Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 16069
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D CBCA(CO)NH' . . . 16069 1
2 '3D HNCACB' . . . 16069 1
3 '3D HNCA' . . . 16069 1
4 '3D HN(CO)CA' . . . 16069 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 $Analysis_CCPN . . 16069 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.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 5 5 ASN CA C 13 53.295 0.050 . 1 . . . . 5 ASN CA . 16069 1
2 . 1 1 5 5 ASN CB C 13 38.795 0.050 . 1 . . . . 5 ASN CB . 16069 1
3 . 1 1 6 6 ALA H H 1 8.109 0.002 . 1 . . . . 6 ALA H . 16069 1
4 . 1 1 6 6 ALA CA C 13 52.841 0.057 . 1 . . . . 6 ALA CA . 16069 1
5 . 1 1 6 6 ALA CB C 13 19.191 0.050 . 1 . . . . 6 ALA CB . 16069 1
6 . 1 1 6 6 ALA N N 15 124.089 0.024 . 1 . . . . 6 ALA N . 16069 1
7 . 1 1 7 7 ARG H H 1 8.173 0.002 . 1 . . . . 7 ARG H . 16069 1
8 . 1 1 7 7 ARG CA C 13 56.416 0.050 . 1 . . . . 7 ARG CA . 16069 1
9 . 1 1 7 7 ARG CB C 13 30.587 0.050 . 1 . . . . 7 ARG CB . 16069 1
10 . 1 1 7 7 ARG N N 15 119.588 0.012 . 1 . . . . 7 ARG N . 16069 1
11 . 1 1 9 9 GLY CA C 13 45.606 0.050 . 1 . . . . 9 GLY CA . 16069 1
12 . 1 1 10 10 ILE H H 1 7.974 0.010 . 1 . . . . 10 ILE H . 16069 1
13 . 1 1 10 10 ILE CA C 13 61.159 0.005 . 1 . . . . 10 ILE CA . 16069 1
14 . 1 1 10 10 ILE CB C 13 39.871 0.116 . 1 . . . . 10 ILE CB . 16069 1
15 . 1 1 10 10 ILE N N 15 120.994 0.014 . 1 . . . . 10 ILE N . 16069 1
16 . 1 1 11 11 LEU H H 1 8.790 0.002 . 1 . . . . 11 LEU H . 16069 1
17 . 1 1 11 11 LEU CA C 13 54.164 0.007 . 1 . . . . 11 LEU CA . 16069 1
18 . 1 1 11 11 LEU CB C 13 44.270 0.055 . 1 . . . . 11 LEU CB . 16069 1
19 . 1 1 11 11 LEU N N 15 129.257 0.018 . 1 . . . . 11 LEU N . 16069 1
20 . 1 1 12 12 SER H H 1 8.391 0.003 . 1 . . . . 12 SER H . 16069 1
21 . 1 1 12 12 SER CA C 13 57.183 0.024 . 1 . . . . 12 SER CA . 16069 1
22 . 1 1 12 12 SER CB C 13 65.200 0.073 . 1 . . . . 12 SER CB . 16069 1
23 . 1 1 12 12 SER N N 15 117.106 0.011 . 1 . . . . 12 SER N . 16069 1
24 . 1 1 13 13 LEU H H 1 8.243 0.001 . 1 . . . . 13 LEU H . 16069 1
25 . 1 1 13 13 LEU CA C 13 54.720 0.009 . 1 . . . . 13 LEU CA . 16069 1
26 . 1 1 13 13 LEU CB C 13 45.632 0.105 . 1 . . . . 13 LEU CB . 16069 1
27 . 1 1 13 13 LEU N N 15 124.784 0.018 . 1 . . . . 13 LEU N . 16069 1
28 . 1 1 14 14 ALA H H 1 8.734 0.005 . 1 . . . . 14 ALA H . 16069 1
29 . 1 1 14 14 ALA CA C 13 50.405 0.008 . 1 . . . . 14 ALA CA . 16069 1
30 . 1 1 14 14 ALA CB C 13 19.734 0.103 . 1 . . . . 14 ALA CB . 16069 1
31 . 1 1 14 14 ALA N N 15 130.104 0.012 . 1 . . . . 14 ALA N . 16069 1
32 . 1 1 15 15 LEU H H 1 8.299 0.004 . 1 . . . . 15 LEU H . 16069 1
33 . 1 1 15 15 LEU CA C 13 52.734 0.010 . 1 . . . . 15 LEU CA . 16069 1
34 . 1 1 15 15 LEU CB C 13 42.427 0.038 . 1 . . . . 15 LEU CB . 16069 1
35 . 1 1 15 15 LEU N N 15 125.227 0.022 . 1 . . . . 15 LEU N . 16069 1
36 . 1 1 16 16 LYS H H 1 8.733 0.008 . 1 . . . . 16 LYS H . 16069 1
37 . 1 1 16 16 LYS CA C 13 58.086 0.016 . 1 . . . . 16 LYS CA . 16069 1
38 . 1 1 16 16 LYS CB C 13 33.268 0.042 . 1 . . . . 16 LYS CB . 16069 1
39 . 1 1 16 16 LYS N N 15 120.664 0.022 . 1 . . . . 16 LYS N . 16069 1
40 . 1 1 17 17 ASP H H 1 7.348 0.001 . 1 . . . . 17 ASP H . 16069 1
41 . 1 1 17 17 ASP CA C 13 52.079 0.004 . 1 . . . . 17 ASP CA . 16069 1
42 . 1 1 17 17 ASP CB C 13 42.939 0.018 . 1 . . . . 17 ASP CB . 16069 1
43 . 1 1 17 17 ASP N N 15 113.751 0.032 . 1 . . . . 17 ASP N . 16069 1
44 . 1 1 18 18 LYS H H 1 9.077 0.001 . 1 . . . . 18 LYS H . 16069 1
45 . 1 1 18 18 LYS CA C 13 62.378 0.050 . 1 . . . . 18 LYS CA . 16069 1
46 . 1 1 18 18 LYS N N 15 118.799 0.014 . 1 . . . . 18 LYS N . 16069 1
47 . 1 1 19 19 PRO CA C 13 66.723 0.050 . 1 . . . . 19 PRO CA . 16069 1
48 . 1 1 20 20 ALA H H 1 8.219 0.050 . 1 . . . . 20 ALA H . 16069 1
49 . 1 1 20 20 ALA CA C 13 55.217 0.050 . 1 . . . . 20 ALA CA . 16069 1
50 . 1 1 20 20 ALA CB C 13 19.062 0.118 . 1 . . . . 20 ALA CB . 16069 1
51 . 1 1 20 20 ALA N N 15 120.438 0.016 . 1 . . . . 20 ALA N . 16069 1
52 . 1 1 21 21 LEU H H 1 7.878 0.002 . 1 . . . . 21 LEU H . 16069 1
53 . 1 1 21 21 LEU CA C 13 57.846 0.009 . 1 . . . . 21 LEU CA . 16069 1
54 . 1 1 21 21 LEU CB C 13 42.046 0.011 . 1 . . . . 21 LEU CB . 16069 1
55 . 1 1 21 21 LEU N N 15 119.842 0.019 . 1 . . . . 21 LEU N . 16069 1
56 . 1 1 22 22 TYR H H 1 9.083 0.005 . 1 . . . . 22 TYR H . 16069 1
57 . 1 1 22 22 TYR CA C 13 61.487 0.020 . 1 . . . . 22 TYR CA . 16069 1
58 . 1 1 22 22 TYR CB C 13 38.278 0.025 . 1 . . . . 22 TYR CB . 16069 1
59 . 1 1 22 22 TYR N N 15 120.069 0.011 . 1 . . . . 22 TYR N . 16069 1
60 . 1 1 23 23 SER H H 1 8.064 0.007 . 1 . . . . 23 SER H . 16069 1
61 . 1 1 23 23 SER CA C 13 61.056 0.039 . 1 . . . . 23 SER CA . 16069 1
62 . 1 1 23 23 SER CB C 13 63.582 0.056 . 1 . . . . 23 SER CB . 16069 1
63 . 1 1 23 23 SER N N 15 111.212 0.031 . 1 . . . . 23 SER N . 16069 1
64 . 1 1 24 24 ALA H H 1 7.591 0.001 . 1 . . . . 24 ALA H . 16069 1
65 . 1 1 24 24 ALA CA C 13 53.846 0.002 . 1 . . . . 24 ALA CA . 16069 1
66 . 1 1 24 24 ALA CB C 13 20.962 0.052 . 1 . . . . 24 ALA CB . 16069 1
67 . 1 1 24 24 ALA N N 15 121.885 0.020 . 1 . . . . 24 ALA N . 16069 1
68 . 1 1 25 25 TYR H H 1 8.099 0.004 . 1 . . . . 25 TYR H . 16069 1
69 . 1 1 25 25 TYR CA C 13 58.328 0.050 . 1 . . . . 25 TYR CA . 16069 1
70 . 1 1 25 25 TYR CB C 13 38.660 0.050 . 1 . . . . 25 TYR CB . 16069 1
71 . 1 1 25 25 TYR N N 15 118.665 0.020 . 1 . . . . 25 TYR N . 16069 1
72 . 1 1 29 29 VAL H H 1 6.388 0.050 . 1 . . . . 29 VAL H . 16069 1
73 . 1 1 29 29 VAL CA C 13 61.238 0.034 . 1 . . . . 29 VAL CA . 16069 1
74 . 1 1 29 29 VAL N N 15 122.991 0.018 . 1 . . . . 29 VAL N . 16069 1
75 . 1 1 30 30 LYS H H 1 8.824 0.003 . 1 . . . . 30 LYS H . 16069 1
76 . 1 1 30 30 LYS CA C 13 58.684 0.022 . 1 . . . . 30 LYS CA . 16069 1
77 . 1 1 30 30 LYS N N 15 130.438 0.015 . 1 . . . . 30 LYS N . 16069 1
78 . 1 1 31 31 GLY H H 1 8.820 0.007 . 1 . . . . 31 GLY H . 16069 1
79 . 1 1 31 31 GLY CA C 13 45.605 0.050 . 1 . . . . 31 GLY CA . 16069 1
80 . 1 1 31 31 GLY N N 15 116.464 0.018 . 1 . . . . 31 GLY N . 16069 1
81 . 1 1 32 32 GLY H H 1 8.176 0.050 . 1 . . . . 32 GLY H . 16069 1
82 . 1 1 32 32 GLY CA C 13 44.303 0.015 . 1 . . . . 32 GLY CA . 16069 1
83 . 1 1 32 32 GLY N N 15 107.684 0.019 . 1 . . . . 32 GLY N . 16069 1
84 . 1 1 33 33 GLY H H 1 6.151 0.010 . 1 . . . . 33 GLY H . 16069 1
85 . 1 1 33 33 GLY CA C 13 45.116 0.031 . 1 . . . . 33 GLY CA . 16069 1
86 . 1 1 33 33 GLY N N 15 104.687 0.050 . 1 . . . . 33 GLY N . 16069 1
87 . 1 1 34 34 ILE H H 1 8.688 0.001 . 1 . . . . 34 ILE H . 16069 1
88 . 1 1 34 34 ILE CA C 13 59.122 0.006 . 1 . . . . 34 ILE CA . 16069 1
89 . 1 1 34 34 ILE N N 15 118.885 0.013 . 1 . . . . 34 ILE N . 16069 1
90 . 1 1 35 35 PHE H H 1 8.758 0.001 . 1 . . . . 35 PHE H . 16069 1
91 . 1 1 35 35 PHE CA C 13 57.613 0.016 . 1 . . . . 35 PHE CA . 16069 1
92 . 1 1 35 35 PHE CB C 13 40.505 0.050 . 1 . . . . 35 PHE CB . 16069 1
93 . 1 1 35 35 PHE N N 15 128.559 0.019 . 1 . . . . 35 PHE N . 16069 1
94 . 1 1 36 36 VAL H H 1 8.513 0.004 . 1 . . . . 36 VAL H . 16069 1
95 . 1 1 36 36 VAL CA C 13 57.940 0.050 . 1 . . . . 36 VAL CA . 16069 1
96 . 1 1 36 36 VAL N N 15 127.304 0.014 . 1 . . . . 36 VAL N . 16069 1
97 . 1 1 38 38 THR H H 1 8.527 0.006 . 1 . . . . 38 THR H . 16069 1
98 . 1 1 38 38 THR N N 15 121.716 0.014 . 1 . . . . 38 THR N . 16069 1
99 . 1 1 39 39 PRO CA C 13 62.628 0.050 . 1 . . . . 39 PRO CA . 16069 1
100 . 1 1 39 39 PRO CB C 13 31.972 0.050 . 1 . . . . 39 PRO CB . 16069 1
101 . 1 1 40 40 LYS H H 1 8.101 0.003 . 1 . . . . 40 LYS H . 16069 1
102 . 1 1 40 40 LYS CA C 13 56.777 0.002 . 1 . . . . 40 LYS CA . 16069 1
103 . 1 1 40 40 LYS CB C 13 33.208 0.026 . 1 . . . . 40 LYS CB . 16069 1
104 . 1 1 40 40 LYS N N 15 123.599 0.013 . 1 . . . . 40 LYS N . 16069 1
105 . 1 1 41 41 ARG H H 1 8.140 0.001 . 1 . . . . 41 ARG H . 16069 1
106 . 1 1 41 41 ARG CA C 13 55.615 0.050 . 1 . . . . 41 ARG CA . 16069 1
107 . 1 1 41 41 ARG CB C 13 29.969 0.075 . 1 . . . . 41 ARG CB . 16069 1
108 . 1 1 41 41 ARG N N 15 122.613 0.052 . 1 . . . . 41 ARG N . 16069 1
109 . 1 1 42 42 TYR H H 1 8.298 0.001 . 1 . . . . 42 TYR H . 16069 1
110 . 1 1 42 42 TYR CA C 13 57.937 0.003 . 1 . . . . 42 TYR CA . 16069 1
111 . 1 1 42 42 TYR CB C 13 43.090 0.028 . 1 . . . . 42 TYR CB . 16069 1
112 . 1 1 42 42 TYR N N 15 124.519 0.017 . 1 . . . . 42 TYR N . 16069 1
113 . 1 1 43 43 MET H H 1 8.884 0.005 . 1 . . . . 43 MET H . 16069 1
114 . 1 1 43 43 MET CA C 13 53.238 0.014 . 1 . . . . 43 MET CA . 16069 1
115 . 1 1 43 43 MET CB C 13 34.263 0.056 . 1 . . . . 43 MET CB . 16069 1
116 . 1 1 43 43 MET N N 15 119.968 0.028 . 1 . . . . 43 MET N . 16069 1
117 . 1 1 44 44 LEU H H 1 8.280 0.001 . 1 . . . . 44 LEU H . 16069 1
118 . 1 1 44 44 LEU CA C 13 56.928 0.052 . 1 . . . . 44 LEU CA . 16069 1
119 . 1 1 44 44 LEU N N 15 121.032 0.022 . 1 . . . . 44 LEU N . 16069 1
120 . 1 1 45 45 GLY H H 1 9.063 0.005 . 1 . . . . 45 GLY H . 16069 1
121 . 1 1 45 45 GLY CA C 13 44.968 0.039 . 1 . . . . 45 GLY CA . 16069 1
122 . 1 1 45 45 GLY N N 15 112.996 0.033 . 1 . . . . 45 GLY N . 16069 1
123 . 1 1 46 46 ASP H H 1 8.033 0.050 . 1 . . . . 46 ASP H . 16069 1
124 . 1 1 46 46 ASP CA C 13 55.454 0.033 . 1 . . . . 46 ASP CA . 16069 1
125 . 1 1 46 46 ASP CB C 13 41.290 0.050 . 1 . . . . 46 ASP CB . 16069 1
126 . 1 1 46 46 ASP N N 15 121.559 0.020 . 1 . . . . 46 ASP N . 16069 1
127 . 1 1 47 47 GLU H H 1 8.500 0.003 . 1 . . . . 47 GLU H . 16069 1
128 . 1 1 47 47 GLU CA C 13 55.958 0.070 . 1 . . . . 47 GLU CA . 16069 1
129 . 1 1 47 47 GLU CB C 13 30.974 0.065 . 1 . . . . 47 GLU CB . 16069 1
130 . 1 1 47 47 GLU N N 15 121.011 0.023 . 1 . . . . 47 GLU N . 16069 1
131 . 1 1 48 48 VAL H H 1 8.231 0.003 . 1 . . . . 48 VAL H . 16069 1
132 . 1 1 48 48 VAL CA C 13 59.369 0.001 . 1 . . . . 48 VAL CA . 16069 1
133 . 1 1 48 48 VAL CB C 13 35.304 0.078 . 1 . . . . 48 VAL CB . 16069 1
134 . 1 1 48 48 VAL N N 15 118.762 0.020 . 1 . . . . 48 VAL N . 16069 1
135 . 1 1 49 49 PHE H H 1 8.455 0.050 . 1 . . . . 49 PHE H . 16069 1
136 . 1 1 49 49 PHE CA C 13 56.856 0.009 . 1 . . . . 49 PHE CA . 16069 1
137 . 1 1 49 49 PHE CB C 13 40.501 0.041 . 1 . . . . 49 PHE CB . 16069 1
138 . 1 1 49 49 PHE N N 15 125.672 0.019 . 1 . . . . 49 PHE N . 16069 1
139 . 1 1 50 50 LEU H H 1 8.727 0.002 . 1 . . . . 50 LEU H . 16069 1
140 . 1 1 50 50 LEU CA C 13 52.496 0.017 . 1 . . . . 50 LEU CA . 16069 1
141 . 1 1 50 50 LEU CB C 13 45.759 0.027 . 1 . . . . 50 LEU CB . 16069 1
142 . 1 1 50 50 LEU N N 15 126.646 0.032 . 1 . . . . 50 LEU N . 16069 1
143 . 1 1 51 51 LEU H H 1 8.476 0.003 . 1 . . . . 51 LEU H . 16069 1
144 . 1 1 51 51 LEU CA C 13 53.318 0.050 . 1 . . . . 51 LEU CA . 16069 1
145 . 1 1 51 51 LEU CB C 13 43.381 0.076 . 1 . . . . 51 LEU CB . 16069 1
146 . 1 1 51 51 LEU N N 15 123.377 0.025 . 1 . . . . 51 LEU N . 16069 1
147 . 1 1 52 52 LEU H H 1 9.024 0.003 . 1 . . . . 52 LEU H . 16069 1
148 . 1 1 52 52 LEU CA C 13 53.572 0.002 . 1 . . . . 52 LEU CA . 16069 1
149 . 1 1 52 52 LEU CB C 13 45.908 0.049 . 1 . . . . 52 LEU CB . 16069 1
150 . 1 1 52 52 LEU N N 15 128.975 0.016 . 1 . . . . 52 LEU N . 16069 1
151 . 1 1 53 53 THR H H 1 8.926 0.007 . 1 . . . . 53 THR H . 16069 1
152 . 1 1 53 53 THR CA C 13 62.079 0.031 . 1 . . . . 53 THR CA . 16069 1
153 . 1 1 53 53 THR CB C 13 70.046 0.050 . 1 . . . . 53 THR CB . 16069 1
154 . 1 1 53 53 THR N N 15 121.840 0.023 . 1 . . . . 53 THR N . 16069 1
155 . 1 1 54 54 LEU H H 1 9.177 0.007 . 1 . . . . 54 LEU H . 16069 1
156 . 1 1 54 54 LEU CA C 13 52.588 0.050 . 1 . . . . 54 LEU CA . 16069 1
157 . 1 1 54 54 LEU CB C 13 40.684 0.050 . 1 . . . . 54 LEU CB . 16069 1
158 . 1 1 54 54 LEU N N 15 127.048 0.016 . 1 . . . . 54 LEU N . 16069 1
159 . 1 1 55 55 PRO CA C 13 63.888 0.050 . 1 . . . . 55 PRO CA . 16069 1
160 . 1 1 55 55 PRO CB C 13 31.745 0.050 . 1 . . . . 55 PRO CB . 16069 1
161 . 1 1 56 56 ASP H H 1 8.607 0.002 . 1 . . . . 56 ASP H . 16069 1
162 . 1 1 56 56 ASP CA C 13 55.424 0.021 . 1 . . . . 56 ASP CA . 16069 1
163 . 1 1 56 56 ASP CB C 13 39.897 0.057 . 1 . . . . 56 ASP CB . 16069 1
164 . 1 1 56 56 ASP N N 15 115.042 0.033 . 1 . . . . 56 ASP N . 16069 1
165 . 1 1 57 57 SER H H 1 7.545 0.004 . 1 . . . . 57 SER H . 16069 1
166 . 1 1 57 57 SER CA C 13 57.208 0.050 . 1 . . . . 57 SER CA . 16069 1
167 . 1 1 57 57 SER CB C 13 64.796 0.050 . 1 . . . . 57 SER CB . 16069 1
168 . 1 1 57 57 SER N N 15 112.408 0.034 . 1 . . . . 57 SER N . 16069 1
169 . 1 1 58 58 SER CA C 13 58.271 0.038 . 1 . . . . 58 SER CA . 16069 1
170 . 1 1 58 58 SER CB C 13 63.839 0.050 . 1 . . . . 58 SER CB . 16069 1
171 . 1 1 59 59 GLU H H 1 8.119 0.002 . 1 . . . . 59 GLU H . 16069 1
172 . 1 1 59 59 GLU CA C 13 56.630 0.046 . 1 . . . . 59 GLU CA . 16069 1
173 . 1 1 59 59 GLU CB C 13 30.716 0.107 . 1 . . . . 59 GLU CB . 16069 1
174 . 1 1 59 59 GLU N N 15 123.101 0.024 . 1 . . . . 59 GLU N . 16069 1
175 . 1 1 60 60 ARG H H 1 8.514 0.001 . 1 . . . . 60 ARG H . 16069 1
176 . 1 1 60 60 ARG CA C 13 55.154 0.050 . 1 . . . . 60 ARG CA . 16069 1
177 . 1 1 60 60 ARG N N 15 124.314 0.015 . 1 . . . . 60 ARG N . 16069 1
178 . 1 1 61 61 LEU H H 1 9.408 0.006 . 1 . . . . 61 LEU H . 16069 1
179 . 1 1 61 61 LEU CA C 13 52.019 0.050 . 1 . . . . 61 LEU CA . 16069 1
180 . 1 1 61 61 LEU N N 15 127.290 0.015 . 1 . . . . 61 LEU N . 16069 1
181 . 1 1 62 62 PRO CA C 13 61.635 0.050 . 1 . . . . 62 PRO CA . 16069 1
182 . 1 1 62 62 PRO CB C 13 32.370 0.050 . 1 . . . . 62 PRO CB . 16069 1
183 . 1 1 63 63 VAL H H 1 8.848 0.004 . 1 . . . . 63 VAL H . 16069 1
184 . 1 1 63 63 VAL CA C 13 61.441 0.003 . 1 . . . . 63 VAL CA . 16069 1
185 . 1 1 63 63 VAL CB C 13 34.745 0.047 . 1 . . . . 63 VAL CB . 16069 1
186 . 1 1 63 63 VAL N N 15 123.549 0.010 . 1 . . . . 63 VAL N . 16069 1
187 . 1 1 64 64 ALA H H 1 8.456 0.007 . 1 . . . . 64 ALA H . 16069 1
188 . 1 1 64 64 ALA CA C 13 50.902 0.004 . 1 . . . . 64 ALA CA . 16069 1
189 . 1 1 64 64 ALA CB C 13 18.172 0.070 . 1 . . . . 64 ALA CB . 16069 1
190 . 1 1 64 64 ALA N N 15 131.867 0.013 . 1 . . . . 64 ALA N . 16069 1
191 . 1 1 65 65 GLY H H 1 8.111 0.001 . 1 . . . . 65 GLY H . 16069 1
192 . 1 1 65 65 GLY CA C 13 44.287 0.024 . 1 . . . . 65 GLY CA . 16069 1
193 . 1 1 65 65 GLY N N 15 107.785 0.016 . 1 . . . . 65 GLY N . 16069 1
194 . 1 1 66 66 LYS H H 1 7.620 0.001 . 1 . . . . 66 LYS H . 16069 1
195 . 1 1 66 66 LYS CA C 13 54.122 0.019 . 1 . . . . 66 LYS CA . 16069 1
196 . 1 1 66 66 LYS CB C 13 36.658 0.093 . 1 . . . . 66 LYS CB . 16069 1
197 . 1 1 66 66 LYS N N 15 118.296 0.024 . 1 . . . . 66 LYS N . 16069 1
198 . 1 1 67 67 VAL H H 1 9.019 0.003 . 1 . . . . 67 VAL H . 16069 1
199 . 1 1 67 67 VAL CA C 13 64.389 0.050 . 1 . . . . 67 VAL CA . 16069 1
200 . 1 1 67 67 VAL N N 15 124.249 0.010 . 1 . . . . 67 VAL N . 16069 1
201 . 1 1 69 69 TRP CA C 13 58.127 0.050 . 1 . . . . 69 TRP CA . 16069 1
202 . 1 1 70 70 THR H H 1 7.871 0.005 . 1 . . . . 70 THR H . 16069 1
203 . 1 1 70 70 THR CA C 13 59.843 0.050 . 1 . . . . 70 THR CA . 16069 1
204 . 1 1 70 70 THR CB C 13 71.243 0.050 . 1 . . . . 70 THR CB . 16069 1
205 . 1 1 70 70 THR N N 15 116.423 0.033 . 1 . . . . 70 THR N . 16069 1
206 . 1 1 71 71 THR H H 1 8.198 0.009 . 1 . . . . 71 THR H . 16069 1
207 . 1 1 71 71 THR N N 15 116.304 0.034 . 1 . . . . 71 THR N . 16069 1
208 . 1 1 72 72 PRO CB C 13 32.472 0.077 . 1 . . . . 72 PRO CB . 16069 1
209 . 1 1 73 73 ALA H H 1 8.542 0.002 . 1 . . . . 73 ALA H . 16069 1
210 . 1 1 73 73 ALA CA C 13 53.051 0.023 . 1 . . . . 73 ALA CA . 16069 1
211 . 1 1 73 73 ALA CB C 13 18.971 0.040 . 1 . . . . 73 ALA CB . 16069 1
212 . 1 1 73 73 ALA N N 15 123.842 0.033 . 1 . . . . 73 ALA N . 16069 1
213 . 1 1 74 74 GLY H H 1 8.469 0.001 . 1 . . . . 74 GLY H . 16069 1
214 . 1 1 74 74 GLY CA C 13 45.438 0.003 . 1 . . . . 74 GLY CA . 16069 1
215 . 1 1 74 74 GLY N N 15 108.625 0.014 . 1 . . . . 74 GLY N . 16069 1
216 . 1 1 75 75 ALA H H 1 8.007 0.004 . 1 . . . . 75 ALA H . 16069 1
217 . 1 1 75 75 ALA CA C 13 52.881 0.002 . 1 . . . . 75 ALA CA . 16069 1
218 . 1 1 75 75 ALA CB C 13 19.428 0.142 . 1 . . . . 75 ALA CB . 16069 1
219 . 1 1 75 75 ALA N N 15 123.558 0.030 . 1 . . . . 75 ALA N . 16069 1
220 . 1 1 76 76 GLN H H 1 8.404 0.002 . 1 . . . . 76 GLN H . 16069 1
221 . 1 1 76 76 GLN CA C 13 56.170 0.050 . 1 . . . . 76 GLN CA . 16069 1
222 . 1 1 76 76 GLN CB C 13 29.316 0.043 . 1 . . . . 76 GLN CB . 16069 1
223 . 1 1 76 76 GLN N N 15 118.691 0.052 . 1 . . . . 76 GLN N . 16069 1
224 . 1 1 77 77 GLY H H 1 8.393 0.003 . 1 . . . . 77 GLY H . 16069 1
225 . 1 1 77 77 GLY CA C 13 45.785 0.050 . 1 . . . . 77 GLY CA . 16069 1
226 . 1 1 77 77 GLY N N 15 109.751 0.029 . 1 . . . . 77 GLY N . 16069 1
227 . 1 1 78 78 ASN CA C 13 53.494 0.009 . 1 . . . . 78 ASN CA . 16069 1
228 . 1 1 78 78 ASN CB C 13 38.605 0.050 . 1 . . . . 78 ASN CB . 16069 1
229 . 1 1 79 79 ARG H H 1 7.968 0.002 . 1 . . . . 79 ARG H . 16069 1
230 . 1 1 79 79 ARG CA C 13 56.101 0.004 . 1 . . . . 79 ARG CA . 16069 1
231 . 1 1 79 79 ARG CB C 13 31.232 0.062 . 1 . . . . 79 ARG CB . 16069 1
232 . 1 1 79 79 ARG N N 15 120.167 0.019 . 1 . . . . 79 ARG N . 16069 1
233 . 1 1 80 80 ALA H H 1 8.242 0.006 . 1 . . . . 80 ALA H . 16069 1
234 . 1 1 80 80 ALA CA C 13 51.991 0.028 . 1 . . . . 80 ALA CA . 16069 1
235 . 1 1 80 80 ALA CB C 13 19.750 0.073 . 1 . . . . 80 ALA CB . 16069 1
236 . 1 1 80 80 ALA N N 15 125.609 0.021 . 1 . . . . 80 ALA N . 16069 1
237 . 1 1 81 81 ALA H H 1 7.993 0.006 . 1 . . . . 81 ALA H . 16069 1
238 . 1 1 81 81 ALA CA C 13 51.966 0.003 . 1 . . . . 81 ALA CA . 16069 1
239 . 1 1 81 81 ALA CB C 13 19.598 0.050 . 1 . . . . 81 ALA CB . 16069 1
240 . 1 1 81 81 ALA N N 15 121.866 0.020 . 1 . . . . 81 ALA N . 16069 1
241 . 1 1 82 82 GLY H H 1 8.470 0.004 . 1 . . . . 82 GLY H . 16069 1
242 . 1 1 82 82 GLY CA C 13 47.178 0.006 . 1 . . . . 82 GLY CA . 16069 1
243 . 1 1 82 82 GLY N N 15 107.212 0.039 . 1 . . . . 82 GLY N . 16069 1
244 . 1 1 83 83 ILE H H 1 7.866 0.003 . 1 . . . . 83 ILE H . 16069 1
245 . 1 1 83 83 ILE CA C 13 58.205 0.005 . 1 . . . . 83 ILE CA . 16069 1
246 . 1 1 83 83 ILE CB C 13 41.821 0.050 . 1 . . . . 83 ILE CB . 16069 1
247 . 1 1 83 83 ILE N N 15 111.602 0.033 . 1 . . . . 83 ILE N . 16069 1
248 . 1 1 84 84 GLY H H 1 8.876 0.005 . 1 . . . . 84 GLY H . 16069 1
249 . 1 1 84 84 GLY CA C 13 44.787 0.024 . 1 . . . . 84 GLY CA . 16069 1
250 . 1 1 84 84 GLY N N 15 108.368 0.046 . 1 . . . . 84 GLY N . 16069 1
251 . 1 1 85 85 VAL H H 1 8.885 0.003 . 1 . . . . 85 VAL H . 16069 1
252 . 1 1 85 85 VAL CA C 13 60.963 0.015 . 1 . . . . 85 VAL CA . 16069 1
253 . 1 1 85 85 VAL N N 15 127.070 0.021 . 1 . . . . 85 VAL N . 16069 1
254 . 1 1 86 86 GLN H H 1 9.115 0.004 . 1 . . . . 86 GLN H . 16069 1
255 . 1 1 86 86 GLN CA C 13 54.576 0.038 . 1 . . . . 86 GLN CA . 16069 1
256 . 1 1 86 86 GLN CB C 13 31.744 0.105 . 1 . . . . 86 GLN CB . 16069 1
257 . 1 1 86 86 GLN N N 15 126.822 0.033 . 1 . . . . 86 GLN N . 16069 1
258 . 1 1 87 87 PHE H H 1 8.333 0.002 . 1 . . . . 87 PHE H . 16069 1
259 . 1 1 87 87 PHE CA C 13 53.455 0.050 . 1 . . . . 87 PHE CA . 16069 1
260 . 1 1 87 87 PHE CB C 13 35.205 0.050 . 1 . . . . 87 PHE CB . 16069 1
261 . 1 1 87 87 PHE N N 15 127.441 0.015 . 1 . . . . 87 PHE N . 16069 1
262 . 1 1 88 88 PRO CA C 13 62.574 0.050 . 1 . . . . 88 PRO CA . 16069 1
263 . 1 1 88 88 PRO CB C 13 32.178 0.001 . 1 . . . . 88 PRO CB . 16069 1
264 . 1 1 89 89 ASP H H 1 8.368 0.004 . 1 . . . . 89 ASP H . 16069 1
265 . 1 1 89 89 ASP CA C 13 54.123 0.006 . 1 . . . . 89 ASP CA . 16069 1
266 . 1 1 89 89 ASP CB C 13 41.455 0.055 . 1 . . . . 89 ASP CB . 16069 1
267 . 1 1 89 89 ASP N N 15 119.464 0.025 . 1 . . . . 89 ASP N . 16069 1
268 . 1 1 90 90 GLY H H 1 8.247 0.004 . 1 . . . . 90 GLY H . 16069 1
269 . 1 1 90 90 GLY CA C 13 45.074 0.050 . 1 . . . . 90 GLY CA . 16069 1
270 . 1 1 90 90 GLY N N 15 109.970 0.014 . 1 . . . . 90 GLY N . 16069 1
271 . 1 1 91 91 PRO CA C 13 65.445 0.050 . 1 . . . . 91 PRO CA . 16069 1
272 . 1 1 91 91 PRO CB C 13 32.287 0.050 . 1 . . . . 91 PRO CB . 16069 1
273 . 1 1 92 92 GLU H H 1 8.982 0.002 . 1 . . . . 92 GLU H . 16069 1
274 . 1 1 92 92 GLU CA C 13 59.809 0.010 . 1 . . . . 92 GLU CA . 16069 1
275 . 1 1 92 92 GLU CB C 13 28.989 0.118 . 1 . . . . 92 GLU CB . 16069 1
276 . 1 1 92 92 GLU N N 15 118.314 0.022 . 1 . . . . 92 GLU N . 16069 1
277 . 1 1 93 93 GLY H H 1 7.806 0.006 . 1 . . . . 93 GLY H . 16069 1
278 . 1 1 93 93 GLY CA C 13 46.808 0.015 . 1 . . . . 93 GLY CA . 16069 1
279 . 1 1 93 93 GLY N N 15 108.016 0.019 . 1 . . . . 93 GLY N . 16069 1
280 . 1 1 94 94 GLU H H 1 8.106 0.004 . 1 . . . . 94 GLU H . 16069 1
281 . 1 1 94 94 GLU CA C 13 59.182 0.050 . 1 . . . . 94 GLU CA . 16069 1
282 . 1 1 94 94 GLU CB C 13 29.794 0.060 . 1 . . . . 94 GLU CB . 16069 1
283 . 1 1 94 94 GLU N N 15 121.497 0.025 . 1 . . . . 94 GLU N . 16069 1
284 . 1 1 95 95 ALA H H 1 7.919 0.002 . 1 . . . . 95 ALA H . 16069 1
285 . 1 1 95 95 ALA CA C 13 55.108 0.014 . 1 . . . . 95 ALA CA . 16069 1
286 . 1 1 95 95 ALA CB C 13 18.231 0.074 . 1 . . . . 95 ALA CB . 16069 1
287 . 1 1 95 95 ALA N N 15 119.337 0.006 . 1 . . . . 95 ALA N . 16069 1
288 . 1 1 96 96 VAL H H 1 7.110 0.003 . 1 . . . . 96 VAL H . 16069 1
289 . 1 1 96 96 VAL CA C 13 66.232 0.004 . 1 . . . . 96 VAL CA . 16069 1
290 . 1 1 96 96 VAL CB C 13 31.345 0.095 . 1 . . . . 96 VAL CB . 16069 1
291 . 1 1 96 96 VAL N N 15 117.648 0.020 . 1 . . . . 96 VAL N . 16069 1
292 . 1 1 97 97 ARG H H 1 8.152 0.002 . 1 . . . . 97 ARG H . 16069 1
293 . 1 1 97 97 ARG CA C 13 60.963 0.015 . 1 . . . . 97 ARG CA . 16069 1
294 . 1 1 97 97 ARG CB C 13 30.501 0.134 . 1 . . . . 97 ARG CB . 16069 1
295 . 1 1 97 97 ARG N N 15 120.821 0.028 . 1 . . . . 97 ARG N . 16069 1
296 . 1 1 98 98 ASN H H 1 8.792 0.005 . 1 . . . . 98 ASN H . 16069 1
297 . 1 1 98 98 ASN CA C 13 56.374 0.025 . 1 . . . . 98 ASN CA . 16069 1
298 . 1 1 98 98 ASN CB C 13 38.484 0.024 . 1 . . . . 98 ASN CB . 16069 1
299 . 1 1 98 98 ASN N N 15 115.797 0.028 . 1 . . . . 98 ASN N . 16069 1
300 . 1 1 99 99 LYS H H 1 7.685 0.002 . 1 . . . . 99 LYS H . 16069 1
301 . 1 1 99 99 LYS CA C 13 59.683 0.050 . 1 . . . . 99 LYS CA . 16069 1
302 . 1 1 99 99 LYS CB C 13 32.394 0.074 . 1 . . . . 99 LYS CB . 16069 1
303 . 1 1 99 99 LYS N N 15 121.438 0.012 . 1 . . . . 99 LYS N . 16069 1
304 . 1 1 100 100 ILE H H 1 7.939 0.003 . 1 . . . . 100 ILE H . 16069 1
305 . 1 1 100 100 ILE CA C 13 66.543 0.009 . 1 . . . . 100 ILE CA . 16069 1
306 . 1 1 100 100 ILE CB C 13 38.269 0.050 . 1 . . . . 100 ILE CB . 16069 1
307 . 1 1 100 100 ILE N N 15 119.318 0.015 . 1 . . . . 100 ILE N . 16069 1
308 . 1 1 101 101 GLU H H 1 8.655 0.001 . 1 . . . . 101 GLU H . 16069 1
309 . 1 1 101 101 GLU CA C 13 60.305 0.007 . 1 . . . . 101 GLU CA . 16069 1
310 . 1 1 101 101 GLU CB C 13 28.886 0.150 . 1 . . . . 101 GLU CB . 16069 1
311 . 1 1 101 101 GLU N N 15 117.644 0.026 . 1 . . . . 101 GLU N . 16069 1
312 . 1 1 102 102 THR H H 1 8.077 0.001 . 1 . . . . 102 THR H . 16069 1
313 . 1 1 102 102 THR CA C 13 66.805 0.014 . 1 . . . . 102 THR CA . 16069 1
314 . 1 1 102 102 THR CB C 13 69.032 0.050 . 1 . . . . 102 THR CB . 16069 1
315 . 1 1 102 102 THR N N 15 115.593 0.046 . 1 . . . . 102 THR N . 16069 1
316 . 1 1 103 103 LEU H H 1 7.645 0.002 . 1 . . . . 103 LEU H . 16069 1
317 . 1 1 103 103 LEU CA C 13 57.826 0.017 . 1 . . . . 103 LEU CA . 16069 1
318 . 1 1 103 103 LEU CB C 13 43.174 0.015 . 1 . . . . 103 LEU CB . 16069 1
319 . 1 1 103 103 LEU N N 15 122.670 0.017 . 1 . . . . 103 LEU N . 16069 1
320 . 1 1 104 104 LEU H H 1 7.970 0.003 . 1 . . . . 104 LEU H . 16069 1
321 . 1 1 104 104 LEU CA C 13 55.471 0.040 . 1 . . . . 104 LEU CA . 16069 1
322 . 1 1 104 104 LEU CB C 13 41.776 0.075 . 1 . . . . 104 LEU CB . 16069 1
323 . 1 1 104 104 LEU N N 15 115.636 0.025 . 1 . . . . 104 LEU N . 16069 1
324 . 1 1 105 105 ALA H H 1 7.445 0.001 . 1 . . . . 105 ALA H . 16069 1
325 . 1 1 105 105 ALA CA C 13 54.227 0.016 . 1 . . . . 105 ALA CA . 16069 1
326 . 1 1 105 105 ALA CB C 13 18.531 0.064 . 1 . . . . 105 ALA CB . 16069 1
327 . 1 1 105 105 ALA N N 15 123.033 0.017 . 1 . . . . 105 ALA N . 16069 1
328 . 1 1 106 106 GLY H H 1 8.272 0.001 . 1 . . . . 106 GLY H . 16069 1
329 . 1 1 106 106 GLY CA C 13 45.597 0.002 . 1 . . . . 106 GLY CA . 16069 1
330 . 1 1 106 106 GLY N N 15 107.405 0.014 . 1 . . . . 106 GLY N . 16069 1
331 . 1 1 107 107 LEU H H 1 7.785 0.001 . 1 . . . . 107 LEU H . 16069 1
332 . 1 1 107 107 LEU CA C 13 55.664 0.021 . 1 . . . . 107 LEU CA . 16069 1
333 . 1 1 107 107 LEU CB C 13 42.622 0.081 . 1 . . . . 107 LEU CB . 16069 1
334 . 1 1 107 107 LEU N N 15 121.460 0.015 . 1 . . . . 107 LEU N . 16069 1
335 . 1 1 108 108 THR H H 1 8.160 0.001 . 1 . . . . 108 THR H . 16069 1
336 . 1 1 108 108 THR CA C 13 61.627 0.006 . 1 . . . . 108 THR CA . 16069 1
337 . 1 1 108 108 THR CB C 13 69.985 0.050 . 1 . . . . 108 THR CB . 16069 1
338 . 1 1 108 108 THR N N 15 114.486 0.022 . 1 . . . . 108 THR N . 16069 1
339 . 1 1 109 109 THR H H 1 8.093 0.002 . 1 . . . . 109 THR H . 16069 1
340 . 1 1 109 109 THR CA C 13 61.832 0.030 . 1 . . . . 109 THR CA . 16069 1
341 . 1 1 109 109 THR CB C 13 69.810 0.050 . 1 . . . . 109 THR CB . 16069 1
342 . 1 1 109 109 THR N N 15 115.702 0.010 . 1 . . . . 109 THR N . 16069 1
343 . 1 1 110 110 SER H H 1 8.256 0.002 . 1 . . . . 110 SER H . 16069 1
344 . 1 1 110 110 SER CA C 13 58.486 0.010 . 1 . . . . 110 SER CA . 16069 1
345 . 1 1 110 110 SER CB C 13 63.952 0.025 . 1 . . . . 110 SER CB . 16069 1
346 . 1 1 110 110 SER N N 15 117.451 0.011 . 1 . . . . 110 SER N . 16069 1
347 . 1 1 111 111 ASP H H 1 8.279 0.002 . 1 . . . . 111 ASP H . 16069 1
348 . 1 1 111 111 ASP CA C 13 54.353 0.012 . 1 . . . . 111 ASP CA . 16069 1
349 . 1 1 111 111 ASP CB C 13 41.276 0.062 . 1 . . . . 111 ASP CB . 16069 1
350 . 1 1 111 111 ASP N N 15 122.211 0.012 . 1 . . . . 111 ASP N . 16069 1
351 . 1 1 112 112 LYS H H 1 8.037 0.001 . 1 . . . . 112 LYS H . 16069 1
352 . 1 1 112 112 LYS CA C 13 54.190 0.050 . 1 . . . . 112 LYS CA . 16069 1
353 . 1 1 112 112 LYS CB C 13 32.794 0.050 . 1 . . . . 112 LYS CB . 16069 1
354 . 1 1 112 112 LYS N N 15 121.859 0.006 . 1 . . . . 112 LYS N . 16069 1
355 . 1 1 113 113 PRO CA C 13 63.155 0.050 . 1 . . . . 113 PRO CA . 16069 1
356 . 1 1 113 113 PRO CB C 13 32.164 0.050 . 1 . . . . 113 PRO CB . 16069 1
357 . 1 1 114 114 THR H H 1 8.238 0.001 . 1 . . . . 114 THR H . 16069 1
358 . 1 1 114 114 THR CA C 13 62.000 0.050 . 1 . . . . 114 THR CA . 16069 1
359 . 1 1 114 114 THR CB C 13 69.796 0.050 . 1 . . . . 114 THR CB . 16069 1
360 . 1 1 114 114 THR N N 15 114.220 0.012 . 1 . . . . 114 THR N . 16069 1
361 . 1 1 115 115 HIS CA C 13 56.132 0.050 . 1 . . . . 115 HIS CA . 16069 1
362 . 1 1 115 115 HIS CB C 13 30.993 0.050 . 1 . . . . 115 HIS CB . 16069 1
363 . 1 1 116 116 THR H H 1 8.037 0.003 . 1 . . . . 116 THR H . 16069 1
364 . 1 1 116 116 THR CA C 13 61.740 0.016 . 1 . . . . 116 THR CA . 16069 1
365 . 1 1 116 116 THR CB C 13 69.875 0.050 . 1 . . . . 116 THR CB . 16069 1
366 . 1 1 116 116 THR N N 15 115.691 0.012 . 1 . . . . 116 THR N . 16069 1
367 . 1 1 117 117 MET H H 1 7.957 0.002 . 1 . . . . 117 MET H . 16069 1
368 . 1 1 117 117 MET CA C 13 57.239 0.050 . 1 . . . . 117 MET CA . 16069 1
369 . 1 1 117 117 MET CB C 13 33.982 0.050 . 1 . . . . 117 MET CB . 16069 1
370 . 1 1 117 117 MET N N 15 127.775 0.012 . 1 . . . . 117 MET N . 16069 1
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