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 50908
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'backbone assignment of human CSNAP'
_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 '2D 1H-15N HSQC' . . . 50908 1
2 '3D HNCO' . . . 50908 1
3 '3D HN(CA)CO' . . . 50908 1
4 '3D HNCACB' . . . 50908 1
5 '3D CBCA(CO)NH' . . . 50908 1
6 '3D HN(CA)NNH' . . . 50908 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 . . 50908 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 2 2 MET C C 13 176.195 0.005 . 1 . . . . . 1 MET C . 50908 1
2 . 1 . 1 2 2 MET CA C 13 55.373 0.000 . 1 . . . . . 1 MET CA . 50908 1
3 . 1 . 1 2 2 MET CB C 13 33.074 0.100 . 1 . . . . . 1 MET CB . 50908 1
4 . 1 . 1 3 3 LYS H H 1 8.625 0.001 . 1 . . . . . 2 LYS H . 50908 1
5 . 1 . 1 3 3 LYS C C 13 174.322 0.000 . 1 . . . . . 2 LYS C . 50908 1
6 . 1 . 1 3 3 LYS CA C 13 54.387 0.000 . 1 . . . . . 2 LYS CA . 50908 1
7 . 1 . 1 3 3 LYS CB C 13 32.756 0.000 . 1 . . . . . 2 LYS CB . 50908 1
8 . 1 . 1 3 3 LYS N N 15 125.078 0.011 . 1 . . . . . 2 LYS N . 50908 1
9 . 1 . 1 4 4 PRO C C 13 176.479 0.000 . 1 . . . . . 3 PRO C . 50908 1
10 . 1 . 1 4 4 PRO CA C 13 62.950 0.000 . 1 . . . . . 3 PRO CA . 50908 1
11 . 1 . 1 4 4 PRO CB C 13 32.184 0.000 . 1 . . . . . 3 PRO CB . 50908 1
12 . 1 . 1 5 5 ALA H H 1 8.556 0.001 . 1 . . . . . 4 ALA H . 50908 1
13 . 1 . 1 5 5 ALA C C 13 177.982 0.018 . 1 . . . . . 4 ALA C . 50908 1
14 . 1 . 1 5 5 ALA CA C 13 52.445 0.022 . 1 . . . . . 4 ALA CA . 50908 1
15 . 1 . 1 5 5 ALA CB C 13 19.237 0.057 . 1 . . . . . 4 ALA CB . 50908 1
16 . 1 . 1 5 5 ALA N N 15 125.200 0.009 . 1 . . . . . 4 ALA N . 50908 1
17 . 1 . 1 6 6 VAL H H 1 8.224 0.001 . 1 . . . . . 5 VAL H . 50908 1
18 . 1 . 1 6 6 VAL C C 13 175.860 0.012 . 1 . . . . . 5 VAL C . 50908 1
19 . 1 . 1 6 6 VAL CA C 13 62.284 0.030 . 1 . . . . . 5 VAL CA . 50908 1
20 . 1 . 1 6 6 VAL CB C 13 32.994 0.073 . 1 . . . . . 5 VAL CB . 50908 1
21 . 1 . 1 6 6 VAL N N 15 119.191 0.019 . 1 . . . . . 5 VAL N . 50908 1
22 . 1 . 1 7 7 ASP H H 1 8.440 0.002 . 1 . . . . . 6 ASP H . 50908 1
23 . 1 . 1 7 7 ASP C C 13 176.205 0.004 . 1 . . . . . 6 ASP C . 50908 1
24 . 1 . 1 7 7 ASP CA C 13 54.312 0.030 . 1 . . . . . 6 ASP CA . 50908 1
25 . 1 . 1 7 7 ASP CB C 13 41.217 0.043 . 1 . . . . . 6 ASP CB . 50908 1
26 . 1 . 1 7 7 ASP N N 15 123.558 0.019 . 1 . . . . . 6 ASP N . 50908 1
27 . 1 . 1 8 8 GLU H H 1 8.328 0.002 . 1 . . . . . 7 GLU H . 50908 1
28 . 1 . 1 8 8 GLU C C 13 176.300 0.001 . 1 . . . . . 7 GLU C . 50908 1
29 . 1 . 1 8 8 GLU CA C 13 56.666 0.009 . 1 . . . . . 7 GLU CA . 50908 1
30 . 1 . 1 8 8 GLU CB C 13 30.294 0.022 . 1 . . . . . 7 GLU CB . 50908 1
31 . 1 . 1 8 8 GLU N N 15 121.642 0.073 . 1 . . . . . 7 GLU N . 50908 1
32 . 1 . 1 9 9 MET H H 1 8.346 0.002 . 1 . . . . . 8 MET H . 50908 1
33 . 1 . 1 9 9 MET C C 13 175.634 0.001 . 1 . . . . . 8 MET C . 50908 1
34 . 1 . 1 9 9 MET CA C 13 55.871 0.000 . 1 . . . . . 8 MET CA . 50908 1
35 . 1 . 1 9 9 MET CB C 13 40.169 0.000 . 1 . . . . . 8 MET CB . 50908 1
36 . 1 . 1 9 9 MET N N 15 120.832 0.145 . 1 . . . . . 8 MET N . 50908 1
37 . 1 . 1 10 10 PHE H H 1 8.328 0.004 . 1 . . . . . 9 PHE H . 50908 1
38 . 1 . 1 10 10 PHE C C 13 173.812 0.000 . 1 . . . . . 9 PHE C . 50908 1
39 . 1 . 1 10 10 PHE CA C 13 54.757 0.000 . 1 . . . . . 9 PHE CA . 50908 1
40 . 1 . 1 10 10 PHE CB C 13 39.311 0.000 . 1 . . . . . 9 PHE CB . 50908 1
41 . 1 . 1 10 10 PHE N N 15 121.154 0.054 . 1 . . . . . 9 PHE N . 50908 1
42 . 1 . 1 11 11 PRO C C 13 177.055 0.000 . 1 . . . . . 10 PRO C . 50908 1
43 . 1 . 1 11 11 PRO CA C 13 63.302 0.024 . 1 . . . . . 10 PRO CA . 50908 1
44 . 1 . 1 11 11 PRO CB C 13 32.095 0.031 . 1 . . . . . 10 PRO CB . 50908 1
45 . 1 . 1 12 12 GLU H H 1 8.713 0.001 . 1 . . . . . 11 GLU H . 50908 1
46 . 1 . 1 12 12 GLU C C 13 177.365 0.017 . 1 . . . . . 11 GLU C . 50908 1
47 . 1 . 1 12 12 GLU CA C 13 57.004 0.003 . 1 . . . . . 11 GLU CA . 50908 1
48 . 1 . 1 12 12 GLU CB C 13 29.998 0.018 . 1 . . . . . 11 GLU CB . 50908 1
49 . 1 . 1 12 12 GLU N N 15 121.084 0.020 . 1 . . . . . 11 GLU N . 50908 1
50 . 1 . 1 13 13 GLY H H 1 8.532 0.002 . 1 . . . . . 12 GLY H . 50908 1
51 . 1 . 1 13 13 GLY C C 13 173.797 0.003 . 1 . . . . . 12 GLY C . 50908 1
52 . 1 . 1 13 13 GLY CA C 13 45.286 0.009 . 1 . . . . . 12 GLY CA . 50908 1
53 . 1 . 1 13 13 GLY N N 15 110.780 0.019 . 1 . . . . . 12 GLY N . 50908 1
54 . 1 . 1 14 14 ALA H H 1 8.262 0.001 . 1 . . . . . 13 ALA H . 50908 1
55 . 1 . 1 14 14 ALA C C 13 177.779 0.002 . 1 . . . . . 13 ALA C . 50908 1
56 . 1 . 1 14 14 ALA CA C 13 52.113 0.106 . 1 . . . . . 13 ALA CA . 50908 1
57 . 1 . 1 14 14 ALA CB C 13 19.792 0.091 . 1 . . . . . 13 ALA CB . 50908 1
58 . 1 . 1 14 14 ALA N N 15 123.746 0.027 . 1 . . . . . 13 ALA N . 50908 1
59 . 1 . 1 15 15 GLY H H 1 8.288 0.001 . 1 . . . . . 14 GLY H . 50908 1
60 . 1 . 1 15 15 GLY C C 13 171.694 0.000 . 1 . . . . . 14 GLY C . 50908 1
61 . 1 . 1 15 15 GLY CA C 13 44.439 0.000 . 1 . . . . . 14 GLY CA . 50908 1
62 . 1 . 1 15 15 GLY N N 15 108.373 0.022 . 1 . . . . . 14 GLY N . 50908 1
63 . 1 . 1 16 16 PRO C C 13 176.644 0.000 . 1 . . . . . 15 PRO C . 50908 1
64 . 1 . 1 16 16 PRO CA C 13 62.884 0.000 . 1 . . . . . 15 PRO CA . 50908 1
65 . 1 . 1 16 16 PRO CB C 13 32.083 0.034 . 1 . . . . . 15 PRO CB . 50908 1
66 . 1 . 1 17 17 TYR H H 1 8.377 0.003 . 1 . . . . . 16 TYR H . 50908 1
67 . 1 . 1 17 17 TYR C C 13 175.583 0.005 . 1 . . . . . 16 TYR C . 50908 1
68 . 1 . 1 17 17 TYR CA C 13 58.059 0.015 . 1 . . . . . 16 TYR CA . 50908 1
69 . 1 . 1 17 17 TYR CB C 13 38.623 0.038 . 1 . . . . . 16 TYR CB . 50908 1
70 . 1 . 1 17 17 TYR N N 15 121.143 0.047 . 1 . . . . . 16 TYR N . 50908 1
71 . 1 . 1 18 18 VAL H H 1 7.831 0.005 . 1 . . . . . 17 VAL H . 50908 1
72 . 1 . 1 18 18 VAL C C 13 174.634 0.004 . 1 . . . . . 17 VAL C . 50908 1
73 . 1 . 1 18 18 VAL CA C 13 61.649 0.000 . 1 . . . . . 17 VAL CA . 50908 1
74 . 1 . 1 18 18 VAL CB C 13 33.466 0.032 . 1 . . . . . 17 VAL CB . 50908 1
75 . 1 . 1 18 18 VAL N N 15 124.362 0.105 . 1 . . . . . 17 VAL N . 50908 1
76 . 1 . 1 19 19 ASP H H 1 8.376 0.004 . 1 . . . . . 18 ASP H . 50908 1
77 . 1 . 1 19 19 ASP C C 13 176.278 0.007 . 1 . . . . . 18 ASP C . 50908 1
78 . 1 . 1 19 19 ASP CA C 13 53.997 0.014 . 1 . . . . . 18 ASP CA . 50908 1
79 . 1 . 1 19 19 ASP CB C 13 41.257 0.055 . 1 . . . . . 18 ASP CB . 50908 1
80 . 1 . 1 19 19 ASP N N 15 124.561 0.093 . 1 . . . . . 18 ASP N . 50908 1
81 . 1 . 1 20 20 LEU H H 1 8.365 0.002 . 1 . . . . . 19 LEU H . 50908 1
82 . 1 . 1 20 20 LEU C C 13 177.503 0.004 . 1 . . . . . 19 LEU C . 50908 1
83 . 1 . 1 20 20 LEU CA C 13 55.373 0.022 . 1 . . . . . 19 LEU CA . 50908 1
84 . 1 . 1 20 20 LEU CB C 13 42.543 0.041 . 1 . . . . . 19 LEU CB . 50908 1
85 . 1 . 1 20 20 LEU N N 15 124.243 0.020 . 1 . . . . . 19 LEU N . 50908 1
86 . 1 . 1 21 21 ASP H H 1 8.469 0.004 . 1 . . . . . 20 ASP H . 50908 1
87 . 1 . 1 21 21 ASP C C 13 176.780 0.008 . 1 . . . . . 20 ASP C . 50908 1
88 . 1 . 1 21 21 ASP CA C 13 54.564 0.078 . 1 . . . . . 20 ASP CA . 50908 1
89 . 1 . 1 21 21 ASP CB C 13 41.106 0.001 . 1 . . . . . 20 ASP CB . 50908 1
90 . 1 . 1 21 21 ASP N N 15 121.167 0.047 . 1 . . . . . 20 ASP N . 50908 1
91 . 1 . 1 22 22 GLU H H 1 8.361 0.006 . 1 . . . . . 21 GLU H . 50908 1
92 . 1 . 1 22 22 GLU C C 13 176.835 0.010 . 1 . . . . . 21 GLU C . 50908 1
93 . 1 . 1 22 22 GLU CA C 13 56.995 0.042 . 1 . . . . . 21 GLU CA . 50908 1
94 . 1 . 1 22 22 GLU CB C 13 30.070 0.005 . 1 . . . . . 21 GLU CB . 50908 1
95 . 1 . 1 22 22 GLU N N 15 121.857 0.019 . 1 . . . . . 21 GLU N . 50908 1
96 . 1 . 1 23 23 ALA H H 1 8.429 0.002 . 1 . . . . . 22 ALA H . 50908 1
97 . 1 . 1 23 23 ALA C C 13 178.652 0.006 . 1 . . . . . 22 ALA C . 50908 1
98 . 1 . 1 23 23 ALA CA C 13 52.949 0.004 . 1 . . . . . 22 ALA CA . 50908 1
99 . 1 . 1 23 23 ALA CB C 13 19.009 0.058 . 1 . . . . . 22 ALA CB . 50908 1
100 . 1 . 1 23 23 ALA N N 15 124.497 0.020 . 1 . . . . . 22 ALA N . 50908 1
101 . 1 . 1 24 24 GLY H H 1 8.394 0.002 . 1 . . . . . 23 GLY H . 50908 1
102 . 1 . 1 24 24 GLY C C 13 175.029 0.007 . 1 . . . . . 23 GLY C . 50908 1
103 . 1 . 1 24 24 GLY CA C 13 45.582 0.012 . 1 . . . . . 23 GLY CA . 50908 1
104 . 1 . 1 24 24 GLY N N 15 108.016 0.025 . 1 . . . . . 23 GLY N . 50908 1
105 . 1 . 1 25 25 GLY H H 1 8.346 0.005 . 1 . . . . . 24 GLY H . 50908 1
106 . 1 . 1 25 25 GLY C C 13 174.512 0.005 . 1 . . . . . 24 GLY C . 50908 1
107 . 1 . 1 25 25 GLY CA C 13 45.320 0.030 . 1 . . . . . 24 GLY CA . 50908 1
108 . 1 . 1 25 25 GLY N N 15 108.825 0.037 . 1 . . . . . 24 GLY N . 50908 1
109 . 1 . 1 26 26 SER H H 1 8.438 0.003 . 1 . . . . . 25 SER H . 50908 1
110 . 1 . 1 26 26 SER C C 13 175.326 0.010 . 1 . . . . . 25 SER C . 50908 1
111 . 1 . 1 26 26 SER CA C 13 58.451 0.036 . 1 . . . . . 25 SER CA . 50908 1
112 . 1 . 1 26 26 SER CB C 13 63.734 0.023 . 1 . . . . . 25 SER CB . 50908 1
113 . 1 . 1 26 26 SER N N 15 115.714 0.048 . 1 . . . . . 25 SER N . 50908 1
114 . 1 . 1 27 27 THR H H 1 8.352 0.003 . 1 . . . . . 26 THR H . 50908 1
115 . 1 . 1 27 27 THR C C 13 175.413 0.019 . 1 . . . . . 26 THR C . 50908 1
116 . 1 . 1 27 27 THR CA C 13 62.333 0.056 . 1 . . . . . 26 THR CA . 50908 1
117 . 1 . 1 27 27 THR CB C 13 69.531 0.049 . 1 . . . . . 26 THR CB . 50908 1
118 . 1 . 1 27 27 THR N N 15 115.642 0.020 . 1 . . . . . 26 THR N . 50908 1
119 . 1 . 1 28 28 GLY H H 1 8.461 0.003 . 1 . . . . . 27 GLY H . 50908 1
120 . 1 . 1 28 28 GLY C C 13 174.103 0.005 . 1 . . . . . 27 GLY C . 50908 1
121 . 1 . 1 28 28 GLY CA C 13 45.467 0.003 . 1 . . . . . 27 GLY CA . 50908 1
122 . 1 . 1 28 28 GLY N N 15 111.065 0.025 . 1 . . . . . 27 GLY N . 50908 1
123 . 1 . 1 29 29 LEU H H 1 8.116 0.005 . 1 . . . . . 28 LEU H . 50908 1
124 . 1 . 1 29 29 LEU C C 13 177.529 0.008 . 1 . . . . . 28 LEU C . 50908 1
125 . 1 . 1 29 29 LEU CA C 13 55.303 0.001 . 1 . . . . . 28 LEU CA . 50908 1
126 . 1 . 1 29 29 LEU CB C 13 42.382 0.075 . 1 . . . . . 28 LEU CB . 50908 1
127 . 1 . 1 29 29 LEU N N 15 121.622 0.042 . 1 . . . . . 28 LEU N . 50908 1
128 . 1 . 1 30 30 LEU H H 1 8.330 0.002 . 1 . . . . . 29 LEU H . 50908 1
129 . 1 . 1 30 30 LEU C C 13 177.526 0.007 . 1 . . . . . 29 LEU C . 50908 1
130 . 1 . 1 30 30 LEU CA C 13 55.336 0.015 . 1 . . . . . 29 LEU CA . 50908 1
131 . 1 . 1 30 30 LEU CB C 13 41.977 0.028 . 1 . . . . . 29 LEU CB . 50908 1
132 . 1 . 1 30 30 LEU N N 15 122.806 0.026 . 1 . . . . . 29 LEU N . 50908 1
133 . 1 . 1 31 31 MET H H 1 8.340 0.003 . 1 . . . . . 30 MET H . 50908 1
134 . 1 . 1 31 31 MET C C 13 175.953 0.003 . 1 . . . . . 30 MET C . 50908 1
135 . 1 . 1 31 31 MET CA C 13 55.489 0.021 . 1 . . . . . 30 MET CA . 50908 1
136 . 1 . 1 31 31 MET CB C 13 32.929 0.015 . 1 . . . . . 30 MET CB . 50908 1
137 . 1 . 1 31 31 MET N N 15 121.191 0.030 . 1 . . . . . 30 MET N . 50908 1
138 . 1 . 1 32 32 ASP H H 1 8.392 0.003 . 1 . . . . . 31 ASP H . 50908 1
139 . 1 . 1 32 32 ASP C C 13 176.520 0.003 . 1 . . . . . 31 ASP C . 50908 1
140 . 1 . 1 32 32 ASP CA C 13 54.295 0.004 . 1 . . . . . 31 ASP CA . 50908 1
141 . 1 . 1 32 32 ASP CB C 13 40.990 0.027 . 1 . . . . . 31 ASP CB . 50908 1
142 . 1 . 1 32 32 ASP N N 15 121.931 0.087 . 1 . . . . . 31 ASP N . 50908 1
143 . 1 . 1 33 33 LEU H H 1 8.305 0.004 . 1 . . . . . 32 LEU H . 50908 1
144 . 1 . 1 33 33 LEU C C 13 177.852 0.003 . 1 . . . . . 32 LEU C . 50908 1
145 . 1 . 1 33 33 LEU CA C 13 55.793 0.065 . 1 . . . . . 32 LEU CA . 50908 1
146 . 1 . 1 33 33 LEU CB C 13 42.061 0.091 . 1 . . . . . 32 LEU CB . 50908 1
147 . 1 . 1 33 33 LEU N N 15 123.459 0.071 . 1 . . . . . 32 LEU N . 50908 1
148 . 1 . 1 34 34 ALA H H 1 8.330 0.004 . 1 . . . . . 33 ALA H . 50908 1
149 . 1 . 1 34 34 ALA C C 13 178.226 0.002 . 1 . . . . . 33 ALA C . 50908 1
150 . 1 . 1 34 34 ALA CA C 13 52.939 0.017 . 1 . . . . . 33 ALA CA . 50908 1
151 . 1 . 1 34 34 ALA CB C 13 18.933 0.012 . 1 . . . . . 33 ALA CB . 50908 1
152 . 1 . 1 34 34 ALA N N 15 123.935 0.069 . 1 . . . . . 33 ALA N . 50908 1
153 . 1 . 1 35 35 ALA H H 1 8.145 0.004 . 1 . . . . . 34 ALA H . 50908 1
154 . 1 . 1 35 35 ALA C C 13 178.156 0.001 . 1 . . . . . 34 ALA C . 50908 1
155 . 1 . 1 35 35 ALA CA C 13 53.128 0.009 . 1 . . . . . 34 ALA CA . 50908 1
156 . 1 . 1 35 35 ALA CB C 13 18.995 0.068 . 1 . . . . . 34 ALA CB . 50908 1
157 . 1 . 1 35 35 ALA N N 15 122.463 0.037 . 1 . . . . . 34 ALA N . 50908 1
158 . 1 . 1 36 36 ASN H H 1 8.322 0.004 . 1 . . . . . 35 ASN H . 50908 1
159 . 1 . 1 36 36 ASN C C 13 175.602 0.002 . 1 . . . . . 35 ASN C . 50908 1
160 . 1 . 1 36 36 ASN CA C 13 53.403 0.005 . 1 . . . . . 35 ASN CA . 50908 1
161 . 1 . 1 36 36 ASN CB C 13 38.862 0.004 . 1 . . . . . 35 ASN CB . 50908 1
162 . 1 . 1 36 36 ASN N N 15 117.295 0.022 . 1 . . . . . 35 ASN N . 50908 1
163 . 1 . 1 37 37 GLU H H 1 8.319 0.006 . 1 . . . . . 36 GLU H . 50908 1
164 . 1 . 1 37 37 GLU C C 13 176.661 0.014 . 1 . . . . . 36 GLU C . 50908 1
165 . 1 . 1 37 37 GLU CA C 13 57.012 0.009 . 1 . . . . . 36 GLU CA . 50908 1
166 . 1 . 1 37 37 GLU CB C 13 30.242 0.021 . 1 . . . . . 36 GLU CB . 50908 1
167 . 1 . 1 37 37 GLU N N 15 121.309 0.031 . 1 . . . . . 36 GLU N . 50908 1
168 . 1 . 1 38 38 LYS H H 1 8.265 0.003 . 1 . . . . . 37 LYS H . 50908 1
169 . 1 . 1 38 38 LYS C C 13 176.432 0.003 . 1 . . . . . 37 LYS C . 50908 1
170 . 1 . 1 38 38 LYS CA C 13 56.332 0.019 . 1 . . . . . 37 LYS CA . 50908 1
171 . 1 . 1 38 38 LYS CB C 13 32.941 0.028 . 1 . . . . . 37 LYS CB . 50908 1
172 . 1 . 1 38 38 LYS N N 15 121.769 0.012 . 1 . . . . . 37 LYS N . 50908 1
173 . 1 . 1 39 39 ALA H H 1 8.240 0.001 . 1 . . . . . 38 ALA H . 50908 1
174 . 1 . 1 39 39 ALA C C 13 177.720 0.006 . 1 . . . . . 38 ALA C . 50908 1
175 . 1 . 1 39 39 ALA CA C 13 52.522 0.014 . 1 . . . . . 38 ALA CA . 50908 1
176 . 1 . 1 39 39 ALA CB C 13 19.207 0.049 . 1 . . . . . 38 ALA CB . 50908 1
177 . 1 . 1 39 39 ALA N N 15 125.135 0.012 . 1 . . . . . 38 ALA N . 50908 1
178 . 1 . 1 40 40 VAL H H 1 8.159 0.002 . 1 . . . . . 39 VAL H . 50908 1
179 . 1 . 1 40 40 VAL C C 13 176.050 0.011 . 1 . . . . . 39 VAL C . 50908 1
180 . 1 . 1 40 40 VAL CA C 13 62.298 0.021 . 1 . . . . . 39 VAL CA . 50908 1
181 . 1 . 1 40 40 VAL CB C 13 32.870 0.053 . 1 . . . . . 39 VAL CB . 50908 1
182 . 1 . 1 40 40 VAL N N 15 119.615 0.018 . 1 . . . . . 39 VAL N . 50908 1
183 . 1 . 1 41 41 HIS H H 1 8.451 0.003 . 1 . . . . . 40 HIS H . 50908 1
184 . 1 . 1 41 41 HIS C C 13 174.812 0.005 . 1 . . . . . 40 HIS C . 50908 1
185 . 1 . 1 41 41 HIS CA C 13 55.851 0.044 . 1 . . . . . 40 HIS CA . 50908 1
186 . 1 . 1 41 41 HIS CB C 13 30.529 0.052 . 1 . . . . . 40 HIS CB . 50908 1
187 . 1 . 1 41 41 HIS N N 15 123.557 0.027 . 1 . . . . . 40 HIS N . 50908 1
188 . 1 . 1 42 42 ALA H H 1 8.360 0.002 . 1 . . . . . 41 ALA H . 50908 1
189 . 1 . 1 42 42 ALA C C 13 177.241 0.008 . 1 . . . . . 41 ALA C . 50908 1
190 . 1 . 1 42 42 ALA CA C 13 52.606 0.028 . 1 . . . . . 41 ALA CA . 50908 1
191 . 1 . 1 42 42 ALA CB C 13 19.489 0.058 . 1 . . . . . 41 ALA CB . 50908 1
192 . 1 . 1 42 42 ALA N N 15 126.002 0.015 . 1 . . . . . 41 ALA N . 50908 1
193 . 1 . 1 43 43 ASP H H 1 8.528 0.003 . 1 . . . . . 42 ASP H . 50908 1
194 . 1 . 1 43 43 ASP C C 13 175.892 0.001 . 1 . . . . . 42 ASP C . 50908 1
195 . 1 . 1 43 43 ASP CA C 13 54.401 0.014 . 1 . . . . . 42 ASP CA . 50908 1
196 . 1 . 1 43 43 ASP CB C 13 41.162 0.017 . 1 . . . . . 42 ASP CB . 50908 1
197 . 1 . 1 43 43 ASP N N 15 119.674 0.014 . 1 . . . . . 42 ASP N . 50908 1
198 . 1 . 1 44 44 PHE H H 1 8.089 0.003 . 1 . . . . . 43 PHE H . 50908 1
199 . 1 . 1 44 44 PHE C C 13 175.254 0.006 . 1 . . . . . 43 PHE C . 50908 1
200 . 1 . 1 44 44 PHE CA C 13 57.782 0.044 . 1 . . . . . 43 PHE CA . 50908 1
201 . 1 . 1 44 44 PHE CB C 13 39.656 0.078 . 1 . . . . . 43 PHE CB . 50908 1
202 . 1 . 1 44 44 PHE N N 15 120.050 0.056 . 1 . . . . . 43 PHE N . 50908 1
203 . 1 . 1 45 45 PHE H H 1 8.183 0.004 . 1 . . . . . 44 PHE H . 50908 1
204 . 1 . 1 45 45 PHE C C 13 175.026 0.003 . 1 . . . . . 44 PHE C . 50908 1
205 . 1 . 1 45 45 PHE CA C 13 57.617 0.047 . 1 . . . . . 44 PHE CA . 50908 1
206 . 1 . 1 45 45 PHE CB C 13 39.718 0.022 . 1 . . . . . 44 PHE CB . 50908 1
207 . 1 . 1 45 45 PHE N N 15 121.611 0.015 . 1 . . . . . 44 PHE N . 50908 1
208 . 1 . 1 46 46 ASN H H 1 8.279 0.004 . 1 . . . . . 45 ASN H . 50908 1
209 . 1 . 1 46 46 ASN C C 13 174.447 0.007 . 1 . . . . . 45 ASN C . 50908 1
210 . 1 . 1 46 46 ASN CA C 13 52.982 0.010 . 1 . . . . . 45 ASN CA . 50908 1
211 . 1 . 1 46 46 ASN CB C 13 39.211 0.071 . 1 . . . . . 45 ASN CB . 50908 1
212 . 1 . 1 46 46 ASN N N 15 120.981 0.014 . 1 . . . . . 45 ASN N . 50908 1
213 . 1 . 1 47 47 ASP H H 1 8.165 0.003 . 1 . . . . . 46 ASP H . 50908 1
214 . 1 . 1 47 47 ASP C C 13 175.821 0.019 . 1 . . . . . 46 ASP C . 50908 1
215 . 1 . 1 47 47 ASP CA C 13 54.325 0.027 . 1 . . . . . 46 ASP CA . 50908 1
216 . 1 . 1 47 47 ASP CB C 13 40.966 0.035 . 1 . . . . . 46 ASP CB . 50908 1
217 . 1 . 1 47 47 ASP N N 15 121.185 0.021 . 1 . . . . . 46 ASP N . 50908 1
218 . 1 . 1 48 48 PHE H H 1 8.098 0.004 . 1 . . . . . 47 PHE H . 50908 1
219 . 1 . 1 48 48 PHE C C 13 175.613 0.001 . 1 . . . . . 47 PHE C . 50908 1
220 . 1 . 1 48 48 PHE CA C 13 57.629 0.050 . 1 . . . . . 47 PHE CA . 50908 1
221 . 1 . 1 48 48 PHE CB C 13 39.523 0.011 . 1 . . . . . 47 PHE CB . 50908 1
222 . 1 . 1 48 48 PHE N N 15 119.673 0.064 . 1 . . . . . 47 PHE N . 50908 1
223 . 1 . 1 49 49 GLU H H 1 8.242 0.007 . 1 . . . . . 48 GLU H . 50908 1
224 . 1 . 1 49 49 GLU C C 13 175.671 0.030 . 1 . . . . . 48 GLU C . 50908 1
225 . 1 . 1 49 49 GLU CA C 13 56.322 0.035 . 1 . . . . . 48 GLU CA . 50908 1
226 . 1 . 1 49 49 GLU CB C 13 30.759 0.044 . 1 . . . . . 48 GLU CB . 50908 1
227 . 1 . 1 49 49 GLU N N 15 122.441 0.009 . 1 . . . . . 48 GLU N . 50908 1
228 . 1 . 1 50 50 ASP H H 1 8.343 0.003 . 1 . . . . . 49 ASP H . 50908 1
229 . 1 . 1 50 50 ASP C C 13 175.680 0.006 . 1 . . . . . 49 ASP C . 50908 1
230 . 1 . 1 50 50 ASP CA C 13 54.166 0.018 . 1 . . . . . 49 ASP CA . 50908 1
231 . 1 . 1 50 50 ASP CB C 13 41.212 0.013 . 1 . . . . . 49 ASP CB . 50908 1
232 . 1 . 1 50 50 ASP N N 15 121.836 0.019 . 1 . . . . . 49 ASP N . 50908 1
233 . 1 . 1 51 51 LEU H H 1 8.136 0.002 . 1 . . . . . 50 LEU H . 50908 1
234 . 1 . 1 51 51 LEU C C 13 176.932 0.003 . 1 . . . . . 50 LEU C . 50908 1
235 . 1 . 1 51 51 LEU CA C 13 54.992 0.001 . 1 . . . . . 50 LEU CA . 50908 1
236 . 1 . 1 51 51 LEU CB C 13 42.426 0.021 . 1 . . . . . 50 LEU CB . 50908 1
237 . 1 . 1 51 51 LEU N N 15 122.588 0.033 . 1 . . . . . 50 LEU N . 50908 1
238 . 1 . 1 52 52 PHE H H 1 8.339 0.001 . 1 . . . . . 51 PHE H . 50908 1
239 . 1 . 1 52 52 PHE C C 13 175.311 0.006 . 1 . . . . . 51 PHE C . 50908 1
240 . 1 . 1 52 52 PHE CA C 13 57.341 0.010 . 1 . . . . . 51 PHE CA . 50908 1
241 . 1 . 1 52 52 PHE CB C 13 39.831 0.000 . 1 . . . . . 51 PHE CB . 50908 1
242 . 1 . 1 52 52 PHE N N 15 121.285 0.010 . 1 . . . . . 51 PHE N . 50908 1
243 . 1 . 1 53 53 ASP H H 1 8.422 0.002 . 1 . . . . . 52 ASP H . 50908 1
244 . 1 . 1 53 53 ASP C C 13 175.797 0.005 . 1 . . . . . 52 ASP C . 50908 1
245 . 1 . 1 53 53 ASP CA C 13 54.056 0.073 . 1 . . . . . 52 ASP CA . 50908 1
246 . 1 . 1 53 53 ASP CB C 13 41.546 0.018 . 1 . . . . . 52 ASP CB . 50908 1
247 . 1 . 1 53 53 ASP N N 15 122.892 0.012 . 1 . . . . . 52 ASP N . 50908 1
248 . 1 . 1 54 54 ASP H H 1 8.339 0.002 . 1 . . . . . 53 ASP H . 50908 1
249 . 1 . 1 54 54 ASP C C 13 176.262 0.002 . 1 . . . . . 53 ASP C . 50908 1
250 . 1 . 1 54 54 ASP CA C 13 54.339 0.014 . 1 . . . . . 53 ASP CA . 50908 1
251 . 1 . 1 54 54 ASP CB C 13 41.280 0.001 . 1 . . . . . 53 ASP CB . 50908 1
252 . 1 . 1 54 54 ASP N N 15 121.743 0.024 . 1 . . . . . 53 ASP N . 50908 1
253 . 1 . 1 55 55 ASP H H 1 8.416 0.004 . 1 . . . . . 54 ASP H . 50908 1
254 . 1 . 1 55 55 ASP C C 13 176.177 0.001 . 1 . . . . . 54 ASP C . 50908 1
255 . 1 . 1 55 55 ASP CA C 13 54.590 0.006 . 1 . . . . . 54 ASP CA . 50908 1
256 . 1 . 1 55 55 ASP CB C 13 41.156 0.000 . 1 . . . . . 54 ASP CB . 50908 1
257 . 1 . 1 55 55 ASP N N 15 120.743 0.023 . 1 . . . . . 54 ASP N . 50908 1
258 . 1 . 1 56 56 ASP H H 1 8.341 0.002 . 1 . . . . . 55 ASP H . 50908 1
259 . 1 . 1 56 56 ASP C C 13 176.081 0.001 . 1 . . . . . 55 ASP C . 50908 1
260 . 1 . 1 56 56 ASP CA C 13 54.318 0.021 . 1 . . . . . 55 ASP CA . 50908 1
261 . 1 . 1 56 56 ASP CB C 13 41.046 0.016 . 1 . . . . . 55 ASP CB . 50908 1
262 . 1 . 1 56 56 ASP N N 15 120.800 0.033 . 1 . . . . . 55 ASP N . 50908 1
263 . 1 . 1 57 57 ILE H H 1 8.053 0.002 . 1 . . . . . 56 ILE H . 50908 1
264 . 1 . 1 57 57 ILE C C 13 175.765 0.004 . 1 . . . . . 56 ILE C . 50908 1
265 . 1 . 1 57 57 ILE CA C 13 61.255 0.032 . 1 . . . . . 56 ILE CA . 50908 1
266 . 1 . 1 57 57 ILE CB C 13 38.599 0.024 . 1 . . . . . 56 ILE CB . 50908 1
267 . 1 . 1 57 57 ILE N N 15 121.468 0.015 . 1 . . . . . 56 ILE N . 50908 1
268 . 1 . 1 58 58 GLN H H 1 8.117 0.002 . 1 . . . . . 57 GLN H . 50908 1
269 . 1 . 1 58 58 GLN C C 13 180.780 0.000 . 1 . . . . . 57 GLN C . 50908 1
270 . 1 . 1 58 58 GLN CA C 13 57.321 0.000 . 1 . . . . . 57 GLN CA . 50908 1
271 . 1 . 1 58 58 GLN CB C 13 30.461 0.000 . 1 . . . . . 57 GLN CB . 50908 1
272 . 1 . 1 58 58 GLN N N 15 129.975 0.088 . 1 . . . . . 57 GLN N . 50908 1
stop_
save_