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 15918
_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 '2D 1H-15N HSQC' . . . 15918 1
2 '3D CBCA(CO)NH' . . . 15918 1
3 '3D HNCO' . . . 15918 1
4 '3D HNCACB' . . . 15918 1
5 '3D HN(CA)CO' . . . 15918 1
6 '3D 1H-15N TOCSY' . . . 15918 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
2 $CARA . . 15918 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 3 3 ALA H H 1 8.539 0.020 . 1 . . . . 3 ALA H . 15918 1
2 . 1 1 3 3 ALA C C 13 174.761 0.3 . 1 . . . . 3 ALA C . 15918 1
3 . 1 1 3 3 ALA CA C 13 50.410 0.3 . 1 . . . . 3 ALA CA . 15918 1
4 . 1 1 3 3 ALA CB C 13 16.597 0.3 . 1 . . . . 3 ALA CB . 15918 1
5 . 1 1 3 3 ALA N N 15 125.627 0.3 . 1 . . . . 3 ALA N . 15918 1
6 . 1 1 4 4 ALA H H 1 8.321 0.020 . 1 . . . . 4 ALA H . 15918 1
7 . 1 1 4 4 ALA C C 13 175.161 0.3 . 1 . . . . 4 ALA C . 15918 1
8 . 1 1 4 4 ALA CA C 13 50.138 0.3 . 1 . . . . 4 ALA CA . 15918 1
9 . 1 1 4 4 ALA CB C 13 16.605 0.3 . 1 . . . . 4 ALA CB . 15918 1
10 . 1 1 4 4 ALA N N 15 122.769 0.3 . 1 . . . . 4 ALA N . 15918 1
11 . 1 1 5 5 GLU H H 1 8.304 0.020 . 1 . . . . 5 GLU H . 15918 1
12 . 1 1 5 5 GLU C C 13 173.649 0.3 . 1 . . . . 5 GLU C . 15918 1
13 . 1 1 5 5 GLU CA C 13 53.883 0.3 . 1 . . . . 5 GLU CA . 15918 1
14 . 1 1 5 5 GLU CB C 13 27.700 0.3 . 1 . . . . 5 GLU CB . 15918 1
15 . 1 1 5 5 GLU N N 15 120.089 0.3 . 1 . . . . 5 GLU N . 15918 1
16 . 1 1 6 6 VAL H H 1 8.115 0.020 . 1 . . . . 6 VAL H . 15918 1
17 . 1 1 6 6 VAL C C 13 173.145 0.3 . 1 . . . . 6 VAL C . 15918 1
18 . 1 1 6 6 VAL CA C 13 59.600 0.3 . 1 . . . . 6 VAL CA . 15918 1
19 . 1 1 6 6 VAL CB C 13 30.185 0.3 . 1 . . . . 6 VAL CB . 15918 1
20 . 1 1 6 6 VAL N N 15 121.768 0.3 . 1 . . . . 6 VAL N . 15918 1
21 . 1 1 7 7 ILE H H 1 8.233 0.020 . 1 . . . . 7 ILE H . 15918 1
22 . 1 1 7 7 ILE CA C 13 58.192 0.3 . 1 . . . . 7 ILE CA . 15918 1
23 . 1 1 7 7 ILE CB C 13 35.985 0.3 . 1 . . . . 7 ILE CB . 15918 1
24 . 1 1 7 7 ILE N N 15 126.149 0.3 . 1 . . . . 7 ILE N . 15918 1
25 . 1 1 8 8 VAL H H 1 8.152 0.020 . 1 . . . . 8 VAL H . 15918 1
26 . 1 1 8 8 VAL CA C 13 59.352 0.3 . 1 . . . . 8 VAL CA . 15918 1
27 . 1 1 8 8 VAL CB C 13 30.268 0.3 . 1 . . . . 8 VAL CB . 15918 1
28 . 1 1 8 8 VAL N N 15 125.380 0.3 . 1 . . . . 8 VAL N . 15918 1
29 . 1 1 9 9 TYR H H 1 8.331 0.020 . 1 . . . . 9 TYR H . 15918 1
30 . 1 1 9 9 TYR C C 13 173.078 0.3 . 1 . . . . 9 TYR C . 15918 1
31 . 1 1 9 9 TYR CA C 13 55.291 0.3 . 1 . . . . 9 TYR CA . 15918 1
32 . 1 1 9 9 TYR CB C 13 36.400 0.3 . 1 . . . . 9 TYR CB . 15918 1
33 . 1 1 9 9 TYR N N 15 124.958 0.3 . 1 . . . . 9 TYR N . 15918 1
34 . 1 1 10 10 GLU H H 1 8.428 0.020 . 1 . . . . 10 GLU H . 15918 1
35 . 1 1 10 10 GLU C C 13 173.305 0.3 . 1 . . . . 10 GLU C . 15918 1
36 . 1 1 10 10 GLU CA C 13 53.717 0.3 . 1 . . . . 10 GLU CA . 15918 1
37 . 1 1 10 10 GLU CB C 13 27.865 0.3 . 1 . . . . 10 GLU CB . 15918 1
38 . 1 1 10 10 GLU N N 15 122.546 0.3 . 1 . . . . 10 GLU N . 15918 1
39 . 1 1 11 11 HIS H H 1 8.542 0.020 . 1 . . . . 11 HIS H . 15918 1
40 . 1 1 11 11 HIS C C 13 171.880 0.3 . 1 . . . . 11 HIS C . 15918 1
41 . 1 1 11 11 HIS CA C 13 52.806 0.3 . 1 . . . . 11 HIS CA . 15918 1
42 . 1 1 11 11 HIS CB C 13 26.871 0.3 . 1 . . . . 11 HIS CB . 15918 1
43 . 1 1 11 11 HIS N N 15 120.313 0.3 . 1 . . . . 11 HIS N . 15918 1
44 . 1 1 12 12 VAL H H 1 8.178 0.020 . 1 . . . . 12 VAL H . 15918 1
45 . 1 1 12 12 VAL C C 13 172.827 0.3 . 1 . . . . 12 VAL C . 15918 1
46 . 1 1 12 12 VAL CA C 13 59.434 0.3 . 1 . . . . 12 VAL CA . 15918 1
47 . 1 1 12 12 VAL CB C 13 30.351 0.3 . 1 . . . . 12 VAL CB . 15918 1
48 . 1 1 12 12 VAL N N 15 121.425 0.3 . 1 . . . . 12 VAL N . 15918 1
49 . 1 1 13 13 ASN H H 1 8.518 0.020 . 1 . . . . 13 ASN H . 15918 1
50 . 1 1 13 13 ASN CA C 13 50.403 0.3 . 1 . . . . 13 ASN CA . 15918 1
51 . 1 1 13 13 ASN CB C 13 36.565 0.3 . 1 . . . . 13 ASN CB . 15918 1
52 . 1 1 13 13 ASN N N 15 122.547 0.3 . 1 . . . . 13 ASN N . 15918 1
53 . 1 1 14 14 PHE H H 1 8.358 0.020 . 1 . . . . 14 PHE H . 15918 1
54 . 1 1 14 14 PHE C C 13 173.661 0.3 . 1 . . . . 14 PHE C . 15918 1
55 . 1 1 14 14 PHE CA C 13 55.374 0.3 . 1 . . . . 14 PHE CA . 15918 1
56 . 1 1 14 14 PHE CB C 13 36.980 0.3 . 1 . . . . 14 PHE CB . 15918 1
57 . 1 1 14 14 PHE N N 15 121.944 0.3 . 1 . . . . 14 PHE N . 15918 1
58 . 1 1 15 15 GLY H H 1 8.471 0.020 . 1 . . . . 15 GLY H . 15918 1
59 . 1 1 15 15 GLY C C 13 171.946 0.3 . 1 . . . . 15 GLY C . 15918 1
60 . 1 1 15 15 GLY CA C 13 42.863 0.3 . 1 . . . . 15 GLY CA . 15918 1
61 . 1 1 15 15 GLY N N 15 110.852 0.3 . 1 . . . . 15 GLY N . 15918 1
62 . 1 1 16 16 GLY H H 1 8.084 0.020 . 1 . . . . 16 GLY H . 15918 1
63 . 1 1 16 16 GLY C C 13 171.463 0.3 . 1 . . . . 16 GLY C . 15918 1
64 . 1 1 16 16 GLY CA C 13 42.720 0.3 . 1 . . . . 16 GLY CA . 15918 1
65 . 1 1 16 16 GLY N N 15 109.134 0.3 . 1 . . . . 16 GLY N . 15918 1
66 . 1 1 17 17 LYS H H 1 8.293 0.020 . 1 . . . . 17 LYS H . 15918 1
67 . 1 1 17 17 LYS C C 13 174.093 0.3 . 1 . . . . 17 LYS C . 15918 1
68 . 1 1 17 17 LYS CA C 13 53.883 0.3 . 1 . . . . 17 LYS CA . 15918 1
69 . 1 1 17 17 LYS CB C 13 30.600 0.3 . 1 . . . . 17 LYS CB . 15918 1
70 . 1 1 17 17 LYS N N 15 121.247 0.3 . 1 . . . . 17 LYS N . 15918 1
71 . 1 1 18 18 SER H H 1 8.387 0.020 . 1 . . . . 18 SER H . 15918 1
72 . 1 1 18 18 SER C C 13 171.697 0.3 . 1 . . . . 18 SER C . 15918 1
73 . 1 1 18 18 SER CA C 13 55.623 0.3 . 1 . . . . 18 SER CA . 15918 1
74 . 1 1 18 18 SER CB C 13 61.340 0.3 . 1 . . . . 18 SER CB . 15918 1
75 . 1 1 18 18 SER N N 15 117.232 0.3 . 1 . . . . 18 SER N . 15918 1
76 . 1 1 19 19 PHE H H 1 8.337 0.020 . 1 . . . . 19 PHE H . 15918 1
77 . 1 1 19 19 PHE C C 13 172.710 0.3 . 1 . . . . 19 PHE C . 15918 1
78 . 1 1 19 19 PHE CA C 13 55.430 0.3 . 1 . . . . 19 PHE CA . 15918 1
79 . 1 1 19 19 PHE CB C 13 37.145 0.3 . 1 . . . . 19 PHE CB . 15918 1
80 . 1 1 19 19 PHE N N 15 122.543 0.3 . 1 . . . . 19 PHE N . 15918 1
81 . 1 1 20 20 ASP H H 1 8.345 0.020 . 1 . . . . 20 ASP H . 15918 1
82 . 1 1 20 20 ASP CA C 13 51.397 0.3 . 1 . . . . 20 ASP CA . 15918 1
83 . 1 1 20 20 ASP CB C 13 38.803 0.3 . 1 . . . . 20 ASP CB . 15918 1
84 . 1 1 20 20 ASP N N 15 122.197 0.3 . 1 . . . . 20 ASP N . 15918 1
85 . 1 1 21 21 ALA H H 1 8.300 0.020 . 1 . . . . 21 ALA H . 15918 1
86 . 1 1 21 21 ALA C C 13 175.462 0.3 . 1 . . . . 21 ALA C . 15918 1
87 . 1 1 21 21 ALA CA C 13 50.320 0.3 . 1 . . . . 21 ALA CA . 15918 1
88 . 1 1 21 21 ALA CB C 13 16.762 0.3 . 1 . . . . 21 ALA CB . 15918 1
89 . 1 1 21 21 ALA N N 15 124.992 0.3 . 1 . . . . 21 ALA N . 15918 1
90 . 1 1 22 22 THR H H 1 8.235 0.020 . 1 . . . . 22 THR H . 15918 1
91 . 1 1 22 22 THR C C 13 172.297 0.3 . 1 . . . . 22 THR C . 15918 1
92 . 1 1 22 22 THR CA C 13 59.269 0.3 . 1 . . . . 22 THR CA . 15918 1
93 . 1 1 22 22 THR CB C 13 67.134 0.3 . 1 . . . . 22 THR CB . 15918 1
94 . 1 1 22 22 THR N N 15 112.232 0.3 . 1 . . . . 22 THR N . 15918 1
95 . 1 1 23 23 SER H H 1 8.238 0.020 . 1 . . . . 23 SER H . 15918 1
96 . 1 1 23 23 SER C C 13 171.595 0.3 . 1 . . . . 23 SER C . 15918 1
97 . 1 1 23 23 SER CA C 13 55.643 0.3 . 1 . . . . 23 SER CA . 15918 1
98 . 1 1 23 23 SER CB C 13 61.635 0.3 . 1 . . . . 23 SER CB . 15918 1
99 . 1 1 23 23 SER N N 15 117.555 0.3 . 1 . . . . 23 SER N . 15918 1
100 . 1 1 24 24 ASP H H 1 8.460 0.020 . 1 . . . . 24 ASP H . 15918 1
101 . 1 1 24 24 ASP CA C 13 51.729 0.3 . 1 . . . . 24 ASP CA . 15918 1
102 . 1 1 24 24 ASP CB C 13 38.637 0.3 . 1 . . . . 24 ASP CB . 15918 1
103 . 1 1 24 24 ASP N N 15 122.630 0.3 . 1 . . . . 24 ASP N . 15918 1
104 . 1 1 25 25 GLN H H 1 8.268 0.020 . 1 . . . . 25 GLN H . 15918 1
105 . 1 1 25 25 GLN C C 13 171.351 0.3 . 1 . . . . 25 GLN C . 15918 1
106 . 1 1 25 25 GLN CA C 13 51.314 0.3 . 1 . . . . 25 GLN CA . 15918 1
107 . 1 1 25 25 GLN CB C 13 26.374 0.3 . 1 . . . . 25 GLN CB . 15918 1
108 . 1 1 25 25 GLN N N 15 120.822 0.3 . 1 . . . . 25 GLN N . 15918 1
109 . 1 1 27 27 GLY H H 1 8.593 0.020 . 1 . . . . 27 GLY H . 15918 1
110 . 1 1 27 27 GLY C C 13 171.346 0.3 . 1 . . . . 27 GLY C . 15918 1
111 . 1 1 27 27 GLY CA C 13 42.697 0.3 . 1 . . . . 27 GLY CA . 15918 1
112 . 1 1 27 27 GLY N N 15 110.169 0.3 . 1 . . . . 27 GLY N . 15918 1
113 . 1 1 28 28 ALA H H 1 8.248 0.020 . 1 . . . . 28 ALA H . 15918 1
114 . 1 1 28 28 ALA C C 13 175.685 0.3 . 1 . . . . 28 ALA C . 15918 1
115 . 1 1 28 28 ALA CA C 13 50.237 0.3 . 1 . . . . 28 ALA CA . 15918 1
116 . 1 1 28 28 ALA CB C 13 16.928 0.3 . 1 . . . . 28 ALA CB . 15918 1
117 . 1 1 28 28 ALA N N 15 123.999 0.3 . 1 . . . . 28 ALA N . 15918 1
118 . 1 1 29 29 GLY H H 1 8.491 0.020 . 1 . . . . 29 GLY H . 15918 1
119 . 1 1 29 29 GLY C C 13 171.314 0.3 . 1 . . . . 29 GLY C . 15918 1
120 . 1 1 29 29 GLY CA C 13 42.701 0.3 . 1 . . . . 29 GLY CA . 15918 1
121 . 1 1 29 29 GLY N N 15 108.452 0.3 . 1 . . . . 29 GLY N . 15918 1
122 . 1 1 30 30 ASP H H 1 8.282 0.020 . 1 . . . . 30 ASP H . 15918 1
123 . 1 1 30 30 ASP CA C 13 51.646 0.3 . 1 . . . . 30 ASP CA . 15918 1
124 . 1 1 30 30 ASP CB C 13 38.720 0.3 . 1 . . . . 30 ASP CB . 15918 1
125 . 1 1 30 30 ASP N N 15 120.579 0.3 . 1 . . . . 30 ASP N . 15918 1
126 . 1 1 31 31 ASN H H 1 8.522 0.020 . 1 . . . . 31 ASN H . 15918 1
127 . 1 1 31 31 ASN CA C 13 50.900 0.3 . 1 . . . . 31 ASN CA . 15918 1
128 . 1 1 31 31 ASN CB C 13 36.151 0.3 . 1 . . . . 31 ASN CB . 15918 1
129 . 1 1 31 31 ASN N N 15 119.066 0.3 . 1 . . . . 31 ASN N . 15918 1
130 . 1 1 32 32 LEU H H 1 8.321 0.020 . 1 . . . . 32 LEU H . 15918 1
131 . 1 1 32 32 LEU C C 13 174.669 0.3 . 1 . . . . 32 LEU C . 15918 1
132 . 1 1 32 32 LEU CA C 13 53.054 0.3 . 1 . . . . 32 LEU CA . 15918 1
133 . 1 1 32 32 LEU CB C 13 39.548 0.3 . 1 . . . . 32 LEU CB . 15918 1
134 . 1 1 32 32 LEU N N 15 122.376 0.3 . 1 . . . . 32 LEU N . 15918 1
135 . 1 1 33 33 ASN H H 1 8.433 0.020 . 1 . . . . 33 ASN H . 15918 1
136 . 1 1 33 33 ASN CA C 13 50.983 0.3 . 1 . . . . 33 ASN CA . 15918 1
137 . 1 1 33 33 ASN CB C 13 36.317 0.3 . 1 . . . . 33 ASN CB . 15918 1
138 . 1 1 33 33 ASN N N 15 118.764 0.3 . 1 . . . . 33 ASN N . 15918 1
139 . 1 1 34 34 ASP H H 1 8.318 0.020 . 1 . . . . 34 ASP H . 15918 1
140 . 1 1 34 34 ASP CA C 13 51.977 0.3 . 1 . . . . 34 ASP CA . 15918 1
141 . 1 1 34 34 ASP CB C 13 38.637 0.3 . 1 . . . . 34 ASP CB . 15918 1
142 . 1 1 34 34 ASP N N 15 121.024 0.3 . 1 . . . . 34 ASP N . 15918 1
143 . 1 1 35 35 LYS H H 1 8.260 0.020 . 1 . . . . 35 LYS H . 15918 1
144 . 1 1 35 35 LYS C C 13 174.151 0.3 . 1 . . . . 35 LYS C . 15918 1
145 . 1 1 35 35 LYS CA C 13 53.883 0.3 . 1 . . . . 35 LYS CA . 15918 1
146 . 1 1 35 35 LYS CB C 13 30.434 0.3 . 1 . . . . 35 LYS CB . 15918 1
147 . 1 1 35 35 LYS N N 15 121.343 0.3 . 1 . . . . 35 LYS N . 15918 1
148 . 1 1 36 36 ILE H H 1 8.196 0.020 . 1 . . . . 36 ILE H . 15918 1
149 . 1 1 36 36 ILE C C 13 173.729 0.3 . 1 . . . . 36 ILE C . 15918 1
150 . 1 1 36 36 ILE CA C 13 58.772 0.3 . 1 . . . . 36 ILE CA . 15918 1
151 . 1 1 36 36 ILE CB C 13 35.985 0.3 . 1 . . . . 36 ILE CB . 15918 1
152 . 1 1 36 36 ILE N N 15 121.909 0.3 . 1 . . . . 36 ILE N . 15918 1
153 . 1 1 37 37 SER H H 1 8.395 0.020 . 1 . . . . 37 SER H . 15918 1
154 . 1 1 37 37 SER C C 13 171.954 0.3 . 1 . . . . 37 SER C . 15918 1
155 . 1 1 37 37 SER CA C 13 55.789 0.3 . 1 . . . . 37 SER CA . 15918 1
156 . 1 1 37 37 SER CB C 13 61.423 0.3 . 1 . . . . 37 SER CB . 15918 1
157 . 1 1 37 37 SER N N 15 119.852 0.3 . 1 . . . . 37 SER N . 15918 1
158 . 1 1 38 38 SER H H 1 8.386 0.020 . 1 . . . . 38 SER H . 15918 1
159 . 1 1 38 38 SER C C 13 171.822 0.3 . 1 . . . . 38 SER C . 15918 1
160 . 1 1 38 38 SER N N 15 118.590 0.3 . 1 . . . . 38 SER N . 15918 1
161 . 1 1 39 39 ILE H H 1 8.136 0.020 . 1 . . . . 39 ILE H . 15918 1
162 . 1 1 39 39 ILE C C 13 173.500 0.3 . 1 . . . . 39 ILE C . 15918 1
163 . 1 1 39 39 ILE CA C 13 58.772 0.3 . 1 . . . . 39 ILE CA . 15918 1
164 . 1 1 39 39 ILE CB C 13 36.068 0.3 . 1 . . . . 39 ILE CB . 15918 1
165 . 1 1 39 39 ILE N N 15 122.452 0.3 . 1 . . . . 39 ILE N . 15918 1
166 . 1 1 40 40 LYS H H 1 8.381 0.020 . 1 . . . . 40 LYS H . 15918 1
167 . 1 1 40 40 LYS C C 13 173.854 0.3 . 1 . . . . 40 LYS C . 15918 1
168 . 1 1 40 40 LYS CA C 13 53.883 0.3 . 1 . . . . 40 LYS CA . 15918 1
169 . 1 1 40 40 LYS CB C 13 30.351 0.3 . 1 . . . . 40 LYS CB . 15918 1
170 . 1 1 40 40 LYS N N 15 125.914 0.3 . 1 . . . . 40 LYS N . 15918 1
171 . 1 1 41 41 VAL H H 1 8.145 0.020 . 1 . . . . 41 VAL H . 15918 1
172 . 1 1 41 41 VAL C C 13 173.571 0.3 . 1 . . . . 41 VAL C . 15918 1
173 . 1 1 41 41 VAL CA C 13 59.434 0.3 . 1 . . . . 41 VAL CA . 15918 1
174 . 1 1 41 41 VAL CB C 13 30.189 0.3 . 1 . . . . 41 VAL CB . 15918 1
175 . 1 1 41 41 VAL N N 15 122.084 0.3 . 1 . . . . 41 VAL N . 15918 1
176 . 1 1 42 42 LYS H H 1 8.451 0.020 . 1 . . . . 42 LYS H . 15918 1
177 . 1 1 42 42 LYS C C 13 173.945 0.3 . 1 . . . . 42 LYS C . 15918 1
178 . 1 1 42 42 LYS CA C 13 53.883 0.3 . 1 . . . . 42 LYS CA . 15918 1
179 . 1 1 42 42 LYS CB C 13 30.313 0.3 . 1 . . . . 42 LYS CB . 15918 1
180 . 1 1 42 42 LYS N N 15 125.632 0.3 . 1 . . . . 42 LYS N . 15918 1
181 . 1 1 43 43 SER H H 1 8.388 0.020 . 1 . . . . 43 SER H . 15918 1
182 . 1 1 43 43 SER C C 13 172.367 0.3 . 1 . . . . 43 SER C . 15918 1
183 . 1 1 43 43 SER CA C 13 56.037 0.3 . 1 . . . . 43 SER CA . 15918 1
184 . 1 1 43 43 SER CB C 13 61.589 0.3 . 1 . . . . 43 SER CB . 15918 1
185 . 1 1 43 43 SER N N 15 117.625 0.3 . 1 . . . . 43 SER N . 15918 1
186 . 1 1 44 44 GLY H H 1 8.470 0.020 . 1 . . . . 44 GLY H . 15918 1
187 . 1 1 44 44 GLY C C 13 171.673 0.3 . 1 . . . . 44 GLY C . 15918 1
188 . 1 1 44 44 GLY CA C 13 42.863 0.3 . 1 . . . . 44 GLY CA . 15918 1
189 . 1 1 44 44 GLY N N 15 111.279 0.3 . 1 . . . . 44 GLY N . 15918 1
190 . 1 1 45 45 THR H H 1 8.046 0.020 . 1 . . . . 45 THR H . 15918 1
191 . 1 1 45 45 THR CA C 13 59.269 0.3 . 1 . . . . 45 THR CA . 15918 1
192 . 1 1 45 45 THR CB C 13 67.192 0.3 . 1 . . . . 45 THR CB . 15918 1
193 . 1 1 45 45 THR N N 15 113.628 0.3 . 1 . . . . 45 THR N . 15918 1
194 . 1 1 46 46 TRP H H 1 8.169 0.020 . 1 . . . . 46 TRP H . 15918 1
195 . 1 1 46 46 TRP C C 13 173.606 0.3 . 1 . . . . 46 TRP C . 15918 1
196 . 1 1 46 46 TRP CA C 13 55.126 0.3 . 1 . . . . 46 TRP CA . 15918 1
197 . 1 1 46 46 TRP CB C 13 26.954 0.3 . 1 . . . . 46 TRP CB . 15918 1
198 . 1 1 46 46 TRP N N 15 123.608 0.3 . 1 . . . . 46 TRP N . 15918 1
199 . 1 1 47 47 ARG H H 1 7.975 0.020 . 1 . . . . 47 ARG H . 15918 1
200 . 1 1 47 47 ARG C C 13 173.122 0.3 . 1 . . . . 47 ARG C . 15918 1
201 . 1 1 47 47 ARG CA C 13 53.717 0.3 . 1 . . . . 47 ARG CA . 15918 1
202 . 1 1 47 47 ARG CB C 13 28.114 0.3 . 1 . . . . 47 ARG CB . 15918 1
203 . 1 1 47 47 ARG N N 15 122.493 0.3 . 1 . . . . 47 ARG N . 15918 1
204 . 1 1 48 48 PHE H H 1 8.003 0.020 . 1 . . . . 48 PHE H . 15918 1
205 . 1 1 48 48 PHE C C 13 172.823 0.3 . 1 . . . . 48 PHE C . 15918 1
206 . 1 1 48 48 PHE CA C 13 55.457 0.3 . 1 . . . . 48 PHE CA . 15918 1
207 . 1 1 48 48 PHE CB C 13 36.897 0.3 . 1 . . . . 48 PHE CB . 15918 1
208 . 1 1 48 48 PHE N N 15 120.833 0.3 . 1 . . . . 48 PHE N . 15918 1
209 . 1 1 49 49 TYR H H 1 7.928 0.020 . 1 . . . . 49 TYR H . 15918 1
210 . 1 1 49 49 TYR C C 13 172.897 0.3 . 1 . . . . 49 TYR C . 15918 1
211 . 1 1 49 49 TYR CA C 13 55.209 0.3 . 1 . . . . 49 TYR CA . 15918 1
212 . 1 1 49 49 TYR CB C 13 36.317 0.3 . 1 . . . . 49 TYR CB . 15918 1
213 . 1 1 49 49 TYR N N 15 120.824 0.3 . 1 . . . . 49 TYR N . 15918 1
214 . 1 1 50 50 GLU H H 1 8.210 0.020 . 1 . . . . 50 GLU H . 15918 1
215 . 1 1 50 50 GLU C C 13 173.282 0.3 . 1 . . . . 50 GLU C . 15918 1
216 . 1 1 50 50 GLU CA C 13 53.966 0.3 . 1 . . . . 50 GLU CA . 15918 1
217 . 1 1 50 50 GLU CB C 13 27.700 0.3 . 1 . . . . 50 GLU CB . 15918 1
218 . 1 1 50 50 GLU N N 15 122.129 0.3 . 1 . . . . 50 GLU N . 15918 1
219 . 1 1 51 51 TYR H H 1 8.067 0.020 . 1 . . . . 51 TYR H . 15918 1
220 . 1 1 51 51 TYR C C 13 173.079 0.3 . 1 . . . . 51 TYR C . 15918 1
221 . 1 1 51 51 TYR CA C 13 55.291 0.3 . 1 . . . . 51 TYR CA . 15918 1
222 . 1 1 51 51 TYR CB C 13 36.151 0.3 . 1 . . . . 51 TYR CB . 15918 1
223 . 1 1 51 51 TYR N N 15 120.829 0.3 . 1 . . . . 51 TYR N . 15918 1
224 . 1 1 52 52 ILE H H 1 7.966 0.020 . 1 . . . . 52 ILE H . 15918 1
225 . 1 1 52 52 ILE C C 13 172.698 0.3 . 1 . . . . 52 ILE C . 15918 1
226 . 1 1 52 52 ILE CA C 13 58.440 0.3 . 1 . . . . 52 ILE CA . 15918 1
227 . 1 1 52 52 ILE CB C 13 36.252 0.3 . 1 . . . . 52 ILE CB . 15918 1
228 . 1 1 52 52 ILE N N 15 122.372 0.3 . 1 . . . . 52 ILE N . 15918 1
229 . 1 1 53 53 ASN H H 1 8.293 0.020 . 1 . . . . 53 ASN H . 15918 1
230 . 1 1 53 53 ASN CA C 13 50.237 0.3 . 1 . . . . 53 ASN CA . 15918 1
231 . 1 1 53 53 ASN CB C 13 36.393 0.3 . 1 . . . . 53 ASN CB . 15918 1
232 . 1 1 53 53 ASN N N 15 122.379 0.3 . 1 . . . . 53 ASN N . 15918 1
233 . 1 1 54 54 TYR H H 1 8.218 0.020 . 1 . . . . 54 TYR H . 15918 1
234 . 1 1 54 54 TYR CA C 13 55.789 0.3 . 1 . . . . 54 TYR CA . 15918 1
235 . 1 1 54 54 TYR CB C 13 36.416 0.3 . 1 . . . . 54 TYR CB . 15918 1
236 . 1 1 54 54 TYR N N 15 121.941 0.3 . 1 . . . . 54 TYR N . 15918 1
237 . 1 1 55 55 GLY H H 1 8.367 0.020 . 1 . . . . 55 GLY H . 15918 1
238 . 1 1 55 55 GLY C C 13 171.899 0.3 . 1 . . . . 55 GLY C . 15918 1
239 . 1 1 55 55 GLY CA C 13 42.863 0.3 . 1 . . . . 55 GLY CA . 15918 1
240 . 1 1 55 55 GLY N N 15 110.535 0.3 . 1 . . . . 55 GLY N . 15918 1
241 . 1 1 56 56 GLY H H 1 8.014 0.020 . 1 . . . . 56 GLY H . 15918 1
242 . 1 1 56 56 GLY C C 13 171.463 0.3 . 1 . . . . 56 GLY C . 15918 1
243 . 1 1 56 56 GLY CA C 13 42.720 0.3 . 1 . . . . 56 GLY CA . 15918 1
244 . 1 1 56 56 GLY N N 15 108.796 0.3 . 1 . . . . 56 GLY N . 15918 1
245 . 1 1 57 57 ARG H H 1 8.159 0.020 . 1 . . . . 57 ARG H . 15918 1
246 . 1 1 57 57 ARG C C 13 173.549 0.3 . 1 . . . . 57 ARG C . 15918 1
247 . 1 1 57 57 ARG CA C 13 53.883 0.3 . 1 . . . . 57 ARG CA . 15918 1
248 . 1 1 57 57 ARG CB C 13 27.782 0.3 . 1 . . . . 57 ARG CB . 15918 1
249 . 1 1 57 57 ARG N N 15 120.659 0.3 . 1 . . . . 57 ARG N . 15918 1
250 . 1 1 58 58 TYR H H 1 8.191 0.020 . 1 . . . . 58 TYR H . 15918 1
251 . 1 1 58 58 TYR C C 13 173.120 0.3 . 1 . . . . 58 TYR C . 15918 1
252 . 1 1 58 58 TYR CA C 13 55.623 0.3 . 1 . . . . 58 TYR CA . 15918 1
253 . 1 1 58 58 TYR CB C 13 36.068 0.3 . 1 . . . . 58 TYR CB . 15918 1
254 . 1 1 58 58 TYR N N 15 120.744 0.3 . 1 . . . . 58 TYR N . 15918 1
255 . 1 1 59 59 TRP H H 1 7.872 0.020 . 1 . . . . 59 TRP H . 15918 1
256 . 1 1 59 59 TRP CA C 13 54.629 0.3 . 1 . . . . 59 TRP CA . 15918 1
257 . 1 1 59 59 TRP CB C 13 27.120 0.3 . 1 . . . . 59 TRP CB . 15918 1
258 . 1 1 59 59 TRP N N 15 121.511 0.3 . 1 . . . . 59 TRP N . 15918 1
259 . 1 1 60 60 ASP H H 1 8.175 0.020 . 1 . . . . 60 ASP H . 15918 1
260 . 1 1 60 60 ASP CA C 13 51.646 0.3 . 1 . . . . 60 ASP CA . 15918 1
261 . 1 1 60 60 ASP CB C 13 38.388 0.3 . 1 . . . . 60 ASP CB . 15918 1
262 . 1 1 60 60 ASP N N 15 121.601 0.3 . 1 . . . . 60 ASP N . 15918 1
263 . 1 1 61 61 LEU H H 1 8.006 0.020 . 1 . . . . 61 LEU H . 15918 1
264 . 1 1 61 61 LEU C C 13 174.990 0.3 . 1 . . . . 61 LEU C . 15918 1
265 . 1 1 61 61 LEU CA C 13 52.391 0.3 . 1 . . . . 61 LEU CA . 15918 1
266 . 1 1 61 61 LEU CB C 13 40.046 0.3 . 1 . . . . 61 LEU CB . 15918 1
267 . 1 1 61 61 LEU N N 15 121.874 0.3 . 1 . . . . 61 LEU N . 15918 1
268 . 1 1 62 62 GLY H H 1 8.404 0.020 . 1 . . . . 62 GLY H . 15918 1
269 . 1 1 62 62 GLY C C 13 169.277 0.3 . 1 . . . . 62 GLY C . 15918 1
270 . 1 1 62 62 GLY CA C 13 41.981 0.3 . 1 . . . . 62 GLY CA . 15918 1
271 . 1 1 62 62 GLY N N 15 109.739 0.3 . 1 . . . . 62 GLY N . 15918 1
272 . 1 1 64 64 GLY H H 1 8.534 0.020 . 1 . . . . 64 GLY H . 15918 1
273 . 1 1 64 64 GLY C C 13 171.361 0.3 . 1 . . . . 64 GLY C . 15918 1
274 . 1 1 64 64 GLY CA C 13 42.720 0.3 . 1 . . . . 64 GLY CA . 15918 1
275 . 1 1 64 64 GLY N N 15 109.911 0.3 . 1 . . . . 64 GLY N . 15918 1
276 . 1 1 65 65 GLU H H 1 8.204 0.020 . 1 . . . . 65 GLU H . 15918 1
277 . 1 1 65 65 GLU C C 13 173.631 0.3 . 1 . . . . 65 GLU C . 15918 1
278 . 1 1 65 65 GLU CA C 13 53.800 0.3 . 1 . . . . 65 GLU CA . 15918 1
279 . 1 1 65 65 GLU CB C 13 27.865 0.3 . 1 . . . . 65 GLU CB . 15918 1
280 . 1 1 65 65 GLU N N 15 120.736 0.3 . 1 . . . . 65 GLU N . 15918 1
281 . 1 1 66 66 TYR H H 1 8.295 0.020 . 1 . . . . 66 TYR H . 15918 1
282 . 1 1 66 66 TYR C C 13 173.219 0.3 . 1 . . . . 66 TYR C . 15918 1
283 . 1 1 66 66 TYR CA C 13 55.126 0.3 . 1 . . . . 66 TYR CA . 15918 1
284 . 1 1 66 66 TYR CB C 13 36.400 0.3 . 1 . . . . 66 TYR CB . 15918 1
285 . 1 1 66 66 TYR N N 15 120.747 0.3 . 1 . . . . 66 TYR N . 15918 1
286 . 1 1 67 67 SER H H 1 8.265 0.020 . 1 . . . . 67 SER H . 15918 1
287 . 1 1 67 67 SER C C 13 171.806 0.3 . 1 . . . . 67 SER C . 15918 1
288 . 1 1 67 67 SER CA C 13 55.544 0.3 . 1 . . . . 67 SER CA . 15918 1
289 . 1 1 67 67 SER CB C 13 61.506 0.3 . 1 . . . . 67 SER CB . 15918 1
290 . 1 1 67 67 SER N N 15 117.395 0.3 . 1 . . . . 67 SER N . 15918 1
291 . 1 1 68 68 SER H H 1 8.440 0.020 . 1 . . . . 68 SER H . 15918 1
292 . 1 1 68 68 SER C C 13 172.120 0.3 . 1 . . . . 68 SER C . 15918 1
293 . 1 1 68 68 SER N N 15 118.591 0.3 . 1 . . . . 68 SER N . 15918 1
294 . 1 1 69 69 VAL H H 1 8.158 0.020 . 1 . . . . 69 VAL H . 15918 1
295 . 1 1 69 69 VAL C C 13 173.780 0.3 . 1 . . . . 69 VAL C . 15918 1
296 . 1 1 69 69 VAL CA C 13 60.014 0.3 . 1 . . . . 69 VAL CA . 15918 1
297 . 1 1 69 69 VAL CB C 13 30.020 0.3 . 1 . . . . 69 VAL CB . 15918 1
298 . 1 1 69 69 VAL N N 15 121.257 0.3 . 1 . . . . 69 VAL N . 15918 1
299 . 1 1 70 70 GLU H H 1 8.460 0.020 . 1 . . . . 70 GLU H . 15918 1
300 . 1 1 70 70 GLU C C 13 173.994 0.3 . 1 . . . . 70 GLU C . 15918 1
301 . 1 1 70 70 GLU CA C 13 54.131 0.3 . 1 . . . . 70 GLU CA . 15918 1
302 . 1 1 70 70 GLU CB C 13 27.534 0.3 . 1 . . . . 70 GLU CB . 15918 1
303 . 1 1 70 70 GLU N N 15 123.839 0.3 . 1 . . . . 70 GLU N . 15918 1
304 . 1 1 71 71 SER H H 1 8.301 0.020 . 1 . . . . 71 SER H . 15918 1
305 . 1 1 71 71 SER C C 13 171.673 0.3 . 1 . . . . 71 SER C . 15918 1
306 . 1 1 71 71 SER CA C 13 55.789 0.3 . 1 . . . . 71 SER CA . 15918 1
307 . 1 1 71 71 SER CB C 13 61.423 0.3 . 1 . . . . 71 SER CB . 15918 1
308 . 1 1 71 71 SER N N 15 116.868 0.3 . 1 . . . . 71 SER N . 15918 1
309 . 1 1 72 72 ALA H H 1 8.360 0.020 . 1 . . . . 72 ALA H . 15918 1
310 . 1 1 72 72 ALA C C 13 175.404 0.3 . 1 . . . . 72 ALA C . 15918 1
311 . 1 1 72 72 ALA CA C 13 50.071 0.3 . 1 . . . . 72 ALA CA . 15918 1
312 . 1 1 72 72 ALA CB C 13 16.845 0.3 . 1 . . . . 72 ALA CB . 15918 1
313 . 1 1 72 72 ALA N N 15 125.963 0.3 . 1 . . . . 72 ALA N . 15918 1
314 . 1 1 73 73 GLY H H 1 8.335 0.020 . 1 . . . . 73 GLY H . 15918 1
315 . 1 1 73 73 GLY C C 13 171.003 0.3 . 1 . . . . 73 GLY C . 15918 1
316 . 1 1 73 73 GLY CA C 13 42.621 0.3 . 1 . . . . 73 GLY CA . 15918 1
317 . 1 1 73 73 GLY N N 15 108.277 0.3 . 1 . . . . 73 GLY N . 15918 1
318 . 1 1 74 74 ILE H H 1 8.055 0.020 . 1 . . . . 74 ILE H . 15918 1
319 . 1 1 74 74 ILE C C 13 172.171 0.3 . 1 . . . . 74 ILE C . 15918 1
320 . 1 1 74 74 ILE CA C 13 56.451 0.3 . 1 . . . . 74 ILE CA . 15918 1
321 . 1 1 74 74 ILE CB C 13 36.068 0.3 . 1 . . . . 74 ILE CB . 15918 1
322 . 1 1 74 74 ILE N N 15 121.700 0.3 . 1 . . . . 74 ILE N . 15918 1
323 . 1 1 76 76 ASP H H 1 8.489 0.020 . 1 . . . . 76 ASP H . 15918 1
324 . 1 1 76 76 ASP CA C 13 51.977 0.3 . 1 . . . . 76 ASP CA . 15918 1
325 . 1 1 76 76 ASP CB C 13 38.637 0.3 . 1 . . . . 76 ASP CB . 15918 1
326 . 1 1 76 76 ASP N N 15 121.343 0.3 . 1 . . . . 76 ASP N . 15918 1
327 . 1 1 77 77 ASN H H 1 8.454 0.020 . 1 . . . . 77 ASN H . 15918 1
328 . 1 1 77 77 ASN C C 13 173.128 0.3 . 1 . . . . 77 ASN C . 15918 1
329 . 1 1 77 77 ASN CA C 13 50.734 0.3 . 1 . . . . 77 ASN CA . 15918 1
330 . 1 1 77 77 ASN CB C 13 36.317 0.3 . 1 . . . . 77 ASN CB . 15918 1
331 . 1 1 77 77 ASN N N 15 119.710 0.3 . 1 . . . . 77 ASN N . 15918 1
332 . 1 1 78 78 SER H H 1 8.389 0.020 . 1 . . . . 78 SER H . 15918 1
333 . 1 1 78 78 SER C C 13 172.079 0.3 . 1 . . . . 78 SER C . 15918 1
334 . 1 1 78 78 SER CA C 13 56.534 0.3 . 1 . . . . 78 SER CA . 15918 1
335 . 1 1 78 78 SER CB C 13 61.506 0.3 . 1 . . . . 78 SER CB . 15918 1
336 . 1 1 78 78 SER N N 15 116.315 0.3 . 1 . . . . 78 SER N . 15918 1
337 . 1 1 79 79 ILE H H 1 8.139 0.020 . 1 . . . . 79 ILE H . 15918 1
338 . 1 1 79 79 ILE CA C 13 58.999 0.3 . 1 . . . . 79 ILE CA . 15918 1
339 . 1 1 79 79 ILE CB C 13 36.229 0.3 . 1 . . . . 79 ILE CB . 15918 1
340 . 1 1 79 79 ILE N N 15 122.135 0.3 . 1 . . . . 79 ILE N . 15918 1
341 . 1 1 80 80 SER H H 1 8.374 0.020 . 1 . . . . 80 SER H . 15918 1
342 . 1 1 80 80 SER C C 13 172.004 0.3 . 1 . . . . 80 SER C . 15918 1
343 . 1 1 80 80 SER CA C 13 55.789 0.3 . 1 . . . . 80 SER CA . 15918 1
344 . 1 1 80 80 SER CB C 13 61.423 0.3 . 1 . . . . 80 SER CB . 15918 1
345 . 1 1 80 80 SER N N 15 119.463 0.3 . 1 . . . . 80 SER N . 15918 1
346 . 1 1 81 81 SER H H 1 8.314 0.020 . 1 . . . . 81 SER H . 15918 1
347 . 1 1 81 81 SER C C 13 171.595 0.3 . 1 . . . . 81 SER C . 15918 1
348 . 1 1 81 81 SER N N 15 118.252 0.3 . 1 . . . . 81 SER N . 15918 1
349 . 1 1 82 82 PHE H H 1 8.241 0.020 . 1 . . . . 82 PHE H . 15918 1
350 . 1 1 82 82 PHE C C 13 172.985 0.3 . 1 . . . . 82 PHE C . 15918 1
351 . 1 1 82 82 PHE CA C 13 55.293 0.3 . 1 . . . . 82 PHE CA . 15918 1
352 . 1 1 82 82 PHE CB C 13 37.145 0.3 . 1 . . . . 82 PHE CB . 15918 1
353 . 1 1 82 82 PHE N N 15 122.203 0.3 . 1 . . . . 82 PHE N . 15918 1
354 . 1 1 83 83 ARG H H 1 8.201 0.020 . 1 . . . . 83 ARG H . 15918 1
355 . 1 1 83 83 ARG C C 13 173.134 0.3 . 1 . . . . 83 ARG C . 15918 1
356 . 1 1 83 83 ARG CA C 13 53.634 0.3 . 1 . . . . 83 ARG CA . 15918 1
357 . 1 1 83 83 ARG CB C 13 28.445 0.3 . 1 . . . . 83 ARG CB . 15918 1
358 . 1 1 83 83 ARG N N 15 122.716 0.3 . 1 . . . . 83 ARG N . 15918 1
359 . 1 1 84 84 GLN H H 1 8.417 0.020 . 1 . . . . 84 GLN H . 15918 1
360 . 1 1 84 84 GLN C C 13 172.549 0.3 . 1 . . . . 84 GLN C . 15918 1
361 . 1 1 84 84 GLN CA C 13 53.340 0.3 . 1 . . . . 84 GLN CA . 15918 1
362 . 1 1 84 84 GLN CB C 13 26.954 0.3 . 1 . . . . 84 GLN CB . 15918 1
363 . 1 1 84 84 GLN N N 15 122.887 0.3 . 1 . . . . 84 GLN N . 15918 1
364 . 1 1 85 85 ILE H H 1 7.913 0.020 . 1 . . . . 85 ILE H . 15918 1
365 . 1 1 85 85 ILE C C 13 178.723 0.3 . 1 . . . . 85 ILE C . 15918 1
366 . 1 1 85 85 ILE CA C 13 60.677 0.3 . 1 . . . . 85 ILE CA . 15918 1
367 . 1 1 85 85 ILE CB C 13 36.648 0.3 . 1 . . . . 85 ILE CB . 15918 1
368 . 1 1 85 85 ILE N N 15 127.173 0.3 . 1 . . . . 85 ILE N . 15918 1
stop_
save_