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 30162
_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-15N HSQC' . . . 30162 1
2 '3D HNCA' . . . 30162 1
3 '3D HNCO' . . . 30162 1
4 '3D HN(CO)CA' . . . 30162 1
5 '3D HN(CA)CO' . . . 30162 1
6 '3D 1H-13C NOESY aromatic' . . . 30162 1
7 '3D 1H-13C NOESY' . . . 30162 1
8 '3D 1H-15N NOESY' . . . 30162 1
9 '3D CBCANH' . . . 30162 1
10 HCCCONH . . . 30162 1
11 '3D HCCH-TOCSY' . . . 30162 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 H H 1 8.299 0.023 . 1 . . . . A 630 GLY H1 . 30162 1
2 . 1 1 1 1 GLY HA2 H 1 3.770 0.023 . 1 . . . . A 630 GLY HA2 . 30162 1
3 . 1 1 1 1 GLY HA3 H 1 3.770 0.023 . 1 . . . . A 630 GLY HA3 . 30162 1
4 . 1 1 1 1 GLY CA C 13 44.025 0.160 . 1 . . . . A 630 GLY CA . 30162 1
5 . 1 1 1 1 GLY N N 15 109.635 0.109 . 1 . . . . A 630 GLY N . 30162 1
6 . 1 1 2 2 SER H H 1 8.576 0.023 . 1 . . . . A 631 SER H . 30162 1
7 . 1 1 2 2 SER HA H 1 3.708 0.023 . 1 . . . . A 631 SER HA . 30162 1
8 . 1 1 2 2 SER C C 13 174.026 0.125 . 1 . . . . A 631 SER C . 30162 1
9 . 1 1 2 2 SER CA C 13 58.187 0.160 . 1 . . . . A 631 SER CA . 30162 1
10 . 1 1 2 2 SER CB C 13 63.805 0.138 . 1 . . . . A 631 SER CB . 30162 1
11 . 1 1 2 2 SER N N 15 115.897 0.109 . 1 . . . . A 631 SER N . 30162 1
12 . 1 1 3 3 ASP H H 1 8.363 0.023 . 1 . . . . A 632 ASP H . 30162 1
13 . 1 1 3 3 ASP HA H 1 4.444 0.023 . 1 . . . . A 632 ASP HA . 30162 1
14 . 1 1 3 3 ASP HB2 H 1 2.505 0.023 . 1 . . . . A 632 ASP HB2 . 30162 1
15 . 1 1 3 3 ASP HB3 H 1 2.505 0.023 . 1 . . . . A 632 ASP HB3 . 30162 1
16 . 1 1 3 3 ASP C C 13 176.080 0.125 . 1 . . . . A 632 ASP C . 30162 1
17 . 1 1 3 3 ASP CA C 13 53.768 0.160 . 1 . . . . A 632 ASP CA . 30162 1
18 . 1 1 3 3 ASP CB C 13 40.370 0.138 . 1 . . . . A 632 ASP CB . 30162 1
19 . 1 1 3 3 ASP N N 15 122.257 0.109 . 1 . . . . A 632 ASP N . 30162 1
20 . 1 1 4 4 LYS H H 1 8.163 0.023 . 1 . . . . A 633 LYS H . 30162 1
21 . 1 1 4 4 LYS HA H 1 4.223 0.023 . 1 . . . . A 633 LYS HA . 30162 1
22 . 1 1 4 4 LYS HB2 H 1 1.593 0.023 . 1 . . . . A 633 LYS HB2 . 30162 1
23 . 1 1 4 4 LYS HB3 H 1 1.686 0.023 . 1 . . . . A 633 LYS HB3 . 30162 1
24 . 1 1 4 4 LYS HG2 H 1 1.282 0.023 . 1 . . . . A 633 LYS HG2 . 30162 1
25 . 1 1 4 4 LYS HG3 H 1 1.282 0.023 . 1 . . . . A 633 LYS HG3 . 30162 1
26 . 1 1 4 4 LYS HD2 H 1 1.527 0.023 . 1 . . . . A 633 LYS HD2 . 30162 1
27 . 1 1 4 4 LYS HD3 H 1 1.527 0.023 . 1 . . . . A 633 LYS HD3 . 30162 1
28 . 1 1 4 4 LYS HE2 H 1 2.840 0.023 . 1 . . . . A 633 LYS HE2 . 30162 1
29 . 1 1 4 4 LYS HE3 H 1 2.840 0.023 . 1 . . . . A 633 LYS HE3 . 30162 1
30 . 1 1 4 4 LYS C C 13 176.479 0.125 . 1 . . . . A 633 LYS C . 30162 1
31 . 1 1 4 4 LYS CA C 13 56.040 0.160 . 1 . . . . A 633 LYS CA . 30162 1
32 . 1 1 4 4 LYS CB C 13 32.793 0.138 . 1 . . . . A 633 LYS CB . 30162 1
33 . 1 1 4 4 LYS CG C 13 24.500 . . 1 . . . . A 633 LYS CG . 30162 1
34 . 1 1 4 4 LYS CD C 13 28.889 . . 1 . . . . A 633 LYS CD . 30162 1
35 . 1 1 4 4 LYS CE C 13 41.917 . . 1 . . . . A 633 LYS CE . 30162 1
36 . 1 1 4 4 LYS N N 15 121.504 0.109 . 1 . . . . A 633 LYS N . 30162 1
37 . 1 1 5 5 THR H H 1 8.102 0.023 . 1 . . . . A 634 THR H . 30162 1
38 . 1 1 5 5 THR HA H 1 4.103 0.023 . 1 . . . . A 634 THR HA . 30162 1
39 . 1 1 5 5 THR HB H 1 4.026 0.023 . 1 . . . . A 634 THR HB . 30162 1
40 . 1 1 5 5 THR HG21 H 1 1.037 0.023 . 1 . . . . A 634 THR HG21 . 30162 1
41 . 1 1 5 5 THR HG22 H 1 1.037 0.023 . 1 . . . . A 634 THR HG22 . 30162 1
42 . 1 1 5 5 THR HG23 H 1 1.037 0.023 . 1 . . . . A 634 THR HG23 . 30162 1
43 . 1 1 5 5 THR C C 13 174.163 0.125 . 1 . . . . A 634 THR C . 30162 1
44 . 1 1 5 5 THR CA C 13 62.098 0.160 . 1 . . . . A 634 THR CA . 30162 1
45 . 1 1 5 5 THR CB C 13 69.689 0.138 . 1 . . . . A 634 THR CB . 30162 1
46 . 1 1 5 5 THR CG2 C 13 21.720 . . 1 . . . . A 634 THR CG2 . 30162 1
47 . 1 1 5 5 THR N N 15 115.462 0.109 . 1 . . . . A 634 THR N . 30162 1
48 . 1 1 6 6 LEU H H 1 8.023 0.023 . 1 . . . . A 635 LEU H . 30162 1
49 . 1 1 6 6 LEU HA H 1 4.502 0.023 . 1 . . . . A 635 LEU HA . 30162 1
50 . 1 1 6 6 LEU HB2 H 1 1.445 0.023 . 1 . . . . A 635 LEU HB2 . 30162 1
51 . 1 1 6 6 LEU HB3 H 1 1.481 0.023 . 1 . . . . A 635 LEU HB3 . 30162 1
52 . 1 1 6 6 LEU HD11 H 1 0.786 0.023 . 1 . . . . A 635 LEU HD11 . 30162 1
53 . 1 1 6 6 LEU HD12 H 1 0.786 0.023 . 1 . . . . A 635 LEU HD12 . 30162 1
54 . 1 1 6 6 LEU HD13 H 1 0.786 0.023 . 1 . . . . A 635 LEU HD13 . 30162 1
55 . 1 1 6 6 LEU HD21 H 1 0.750 0.023 . 1 . . . . A 635 LEU HD21 . 30162 1
56 . 1 1 6 6 LEU HD22 H 1 0.750 0.023 . 1 . . . . A 635 LEU HD22 . 30162 1
57 . 1 1 6 6 LEU HD23 H 1 0.750 0.023 . 1 . . . . A 635 LEU HD23 . 30162 1
58 . 1 1 6 6 LEU C C 13 175.089 0.125 . 1 . . . . A 635 LEU C . 30162 1
59 . 1 1 6 6 LEU CA C 13 52.878 0.160 . 1 . . . . A 635 LEU CA . 30162 1
60 . 1 1 6 6 LEU CB C 13 41.741 0.138 . 1 . . . . A 635 LEU CB . 30162 1
61 . 1 1 6 6 LEU N N 15 125.558 0.109 . 1 . . . . A 635 LEU N . 30162 1
62 . 1 1 7 7 PRO HA H 1 4.256 0.023 . 1 . . . . A 636 PRO HA . 30162 1
63 . 1 1 7 7 PRO HB2 H 1 2.127 0.023 . 1 . . . . A 636 PRO HB2 . 30162 1
64 . 1 1 7 7 PRO HB3 H 1 2.127 0.023 . 1 . . . . A 636 PRO HB3 . 30162 1
65 . 1 1 7 7 PRO HG2 H 1 1.750 0.023 . 1 . . . . A 636 PRO HG2 . 30162 1
66 . 1 1 7 7 PRO HG3 H 1 1.850 0.023 . 1 . . . . A 636 PRO HG3 . 30162 1
67 . 1 1 7 7 PRO HD2 H 1 3.494 0.023 . 1 . . . . A 636 PRO HD2 . 30162 1
68 . 1 1 7 7 PRO HD3 H 1 3.668 0.023 . 1 . . . . A 636 PRO HD3 . 30162 1
69 . 1 1 7 7 PRO C C 13 176.557 0.125 . 1 . . . . A 636 PRO C . 30162 1
70 . 1 1 7 7 PRO CA C 13 63.206 0.160 . 1 . . . . A 636 PRO CA . 30162 1
71 . 1 1 7 7 PRO CB C 13 31.898 0.138 . 1 . . . . A 636 PRO CB . 30162 1
72 . 1 1 7 7 PRO CG C 13 27.255 . . 1 . . . . A 636 PRO CG . 30162 1
73 . 1 1 7 7 PRO CD C 13 50.500 . . 1 . . . . A 636 PRO CD . 30162 1
74 . 1 1 8 8 ASP H H 1 8.245 0.023 . 1 . . . . A 637 ASP H . 30162 1
75 . 1 1 8 8 ASP HA H 1 4.387 0.023 . 1 . . . . A 637 ASP HA . 30162 1
76 . 1 1 8 8 ASP HB2 H 1 2.558 0.023 . 1 . . . . A 637 ASP HB2 . 30162 1
77 . 1 1 8 8 ASP HB3 H 1 2.558 0.023 . 1 . . . . A 637 ASP HB3 . 30162 1
78 . 1 1 8 8 ASP C C 13 176.226 0.125 . 1 . . . . A 637 ASP C . 30162 1
79 . 1 1 8 8 ASP CA C 13 53.866 0.160 . 1 . . . . A 637 ASP CA . 30162 1
80 . 1 1 8 8 ASP CB C 13 40.965 0.138 . 1 . . . . A 637 ASP CB . 30162 1
81 . 1 1 8 8 ASP N N 15 119.909 0.109 . 1 . . . . A 637 ASP N . 30162 1
82 . 1 1 9 9 GLN H H 1 8.198 0.023 . 1 . . . . A 638 GLN H . 30162 1
83 . 1 1 9 9 GLN HA H 1 4.185 0.023 . 1 . . . . A 638 GLN HA . 30162 1
84 . 1 1 9 9 GLN HB2 H 1 1.846 0.023 . 1 . . . . A 638 GLN HB2 . 30162 1
85 . 1 1 9 9 GLN HB3 H 1 2.035 0.023 . 1 . . . . A 638 GLN HB3 . 30162 1
86 . 1 1 9 9 GLN HG2 H 1 2.216 0.023 . 1 . . . . A 638 GLN HG2 . 30162 1
87 . 1 1 9 9 GLN HG3 H 1 2.216 0.023 . 1 . . . . A 638 GLN HG3 . 30162 1
88 . 1 1 9 9 GLN C C 13 176.382 0.125 . 1 . . . . A 638 GLN C . 30162 1
89 . 1 1 9 9 GLN CA C 13 55.857 0.160 . 1 . . . . A 638 GLN CA . 30162 1
90 . 1 1 9 9 GLN CB C 13 29.343 0.138 . 1 . . . . A 638 GLN CB . 30162 1
91 . 1 1 9 9 GLN CG C 13 33.895 . . 1 . . . . A 638 GLN CG . 30162 1
92 . 1 1 9 9 GLN N N 15 120.549 0.109 . 1 . . . . A 638 GLN N . 30162 1
93 . 1 1 10 10 GLY H H 1 8.333 0.023 . 1 . . . . A 639 GLY H . 30162 1
94 . 1 1 10 10 GLY HA2 H 1 3.802 0.023 . 1 . . . . A 639 GLY HA2 . 30162 1
95 . 1 1 10 10 GLY HA3 H 1 3.802 0.023 . 1 . . . . A 639 GLY HA3 . 30162 1
96 . 1 1 10 10 GLY C C 13 173.859 0.125 . 1 . . . . A 639 GLY C . 30162 1
97 . 1 1 10 10 GLY CA C 13 45.370 0.160 . 1 . . . . A 639 GLY CA . 30162 1
98 . 1 1 10 10 GLY N N 15 109.653 0.109 . 1 . . . . A 639 GLY N . 30162 1
99 . 1 1 11 11 ASP H H 1 8.113 0.023 . 1 . . . . A 640 ASP H . 30162 1
100 . 1 1 11 11 ASP HA H 1 4.518 0.023 . 1 . . . . A 640 ASP HA . 30162 1
101 . 1 1 11 11 ASP HB2 H 1 2.516 0.023 . 1 . . . . A 640 ASP HB2 . 30162 1
102 . 1 1 11 11 ASP HB3 H 1 2.516 0.023 . 1 . . . . A 640 ASP HB3 . 30162 1
103 . 1 1 11 11 ASP C C 13 176.109 0.125 . 1 . . . . A 640 ASP C . 30162 1
104 . 1 1 11 11 ASP CA C 13 54.154 0.160 . 1 . . . . A 640 ASP CA . 30162 1
105 . 1 1 11 11 ASP CB C 13 41.056 0.138 . 1 . . . . A 640 ASP CB . 30162 1
106 . 1 1 11 11 ASP N N 15 120.160 0.109 . 1 . . . . A 640 ASP N . 30162 1
107 . 1 1 12 12 ASN H H 1 8.275 0.023 . 1 . . . . A 641 ASN H . 30162 1
108 . 1 1 12 12 ASN HA H 1 4.545 0.023 . 1 . . . . A 641 ASN HA . 30162 1
109 . 1 1 12 12 ASN HB2 H 1 2.658 0.023 . 1 . . . . A 641 ASN HB2 . 30162 1
110 . 1 1 12 12 ASN HB3 H 1 2.658 0.023 . 1 . . . . A 641 ASN HB3 . 30162 1
111 . 1 1 12 12 ASN C C 13 174.886 0.125 . 1 . . . . A 641 ASN C . 30162 1
112 . 1 1 12 12 ASN CA C 13 53.983 0.160 . 1 . . . . A 641 ASN CA . 30162 1
113 . 1 1 12 12 ASN CB C 13 39.139 0.138 . 1 . . . . A 641 ASN CB . 30162 1
114 . 1 1 12 12 ASN N N 15 118.739 0.109 . 1 . . . . A 641 ASN N . 30162 1
115 . 1 1 13 13 ASP H H 1 8.143 0.023 . 1 . . . . A 642 ASP H . 30162 1
116 . 1 1 13 13 ASP HA H 1 4.467 0.023 . 1 . . . . A 642 ASP HA . 30162 1
117 . 1 1 13 13 ASP HB2 H 1 2.482 0.023 . 1 . . . . A 642 ASP HB2 . 30162 1
118 . 1 1 13 13 ASP HB3 H 1 2.525 0.023 . 1 . . . . A 642 ASP HB3 . 30162 1
119 . 1 1 13 13 ASP C C 13 175.751 0.125 . 1 . . . . A 642 ASP C . 30162 1
120 . 1 1 13 13 ASP CA C 13 54.309 0.160 . 1 . . . . A 642 ASP CA . 30162 1
121 . 1 1 13 13 ASP CB C 13 40.861 0.138 . 1 . . . . A 642 ASP CB . 30162 1
122 . 1 1 13 13 ASP N N 15 120.062 0.109 . 1 . . . . A 642 ASP N . 30162 1
123 . 1 1 14 14 ASN H H 1 8.008 0.023 . 1 . . . . A 643 ASN H . 30162 1
124 . 1 1 14 14 ASN HA H 1 4.387 0.023 . 1 . . . . A 643 ASN HA . 30162 1
125 . 1 1 14 14 ASN HB2 H 1 1.868 0.023 . 1 . . . . A 643 ASN HB2 . 30162 1
126 . 1 1 14 14 ASN HB3 H 1 2.096 0.023 . 1 . . . . A 643 ASN HB3 . 30162 1
127 . 1 1 14 14 ASN C C 13 176.329 0.125 . 1 . . . . A 643 ASN C . 30162 1
128 . 1 1 14 14 ASN CA C 13 53.161 0.160 . 1 . . . . A 643 ASN CA . 30162 1
129 . 1 1 14 14 ASN CB C 13 38.897 0.138 . 1 . . . . A 643 ASN CB . 30162 1
130 . 1 1 14 14 ASN N N 15 118.292 0.109 . 1 . . . . A 643 ASN N . 30162 1
131 . 1 1 15 15 TRP H H 1 8.125 0.023 . 1 . . . . A 644 TRP H . 30162 1
132 . 1 1 15 15 TRP HA H 1 4.181 0.023 . 1 . . . . A 644 TRP HA . 30162 1
133 . 1 1 15 15 TRP HB2 H 1 3.068 0.023 . 1 . . . . A 644 TRP HB2 . 30162 1
134 . 1 1 15 15 TRP HB3 H 1 3.259 0.023 . 1 . . . . A 644 TRP HB3 . 30162 1
135 . 1 1 15 15 TRP HD1 H 1 6.739 0.023 . 1 . . . . A 644 TRP HD1 . 30162 1
136 . 1 1 15 15 TRP HE1 H 1 10.467 0.023 . 1 . . . . A 644 TRP HE1 . 30162 1
137 . 1 1 15 15 TRP HE3 H 1 7.226 0.023 . 1 . . . . A 644 TRP HE3 . 30162 1
138 . 1 1 15 15 TRP HZ2 H 1 7.299 0.023 . 1 . . . . A 644 TRP HZ2 . 30162 1
139 . 1 1 15 15 TRP HZ3 H 1 6.674 0.023 . 1 . . . . A 644 TRP HZ3 . 30162 1
140 . 1 1 15 15 TRP HH2 H 1 6.957 0.023 . 1 . . . . A 644 TRP HH2 . 30162 1
141 . 1 1 15 15 TRP C C 13 176.503 0.125 . 1 . . . . A 644 TRP C . 30162 1
142 . 1 1 15 15 TRP CA C 13 59.376 0.160 . 1 . . . . A 644 TRP CA . 30162 1
143 . 1 1 15 15 TRP CB C 13 28.821 0.138 . 1 . . . . A 644 TRP CB . 30162 1
144 . 1 1 15 15 TRP CD1 C 13 126.951 . . 1 . . . . A 644 TRP CD1 . 30162 1
145 . 1 1 15 15 TRP CE3 C 13 120.192 . . 1 . . . . A 644 TRP CE3 . 30162 1
146 . 1 1 15 15 TRP CZ2 C 13 114.446 . . 1 . . . . A 644 TRP CZ2 . 30162 1
147 . 1 1 15 15 TRP CZ3 C 13 118.331 . . 1 . . . . A 644 TRP CZ3 . 30162 1
148 . 1 1 15 15 TRP CH2 C 13 123.991 . . 1 . . . . A 644 TRP CH2 . 30162 1
149 . 1 1 15 15 TRP N N 15 121.589 0.109 . 1 . . . . A 644 TRP N . 30162 1
150 . 1 1 15 15 TRP NE1 N 15 131.137 0.109 . 1 . . . . A 644 TRP NE1 . 30162 1
151 . 1 1 16 16 TRP H H 1 6.830 0.023 . 1 . . . . A 645 TRP H . 30162 1
152 . 1 1 16 16 TRP HA H 1 4.260 0.023 . 1 . . . . A 645 TRP HA . 30162 1
153 . 1 1 16 16 TRP HB2 H 1 2.208 0.023 . 1 . . . . A 645 TRP HB2 . 30162 1
154 . 1 1 16 16 TRP HB3 H 1 2.977 0.023 . 1 . . . . A 645 TRP HB3 . 30162 1
155 . 1 1 16 16 TRP HD1 H 1 7.421 0.023 . 1 . . . . A 645 TRP HD1 . 30162 1
156 . 1 1 16 16 TRP HE1 H 1 10.091 0.023 . 1 . . . . A 645 TRP HE1 . 30162 1
157 . 1 1 16 16 TRP HZ2 H 1 7.282 0.023 . 1 . . . . A 645 TRP HZ2 . 30162 1
158 . 1 1 16 16 TRP HH2 H 1 6.864 0.023 . 1 . . . . A 645 TRP HH2 . 30162 1
159 . 1 1 16 16 TRP C C 13 176.611 0.125 . 1 . . . . A 645 TRP C . 30162 1
160 . 1 1 16 16 TRP CA C 13 57.665 0.160 . 1 . . . . A 645 TRP CA . 30162 1
161 . 1 1 16 16 TRP CB C 13 28.252 0.138 . 1 . . . . A 645 TRP CB . 30162 1
162 . 1 1 16 16 TRP CD1 C 13 127.380 . . 1 . . . . A 645 TRP CD1 . 30162 1
163 . 1 1 16 16 TRP CZ2 C 13 114.450 . . 1 . . . . A 645 TRP CZ2 . 30162 1
164 . 1 1 16 16 TRP CH2 C 13 123.697 . . 1 . . . . A 645 TRP CH2 . 30162 1
165 . 1 1 16 16 TRP N N 15 116.388 0.109 . 1 . . . . A 645 TRP N . 30162 1
166 . 1 1 16 16 TRP NE1 N 15 129.730 0.109 . 1 . . . . A 645 TRP NE1 . 30162 1
167 . 1 1 17 17 THR H H 1 7.299 0.023 . 1 . . . . A 646 THR H . 30162 1
168 . 1 1 17 17 THR HA H 1 4.208 0.023 . 1 . . . . A 646 THR HA . 30162 1
169 . 1 1 17 17 THR HB H 1 3.954 0.023 . 1 . . . . A 646 THR HB . 30162 1
170 . 1 1 17 17 THR HG21 H 1 0.985 0.023 . 1 . . . . A 646 THR HG21 . 30162 1
171 . 1 1 17 17 THR HG22 H 1 0.985 0.023 . 1 . . . . A 646 THR HG22 . 30162 1
172 . 1 1 17 17 THR HG23 H 1 0.985 0.023 . 1 . . . . A 646 THR HG23 . 30162 1
173 . 1 1 17 17 THR C C 13 176.080 0.125 . 1 . . . . A 646 THR C . 30162 1
174 . 1 1 17 17 THR CA C 13 65.139 0.160 . 1 . . . . A 646 THR CA . 30162 1
175 . 1 1 17 17 THR CB C 13 68.898 0.138 . 1 . . . . A 646 THR CB . 30162 1
176 . 1 1 17 17 THR CG2 C 13 21.402 . . 1 . . . . A 646 THR CG2 . 30162 1
177 . 1 1 17 17 THR N N 15 114.323 0.109 . 1 . . . . A 646 THR N . 30162 1
178 . 1 1 18 18 GLY H H 1 8.272 0.023 . 1 . . . . A 647 GLY H . 30162 1
179 . 1 1 18 18 GLY HA2 H 1 3.709 0.023 . 1 . . . . A 647 GLY HA2 . 30162 1
180 . 1 1 18 18 GLY HA3 H 1 3.879 0.023 . 1 . . . . A 647 GLY HA3 . 30162 1
181 . 1 1 18 18 GLY C C 13 175.406 0.125 . 1 . . . . A 647 GLY C . 30162 1
182 . 1 1 18 18 GLY CA C 13 45.977 0.160 . 1 . . . . A 647 GLY CA . 30162 1
183 . 1 1 18 18 GLY N N 15 110.508 0.109 . 1 . . . . A 647 GLY N . 30162 1
184 . 1 1 19 19 TRP H H 1 7.478 0.023 . 1 . . . . A 648 TRP H . 30162 1
185 . 1 1 19 19 TRP HA H 1 3.806 0.023 . 1 . . . . A 648 TRP HA . 30162 1
186 . 1 1 19 19 TRP HB2 H 1 3.155 0.023 . 1 . . . . A 648 TRP HB2 . 30162 1
187 . 1 1 19 19 TRP HB3 H 1 3.155 0.023 . 1 . . . . A 648 TRP HB3 . 30162 1
188 . 1 1 19 19 TRP HD1 H 1 7.421 0.023 . 1 . . . . A 648 TRP HD1 . 30162 1
189 . 1 1 19 19 TRP HE1 H 1 10.746 0.023 . 1 . . . . A 648 TRP HE1 . 30162 1
190 . 1 1 19 19 TRP HE3 H 1 7.002 0.023 . 1 . . . . A 648 TRP HE3 . 30162 1
191 . 1 1 19 19 TRP HZ2 H 1 7.337 0.023 . 1 . . . . A 648 TRP HZ2 . 30162 1
192 . 1 1 19 19 TRP C C 13 176.956 0.125 . 1 . . . . A 648 TRP C . 30162 1
193 . 1 1 19 19 TRP CA C 13 59.300 0.160 . 1 . . . . A 648 TRP CA . 30162 1
194 . 1 1 19 19 TRP CB C 13 28.274 0.138 . 1 . . . . A 648 TRP CB . 30162 1
195 . 1 1 19 19 TRP CD1 C 13 127.987 . . 1 . . . . A 648 TRP CD1 . 30162 1
196 . 1 1 19 19 TRP CE3 C 13 128.403 . . 1 . . . . A 648 TRP CE3 . 30162 1
197 . 1 1 19 19 TRP CZ2 C 13 114.446 . . 1 . . . . A 648 TRP CZ2 . 30162 1
198 . 1 1 19 19 TRP N N 15 120.335 0.109 . 1 . . . . A 648 TRP N . 30162 1
199 . 1 1 19 19 TRP NE1 N 15 131.662 0.109 . 1 . . . . A 648 TRP NE1 . 30162 1
200 . 1 1 20 20 ARG H H 1 7.325 0.023 . 1 . . . . A 649 ARG H . 30162 1
201 . 1 1 20 20 ARG HA H 1 3.382 0.023 . 1 . . . . A 649 ARG HA . 30162 1
202 . 1 1 20 20 ARG HB2 H 1 1.075 0.023 . 1 . . . . A 649 ARG HB2 . 30162 1
203 . 1 1 20 20 ARG HB3 H 1 1.336 0.023 . 1 . . . . A 649 ARG HB3 . 30162 1
204 . 1 1 20 20 ARG HG2 H 1 0.458 0.023 . 1 . . . . A 649 ARG HG2 . 30162 1
205 . 1 1 20 20 ARG HG3 H 1 0.561 0.023 . 1 . . . . A 649 ARG HG3 . 30162 1
206 . 1 1 20 20 ARG HD2 H 1 2.738 0.023 . 1 . . . . A 649 ARG HD2 . 30162 1
207 . 1 1 20 20 ARG HD3 H 1 2.738 0.023 . 1 . . . . A 649 ARG HD3 . 30162 1
208 . 1 1 20 20 ARG C C 13 178.063 0.125 . 1 . . . . A 649 ARG C . 30162 1
209 . 1 1 20 20 ARG CA C 13 59.207 0.160 . 1 . . . . A 649 ARG CA . 30162 1
210 . 1 1 20 20 ARG CB C 13 29.151 0.138 . 1 . . . . A 649 ARG CB . 30162 1
211 . 1 1 20 20 ARG CG C 13 27.159 . . 1 . . . . A 649 ARG CG . 30162 1
212 . 1 1 20 20 ARG CD C 13 43.264 . . 1 . . . . A 649 ARG CD . 30162 1
213 . 1 1 20 20 ARG N N 15 119.033 0.109 . 1 . . . . A 649 ARG N . 30162 1
214 . 1 1 21 21 GLN H H 1 7.666 0.023 . 1 . . . . A 650 GLN H . 30162 1
215 . 1 1 21 21 GLN HA H 1 3.916 0.023 . 1 . . . . A 650 GLN HA . 30162 1
216 . 1 1 21 21 GLN HB2 H 1 1.804 0.023 . 1 . . . . A 650 GLN HB2 . 30162 1
217 . 1 1 21 21 GLN HB3 H 1 1.804 0.023 . 1 . . . . A 650 GLN HB3 . 30162 1
218 . 1 1 21 21 GLN HG2 H 1 2.011 0.023 . 1 . . . . A 650 GLN HG2 . 30162 1
219 . 1 1 21 21 GLN HG3 H 1 2.011 0.023 . 1 . . . . A 650 GLN HG3 . 30162 1
220 . 1 1 21 21 GLN C C 13 176.223 0.125 . 1 . . . . A 650 GLN C . 30162 1
221 . 1 1 21 21 GLN CA C 13 56.953 0.160 . 1 . . . . A 650 GLN CA . 30162 1
222 . 1 1 21 21 GLN CB C 13 28.385 0.138 . 1 . . . . A 650 GLN CB . 30162 1
223 . 1 1 21 21 GLN CG C 13 33.787 . . 1 . . . . A 650 GLN CG . 30162 1
224 . 1 1 21 21 GLN N N 15 114.465 0.109 . 1 . . . . A 650 GLN N . 30162 1
225 . 1 1 22 22 TRP H H 1 7.681 0.023 . 1 . . . . A 651 TRP H . 30162 1
226 . 1 1 22 22 TRP HA H 1 4.320 0.023 . 1 . . . . A 651 TRP HA . 30162 1
227 . 1 1 22 22 TRP HB2 H 1 3.194 0.023 . 1 . . . . A 651 TRP HB2 . 30162 1
228 . 1 1 22 22 TRP HB3 H 1 3.435 0.023 . 1 . . . . A 651 TRP HB3 . 30162 1
229 . 1 1 22 22 TRP HD1 H 1 7.130 0.023 . 1 . . . . A 651 TRP HD1 . 30162 1
230 . 1 1 22 22 TRP HE1 H 1 10.306 0.023 . 1 . . . . A 651 TRP HE1 . 30162 1
231 . 1 1 22 22 TRP HE3 H 1 7.200 0.023 . 1 . . . . A 651 TRP HE3 . 30162 1
232 . 1 1 22 22 TRP HZ2 H 1 7.401 0.023 . 1 . . . . A 651 TRP HZ2 . 30162 1
233 . 1 1 22 22 TRP HH2 H 1 7.087 0.023 . 1 . . . . A 651 TRP HH2 . 30162 1
234 . 1 1 22 22 TRP C C 13 174.795 0.125 . 1 . . . . A 651 TRP C . 30162 1
235 . 1 1 22 22 TRP CA C 13 57.621 0.160 . 1 . . . . A 651 TRP CA . 30162 1
236 . 1 1 22 22 TRP CB C 13 29.626 0.138 . 1 . . . . A 651 TRP CB . 30162 1
237 . 1 1 22 22 TRP CD1 C 13 126.296 . . 1 . . . . A 651 TRP CD1 . 30162 1
238 . 1 1 22 22 TRP CE3 C 13 120.655 . . 1 . . . . A 651 TRP CE3 . 30162 1
239 . 1 1 22 22 TRP CZ2 C 13 114.446 . . 1 . . . . A 651 TRP CZ2 . 30162 1
240 . 1 1 22 22 TRP CH2 C 13 123.990 . . 1 . . . . A 651 TRP CH2 . 30162 1
241 . 1 1 22 22 TRP N N 15 118.593 0.109 . 1 . . . . A 651 TRP N . 30162 1
242 . 1 1 22 22 TRP NE1 N 15 129.502 0.109 . 1 . . . . A 651 TRP NE1 . 30162 1
243 . 1 1 23 23 ILE H H 1 7.071 0.023 . 1 . . . . A 652 ILE H . 30162 1
244 . 1 1 23 23 ILE C C 13 174.368 0.125 . 1 . . . . A 652 ILE C . 30162 1
245 . 1 1 23 23 ILE N N 15 117.360 0.109 . 1 . . . . A 652 ILE N . 30162 1
246 . 1 1 24 24 PRO HA H 1 4.321 0.023 . 1 . . . . A 653 PRO HA . 30162 1
247 . 1 1 24 24 PRO HB2 H 1 2.234 0.023 . 1 . . . . A 653 PRO HB2 . 30162 1
248 . 1 1 24 24 PRO HB3 H 1 2.234 0.023 . 1 . . . . A 653 PRO HB3 . 30162 1
249 . 1 1 24 24 PRO HG2 H 1 1.837 0.023 . 1 . . . . A 653 PRO HG2 . 30162 1
250 . 1 1 24 24 PRO HG3 H 1 1.837 0.023 . 1 . . . . A 653 PRO HG3 . 30162 1
251 . 1 1 24 24 PRO C C 13 176.081 0.125 . 1 . . . . A 653 PRO C . 30162 1
252 . 1 1 24 24 PRO CA C 13 63.018 0.160 . 1 . . . . A 653 PRO CA . 30162 1
253 . 1 1 24 24 PRO CB C 13 31.662 0.138 . 1 . . . . A 653 PRO CB . 30162 1
254 . 1 1 25 25 ALA H H 1 8.396 0.023 . 1 . . . . A 654 ALA H . 30162 1
255 . 1 1 25 25 ALA HA H 1 4.072 0.023 . 1 . . . . A 654 ALA HA . 30162 1
256 . 1 1 25 25 ALA HB1 H 1 1.281 0.023 . 1 . . . . A 654 ALA HB1 . 30162 1
257 . 1 1 25 25 ALA HB2 H 1 1.281 0.023 . 1 . . . . A 654 ALA HB2 . 30162 1
258 . 1 1 25 25 ALA HB3 H 1 1.281 0.023 . 1 . . . . A 654 ALA HB3 . 30162 1
259 . 1 1 25 25 ALA C C 13 177.007 0.125 . 1 . . . . A 654 ALA C . 30162 1
260 . 1 1 25 25 ALA CA C 13 53.095 0.160 . 1 . . . . A 654 ALA CA . 30162 1
261 . 1 1 25 25 ALA CB C 13 18.869 0.138 . 1 . . . . A 654 ALA CB . 30162 1
262 . 1 1 25 25 ALA N N 15 123.364 0.109 . 1 . . . . A 654 ALA N . 30162 1
263 . 1 1 26 26 GLY H H 1 8.477 0.023 . 1 . . . . A 655 GLY H . 30162 1
264 . 1 1 26 26 GLY HA2 H 1 3.790 0.023 . 1 . . . . A 655 GLY HA2 . 30162 1
265 . 1 1 26 26 GLY HA3 H 1 3.790 0.023 . 1 . . . . A 655 GLY HA3 . 30162 1
266 . 1 1 26 26 GLY C C 13 176.242 0.125 . 1 . . . . A 655 GLY C . 30162 1
267 . 1 1 26 26 GLY CA C 13 45.783 0.160 . 1 . . . . A 655 GLY CA . 30162 1
268 . 1 1 26 26 GLY N N 15 106.208 0.109 . 1 . . . . A 655 GLY N . 30162 1
269 . 1 1 27 27 ILE H H 1 7.505 0.023 . 1 . . . . A 656 ILE H . 30162 1
270 . 1 1 27 27 ILE HA H 1 4.069 0.023 . 1 . . . . A 656 ILE HA . 30162 1
271 . 1 1 27 27 ILE HB H 1 1.765 0.023 . 1 . . . . A 656 ILE HB . 30162 1
272 . 1 1 27 27 ILE HG12 H 1 1.197 0.023 . 1 . . . . A 656 ILE HG12 . 30162 1
273 . 1 1 27 27 ILE HG13 H 1 1.458 0.023 . 1 . . . . A 656 ILE HG13 . 30162 1
274 . 1 1 27 27 ILE HG21 H 1 0.823 0.023 . 1 . . . . A 656 ILE HG21 . 30162 1
275 . 1 1 27 27 ILE HG22 H 1 0.823 0.023 . 1 . . . . A 656 ILE HG22 . 30162 1
276 . 1 1 27 27 ILE HG23 H 1 0.823 0.023 . 1 . . . . A 656 ILE HG23 . 30162 1
277 . 1 1 27 27 ILE C C 13 175.091 0.125 . 1 . . . . A 656 ILE C . 30162 1
278 . 1 1 27 27 ILE CA C 13 61.743 0.160 . 1 . . . . A 656 ILE CA . 30162 1
279 . 1 1 27 27 ILE CB C 13 38.806 0.138 . 1 . . . . A 656 ILE CB . 30162 1
280 . 1 1 27 27 ILE CG1 C 13 27.412 . . 1 . . . . A 656 ILE CG1 . 30162 1
281 . 1 1 27 27 ILE CG2 C 13 17.625 . . 1 . . . . A 656 ILE CG2 . 30162 1
282 . 1 1 27 27 ILE CD1 C 13 13.365 . . 1 . . . . A 656 ILE CD1 . 30162 1
283 . 1 1 27 27 ILE N N 15 117.365 0.109 . 1 . . . . A 656 ILE N . 30162 1
284 . 1 1 28 28 GLY H H 1 8.250 0.023 . 1 . . . . A 657 GLY H . 30162 1
285 . 1 1 28 28 GLY HA2 H 1 3.830 0.023 . 1 . . . . A 657 GLY HA2 . 30162 1
286 . 1 1 28 28 GLY HA3 H 1 4.034 0.023 . 1 . . . . A 657 GLY HA3 . 30162 1
287 . 1 1 28 28 GLY C C 13 173.432 0.125 . 1 . . . . A 657 GLY C . 30162 1
288 . 1 1 28 28 GLY CA C 13 45.053 0.160 . 1 . . . . A 657 GLY CA . 30162 1
289 . 1 1 28 28 GLY N N 15 110.490 0.109 . 1 . . . . A 657 GLY N . 30162 1
290 . 1 1 29 29 VAL H H 1 8.610 0.023 . 1 . . . . A 658 VAL H . 30162 1
291 . 1 1 29 29 VAL HA H 1 3.459 0.023 . 1 . . . . A 658 VAL HA . 30162 1
292 . 1 1 29 29 VAL HB H 1 1.997 0.023 . 1 . . . . A 658 VAL HB . 30162 1
293 . 1 1 29 29 VAL HG11 H 1 0.965 0.023 . 1 . . . . A 658 VAL HG11 . 30162 1
294 . 1 1 29 29 VAL HG12 H 1 0.965 0.023 . 1 . . . . A 658 VAL HG12 . 30162 1
295 . 1 1 29 29 VAL HG13 H 1 0.965 0.023 . 1 . . . . A 658 VAL HG13 . 30162 1
296 . 1 1 29 29 VAL HG21 H 1 0.837 0.023 . 1 . . . . A 658 VAL HG21 . 30162 1
297 . 1 1 29 29 VAL HG22 H 1 0.837 0.023 . 1 . . . . A 658 VAL HG22 . 30162 1
298 . 1 1 29 29 VAL HG23 H 1 0.837 0.023 . 1 . . . . A 658 VAL HG23 . 30162 1
299 . 1 1 29 29 VAL C C 13 177.064 0.125 . 1 . . . . A 658 VAL C . 30162 1
300 . 1 1 29 29 VAL CA C 13 66.494 0.160 . 1 . . . . A 658 VAL CA . 30162 1
301 . 1 1 29 29 VAL CB C 13 31.552 0.138 . 1 . . . . A 658 VAL CB . 30162 1
302 . 1 1 29 29 VAL CG1 C 13 22.639 . . 1 . . . . A 658 VAL CG1 . 30162 1
303 . 1 1 29 29 VAL CG2 C 13 21.558 . . 1 . . . . A 658 VAL CG2 . 30162 1
304 . 1 1 29 29 VAL N N 15 119.521 0.109 . 1 . . . . A 658 VAL N . 30162 1
305 . 1 1 30 30 THR H H 1 8.314 0.023 . 1 . . . . A 659 THR H . 30162 1
306 . 1 1 30 30 THR HA H 1 4.039 0.023 . 1 . . . . A 659 THR HA . 30162 1
307 . 1 1 30 30 THR HB H 1 3.990 0.023 . 1 . . . . A 659 THR HB . 30162 1
308 . 1 1 30 30 THR HG21 H 1 1.034 0.023 . 1 . . . . A 659 THR HG21 . 30162 1
309 . 1 1 30 30 THR HG22 H 1 1.034 0.023 . 1 . . . . A 659 THR HG22 . 30162 1
310 . 1 1 30 30 THR HG23 H 1 1.034 0.023 . 1 . . . . A 659 THR HG23 . 30162 1
311 . 1 1 30 30 THR C C 13 176.476 0.125 . 1 . . . . A 659 THR C . 30162 1
312 . 1 1 30 30 THR CA C 13 67.348 0.160 . 1 . . . . A 659 THR CA . 30162 1
313 . 1 1 30 30 THR CG2 C 13 21.895 . . 1 . . . . A 659 THR CG2 . 30162 1
314 . 1 1 30 30 THR N N 15 115.155 0.109 . 1 . . . . A 659 THR N . 30162 1
315 . 1 1 31 31 GLY H H 1 7.991 0.023 . 1 . . . . A 660 GLY H . 30162 1
316 . 1 1 31 31 GLY HA2 H 1 3.529 0.023 . 1 . . . . A 660 GLY HA2 . 30162 1
317 . 1 1 31 31 GLY HA3 H 1 3.529 0.023 . 1 . . . . A 660 GLY HA3 . 30162 1
318 . 1 1 31 31 GLY C C 13 174.296 0.125 . 1 . . . . A 660 GLY C . 30162 1
319 . 1 1 31 31 GLY CA C 13 47.464 0.160 . 1 . . . . A 660 GLY CA . 30162 1
320 . 1 1 31 31 GLY N N 15 106.921 0.109 . 1 . . . . A 660 GLY N . 30162 1
321 . 1 1 32 32 VAL H H 1 7.598 0.023 . 1 . . . . A 661 VAL H . 30162 1
322 . 1 1 32 32 VAL HA H 1 3.402 0.023 . 1 . . . . A 661 VAL HA . 30162 1
323 . 1 1 32 32 VAL HB H 1 2.123 0.023 . 1 . . . . A 661 VAL HB . 30162 1
324 . 1 1 32 32 VAL HG11 H 1 0.767 0.023 . 1 . . . . A 661 VAL HG11 . 30162 1
325 . 1 1 32 32 VAL HG12 H 1 0.767 0.023 . 1 . . . . A 661 VAL HG12 . 30162 1
326 . 1 1 32 32 VAL HG13 H 1 0.767 0.023 . 1 . . . . A 661 VAL HG13 . 30162 1
327 . 1 1 32 32 VAL HG21 H 1 0.767 0.023 . 1 . . . . A 661 VAL HG21 . 30162 1
328 . 1 1 32 32 VAL HG22 H 1 0.767 0.023 . 1 . . . . A 661 VAL HG22 . 30162 1
329 . 1 1 32 32 VAL HG23 H 1 0.767 0.023 . 1 . . . . A 661 VAL HG23 . 30162 1
330 . 1 1 32 32 VAL C C 13 176.698 0.125 . 1 . . . . A 661 VAL C . 30162 1
331 . 1 1 32 32 VAL CA C 13 67.112 0.160 . 1 . . . . A 661 VAL CA . 30162 1
332 . 1 1 32 32 VAL CB C 13 31.484 0.138 . 1 . . . . A 661 VAL CB . 30162 1
333 . 1 1 32 32 VAL CG1 C 13 23.565 . . 1 . . . . A 661 VAL CG1 . 30162 1
334 . 1 1 32 32 VAL CG2 C 13 21.514 . . 1 . . . . A 661 VAL CG2 . 30162 1
335 . 1 1 32 32 VAL N N 15 119.675 0.109 . 1 . . . . A 661 VAL N . 30162 1
336 . 1 1 33 33 VAL H H 1 8.053 0.023 . 1 . . . . A 662 VAL H . 30162 1
337 . 1 1 33 33 VAL HA H 1 3.285 0.023 . 1 . . . . A 662 VAL HA . 30162 1
338 . 1 1 33 33 VAL HB H 1 2.130 0.023 . 1 . . . . A 662 VAL HB . 30162 1
339 . 1 1 33 33 VAL HG11 H 1 0.755 0.023 . 1 . . . . A 662 VAL HG11 . 30162 1
340 . 1 1 33 33 VAL HG12 H 1 0.755 0.023 . 1 . . . . A 662 VAL HG12 . 30162 1
341 . 1 1 33 33 VAL HG13 H 1 0.755 0.023 . 1 . . . . A 662 VAL HG13 . 30162 1
342 . 1 1 33 33 VAL HG21 H 1 0.755 0.023 . 1 . . . . A 662 VAL HG21 . 30162 1
343 . 1 1 33 33 VAL HG22 H 1 0.755 0.023 . 1 . . . . A 662 VAL HG22 . 30162 1
344 . 1 1 33 33 VAL HG23 H 1 0.755 0.023 . 1 . . . . A 662 VAL HG23 . 30162 1
345 . 1 1 33 33 VAL C C 13 177.277 0.125 . 1 . . . . A 662 VAL C . 30162 1
346 . 1 1 33 33 VAL CA C 13 67.393 0.160 . 1 . . . . A 662 VAL CA . 30162 1
347 . 1 1 33 33 VAL CB C 13 31.072 0.138 . 1 . . . . A 662 VAL CB . 30162 1
348 . 1 1 33 33 VAL CG1 C 13 23.490 . . 1 . . . . A 662 VAL CG1 . 30162 1
349 . 1 1 33 33 VAL CG2 C 13 21.509 . . 1 . . . . A 662 VAL CG2 . 30162 1
350 . 1 1 33 33 VAL N N 15 118.364 0.109 . 1 . . . . A 662 VAL N . 30162 1
351 . 1 1 34 34 ILE H H 1 8.000 0.023 . 1 . . . . A 663 ILE H . 30162 1
352 . 1 1 34 34 ILE HA H 1 3.410 0.023 . 1 . . . . A 663 ILE HA . 30162 1
353 . 1 1 34 34 ILE HB H 1 1.794 0.023 . 1 . . . . A 663 ILE HB . 30162 1
354 . 1 1 34 34 ILE HG21 H 1 0.723 0.023 . 1 . . . . A 663 ILE HG21 . 30162 1
355 . 1 1 34 34 ILE HG22 H 1 0.723 0.023 . 1 . . . . A 663 ILE HG22 . 30162 1
356 . 1 1 34 34 ILE HG23 H 1 0.723 0.023 . 1 . . . . A 663 ILE HG23 . 30162 1
357 . 1 1 34 34 ILE C C 13 176.539 0.125 . 1 . . . . A 663 ILE C . 30162 1
358 . 1 1 34 34 ILE CA C 13 65.383 0.160 . 1 . . . . A 663 ILE CA . 30162 1
359 . 1 1 34 34 ILE CB C 13 37.284 0.138 . 1 . . . . A 663 ILE CB . 30162 1
360 . 1 1 34 34 ILE CG1 C 13 29.449 . . 1 . . . . A 663 ILE CG1 . 30162 1
361 . 1 1 34 34 ILE CG2 C 13 17.393 . . 1 . . . . A 663 ILE CG2 . 30162 1
362 . 1 1 34 34 ILE CD1 C 13 13.189 . . 1 . . . . A 663 ILE CD1 . 30162 1
363 . 1 1 34 34 ILE N N 15 117.189 0.109 . 1 . . . . A 663 ILE N . 30162 1
364 . 1 1 35 35 ALA H H 1 8.040 0.023 . 1 . . . . A 664 ALA H . 30162 1
365 . 1 1 35 35 ALA HA H 1 3.780 0.023 . 1 . . . . A 664 ALA HA . 30162 1
366 . 1 1 35 35 ALA HB1 H 1 1.328 0.023 . 1 . . . . A 664 ALA HB1 . 30162 1
367 . 1 1 35 35 ALA HB2 H 1 1.328 0.023 . 1 . . . . A 664 ALA HB2 . 30162 1
368 . 1 1 35 35 ALA HB3 H 1 1.328 0.023 . 1 . . . . A 664 ALA HB3 . 30162 1
369 . 1 1 35 35 ALA C C 13 178.530 0.125 . 1 . . . . A 664 ALA C . 30162 1
370 . 1 1 35 35 ALA CA C 13 55.680 0.160 . 1 . . . . A 664 ALA CA . 30162 1
371 . 1 1 35 35 ALA CB C 13 17.982 0.138 . 1 . . . . A 664 ALA CB . 30162 1
372 . 1 1 35 35 ALA N N 15 120.591 0.109 . 1 . . . . A 664 ALA N . 30162 1
373 . 1 1 36 36 VAL H H 1 8.169 0.023 . 1 . . . . A 665 VAL H . 30162 1
374 . 1 1 36 36 VAL HA H 1 3.401 0.023 . 1 . . . . A 665 VAL HA . 30162 1
375 . 1 1 36 36 VAL HB H 1 2.094 0.023 . 1 . . . . A 665 VAL HB . 30162 1
376 . 1 1 36 36 VAL HG11 H 1 0.878 0.023 . 1 . . . . A 665 VAL HG11 . 30162 1
377 . 1 1 36 36 VAL HG12 H 1 0.878 0.023 . 1 . . . . A 665 VAL HG12 . 30162 1
378 . 1 1 36 36 VAL HG13 H 1 0.878 0.023 . 1 . . . . A 665 VAL HG13 . 30162 1
379 . 1 1 36 36 VAL HG21 H 1 0.730 0.023 . 1 . . . . A 665 VAL HG21 . 30162 1
380 . 1 1 36 36 VAL HG22 H 1 0.730 0.023 . 1 . . . . A 665 VAL HG22 . 30162 1
381 . 1 1 36 36 VAL HG23 H 1 0.730 0.023 . 1 . . . . A 665 VAL HG23 . 30162 1
382 . 1 1 36 36 VAL C C 13 177.362 0.125 . 1 . . . . A 665 VAL C . 30162 1
383 . 1 1 36 36 VAL CA C 13 67.157 0.160 . 1 . . . . A 665 VAL CA . 30162 1
384 . 1 1 36 36 VAL CB C 13 31.385 0.138 . 1 . . . . A 665 VAL CB . 30162 1
385 . 1 1 36 36 VAL CG1 C 13 23.378 . . 1 . . . . A 665 VAL CG1 . 30162 1
386 . 1 1 36 36 VAL CG2 C 13 21.792 . . 1 . . . . A 665 VAL CG2 . 30162 1
387 . 1 1 36 36 VAL N N 15 116.031 0.109 . 1 . . . . A 665 VAL N . 30162 1
388 . 1 1 37 37 ILE H H 1 8.049 0.023 . 1 . . . . A 666 ILE H . 30162 1
389 . 1 1 37 37 ILE HA H 1 3.455 0.023 . 1 . . . . A 666 ILE HA . 30162 1
390 . 1 1 37 37 ILE HB H 1 1.835 0.023 . 1 . . . . A 666 ILE HB . 30162 1
391 . 1 1 37 37 ILE HG21 H 1 0.727 0.023 . 1 . . . . A 666 ILE HG21 . 30162 1
392 . 1 1 37 37 ILE HG22 H 1 0.727 0.023 . 1 . . . . A 666 ILE HG22 . 30162 1
393 . 1 1 37 37 ILE HG23 H 1 0.727 0.023 . 1 . . . . A 666 ILE HG23 . 30162 1
394 . 1 1 37 37 ILE C C 13 177.372 0.125 . 1 . . . . A 666 ILE C . 30162 1
395 . 1 1 37 37 ILE CA C 13 65.903 0.160 . 1 . . . . A 666 ILE CA . 30162 1
396 . 1 1 37 37 ILE CB C 13 37.699 0.138 . 1 . . . . A 666 ILE CB . 30162 1
397 . 1 1 37 37 ILE CG1 C 13 28.910 . . 1 . . . . A 666 ILE CG1 . 30162 1
398 . 1 1 37 37 ILE CG2 C 13 16.947 . . 1 . . . . A 666 ILE CG2 . 30162 1
399 . 1 1 37 37 ILE CD1 C 13 13.101 . . 1 . . . . A 666 ILE CD1 . 30162 1
400 . 1 1 37 37 ILE N N 15 118.813 0.109 . 1 . . . . A 666 ILE N . 30162 1
401 . 1 1 38 38 ALA H H 1 8.563 0.023 . 1 . . . . A 667 ALA H . 30162 1
402 . 1 1 38 38 ALA HA H 1 3.803 0.023 . 1 . . . . A 667 ALA HA . 30162 1
403 . 1 1 38 38 ALA HB1 H 1 1.296 0.023 . 1 . . . . A 667 ALA HB1 . 30162 1
404 . 1 1 38 38 ALA HB2 H 1 1.296 0.023 . 1 . . . . A 667 ALA HB2 . 30162 1
405 . 1 1 38 38 ALA HB3 H 1 1.296 0.023 . 1 . . . . A 667 ALA HB3 . 30162 1
406 . 1 1 38 38 ALA C C 13 178.923 0.125 . 1 . . . . A 667 ALA C . 30162 1
407 . 1 1 38 38 ALA CA C 13 55.748 0.160 . 1 . . . . A 667 ALA CA . 30162 1
408 . 1 1 38 38 ALA CB C 13 17.794 0.138 . 1 . . . . A 667 ALA CB . 30162 1
409 . 1 1 38 38 ALA N N 15 120.622 0.109 . 1 . . . . A 667 ALA N . 30162 1
410 . 1 1 39 39 LEU H H 1 8.321 0.023 . 1 . . . . A 668 LEU H . 30162 1
411 . 1 1 39 39 LEU HA H 1 3.837 0.023 . 1 . . . . A 668 LEU HA . 30162 1
412 . 1 1 39 39 LEU HB2 H 1 1.767 0.023 . 1 . . . . A 668 LEU HB2 . 30162 1
413 . 1 1 39 39 LEU HB3 H 1 1.834 0.023 . 1 . . . . A 668 LEU HB3 . 30162 1
414 . 1 1 39 39 LEU HG H 1 1.311 0.023 . 1 . . . . A 668 LEU HG . 30162 1
415 . 1 1 39 39 LEU HD11 H 1 0.678 0.023 . 1 . . . . A 668 LEU HD11 . 30162 1
416 . 1 1 39 39 LEU HD12 H 1 0.678 0.023 . 1 . . . . A 668 LEU HD12 . 30162 1
417 . 1 1 39 39 LEU HD13 H 1 0.678 0.023 . 1 . . . . A 668 LEU HD13 . 30162 1
418 . 1 1 39 39 LEU HD21 H 1 0.678 0.023 . 1 . . . . A 668 LEU HD21 . 30162 1
419 . 1 1 39 39 LEU HD22 H 1 0.678 0.023 . 1 . . . . A 668 LEU HD22 . 30162 1
420 . 1 1 39 39 LEU HD23 H 1 0.678 0.023 . 1 . . . . A 668 LEU HD23 . 30162 1
421 . 1 1 39 39 LEU C C 13 178.480 0.125 . 1 . . . . A 668 LEU C . 30162 1
422 . 1 1 39 39 LEU CA C 13 58.297 0.160 . 1 . . . . A 668 LEU CA . 30162 1
423 . 1 1 39 39 LEU CB C 13 41.565 0.138 . 1 . . . . A 668 LEU CB . 30162 1
424 . 1 1 39 39 LEU CG C 13 26.696 . . 1 . . . . A 668 LEU CG . 30162 1
425 . 1 1 39 39 LEU CD1 C 13 24.810 . . 1 . . . . A 668 LEU CD1 . 30162 1
426 . 1 1 39 39 LEU N N 15 116.931 0.109 . 1 . . . . A 668 LEU N . 30162 1
427 . 1 1 40 40 PHE H H 1 8.317 0.023 . 1 . . . . A 669 PHE H . 30162 1
428 . 1 1 40 40 PHE HA H 1 3.965 0.023 . 1 . . . . A 669 PHE HA . 30162 1
429 . 1 1 40 40 PHE HB2 H 1 3.059 0.023 . 1 . . . . A 669 PHE HB2 . 30162 1
430 . 1 1 40 40 PHE HB3 H 1 3.059 0.023 . 1 . . . . A 669 PHE HB3 . 30162 1
431 . 1 1 40 40 PHE HD1 H 1 7.152 0.023 . 1 . . . . A 669 PHE HD1 . 30162 1
432 . 1 1 40 40 PHE C C 13 176.820 0.125 . 1 . . . . A 669 PHE C . 30162 1
433 . 1 1 40 40 PHE CA C 13 61.630 0.160 . 1 . . . . A 669 PHE CA . 30162 1
434 . 1 1 40 40 PHE CB C 13 38.945 0.138 . 1 . . . . A 669 PHE CB . 30162 1
435 . 1 1 40 40 PHE CD1 C 13 131.905 . . 1 . . . . A 669 PHE CD1 . 30162 1
436 . 1 1 40 40 PHE N N 15 118.496 0.109 . 1 . . . . A 669 PHE N . 30162 1
437 . 1 1 41 41 ALA H H 1 8.546 0.023 . 1 . . . . A 670 ALA H . 30162 1
438 . 1 1 41 41 ALA HA H 1 3.792 0.023 . 1 . . . . A 670 ALA HA . 30162 1
439 . 1 1 41 41 ALA HB1 H 1 1.431 0.023 . 1 . . . . A 670 ALA HB1 . 30162 1
440 . 1 1 41 41 ALA HB2 H 1 1.431 0.023 . 1 . . . . A 670 ALA HB2 . 30162 1
441 . 1 1 41 41 ALA HB3 H 1 1.431 0.023 . 1 . . . . A 670 ALA HB3 . 30162 1
442 . 1 1 41 41 ALA C C 13 179.261 0.125 . 1 . . . . A 670 ALA C . 30162 1
443 . 1 1 41 41 ALA CA C 13 55.624 0.160 . 1 . . . . A 670 ALA CA . 30162 1
444 . 1 1 41 41 ALA CB C 13 18.217 0.138 . 1 . . . . A 670 ALA CB . 30162 1
445 . 1 1 41 41 ALA N N 15 120.299 0.109 . 1 . . . . A 670 ALA N . 30162 1
446 . 1 1 42 42 ILE H H 1 8.475 0.023 . 1 . . . . A 671 ILE H . 30162 1
447 . 1 1 42 42 ILE HA H 1 3.504 0.023 . 1 . . . . A 671 ILE HA . 30162 1
448 . 1 1 42 42 ILE HB H 1 1.877 0.023 . 1 . . . . A 671 ILE HB . 30162 1
449 . 1 1 42 42 ILE HG21 H 1 0.742 0.023 . 1 . . . . A 671 ILE HG21 . 30162 1
450 . 1 1 42 42 ILE HG22 H 1 0.742 0.023 . 1 . . . . A 671 ILE HG22 . 30162 1
451 . 1 1 42 42 ILE HG23 H 1 0.742 0.023 . 1 . . . . A 671 ILE HG23 . 30162 1
452 . 1 1 42 42 ILE C C 13 177.917 0.125 . 1 . . . . A 671 ILE C . 30162 1
453 . 1 1 42 42 ILE CA C 13 65.549 0.160 . 1 . . . . A 671 ILE CA . 30162 1
454 . 1 1 42 42 ILE CB C 13 38.275 0.138 . 1 . . . . A 671 ILE CB . 30162 1
455 . 1 1 42 42 ILE CG1 C 13 30.035 . . 1 . . . . A 671 ILE CG1 . 30162 1
456 . 1 1 42 42 ILE CG2 C 13 17.844 . . 1 . . . . A 671 ILE CG2 . 30162 1
457 . 1 1 42 42 ILE CD1 C 13 13.420 . . 1 . . . . A 671 ILE CD1 . 30162 1
458 . 1 1 42 42 ILE N N 15 117.113 0.109 . 1 . . . . A 671 ILE N . 30162 1
459 . 1 1 43 43 ALA H H 1 8.319 0.023 . 1 . . . . A 672 ALA H . 30162 1
460 . 1 1 43 43 ALA HA H 1 3.806 0.023 . 1 . . . . A 672 ALA HA . 30162 1
461 . 1 1 43 43 ALA HB1 H 1 1.325 0.023 . 1 . . . . A 672 ALA HB1 . 30162 1
462 . 1 1 43 43 ALA HB2 H 1 1.325 0.023 . 1 . . . . A 672 ALA HB2 . 30162 1
463 . 1 1 43 43 ALA HB3 H 1 1.325 0.023 . 1 . . . . A 672 ALA HB3 . 30162 1
464 . 1 1 43 43 ALA C C 13 178.417 0.125 . 1 . . . . A 672 ALA C . 30162 1
465 . 1 1 43 43 ALA CA C 13 55.460 0.160 . 1 . . . . A 672 ALA CA . 30162 1
466 . 1 1 43 43 ALA CB C 13 18.331 0.138 . 1 . . . . A 672 ALA CB . 30162 1
467 . 1 1 43 43 ALA N N 15 121.366 0.109 . 1 . . . . A 672 ALA N . 30162 1
468 . 1 1 44 44 LYS H H 1 7.837 0.023 . 1 . . . . A 673 LYS H . 30162 1
469 . 1 1 44 44 LYS HA H 1 3.853 0.023 . 1 . . . . A 673 LYS HA . 30162 1
470 . 1 1 44 44 LYS HB2 H 1 1.236 0.023 . 1 . . . . A 673 LYS HB2 . 30162 1
471 . 1 1 44 44 LYS HB3 H 1 1.390 0.023 . 1 . . . . A 673 LYS HB3 . 30162 1
472 . 1 1 44 44 LYS HG2 H 1 0.765 0.023 . 1 . . . . A 673 LYS HG2 . 30162 1
473 . 1 1 44 44 LYS HG3 H 1 0.888 0.023 . 1 . . . . A 673 LYS HG3 . 30162 1
474 . 1 1 44 44 LYS HD2 H 1 1.293 0.023 . 1 . . . . A 673 LYS HD2 . 30162 1
475 . 1 1 44 44 LYS HD3 H 1 1.293 0.023 . 1 . . . . A 673 LYS HD3 . 30162 1
476 . 1 1 44 44 LYS C C 13 177.553 0.125 . 1 . . . . A 673 LYS C . 30162 1
477 . 1 1 44 44 LYS CA C 13 56.925 0.160 . 1 . . . . A 673 LYS CA . 30162 1
478 . 1 1 44 44 LYS CB C 13 31.908 0.138 . 1 . . . . A 673 LYS CB . 30162 1
479 . 1 1 44 44 LYS CG C 13 24.299 . . 1 . . . . A 673 LYS CG . 30162 1
480 . 1 1 44 44 LYS CD C 13 28.258 . . 1 . . . . A 673 LYS CD . 30162 1
481 . 1 1 44 44 LYS N N 15 113.541 0.109 . 1 . . . . A 673 LYS N . 30162 1
482 . 1 1 45 45 PHE H H 1 8.017 0.023 . 1 . . . . A 674 PHE H . 30162 1
483 . 1 1 45 45 PHE HA H 1 4.472 0.023 . 1 . . . . A 674 PHE HA . 30162 1
484 . 1 1 45 45 PHE HB2 H 1 2.888 0.023 . 1 . . . . A 674 PHE HB2 . 30162 1
485 . 1 1 45 45 PHE HB3 H 1 3.075 0.023 . 1 . . . . A 674 PHE HB3 . 30162 1
486 . 1 1 45 45 PHE HD1 H 1 7.313 0.023 . 1 . . . . A 674 PHE HD1 . 30162 1
487 . 1 1 45 45 PHE HD2 H 1 7.048 0.023 . 1 . . . . A 674 PHE HD2 . 30162 1
488 . 1 1 45 45 PHE HE1 H 1 7.140 0.023 . 1 . . . . A 674 PHE HE1 . 30162 1
489 . 1 1 45 45 PHE HZ H 1 6.928 0.023 . 1 . . . . A 674 PHE HZ . 30162 1
490 . 1 1 45 45 PHE C C 13 176.197 0.125 . 1 . . . . A 674 PHE C . 30162 1
491 . 1 1 45 45 PHE CA C 13 59.660 0.160 . 1 . . . . A 674 PHE CA . 30162 1
492 . 1 1 45 45 PHE CB C 13 40.652 0.138 . 1 . . . . A 674 PHE CB . 30162 1
493 . 1 1 45 45 PHE CD1 C 13 132.018 . . 1 . . . . A 674 PHE CD1 . 30162 1
494 . 1 1 45 45 PHE CD2 C 13 130.881 . . 1 . . . . A 674 PHE CD2 . 30162 1
495 . 1 1 45 45 PHE N N 15 114.585 0.109 . 1 . . . . A 674 PHE N . 30162 1
496 . 1 1 46 46 VAL H H 1 7.904 0.023 . 1 . . . . A 675 VAL H . 30162 1
497 . 1 1 46 46 VAL HA H 1 3.846 0.023 . 1 . . . . A 675 VAL HA . 30162 1
498 . 1 1 46 46 VAL HB H 1 1.956 0.023 . 1 . . . . A 675 VAL HB . 30162 1
499 . 1 1 46 46 VAL HG11 H 1 0.727 0.023 . 1 . . . . A 675 VAL HG11 . 30162 1
500 . 1 1 46 46 VAL HG12 H 1 0.727 0.023 . 1 . . . . A 675 VAL HG12 . 30162 1
501 . 1 1 46 46 VAL HG13 H 1 0.727 0.023 . 1 . . . . A 675 VAL HG13 . 30162 1
502 . 1 1 46 46 VAL HG21 H 1 0.424 0.023 . 1 . . . . A 675 VAL HG21 . 30162 1
503 . 1 1 46 46 VAL HG22 H 1 0.424 0.023 . 1 . . . . A 675 VAL HG22 . 30162 1
504 . 1 1 46 46 VAL HG23 H 1 0.424 0.023 . 1 . . . . A 675 VAL HG23 . 30162 1
505 . 1 1 46 46 VAL C C 13 174.797 0.125 . 1 . . . . A 675 VAL C . 30162 1
506 . 1 1 46 46 VAL CA C 13 63.900 0.160 . 1 . . . . A 675 VAL CA . 30162 1
507 . 1 1 46 46 VAL CB C 13 32.676 0.138 . 1 . . . . A 675 VAL CB . 30162 1
508 . 1 1 46 46 VAL CG1 C 13 21.862 . . 1 . . . . A 675 VAL CG1 . 30162 1
509 . 1 1 46 46 VAL N N 15 115.704 0.109 . 1 . . . . A 675 VAL N . 30162 1
510 . 1 1 47 47 PHE H H 1 7.345 0.023 . 1 . . . . A 676 PHE H . 30162 1
511 . 1 1 47 47 PHE HA H 1 4.310 0.023 . 1 . . . . A 676 PHE HA . 30162 1
512 . 1 1 47 47 PHE HB2 H 1 2.884 0.023 . 1 . . . . A 676 PHE HB2 . 30162 1
513 . 1 1 47 47 PHE HB3 H 1 3.148 0.023 . 1 . . . . A 676 PHE HB3 . 30162 1
514 . 1 1 47 47 PHE HD1 H 1 7.243 0.023 . 1 . . . . A 676 PHE HD1 . 30162 1
515 . 1 1 47 47 PHE HE1 H 1 7.059 0.023 . 1 . . . . A 676 PHE HE1 . 30162 1
516 . 1 1 47 47 PHE C C 13 178.780 0.125 . 1 . . . . A 676 PHE C . 30162 1
517 . 1 1 47 47 PHE CA C 13 58.993 0.160 . 1 . . . . A 676 PHE CA . 30162 1
518 . 1 1 47 47 PHE CB C 13 40.426 0.138 . 1 . . . . A 676 PHE CB . 30162 1
519 . 1 1 47 47 PHE CD1 C 13 131.990 . . 1 . . . . A 676 PHE CD1 . 30162 1
520 . 1 1 47 47 PHE N N 15 121.992 0.109 . 1 . . . . A 676 PHE N . 30162 1
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