEU HD22 . 30481 1
181 . 1 1 16 16 LEU HD23 H 1 0.649 0.02 . 2 . . . . A 16 LEU HD23 . 30481 1
182 . 1 1 16 16 LEU CA C 13 58.213 0.3 . 1 . . . . A 16 LEU CA . 30481 1
183 . 1 1 16 16 LEU CB C 13 41.798 0.3 . 1 . . . . A 16 LEU CB . 30481 1
184 . 1 1 16 16 LEU CG C 13 26.94 0.3 . 1 . . . . A 16 LEU CG . 30481 1
185 . 1 1 16 16 LEU CD1 C 13 23.019 0.3 . 1 . . . . A 16 LEU CD1 . 30481 1
186 . 1 1 16 16 LEU CD2 C 13 22.84 0.3 . 1 . . . . A 16 LEU CD2 . 30481 1
187 . 1 1 16 16 LEU N N 15 120.972 0.3 . 1 . . . . A 16 LEU N . 30481 1
188 . 1 1 17 17 ILE H H 1 8.353 0.02 . 1 . . . . A 17 ILE H . 30481 1
189 . 1 1 17 17 ILE HA H 1 3.385 0.02 . 1 . . . . A 17 ILE HA . 30481 1
190 . 1 1 17 17 ILE HB H 1 1.598 0.02 . 1 . . . . A 17 ILE HB . 30481 1
191 . 1 1 17 17 ILE HG12 H 1 0.912 0.02 . 2 . . . . A 17 ILE HG12 . 30481 1
192 . 1 1 17 17 ILE HG13 H 1 0.912 0.02 . 2 . . . . A 17 ILE HG13 . 30481 1
193 . 1 1 17 17 ILE HG21 H 1 0.6 0.02 . 1 . . . . A 17 ILE HG21 . 30481 1
194 . 1 1 17 17 ILE HG22 H 1 0.6 0.02 . 1 . . . . A 17 ILE HG22 . 30481 1
195 . 1 1 17 17 ILE HG23 H 1 0.6 0.02 . 1 . . . . A 17 ILE HG23 . 30481 1
196 . 1 1 17 17 ILE HD11 H 1 0.513 0.02 . 1 . . . . A 17 ILE HD11 . 30481 1
197 . 1 1 17 17 ILE HD12 H 1 0.513 0.02 . 1 . . . . A 17 ILE HD12 . 30481 1
198 . 1 1 17 17 ILE HD13 H 1 0.513 0.02 . 1 . . . . A 17 ILE HD13 . 30481 1
199 . 1 1 17 17 ILE CA C 13 65.162 0.3 . 1 . . . . A 17 ILE CA . 30481 1
200 . 1 1 17 17 ILE CB C 13 37.254 0.3 . 1 . . . . A 17 ILE CB . 30481 1
201 . 1 1 17 17 ILE CG1 C 13 28.823 0.3 . 1 . . . . A 17 ILE CG1 . 30481 1
202 . 1 1 17 17 ILE CG2 C 13 16.379 0.3 . 1 . . . . A 17 ILE CG2 . 30481 1
203 . 1 1 17 17 ILE CD1 C 13 11.572 0.3 . 1 . . . . A 17 ILE CD1 . 30481 1
204 . 1 1 17 17 ILE N N 15 117.822 0.3 . 1 . . . . A 17 ILE N . 30481 1
205 . 1 1 18 18 SER H H 1 7.709 0.02 . 1 . . . . A 18 SER H . 30481 1
206 . 1 1 18 18 SER HA H 1 3.833 0.02 . 1 . . . . A 18 SER HA . 30481 1
207 . 1 1 18 18 SER HB2 H 1 3.789 0.02 . 2 . . . . A 18 SER HB2 . 30481 1
208 . 1 1 18 18 SER HB3 H 1 3.789 0.02 . 2 . . . . A 18 SER HB3 . 30481 1
209 . 1 1 18 18 SER CA C 13 62.177 0.3 . 1 . . . . A 18 SER CA . 30481 1
210 . 1 1 18 18 SER CB C 13 62.669 0.3 . 1 . . . . A 18 SER CB . 30481 1
211 . 1 1 18 18 SER N N 15 112.919 0.3 . 1 . . . . A 18 SER N . 30481 1
212 . 1 1 19 19 TRP H H 1 7.791 0.02 . 1 . . . . A 19 TRP H . 30481 1
213 . 1 1 19 19 TRP HA H 1 4.014 0.02 . 1 . . . . A 19 TRP HA . 30481 1
214 . 1 1 19 19 TRP HB2 H 1 3.402 0.02 . 2 . . . . A 19 TRP HB2 . 30481 1
215 . 1 1 19 19 TRP HB3 H 1 3.098 0.02 . 2 . . . . A 19 TRP HB3 . 30481 1
216 . 1 1 19 19 TRP HE1 H 1 9.741 0.02 . 1 . . . . A 19 TRP HE1 . 30481 1
217 . 1 1 19 19 TRP CA C 13 61.425 0.3 . 1 . . . . A 19 TRP CA . 30481 1
218 . 1 1 19 19 TRP CB C 13 28.935 0.3 . 1 . . . . A 19 TRP CB . 30481 1
219 . 1 1 19 19 TRP N N 15 122.831 0.3 . 1 . . . . A 19 TRP N . 30481 1
220 . 1 1 19 19 TRP NE1 N 15 127.346 0.3 . 1 . . . . A 19 TRP NE1 . 30481 1
221 . 1 1 20 20 ILE H H 1 8.512 0.02 . 1 . . . . A 20 ILE H . 30481 1
222 . 1 1 20 20 ILE HA H 1 3.112 0.02 . 1 . . . . A 20 ILE HA . 30481 1
223 . 1 1 20 20 ILE HB H 1 1.734 0.02 . 1 . . . . A 20 ILE HB . 30481 1
224 . 1 1 20 20 ILE HG12 H 1 1.084 0.02 . 2 . . . . A 20 ILE HG12 . 30481 1
225 . 1 1 20 20 ILE HG13 H 1 0.995 0.02 . 2 . . . . A 20 ILE HG13 . 30481 1
226 . 1 1 20 20 ILE HG21 H 1 0.604 0.02 . 1 . . . . A 20 ILE HG21 . 30481 1
227 . 1 1 20 20 ILE HG22 H 1 0.604 0.02 . 1 . . . . A 20 ILE HG22 . 30481 1
228 . 1 1 20 20 ILE HG23 H 1 0.604 0.02 . 1 . . . . A 20 ILE HG23 . 30481 1
229 . 1 1 20 20 ILE HD11 H 1 0.602 0.02 . 1 . . . . A 20 ILE HD11 . 30481 1
230 . 1 1 20 20 ILE HD12 H 1 0.602 0.02 . 1 . . . . A 20 ILE HD12 . 30481 1
231 . 1 1 20 20 ILE HD13 H 1 0.602 0.02 . 1 . . . . A 20 ILE HD13 . 30481 1
232 . 1 1 20 20 ILE CA C 13 65.658 0.3 . 1 . . . . A 20 ILE CA . 30481 1
233 . 1 1 20 20 ILE CB C 13 38.061 0.3 . 1 . . . . A 20 ILE CB . 30481 1
234 . 1 1 20 20 ILE CG1 C 13 28.225 0.3 . 1 . . . . A 20 ILE CG1 . 30481 1
235 . 1 1 20 20 ILE CG2 C 13 16.312 0.3 . 1 . . . . A 20 ILE CG2 . 30481 1
236 . 1 1 20 20 ILE CD1 C 13 12.466 0.3 . 1 . . . . A 20 ILE CD1 . 30481 1
237 . 1 1 20 20 ILE N N 15 119.903 0.3 . 1 . . . . A 20 ILE N . 30481 1
238 . 1 1 21 21 LYS H H 1 8.129 0.02 . 1 . . . . A 21 LYS H . 30481 1
239 . 1 1 21 21 LYS HA H 1 3.642 0.02 . 1 . . . . A 21 LYS HA . 30481 1
240 . 1 1 21 21 LYS HB2 H 1 1.594 0.02 . 2 . . . . A 21 LYS HB2 . 30481 1
241 . 1 1 21 21 LYS HB3 H 1 1.594 0.02 . 2 . . . . A 21 LYS HB3 . 30481 1
242 . 1 1 21 21 LYS HG2 H 1 1.374 0.02 . 1 . . . . A 21 LYS HG2 . 30481 1
243 . 1 1 21 21 LYS HG3 H 1 1.374 0.02 . 1 . . . . A 21 LYS HG3 . 30481 1
244 . 1 1 21 21 LYS HD2 H 1 1.361 0.02 . 2 . . . . A 21 LYS HD2 . 30481 1
245 . 1 1 21 21 LYS HD3 H 1 1.361 0.02 . 2 . . . . A 21 LYS HD3 . 30481 1
246 . 1 1 21 21 LYS HE2 H 1 2.612 0.02 . 2 . . . . A 21 LYS HE2 . 30481 1
247 . 1 1 21 21 LYS HE3 H 1 2.612 0.02 . 2 . . . . A 21 LYS HE3 . 30481 1
248 . 1 1 21 21 LYS CA C 13 59.049 0.3 . 1 . . . . A 21 LYS CA . 30481 1
249 . 1 1 21 21 LYS CB C 13 32.322 0.3 . 1 . . . . A 21 LYS CB . 30481 1
250 . 1 1 21 21 LYS CG C 13 25.686 0.3 . 1 . . . . A 21 LYS CG . 30481 1
251 . 1 1 21 21 LYS CD C 13 29.102 0.3 . 1 . . . . A 21 LYS CD . 30481 1
252 . 1 1 21 21 LYS CE C 13 41.536 0.3 . 1 . . . . A 21 LYS CE . 30481 1
253 . 1 1 21 21 LYS N N 15 117.253 0.3 . 1 . . . . A 21 LYS N . 30481 1
254 . 1 1 22 22 ARG H H 1 7.387 0.02 . 1 . . . . A 22 ARG H . 30481 1
255 . 1 1 22 22 ARG HA H 1 3.829 0.02 . 1 . . . . A 22 ARG HA . 30481 1
256 . 1 1 22 22 ARG HB2 H 1 1.583 0.02 . 2 . . . . A 22 ARG HB2 . 30481 1
257 . 1 1 22 22 ARG HB3 H 1 1.583 0.02 . 2 . . . . A 22 ARG HB3 . 30481 1
258 . 1 1 22 22 ARG HG2 H 1 1.294 0.02 . 2 . . . . A 22 ARG HG2 . 30481 1
259 . 1 1 22 22 ARG HG3 H 1 1.4 0.02 . 2 . . . . A 22 ARG HG3 . 30481 1
260 . 1 1 22 22 ARG HD2 H 1 2.795 0.02 . 2 . . . . A 22 ARG HD2 . 30481 1
261 . 1 1 22 22 ARG HD3 H 1 2.795 0.02 . 2 . . . . A 22 ARG HD3 . 30481 1
262 . 1 1 22 22 ARG CA C 13 57.861 0.3 . 1 . . . . A 22 ARG CA . 30481 1
263 . 1 1 22 22 ARG CB C 13 29.999 0.3 . 1 . . . . A 22 ARG CB . 30481 1
264 . 1 1 22 22 ARG CG C 13 27.15 0.3 . 1 . . . . A 22 ARG CG . 30481 1
265 . 1 1 22 22 ARG CD C 13 43.008 0.3 . 1 . . . . A 22 ARG CD . 30481 1
266 . 1 1 22 22 ARG N N 15 117.539 0.3 . 1 . . . . A 22 ARG N . 30481 1
267 . 1 1 23 23 LYS H H 1 7.802 0.02 . 1 . . . . A 23 LYS H . 30481 1
268 . 1 1 23 23 LYS HA H 1 3.707 0.02 . 1 . . . . A 23 LYS HA . 30481 1
269 . 1 1 23 23 LYS HB2 H 1 1.223 0.02 . 1 . . . . A 23 LYS HB2 . 30481 1
270 . 1 1 23 23 LYS HB3 H 1 1.318 0.02 . 1 . . . . A 23 LYS HB3 . 30481 1
271 . 1 1 23 23 LYS HG2 H 1 1.221 0.02 . 1 . . . . A 23 LYS HG2 . 30481 1
272 . 1 1 23 23 LYS HG3 H 1 1.111 0.02 . 1 . . . . A 23 LYS HG3 . 30481 1
273 . 1 1 23 23 LYS HD2 H 1 1.088 0.02 . 2 . . . . A 23 LYS HD2 . 30481 1
274 . 1 1 23 23 LYS HD3 H 1 1.088 0.02 . 2 . . . . A 23 LYS HD3 . 30481 1
275 . 1 1 23 23 LYS HE2 H 1 2.501 0.02 . 2 . . . . A 23 LYS HE2 . 30481 1
276 . 1 1 23 23 LYS HE3 H 1 2.406 0.02 . 2 . . . . A 23 LYS HE3 . 30481 1
277 . 1 1 23 23 LYS CA C 13 56.978 0.3 . 1 . . . . A 23 LYS CA . 30481 1
278 . 1 1 23 23 LYS CB C 13 31.461 0.3 . 1 . . . . A 23 LYS CB . 30481 1
279 . 1 1 23 23 LYS CG C 13 24.798 0.3 . 1 . . . . A 23 LYS CG . 30481 1
280 . 1 1 23 23 LYS CD C 13 29.11 0.3 . 1 . . . . A 23 LYS CD . 30481 1
281 . 1 1 23 23 LYS CE C 13 41.658 0.3 . 1 . . . . A 23 LYS CE . 30481 1
282 . 1 1 23 23 LYS N N 15 119.511 0.3 . 1 . . . . A 23 LYS N . 30481 1
283 . 1 1 24 24 ARG H H 1 7.778 0.02 . 1 . . . . A 24 ARG H . 30481 1
284 . 1 1 24 24 ARG HA H 1 3.922 0.02 . 1 . . . . A 24 ARG HA . 30481 1
285 . 1 1 24 24 ARG HB2 H 1 1.63 0.02 . 2 . . . . A 24 ARG HB2 . 30481 1
286 . 1 1 24 24 ARG HB3 H 1 1.494 0.02 . 2 . . . . A 24 ARG HB3 . 30481 1
287 . 1 1 24 24 ARG HG2 H 1 1.292 0.02 . 2 . . . . A 24 ARG HG2 . 30481 1
288 . 1 1 24 24 ARG HG3 H 1 1.39 0.02 . 2 . . . . A 24 ARG HG3 . 30481 1
289 . 1 1 24 24 ARG HD2 H 1 2.812 0.02 . 2 . . . . A 24 ARG HD2 . 30481 1
290 . 1 1 24 24 ARG HD3 H 1 2.812 0.02 . 2 . . . . A 24 ARG HD3 . 30481 1
291 . 1 1 24 24 ARG CA C 13 56.423 0.3 . 1 . . . . A 24 ARG CA . 30481 1
292 . 1 1 24 24 ARG CB C 13 30.135 0.3 . 1 . . . . A 24 ARG CB . 30481 1
293 . 1 1 24 24 ARG CG C 13 26.76 0.3 . 1 . . . . A 24 ARG CG . 30481 1
294 . 1 1 24 24 ARG CD C 13 42.906 0.3 . 1 . . . . A 24 ARG CD . 30481 1
295 . 1 1 24 24 ARG N N 15 118.211 0.3 . 1 . . . . A 24 ARG N . 30481 1
296 . 1 1 25 25 GLN H H 1 7.607 0.02 . 1 . . . . A 25 GLN H . 30481 1
297 . 1 1 25 25 GLN HA H 1 3.865 0.02 . 1 . . . . A 25 GLN HA . 30481 1
298 . 1 1 25 25 GLN HB2 H 1 1.833 0.02 . 2 . . . . A 25 GLN HB2 . 30481 1
299 . 1 1 25 25 GLN HB3 H 1 1.639 0.02 . 2 . . . . A 25 GLN HB3 . 30481 1
300 . 1 1 25 25 GLN HG2 H 1 2.019 0.02 . 2 . . . . A 25 GLN HG2 . 30481 1
301 . 1 1 25 25 GLN HG3 H 1 2.019 0.02 . 2 . . . . A 25 GLN HG3 . 30481 1
302 . 1 1 25 25 GLN HE21 H 1 7.307 0.02 . 5 . . . . A 25 GLN HE21 . 30481 1
303 . 1 1 25 25 GLN HE22 H 1 6.547 0.02 . 5 . . . . A 25 GLN HE22 . 30481 1
304 . 1 1 25 25 GLN CA C 13 57.345 0.3 . 1 . . . . A 25 GLN CA . 30481 1
305 . 1 1 25 25 GLN CB C 13 30.607 0.3 . 1 . . . . A 25 GLN CB . 30481 1
306 . 1 1 25 25 GLN CG C 13 34.162 0.3 . 1 . . . . A 25 GLN CG . 30481 1
307 . 1 1 25 25 GLN N N 15 124.767 0.3 . 1 . . . . A 25 GLN N . 30481 1
308 . 1 1 25 25 GLN NE2 N 15 111.268 0.3 . 5 . . . . A 25 GLN NE2 . 30481 1
309 . 1 1 26 26 GLN H H 1 7.613 0.02 . 1 . . . . A 26 GLN H . 30481 1
310 . 1 1 26 26 GLN HA H 1 3.983 0.02 . 1 . . . . A 26 GLN HA . 30481 1
311 . 1 1 26 26 GLN HB2 H 1 1.873 0.02 . 2 . . . . A 26 GLN HB2 . 30481 1
312 . 1 1 26 26 GLN HB3 H 1 1.778 0.02 . 2 . . . . A 26 GLN HB3 . 30481 1
313 . 1 1 26 26 GLN HG2 H 1 2.091 0.02 . 2 . . . . A 26 GLN HG2 . 30481 1
314 . 1 1 26 26 GLN HG3 H 1 2.091 0.02 . 2 . . . . A 26 GLN HG3 . 30481 1
315 . 1 1 26 26 GLN HE21 H 1 7.356 0.02 . 5 . . . . A 26 GLN HE21 . 30481 1
316 . 1 1 26 26 GLN HE22 H 1 6.544 0.02 . 5 . . . . A 26 GLN HE22 . 30481 1
317 . 1 1 26 26 GLN CA C 13 55.98 0.3 . 1 . . . . A 26 GLN CA . 30481 1
318 . 1 1 26 26 GLN CB C 13 28.99 0.3 . 1 . . . . A 26 GLN CB . 30481 1
319 . 1 1 26 26 GLN CG C 13 33.764 0.3 . 1 . . . . A 26 GLN CG . 30481 1
320 . 1 1 26 26 GLN N N 15 125.125 0.3 . 1 . . . . A 26 GLN N . 30481 1
321 . 1 1 26 26 GLN NE2 N 15 111.402 0.3 . 5 . . . . A 26 GLN NE2 . 30481 1
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