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 36513
_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 $chemical_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-15N HSQC' 1 $sample_1 isotropic 36513 1
2 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36513 1
3 '3D HNCACB' 1 $sample_1 isotropic 36513 1
4 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36513 1
5 '3D C(CO)NH' 1 $sample_1 isotropic 36513 1
6 '3D HNHA' 1 $sample_1 isotropic 36513 1
7 '3D HCCH-TOCSY' 1 $sample_1 isotropic 36513 1
8 '3D HBHANH' 1 $sample_1 isotropic 36513 1
9 '3D H(CCO)NH' 1 $sample_1 isotropic 36513 1
10 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36513 1
11 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36513 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 2 2 ALA HA H 1 4.206 0.000 . 1 . . . . A 586 ALA HA . 36513 1
2 . 1 . 1 2 2 ALA HB1 H 1 1.419 0.000 . 1 . . . . A 586 ALA HB1 . 36513 1
3 . 1 . 1 2 2 ALA HB2 H 1 1.419 0.000 . 1 . . . . A 586 ALA HB2 . 36513 1
4 . 1 . 1 2 2 ALA HB3 H 1 1.419 0.000 . 1 . . . . A 586 ALA HB3 . 36513 1
5 . 1 . 1 2 2 ALA CA C 13 53.753 0.044 . 1 . . . . A 586 ALA CA . 36513 1
6 . 1 . 1 2 2 ALA CB C 13 17.664 0.043 . 1 . . . . A 586 ALA CB . 36513 1
7 . 1 . 1 3 3 GLN H H 1 8.639 0.003 . 1 . . . . A 587 GLN H . 36513 1
8 . 1 . 1 3 3 GLN HA H 1 4.130 0.005 . 1 . . . . A 587 GLN HA . 36513 1
9 . 1 . 1 3 3 GLN HB2 H 1 2.075 0.009 . 2 . . . . A 587 GLN HB2 . 36513 1
10 . 1 . 1 3 3 GLN HB3 H 1 1.941 0.007 . 2 . . . . A 587 GLN HB3 . 36513 1
11 . 1 . 1 3 3 GLN HG2 H 1 2.352 0.007 . 1 . . . . A 587 GLN HG2 . 36513 1
12 . 1 . 1 3 3 GLN HE21 H 1 6.868 0.002 . 1 . . . . A 587 GLN HE21 . 36513 1
13 . 1 . 1 3 3 GLN HE22 H 1 7.764 0.001 . 1 . . . . A 587 GLN HE22 . 36513 1
14 . 1 . 1 3 3 GLN CA C 13 57.655 0.030 . 1 . . . . A 587 GLN CA . 36513 1
15 . 1 . 1 3 3 GLN CB C 13 27.667 0.040 . 1 . . . . A 587 GLN CB . 36513 1
16 . 1 . 1 3 3 GLN CG C 13 32.824 0.042 . 1 . . . . A 587 GLN CG . 36513 1
17 . 1 . 1 3 3 GLN N N 15 119.397 0.018 . 1 . . . . A 587 GLN N . 36513 1
18 . 1 . 1 3 3 GLN NE2 N 15 112.513 0.205 . 1 . . . . A 587 GLN NE2 . 36513 1
19 . 1 . 1 4 4 GLU H H 1 7.993 0.002 . 1 . . . . A 588 GLU H . 36513 1
20 . 1 . 1 4 4 GLU HA H 1 4.088 0.001 . 1 . . . . A 588 GLU HA . 36513 1
21 . 1 . 1 4 4 GLU HB2 H 1 2.050 0.000 . 1 . . . . A 588 GLU HB2 . 36513 1
22 . 1 . 1 4 4 GLU HG2 H 1 2.269 0.000 . 1 . . . . A 588 GLU HG2 . 36513 1
23 . 1 . 1 4 4 GLU CA C 13 57.959 0.005 . 1 . . . . A 588 GLU CA . 36513 1
24 . 1 . 1 4 4 GLU CB C 13 29.005 0.002 . 1 . . . . A 588 GLU CB . 36513 1
25 . 1 . 1 4 4 GLU CG C 13 36.196 0.000 . 1 . . . . A 588 GLU CG . 36513 1
26 . 1 . 1 4 4 GLU N N 15 119.947 0.019 . 1 . . . . A 588 GLU N . 36513 1
27 . 1 . 1 5 5 GLU H H 1 8.125 0.003 . 1 . . . . A 589 GLU H . 36513 1
28 . 1 . 1 5 5 GLU HA H 1 4.095 0.005 . 1 . . . . A 589 GLU HA . 36513 1
29 . 1 . 1 5 5 GLU HB2 H 1 2.048 0.003 . 1 . . . . A 589 GLU HB2 . 36513 1
30 . 1 . 1 5 5 GLU HG2 H 1 2.278 0.003 . 2 . . . . A 589 GLU HG2 . 36513 1
31 . 1 . 1 5 5 GLU HG3 H 1 2.374 0.000 . 2 . . . . A 589 GLU HG3 . 36513 1
32 . 1 . 1 5 5 GLU CA C 13 58.025 0.053 . 1 . . . . A 589 GLU CA . 36513 1
33 . 1 . 1 5 5 GLU CB C 13 28.803 0.025 . 1 . . . . A 589 GLU CB . 36513 1
34 . 1 . 1 5 5 GLU CG C 13 35.868 0.051 . 1 . . . . A 589 GLU CG . 36513 1
35 . 1 . 1 5 5 GLU N N 15 120.388 0.026 . 1 . . . . A 589 GLU N . 36513 1
36 . 1 . 1 6 6 ALA H H 1 8.185 0.002 . 1 . . . . A 590 ALA H . 36513 1
37 . 1 . 1 6 6 ALA HA H 1 4.208 0.014 . 1 . . . . A 590 ALA HA . 36513 1
38 . 1 . 1 6 6 ALA HB1 H 1 1.438 0.001 . 1 . . . . A 590 ALA HB1 . 36513 1
39 . 1 . 1 6 6 ALA HB2 H 1 1.438 0.001 . 1 . . . . A 590 ALA HB2 . 36513 1
40 . 1 . 1 6 6 ALA HB3 H 1 1.438 0.001 . 1 . . . . A 590 ALA HB3 . 36513 1
41 . 1 . 1 6 6 ALA CA C 13 53.848 0.101 . 1 . . . . A 590 ALA CA . 36513 1
42 . 1 . 1 6 6 ALA CB C 13 17.568 0.061 . 1 . . . . A 590 ALA CB . 36513 1
43 . 1 . 1 6 6 ALA N N 15 123.663 0.028 . 1 . . . . A 590 ALA N . 36513 1
44 . 1 . 1 7 7 GLU H H 1 8.240 0.003 . 1 . . . . A 591 GLU H . 36513 1
45 . 1 . 1 7 7 GLU HA H 1 4.061 0.002 . 1 . . . . A 591 GLU HA . 36513 1
46 . 1 . 1 7 7 GLU HB2 H 1 2.036 0.000 . 1 . . . . A 591 GLU HB2 . 36513 1
47 . 1 . 1 7 7 GLU HG2 H 1 2.240 0.001 . 2 . . . . A 591 GLU HG2 . 36513 1
48 . 1 . 1 7 7 GLU HG3 H 1 2.443 0.002 . 2 . . . . A 591 GLU HG3 . 36513 1
49 . 1 . 1 7 7 GLU CA C 13 58.089 0.001 . 1 . . . . A 591 GLU CA . 36513 1
50 . 1 . 1 7 7 GLU CB C 13 28.787 0.001 . 1 . . . . A 591 GLU CB . 36513 1
51 . 1 . 1 7 7 GLU CG C 13 35.964 0.005 . 1 . . . . A 591 GLU CG . 36513 1
52 . 1 . 1 7 7 GLU N N 15 119.402 0.015 . 1 . . . . A 591 GLU N . 36513 1
53 . 1 . 1 8 8 ALA H H 1 8.077 0.002 . 1 . . . . A 592 ALA H . 36513 1
54 . 1 . 1 8 8 ALA HA H 1 4.108 0.012 . 1 . . . . A 592 ALA HA . 36513 1
55 . 1 . 1 8 8 ALA HB1 H 1 1.477 0.000 . 1 . . . . A 592 ALA HB1 . 36513 1
56 . 1 . 1 8 8 ALA HB2 H 1 1.477 0.000 . 1 . . . . A 592 ALA HB2 . 36513 1
57 . 1 . 1 8 8 ALA HB3 H 1 1.477 0.000 . 1 . . . . A 592 ALA HB3 . 36513 1
58 . 1 . 1 8 8 ALA CA C 13 53.999 0.064 . 1 . . . . A 592 ALA CA . 36513 1
59 . 1 . 1 8 8 ALA CB C 13 17.454 0.032 . 1 . . . . A 592 ALA CB . 36513 1
60 . 1 . 1 8 8 ALA N N 15 122.559 0.027 . 1 . . . . A 592 ALA N . 36513 1
61 . 1 . 1 9 9 GLU H H 1 8.052 0.002 . 1 . . . . A 593 GLU H . 36513 1
62 . 1 . 1 9 9 GLU HA H 1 4.250 0.008 . 1 . . . . A 593 GLU HA . 36513 1
63 . 1 . 1 9 9 GLU HB2 H 1 2.058 0.000 . 1 . . . . A 593 GLU HB2 . 36513 1
64 . 1 . 1 9 9 GLU HG2 H 1 2.304 0.000 . 1 . . . . A 593 GLU HG2 . 36513 1
65 . 1 . 1 9 9 GLU CA C 13 57.749 0.029 . 1 . . . . A 593 GLU CA . 36513 1
66 . 1 . 1 9 9 GLU CB C 13 28.549 0.011 . 1 . . . . A 593 GLU CB . 36513 1
67 . 1 . 1 9 9 GLU CG C 13 34.733 0.052 . 1 . . . . A 593 GLU CG . 36513 1
68 . 1 . 1 9 9 GLU N N 15 120.228 0.018 . 1 . . . . A 593 GLU N . 36513 1
69 . 1 . 1 10 10 GLU H H 1 8.093 0.003 . 1 . . . . A 594 GLU H . 36513 1
70 . 1 . 1 10 10 GLU HA H 1 4.061 0.006 . 1 . . . . A 594 GLU HA . 36513 1
71 . 1 . 1 10 10 GLU HB2 H 1 2.062 0.005 . 1 . . . . A 594 GLU HB2 . 36513 1
72 . 1 . 1 10 10 GLU HG2 H 1 2.363 0.001 . 1 . . . . A 594 GLU HG2 . 36513 1
73 . 1 . 1 10 10 GLU CA C 13 58.234 0.106 . 1 . . . . A 594 GLU CA . 36513 1
74 . 1 . 1 10 10 GLU CB C 13 28.763 0.033 . 1 . . . . A 594 GLU CB . 36513 1
75 . 1 . 1 10 10 GLU CG C 13 35.507 0.083 . 1 . . . . A 594 GLU CG . 36513 1
76 . 1 . 1 10 10 GLU N N 15 120.071 0.046 . 1 . . . . A 594 GLU N . 36513 1
77 . 1 . 1 11 11 ARG H H 1 8.044 0.001 . 1 . . . . A 595 ARG H . 36513 1
78 . 1 . 1 11 11 ARG HA H 1 4.098 0.000 . 1 . . . . A 595 ARG HA . 36513 1
79 . 1 . 1 11 11 ARG HB2 H 1 1.890 0.007 . 1 . . . . A 595 ARG HB2 . 36513 1
80 . 1 . 1 11 11 ARG HG2 H 1 1.546 0.001 . 1 . . . . A 595 ARG HG2 . 36513 1
81 . 1 . 1 11 11 ARG HD2 H 1 3.207 0.001 . 1 . . . . A 595 ARG HD2 . 36513 1
82 . 1 . 1 11 11 ARG HE H 1 7.411 0.001 . 1 . . . . A 595 ARG HE . 36513 1
83 . 1 . 1 11 11 ARG CA C 13 58.027 0.055 . 1 . . . . A 595 ARG CA . 36513 1
84 . 1 . 1 11 11 ARG CB C 13 29.299 0.055 . 1 . . . . A 595 ARG CB . 36513 1
85 . 1 . 1 11 11 ARG CG C 13 26.624 0.073 . 1 . . . . A 595 ARG CG . 36513 1
86 . 1 . 1 11 11 ARG CD C 13 42.635 0.021 . 1 . . . . A 595 ARG CD . 36513 1
87 . 1 . 1 11 11 ARG N N 15 119.635 0.060 . 1 . . . . A 595 ARG N . 36513 1
88 . 1 . 1 11 11 ARG NE N 15 84.182 0.006 . 1 . . . . A 595 ARG NE . 36513 1
89 . 1 . 1 12 12 ARG H H 1 8.086 0.001 . 1 . . . . A 596 ARG H . 36513 1
90 . 1 . 1 12 12 ARG HA H 1 4.102 0.015 . 1 . . . . A 596 ARG HA . 36513 1
91 . 1 . 1 12 12 ARG HB2 H 1 1.896 0.000 . 1 . . . . A 596 ARG HB2 . 36513 1
92 . 1 . 1 12 12 ARG HG2 H 1 1.717 0.001 . 1 . . . . A 596 ARG HG2 . 36513 1
93 . 1 . 1 12 12 ARG HD2 H 1 3.131 0.001 . 1 . . . . A 596 ARG HD2 . 36513 1
94 . 1 . 1 12 12 ARG HE H 1 7.538 0.001 . 1 . . . . A 596 ARG HE . 36513 1
95 . 1 . 1 12 12 ARG CA C 13 58.175 0.059 . 1 . . . . A 596 ARG CA . 36513 1
96 . 1 . 1 12 12 ARG CB C 13 29.318 0.052 . 1 . . . . A 596 ARG CB . 36513 1
97 . 1 . 1 12 12 ARG CG C 13 26.678 0.122 . 1 . . . . A 596 ARG CG . 36513 1
98 . 1 . 1 12 12 ARG CD C 13 42.643 0.101 . 1 . . . . A 596 ARG CD . 36513 1
99 . 1 . 1 12 12 ARG N N 15 120.634 0.015 . 1 . . . . A 596 ARG N . 36513 1
100 . 1 . 1 12 12 ARG NE N 15 84.222 0.003 . 1 . . . . A 596 ARG NE . 36513 1
101 . 1 . 1 13 13 LEU H H 1 8.198 0.002 . 1 . . . . A 597 LEU H . 36513 1
102 . 1 . 1 13 13 LEU HA H 1 4.081 0.006 . 1 . . . . A 597 LEU HA . 36513 1
103 . 1 . 1 13 13 LEU HB2 H 1 1.825 0.001 . 2 . . . . A 597 LEU HB2 . 36513 1
104 . 1 . 1 13 13 LEU HB3 H 1 1.580 0.002 . 2 . . . . A 597 LEU HB3 . 36513 1
105 . 1 . 1 13 13 LEU HD11 H 1 0.905 0.001 . 2 . . . . A 597 LEU HD11 . 36513 1
106 . 1 . 1 13 13 LEU HD12 H 1 0.905 0.001 . 2 . . . . A 597 LEU HD12 . 36513 1
107 . 1 . 1 13 13 LEU HD13 H 1 0.905 0.001 . 2 . . . . A 597 LEU HD13 . 36513 1
108 . 1 . 1 13 13 LEU HD21 H 1 0.839 0.000 . 2 . . . . A 597 LEU HD21 . 36513 1
109 . 1 . 1 13 13 LEU HD22 H 1 0.839 0.000 . 2 . . . . A 597 LEU HD22 . 36513 1
110 . 1 . 1 13 13 LEU HD23 H 1 0.839 0.000 . 2 . . . . A 597 LEU HD23 . 36513 1
111 . 1 . 1 13 13 LEU CA C 13 56.910 0.156 . 1 . . . . A 597 LEU CA . 36513 1
112 . 1 . 1 13 13 LEU CB C 13 40.916 0.032 . 1 . . . . A 597 LEU CB . 36513 1
113 . 1 . 1 13 13 LEU CG C 13 26.233 0.033 . 1 . . . . A 597 LEU CG . 36513 1
114 . 1 . 1 13 13 LEU CD1 C 13 24.615 0.162 . 2 . . . . A 597 LEU CD1 . 36513 1
115 . 1 . 1 13 13 LEU CD2 C 13 22.717 0.042 . 2 . . . . A 597 LEU CD2 . 36513 1
116 . 1 . 1 13 13 LEU N N 15 120.296 0.064 . 1 . . . . A 597 LEU N . 36513 1
117 . 1 . 1 14 14 GLN H H 1 8.107 0.002 . 1 . . . . A 598 GLN H . 36513 1
118 . 1 . 1 14 14 GLN HA H 1 4.089 0.003 . 1 . . . . A 598 GLN HA . 36513 1
119 . 1 . 1 14 14 GLN HB2 H 1 2.162 0.001 . 1 . . . . A 598 GLN HB2 . 36513 1
120 . 1 . 1 14 14 GLN HG2 H 1 2.507 0.001 . 2 . . . . A 598 GLN HG2 . 36513 1
121 . 1 . 1 14 14 GLN HG3 H 1 2.379 0.000 . 2 . . . . A 598 GLN HG3 . 36513 1
122 . 1 . 1 14 14 GLN HE21 H 1 6.801 0.001 . 1 . . . . A 598 GLN HE21 . 36513 1
123 . 1 . 1 14 14 GLN HE22 H 1 7.681 0.001 . 1 . . . . A 598 GLN HE22 . 36513 1
124 . 1 . 1 14 14 GLN CA C 13 57.867 0.002 . 1 . . . . A 598 GLN CA . 36513 1
125 . 1 . 1 14 14 GLN CB C 13 27.659 0.063 . 1 . . . . A 598 GLN CB . 36513 1
126 . 1 . 1 14 14 GLN CG C 13 33.061 0.075 . 1 . . . . A 598 GLN CG . 36513 1
127 . 1 . 1 14 14 GLN N N 15 120.225 0.012 . 1 . . . . A 598 GLN N . 36513 1
128 . 1 . 1 14 14 GLN NE2 N 15 111.724 0.188 . 1 . . . . A 598 GLN NE2 . 36513 1
129 . 1 . 1 15 15 GLU H H 1 8.436 0.004 . 1 . . . . A 599 GLU H . 36513 1
130 . 1 . 1 15 15 GLU HA H 1 4.058 0.003 . 1 . . . . A 599 GLU HA . 36513 1
131 . 1 . 1 15 15 GLU HB2 H 1 1.991 0.000 . 2 . . . . A 599 GLU HB2 . 36513 1
132 . 1 . 1 15 15 GLU HB3 H 1 2.172 0.000 . 2 . . . . A 599 GLU HB3 . 36513 1
133 . 1 . 1 15 15 GLU HG2 H 1 2.481 0.002 . 1 . . . . A 599 GLU HG2 . 36513 1
134 . 1 . 1 15 15 GLU CA C 13 58.303 0.001 . 1 . . . . A 599 GLU CA . 36513 1
135 . 1 . 1 15 15 GLU CB C 13 28.577 0.070 . 1 . . . . A 599 GLU CB . 36513 1
136 . 1 . 1 15 15 GLU CG C 13 35.751 0.000 . 1 . . . . A 599 GLU CG . 36513 1
137 . 1 . 1 15 15 GLU N N 15 119.742 0.026 . 1 . . . . A 599 GLU N . 36513 1
138 . 1 . 1 16 16 GLN H H 1 8.197 0.001 . 1 . . . . A 600 GLN H . 36513 1
139 . 1 . 1 16 16 GLN HA H 1 4.040 0.009 . 1 . . . . A 600 GLN HA . 36513 1
140 . 1 . 1 16 16 GLN HB2 H 1 2.160 0.006 . 1 . . . . A 600 GLN HB2 . 36513 1
141 . 1 . 1 16 16 GLN HG2 H 1 2.321 0.000 . 1 . . . . A 600 GLN HG2 . 36513 1
142 . 1 . 1 16 16 GLN HE21 H 1 6.731 0.001 . 1 . . . . A 600 GLN HE21 . 36513 1
143 . 1 . 1 16 16 GLN HE22 H 1 7.750 0.000 . 1 . . . . A 600 GLN HE22 . 36513 1
144 . 1 . 1 16 16 GLN CA C 13 58.252 0.022 . 1 . . . . A 600 GLN CA . 36513 1
145 . 1 . 1 16 16 GLN CB C 13 27.824 0.033 . 1 . . . . A 600 GLN CB . 36513 1
146 . 1 . 1 16 16 GLN CG C 13 33.233 0.067 . 1 . . . . A 600 GLN CG . 36513 1
147 . 1 . 1 16 16 GLN N N 15 119.664 0.026 . 1 . . . . A 600 GLN N . 36513 1
148 . 1 . 1 16 16 GLN NE2 N 15 110.397 0.220 . 1 . . . . A 600 GLN NE2 . 36513 1
149 . 1 . 1 17 17 GLU H H 1 8.160 0.001 . 1 . . . . A 601 GLU H . 36513 1
150 . 1 . 1 17 17 GLU HA H 1 4.079 0.009 . 1 . . . . A 601 GLU HA . 36513 1
151 . 1 . 1 17 17 GLU HB2 H 1 2.099 0.000 . 1 . . . . A 601 GLU HB2 . 36513 1
152 . 1 . 1 17 17 GLU HG2 H 1 2.381 0.001 . 1 . . . . A 601 GLU HG2 . 36513 1
153 . 1 . 1 17 17 GLU CA C 13 58.416 0.002 . 1 . . . . A 601 GLU CA . 36513 1
154 . 1 . 1 17 17 GLU CB C 13 28.749 0.000 . 1 . . . . A 601 GLU CB . 36513 1
155 . 1 . 1 17 17 GLU CG C 13 35.665 0.009 . 1 . . . . A 601 GLU CG . 36513 1
156 . 1 . 1 17 17 GLU N N 15 120.249 0.007 . 1 . . . . A 601 GLU N . 36513 1
157 . 1 . 1 18 18 GLU H H 1 8.262 0.002 . 1 . . . . A 602 GLU H . 36513 1
158 . 1 . 1 18 18 GLU HA H 1 4.085 0.000 . 1 . . . . A 602 GLU HA . 36513 1
159 . 1 . 1 18 18 GLU HB2 H 1 2.075 0.000 . 1 . . . . A 602 GLU HB2 . 36513 1
160 . 1 . 1 18 18 GLU HG2 H 1 2.279 0.001 . 2 . . . . A 602 GLU HG2 . 36513 1
161 . 1 . 1 18 18 GLU HG3 H 1 2.448 0.000 . 2 . . . . A 602 GLU HG3 . 36513 1
162 . 1 . 1 18 18 GLU CA C 13 58.400 0.000 . 1 . . . . A 602 GLU CA . 36513 1
163 . 1 . 1 18 18 GLU CB C 13 28.795 0.000 . 1 . . . . A 602 GLU CB . 36513 1
164 . 1 . 1 18 18 GLU CG C 13 35.694 0.003 . 1 . . . . A 602 GLU CG . 36513 1
165 . 1 . 1 18 18 GLU N N 15 119.324 0.049 . 1 . . . . A 602 GLU N . 36513 1
166 . 1 . 1 19 19 LEU H H 1 8.178 0.004 . 1 . . . . A 603 LEU H . 36513 1
167 . 1 . 1 19 19 LEU HA H 1 4.187 0.027 . 1 . . . . A 603 LEU HA . 36513 1
168 . 1 . 1 19 19 LEU HB2 H 1 1.771 0.004 . 2 . . . . A 603 LEU HB2 . 36513 1
169 . 1 . 1 19 19 LEU HB3 H 1 1.902 0.003 . 2 . . . . A 603 LEU HB3 . 36513 1
170 . 1 . 1 19 19 LEU HG H 1 1.711 0.002 . 1 . . . . A 603 LEU HG . 36513 1
171 . 1 . 1 19 19 LEU HD11 H 1 0.929 0.003 . 2 . . . . A 603 LEU HD11 . 36513 1
172 . 1 . 1 19 19 LEU HD12 H 1 0.929 0.003 . 2 . . . . A 603 LEU HD12 . 36513 1
173 . 1 . 1 19 19 LEU HD13 H 1 0.929 0.003 . 2 . . . . A 603 LEU HD13 . 36513 1
174 . 1 . 1 19 19 LEU HD21 H 1 0.987 0.000 . 2 . . . . A 603 LEU HD21 . 36513 1
175 . 1 . 1 19 19 LEU HD22 H 1 0.987 0.000 . 2 . . . . A 603 LEU HD22 . 36513 1
176 . 1 . 1 19 19 LEU HD23 H 1 0.987 0.000 . 2 . . . . A 603 LEU HD23 . 36513 1
177 . 1 . 1 19 19 LEU CA C 13 57.612 0.155 . 1 . . . . A 603 LEU CA . 36513 1
178 . 1 . 1 19 19 LEU CB C 13 40.865 0.054 . 1 . . . . A 603 LEU CB . 36513 1
179 . 1 . 1 19 19 LEU CG C 13 26.543 0.116 . 1 . . . . A 603 LEU CG . 36513 1
180 . 1 . 1 19 19 LEU CD1 C 13 24.775 0.071 . 2 . . . . A 603 LEU CD1 . 36513 1
181 . 1 . 1 19 19 LEU CD2 C 13 23.274 0.193 . 2 . . . . A 603 LEU CD2 . 36513 1
182 . 1 . 1 19 19 LEU N N 15 121.877 0.101 . 1 . . . . A 603 LEU N . 36513 1
183 . 1 . 1 20 20 GLU H H 1 8.589 0.002 . 1 . . . . A 604 GLU H . 36513 1
184 . 1 . 1 20 20 GLU HA H 1 3.806 0.004 . 1 . . . . A 604 GLU HA . 36513 1
185 . 1 . 1 20 20 GLU HB2 H 1 2.165 0.000 . 1 . . . . A 604 GLU HB2 . 36513 1
186 . 1 . 1 20 20 GLU HG2 H 1 2.525 0.001 . 1 . . . . A 604 GLU HG2 . 36513 1
187 . 1 . 1 20 20 GLU CA C 13 59.564 0.017 . 1 . . . . A 604 GLU CA . 36513 1
188 . 1 . 1 20 20 GLU CB C 13 27.830 0.040 . 1 . . . . A 604 GLU CB . 36513 1
189 . 1 . 1 20 20 GLU CG C 13 34.758 0.033 . 1 . . . . A 604 GLU CG . 36513 1
190 . 1 . 1 20 20 GLU N N 15 118.818 0.040 . 1 . . . . A 604 GLU N . 36513 1
191 . 1 . 1 21 21 ASN H H 1 8.408 0.006 . 1 . . . . A 605 ASN H . 36513 1
192 . 1 . 1 21 21 ASN HA H 1 4.423 0.009 . 1 . . . . A 605 ASN HA . 36513 1
193 . 1 . 1 21 21 ASN HB2 H 1 2.960 0.000 . 2 . . . . A 605 ASN HB2 . 36513 1
194 . 1 . 1 21 21 ASN HB3 H 1 2.845 0.000 . 2 . . . . A 605 ASN HB3 . 36513 1
195 . 1 . 1 21 21 ASN HD21 H 1 7.101 0.001 . 1 . . . . A 605 ASN HD21 . 36513 1
196 . 1 . 1 21 21 ASN HD22 H 1 7.790 0.002 . 1 . . . . A 605 ASN HD22 . 36513 1
197 . 1 . 1 21 21 ASN CA C 13 55.504 0.062 . 1 . . . . A 605 ASN CA . 36513 1
198 . 1 . 1 21 21 ASN CB C 13 37.999 0.041 . 1 . . . . A 605 ASN CB . 36513 1
199 . 1 . 1 21 21 ASN N N 15 117.072 0.016 . 1 . . . . A 605 ASN N . 36513 1
200 . 1 . 1 21 21 ASN ND2 N 15 112.669 0.217 . 1 . . . . A 605 ASN ND2 . 36513 1
201 . 1 . 1 22 22 TYR H H 1 8.212 0.002 . 1 . . . . A 606 TYR H . 36513 1
202 . 1 . 1 22 22 TYR HA H 1 4.254 0.012 . 1 . . . . A 606 TYR HA . 36513 1
203 . 1 . 1 22 22 TYR HB2 H 1 3.245 0.006 . 1 . . . . A 606 TYR HB2 . 36513 1
204 . 1 . 1 22 22 TYR CA C 13 61.107 0.027 . 1 . . . . A 606 TYR CA . 36513 1
205 . 1 . 1 22 22 TYR CB C 13 38.035 0.023 . 1 . . . . A 606 TYR CB . 36513 1
206 . 1 . 1 22 22 TYR N N 15 121.677 0.014 . 1 . . . . A 606 TYR N . 36513 1
207 . 1 . 1 23 23 ILE H H 1 8.535 0.002 . 1 . . . . A 607 ILE H . 36513 1
208 . 1 . 1 23 23 ILE HA H 1 3.486 0.005 . 1 . . . . A 607 ILE HA . 36513 1
209 . 1 . 1 23 23 ILE HB H 1 2.001 0.000 . 1 . . . . A 607 ILE HB . 36513 1
210 . 1 . 1 23 23 ILE HG12 H 1 1.154 0.002 . 1 . . . . A 607 ILE HG12 . 36513 1
211 . 1 . 1 23 23 ILE HG21 H 1 0.880 0.000 . 1 . . . . A 607 ILE HG21 . 36513 1
212 . 1 . 1 23 23 ILE HG22 H 1 0.880 0.000 . 1 . . . . A 607 ILE HG22 . 36513 1
213 . 1 . 1 23 23 ILE HG23 H 1 0.880 0.000 . 1 . . . . A 607 ILE HG23 . 36513 1
214 . 1 . 1 23 23 ILE HD11 H 1 0.883 0.000 . 1 . . . . A 607 ILE HD11 . 36513 1
215 . 1 . 1 23 23 ILE HD12 H 1 0.883 0.000 . 1 . . . . A 607 ILE HD12 . 36513 1
216 . 1 . 1 23 23 ILE HD13 H 1 0.883 0.000 . 1 . . . . A 607 ILE HD13 . 36513 1
217 . 1 . 1 23 23 ILE CA C 13 64.656 0.018 . 1 . . . . A 607 ILE CA . 36513 1
218 . 1 . 1 23 23 ILE CB C 13 37.178 0.081 . 1 . . . . A 607 ILE CB . 36513 1
219 . 1 . 1 23 23 ILE CG1 C 13 28.715 0.041 . 1 . . . . A 607 ILE CG1 . 36513 1
220 . 1 . 1 23 23 ILE CG2 C 13 16.885 0.063 . 1 . . . . A 607 ILE CG2 . 36513 1
221 . 1 . 1 23 23 ILE CD1 C 13 12.919 0.062 . 1 . . . . A 607 ILE CD1 . 36513 1
222 . 1 . 1 23 23 ILE N N 15 119.027 0.029 . 1 . . . . A 607 ILE N . 36513 1
223 . 1 . 1 24 24 GLU H H 1 8.357 0.003 . 1 . . . . A 608 GLU H . 36513 1
224 . 1 . 1 24 24 GLU HA H 1 3.763 0.006 . 1 . . . . A 608 GLU HA . 36513 1
225 . 1 . 1 24 24 GLU HB2 H 1 1.772 0.002 . 2 . . . . A 608 GLU HB2 . 36513 1
226 . 1 . 1 24 24 GLU HB3 H 1 1.917 0.000 . 2 . . . . A 608 GLU HB3 . 36513 1
227 . 1 . 1 24 24 GLU HG2 H 1 2.221 0.000 . 1 . . . . A 608 GLU HG2 . 36513 1
228 . 1 . 1 24 24 GLU CA C 13 59.463 0.038 . 1 . . . . A 608 GLU CA . 36513 1
229 . 1 . 1 24 24 GLU CB C 13 29.071 0.041 . 1 . . . . A 608 GLU CB . 36513 1
230 . 1 . 1 24 24 GLU CG C 13 35.316 0.046 . 1 . . . . A 608 GLU CG . 36513 1
231 . 1 . 1 24 24 GLU N N 15 116.845 0.041 . 1 . . . . A 608 GLU N . 36513 1
232 . 1 . 1 25 25 HIS H H 1 8.159 0.003 . 1 . . . . A 609 HIS H . 36513 1
233 . 1 . 1 25 25 HIS HA H 1 4.641 0.006 . 1 . . . . A 609 HIS HA . 36513 1
234 . 1 . 1 25 25 HIS HB2 H 1 3.262 0.001 . 1 . . . . A 609 HIS HB2 . 36513 1
235 . 1 . 1 25 25 HIS CA C 13 56.985 0.071 . 1 . . . . A 609 HIS CA . 36513 1
236 . 1 . 1 25 25 HIS CB C 13 28.457 0.055 . 1 . . . . A 609 HIS CB . 36513 1
237 . 1 . 1 25 25 HIS N N 15 112.694 0.038 . 1 . . . . A 609 HIS N . 36513 1
238 . 1 . 1 26 26 VAL H H 1 8.028 0.002 . 1 . . . . A 610 VAL H . 36513 1
239 . 1 . 1 26 26 VAL HA H 1 3.808 0.006 . 1 . . . . A 610 VAL HA . 36513 1
240 . 1 . 1 26 26 VAL HB H 1 1.802 0.003 . 1 . . . . A 610 VAL HB . 36513 1
241 . 1 . 1 26 26 VAL HG11 H 1 0.778 0.000 . 2 . . . . A 610 VAL HG11 . 36513 1
242 . 1 . 1 26 26 VAL HG12 H 1 0.778 0.000 . 2 . . . . A 610 VAL HG12 . 36513 1
243 . 1 . 1 26 26 VAL HG13 H 1 0.778 0.000 . 2 . . . . A 610 VAL HG13 . 36513 1
244 . 1 . 1 26 26 VAL HG21 H 1 0.822 0.001 . 2 . . . . A 610 VAL HG21 . 36513 1
245 . 1 . 1 26 26 VAL HG22 H 1 0.822 0.001 . 2 . . . . A 610 VAL HG22 . 36513 1
246 . 1 . 1 26 26 VAL HG23 H 1 0.822 0.001 . 2 . . . . A 610 VAL HG23 . 36513 1
247 . 1 . 1 26 26 VAL CA C 13 64.488 0.041 . 1 . . . . A 610 VAL CA . 36513 1
248 . 1 . 1 26 26 VAL CB C 13 30.796 0.082 . 1 . . . . A 610 VAL CB . 36513 1
249 . 1 . 1 26 26 VAL CG1 C 13 20.982 0.010 . 2 . . . . A 610 VAL CG1 . 36513 1
250 . 1 . 1 26 26 VAL CG2 C 13 21.201 0.066 . 2 . . . . A 610 VAL CG2 . 36513 1
251 . 1 . 1 26 26 VAL N N 15 118.645 0.033 . 1 . . . . A 610 VAL N . 36513 1
252 . 1 . 1 27 27 LEU H H 1 7.736 0.004 . 1 . . . . A 611 LEU H . 36513 1
253 . 1 . 1 27 27 LEU HA H 1 4.152 0.007 . 1 . . . . A 611 LEU HA . 36513 1
254 . 1 . 1 27 27 LEU HB2 H 1 1.516 0.004 . 2 . . . . A 611 LEU HB2 . 36513 1
255 . 1 . 1 27 27 LEU HB3 H 1 1.867 0.011 . 2 . . . . A 611 LEU HB3 . 36513 1
256 . 1 . 1 27 27 LEU HD11 H 1 0.921 0.005 . 2 . . . . A 611 LEU HD11 . 36513 1
257 . 1 . 1 27 27 LEU HD12 H 1 0.921 0.005 . 2 . . . . A 611 LEU HD12 . 36513 1
258 . 1 . 1 27 27 LEU HD13 H 1 0.921 0.005 . 2 . . . . A 611 LEU HD13 . 36513 1
259 . 1 . 1 27 27 LEU HD21 H 1 0.841 0.002 . 2 . . . . A 611 LEU HD21 . 36513 1
260 . 1 . 1 27 27 LEU HD22 H 1 0.841 0.002 . 2 . . . . A 611 LEU HD22 . 36513 1
261 . 1 . 1 27 27 LEU HD23 H 1 0.841 0.002 . 2 . . . . A 611 LEU HD23 . 36513 1
262 . 1 . 1 27 27 LEU CA C 13 56.510 0.026 . 1 . . . . A 611 LEU CA . 36513 1
263 . 1 . 1 27 27 LEU CB C 13 40.967 0.073 . 1 . . . . A 611 LEU CB . 36513 1
264 . 1 . 1 27 27 LEU CD1 C 13 24.885 0.033 . 2 . . . . A 611 LEU CD1 . 36513 1
265 . 1 . 1 27 27 LEU CD2 C 13 22.588 0.086 . 2 . . . . A 611 LEU CD2 . 36513 1
266 . 1 . 1 27 27 LEU N N 15 116.833 0.052 . 1 . . . . A 611 LEU N . 36513 1
267 . 1 . 1 28 28 LEU H H 1 7.782 0.007 . 1 . . . . A 612 LEU H . 36513 1
268 . 1 . 1 28 28 LEU HA H 1 4.274 0.010 . 1 . . . . A 612 LEU HA . 36513 1
269 . 1 . 1 28 28 LEU HB2 H 1 1.979 0.002 . 2 . . . . A 612 LEU HB2 . 36513 1
270 . 1 . 1 28 28 LEU HB3 H 1 1.520 0.001 . 2 . . . . A 612 LEU HB3 . 36513 1
271 . 1 . 1 28 28 LEU HG H 1 1.622 0.000 . 1 . . . . A 612 LEU HG . 36513 1
272 . 1 . 1 28 28 LEU HD11 H 1 0.826 0.001 . 2 . . . . A 612 LEU HD11 . 36513 1
273 . 1 . 1 28 28 LEU HD12 H 1 0.826 0.001 . 2 . . . . A 612 LEU HD12 . 36513 1
274 . 1 . 1 28 28 LEU HD13 H 1 0.826 0.001 . 2 . . . . A 612 LEU HD13 . 36513 1
275 . 1 . 1 28 28 LEU HD21 H 1 0.802 0.002 . 2 . . . . A 612 LEU HD21 . 36513 1
276 . 1 . 1 28 28 LEU HD22 H 1 0.802 0.002 . 2 . . . . A 612 LEU HD22 . 36513 1
277 . 1 . 1 28 28 LEU HD23 H 1 0.802 0.002 . 2 . . . . A 612 LEU HD23 . 36513 1
278 . 1 . 1 28 28 LEU CA C 13 54.317 0.045 . 1 . . . . A 612 LEU CA . 36513 1
279 . 1 . 1 28 28 LEU CB C 13 40.747 0.053 . 1 . . . . A 612 LEU CB . 36513 1
280 . 1 . 1 28 28 LEU CG C 13 26.149 0.013 . 1 . . . . A 612 LEU CG . 36513 1
281 . 1 . 1 28 28 LEU CD1 C 13 25.000 0.125 . 2 . . . . A 612 LEU CD1 . 36513 1
282 . 1 . 1 28 28 LEU CD2 C 13 22.339 0.110 . 2 . . . . A 612 LEU CD2 . 36513 1
283 . 1 . 1 28 28 LEU N N 15 113.771 0.032 . 1 . . . . A 612 LEU N . 36513 1
284 . 1 . 1 29 29 ARG H H 1 7.150 0.003 . 1 . . . . A 613 ARG H . 36513 1
285 . 1 . 1 29 29 ARG HA H 1 4.022 0.007 . 1 . . . . A 613 ARG HA . 36513 1
286 . 1 . 1 29 29 ARG HB2 H 1 1.820 0.002 . 2 . . . . A 613 ARG HB2 . 36513 1
287 . 1 . 1 29 29 ARG HB3 H 1 1.899 0.000 . 2 . . . . A 613 ARG HB3 . 36513 1
288 . 1 . 1 29 29 ARG HG2 H 1 1.533 0.001 . 1 . . . . A 613 ARG HG2 . 36513 1
289 . 1 . 1 29 29 ARG HD2 H 1 3.129 0.000 . 1 . . . . A 613 ARG HD2 . 36513 1
290 . 1 . 1 29 29 ARG HE H 1 7.382 0.001 . 1 . . . . A 613 ARG HE . 36513 1
291 . 1 . 1 29 29 ARG CA C 13 55.516 0.075 . 1 . . . . A 613 ARG CA . 36513 1
292 . 1 . 1 29 29 ARG CB C 13 27.772 0.057 . 1 . . . . A 613 ARG CB . 36513 1
293 . 1 . 1 29 29 ARG CG C 13 26.477 0.081 . 1 . . . . A 613 ARG CG . 36513 1
294 . 1 . 1 29 29 ARG CD C 13 42.782 0.010 . 1 . . . . A 613 ARG CD . 36513 1
295 . 1 . 1 29 29 ARG N N 15 113.610 0.028 . 1 . . . . A 613 ARG N . 36513 1
296 . 1 . 1 29 29 ARG NE N 15 84.628 0.004 . 1 . . . . A 613 ARG NE . 36513 1
297 . 1 . 1 30 30 ARG H H 1 8.195 0.002 . 1 . . . . A 614 ARG H . 36513 1
298 . 1 . 1 30 30 ARG HA H 1 4.498 0.006 . 1 . . . . A 614 ARG HA . 36513 1
299 . 1 . 1 30 30 ARG HB2 H 1 1.874 0.002 . 2 . . . . A 614 ARG HB2 . 36513 1
300 . 1 . 1 30 30 ARG HB3 H 1 1.565 0.001 . 2 . . . . A 614 ARG HB3 . 36513 1
301 . 1 . 1 30 30 ARG HG2 H 1 1.666 0.003 . 1 . . . . A 614 ARG HG2 . 36513 1
302 . 1 . 1 30 30 ARG HD2 H 1 3.130 0.001 . 1 . . . . A 614 ARG HD2 . 36513 1
303 . 1 . 1 30 30 ARG HE H 1 7.906 0.001 . 1 . . . . A 614 ARG HE . 36513 1
304 . 1 . 1 30 30 ARG CA C 13 53.455 0.048 . 1 . . . . A 614 ARG CA . 36513 1
305 . 1 . 1 30 30 ARG CB C 13 28.852 0.074 . 1 . . . . A 614 ARG CB . 36513 1
306 . 1 . 1 30 30 ARG CG C 13 26.490 0.083 . 1 . . . . A 614 ARG CG . 36513 1
307 . 1 . 1 30 30 ARG CD C 13 42.810 0.037 . 1 . . . . A 614 ARG CD . 36513 1
308 . 1 . 1 30 30 ARG N N 15 120.676 0.084 . 1 . . . . A 614 ARG N . 36513 1
309 . 1 . 1 30 30 ARG NE N 15 83.251 0.008 . 1 . . . . A 614 ARG NE . 36513 1
310 . 1 . 1 31 31 PRO HA H 1 4.213 0.001 . 1 . . . . A 615 PRO HA . 36513 1
311 . 1 . 1 31 31 PRO HB2 H 1 2.200 0.000 . 2 . . . . A 615 PRO HB2 . 36513 1
312 . 1 . 1 31 31 PRO HB3 H 1 1.889 0.000 . 2 . . . . A 615 PRO HB3 . 36513 1
313 . 1 . 1 31 31 PRO HG2 H 1 1.963 0.001 . 1 . . . . A 615 PRO HG2 . 36513 1
314 . 1 . 1 31 31 PRO HD2 H 1 3.774 0.001 . 2 . . . . A 615 PRO HD2 . 36513 1
315 . 1 . 1 31 31 PRO HD3 H 1 3.639 0.001 . 2 . . . . A 615 PRO HD3 . 36513 1
316 . 1 . 1 31 31 PRO CA C 13 64.203 0.034 . 1 . . . . A 615 PRO CA . 36513 1
317 . 1 . 1 31 31 PRO CB C 13 31.380 0.030 . 1 . . . . A 615 PRO CB . 36513 1
318 . 1 . 1 31 31 PRO CG C 13 26.664 0.057 . 1 . . . . A 615 PRO CG . 36513 1
319 . 1 . 1 31 31 PRO CD C 13 49.663 0.018 . 1 . . . . A 615 PRO CD . 36513 1
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