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 50814
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name '1H 15N and 13C chemical shift assignment of WT JIP1-SH3'
_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' . . . 50814 1
2 '3D HN(CA)CO' . . . 50814 1
3 '3D HNCA' . . . 50814 1
4 '3D HN(CO)CA' . . . 50814 1
5 '3D HNCACB' . . . 50814 1
6 '3D HN(CO)CACB' . . . 50814 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 . . 50814 1
2 $software_2 . . 50814 1
3 $software_3 . . 50814 1
4 $software_4 . . 50814 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 3 3 MET H H 1 8.414 . . 1 . . . . . 489 MET H . 50814 1
2 . 1 . 1 3 3 MET C C 13 174.838 . . 1 . . . . . 489 MET C . 50814 1
3 . 1 . 1 3 3 MET CA C 13 55.752 . . 1 . . . . . 489 MET CA . 50814 1
4 . 1 . 1 3 3 MET CB C 13 33.358 . . 1 . . . . . 489 MET CB . 50814 1
5 . 1 . 1 3 3 MET N N 15 122.554 . . 1 . . . . . 489 MET N . 50814 1
6 . 1 . 1 4 4 GLU H H 1 8.133 . . 1 . . . . . 490 GLU H . 50814 1
7 . 1 . 1 4 4 GLU C C 13 174.727 . . 1 . . . . . 490 GLU C . 50814 1
8 . 1 . 1 4 4 GLU CA C 13 55.385 . . 1 . . . . . 490 GLU CA . 50814 1
9 . 1 . 1 4 4 GLU CB C 13 31.375 . . 1 . . . . . 490 GLU CB . 50814 1
10 . 1 . 1 4 4 GLU N N 15 121.815 . . 1 . . . . . 490 GLU N . 50814 1
11 . 1 . 1 5 5 GLN H H 1 8.439 . . 1 . . . . . 491 GLN H . 50814 1
12 . 1 . 1 5 5 GLN C C 13 175.716 . . 1 . . . . . 491 GLN C . 50814 1
13 . 1 . 1 5 5 GLN CA C 13 56.677 . . 1 . . . . . 491 GLN CA . 50814 1
14 . 1 . 1 5 5 GLN CB C 13 29.181 . . 1 . . . . . 491 GLN CB . 50814 1
15 . 1 . 1 5 5 GLN N N 15 121.422 . . 1 . . . . . 491 GLN N . 50814 1
16 . 1 . 1 6 6 THR H H 1 9.297 . . 1 . . . . . 492 THR H . 50814 1
17 . 1 . 1 6 6 THR C C 13 176.048 . . 1 . . . . . 492 THR C . 50814 1
18 . 1 . 1 6 6 THR CA C 13 62.666 . . 1 . . . . . 492 THR CA . 50814 1
19 . 1 . 1 6 6 THR CB C 13 69.377 . . 1 . . . . . 492 THR CB . 50814 1
20 . 1 . 1 6 6 THR N N 15 114.699 . . 1 . . . . . 492 THR N . 50814 1
21 . 1 . 1 7 7 HIS H H 1 8.49 . . 1 . . . . . 493 HIS H . 50814 1
22 . 1 . 1 7 7 HIS C C 13 174.736 . . 1 . . . . . 493 HIS C . 50814 1
23 . 1 . 1 7 7 HIS CA C 13 56.293 . . 1 . . . . . 493 HIS CA . 50814 1
24 . 1 . 1 7 7 HIS CB C 13 37.785 . . 1 . . . . . 493 HIS CB . 50814 1
25 . 1 . 1 7 7 HIS N N 15 121.886 . . 1 . . . . . 493 HIS N . 50814 1
26 . 1 . 1 8 8 ARG H H 1 9.435 . . 1 . . . . . 494 ARG H . 50814 1
27 . 1 . 1 8 8 ARG C C 13 174.849 . . 1 . . . . . 494 ARG C . 50814 1
28 . 1 . 1 8 8 ARG CA C 13 54.041 . . 1 . . . . . 494 ARG CA . 50814 1
29 . 1 . 1 8 8 ARG CB C 13 34.704 . . 1 . . . . . 494 ARG CB . 50814 1
30 . 1 . 1 8 8 ARG N N 15 121.652 . . 1 . . . . . 494 ARG N . 50814 1
31 . 1 . 1 9 9 ALA H H 1 8.663 . . 1 . . . . . 495 ALA H . 50814 1
32 . 1 . 1 9 9 ALA C C 13 179.513 . . 1 . . . . . 495 ALA C . 50814 1
33 . 1 . 1 9 9 ALA CA C 13 51.857 . . 1 . . . . . 495 ALA CA . 50814 1
34 . 1 . 1 9 9 ALA CB C 13 21.13 . . 1 . . . . . 495 ALA CB . 50814 1
35 . 1 . 1 9 9 ALA N N 15 126.257 . . 1 . . . . . 495 ALA N . 50814 1
36 . 1 . 1 10 10 ILE H H 1 8.713 . . 1 . . . . . 496 ILE H . 50814 1
37 . 1 . 1 10 10 ILE C C 13 173.629 . . 1 . . . . . 496 ILE C . 50814 1
38 . 1 . 1 10 10 ILE CA C 13 60.859 . . 1 . . . . . 496 ILE CA . 50814 1
39 . 1 . 1 10 10 ILE CB C 13 39.657 . . 1 . . . . . 496 ILE CB . 50814 1
40 . 1 . 1 10 10 ILE N N 15 116.272 . . 1 . . . . . 496 ILE N . 50814 1
41 . 1 . 1 11 11 PHE H H 1 6.914 . . 1 . . . . . 497 PHE H . 50814 1
42 . 1 . 1 11 11 PHE C C 13 172.151 . . 1 . . . . . 497 PHE C . 50814 1
43 . 1 . 1 11 11 PHE CA C 13 55.866 . . 1 . . . . . 497 PHE CA . 50814 1
44 . 1 . 1 11 11 PHE CB C 13 42.907 . . 1 . . . . . 497 PHE CB . 50814 1
45 . 1 . 1 11 11 PHE N N 15 117.941 . . 1 . . . . . 497 PHE N . 50814 1
46 . 1 . 1 12 12 ARG H H 1 7.281 . . 1 . . . . . 498 ARG H . 50814 1
47 . 1 . 1 12 12 ARG C C 13 174.376 . . 1 . . . . . 498 ARG C . 50814 1
48 . 1 . 1 12 12 ARG CA C 13 55.72 . . 1 . . . . . 498 ARG CA . 50814 1
49 . 1 . 1 12 12 ARG CB C 13 31.171 . . 1 . . . . . 498 ARG CB . 50814 1
50 . 1 . 1 12 12 ARG N N 15 120.221 . . 1 . . . . . 498 ARG N . 50814 1
51 . 1 . 1 13 13 PHE H H 1 8.797 . . 1 . . . . . 499 PHE H . 50814 1
52 . 1 . 1 13 13 PHE C C 13 173.026 . . 1 . . . . . 499 PHE C . 50814 1
53 . 1 . 1 13 13 PHE CA C 13 57.062 . . 1 . . . . . 499 PHE CA . 50814 1
54 . 1 . 1 13 13 PHE CB C 13 42.989 . . 1 . . . . . 499 PHE CB . 50814 1
55 . 1 . 1 13 13 PHE N N 15 127.339 . . 1 . . . . . 499 PHE N . 50814 1
56 . 1 . 1 14 14 VAL H H 1 8.841 . . 1 . . . . . 500 VAL H . 50814 1
57 . 1 . 1 14 14 VAL C C 13 173.077 . . 1 . . . . . 500 VAL C . 50814 1
58 . 1 . 1 14 14 VAL CA C 13 59.099 . . 1 . . . . . 500 VAL CA . 50814 1
59 . 1 . 1 14 14 VAL CB C 13 32.789 . . 1 . . . . . 500 VAL CB . 50814 1
60 . 1 . 1 14 14 VAL N N 15 130.533 . . 1 . . . . . 500 VAL N . 50814 1
61 . 1 . 1 15 15 PRO C C 13 177.905 . . 1 . . . . . 501 PRO C . 50814 1
62 . 1 . 1 15 15 PRO CA C 13 63.769 . . 1 . . . . . 501 PRO CA . 50814 1
63 . 1 . 1 15 15 PRO CB C 13 34.26 . . 1 . . . . . 501 PRO CB . 50814 1
64 . 1 . 1 16 16 ARG H H 1 9.11 . . 1 . . . . . 502 ARG H . 50814 1
65 . 1 . 1 16 16 ARG C C 13 174.965 . . 1 . . . . . 502 ARG C . 50814 1
66 . 1 . 1 16 16 ARG CA C 13 56.675 . . 1 . . . . . 502 ARG CA . 50814 1
67 . 1 . 1 16 16 ARG CB C 13 32.615 . . 1 . . . . . 502 ARG CB . 50814 1
68 . 1 . 1 16 16 ARG N N 15 121.113 . . 1 . . . . . 502 ARG N . 50814 1
69 . 1 . 1 17 17 HIS H H 1 8.536 . . 1 . . . . . 503 HIS H . 50814 1
70 . 1 . 1 17 17 HIS C C 13 176.143 . . 1 . . . . . 503 HIS C . 50814 1
71 . 1 . 1 17 17 HIS CA C 13 54.461 . . 1 . . . . . 503 HIS CA . 50814 1
72 . 1 . 1 17 17 HIS CB C 13 30.286 . . 1 . . . . . 503 HIS CB . 50814 1
73 . 1 . 1 17 17 HIS N N 15 119.527 . . 1 . . . . . 503 HIS N . 50814 1
74 . 1 . 1 18 18 GLU H H 1 9.024 . . 1 . . . . . 504 GLU H . 50814 1
75 . 1 . 1 18 18 GLU C C 13 175.684 . . 1 . . . . . 504 GLU C . 50814 1
76 . 1 . 1 18 18 GLU CA C 13 59.485 . . 1 . . . . . 504 GLU CA . 50814 1
77 . 1 . 1 18 18 GLU CB C 13 29.896 . . 1 . . . . . 504 GLU CB . 50814 1
78 . 1 . 1 18 18 GLU N N 15 121.915 . . 1 . . . . . 504 GLU N . 50814 1
79 . 1 . 1 19 19 ASP H H 1 9.179 . . 1 . . . . . 505 ASP H . 50814 1
80 . 1 . 1 19 19 ASP C C 13 177.287 . . 1 . . . . . 505 ASP C . 50814 1
81 . 1 . 1 19 19 ASP CA C 13 53.107 . . 1 . . . . . 505 ASP CA . 50814 1
82 . 1 . 1 19 19 ASP CB C 13 39.35 . . 1 . . . . . 505 ASP CB . 50814 1
83 . 1 . 1 19 19 ASP N N 15 115.019 . . 1 . . . . . 505 ASP N . 50814 1
84 . 1 . 1 20 20 GLU H H 1 7.539 . . 1 . . . . . 506 GLU H . 50814 1
85 . 1 . 1 20 20 GLU C C 13 176.065 . . 1 . . . . . 506 GLU C . 50814 1
86 . 1 . 1 20 20 GLU CA C 13 55.889 . . 1 . . . . . 506 GLU CA . 50814 1
87 . 1 . 1 20 20 GLU CB C 13 32.21 . . 1 . . . . . 506 GLU CB . 50814 1
88 . 1 . 1 20 20 GLU N N 15 120.784 . . 1 . . . . . 506 GLU N . 50814 1
89 . 1 . 1 21 21 LEU H H 1 8.839 . . 1 . . . . . 507 LEU H . 50814 1
90 . 1 . 1 21 21 LEU C C 13 173.202 . . 1 . . . . . 507 LEU C . 50814 1
91 . 1 . 1 21 21 LEU CA C 13 52.725 . . 1 . . . . . 507 LEU CA . 50814 1
92 . 1 . 1 21 21 LEU CB C 13 46.322 . . 1 . . . . . 507 LEU CB . 50814 1
93 . 1 . 1 21 21 LEU N N 15 124.301 . . 1 . . . . . 507 LEU N . 50814 1
94 . 1 . 1 22 22 GLU H H 1 8.353 . . 1 . . . . . 508 GLU H . 50814 1
95 . 1 . 1 22 22 GLU C C 13 176.216 . . 1 . . . . . 508 GLU C . 50814 1
96 . 1 . 1 22 22 GLU CA C 13 56.956 . . 1 . . . . . 508 GLU CA . 50814 1
97 . 1 . 1 22 22 GLU CB C 13 29.501 . . 1 . . . . . 508 GLU CB . 50814 1
98 . 1 . 1 22 22 GLU N N 15 124.004 . . 1 . . . . . 508 GLU N . 50814 1
99 . 1 . 1 23 23 LEU H H 1 9.066 . . 1 . . . . . 509 LEU H . 50814 1
100 . 1 . 1 23 23 LEU C C 13 177.239 . . 1 . . . . . 509 LEU C . 50814 1
101 . 1 . 1 23 23 LEU CA C 13 53.952 . . 1 . . . . . 509 LEU CA . 50814 1
102 . 1 . 1 23 23 LEU CB C 13 45.383 . . 1 . . . . . 509 LEU CB . 50814 1
103 . 1 . 1 23 23 LEU N N 15 123.378 . . 1 . . . . . 509 LEU N . 50814 1
104 . 1 . 1 24 24 GLU H H 1 8.533 . . 1 . . . . . 510 GLU H . 50814 1
105 . 1 . 1 24 24 GLU C C 13 175.217 . . 1 . . . . . 510 GLU C . 50814 1
106 . 1 . 1 24 24 GLU CA C 13 54.344 . . 1 . . . . . 510 GLU CA . 50814 1
107 . 1 . 1 24 24 GLU CB C 13 30.981 . . 1 . . . . . 510 GLU CB . 50814 1
108 . 1 . 1 24 24 GLU N N 15 124.052 . . 1 . . . . . 510 GLU N . 50814 1
109 . 1 . 1 25 25 VAL H H 1 9.047 . . 1 . . . . . 511 VAL H . 50814 1
110 . 1 . 1 25 25 VAL C C 13 177.059 . . 1 . . . . . 511 VAL C . 50814 1
111 . 1 . 1 25 25 VAL CA C 13 66.538 . . 1 . . . . . 511 VAL CA . 50814 1
112 . 1 . 1 25 25 VAL CB C 13 30.981 . . 1 . . . . . 511 VAL CB . 50814 1
113 . 1 . 1 25 25 VAL N N 15 122.475 . . 1 . . . . . 511 VAL N . 50814 1
114 . 1 . 1 26 26 ASP H H 1 8.475 . . 1 . . . . . 512 ASP H . 50814 1
115 . 1 . 1 26 26 ASP C C 13 176.049 . . 1 . . . . . 512 ASP C . 50814 1
116 . 1 . 1 26 26 ASP CA C 13 57.196 . . 1 . . . . . 512 ASP CA . 50814 1
117 . 1 . 1 26 26 ASP CB C 13 39.026 . . 1 . . . . . 512 ASP CB . 50814 1
118 . 1 . 1 26 26 ASP N N 15 120.226 . . 1 . . . . . 512 ASP N . 50814 1
119 . 1 . 1 27 27 ASP H H 1 8.38 . . 1 . . . . . 513 ASP H . 50814 1
120 . 1 . 1 27 27 ASP C C 13 174.362 . . 1 . . . . . 513 ASP C . 50814 1
121 . 1 . 1 27 27 ASP CA C 13 54.07 . . 1 . . . . . 513 ASP CA . 50814 1
122 . 1 . 1 27 27 ASP CB C 13 39.82 . . 1 . . . . . 513 ASP CB . 50814 1
123 . 1 . 1 27 27 ASP N N 15 122.746 . . 1 . . . . . 513 ASP N . 50814 1
124 . 1 . 1 28 28 PRO C C 13 175.75 . . 1 . . . . . 514 PRO C . 50814 1
125 . 1 . 1 28 28 PRO CA C 13 62.137 . . 1 . . . . . 514 PRO CA . 50814 1
126 . 1 . 1 28 28 PRO CB C 13 31.289 . . 1 . . . . . 514 PRO CB . 50814 1
127 . 1 . 1 29 29 LEU H H 1 8.33 . . 1 . . . . . 515 LEU H . 50814 1
128 . 1 . 1 29 29 LEU C C 13 175.175 . . 1 . . . . . 515 LEU C . 50814 1
129 . 1 . 1 29 29 LEU CA C 13 52.842 . . 1 . . . . . 515 LEU CA . 50814 1
130 . 1 . 1 29 29 LEU CB C 13 47.252 . . 1 . . . . . 515 LEU CB . 50814 1
131 . 1 . 1 29 29 LEU N N 15 121.472 . . 1 . . . . . 515 LEU N . 50814 1
132 . 1 . 1 30 30 LEU H H 1 9.167 . . 1 . . . . . 516 LEU H . 50814 1
133 . 1 . 1 30 30 LEU C C 13 175.779 . . 1 . . . . . 516 LEU C . 50814 1
134 . 1 . 1 30 30 LEU CA C 13 54.866 . . 1 . . . . . 516 LEU CA . 50814 1
135 . 1 . 1 30 30 LEU CB C 13 43.656 . . 1 . . . . . 516 LEU CB . 50814 1
136 . 1 . 1 30 30 LEU N N 15 126.841 . . 1 . . . . . 516 LEU N . 50814 1
137 . 1 . 1 31 31 VAL H H 1 9.13 . . 1 . . . . . 517 VAL H . 50814 1
138 . 1 . 1 31 31 VAL C C 13 175.376 . . 1 . . . . . 517 VAL C . 50814 1
139 . 1 . 1 31 31 VAL CA C 13 63.445 . . 1 . . . . . 517 VAL CA . 50814 1
140 . 1 . 1 31 31 VAL CB C 13 31.304 . . 1 . . . . . 517 VAL CB . 50814 1
141 . 1 . 1 31 31 VAL N N 15 127.414 . . 1 . . . . . 517 VAL N . 50814 1
142 . 1 . 1 32 32 GLU H H 1 8.868 . . 1 . . . . . 518 GLU H . 50814 1
143 . 1 . 1 32 32 GLU C C 13 176.117 . . 1 . . . . . 518 GLU C . 50814 1
144 . 1 . 1 32 32 GLU CA C 13 57.244 . . 1 . . . . . 518 GLU CA . 50814 1
145 . 1 . 1 32 32 GLU CB C 13 31.837 . . 1 . . . . . 518 GLU CB . 50814 1
146 . 1 . 1 32 32 GLU N N 15 129.601 . . 1 . . . . . 518 GLU N . 50814 1
147 . 1 . 1 33 33 LEU H H 1 7.639 . . 1 . . . . . 519 LEU H . 50814 1
148 . 1 . 1 33 33 LEU C C 13 174.758 . . 1 . . . . . 519 LEU C . 50814 1
149 . 1 . 1 33 33 LEU CA C 13 55.345 . . 1 . . . . . 519 LEU CA . 50814 1
150 . 1 . 1 33 33 LEU CB C 13 45.691 . . 1 . . . . . 519 LEU CB . 50814 1
151 . 1 . 1 33 33 LEU N N 15 119.413 . . 1 . . . . . 519 LEU N . 50814 1
152 . 1 . 1 34 34 GLN H H 1 8.736 . . 1 . . . . . 520 GLN H . 50814 1
153 . 1 . 1 34 34 GLN C C 13 174.383 . . 1 . . . . . 520 GLN C . 50814 1
154 . 1 . 1 34 34 GLN CA C 13 54.47 . . 1 . . . . . 520 GLN CA . 50814 1
155 . 1 . 1 34 34 GLN CB C 13 27.445 . . 1 . . . . . 520 GLN CB . 50814 1
156 . 1 . 1 34 34 GLN N N 15 126.569 . . 1 . . . . . 520 GLN N . 50814 1
157 . 1 . 1 35 35 ALA H H 1 7.899 . . 1 . . . . . 521 ALA H . 50814 1
158 . 1 . 1 35 35 ALA C C 13 179.17 . . 1 . . . . . 521 ALA C . 50814 1
159 . 1 . 1 35 35 ALA CA C 13 52.461 . . 1 . . . . . 521 ALA CA . 50814 1
160 . 1 . 1 35 35 ALA CB C 13 20.979 . . 1 . . . . . 521 ALA CB . 50814 1
161 . 1 . 1 35 35 ALA N N 15 125.576 . . 1 . . . . . 521 ALA N . 50814 1
162 . 1 . 1 36 36 GLU H H 1 9.018 . . 1 . . . . . 522 GLU H . 50814 1
163 . 1 . 1 36 36 GLU C C 13 175.606 . . 1 . . . . . 522 GLU C . 50814 1
164 . 1 . 1 36 36 GLU CA C 13 58.212 . . 1 . . . . . 522 GLU CA . 50814 1
165 . 1 . 1 36 36 GLU CB C 13 29.453 . . 1 . . . . . 522 GLU CB . 50814 1
166 . 1 . 1 36 36 GLU N N 15 119.915 . . 1 . . . . . 522 GLU N . 50814 1
167 . 1 . 1 37 37 ASP H H 1 7.977 . . 1 . . . . . 523 ASP H . 50814 1
168 . 1 . 1 37 37 ASP C C 13 175.263 . . 1 . . . . . 523 ASP C . 50814 1
169 . 1 . 1 37 37 ASP CA C 13 52.646 . . 1 . . . . . 523 ASP CA . 50814 1
170 . 1 . 1 37 37 ASP CB C 13 39.09 . . 1 . . . . . 523 ASP CB . 50814 1
171 . 1 . 1 37 37 ASP N N 15 115.688 . . 1 . . . . . 523 ASP N . 50814 1
172 . 1 . 1 38 38 TYR H H 1 7.83 . . 1 . . . . . 524 TYR H . 50814 1
173 . 1 . 1 38 38 TYR C C 13 174.353 . . 1 . . . . . 524 TYR C . 50814 1
174 . 1 . 1 38 38 TYR CA C 13 60.627 . . 1 . . . . . 524 TYR CA . 50814 1
175 . 1 . 1 38 38 TYR CB C 13 34.25 . . 1 . . . . . 524 TYR CB . 50814 1
176 . 1 . 1 38 38 TYR N N 15 109.415 . . 1 . . . . . 524 TYR N . 50814 1
177 . 1 . 1 39 39 TRP H H 1 7.389 . . 1 . . . . . 525 TRP H . 50814 1
178 . 1 . 1 39 39 TRP C C 13 174.834 . . 1 . . . . . 525 TRP C . 50814 1
179 . 1 . 1 39 39 TRP CA C 13 57.151 . . 1 . . . . . 525 TRP CA . 50814 1
180 . 1 . 1 39 39 TRP CB C 13 29.278 . . 1 . . . . . 525 TRP CB . 50814 1
181 . 1 . 1 39 39 TRP N N 15 117.142 . . 1 . . . . . 525 TRP N . 50814 1
182 . 1 . 1 40 40 TYR H H 1 8.794 . . 1 . . . . . 526 TYR H . 50814 1
183 . 1 . 1 40 40 TYR C C 13 175.048 . . 1 . . . . . 526 TYR C . 50814 1
184 . 1 . 1 40 40 TYR CA C 13 52.16 . . 1 . . . . . 526 TYR CA . 50814 1
185 . 1 . 1 40 40 TYR CB C 13 38.945 . . 1 . . . . . 526 TYR CB . 50814 1
186 . 1 . 1 40 40 TYR N N 15 120.487 . . 1 . . . . . 526 TYR N . 50814 1
187 . 1 . 1 41 41 GLU H H 1 8.651 . . 1 . . . . . 527 GLU H . 50814 1
188 . 1 . 1 41 41 GLU C C 13 176.613 . . 1 . . . . . 527 GLU C . 50814 1
189 . 1 . 1 41 41 GLU CA C 13 55.31 . . 1 . . . . . 527 GLU CA . 50814 1
190 . 1 . 1 41 41 GLU CB C 13 30.97 . . 1 . . . . . 527 GLU CB . 50814 1
191 . 1 . 1 41 41 GLU N N 15 119.181 . . 1 . . . . . 527 GLU N . 50814 1
192 . 1 . 1 42 42 ALA H H 1 9.401 . . 1 . . . . . 528 ALA H . 50814 1
193 . 1 . 1 42 42 ALA C C 13 173.303 . . 1 . . . . . 528 ALA C . 50814 1
194 . 1 . 1 42 42 ALA CA C 13 50.906 . . 1 . . . . . 528 ALA CA . 50814 1
195 . 1 . 1 42 42 ALA CB C 13 27.411 . . 1 . . . . . 528 ALA CB . 50814 1
196 . 1 . 1 42 42 ALA N N 15 126.672 . . 1 . . . . . 528 ALA N . 50814 1
197 . 1 . 1 43 43 TYR H H 1 8.717 . . 1 . . . . . 529 TYR H . 50814 1
198 . 1 . 1 43 43 TYR C C 13 175.378 . . 1 . . . . . 529 TYR C . 50814 1
199 . 1 . 1 43 43 TYR CA C 13 56.149 . . 1 . . . . . 529 TYR CA . 50814 1
200 . 1 . 1 43 43 TYR CB C 13 41.448 . . 1 . . . . . 529 TYR CB . 50814 1
201 . 1 . 1 43 43 TYR N N 15 118.425 . . 1 . . . . . 529 TYR N . 50814 1
202 . 1 . 1 44 44 ASN H H 1 8.983 . . 1 . . . . . 530 ASN H . 50814 1
203 . 1 . 1 44 44 ASN C C 13 175.128 . . 1 . . . . . 530 ASN C . 50814 1
204 . 1 . 1 44 44 ASN CA C 13 52.652 . . 1 . . . . . 530 ASN CA . 50814 1
205 . 1 . 1 44 44 ASN CB C 13 40.046 . . 1 . . . . . 530 ASN CB . 50814 1
206 . 1 . 1 44 44 ASN N N 15 125.305 . . 1 . . . . . 530 ASN N . 50814 1
207 . 1 . 1 45 45 MET H H 1 8.819 . . 1 . . . . . 531 MET H . 50814 1
208 . 1 . 1 45 45 MET C C 13 177.354 . . 1 . . . . . 531 MET C . 50814 1
209 . 1 . 1 45 45 MET CA C 13 57.902 . . 1 . . . . . 531 MET CA . 50814 1
210 . 1 . 1 45 45 MET CB C 13 33.263 . . 1 . . . . . 531 MET CB . 50814 1
211 . 1 . 1 45 45 MET N N 15 123.142 . . 1 . . . . . 531 MET N . 50814 1
212 . 1 . 1 46 46 ARG H H 1 8.695 . . 1 . . . . . 532 ARG H . 50814 1
213 . 1 . 1 46 46 ARG C C 13 177.627 . . 1 . . . . . 532 ARG C . 50814 1
214 . 1 . 1 46 46 ARG CA C 13 58.897 . . 1 . . . . . 532 ARG CA . 50814 1
215 . 1 . 1 46 46 ARG CB C 13 30.308 . . 1 . . . . . 532 ARG CB . 50814 1
216 . 1 . 1 46 46 ARG N N 15 119.397 . . 1 . . . . . 532 ARG N . 50814 1
217 . 1 . 1 47 47 THR H H 1 7.115 . . 1 . . . . . 533 THR H . 50814 1
218 . 1 . 1 47 47 THR C C 13 176.85 . . 1 . . . . . 533 THR C . 50814 1
219 . 1 . 1 47 47 THR CA C 13 62.024 . . 1 . . . . . 533 THR CA . 50814 1
220 . 1 . 1 47 47 THR CB C 13 70.159 . . 1 . . . . . 533 THR CB . 50814 1
221 . 1 . 1 47 47 THR N N 15 106.495 . . 1 . . . . . 533 THR N . 50814 1
222 . 1 . 1 48 48 GLY H H 1 8.7 . . 1 . . . . . 534 GLY H . 50814 1
223 . 1 . 1 48 48 GLY C C 13 172.972 . . 1 . . . . . 534 GLY C . 50814 1
224 . 1 . 1 48 48 GLY CA C 13 45.415 . . 1 . . . . . 534 GLY CA . 50814 1
225 . 1 . 1 48 48 GLY N N 15 112.119 . . 1 . . . . . 534 GLY N . 50814 1
226 . 1 . 1 49 49 ALA H H 1 7.43 . . 1 . . . . . 535 ALA H . 50814 1
227 . 1 . 1 49 49 ALA C C 13 174.437 . . 1 . . . . . 535 ALA C . 50814 1
228 . 1 . 1 49 49 ALA CA C 13 51.355 . . 1 . . . . . 535 ALA CA . 50814 1
229 . 1 . 1 49 49 ALA CB C 13 20.858 . . 1 . . . . . 535 ALA CB . 50814 1
230 . 1 . 1 49 49 ALA N N 15 122.463 . . 1 . . . . . 535 ALA N . 50814 1
231 . 1 . 1 50 50 ARG H H 1 8.373 . . 1 . . . . . 536 ARG H . 50814 1
232 . 1 . 1 50 50 ARG C C 13 176.677 . . 1 . . . . . 536 ARG C . 50814 1
233 . 1 . 1 50 50 ARG CA C 13 54.174 . . 1 . . . . . 536 ARG CA . 50814 1
234 . 1 . 1 50 50 ARG CB C 13 34.54 . . 1 . . . . . 536 ARG CB . 50814 1
235 . 1 . 1 50 50 ARG N N 15 117.494 . . 1 . . . . . 536 ARG N . 50814 1
236 . 1 . 1 51 51 GLY H H 1 8.733 . . 1 . . . . . 537 GLY H . 50814 1
237 . 1 . 1 51 51 GLY C C 13 171.665 . . 1 . . . . . 537 GLY C . 50814 1
238 . 1 . 1 51 51 GLY CA C 13 45.818 . . 1 . . . . . 537 GLY CA . 50814 1
239 . 1 . 1 51 51 GLY N N 15 110.237 . . 1 . . . . . 537 GLY N . 50814 1
240 . 1 . 1 52 52 VAL H H 1 8.779 . . 1 . . . . . 538 VAL H . 50814 1
241 . 1 . 1 52 52 VAL C C 13 176.756 . . 1 . . . . . 538 VAL C . 50814 1
242 . 1 . 1 52 52 VAL CA C 13 58.857 . . 1 . . . . . 538 VAL CA . 50814 1
243 . 1 . 1 52 52 VAL CB C 13 35.084 . . 1 . . . . . 538 VAL CB . 50814 1
244 . 1 . 1 52 52 VAL N N 15 112.992 . . 1 . . . . . 538 VAL N . 50814 1
245 . 1 . 1 53 53 PHE H H 1 8.96 . . 1 . . . . . 539 PHE H . 50814 1
246 . 1 . 1 53 53 PHE C C 13 180.621 . . 1 . . . . . 539 PHE C . 50814 1
247 . 1 . 1 53 53 PHE CA C 13 56.29 . . 1 . . . . . 539 PHE CA . 50814 1
248 . 1 . 1 53 53 PHE CB C 13 38.487 . . 1 . . . . . 539 PHE CB . 50814 1
249 . 1 . 1 53 53 PHE N N 15 116.89 . . 1 . . . . . 539 PHE N . 50814 1
250 . 1 . 1 54 54 PRO C C 13 176.945 . . 1 . . . . . 540 PRO C . 50814 1
251 . 1 . 1 54 54 PRO CA C 13 62.883 . . 1 . . . . . 540 PRO CA . 50814 1
252 . 1 . 1 54 54 PRO CB C 13 31.924 . . 1 . . . . . 540 PRO CB . 50814 1
253 . 1 . 1 55 55 ALA H H 1 7.815 . . 1 . . . . . 541 ALA H . 50814 1
254 . 1 . 1 55 55 ALA C C 13 177.809 . . 1 . . . . . 541 ALA C . 50814 1
255 . 1 . 1 55 55 ALA CA C 13 55.632 . . 1 . . . . . 541 ALA CA . 50814 1
256 . 1 . 1 55 55 ALA CB C 13 20.47 . . 1 . . . . . 541 ALA CB . 50814 1
257 . 1 . 1 55 55 ALA N N 15 122.237 . . 1 . . . . . 541 ALA N . 50814 1
258 . 1 . 1 56 56 TYR H H 1 7.312 . . 1 . . . . . 542 TYR H . 50814 1
259 . 1 . 1 56 56 TYR C C 13 174.802 . . 1 . . . . . 542 TYR C . 50814 1
260 . 1 . 1 56 56 TYR CA C 13 59.444 . . 1 . . . . . 542 TYR CA . 50814 1
261 . 1 . 1 56 56 TYR CB C 13 36.523 . . 1 . . . . . 542 TYR CB . 50814 1
262 . 1 . 1 56 56 TYR N N 15 111.246 . . 1 . . . . . 542 TYR N . 50814 1
263 . 1 . 1 57 57 TYR H H 1 8.03 . . 1 . . . . . 543 TYR H . 50814 1
264 . 1 . 1 57 57 TYR C C 13 174.284 . . 1 . . . . . 543 TYR C . 50814 1
265 . 1 . 1 57 57 TYR CA C 13 59.462 . . 1 . . . . . 543 TYR CA . 50814 1
266 . 1 . 1 57 57 TYR CB C 13 37.627 . . 1 . . . . . 543 TYR CB . 50814 1
267 . 1 . 1 57 57 TYR N N 15 115.645 . . 1 . . . . . 543 TYR N . 50814 1
268 . 1 . 1 58 58 ALA H H 1 7.754 . . 1 . . . . . 544 ALA H . 50814 1
269 . 1 . 1 58 58 ALA C C 13 175.326 . . 1 . . . . . 544 ALA C . 50814 1
270 . 1 . 1 58 58 ALA CA C 13 50.423 . . 1 . . . . . 544 ALA CA . 50814 1
271 . 1 . 1 58 58 ALA CB C 13 24.214 . . 1 . . . . . 544 ALA CB . 50814 1
272 . 1 . 1 58 58 ALA N N 15 120.003 . . 1 . . . . . 544 ALA N . 50814 1
273 . 1 . 1 59 59 ILE H H 1 8.588 . . 1 . . . . . 545 ILE H . 50814 1
274 . 1 . 1 59 59 ILE C C 13 174.561 . . 1 . . . . . 545 ILE C . 50814 1
275 . 1 . 1 59 59 ILE CA C 13 58.882 . . 1 . . . . . 545 ILE CA . 50814 1
276 . 1 . 1 59 59 ILE CB C 13 42.529 . . 1 . . . . . 545 ILE CB . 50814 1
277 . 1 . 1 59 59 ILE N N 15 116.082 . . 1 . . . . . 545 ILE N . 50814 1
278 . 1 . 1 60 60 GLU H H 1 8.777 . . 1 . . . . . 546 GLU H . 50814 1
279 . 1 . 1 60 60 GLU C C 13 176.862 . . 1 . . . . . 546 GLU C . 50814 1
280 . 1 . 1 60 60 GLU CA C 13 57.481 . . 1 . . . . . 546 GLU CA . 50814 1
281 . 1 . 1 60 60 GLU CB C 13 30.348 . . 1 . . . . . 546 GLU CB . 50814 1
282 . 1 . 1 60 60 GLU N N 15 125.698 . . 1 . . . . . 546 GLU N . 50814 1
283 . 1 . 1 61 61 VAL H H 1 7.716 . . 1 . . . . . 547 VAL H . 50814 1
284 . 1 . 1 61 61 VAL C C 13 175.36 . . 1 . . . . . 547 VAL C . 50814 1
285 . 1 . 1 61 61 VAL CA C 13 61.583 . . 1 . . . . . 547 VAL CA . 50814 1
286 . 1 . 1 61 61 VAL CB C 13 32.57 . . 1 . . . . . 547 VAL CB . 50814 1
287 . 1 . 1 61 61 VAL N N 15 119.381 . . 1 . . . . . 547 VAL N . 50814 1
288 . 1 . 1 62 62 THR H H 1 8.024 . . 1 . . . . . 548 THR H . 50814 1
289 . 1 . 1 62 62 THR C C 13 173.644 . . 1 . . . . . 548 THR C . 50814 1
290 . 1 . 1 62 62 THR CA C 13 61.611 . . 1 . . . . . 548 THR CA . 50814 1
291 . 1 . 1 62 62 THR CB C 13 70.057 . . 1 . . . . . 548 THR CB . 50814 1
292 . 1 . 1 62 62 THR N N 15 117.438 . . 1 . . . . . 548 THR N . 50814 1
293 . 1 . 1 63 63 LYS H H 1 8.069 . . 1 . . . . . 549 LYS H . 50814 1
294 . 1 . 1 63 63 LYS C C 13 171.294 . . 1 . . . . . 549 LYS C . 50814 1
295 . 1 . 1 63 63 LYS CA C 13 57.691 . . 1 . . . . . 549 LYS CA . 50814 1
296 . 1 . 1 63 63 LYS CB C 13 33.694 . . 1 . . . . . 549 LYS CB . 50814 1
297 . 1 . 1 63 63 LYS N N 15 129.311 . . 1 . . . . . 549 LYS N . 50814 1
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