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 28060
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 '2D 1H-15N HSQC' . . . 28060 1
2 '3D CBCA(CO)NH' . . . 28060 1
3 '3D HNCO' . . . 28060 1
4 '3D HNCA' . . . 28060 1
5 '3D HNCACB' . . . 28060 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 6 6 HIS C C 13 175.792 0.000 . 1 . . . . . 13 HIS C . 28060 1
2 . 1 . 1 6 6 HIS CA C 13 55.945 0.000 . 1 . . . . . 13 HIS CA . 28060 1
3 . 1 . 1 6 6 HIS CB C 13 33.337 0.000 . 1 . . . . . 13 HIS CB . 28060 1
4 . 1 . 1 7 7 HIS H H 1 8.390 0.002 . 1 . . . . . 14 HIS H . 28060 1
5 . 1 . 1 7 7 HIS C C 13 175.981 0.000 . 1 . . . . . 14 HIS C . 28060 1
6 . 1 . 1 7 7 HIS CA C 13 55.979 0.032 . 1 . . . . . 14 HIS CA . 28060 1
7 . 1 . 1 7 7 HIS CB C 13 33.614 0.056 . 1 . . . . . 14 HIS CB . 28060 1
8 . 1 . 1 7 7 HIS N N 15 122.343 0.015 . 1 . . . . . 14 HIS N . 28060 1
9 . 1 . 1 8 8 HIS H H 1 8.730 0.053 . 1 . . . . . 15 HIS H . 28060 1
10 . 1 . 1 8 8 HIS C C 13 174.514 0.000 . 1 . . . . . 15 HIS C . 28060 1
11 . 1 . 1 8 8 HIS CA C 13 55.893 0.041 . 1 . . . . . 15 HIS CA . 28060 1
12 . 1 . 1 8 8 HIS CB C 13 29.889 0.014 . 1 . . . . . 15 HIS CB . 28060 1
13 . 1 . 1 8 8 HIS N N 15 120.559 0.081 . 1 . . . . . 15 HIS N . 28060 1
14 . 1 . 1 9 9 HIS H H 1 8.527 0.010 . 1 . . . . . 16 HIS H . 28060 1
15 . 1 . 1 9 9 HIS C C 13 174.297 0.000 . 1 . . . . . 16 HIS C . 28060 1
16 . 1 . 1 9 9 HIS CA C 13 55.656 0.011 . 1 . . . . . 16 HIS CA . 28060 1
17 . 1 . 1 9 9 HIS CB C 13 29.762 0.054 . 1 . . . . . 16 HIS CB . 28060 1
18 . 1 . 1 9 9 HIS N N 15 120.488 0.066 . 1 . . . . . 16 HIS N . 28060 1
19 . 1 . 1 10 10 ALA H H 1 8.448 0.005 . 1 . . . . . 17 ALA H . 28060 1
20 . 1 . 1 10 10 ALA C C 13 177.689 0.000 . 1 . . . . . 17 ALA C . 28060 1
21 . 1 . 1 10 10 ALA CA C 13 52.969 0.031 . 1 . . . . . 17 ALA CA . 28060 1
22 . 1 . 1 10 10 ALA CB C 13 19.233 0.018 . 1 . . . . . 17 ALA CB . 28060 1
23 . 1 . 1 10 10 ALA N N 15 125.142 0.033 . 1 . . . . . 17 ALA N . 28060 1
24 . 1 . 1 11 11 GLU H H 1 8.595 0.003 . 1 . . . . . 18 GLU H . 28060 1
25 . 1 . 1 11 11 GLU C C 13 176.607 0.000 . 1 . . . . . 18 GLU C . 28060 1
26 . 1 . 1 11 11 GLU CA C 13 57.163 0.031 . 1 . . . . . 18 GLU CA . 28060 1
27 . 1 . 1 11 11 GLU CB C 13 29.718 0.001 . 1 . . . . . 18 GLU CB . 28060 1
28 . 1 . 1 11 11 GLU N N 15 119.132 0.030 . 1 . . . . . 18 GLU N . 28060 1
29 . 1 . 1 12 12 GLU H H 1 8.277 0.004 . 1 . . . . . 19 GLU H . 28060 1
30 . 1 . 1 12 12 GLU C C 13 176.355 0.000 . 1 . . . . . 19 GLU C . 28060 1
31 . 1 . 1 12 12 GLU CA C 13 56.680 0.033 . 1 . . . . . 19 GLU CA . 28060 1
32 . 1 . 1 12 12 GLU CB C 13 30.178 0.066 . 1 . . . . . 19 GLU CB . 28060 1
33 . 1 . 1 12 12 GLU N N 15 119.893 0.051 . 1 . . . . . 19 GLU N . 28060 1
34 . 1 . 1 13 13 GLU H H 1 8.283 0.007 . 1 . . . . . 20 GLU H . 28060 1
35 . 1 . 1 13 13 GLU C C 13 176.289 0.000 . 1 . . . . . 20 GLU C . 28060 1
36 . 1 . 1 13 13 GLU CA C 13 56.549 0.018 . 1 . . . . . 20 GLU CA . 28060 1
37 . 1 . 1 13 13 GLU CB C 13 30.427 0.050 . 1 . . . . . 20 GLU CB . 28060 1
38 . 1 . 1 13 13 GLU N N 15 121.024 0.032 . 1 . . . . . 20 GLU N . 28060 1
39 . 1 . 1 14 14 GLU H H 1 8.348 0.005 . 1 . . . . . 21 GLU H . 28060 1
40 . 1 . 1 14 14 GLU C C 13 176.120 0.000 . 1 . . . . . 21 GLU C . 28060 1
41 . 1 . 1 14 14 GLU CA C 13 56.417 0.060 . 1 . . . . . 21 GLU CA . 28060 1
42 . 1 . 1 14 14 GLU CB C 13 30.791 0.000 . 1 . . . . . 21 GLU CB . 28060 1
43 . 1 . 1 14 14 GLU N N 15 121.432 0.039 . 1 . . . . . 21 GLU N . 28060 1
44 . 1 . 1 15 15 GLU H H 1 8.282 0.002 . 1 . . . . . 22 GLU H . 28060 1
45 . 1 . 1 15 15 GLU C C 13 175.374 0.000 . 1 . . . . . 22 GLU C . 28060 1
46 . 1 . 1 15 15 GLU CA C 13 56.278 0.031 . 1 . . . . . 22 GLU CA . 28060 1
47 . 1 . 1 15 15 GLU CB C 13 30.784 0.006 . 1 . . . . . 22 GLU CB . 28060 1
48 . 1 . 1 15 15 GLU N N 15 122.126 0.014 . 1 . . . . . 22 GLU N . 28060 1
49 . 1 . 1 16 16 GLU H H 1 8.292 0.000 . 1 . . . . . 23 GLU H . 28060 1
50 . 1 . 1 16 16 GLU C C 13 175.940 0.000 . 1 . . . . . 23 GLU C . 28060 1
51 . 1 . 1 16 16 GLU CA C 13 56.081 0.042 . 1 . . . . . 23 GLU CA . 28060 1
52 . 1 . 1 16 16 GLU CB C 13 30.791 0.030 . 1 . . . . . 23 GLU CB . 28060 1
53 . 1 . 1 16 16 GLU N N 15 122.141 0.000 . 1 . . . . . 23 GLU N . 28060 1
54 . 1 . 1 17 17 TYR H H 1 8.705 0.379 . 1 . . . . . 24 TYR H . 28060 1
55 . 1 . 1 17 17 TYR C C 13 174.700 0.000 . 1 . . . . . 24 TYR C . 28060 1
56 . 1 . 1 17 17 TYR CA C 13 57.613 0.020 . 1 . . . . . 24 TYR CA . 28060 1
57 . 1 . 1 17 17 TYR CB C 13 39.805 0.014 . 1 . . . . . 24 TYR CB . 28060 1
58 . 1 . 1 17 17 TYR N N 15 124.426 1.050 . 1 . . . . . 24 TYR N . 28060 1
59 . 1 . 1 18 18 ALA H H 1 9.259 0.039 . 1 . . . . . 25 ALA H . 28060 1
60 . 1 . 1 18 18 ALA C C 13 176.584 0.000 . 1 . . . . . 25 ALA C . 28060 1
61 . 1 . 1 18 18 ALA CA C 13 50.903 0.012 . 1 . . . . . 25 ALA CA . 28060 1
62 . 1 . 1 18 18 ALA CB C 13 21.517 0.000 . 1 . . . . . 25 ALA CB . 28060 1
63 . 1 . 1 18 18 ALA N N 15 125.871 0.275 . 1 . . . . . 25 ALA N . 28060 1
64 . 1 . 1 19 19 VAL H H 1 8.887 0.001 . 1 . . . . . 26 VAL H . 28060 1
65 . 1 . 1 19 19 VAL C C 13 175.196 0.000 . 1 . . . . . 26 VAL C . 28060 1
66 . 1 . 1 19 19 VAL CA C 13 64.113 0.018 . 1 . . . . . 26 VAL CA . 28060 1
67 . 1 . 1 19 19 VAL CB C 13 32.791 0.023 . 1 . . . . . 26 VAL CB . 28060 1
68 . 1 . 1 19 19 VAL N N 15 124.713 0.010 . 1 . . . . . 26 VAL N . 28060 1
69 . 1 . 1 20 20 GLU H H 1 9.403 0.018 . 1 . . . . . 27 GLU H . 28060 1
70 . 1 . 1 20 20 GLU C C 13 175.639 0.000 . 1 . . . . . 27 GLU C . 28060 1
71 . 1 . 1 20 20 GLU CA C 13 57.243 0.000 . 1 . . . . . 27 GLU CA . 28060 1
72 . 1 . 1 20 20 GLU CB C 13 32.262 0.000 . 1 . . . . . 27 GLU CB . 28060 1
73 . 1 . 1 20 20 GLU N N 15 127.443 0.017 . 1 . . . . . 27 GLU N . 28060 1
74 . 1 . 1 21 21 LYS H H 1 7.381 0.017 . 1 . . . . . 28 LYS H . 28060 1
75 . 1 . 1 21 21 LYS C C 13 172.788 0.000 . 1 . . . . . 28 LYS C . 28060 1
76 . 1 . 1 21 21 LYS CA C 13 55.496 0.006 . 1 . . . . . 28 LYS CA . 28060 1
77 . 1 . 1 21 21 LYS CB C 13 36.456 0.020 . 1 . . . . . 28 LYS CB . 28060 1
78 . 1 . 1 21 21 LYS N N 15 114.706 0.033 . 1 . . . . . 28 LYS N . 28060 1
79 . 1 . 1 22 22 ILE H H 1 8.457 0.002 . 1 . . . . . 29 ILE H . 28060 1
80 . 1 . 1 22 22 ILE C C 13 174.817 0.000 . 1 . . . . . 29 ILE C . 28060 1
81 . 1 . 1 22 22 ILE CA C 13 60.859 0.000 . 1 . . . . . 29 ILE CA . 28060 1
82 . 1 . 1 22 22 ILE CB C 13 37.683 0.004 . 1 . . . . . 29 ILE CB . 28060 1
83 . 1 . 1 22 22 ILE N N 15 123.202 0.016 . 1 . . . . . 29 ILE N . 28060 1
84 . 1 . 1 23 23 ILE H H 1 8.912 0.000 . 1 . . . . . 30 ILE H . 28060 1
85 . 1 . 1 23 23 ILE C C 13 175.271 0.000 . 1 . . . . . 30 ILE C . 28060 1
86 . 1 . 1 23 23 ILE CA C 13 61.123 0.064 . 1 . . . . . 30 ILE CA . 28060 1
87 . 1 . 1 23 23 ILE CB C 13 39.210 0.006 . 1 . . . . . 30 ILE CB . 28060 1
88 . 1 . 1 23 23 ILE N N 15 124.814 0.007 . 1 . . . . . 30 ILE N . 28060 1
89 . 1 . 1 24 24 ASP H H 1 7.610 0.009 . 1 . . . . . 31 ASP H . 28060 1
90 . 1 . 1 24 24 ASP C C 13 173.306 0.000 . 1 . . . . . 31 ASP C . 28060 1
91 . 1 . 1 24 24 ASP CA C 13 52.575 0.007 . 1 . . . . . 31 ASP CA . 28060 1
92 . 1 . 1 24 24 ASP CB C 13 44.491 0.031 . 1 . . . . . 31 ASP CB . 28060 1
93 . 1 . 1 24 24 ASP N N 15 117.510 0.028 . 1 . . . . . 31 ASP N . 28060 1
94 . 1 . 1 25 25 ARG H H 1 9.433 0.005 . 1 . . . . . 32 ARG H . 28060 1
95 . 1 . 1 25 25 ARG C C 13 174.034 0.000 . 1 . . . . . 32 ARG C . 28060 1
96 . 1 . 1 25 25 ARG CA C 13 55.236 0.007 . 1 . . . . . 32 ARG CA . 28060 1
97 . 1 . 1 25 25 ARG CB C 13 35.365 0.000 . 1 . . . . . 32 ARG CB . 28060 1
98 . 1 . 1 25 25 ARG N N 15 121.774 0.019 . 1 . . . . . 32 ARG N . 28060 1
99 . 1 . 1 26 26 ARG H H 1 9.413 0.006 . 1 . . . . . 33 ARG H . 28060 1
100 . 1 . 1 26 26 ARG C C 13 171.914 0.000 . 1 . . . . . 33 ARG C . 28060 1
101 . 1 . 1 26 26 ARG CA C 13 54.149 0.029 . 1 . . . . . 33 ARG CA . 28060 1
102 . 1 . 1 26 26 ARG CB C 13 32.643 0.068 . 1 . . . . . 33 ARG CB . 28060 1
103 . 1 . 1 26 26 ARG N N 15 124.218 0.013 . 1 . . . . . 33 ARG N . 28060 1
104 . 1 . 1 27 27 VAL H H 1 8.264 0.003 . 1 . . . . . 34 VAL H . 28060 1
105 . 1 . 1 27 27 VAL C C 13 176.163 0.000 . 1 . . . . . 34 VAL C . 28060 1
106 . 1 . 1 27 27 VAL CA C 13 61.027 0.000 . 1 . . . . . 34 VAL CA . 28060 1
107 . 1 . 1 27 27 VAL CB C 13 32.860 0.000 . 1 . . . . . 34 VAL CB . 28060 1
108 . 1 . 1 27 27 VAL N N 15 119.076 0.028 . 1 . . . . . 34 VAL N . 28060 1
109 . 1 . 1 28 28 ARG H H 1 9.003 0.003 . 1 . . . . . 35 ARG H . 28060 1
110 . 1 . 1 28 28 ARG C C 13 175.328 0.000 . 1 . . . . . 35 ARG C . 28060 1
111 . 1 . 1 28 28 ARG CA C 13 54.892 0.019 . 1 . . . . . 35 ARG CA . 28060 1
112 . 1 . 1 28 28 ARG CB C 13 33.426 0.047 . 1 . . . . . 35 ARG CB . 28060 1
113 . 1 . 1 28 28 ARG N N 15 128.729 0.018 . 1 . . . . . 35 ARG N . 28060 1
114 . 1 . 1 29 29 LYS H H 1 9.469 0.003 . 1 . . . . . 36 LYS H . 28060 1
115 . 1 . 1 29 29 LYS C C 13 176.402 0.000 . 1 . . . . . 36 LYS C . 28060 1
116 . 1 . 1 29 29 LYS CA C 13 56.993 0.048 . 1 . . . . . 36 LYS CA . 28060 1
117 . 1 . 1 29 29 LYS CB C 13 30.075 0.015 . 1 . . . . . 36 LYS CB . 28060 1
118 . 1 . 1 29 29 LYS N N 15 126.758 0.026 . 1 . . . . . 36 LYS N . 28060 1
119 . 1 . 1 30 30 GLY H H 1 8.297 0.003 . 1 . . . . . 37 GLY H . 28060 1
120 . 1 . 1 30 30 GLY C C 13 173.295 0.000 . 1 . . . . . 37 GLY C . 28060 1
121 . 1 . 1 30 30 GLY CA C 13 45.410 0.001 . 1 . . . . . 37 GLY CA . 28060 1
122 . 1 . 1 30 30 GLY N N 15 105.645 7.506 . 1 . . . . . 37 GLY N . 28060 1
123 . 1 . 1 31 31 MET H H 1 7.838 0.005 . 1 . . . . . 38 MET H . 28060 1
124 . 1 . 1 31 31 MET C C 13 174.195 0.000 . 1 . . . . . 38 MET C . 28060 1
125 . 1 . 1 31 31 MET CA C 13 53.573 0.030 . 1 . . . . . 38 MET CA . 28060 1
126 . 1 . 1 31 31 MET CB C 13 34.242 0.029 . 1 . . . . . 38 MET CB . 28060 1
127 . 1 . 1 31 31 MET N N 15 120.979 0.017 . 1 . . . . . 38 MET N . 28060 1
128 . 1 . 1 32 32 VAL H H 1 8.641 0.001 . 1 . . . . . 39 VAL H . 28060 1
129 . 1 . 1 32 32 VAL C C 13 175.685 0.000 . 1 . . . . . 39 VAL C . 28060 1
130 . 1 . 1 32 32 VAL CA C 13 63.251 0.032 . 1 . . . . . 39 VAL CA . 28060 1
131 . 1 . 1 32 32 VAL CB C 13 31.690 0.000 . 1 . . . . . 39 VAL CB . 28060 1
132 . 1 . 1 32 32 VAL N N 15 125.336 0.011 . 1 . . . . . 39 VAL N . 28060 1
133 . 1 . 1 33 33 GLU H H 1 9.083 0.002 . 1 . . . . . 40 GLU H . 28060 1
134 . 1 . 1 33 33 GLU C C 13 174.385 0.000 . 1 . . . . . 40 GLU C . 28060 1
135 . 1 . 1 33 33 GLU CA C 13 53.875 0.012 . 1 . . . . . 40 GLU CA . 28060 1
136 . 1 . 1 33 33 GLU CB C 13 34.911 0.000 . 1 . . . . . 40 GLU CB . 28060 1
137 . 1 . 1 33 33 GLU N N 15 125.986 0.017 . 1 . . . . . 40 GLU N . 28060 1
138 . 1 . 1 34 34 TYR H H 1 8.973 0.004 . 1 . . . . . 41 TYR H . 28060 1
139 . 1 . 1 34 34 TYR C C 13 173.386 0.000 . 1 . . . . . 41 TYR C . 28060 1
140 . 1 . 1 34 34 TYR CA C 13 57.066 0.038 . 1 . . . . . 41 TYR CA . 28060 1
141 . 1 . 1 34 34 TYR CB C 13 42.548 0.013 . 1 . . . . . 41 TYR CB . 28060 1
142 . 1 . 1 34 34 TYR N N 15 118.412 0.028 . 1 . . . . . 41 TYR N . 28060 1
143 . 1 . 1 35 35 TYR H H 1 7.980 0.002 . 1 . . . . . 42 TYR H . 28060 1
144 . 1 . 1 35 35 TYR C C 13 174.233 0.000 . 1 . . . . . 42 TYR C . 28060 1
145 . 1 . 1 35 35 TYR CA C 13 54.830 0.015 . 1 . . . . . 42 TYR CA . 28060 1
146 . 1 . 1 35 35 TYR CB C 13 37.315 0.014 . 1 . . . . . 42 TYR CB . 28060 1
147 . 1 . 1 35 35 TYR N N 15 126.112 0.032 . 1 . . . . . 42 TYR N . 28060 1
148 . 1 . 1 36 36 LEU H H 1 8.388 0.011 . 1 . . . . . 43 LEU H . 28060 1
149 . 1 . 1 36 36 LEU C C 13 173.269 0.000 . 1 . . . . . 43 LEU C . 28060 1
150 . 1 . 1 36 36 LEU CA C 13 53.926 0.007 . 1 . . . . . 43 LEU CA . 28060 1
151 . 1 . 1 36 36 LEU CB C 13 43.598 0.020 . 1 . . . . . 43 LEU CB . 28060 1
152 . 1 . 1 36 36 LEU N N 15 127.561 0.021 . 1 . . . . . 43 LEU N . 28060 1
153 . 1 . 1 37 37 LYS H H 1 7.478 0.013 . 1 . . . . . 44 LYS H . 28060 1
154 . 1 . 1 37 37 LYS C C 13 175.620 0.000 . 1 . . . . . 44 LYS C . 28060 1
155 . 1 . 1 37 37 LYS CA C 13 53.199 0.004 . 1 . . . . . 44 LYS CA . 28060 1
156 . 1 . 1 37 37 LYS CB C 13 35.406 0.000 . 1 . . . . . 44 LYS CB . 28060 1
157 . 1 . 1 37 37 LYS N N 15 118.392 0.012 . 1 . . . . . 44 LYS N . 28060 1
158 . 1 . 1 38 38 TRP H H 1 9.166 0.037 . 1 . . . . . 45 TRP H . 28060 1
159 . 1 . 1 38 38 TRP C C 13 177.068 0.000 . 1 . . . . . 45 TRP C . 28060 1
160 . 1 . 1 38 38 TRP CA C 13 55.814 0.032 . 1 . . . . . 45 TRP CA . 28060 1
161 . 1 . 1 38 38 TRP CB C 13 30.802 0.040 . 1 . . . . . 45 TRP CB . 28060 1
162 . 1 . 1 38 38 TRP N N 15 131.396 0.132 . 1 . . . . . 45 TRP N . 28060 1
163 . 1 . 1 39 39 LYS H H 1 9.357 0.026 . 1 . . . . . 46 LYS H . 28060 1
164 . 1 . 1 39 39 LYS C C 13 178.148 0.000 . 1 . . . . . 46 LYS C . 28060 1
165 . 1 . 1 39 39 LYS CA C 13 58.280 0.000 . 1 . . . . . 46 LYS CA . 28060 1
166 . 1 . 1 39 39 LYS CB C 13 32.866 0.025 . 1 . . . . . 46 LYS CB . 28060 1
167 . 1 . 1 39 39 LYS N N 15 125.191 0.064 . 1 . . . . . 46 LYS N . 28060 1
168 . 1 . 1 40 40 GLY H H 1 9.215 0.031 . 1 . . . . . 47 GLY H . 28060 1
169 . 1 . 1 40 40 GLY C C 13 173.341 0.000 . 1 . . . . . 47 GLY C . 28060 1
170 . 1 . 1 40 40 GLY CA C 13 45.173 0.011 . 1 . . . . . 47 GLY CA . 28060 1
171 . 1 . 1 40 40 GLY N N 15 112.880 0.071 . 1 . . . . . 47 GLY N . 28060 1
172 . 1 . 1 41 41 TYR H H 1 7.700 0.047 . 1 . . . . . 48 TYR H . 28060 1
173 . 1 . 1 41 41 TYR CA C 13 55.854 0.022 . 1 . . . . . 48 TYR CA . 28060 1
174 . 1 . 1 41 41 TYR CB C 13 40.336 0.000 . 1 . . . . . 48 TYR CB . 28060 1
175 . 1 . 1 41 41 TYR N N 15 118.480 0.017 . 1 . . . . . 48 TYR N . 28060 1
176 . 1 . 1 42 42 PRO C C 13 177.761 0.000 . 1 . . . . . 49 PRO C . 28060 1
177 . 1 . 1 42 42 PRO CA C 13 61.942 0.039 . 1 . . . . . 49 PRO CA . 28060 1
178 . 1 . 1 42 42 PRO CB C 13 33.303 0.010 . 1 . . . . . 49 PRO CB . 28060 1
179 . 1 . 1 43 43 GLU H H 1 9.092 0.001 . 1 . . . . . 50 GLU H . 28060 1
180 . 1 . 1 43 43 GLU C C 13 178.277 0.000 . 1 . . . . . 50 GLU C . 28060 1
181 . 1 . 1 43 43 GLU CA C 13 58.301 0.007 . 1 . . . . . 50 GLU CA . 28060 1
182 . 1 . 1 43 43 GLU CB C 13 29.258 0.000 . 1 . . . . . 50 GLU CB . 28060 1
183 . 1 . 1 43 43 GLU N N 15 118.824 0.072 . 1 . . . . . 50 GLU N . 28060 1
184 . 1 . 1 44 44 THR H H 1 7.210 0.007 . 1 . . . . . 51 THR H . 28060 1
185 . 1 . 1 44 44 THR C C 13 176.092 0.000 . 1 . . . . . 51 THR C . 28060 1
186 . 1 . 1 44 44 THR CA C 13 63.651 0.048 . 1 . . . . . 51 THR CA . 28060 1
187 . 1 . 1 44 44 THR CB C 13 68.160 0.011 . 1 . . . . . 51 THR CB . 28060 1
188 . 1 . 1 44 44 THR N N 15 108.954 0.071 . 1 . . . . . 51 THR N . 28060 1
189 . 1 . 1 45 45 GLU H H 1 8.125 0.014 . 1 . . . . . 52 GLU H . 28060 1
190 . 1 . 1 45 45 GLU C C 13 174.912 0.000 . 1 . . . . . 52 GLU C . 28060 1
191 . 1 . 1 45 45 GLU CA C 13 54.664 0.000 . 1 . . . . . 52 GLU CA . 28060 1
192 . 1 . 1 45 45 GLU CB C 13 28.803 0.000 . 1 . . . . . 52 GLU CB . 28060 1
193 . 1 . 1 45 45 GLU N N 15 119.404 0.122 . 1 . . . . . 52 GLU N . 28060 1
194 . 1 . 1 46 46 ASN H H 1 7.279 0.042 . 1 . . . . . 53 ASN H . 28060 1
195 . 1 . 1 46 46 ASN C C 13 176.385 0.000 . 1 . . . . . 53 ASN C . 28060 1
196 . 1 . 1 46 46 ASN CA C 13 54.270 0.020 . 1 . . . . . 53 ASN CA . 28060 1
197 . 1 . 1 46 46 ASN CB C 13 36.873 0.017 . 1 . . . . . 53 ASN CB . 28060 1
198 . 1 . 1 46 46 ASN N N 15 120.070 0.011 . 1 . . . . . 53 ASN N . 28060 1
199 . 1 . 1 47 47 THR H H 1 7.456 0.013 . 1 . . . . . 54 THR H . 28060 1
200 . 1 . 1 47 47 THR C C 13 173.023 0.000 . 1 . . . . . 54 THR C . 28060 1
201 . 1 . 1 47 47 THR CA C 13 59.718 0.066 . 1 . . . . . 54 THR CA . 28060 1
202 . 1 . 1 47 47 THR CB C 13 72.400 0.018 . 1 . . . . . 54 THR CB . 28060 1
203 . 1 . 1 47 47 THR N N 15 110.007 0.021 . 1 . . . . . 54 THR N . 28060 1
204 . 1 . 1 48 48 TRP H H 1 8.595 0.003 . 1 . . . . . 55 TRP H . 28060 1
205 . 1 . 1 48 48 TRP C C 13 177.449 0.000 . 1 . . . . . 55 TRP C . 28060 1
206 . 1 . 1 48 48 TRP CA C 13 56.153 0.044 . 1 . . . . . 55 TRP CA . 28060 1
207 . 1 . 1 48 48 TRP CB C 13 30.473 0.026 . 1 . . . . . 55 TRP CB . 28060 1
208 . 1 . 1 48 48 TRP N N 15 120.539 0.061 . 1 . . . . . 55 TRP N . 28060 1
209 . 1 . 1 49 49 GLU H H 1 9.552 0.002 . 1 . . . . . 56 GLU H . 28060 1
210 . 1 . 1 49 49 GLU CA C 13 52.038 0.005 . 1 . . . . . 56 GLU CA . 28060 1
211 . 1 . 1 49 49 GLU CB C 13 32.807 0.000 . 1 . . . . . 56 GLU CB . 28060 1
212 . 1 . 1 49 49 GLU N N 15 122.425 0.019 . 1 . . . . . 56 GLU N . 28060 1
213 . 1 . 1 50 50 PRO C C 13 178.222 0.000 . 1 . . . . . 57 PRO C . 28060 1
214 . 1 . 1 50 50 PRO CA C 13 62.469 0.030 . 1 . . . . . 57 PRO CA . 28060 1
215 . 1 . 1 50 50 PRO CB C 13 32.570 0.026 . 1 . . . . . 57 PRO CB . 28060 1
216 . 1 . 1 51 51 GLU H H 1 8.840 0.007 . 1 . . . . . 58 GLU H . 28060 1
217 . 1 . 1 51 51 GLU C C 13 177.436 0.000 . 1 . . . . . 58 GLU C . 28060 1
218 . 1 . 1 51 51 GLU CA C 13 59.839 0.010 . 1 . . . . . 58 GLU CA . 28060 1
219 . 1 . 1 51 51 GLU CB C 13 29.840 0.000 . 1 . . . . . 58 GLU CB . 28060 1
220 . 1 . 1 51 51 GLU N N 15 122.294 0.030 . 1 . . . . . 58 GLU N . 28060 1
221 . 1 . 1 52 52 ASN H H 1 8.295 0.008 . 1 . . . . . 59 ASN H . 28060 1
222 . 1 . 1 52 52 ASN C C 13 175.527 0.000 . 1 . . . . . 59 ASN C . 28060 1
223 . 1 . 1 52 52 ASN CA C 13 54.699 0.000 . 1 . . . . . 59 ASN CA . 28060 1
224 . 1 . 1 52 52 ASN CB C 13 37.465 0.012 . 1 . . . . . 59 ASN CB . 28060 1
225 . 1 . 1 52 52 ASN N N 15 114.036 0.017 . 1 . . . . . 59 ASN N . 28060 1
226 . 1 . 1 53 53 ASN H H 1 7.974 0.003 . 1 . . . . . 60 ASN H . 28060 1
227 . 1 . 1 53 53 ASN C C 13 174.950 0.000 . 1 . . . . . 60 ASN C . 28060 1
228 . 1 . 1 53 53 ASN CA C 13 52.488 0.019 . 1 . . . . . 60 ASN CA . 28060 1
229 . 1 . 1 53 53 ASN CB C 13 39.523 0.000 . 1 . . . . . 60 ASN CB . 28060 1
230 . 1 . 1 53 53 ASN N N 15 117.340 0.019 . 1 . . . . . 60 ASN N . 28060 1
231 . 1 . 1 54 54 LEU H H 1 7.476 0.004 . 1 . . . . . 61 LEU H . 28060 1
232 . 1 . 1 54 54 LEU C C 13 176.585 0.000 . 1 . . . . . 61 LEU C . 28060 1
233 . 1 . 1 54 54 LEU CA C 13 54.757 0.048 . 1 . . . . . 61 LEU CA . 28060 1
234 . 1 . 1 54 54 LEU CB C 13 44.288 0.020 . 1 . . . . . 61 LEU CB . 28060 1
235 . 1 . 1 54 54 LEU N N 15 119.571 0.070 . 1 . . . . . 61 LEU N . 28060 1
236 . 1 . 1 55 55 ASP H H 1 8.618 0.029 . 1 . . . . . 62 ASP H . 28060 1
237 . 1 . 1 55 55 ASP C C 13 176.172 0.000 . 1 . . . . . 62 ASP C . 28060 1
238 . 1 . 1 55 55 ASP CA C 13 52.976 0.005 . 1 . . . . . 62 ASP CA . 28060 1
239 . 1 . 1 55 55 ASP CB C 13 41.063 0.006 . 1 . . . . . 62 ASP CB . 28060 1
240 . 1 . 1 55 55 ASP N N 15 120.188 0.037 . 1 . . . . . 62 ASP N . 28060 1
241 . 1 . 1 56 56 CYS H H 1 7.776 0.011 . 1 . . . . . 63 CYS H . 28060 1
242 . 1 . 1 56 56 CYS C C 13 175.295 0.000 . 1 . . . . . 63 CYS C . 28060 1
243 . 1 . 1 56 56 CYS CA C 13 53.425 0.025 . 1 . . . . . 63 CYS CA . 28060 1
244 . 1 . 1 56 56 CYS CB C 13 27.562 0.026 . 1 . . . . . 63 CYS CB . 28060 1
245 . 1 . 1 56 56 CYS N N 15 116.824 0.054 . 1 . . . . . 63 CYS N . 28060 1
246 . 1 . 1 57 57 GLN H H 1 8.381 0.002 . 1 . . . . . 64 GLN H . 28060 1
247 . 1 . 1 57 57 GLN C C 13 177.459 0.000 . 1 . . . . . 64 GLN C . 28060 1
248 . 1 . 1 57 57 GLN CA C 13 59.763 0.004 . 1 . . . . . 64 GLN CA . 28060 1
249 . 1 . 1 57 57 GLN CB C 13 28.137 0.078 . 1 . . . . . 64 GLN CB . 28060 1
250 . 1 . 1 57 57 GLN N N 15 122.540 0.008 . 1 . . . . . 64 GLN N . 28060 1
251 . 1 . 1 58 58 ASP H H 1 8.797 0.001 . 1 . . . . . 65 ASP H . 28060 1
252 . 1 . 1 58 58 ASP C C 13 178.475 0.000 . 1 . . . . . 65 ASP C . 28060 1
253 . 1 . 1 58 58 ASP CA C 13 57.083 0.037 . 1 . . . . . 65 ASP CA . 28060 1
254 . 1 . 1 58 58 ASP CB C 13 39.094 0.017 . 1 . . . . . 65 ASP CB . 28060 1
255 . 1 . 1 58 58 ASP N N 15 118.141 0.009 . 1 . . . . . 65 ASP N . 28060 1
256 . 1 . 1 59 59 LEU H H 1 7.599 0.006 . 1 . . . . . 66 LEU H . 28060 1
257 . 1 . 1 59 59 LEU C C 13 180.634 0.000 . 1 . . . . . 66 LEU C . 28060 1
258 . 1 . 1 59 59 LEU CA C 13 57.441 0.006 . 1 . . . . . 66 LEU CA . 28060 1
259 . 1 . 1 59 59 LEU CB C 13 41.667 0.000 . 1 . . . . . 66 LEU CB . 28060 1
260 . 1 . 1 59 59 LEU N N 15 120.696 0.024 . 1 . . . . . 66 LEU N . 28060 1
261 . 1 . 1 60 60 ILE H H 1 7.843 0.010 . 1 . . . . . 67 ILE H . 28060 1
262 . 1 . 1 60 60 ILE C C 13 177.361 0.000 . 1 . . . . . 67 ILE C . 28060 1
263 . 1 . 1 60 60 ILE CA C 13 66.097 0.001 . 1 . . . . . 67 ILE CA . 28060 1
264 . 1 . 1 60 60 ILE CB C 13 38.361 0.007 . 1 . . . . . 67 ILE CB . 28060 1
265 . 1 . 1 60 60 ILE N N 15 121.945 0.038 . 1 . . . . . 67 ILE N . 28060 1
266 . 1 . 1 61 61 GLN H H 1 8.341 0.014 . 1 . . . . . 68 GLN H . 28060 1
267 . 1 . 1 61 61 GLN C C 13 179.445 0.000 . 1 . . . . . 68 GLN C . 28060 1
268 . 1 . 1 61 61 GLN CA C 13 59.232 0.005 . 1 . . . . . 68 GLN CA . 28060 1
269 . 1 . 1 61 61 GLN CB C 13 27.880 0.001 . 1 . . . . . 68 GLN CB . 28060 1
270 . 1 . 1 61 61 GLN N N 15 118.831 0.014 . 1 . . . . . 68 GLN N . 28060 1
271 . 1 . 1 62 62 GLN H H 1 7.919 0.007 . 1 . . . . . 69 GLN H . 28060 1
272 . 1 . 1 62 62 GLN C C 13 178.445 0.000 . 1 . . . . . 69 GLN C . 28060 1
273 . 1 . 1 62 62 GLN CA C 13 58.801 0.037 . 1 . . . . . 69 GLN CA . 28060 1
274 . 1 . 1 62 62 GLN CB C 13 28.730 0.038 . 1 . . . . . 69 GLN CB . 28060 1
275 . 1 . 1 62 62 GLN N N 15 118.396 0.023 . 1 . . . . . 69 GLN N . 28060 1
276 . 1 . 1 63 63 TYR H H 1 8.037 0.001 . 1 . . . . . 70 TYR H . 28060 1
277 . 1 . 1 63 63 TYR C C 13 178.986 0.000 . 1 . . . . . 70 TYR C . 28060 1
278 . 1 . 1 63 63 TYR CA C 13 61.771 0.032 . 1 . . . . . 70 TYR CA . 28060 1
279 . 1 . 1 63 63 TYR CB C 13 38.429 0.008 . 1 . . . . . 70 TYR CB . 28060 1
280 . 1 . 1 63 63 TYR N N 15 121.894 0.013 . 1 . . . . . 70 TYR N . 28060 1
281 . 1 . 1 64 64 GLU H H 1 8.881 0.003 . 1 . . . . . 71 GLU H . 28060 1
282 . 1 . 1 64 64 GLU C C 13 179.191 0.000 . 1 . . . . . 71 GLU C . 28060 1
283 . 1 . 1 64 64 GLU CA C 13 58.860 0.046 . 1 . . . . . 71 GLU CA . 28060 1
284 . 1 . 1 64 64 GLU CB C 13 29.075 0.000 . 1 . . . . . 71 GLU CB . 28060 1
285 . 1 . 1 64 64 GLU N N 15 119.651 0.021 . 1 . . . . . 71 GLU N . 28060 1
286 . 1 . 1 65 65 ALA H H 1 7.951 0.007 . 1 . . . . . 72 ALA H . 28060 1
287 . 1 . 1 65 65 ALA C C 13 178.895 0.000 . 1 . . . . . 72 ALA C . 28060 1
288 . 1 . 1 65 65 ALA CA C 13 54.154 0.018 . 1 . . . . . 72 ALA CA . 28060 1
289 . 1 . 1 65 65 ALA CB C 13 18.335 0.000 . 1 . . . . . 72 ALA CB . 28060 1
290 . 1 . 1 65 65 ALA N N 15 119.944 0.014 . 1 . . . . . 72 ALA N . 28060 1
291 . 1 . 1 66 66 SER H H 1 7.469 0.003 . 1 . . . . . 73 SER H . 28060 1
292 . 1 . 1 66 66 SER C C 13 174.230 0.000 . 1 . . . . . 73 SER C . 28060 1
293 . 1 . 1 66 66 SER CA C 13 58.877 0.038 . 1 . . . . . 73 SER CA . 28060 1
294 . 1 . 1 66 66 SER CB C 13 64.097 0.035 . 1 . . . . . 73 SER CB . 28060 1
295 . 1 . 1 66 66 SER N N 15 112.066 0.017 . 1 . . . . . 73 SER N . 28060 1
296 . 1 . 1 67 67 ARG H H 1 7.284 0.002 . 1 . . . . . 74 ARG H . 28060 1
297 . 1 . 1 67 67 ARG C C 13 176.020 0.000 . 1 . . . . . 74 ARG C . 28060 1
298 . 1 . 1 67 67 ARG CA C 13 56.437 0.014 . 1 . . . . . 74 ARG CA . 28060 1
299 . 1 . 1 67 67 ARG CB C 13 30.595 0.016 . 1 . . . . . 74 ARG CB . 28060 1
300 . 1 . 1 67 67 ARG N N 15 122.396 0.007 . 1 . . . . . 74 ARG N . 28060 1
301 . 1 . 1 68 68 LYS H H 1 8.179 0.002 . 1 . . . . . 75 LYS H . 28060 1
302 . 1 . 1 68 68 LYS C C 13 175.266 0.000 . 1 . . . . . 75 LYS C . 28060 1
303 . 1 . 1 68 68 LYS CA C 13 55.768 0.000 . 1 . . . . . 75 LYS CA . 28060 1
304 . 1 . 1 68 68 LYS CB C 13 33.293 0.000 . 1 . . . . . 75 LYS CB . 28060 1
305 . 1 . 1 68 68 LYS N N 15 122.590 0.010 . 1 . . . . . 75 LYS N . 28060 1
306 . 1 . 1 69 69 ASP H H 1 7.973 0.003 . 1 . . . . . 76 ASP H . 28060 1
307 . 1 . 1 69 69 ASP CA C 13 55.769 0.023 . 1 . . . . . 76 ASP CA . 28060 1
308 . 1 . 1 69 69 ASP CB C 13 42.133 0.000 . 1 . . . . . 76 ASP CB . 28060 1
309 . 1 . 1 69 69 ASP N N 15 126.856 0.014 . 1 . . . . . 76 ASP N . 28060 1
stop_
save_