Content for NMR-STAR saveframe, "assigned_chemical_shifts_1_DND1-RRM2"
save_assigned_chemical_shifts_1_DND1-RRM2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1_DND1-RRM2
_Assigned_chem_shift_list.Entry_ID 50151
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name DND1-RRM2
_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_DSS
_Assigned_chem_shift_list.Chem_shift_1H_err 0.020
_Assigned_chem_shift_list.Chem_shift_13C_err 0.3
_Assigned_chem_shift_list.Chem_shift_15N_err 0.3
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_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' . . . 50151 1
2 '3D CBCA(CO)NH' . . . 50151 1
4 '3D HNCO' . . . 50151 1
5 '3D HNCACB' . . . 50151 1
6 '3D HNCA' . . . 50151 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_TOPSPIN . . 50151 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 21 21 MET H H 1 8.876 0.020 . 1 . . . . . 21 MET H . 50151 1
2 . 1 . 1 21 21 MET C C 13 174.084 0.3 . 1 . . . . . 21 MET C . 50151 1
3 . 1 . 1 21 21 MET CA C 13 55.259 0.3 . 1 . . . . . 21 MET CA . 50151 1
4 . 1 . 1 21 21 MET CB C 13 34.130 0.3 . 1 . . . . . 21 MET CB . 50151 1
5 . 1 . 1 21 21 MET N N 15 117.517 0.3 . 1 . . . . . 21 MET N . 50151 1
6 . 1 . 1 22 22 GLU H H 1 8.255 0.020 . 1 . . . . . 22 GLU H . 50151 1
7 . 1 . 1 22 22 GLU C C 13 175.227 0.3 . 1 . . . . . 22 GLU C . 50151 1
8 . 1 . 1 22 22 GLU CA C 13 54.654 0.3 . 1 . . . . . 22 GLU CA . 50151 1
9 . 1 . 1 22 22 GLU CB C 13 34.101 0.3 . 1 . . . . . 22 GLU CB . 50151 1
10 . 1 . 1 22 22 GLU N N 15 118.756 0.3 . 1 . . . . . 22 GLU N . 50151 1
11 . 1 . 1 23 23 LEU H H 1 9.076 0.020 . 1 . . . . . 23 LEU H . 50151 1
12 . 1 . 1 23 23 LEU C C 13 175.073 0.3 . 1 . . . . . 23 LEU C . 50151 1
13 . 1 . 1 23 23 LEU CA C 13 52.418 0.3 . 1 . . . . . 23 LEU CA . 50151 1
14 . 1 . 1 23 23 LEU CB C 13 46.833 0.3 . 1 . . . . . 23 LEU CB . 50151 1
15 . 1 . 1 23 23 LEU N N 15 121.218 0.3 . 1 . . . . . 23 LEU N . 50151 1
16 . 1 . 1 24 24 SER H H 1 9.403 0.020 . 1 . . . . . 24 SER H . 50151 1
17 . 1 . 1 24 24 SER C C 13 173.657 0.3 . 1 . . . . . 24 SER C . 50151 1
18 . 1 . 1 24 24 SER CA C 13 55.470 0.3 . 1 . . . . . 24 SER CA . 50151 1
19 . 1 . 1 24 24 SER CB C 13 65.968 0.3 . 1 . . . . . 24 SER CB . 50151 1
20 . 1 . 1 24 24 SER N N 15 115.178 0.3 . 1 . . . . . 24 SER N . 50151 1
21 . 1 . 1 25 25 VAL H H 1 9.134 0.020 . 1 . . . . . 25 VAL H . 50151 1
22 . 1 . 1 25 25 VAL C C 13 173.555 0.3 . 1 . . . . . 25 VAL C . 50151 1
23 . 1 . 1 25 25 VAL CA C 13 60.638 0.3 . 1 . . . . . 25 VAL CA . 50151 1
24 . 1 . 1 25 25 VAL CB C 13 33.039 0.3 . 1 . . . . . 25 VAL CB . 50151 1
25 . 1 . 1 25 25 VAL N N 15 123.249 0.3 . 1 . . . . . 25 VAL N . 50151 1
26 . 1 . 1 26 26 ASP H H 1 9.019 0.020 . 1 . . . . . 26 ASP H . 50151 1
27 . 1 . 1 26 26 ASP C C 13 176.387 0.3 . 1 . . . . . 26 ASP C . 50151 1
28 . 1 . 1 26 26 ASP CA C 13 51.965 0.3 . 1 . . . . . 26 ASP CA . 50151 1
29 . 1 . 1 26 26 ASP CB C 13 43.048 0.3 . 1 . . . . . 26 ASP CB . 50151 1
30 . 1 . 1 26 26 ASP N N 15 126.011 0.3 . 1 . . . . . 26 ASP N . 50151 1
31 . 1 . 1 27 27 GLY H H 1 8.493 0.020 . 1 . . . . . 27 GLY H . 50151 1
32 . 1 . 1 27 27 GLY C C 13 175.346 0.3 . 1 . . . . . 27 GLY C . 50151 1
33 . 1 . 1 27 27 GLY CA C 13 44.740 0.3 . 1 . . . . . 27 GLY CA . 50151 1
34 . 1 . 1 27 27 GLY N N 15 108.732 0.3 . 1 . . . . . 27 GLY N . 50151 1
35 . 1 . 1 28 28 LEU H H 1 8.138 0.020 . 1 . . . . . 28 LEU H . 50151 1
36 . 1 . 1 28 28 LEU C C 13 174.184 0.3 . 1 . . . . . 28 LEU C . 50151 1
37 . 1 . 1 28 28 LEU CA C 13 52.629 0.3 . 1 . . . . . 28 LEU CA . 50151 1
38 . 1 . 1 28 28 LEU CB C 13 39.198 0.3 . 1 . . . . . 28 LEU CB . 50151 1
39 . 1 . 1 28 28 LEU N N 15 119.822 0.3 . 1 . . . . . 28 LEU N . 50151 1
40 . 1 . 1 32 32 LEU H H 1 6.776 0.020 . 1 . . . . . 32 LEU H . 50151 1
41 . 1 . 1 32 32 LEU C C 13 175.995 0.3 . 1 . . . . . 32 LEU C . 50151 1
42 . 1 . 1 32 32 LEU CA C 13 55.198 0.3 . 1 . . . . . 32 LEU CA . 50151 1
43 . 1 . 1 32 32 LEU CB C 13 42.920 0.3 . 1 . . . . . 32 LEU CB . 50151 1
44 . 1 . 1 32 32 LEU N N 15 122.498 0.3 . 1 . . . . . 32 LEU N . 50151 1
45 . 1 . 1 33 33 THR H H 1 7.763 0.020 . 1 . . . . . 33 THR H . 50151 1
46 . 1 . 1 33 33 THR C C 13 174.852 0.3 . 1 . . . . . 33 THR C . 50151 1
47 . 1 . 1 33 33 THR CA C 13 59.368 0.3 . 1 . . . . . 33 THR CA . 50151 1
48 . 1 . 1 33 33 THR CB C 13 71.165 0.3 . 1 . . . . . 33 THR CB . 50151 1
49 . 1 . 1 33 33 THR N N 15 116.671 0.3 . 1 . . . . . 33 THR N . 50151 1
50 . 1 . 1 34 34 ARG H H 1 9.061 0.020 . 1 . . . . . 34 ARG H . 50151 1
51 . 1 . 1 34 34 ARG C C 13 177.753 0.3 . 1 . . . . . 34 ARG C . 50151 1
52 . 1 . 1 34 34 ARG CA C 13 59.701 0.3 . 1 . . . . . 34 ARG CA . 50151 1
53 . 1 . 1 34 34 ARG CB C 13 28.869 0.3 . 1 . . . . . 34 ARG CB . 50151 1
54 . 1 . 1 34 34 ARG N N 15 122.312 0.3 . 1 . . . . . 34 ARG N . 50151 1
55 . 1 . 1 35 35 SER H H 1 8.545 0.020 . 1 . . . . . 35 SER H . 50151 1
56 . 1 . 1 35 35 SER C C 13 177.753 0.3 . 1 . . . . . 35 SER C . 50151 1
57 . 1 . 1 35 35 SER CA C 13 61.574 0.3 . 1 . . . . . 35 SER CA . 50151 1
58 . 1 . 1 35 35 SER N N 15 112.832 0.3 . 1 . . . . . 35 SER N . 50151 1
59 . 1 . 1 36 36 ALA H H 1 7.695 0.020 . 1 . . . . . 36 ALA H . 50151 1
60 . 1 . 1 36 36 ALA C C 13 180.705 0.3 . 1 . . . . . 36 ALA C . 50151 1
61 . 1 . 1 36 36 ALA CA C 13 54.533 0.3 . 1 . . . . . 36 ALA CA . 50151 1
62 . 1 . 1 36 36 ALA CB C 13 18.219 0.3 . 1 . . . . . 36 ALA CB . 50151 1
63 . 1 . 1 36 36 ALA N N 15 125.026 0.3 . 1 . . . . . 36 ALA N . 50151 1
64 . 1 . 1 37 37 LEU H H 1 8.265 0.020 . 1 . . . . . 37 LEU H . 50151 1
65 . 1 . 1 37 37 LEU C C 13 177.343 0.3 . 1 . . . . . 37 LEU C . 50151 1
66 . 1 . 1 37 37 LEU CA C 13 57.767 0.3 . 1 . . . . . 37 LEU CA . 50151 1
67 . 1 . 1 37 37 LEU CB C 13 40.417 0.3 . 1 . . . . . 37 LEU CB . 50151 1
68 . 1 . 1 37 37 LEU N N 15 121.566 0.3 . 1 . . . . . 37 LEU N . 50151 1
69 . 1 . 1 38 38 LEU H H 1 8.334 0.020 . 1 . . . . . 38 LEU H . 50151 1
70 . 1 . 1 38 38 LEU C C 13 180.534 0.3 . 1 . . . . . 38 LEU C . 50151 1
71 . 1 . 1 38 38 LEU CA C 13 57.828 0.3 . 1 . . . . . 38 LEU CA . 50151 1
72 . 1 . 1 38 38 LEU CB C 13 40.319 0.3 . 1 . . . . . 38 LEU CB . 50151 1
73 . 1 . 1 38 38 LEU N N 15 117.033 0.3 . 1 . . . . . 38 LEU N . 50151 1
74 . 1 . 1 39 39 LEU H H 1 7.608 0.020 . 1 . . . . . 39 LEU H . 50151 1
75 . 1 . 1 39 39 LEU C C 13 179.749 0.3 . 1 . . . . . 39 LEU C . 50151 1
76 . 1 . 1 39 39 LEU CA C 13 57.737 0.3 . 1 . . . . . 39 LEU CA . 50151 1
77 . 1 . 1 39 39 LEU CB C 13 41.340 0.3 . 1 . . . . . 39 LEU CB . 50151 1
78 . 1 . 1 39 39 LEU N N 15 119.363 0.3 . 1 . . . . . 39 LEU N . 50151 1
79 . 1 . 1 40 40 ALA H H 1 7.723 0.020 . 1 . . . . . 40 ALA H . 50151 1
80 . 1 . 1 40 40 ALA C C 13 178.572 0.3 . 1 . . . . . 40 ALA C . 50151 1
81 . 1 . 1 40 40 ALA CA C 13 53.748 0.3 . 1 . . . . . 40 ALA CA . 50151 1
82 . 1 . 1 40 40 ALA CB C 13 18.153 0.3 . 1 . . . . . 40 ALA CB . 50151 1
83 . 1 . 1 40 40 ALA N N 15 121.576 0.3 . 1 . . . . . 40 ALA N . 50151 1
84 . 1 . 1 41 41 LEU H H 1 7.615 0.020 . 1 . . . . . 41 LEU H . 50151 1
85 . 1 . 1 41 41 LEU C C 13 177.940 0.3 . 1 . . . . . 41 LEU C . 50151 1
86 . 1 . 1 41 41 LEU CA C 13 53.868 0.3 . 1 . . . . . 41 LEU CA . 50151 1
87 . 1 . 1 41 41 LEU CB C 13 41.468 0.3 . 1 . . . . . 41 LEU CB . 50151 1
88 . 1 . 1 41 41 LEU N N 15 113.156 0.3 . 1 . . . . . 41 LEU N . 50151 1
89 . 1 . 1 42 42 GLN H H 1 7.592 0.020 . 1 . . . . . 42 GLN H . 50151 1
90 . 1 . 1 42 42 GLN C C 13 175.210 0.3 . 1 . . . . . 42 GLN C . 50151 1
91 . 1 . 1 42 42 GLN CA C 13 60.396 0.3 . 1 . . . . . 42 GLN CA . 50151 1
92 . 1 . 1 42 42 GLN CB C 13 26.070 0.3 . 1 . . . . . 42 GLN CB . 50151 1
93 . 1 . 1 42 42 GLN N N 15 123.496 0.3 . 1 . . . . . 42 GLN N . 50151 1
94 . 1 . 1 44 44 LEU H H 1 7.783 0.020 . 1 . . . . . 44 LEU H . 50151 1
95 . 1 . 1 44 44 LEU C C 13 177.923 0.3 . 1 . . . . . 44 LEU C . 50151 1
96 . 1 . 1 44 44 LEU CA C 13 55.712 0.3 . 1 . . . . . 44 LEU CA . 50151 1
97 . 1 . 1 44 44 LEU CB C 13 41.010 0.3 . 1 . . . . . 44 LEU CB . 50151 1
98 . 1 . 1 44 44 LEU N N 15 114.835 0.3 . 1 . . . . . 44 LEU N . 50151 1
99 . 1 . 1 45 45 GLY H H 1 7.652 0.020 . 1 . . . . . 45 GLY H . 50151 1
100 . 1 . 1 45 45 GLY C C 13 172.138 0.3 . 1 . . . . . 45 GLY C . 50151 1
101 . 1 . 1 45 45 GLY CA C 13 44.652 0.3 . 1 . . . . . 45 GLY CA . 50151 1
102 . 1 . 1 45 45 GLY N N 15 104.639 0.3 . 1 . . . . . 45 GLY N . 50151 1
103 . 1 . 1 47 47 GLY H H 1 8.277 0.020 . 1 . . . . . 47 GLY H . 50151 1
104 . 1 . 1 47 47 GLY C C 13 172.514 0.3 . 1 . . . . . 47 GLY C . 50151 1
105 . 1 . 1 47 47 GLY CA C 13 44.740 0.3 . 1 . . . . . 47 GLY CA . 50151 1
106 . 1 . 1 47 47 GLY N N 15 108.478 0.3 . 1 . . . . . 47 GLY N . 50151 1
107 . 1 . 1 48 48 LEU H H 1 7.711 0.020 . 1 . . . . . 48 LEU H . 50151 1
108 . 1 . 1 48 48 LEU C C 13 175.227 0.3 . 1 . . . . . 48 LEU C . 50151 1
109 . 1 . 1 48 48 LEU CA C 13 55.583 0.3 . 1 . . . . . 48 LEU CA . 50151 1
110 . 1 . 1 48 48 LEU CB C 13 40.546 0.3 . 1 . . . . . 48 LEU CB . 50151 1
111 . 1 . 1 48 48 LEU N N 15 122.440 0.3 . 1 . . . . . 48 LEU N . 50151 1
112 . 1 . 1 49 49 GLN H H 1 9.105 0.020 . 1 . . . . . 49 GLN H . 50151 1
113 . 1 . 1 49 49 GLN C C 13 175.568 0.3 . 1 . . . . . 49 GLN C . 50151 1
114 . 1 . 1 49 49 GLN CA C 13 56.014 0.3 . 1 . . . . . 49 GLN CA . 50151 1
115 . 1 . 1 49 49 GLN CB C 13 30.858 0.3 . 1 . . . . . 49 GLN CB . 50151 1
116 . 1 . 1 49 49 GLN N N 15 127.917 0.3 . 1 . . . . . 49 GLN N . 50151 1
117 . 1 . 1 50 50 GLU H H 1 7.590 0.020 . 1 . . . . . 50 GLU H . 50151 1
118 . 1 . 1 50 50 GLU C C 13 172.855 0.3 . 1 . . . . . 50 GLU C . 50151 1
119 . 1 . 1 50 50 GLU CA C 13 54.881 0.3 . 1 . . . . . 50 GLU CA . 50151 1
120 . 1 . 1 50 50 GLU CB C 13 33.504 0.3 . 1 . . . . . 50 GLU CB . 50151 1
121 . 1 . 1 50 50 GLU N N 15 116.230 0.3 . 1 . . . . . 50 GLU N . 50151 1
122 . 1 . 1 51 51 ALA H H 1 8.800 0.020 . 1 . . . . . 51 ALA H . 50151 1
123 . 1 . 1 51 51 ALA C C 13 175.159 0.3 . 1 . . . . . 51 ALA C . 50151 1
124 . 1 . 1 51 51 ALA CA C 13 50.303 0.3 . 1 . . . . . 51 ALA CA . 50151 1
125 . 1 . 1 51 51 ALA CB C 13 21.876 0.3 . 1 . . . . . 51 ALA CB . 50151 1
126 . 1 . 1 51 51 ALA N N 15 124.943 0.3 . 1 . . . . . 51 ALA N . 50151 1
127 . 1 . 1 52 52 ARG H H 1 8.560 0.020 . 1 . . . . . 52 ARG H . 50151 1
128 . 1 . 1 52 52 ARG C C 13 173.793 0.3 . 1 . . . . . 52 ARG C . 50151 1
129 . 1 . 1 52 52 ARG CA C 13 54.322 0.3 . 1 . . . . . 52 ARG CA . 50151 1
130 . 1 . 1 52 52 ARG CB C 13 33.232 0.3 . 1 . . . . . 52 ARG CB . 50151 1
131 . 1 . 1 52 52 ARG N N 15 121.308 0.3 . 1 . . . . . 52 ARG N . 50151 1
132 . 1 . 1 53 53 LEU H H 1 8.588 0.020 . 1 . . . . . 53 LEU H . 50151 1
133 . 1 . 1 53 53 LEU C C 13 178.586 0.3 . 1 . . . . . 53 LEU C . 50151 1
134 . 1 . 1 53 53 LEU CA C 13 52.862 0.3 . 1 . . . . . 53 LEU CA . 50151 1
135 . 1 . 1 53 53 LEU CB C 13 43.984 0.3 . 1 . . . . . 53 LEU CB . 50151 1
136 . 1 . 1 53 53 LEU N N 15 123.636 0.3 . 1 . . . . . 53 LEU N . 50151 1
137 . 1 . 1 54 54 LEU H H 1 9.182 0.020 . 1 . . . . . 54 LEU H . 50151 1
138 . 1 . 1 54 54 LEU C C 13 173.401 0.3 . 1 . . . . . 54 LEU C . 50151 1
139 . 1 . 1 54 54 LEU CA C 13 53.514 0.3 . 1 . . . . . 54 LEU CA . 50151 1
140 . 1 . 1 54 54 LEU CB C 13 43.666 0.3 . 1 . . . . . 54 LEU CB . 50151 1
141 . 1 . 1 54 54 LEU N N 15 126.320 0.3 . 1 . . . . . 54 LEU N . 50151 1
142 . 1 . 1 56 56 SER H H 1 8.181 0.020 . 1 . . . . . 56 SER H . 50151 1
143 . 1 . 1 56 56 SER C C 13 174.544 0.3 . 1 . . . . . 56 SER C . 50151 1
144 . 1 . 1 56 56 SER CA C 13 56.014 0.3 . 1 . . . . . 56 SER CA . 50151 1
145 . 1 . 1 56 56 SER CB C 13 62.039 0.3 . 1 . . . . . 56 SER CB . 50151 1
146 . 1 . 1 56 56 SER N N 15 117.705 0.3 . 1 . . . . . 56 SER N . 50151 1
147 . 1 . 1 58 58 GLY H H 1 8.099 0.020 . 1 . . . . . 58 GLY H . 50151 1
148 . 1 . 1 58 58 GLY C C 13 171.865 0.3 . 1 . . . . . 58 GLY C . 50151 1
149 . 1 . 1 58 58 GLY CA C 13 44.410 0.3 . 1 . . . . . 58 GLY CA . 50151 1
150 . 1 . 1 58 58 GLY N N 15 109.580 0.3 . 1 . . . . . 58 GLY N . 50151 1
151 . 1 . 1 60 60 ALA H H 1 8.341 0.020 . 1 . . . . . 60 ALA H . 50151 1
152 . 1 . 1 60 60 ALA C C 13 175.722 0.3 . 1 . . . . . 60 ALA C . 50151 1
153 . 1 . 1 60 60 ALA CA C 13 50.665 0.3 . 1 . . . . . 60 ALA CA . 50151 1
154 . 1 . 1 60 60 ALA CB C 13 17.000 0.3 . 1 . . . . . 60 ALA CB . 50151 1
155 . 1 . 1 60 60 ALA N N 15 127.164 0.3 . 1 . . . . . 60 ALA N . 50151 1
156 . 1 . 1 62 62 GLY H H 1 8.199 0.020 . 1 . . . . . 62 GLY H . 50151 1
157 . 1 . 1 62 62 GLY C C 13 172.104 0.3 . 1 . . . . . 62 GLY C . 50151 1
158 . 1 . 1 62 62 GLY CA C 13 44.621 0.3 . 1 . . . . . 62 GLY CA . 50151 1
159 . 1 . 1 62 62 GLY N N 15 109.877 0.3 . 1 . . . . . 62 GLY N . 50151 1
160 . 1 . 1 63 63 GLN H H 1 8.643 0.020 . 1 . . . . . 63 GLN H . 50151 1
161 . 1 . 1 63 63 GLN C C 13 172.599 0.3 . 1 . . . . . 63 GLN C . 50151 1
162 . 1 . 1 63 63 GLN CA C 13 54.654 0.3 . 1 . . . . . 63 GLN CA . 50151 1
163 . 1 . 1 63 63 GLN CB C 13 35.758 0.3 . 1 . . . . . 63 GLN CB . 50151 1
164 . 1 . 1 63 63 GLN N N 15 118.741 0.3 . 1 . . . . . 63 GLN N . 50151 1
165 . 1 . 1 64 64 ILE H H 1 9.397 0.020 . 1 . . . . . 64 ILE H . 50151 1
166 . 1 . 1 64 64 ILE C C 13 172.727 0.3 . 1 . . . . . 64 ILE C . 50151 1
167 . 1 . 1 64 64 ILE CA C 13 57.706 0.3 . 1 . . . . . 64 ILE CA . 50151 1
168 . 1 . 1 64 64 ILE CB C 13 42.086 0.3 . 1 . . . . . 64 ILE CB . 50151 1
169 . 1 . 1 64 64 ILE N N 15 121.132 0.3 . 1 . . . . . 64 ILE N . 50151 1
170 . 1 . 1 65 65 ALA H H 1 9.180 0.020 . 1 . . . . . 65 ALA H . 50151 1
171 . 1 . 1 65 65 ALA C C 13 175.637 0.3 . 1 . . . . . 65 ALA C . 50151 1
172 . 1 . 1 65 65 ALA CA C 13 48.459 0.3 . 1 . . . . . 65 ALA CA . 50151 1
173 . 1 . 1 65 65 ALA CB C 13 20.799 0.3 . 1 . . . . . 65 ALA CB . 50151 1
174 . 1 . 1 65 65 ALA N N 15 126.168 0.3 . 1 . . . . . 65 ALA N . 50151 1
175 . 1 . 1 66 66 LEU H H 1 8.927 0.020 . 1 . . . . . 66 LEU H . 50151 1
176 . 1 . 1 66 66 LEU C C 13 176.439 0.3 . 1 . . . . . 66 LEU C . 50151 1
177 . 1 . 1 66 66 LEU CA C 13 52.953 0.3 . 1 . . . . . 66 LEU CA . 50151 1
178 . 1 . 1 66 66 LEU CB C 13 40.995 0.3 . 1 . . . . . 66 LEU CB . 50151 1
179 . 1 . 1 66 66 LEU N N 15 122.312 0.3 . 1 . . . . . 66 LEU N . 50151 1
180 . 1 . 1 67 67 LEU H H 1 9.369 0.020 . 1 . . . . . 67 LEU H . 50151 1
181 . 1 . 1 67 67 LEU C C 13 174.442 0.3 . 1 . . . . . 67 LEU C . 50151 1
182 . 1 . 1 67 67 LEU CA C 13 53.249 0.3 . 1 . . . . . 67 LEU CA . 50151 1
183 . 1 . 1 67 67 LEU CB C 13 44.139 0.3 . 1 . . . . . 67 LEU CB . 50151 1
184 . 1 . 1 67 67 LEU N N 15 124.964 0.3 . 1 . . . . . 67 LEU N . 50151 1
185 . 1 . 1 68 68 LYS H H 1 8.592 0.020 . 1 . . . . . 68 LYS H . 50151 1
186 . 1 . 1 68 68 LYS C C 13 174.613 0.3 . 1 . . . . . 68 LYS C . 50151 1
187 . 1 . 1 68 68 LYS CA C 13 54.950 0.3 . 1 . . . . . 68 LYS CA . 50151 1
188 . 1 . 1 68 68 LYS CB C 13 35.041 0.3 . 1 . . . . . 68 LYS CB . 50151 1
189 . 1 . 1 68 68 LYS N N 15 123.735 0.3 . 1 . . . . . 68 LYS N . 50151 1
190 . 1 . 1 69 69 PHE H H 1 8.896 0.020 . 1 . . . . . 69 PHE H . 50151 1
191 . 1 . 1 69 69 PHE C C 13 175.210 0.3 . 1 . . . . . 69 PHE C . 50151 1
192 . 1 . 1 69 69 PHE CA C 13 56.407 0.3 . 1 . . . . . 69 PHE CA . 50151 1
193 . 1 . 1 69 69 PHE CB C 13 42.535 0.3 . 1 . . . . . 69 PHE CB . 50151 1
194 . 1 . 1 69 69 PHE N N 15 124.998 0.3 . 1 . . . . . 69 PHE N . 50151 1
195 . 1 . 1 70 70 SER H H 1 9.200 0.020 . 1 . . . . . 70 SER H . 50151 1
196 . 1 . 1 70 70 SER C C 13 173.964 0.3 . 1 . . . . . 70 SER C . 50151 1
197 . 1 . 1 70 70 SER CA C 13 58.492 0.3 . 1 . . . . . 70 SER CA . 50151 1
198 . 1 . 1 70 70 SER CB C 13 63.386 0.3 . 1 . . . . . 70 SER CB . 50151 1
199 . 1 . 1 70 70 SER N N 15 111.547 0.3 . 1 . . . . . 70 SER N . 50151 1
200 . 1 . 1 71 71 SER H H 1 7.529 0.020 . 1 . . . . . 71 SER H . 50151 1
201 . 1 . 1 71 71 SER C C 13 173.776 0.3 . 1 . . . . . 71 SER C . 50151 1
202 . 1 . 1 71 71 SER CA C 13 56.954 0.3 . 1 . . . . . 71 SER CA . 50151 1
203 . 1 . 1 71 71 SER CB C 13 65.656 0.3 . 1 . . . . . 71 SER CB . 50151 1
204 . 1 . 1 71 71 SER N N 15 111.706 0.3 . 1 . . . . . 71 SER N . 50151 1
205 . 1 . 1 74 74 ALA H H 1 7.983 0.020 . 1 . . . . . 74 ALA H . 50151 1
206 . 1 . 1 74 74 ALA C C 13 179.749 0.3 . 1 . . . . . 74 ALA C . 50151 1
207 . 1 . 1 74 74 ALA CA C 13 54.412 0.3 . 1 . . . . . 74 ALA CA . 50151 1
208 . 1 . 1 74 74 ALA CB C 13 17.794 0.3 . 1 . . . . . 74 ALA CB . 50151 1
209 . 1 . 1 74 74 ALA N N 15 119.969 0.3 . 1 . . . . . 74 ALA N . 50151 1
210 . 1 . 1 75 75 ALA H H 1 7.461 0.020 . 1 . . . . . 75 ALA H . 50151 1
211 . 1 . 1 75 75 ALA C C 13 177.770 0.3 . 1 . . . . . 75 ALA C . 50151 1
212 . 1 . 1 75 75 ALA CA C 13 54.101 0.3 . 1 . . . . . 75 ALA CA . 50151 1
213 . 1 . 1 75 75 ALA CB C 13 18.149 0.3 . 1 . . . . . 75 ALA CB . 50151 1
214 . 1 . 1 75 75 ALA N N 15 121.649 0.3 . 1 . . . . . 75 ALA N . 50151 1
215 . 1 . 1 76 76 ALA H H 1 8.858 0.020 . 1 . . . . . 76 ALA H . 50151 1
216 . 1 . 1 76 76 ALA C C 13 181.336 0.3 . 1 . . . . . 76 ALA C . 50151 1
217 . 1 . 1 76 76 ALA CA C 13 54.510 0.3 . 1 . . . . . 76 ALA CA . 50151 1
218 . 1 . 1 76 76 ALA CB C 13 17.128 0.3 . 1 . . . . . 76 ALA CB . 50151 1
219 . 1 . 1 76 76 ALA N N 15 120.434 0.3 . 1 . . . . . 76 ALA N . 50151 1
220 . 1 . 1 77 77 MET H H 1 8.169 0.020 . 1 . . . . . 77 MET H . 50151 1
221 . 1 . 1 77 77 MET C C 13 178.708 0.3 . 1 . . . . . 77 MET C . 50151 1
222 . 1 . 1 77 77 MET CA C 13 57.730 0.3 . 1 . . . . . 77 MET CA . 50151 1
223 . 1 . 1 77 77 MET CB C 13 31.564 0.3 . 1 . . . . . 77 MET CB . 50151 1
224 . 1 . 1 77 77 MET N N 15 118.395 0.3 . 1 . . . . . 77 MET N . 50151 1
225 . 1 . 1 78 78 ALA H H 1 7.605 0.020 . 1 . . . . . 78 ALA H . 50151 1
226 . 1 . 1 78 78 ALA C C 13 178.069 0.3 . 1 . . . . . 78 ALA C . 50151 1
227 . 1 . 1 78 78 ALA CA C 13 54.221 0.3 . 1 . . . . . 78 ALA CA . 50151 1
228 . 1 . 1 78 78 ALA CB C 13 19.311 0.3 . 1 . . . . . 78 ALA CB . 50151 1
229 . 1 . 1 78 78 ALA N N 15 124.056 0.3 . 1 . . . . . 78 ALA N . 50151 1
230 . 1 . 1 79 79 LYS H H 1 8.144 0.020 . 1 . . . . . 79 LYS H . 50151 1
231 . 1 . 1 79 79 LYS C C 13 177.241 0.3 . 1 . . . . . 79 LYS C . 50151 1
232 . 1 . 1 79 79 LYS CA C 13 59.882 0.3 . 1 . . . . . 79 LYS CA . 50151 1
233 . 1 . 1 79 79 LYS CB C 13 31.435 0.3 . 1 . . . . . 79 LYS CB . 50151 1
234 . 1 . 1 79 79 LYS N N 15 118.411 0.3 . 1 . . . . . 79 LYS N . 50151 1
235 . 1 . 1 80 80 LYS H H 1 7.264 0.020 . 1 . . . . . 80 LYS H . 50151 1
236 . 1 . 1 80 80 LYS C C 13 177.599 0.3 . 1 . . . . . 80 LYS C . 50151 1
237 . 1 . 1 80 80 LYS CA C 13 58.824 0.3 . 1 . . . . . 80 LYS CA . 50151 1
238 . 1 . 1 80 80 LYS CB C 13 32.156 0.3 . 1 . . . . . 80 LYS CB . 50151 1
239 . 1 . 1 80 80 LYS N N 15 116.586 0.3 . 1 . . . . . 80 LYS N . 50151 1
240 . 1 . 1 81 81 ALA H H 1 7.808 0.020 . 1 . . . . . 81 ALA H . 50151 1
241 . 1 . 1 81 81 ALA C C 13 180.654 0.3 . 1 . . . . . 81 ALA C . 50151 1
242 . 1 . 1 81 81 ALA CA C 13 54.624 0.3 . 1 . . . . . 81 ALA CA . 50151 1
243 . 1 . 1 81 81 ALA CB C 13 17.730 0.3 . 1 . . . . . 81 ALA CB . 50151 1
244 . 1 . 1 81 81 ALA N N 15 120.590 0.3 . 1 . . . . . 81 ALA N . 50151 1
245 . 1 . 1 82 82 LEU H H 1 8.365 0.020 . 1 . . . . . 82 LEU H . 50151 1
246 . 1 . 1 82 82 LEU C C 13 179.135 0.3 . 1 . . . . . 82 LEU C . 50151 1
247 . 1 . 1 82 82 LEU CA C 13 57.072 0.3 . 1 . . . . . 82 LEU CA . 50151 1
248 . 1 . 1 82 82 LEU CB C 13 42.406 0.3 . 1 . . . . . 82 LEU CB . 50151 1
249 . 1 . 1 82 82 LEU N N 15 117.455 0.3 . 1 . . . . . 82 LEU N . 50151 1
250 . 1 . 1 83 83 VAL H H 1 7.948 0.020 . 1 . . . . . 83 VAL H . 50151 1
251 . 1 . 1 83 83 VAL C C 13 178.094 0.3 . 1 . . . . . 83 VAL C . 50151 1
252 . 1 . 1 83 83 VAL CA C 13 64.476 0.3 . 1 . . . . . 83 VAL CA . 50151 1
253 . 1 . 1 83 83 VAL CB C 13 31.451 0.3 . 1 . . . . . 83 VAL CB . 50151 1
254 . 1 . 1 83 83 VAL N N 15 117.078 0.3 . 1 . . . . . 83 VAL N . 50151 1
255 . 1 . 1 84 84 GLU H H 1 8.213 0.020 . 1 . . . . . 84 GLU H . 50151 1
256 . 1 . 1 84 84 GLU C C 13 177.574 0.3 . 1 . . . . . 84 GLU C . 50151 1
257 . 1 . 1 84 84 GLU CA C 13 57.193 0.3 . 1 . . . . . 84 GLU CA . 50151 1
258 . 1 . 1 84 84 GLU CB C 13 28.765 0.3 . 1 . . . . . 84 GLU CB . 50151 1
259 . 1 . 1 84 84 GLU N N 15 119.854 0.3 . 1 . . . . . 84 GLU N . 50151 1
260 . 1 . 1 85 85 GLY H H 1 7.823 0.020 . 1 . . . . . 85 GLY H . 50151 1
261 . 1 . 1 85 85 GLY C C 13 174.527 0.3 . 1 . . . . . 85 GLY C . 50151 1
262 . 1 . 1 85 85 GLY CA C 13 45.860 0.3 . 1 . . . . . 85 GLY CA . 50151 1
263 . 1 . 1 85 85 GLY N N 15 108.043 0.3 . 1 . . . . . 85 GLY N . 50151 1
264 . 1 . 1 86 86 GLN H H 1 8.104 0.020 . 1 . . . . . 86 GLN H . 50151 1
265 . 1 . 1 86 86 GLN C C 13 175.619 0.3 . 1 . . . . . 86 GLN C . 50151 1
266 . 1 . 1 86 86 GLN CA C 13 55.863 0.3 . 1 . . . . . 86 GLN CA . 50151 1
267 . 1 . 1 86 86 GLN CB C 13 27.650 0.3 . 1 . . . . . 86 GLN CB . 50151 1
268 . 1 . 1 86 86 GLN N N 15 117.237 0.3 . 1 . . . . . 86 GLN N . 50151 1
269 . 1 . 1 87 87 SER H H 1 8.157 0.020 . 1 . . . . . 87 SER H . 50151 1
270 . 1 . 1 87 87 SER C C 13 175.551 0.3 . 1 . . . . . 87 SER C . 50151 1
271 . 1 . 1 87 87 SER CA C 13 58.341 0.3 . 1 . . . . . 87 SER CA . 50151 1
272 . 1 . 1 87 87 SER CB C 13 63.194 0.3 . 1 . . . . . 87 SER CB . 50151 1
273 . 1 . 1 87 87 SER N N 15 113.387 0.3 . 1 . . . . . 87 SER N . 50151 1
274 . 1 . 1 89 89 LEU H H 1 8.452 0.020 . 1 . . . . . 89 LEU H . 50151 1
275 . 1 . 1 89 89 LEU C C 13 175.585 0.3 . 1 . . . . . 89 LEU C . 50151 1
276 . 1 . 1 89 89 LEU CA C 13 55.107 0.3 . 1 . . . . . 89 LEU CA . 50151 1
277 . 1 . 1 89 89 LEU CB C 13 43.457 0.3 . 1 . . . . . 89 LEU CB . 50151 1
278 . 1 . 1 89 89 LEU N N 15 122.313 0.3 . 1 . . . . . 89 LEU N . 50151 1
279 . 1 . 1 90 90 CYS H H 1 8.624 0.020 . 1 . . . . . 90 CYS H . 50151 1
280 . 1 . 1 90 90 CYS C C 13 174.408 0.3 . 1 . . . . . 90 CYS C . 50151 1
281 . 1 . 1 90 90 CYS CA C 13 59.066 0.3 . 1 . . . . . 90 CYS CA . 50151 1
282 . 1 . 1 90 90 CYS CB C 13 26.519 0.3 . 1 . . . . . 90 CYS CB . 50151 1
283 . 1 . 1 90 90 CYS N N 15 117.735 0.3 . 1 . . . . . 90 CYS N . 50151 1
284 . 1 . 1 91 91 GLY H H 1 8.315 0.020 . 1 . . . . . 91 GLY H . 50151 1
285 . 1 . 1 91 91 GLY C C 13 173.759 0.3 . 1 . . . . . 91 GLY C . 50151 1
286 . 1 . 1 91 91 GLY CA C 13 44.770 0.3 . 1 . . . . . 91 GLY CA . 50151 1
287 . 1 . 1 91 91 GLY N N 15 106.734 0.3 . 1 . . . . . 91 GLY N . 50151 1
288 . 1 . 1 94 94 VAL H H 1 7.975 0.020 . 1 . . . . . 94 VAL H . 50151 1
289 . 1 . 1 94 94 VAL C C 13 174.920 0.3 . 1 . . . . . 94 VAL C . 50151 1
290 . 1 . 1 94 94 VAL CA C 13 60.003 0.3 . 1 . . . . . 94 VAL CA . 50151 1
291 . 1 . 1 94 94 VAL CB C 13 33.128 0.3 . 1 . . . . . 94 VAL CB . 50151 1
292 . 1 . 1 94 94 VAL N N 15 118.929 0.3 . 1 . . . . . 94 VAL N . 50151 1
293 . 1 . 1 95 95 ALA H H 1 8.271 0.020 . 1 . . . . . 95 ALA H . 50151 1
294 . 1 . 1 95 95 ALA C C 13 176.507 0.3 . 1 . . . . . 95 ALA C . 50151 1
295 . 1 . 1 95 95 ALA CA C 13 50.393 0.3 . 1 . . . . . 95 ALA CA . 50151 1
296 . 1 . 1 95 95 ALA CB C 13 20.143 0.3 . 1 . . . . . 95 ALA CB . 50151 1
297 . 1 . 1 95 95 ALA N N 15 125.809 0.3 . 1 . . . . . 95 ALA N . 50151 1
298 . 1 . 1 96 96 VAL H H 1 8.783 0.020 . 1 . . . . . 96 VAL H . 50151 1
299 . 1 . 1 96 96 VAL C C 13 174.271 0.3 . 1 . . . . . 96 VAL C . 50151 1
300 . 1 . 1 96 96 VAL CA C 13 60.396 0.3 . 1 . . . . . 96 VAL CA . 50151 1
301 . 1 . 1 96 96 VAL CB C 13 32.462 0.3 . 1 . . . . . 96 VAL CB . 50151 1
302 . 1 . 1 96 96 VAL N N 15 126.063 0.3 . 1 . . . . . 96 VAL N . 50151 1
303 . 1 . 1 97 97 GLU H H 1 8.669 0.020 . 1 . . . . . 97 GLU H . 50151 1
304 . 1 . 1 97 97 GLU C C 13 175.364 0.3 . 1 . . . . . 97 GLU C . 50151 1
305 . 1 . 1 97 97 GLU CA C 13 53.476 0.3 . 1 . . . . . 97 GLU CA . 50151 1
306 . 1 . 1 97 97 GLU CB C 13 32.975 0.3 . 1 . . . . . 97 GLU CB . 50151 1
307 . 1 . 1 97 97 GLU N N 15 125.189 0.3 . 1 . . . . . 97 GLU N . 50151 1
308 . 1 . 1 98 98 TRP H H 1 8.773 0.020 . 1 . . . . . 98 TRP H . 50151 1
309 . 1 . 1 98 98 TRP HE1 H 1 10.015 0.020 . 1 . . . . . 98 TRP HE1 . 50151 1
310 . 1 . 1 98 98 TRP C C 13 176.882 0.3 . 1 . . . . . 98 TRP C . 50151 1
311 . 1 . 1 98 98 TRP CA C 13 57.616 0.3 . 1 . . . . . 98 TRP CA . 50151 1
312 . 1 . 1 98 98 TRP CB C 13 29.318 0.3 . 1 . . . . . 98 TRP CB . 50151 1
313 . 1 . 1 98 98 TRP N N 15 120.891 0.3 . 1 . . . . . 98 TRP N . 50151 1
314 . 1 . 1 98 98 TRP NE1 N 15 129.320 0.3 . 1 . . . . . 98 TRP NE1 . 50151 1
315 . 1 . 1 99 99 LEU H H 1 8.445 0.020 . 1 . . . . . 99 LEU H . 50151 1
316 . 1 . 1 99 99 LEU C C 13 175.261 0.3 . 1 . . . . . 99 LEU C . 50151 1
317 . 1 . 1 99 99 LEU CA C 13 55.107 0.3 . 1 . . . . . 99 LEU CA . 50151 1
318 . 1 . 1 99 99 LEU CB C 13 42.086 0.3 . 1 . . . . . 99 LEU CB . 50151 1
319 . 1 . 1 99 99 LEU N N 15 126.196 0.3 . 1 . . . . . 99 LEU N . 50151 1
320 . 1 . 1 100 100 LYS H H 1 7.925 0.020 . 1 . . . . . 100 LYS H . 50151 1
321 . 1 . 1 100 100 LYS C C 13 180.739 0.3 . 1 . . . . . 100 LYS C . 50151 1
322 . 1 . 1 100 100 LYS CA C 13 57.374 0.3 . 1 . . . . . 100 LYS CA . 50151 1
323 . 1 . 1 100 100 LYS CB C 13 33.039 0.3 . 1 . . . . . 100 LYS CB . 50151 1
324 . 1 . 1 100 100 LYS N N 15 128.578 0.3 . 1 . . . . . 100 LYS N . 50151 1
stop_
save_