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 52031
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assigned_chemical_shifts
_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 '3D HNCO' . . . 52031 1
2 '3D HNCACB' . . . 52031 1
3 '3D HN(CA)CO' . . . 52031 1
4 '2D 1H-15N TROSY' . . . 52031 1
5 '3D C(CO)NH' . . . 52031 1
6 '3D HN(CO)CACB' . . . 52031 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 52031 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 MET H H 1 8.291 0.02 . 1 . . . . . 533 MET H . 52031 1
2 . 1 . 1 1 1 MET C C 13 176.432 0.3 . 1 . . . . . 533 MET C . 52031 1
3 . 1 . 1 1 1 MET CA C 13 55.339 0.3 . 1 . . . . . 533 MET CA . 52031 1
4 . 1 . 1 1 1 MET N N 15 120.167 0.3 . 1 . . . . . 533 MET N . 52031 1
5 . 1 . 1 2 2 MET H H 1 8.351 0.02 . 1 . . . . . 534 MET H . 52031 1
6 . 1 . 1 2 2 MET C C 13 176.075 0.3 . 1 . . . . . 534 MET C . 52031 1
7 . 1 . 1 2 2 MET CA C 13 55.335 0.3 . 1 . . . . . 534 MET CA . 52031 1
8 . 1 . 1 2 2 MET N N 15 122.218 0.3 . 1 . . . . . 534 MET N . 52031 1
9 . 1 . 1 3 3 SER H H 1 8.108 0.02 . 1 . . . . . 535 SER H . 52031 1
10 . 1 . 1 3 3 SER C C 13 173.523 0.3 . 1 . . . . . 535 SER C . 52031 1
11 . 1 . 1 3 3 SER CA C 13 57.962 0.3 . 1 . . . . . 535 SER CA . 52031 1
12 . 1 . 1 3 3 SER N N 15 117.479 0.3 . 1 . . . . . 535 SER N . 52031 1
13 . 1 . 1 4 4 ALA H H 1 8.206 0.02 . 1 . . . . . 536 ALA H . 52031 1
14 . 1 . 1 4 4 ALA C C 13 175.538 0.3 . 1 . . . . . 536 ALA C . 52031 1
15 . 1 . 1 4 4 ALA CA C 13 50.396 0.3 . 1 . . . . . 536 ALA CA . 52031 1
16 . 1 . 1 4 4 ALA N N 15 127.024 0.3 . 1 . . . . . 536 ALA N . 52031 1
17 . 1 . 1 6 6 GLY H H 1 8.373 0.02 . 1 . . . . . 538 GLY H . 52031 1
18 . 1 . 1 6 6 GLY C C 13 174.265 0.3 . 1 . . . . . 538 GLY C . 52031 1
19 . 1 . 1 6 6 GLY CA C 13 44.908 0.3 . 1 . . . . . 538 GLY CA . 52031 1
20 . 1 . 1 6 6 GLY N N 15 109.679 0.3 . 1 . . . . . 538 GLY N . 52031 1
21 . 1 . 1 7 7 SER H H 1 7.94 0.02 . 1 . . . . . 539 SER H . 52031 1
22 . 1 . 1 7 7 SER C C 13 174.816 0.3 . 1 . . . . . 539 SER C . 52031 1
23 . 1 . 1 7 7 SER CA C 13 58.474 0.3 . 1 . . . . . 539 SER CA . 52031 1
24 . 1 . 1 7 7 SER N N 15 115.526 0.3 . 1 . . . . . 539 SER N . 52031 1
25 . 1 . 1 8 8 LYS H H 1 8.289 0.02 . 1 . . . . . 540 LYS H . 52031 1
26 . 1 . 1 8 8 LYS C C 13 176.781 0.3 . 1 . . . . . 540 LYS C . 52031 1
27 . 1 . 1 8 8 LYS CA C 13 56.171 0.3 . 1 . . . . . 540 LYS CA . 52031 1
28 . 1 . 1 8 8 LYS N N 15 123.194 0.3 . 1 . . . . . 540 LYS N . 52031 1
29 . 1 . 1 9 9 SER H H 1 8.119 0.02 . 1 . . . . . 541 SER H . 52031 1
30 . 1 . 1 9 9 SER C C 13 174.361 0.3 . 1 . . . . . 541 SER C . 52031 1
31 . 1 . 1 9 9 SER CA C 13 58.282 0.3 . 1 . . . . . 541 SER CA . 52031 1
32 . 1 . 1 9 9 SER N N 15 116.536 0.3 . 1 . . . . . 541 SER N . 52031 1
33 . 1 . 1 10 10 ASN H H 1 8.272 0.02 . 1 . . . . . 542 ASN H . 52031 1
34 . 1 . 1 10 10 ASN C C 13 175.283 0.3 . 1 . . . . . 542 ASN C . 52031 1
35 . 1 . 1 10 10 ASN CA C 13 53.035 0.3 . 1 . . . . . 542 ASN CA . 52031 1
36 . 1 . 1 10 10 ASN N N 15 120.951 0.3 . 1 . . . . . 542 ASN N . 52031 1
37 . 1 . 1 13 13 LYS H H 1 8.159 0.02 . 1 . . . . . 545 LYS H . 52031 1
38 . 1 . 1 13 13 LYS C C 13 177.145 0.3 . 1 . . . . . 545 LYS C . 52031 1
39 . 1 . 1 13 13 LYS CA C 13 56.231 0.3 . 1 . . . . . 545 LYS CA . 52031 1
40 . 1 . 1 13 13 LYS N N 15 122.807 0.3 . 1 . . . . . 545 LYS N . 52031 1
41 . 1 . 1 14 14 GLY H H 1 8.291 0.02 . 1 . . . . . 546 GLY H . 52031 1
42 . 1 . 1 14 14 GLY C C 13 174.63 0.3 . 1 . . . . . 546 GLY C . 52031 1
43 . 1 . 1 14 14 GLY CA C 13 45.036 0.3 . 1 . . . . . 546 GLY CA . 52031 1
44 . 1 . 1 14 14 GLY N N 15 110.54 0.3 . 1 . . . . . 546 GLY N . 52031 1
45 . 1 . 1 18 18 LYS H H 1 8.069 0.02 . 1 . . . . . 550 LYS H . 52031 1
46 . 1 . 1 18 18 LYS C C 13 176.432 0.3 . 1 . . . . . 550 LYS C . 52031 1
47 . 1 . 1 18 18 LYS CA C 13 56.171 0.3 . 1 . . . . . 550 LYS CA . 52031 1
48 . 1 . 1 18 18 LYS N N 15 120.588 0.3 . 1 . . . . . 550 LYS N . 52031 1
49 . 1 . 1 19 19 ASN H H 1 8.324 0.02 . 1 . . . . . 551 ASN H . 52031 1
50 . 1 . 1 19 19 ASN C C 13 174.803 0.3 . 1 . . . . . 551 ASN C . 52031 1
51 . 1 . 1 19 19 ASN CA C 13 52.971 0.3 . 1 . . . . . 551 ASN CA . 52031 1
52 . 1 . 1 19 19 ASN N N 15 119.273 0.3 . 1 . . . . . 551 ASN N . 52031 1
53 . 1 . 1 20 20 ASN H H 1 8.196 0.02 . 1 . . . . . 552 ASN H . 52031 1
54 . 1 . 1 20 20 ASN C C 13 174.905 0.3 . 1 . . . . . 552 ASN C . 52031 1
55 . 1 . 1 20 20 ASN CA C 13 52.967 0.3 . 1 . . . . . 552 ASN CA . 52031 1
56 . 1 . 1 20 20 ASN N N 15 119.273 0.3 . 1 . . . . . 552 ASN N . 52031 1
57 . 1 . 1 21 21 ASN H H 1 8.214 0.02 . 1 . . . . . 553 ASN H . 52031 1
58 . 1 . 1 21 21 ASN C C 13 175.545 0.3 . 1 . . . . . 553 ASN C . 52031 1
59 . 1 . 1 21 21 ASN CA C 13 53.291 0.3 . 1 . . . . . 553 ASN CA . 52031 1
60 . 1 . 1 21 21 ASN N N 15 118.987 0.3 . 1 . . . . . 553 ASN N . 52031 1
61 . 1 . 1 22 22 LYS H H 1 8.177 0.02 . 1 . . . . . 554 LYS H . 52031 1
62 . 1 . 1 22 22 LYS C C 13 176.512 0.3 . 1 . . . . . 554 LYS C . 52031 1
63 . 1 . 1 22 22 LYS CA C 13 56.555 0.3 . 1 . . . . . 554 LYS CA . 52031 1
64 . 1 . 1 22 22 LYS N N 15 121.701 0.3 . 1 . . . . . 554 LYS N . 52031 1
65 . 1 . 1 23 23 ASP H H 1 8.088 0.02 . 1 . . . . . 555 ASP H . 52031 1
66 . 1 . 1 23 23 ASP C C 13 176.706 0.3 . 1 . . . . . 555 ASP C . 52031 1
67 . 1 . 1 23 23 ASP CA C 13 54.315 0.3 . 1 . . . . . 555 ASP CA . 52031 1
68 . 1 . 1 23 23 ASP N N 15 120.225 0.3 . 1 . . . . . 555 ASP N . 52031 1
69 . 1 . 1 24 24 GLY H H 1 8.056 0.02 . 1 . . . . . 556 GLY H . 52031 1
70 . 1 . 1 24 24 GLY C C 13 174.208 0.3 . 1 . . . . . 556 GLY C . 52031 1
71 . 1 . 1 24 24 GLY CA C 13 45.292 0.3 . 1 . . . . . 556 GLY CA . 52031 1
72 . 1 . 1 24 24 GLY N N 15 109.063 0.3 . 1 . . . . . 556 GLY N . 52031 1
73 . 1 . 1 25 25 LYS H H 1 7.928 0.02 . 1 . . . . . 557 LYS H . 52031 1
74 . 1 . 1 25 25 LYS C C 13 176.717 0.3 . 1 . . . . . 557 LYS C . 52031 1
75 . 1 . 1 25 25 LYS CA C 13 56.171 0.3 . 1 . . . . . 557 LYS CA . 52031 1
76 . 1 . 1 25 25 LYS N N 15 120.696 0.3 . 1 . . . . . 557 LYS N . 52031 1
77 . 1 . 1 26 26 LYS H H 1 8.147 0.02 . 1 . . . . . 558 LYS H . 52031 1
78 . 1 . 1 26 26 LYS C C 13 176.339 0.3 . 1 . . . . . 558 LYS C . 52031 1
79 . 1 . 1 26 26 LYS CA C 13 56.171 0.3 . 1 . . . . . 558 LYS CA . 52031 1
80 . 1 . 1 26 26 LYS N N 15 122.804 0.3 . 1 . . . . . 558 LYS N . 52031 1
81 . 1 . 1 27 27 ALA H H 1 8.221 0.02 . 1 . . . . . 559 ALA H . 52031 1
82 . 1 . 1 27 27 ALA C C 13 178.176 0.3 . 1 . . . . . 559 ALA C . 52031 1
83 . 1 . 1 27 27 ALA CA C 13 52.331 0.3 . 1 . . . . . 559 ALA CA . 52031 1
84 . 1 . 1 27 27 ALA N N 15 125.871 0.3 . 1 . . . . . 559 ALA N . 52031 1
85 . 1 . 1 28 28 GLY H H 1 8.243 0.02 . 1 . . . . . 560 GLY H . 52031 1
86 . 1 . 1 28 28 GLY C C 13 174.624 0.3 . 1 . . . . . 560 GLY C . 52031 1
87 . 1 . 1 28 28 GLY CA C 13 45.036 0.3 . 1 . . . . . 560 GLY CA . 52031 1
88 . 1 . 1 28 28 GLY N N 15 108.622 0.3 . 1 . . . . . 560 GLY N . 52031 1
89 . 1 . 1 29 29 GLY H H 1 8.079 0.02 . 1 . . . . . 561 GLY H . 52031 1
90 . 1 . 1 29 29 GLY CA C 13 45.096 0.3 . 1 . . . . . 561 GLY CA . 52031 1
91 . 1 . 1 29 29 GLY N N 15 108.562 0.3 . 1 . . . . . 561 GLY N . 52031 1
92 . 1 . 1 30 30 ALA H H 1 8.113 0.02 . 1 . . . . . 562 ALA H . 52031 1
93 . 1 . 1 30 30 ALA C C 13 178.064 0.3 . 1 . . . . . 562 ALA C . 52031 1
94 . 1 . 1 30 30 ALA CA C 13 52.331 0.3 . 1 . . . . . 562 ALA CA . 52031 1
95 . 1 . 1 30 30 ALA N N 15 123.742 0.3 . 1 . . . . . 562 ALA N . 52031 1
96 . 1 . 1 31 31 SER H H 1 8.165 0.02 . 1 . . . . . 563 SER H . 52031 1
97 . 1 . 1 31 31 SER C C 13 174.445 0.3 . 1 . . . . . 563 SER C . 52031 1
98 . 1 . 1 31 31 SER CA C 13 58.154 0.3 . 1 . . . . . 563 SER CA . 52031 1
99 . 1 . 1 31 31 SER N N 15 115.156 0.3 . 1 . . . . . 563 SER N . 52031 1
100 . 1 . 1 32 32 ALA H H 1 8.163 0.02 . 1 . . . . . 564 ALA H . 52031 1
101 . 1 . 1 32 32 ALA C C 13 178.221 0.3 . 1 . . . . . 564 ALA C . 52031 1
102 . 1 . 1 32 32 ALA CA C 13 52.523 0.3 . 1 . . . . . 564 ALA CA . 52031 1
103 . 1 . 1 32 32 ALA N N 15 126.029 0.3 . 1 . . . . . 564 ALA N . 52031 1
104 . 1 . 1 33 33 GLY H H 1 8.181 0.02 . 1 . . . . . 565 GLY H . 52031 1
105 . 1 . 1 33 33 GLY C C 13 174.771 0.3 . 1 . . . . . 565 GLY C . 52031 1
106 . 1 . 1 33 33 GLY CA C 13 45.036 0.3 . 1 . . . . . 565 GLY CA . 52031 1
107 . 1 . 1 33 33 GLY N N 15 108.034 0.3 . 1 . . . . . 565 GLY N . 52031 1
108 . 1 . 1 38 38 SER H H 1 8.234 0.02 . 1 . . . . . 570 SER H . 52031 1
109 . 1 . 1 38 38 SER CA C 13 58.41 0.3 . 1 . . . . . 570 SER CA . 52031 1
110 . 1 . 1 38 38 SER N N 15 117.966 0.3 . 1 . . . . . 570 SER N . 52031 1
111 . 1 . 1 39 39 LYS H H 1 8.144 0.02 . 1 . . . . . 571 LYS H . 52031 1
112 . 1 . 1 39 39 LYS C C 13 176.665 0.3 . 1 . . . . . 571 LYS C . 52031 1
113 . 1 . 1 39 39 LYS CA C 13 56.107 0.3 . 1 . . . . . 571 LYS CA . 52031 1
114 . 1 . 1 39 39 LYS N N 15 123.163 0.3 . 1 . . . . . 571 LYS N . 52031 1
115 . 1 . 1 40 40 SER H H 1 8.098 0.02 . 1 . . . . . 572 SER H . 52031 1
116 . 1 . 1 40 40 SER C C 13 174.64 0.3 . 1 . . . . . 572 SER C . 52031 1
117 . 1 . 1 40 40 SER CA C 13 58.282 0.3 . 1 . . . . . 572 SER CA . 52031 1
118 . 1 . 1 40 40 SER N N 15 117.077 0.3 . 1 . . . . . 572 SER N . 52031 1
119 . 1 . 1 41 41 LYS H H 1 8.211 0.02 . 1 . . . . . 573 LYS H . 52031 1
120 . 1 . 1 41 41 LYS C C 13 176.211 0.3 . 1 . . . . . 573 LYS C . 52031 1
121 . 1 . 1 41 41 LYS CA C 13 56.299 0.3 . 1 . . . . . 573 LYS CA . 52031 1
122 . 1 . 1 41 41 LYS N N 15 123.277 0.3 . 1 . . . . . 573 LYS N . 52031 1
123 . 1 . 1 42 42 ASP H H 1 8.089 0.02 . 1 . . . . . 574 ASP H . 52031 1
124 . 1 . 1 42 42 ASP C C 13 175.998 0.3 . 1 . . . . . 574 ASP C . 52031 1
125 . 1 . 1 42 42 ASP CA C 13 53.995 0.3 . 1 . . . . . 574 ASP CA . 52031 1
126 . 1 . 1 42 42 ASP N N 15 120.943 0.3 . 1 . . . . . 574 ASP N . 52031 1
127 . 1 . 1 43 43 ASN H H 1 8.267 0.02 . 1 . . . . . 575 ASN H . 52031 1
128 . 1 . 1 43 43 ASN C C 13 175.622 0.3 . 1 . . . . . 575 ASN C . 52031 1
129 . 1 . 1 43 43 ASN CA C 13 52.907 0.3 . 1 . . . . . 575 ASN CA . 52031 1
130 . 1 . 1 43 43 ASN N N 15 120.456 0.3 . 1 . . . . . 575 ASN N . 52031 1
131 . 1 . 1 44 44 SER H H 1 8.184 0.02 . 1 . . . . . 576 SER H . 52031 1
132 . 1 . 1 44 44 SER C C 13 175.245 0.3 . 1 . . . . . 576 SER C . 52031 1
133 . 1 . 1 44 44 SER CA C 13 59.242 0.3 . 1 . . . . . 576 SER CA . 52031 1
134 . 1 . 1 44 44 SER N N 15 116.124 0.3 . 1 . . . . . 576 SER N . 52031 1
135 . 1 . 1 45 45 GLY H H 1 8.257 0.02 . 1 . . . . . 577 GLY H . 52031 1
136 . 1 . 1 45 45 GLY C C 13 174.336 0.3 . 1 . . . . . 577 GLY C . 52031 1
137 . 1 . 1 45 45 GLY CA C 13 45.1 0.3 . 1 . . . . . 577 GLY CA . 52031 1
138 . 1 . 1 45 45 GLY N N 15 110.613 0.3 . 1 . . . . . 577 GLY N . 52031 1
139 . 1 . 1 46 46 LYS H H 1 7.939 0.02 . 1 . . . . . 578 LYS H . 52031 1
140 . 1 . 1 46 46 LYS C C 13 177.286 0.3 . 1 . . . . . 578 LYS C . 52031 1
141 . 1 . 1 46 46 LYS CA C 13 56.235 0.3 . 1 . . . . . 578 LYS CA . 52031 1
142 . 1 . 1 46 46 LYS N N 15 120.549 0.3 . 1 . . . . . 578 LYS N . 52031 1
143 . 1 . 1 47 47 GLY H H 1 8.334 0.02 . 1 . . . . . 579 GLY H . 52031 1
144 . 1 . 1 47 47 GLY C C 13 174.64 0.3 . 1 . . . . . 579 GLY C . 52031 1
145 . 1 . 1 47 47 GLY CA C 13 45.036 0.3 . 1 . . . . . 579 GLY CA . 52031 1
146 . 1 . 1 47 47 GLY N N 15 109.91 0.3 . 1 . . . . . 579 GLY N . 52031 1
147 . 1 . 1 50 50 GLY H H 1 8.359 0.02 . 1 . . . . . 582 GLY H . 52031 1
148 . 1 . 1 50 50 GLY C C 13 174.701 0.3 . 1 . . . . . 582 GLY C . 52031 1
149 . 1 . 1 50 50 GLY CA C 13 45.1 0.3 . 1 . . . . . 582 GLY CA . 52031 1
150 . 1 . 1 50 50 GLY N N 15 110.93 0.3 . 1 . . . . . 582 GLY N . 52031 1
151 . 1 . 1 52 52 GLY H H 1 8.15 0.02 . 1 . . . . . 584 GLY H . 52031 1
152 . 1 . 1 52 52 GLY C C 13 174.393 0.3 . 1 . . . . . 584 GLY C . 52031 1
153 . 1 . 1 52 52 GLY CA C 13 44.917 0.3 . 1 . . . . . 584 GLY CA . 52031 1
154 . 1 . 1 52 52 GLY N N 15 108.749 0.3 . 1 . . . . . 584 GLY N . 52031 1
155 . 1 . 1 53 53 SER H H 1 8.164 0.02 . 1 . . . . . 585 SER H . 52031 1
156 . 1 . 1 53 53 SER C C 13 174.329 0.3 . 1 . . . . . 585 SER C . 52031 1
157 . 1 . 1 53 53 SER CA C 13 58.346 0.3 . 1 . . . . . 585 SER CA . 52031 1
158 . 1 . 1 53 53 SER N N 15 115.478 0.3 . 1 . . . . . 585 SER N . 52031 1
159 . 1 . 1 54 54 ASP H H 1 8.232 0.02 . 1 . . . . . 586 ASP H . 52031 1
160 . 1 . 1 54 54 ASP C C 13 176.368 0.3 . 1 . . . . . 586 ASP C . 52031 1
161 . 1 . 1 54 54 ASP CA C 13 53.995 0.3 . 1 . . . . . 586 ASP CA . 52031 1
162 . 1 . 1 54 54 ASP N N 15 121.983 0.3 . 1 . . . . . 586 ASP N . 52031 1
163 . 1 . 1 55 55 SER H H 1 8.048 0.02 . 1 . . . . . 587 SER H . 52031 1
164 . 1 . 1 55 55 SER CA C 13 58.41 0.3 . 1 . . . . . 587 SER CA . 52031 1
165 . 1 . 1 55 55 SER N N 15 116.304 0.3 . 1 . . . . . 587 SER N . 52031 1
166 . 1 . 1 57 57 SER H H 1 8.056 0.02 . 1 . . . . . 589 SER H . 52031 1
167 . 1 . 1 57 57 SER C C 13 174.72 0.3 . 1 . . . . . 589 SER C . 52031 1
168 . 1 . 1 57 57 SER CA C 13 58.538 0.3 . 1 . . . . . 589 SER CA . 52031 1
169 . 1 . 1 57 57 SER N N 15 116.266 0.3 . 1 . . . . . 589 SER N . 52031 1
170 . 1 . 1 58 58 SER H H 1 8.16 0.02 . 1 . . . . . 590 SER H . 52031 1
171 . 1 . 1 58 58 SER C C 13 175.046 0.3 . 1 . . . . . 590 SER C . 52031 1
172 . 1 . 1 58 58 SER CA C 13 58.215 0.3 . 1 . . . . . 590 SER CA . 52031 1
173 . 1 . 1 58 58 SER N N 15 117.688 0.3 . 1 . . . . . 590 SER N . 52031 1
174 . 1 . 1 59 59 GLY H H 1 8.201 0.02 . 1 . . . . . 591 GLY H . 52031 1
175 . 1 . 1 59 59 GLY C C 13 174.656 0.3 . 1 . . . . . 591 GLY C . 52031 1
176 . 1 . 1 59 59 GLY CA C 13 45.1 0.3 . 1 . . . . . 591 GLY CA . 52031 1
177 . 1 . 1 59 59 GLY N N 15 110.599 0.3 . 1 . . . . . 591 GLY N . 52031 1
178 . 1 . 1 62 62 ASN H H 1 8.191 0.02 . 1 . . . . . 594 ASN H . 52031 1
179 . 1 . 1 62 62 ASN C C 13 175.526 0.3 . 1 . . . . . 594 ASN C . 52031 1
180 . 1 . 1 62 62 ASN CA C 13 52.907 0.3 . 1 . . . . . 594 ASN CA . 52031 1
181 . 1 . 1 62 62 ASN N N 15 118.631 0.3 . 1 . . . . . 594 ASN N . 52031 1
182 . 1 . 1 63 63 SER H H 1 8.218 0.02 . 1 . . . . . 595 SER H . 52031 1
183 . 1 . 1 63 63 SER C C 13 175.072 0.3 . 1 . . . . . 595 SER C . 52031 1
184 . 1 . 1 63 63 SER CA C 13 58.538 0.3 . 1 . . . . . 595 SER CA . 52031 1
185 . 1 . 1 63 63 SER N N 15 116.423 0.3 . 1 . . . . . 595 SER N . 52031 1
186 . 1 . 1 65 65 GLY H H 1 8.004 0.02 . 1 . . . . . 597 GLY H . 52031 1
187 . 1 . 1 65 65 GLY C C 13 174.208 0.3 . 1 . . . . . 597 GLY C . 52031 1
188 . 1 . 1 65 65 GLY CA C 13 44.908 0.3 . 1 . . . . . 597 GLY CA . 52031 1
189 . 1 . 1 65 65 GLY N N 15 108.628 0.3 . 1 . . . . . 597 GLY N . 52031 1
190 . 1 . 1 66 66 SER H H 1 8.079 0.02 . 1 . . . . . 598 SER H . 52031 1
191 . 1 . 1 66 66 SER C C 13 174.328 0.3 . 1 . . . . . 598 SER C . 52031 1
192 . 1 . 1 66 66 SER CA C 13 58.282 0.3 . 1 . . . . . 598 SER CA . 52031 1
193 . 1 . 1 66 66 SER N N 15 115.419 0.3 . 1 . . . . . 598 SER N . 52031 1
194 . 1 . 1 67 67 ASN H H 1 8.318 0.02 . 1 . . . . . 599 ASN H . 52031 1
195 . 1 . 1 67 67 ASN C C 13 174.854 0.3 . 1 . . . . . 599 ASN C . 52031 1
196 . 1 . 1 67 67 ASN CA C 13 53.163 0.3 . 1 . . . . . 599 ASN CA . 52031 1
197 . 1 . 1 67 67 ASN N N 15 120.232 0.3 . 1 . . . . . 599 ASN N . 52031 1
198 . 1 . 1 68 68 ASN H H 1 8.101 0.02 . 1 . . . . . 600 ASN H . 52031 1
199 . 1 . 1 68 68 ASN C C 13 175.142 0.3 . 1 . . . . . 600 ASN C . 52031 1
200 . 1 . 1 68 68 ASN CA C 13 53.095 0.3 . 1 . . . . . 600 ASN CA . 52031 1
201 . 1 . 1 68 68 ASN N N 15 118.825 0.3 . 1 . . . . . 600 ASN N . 52031 1
202 . 1 . 1 69 69 SER H H 1 7.978 0.02 . 1 . . . . . 601 SER H . 52031 1
203 . 1 . 1 69 69 SER C C 13 174.393 0.3 . 1 . . . . . 601 SER C . 52031 1
204 . 1 . 1 69 69 SER CA C 13 58.538 0.3 . 1 . . . . . 601 SER CA . 52031 1
205 . 1 . 1 69 69 SER N N 15 115.789 0.3 . 1 . . . . . 601 SER N . 52031 1
206 . 1 . 1 70 70 SER H H 1 7.961 0.02 . 1 . . . . . 602 SER H . 52031 1
207 . 1 . 1 70 70 SER C C 13 173.729 0.3 . 1 . . . . . 602 SER C . 52031 1
208 . 1 . 1 70 70 SER CA C 13 58.343 0.3 . 1 . . . . . 602 SER CA . 52031 1
209 . 1 . 1 70 70 SER N N 15 117.119 0.3 . 1 . . . . . 602 SER N . 52031 1
210 . 1 . 1 71 71 TRP H H 1 7.477 0.02 . 1 . . . . . 603 TRP H . 52031 1
211 . 1 . 1 71 71 TRP C C 13 174.653 0.3 . 1 . . . . . 603 TRP C . 52031 1
212 . 1 . 1 71 71 TRP CA C 13 56.491 0.3 . 1 . . . . . 603 TRP CA . 52031 1
213 . 1 . 1 71 71 TRP N N 15 121.573 0.3 . 1 . . . . . 603 TRP N . 52031 1
214 . 1 . 1 72 72 TRP H H 1 7.121 0.02 . 1 . . . . . 604 TRP H . 52031 1
215 . 1 . 1 72 72 TRP C C 13 174.468 0.3 . 1 . . . . . 604 TRP C . 52031 1
216 . 1 . 1 72 72 TRP CA C 13 58.279 0.3 . 1 . . . . . 604 TRP CA . 52031 1
217 . 1 . 1 72 72 TRP N N 15 126.321 0.3 . 1 . . . . . 604 TRP N . 52031 1
stop_
save_