Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 6501
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_Assigned_chem_shift_list.Chem_shift_1H_err 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.4
_Assigned_chem_shift_list.Chem_shift_15N_err 0.1
_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 $sample_1 isotropic 6501 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 1 1 ASN H H 1 8.602 0.01 . 1 . . . . . ASN H . 6501 1
2 . 1 1 1 1 ASN CA C 13 53.2 0.4 . 1 . . . . . ASN CA . 6501 1
3 . 1 1 1 1 ASN CB C 13 38.4 0.4 . 1 . . . . . ASN CB . 6501 1
4 . 1 1 1 1 ASN N N 15 120.5 0.1 . 1 . . . . . ASN N . 6501 1
5 . 1 1 2 2 ASN H H 1 8.487 0.01 . 1 . . . . . ASN H . 6501 1
6 . 1 1 2 2 ASN CA C 13 53.2 0.4 . 1 . . . . . ASN CA . 6501 1
7 . 1 1 2 2 ASN CB C 13 38.3 0.4 . 1 . . . . . ASN CB . 6501 1
8 . 1 1 2 2 ASN N N 15 119.8 0.1 . 1 . . . . . ASN N . 6501 1
9 . 1 1 3 3 GLU H H 1 8.400 0.01 . 1 . . . . . GLU H . 6501 1
10 . 1 1 3 3 GLU CA C 13 56.4 0.4 . 1 . . . . . GLU CA . 6501 1
11 . 1 1 3 3 GLU CB C 13 29.5 0.4 . 1 . . . . . GLU CB . 6501 1
12 . 1 1 3 3 GLU N N 15 121.4 0.1 . 1 . . . . . GLU N . 6501 1
13 . 1 1 4 4 LEU H H 1 8.239 0.01 . 1 . . . . . LEU H . 6501 1
14 . 1 1 4 4 LEU CA C 13 54.6 0.4 . 1 . . . . . LEU CA . 6501 1
15 . 1 1 4 4 LEU CB C 13 41.5 0.4 . 1 . . . . . LEU CB . 6501 1
16 . 1 1 4 4 LEU N N 15 123.1 0.1 . 1 . . . . . LEU N . 6501 1
17 . 1 1 5 5 SER H H 1 8.264 0.01 . 1 . . . . . SER H . 6501 1
18 . 1 1 5 5 SER CA C 13 55.9 0.4 . 1 . . . . . SER CA . 6501 1
19 . 1 1 5 5 SER CB C 13 63.0 0.4 . 1 . . . . . SER CB . 6501 1
20 . 1 1 5 5 SER N N 15 118.4 0.1 . 1 . . . . . SER N . 6501 1
21 . 1 1 6 6 PRO CA C 13 63.3 0.4 . 1 . . . . . PRO CA . 6501 1
22 . 1 1 7 7 VAL H H 1 8.091 0.01 . 1 . . . . . VAL H . 6501 1
23 . 1 1 7 7 VAL CA C 13 62.0 0.4 . 1 . . . . . VAL CA . 6501 1
24 . 1 1 7 7 VAL CB C 13 31.8 0.4 . 1 . . . . . VAL CB . 6501 1
25 . 1 1 7 7 VAL N N 15 120.2 0.1 . 1 . . . . . VAL N . 6501 1
26 . 1 1 8 8 ALA H H 1 8.303 0.01 . 1 . . . . . ALA H . 6501 1
27 . 1 1 8 8 ALA CA C 13 56.4 0.4 . 9 . . . . . ALA CA . 6501 1
28 . 1 1 8 8 ALA CB C 13 18.6 0.4 . 1 . . . . . ALA CB . 6501 1
29 . 1 1 8 8 ALA N N 15 128.1 0.1 . 1 . . . . . ALA N . 6501 1
30 . 1 1 9 9 LEU H H 1 8.279 0.01 . 1 . . . . . LEU H . 6501 1
31 . 1 1 9 9 LEU CA C 13 54.4 0.4 . 1 . . . . . LEU CA . 6501 1
32 . 1 1 9 9 LEU N N 15 123.3 0.1 . 1 . . . . . LEU N . 6501 1
33 . 1 1 10 10 ARG H H 1 8.423 0.01 . 1 . . . . . ARG H . 6501 1
34 . 1 1 10 10 ARG CA C 13 53.7 0.4 . 1 . . . . . ARG CA . 6501 1
35 . 1 1 10 10 ARG CB C 13 31.6 0.4 . 9 . . . . . ARG CB . 6501 1
36 . 1 1 10 10 ARG N N 15 124.0 0.1 . 1 . . . . . ARG N . 6501 1
37 . 1 1 11 11 GLN H H 1 8.286 0.01 . 1 . . . . . GLN H . 6501 1
38 . 1 1 11 11 GLN CA C 13 53.6 0.4 . 1 . . . . . GLN CA . 6501 1
39 . 1 1 11 11 GLN CB C 13 32.2 0.4 . 1 . . . . . GLN CB . 6501 1
40 . 1 1 11 11 GLN N N 15 116.4 0.1 . 1 . . . . . GLN N . 6501 1
41 . 1 1 12 12 MET H H 1 9.115 0.01 . 1 . . . . . MET H . 6501 1
42 . 1 1 12 12 MET CA C 13 54.3 0.4 . 1 . . . . . MET CA . 6501 1
43 . 1 1 12 12 MET CB C 13 35.2 0.4 . 1 . . . . . MET CB . 6501 1
44 . 1 1 12 12 MET N N 15 119.3 0.1 . 1 . . . . . MET N . 6501 1
45 . 1 1 13 13 SER H H 1 8.895 0.01 . 1 . . . . . SER H . 6501 1
46 . 1 1 13 13 SER CA C 13 58.7 0.4 . 1 . . . . . SER CA . 6501 1
47 . 1 1 13 13 SER CB C 13 63.5 0.4 . 1 . . . . . SER CB . 6501 1
48 . 1 1 13 13 SER N N 15 119.5 0.1 . 1 . . . . . SER N . 6501 1
49 . 1 1 14 14 CYS H H 1 8.769 0.01 . 1 . . . . . CYS H . 6501 1
50 . 1 1 14 14 CYS CA C 13 56.7 0.4 . 1 . . . . . CYS CA . 6501 1
51 . 1 1 14 14 CYS CB C 13 31.4 0.4 . 1 . . . . . CYS CB . 6501 1
52 . 1 1 14 14 CYS N N 15 119.9 0.1 . 1 . . . . . CYS N . 6501 1
53 . 1 1 15 15 ALA H H 1 7.825 0.01 . 1 . . . . . ALA H . 6501 1
54 . 1 1 15 15 ALA CA C 13 50.2 0.4 . 1 . . . . . ALA CA . 6501 1
55 . 1 1 15 15 ALA CB C 13 20.5 0.4 . 1 . . . . . ALA CB . 6501 1
56 . 1 1 15 15 ALA N N 15 122.5 0.1 . 1 . . . . . ALA N . 6501 1
57 . 1 1 16 16 ALA H H 1 8.813 0.01 . 1 . . . . . ALA H . 6501 1
58 . 1 1 16 16 ALA CA C 13 50.8 0.4 . 1 . . . . . ALA CA . 6501 1
59 . 1 1 16 16 ALA CB C 13 23.9 0.4 . 1 . . . . . ALA CB . 6501 1
60 . 1 1 16 16 ALA N N 15 123.0 0.1 . 1 . . . . . ALA N . 6501 1
61 . 1 1 17 17 GLY H H 1 8.956 0.01 . 1 . . . . . GLY H . 6501 1
62 . 1 1 17 17 GLY CA C 13 45.3 0.4 . 1 . . . . . GLY CA . 6501 1
63 . 1 1 17 17 GLY N N 15 107.7 0.1 . 1 . . . . . GLY N . 6501 1
64 . 1 1 18 18 THR H H 1 9.107 0.01 . 1 . . . . . THR H . 6501 1
65 . 1 1 18 18 THR CA C 13 64.5 0.4 . 1 . . . . . THR CA . 6501 1
66 . 1 1 18 18 THR N N 15 116.6 0.1 . 1 . . . . . THR N . 6501 1
67 . 1 1 19 19 THR H H 1 7.277 0.01 . 1 . . . . . THR H . 6501 1
68 . 1 1 19 19 THR CA C 13 59.0 0.4 . 1 . . . . . THR CA . 6501 1
69 . 1 1 19 19 THR CB C 13 71.8 0.4 . 1 . . . . . THR CB . 6501 1
70 . 1 1 19 19 THR N N 15 109.4 0.1 . 1 . . . . . THR N . 6501 1
71 . 1 1 20 20 GLN H H 1 8.543 0.01 . 1 . . . . . GLN H . 6501 1
72 . 1 1 20 20 GLN CA C 13 59.2 0.4 . 1 . . . . . GLN CA . 6501 1
73 . 1 1 20 20 GLN CB C 13 26.4 0.4 . 1 . . . . . GLN CB . 6501 1
74 . 1 1 20 20 GLN N N 15 119.8 0.1 . 1 . . . . . GLN N . 6501 1
75 . 1 1 21 21 THR H H 1 7.515 0.01 . 1 . . . . . THR H . 6501 1
76 . 1 1 21 21 THR CA C 13 62.7 0.4 . 1 . . . . . THR CA . 6501 1
77 . 1 1 21 21 THR CB C 13 68.5 0.4 . 1 . . . . . THR CB . 6501 1
78 . 1 1 21 21 THR N N 15 107.7 0.1 . 1 . . . . . THR N . 6501 1
79 . 1 1 22 22 ALA H H 1 7.316 0.01 . 1 . . . . . ALA H . 6501 1
80 . 1 1 22 22 ALA CA C 13 51.4 0.4 . 1 . . . . . ALA CA . 6501 1
81 . 1 1 22 22 ALA CB C 13 18.7 0.4 . 1 . . . . . ALA CB . 6501 1
82 . 1 1 22 22 ALA N N 15 124.1 0.1 . 1 . . . . . ALA N . 6501 1
83 . 1 1 23 23 CYS H H 1 7.680 0.01 . 1 . . . . . CYS H . 6501 1
84 . 1 1 23 23 CYS CA C 13 59.4 0.4 . 1 . . . . . CYS CA . 6501 1
85 . 1 1 23 23 CYS N N 15 119.6 0.1 . 1 . . . . . CYS N . 6501 1
86 . 1 1 24 24 THR H H 1 8.232 0.01 . 1 . . . . . THR H . 6501 1
87 . 1 1 24 24 THR CA C 13 61.6 0.4 . 1 . . . . . THR CA . 6501 1
88 . 1 1 24 24 THR CB C 13 69.8 0.4 . 1 . . . . . THR CB . 6501 1
89 . 1 1 24 24 THR N N 15 119.4 0.1 . 1 . . . . . THR N . 6501 1
90 . 1 1 25 25 ASP H H 1 8.253 0.01 . 1 . . . . . ASP H . 6501 1
91 . 1 1 25 25 ASP CA C 13 53.9 0.4 . 1 . . . . . ASP CA . 6501 1
92 . 1 1 25 25 ASP CB C 13 42.1 0.4 . 1 . . . . . ASP CB . 6501 1
93 . 1 1 25 25 ASP N N 15 122.3 0.1 . 1 . . . . . ASP N . 6501 1
94 . 1 1 26 26 ASP H H 1 8.655 0.01 . 1 . . . . . ASP H . 6501 1
95 . 1 1 26 26 ASP CA C 13 55.0 0.4 . 1 . . . . . ASP CA . 6501 1
96 . 1 1 26 26 ASP CB C 13 41.9 0.4 . 1 . . . . . ASP CB . 6501 1
97 . 1 1 26 26 ASP N N 15 121.2 0.1 . 1 . . . . . ASP N . 6501 1
98 . 1 1 27 27 ASN H H 1 8.652 0.01 . 1 . . . . . ASN H . 6501 1
99 . 1 1 27 27 ASN CA C 13 52.2 0.4 . 1 . . . . . ASN CA . 6501 1
100 . 1 1 27 27 ASN CB C 13 39.1 0.4 . 9 . . . . . ASN CB . 6501 1
101 . 1 1 27 27 ASN N N 15 121.1 0.1 . 1 . . . . . ASN N . 6501 1
102 . 1 1 28 28 ALA H H 1 8.313 0.01 . 1 . . . . . ALA H . 6501 1
103 . 1 1 28 28 ALA CA C 13 51.2 0.4 . 1 . . . . . ALA CA . 6501 1
104 . 1 1 28 28 ALA CB C 13 20.9 0.4 . 1 . . . . . ALA CB . 6501 1
105 . 1 1 28 28 ALA N N 15 122.8 0.1 . 1 . . . . . ALA N . 6501 1
106 . 1 1 29 29 LEU H H 1 8.529 0.01 . 1 . . . . . LEU H . 6501 1
107 . 1 1 29 29 LEU CA C 13 53.4 0.4 . 1 . . . . . LEU CA . 6501 1
108 . 1 1 29 29 LEU CB C 13 44.3 0.4 . 1 . . . . . LEU CB . 6501 1
109 . 1 1 29 29 LEU N N 15 121.7 0.1 . 1 . . . . . LEU N . 6501 1
110 . 1 1 30 30 ALA H H 1 9.612 0.01 . 1 . . . . . ALA H . 6501 1
111 . 1 1 30 30 ALA CA C 13 49.9 0.4 . 1 . . . . . ALA CA . 6501 1
112 . 1 1 30 30 ALA CB C 13 20.5 0.4 . 1 . . . . . ALA CB . 6501 1
113 . 1 1 30 30 ALA N N 15 126.3 0.1 . 1 . . . . . ALA N . 6501 1
114 . 1 1 31 31 TYR H H 1 9.117 0.01 . 1 . . . . . TYR H . 6501 1
115 . 1 1 31 31 TYR CA C 13 56.7 0.4 . 1 . . . . . TYR CA . 6501 1
116 . 1 1 31 31 TYR CB C 13 40.2 0.4 . 1 . . . . . TYR CB . 6501 1
117 . 1 1 31 31 TYR N N 15 121.1 0.1 . 1 . . . . . TYR N . 6501 1
118 . 1 1 32 32 TYR H H 1 9.315 0.01 . 1 . . . . . TYR H . 6501 1
119 . 1 1 32 32 TYR CA C 13 55.1 0.4 . 1 . . . . . TYR CA . 6501 1
120 . 1 1 32 32 TYR CB C 13 42.5 0.4 . 1 . . . . . TYR CB . 6501 1
121 . 1 1 32 32 TYR N N 15 120.7 0.1 . 1 . . . . . TYR N . 6501 1
122 . 1 1 33 33 ASN H H 1 8.937 0.01 . 1 . . . . . ASN H . 6501 1
123 . 1 1 33 33 ASN CA C 13 51.0 0.4 . 1 . . . . . ASN CA . 6501 1
124 . 1 1 33 33 ASN CB C 13 41.1 0.4 . 1 . . . . . ASN CB . 6501 1
125 . 1 1 33 33 ASN N N 15 117.6 0.1 . 1 . . . . . ASN N . 6501 1
126 . 1 1 34 34 ASN H H 1 8.860 0.01 . 1 . . . . . ASN H . 6501 1
127 . 1 1 34 34 ASN CA C 13 52.8 0.4 . 1 . . . . . ASN CA . 6501 1
128 . 1 1 34 34 ASN CB C 13 39.1 0.4 . 1 . . . . . ASN CB . 6501 1
129 . 1 1 34 34 ASN N N 15 122.5 0.1 . 1 . . . . . ASN N . 6501 1
130 . 1 1 35 35 SER H H 1 8.292 0.01 . 1 . . . . . SER H . 6501 1
131 . 1 1 35 35 SER CA C 13 58.0 0.4 . 1 . . . . . SER CA . 6501 1
132 . 1 1 35 35 SER CB C 13 64.8 0.4 . 1 . . . . . SER CB . 6501 1
133 . 1 1 35 35 SER N N 15 118.2 0.1 . 1 . . . . . SER N . 6501 1
134 . 1 1 36 36 LYS H H 1 8.535 0.01 . 1 . . . . . LYS H . 6501 1
135 . 1 1 36 36 LYS CA C 13 58.4 0.4 . 1 . . . . . LYS CA . 6501 1
136 . 1 1 36 36 LYS N N 15 118.7 0.1 . 1 . . . . . LYS N . 6501 1
137 . 1 1 37 37 GLY H H 1 8.427 0.01 . 1 . . . . . GLY H . 6501 1
138 . 1 1 37 37 GLY CA C 13 44.8 0.4 . 1 . . . . . GLY CA . 6501 1
139 . 1 1 37 37 GLY N N 15 111.1 0.1 . 1 . . . . . GLY N . 6501 1
140 . 1 1 38 38 GLY H H 1 7.731 0.01 . 1 . . . . . GLY H . 6501 1
141 . 1 1 38 38 GLY CA C 13 44.0 0.4 . 1 . . . . . GLY CA . 6501 1
142 . 1 1 38 38 GLY N N 15 109.4 0.1 . 1 . . . . . GLY N . 6501 1
143 . 1 1 39 39 ARG H H 1 8.366 0.01 . 1 . . . . . ARG H . 6501 1
144 . 1 1 39 39 ARG CA C 13 56.3 0.4 . 1 . . . . . ARG CA . 6501 1
145 . 1 1 39 39 ARG CB C 13 29.7 0.4 . 1 . . . . . ARG CB . 6501 1
146 . 1 1 39 39 ARG N N 15 121.6 0.1 . 1 . . . . . ARG N . 6501 1
147 . 1 1 40 40 PHE H H 1 8.967 0.01 . 1 . . . . . PHE H . 6501 1
148 . 1 1 40 40 PHE CA C 13 56.0 0.4 . 1 . . . . . PHE CA . 6501 1
149 . 1 1 40 40 PHE CB C 13 39.2 0.4 . 1 . . . . . PHE CB . 6501 1
150 . 1 1 40 40 PHE N N 15 127.2 0.1 . 1 . . . . . PHE N . 6501 1
151 . 1 1 41 41 VAL H H 1 8.073 0.01 . 1 . . . . . VAL H . 6501 1
152 . 1 1 41 41 VAL CA C 13 63.0 0.4 . 1 . . . . . VAL CA . 6501 1
153 . 1 1 41 41 VAL CB C 13 31.0 0.4 . 1 . . . . . VAL CB . 6501 1
154 . 1 1 41 41 VAL N N 15 127.7 0.1 . 1 . . . . . VAL N . 6501 1
155 . 1 1 42 42 LEU H H 1 8.746 0.01 . 1 . . . . . LEU H . 6501 1
156 . 1 1 42 42 LEU CA C 13 56.1 0.4 . 1 . . . . . LEU CA . 6501 1
157 . 1 1 42 42 LEU CB C 13 44.5 0.4 . 1 . . . . . LEU CB . 6501 1
158 . 1 1 42 42 LEU N N 15 124.1 0.1 . 1 . . . . . LEU N . 6501 1
159 . 1 1 43 43 ALA H H 1 7.511 0.01 . 1 . . . . . ALA H . 6501 1
160 . 1 1 43 43 ALA CA C 13 50.6 0.4 . 1 . . . . . ALA CA . 6501 1
161 . 1 1 43 43 ALA CB C 13 23.6 0.4 . 1 . . . . . ALA CB . 6501 1
162 . 1 1 43 43 ALA N N 15 115.5 0.1 . 1 . . . . . ALA N . 6501 1
163 . 1 1 44 44 LEU H H 1 9.497 0.01 . 1 . . . . . LEU H . 6501 1
164 . 1 1 44 44 LEU CA C 13 53.5 0.4 . 1 . . . . . LEU CA . 6501 1
165 . 1 1 44 44 LEU CB C 13 46.3 0.4 . 1 . . . . . LEU CB . 6501 1
166 . 1 1 44 44 LEU N N 15 121.1 0.1 . 1 . . . . . LEU N . 6501 1
167 . 1 1 45 45 LEU H H 1 9.650 0.01 . 1 . . . . . LEU H . 6501 1
168 . 1 1 45 45 LEU CA C 13 53.2 0.4 . 1 . . . . . LEU CA . 6501 1
169 . 1 1 45 45 LEU CB C 13 46.2 0.4 . 1 . . . . . LEU CB . 6501 1
170 . 1 1 45 45 LEU N N 15 123.3 0.1 . 1 . . . . . LEU N . 6501 1
171 . 1 1 46 46 SER H H 1 9.466 0.01 . 1 . . . . . SER H . 6501 1
172 . 1 1 46 46 SER CA C 13 56.5 0.4 . 1 . . . . . SER CA . 6501 1
173 . 1 1 46 46 SER CB C 13 65.7 0.4 . 1 . . . . . SER CB . 6501 1
174 . 1 1 46 46 SER N N 15 118.5 0.1 . 1 . . . . . SER N . 6501 1
175 . 1 1 47 47 ASP H H 1 9.127 0.01 . 1 . . . . . ASP H . 6501 1
176 . 1 1 47 47 ASP CA C 13 55.9 0.4 . 1 . . . . . ASP CA . 6501 1
177 . 1 1 47 47 ASP CB C 13 40.8 0.4 . 1 . . . . . ASP CB . 6501 1
178 . 1 1 47 47 ASP N N 15 125.4 0.1 . 1 . . . . . ASP N . 6501 1
179 . 1 1 48 48 HIS H H 1 8.705 0.01 . 1 . . . . . HIS H . 6501 1
180 . 1 1 48 48 HIS CA C 13 55.9 0.4 . 1 . . . . . HIS CA . 6501 1
181 . 1 1 48 48 HIS CB C 13 31.0 0.4 . 1 . . . . . HIS CB . 6501 1
182 . 1 1 48 48 HIS N N 15 118.4 0.1 . 1 . . . . . HIS N . 6501 1
183 . 1 1 49 49 GLN H H 1 8.138 0.01 . 1 . . . . . GLN H . 6501 1
184 . 1 1 49 49 GLN CA C 13 56.2 0.4 . 9 . . . . . GLN CA . 6501 1
185 . 1 1 49 49 GLN CB C 13 29.4 0.4 . 1 . . . . . GLN CB . 6501 1
186 . 1 1 49 49 GLN N N 15 120.6 0.1 . 1 . . . . . GLN N . 6501 1
187 . 1 1 50 50 ASP H H 1 8.401 0.01 . 1 . . . . . ASP H . 6501 1
188 . 1 1 50 50 ASP CA C 13 52.9 0.4 . 1 . . . . . ASP CA . 6501 1
189 . 1 1 50 50 ASP CB C 13 39.7 0.4 . 1 . . . . . ASP CB . 6501 1
190 . 1 1 50 50 ASP N N 15 118.3 0.1 . 1 . . . . . ASP N . 6501 1
191 . 1 1 51 51 LEU H H 1 7.790 0.01 . 1 . . . . . LEU H . 6501 1
192 . 1 1 51 51 LEU CA C 13 55.4 0.4 . 1 . . . . . LEU CA . 6501 1
193 . 1 1 51 51 LEU CB C 13 40.2 0.4 . 1 . . . . . LEU CB . 6501 1
194 . 1 1 51 51 LEU N N 15 117.6 0.1 . 1 . . . . . LEU N . 6501 1
195 . 1 1 52 52 LYS H H 1 8.098 0.01 . 1 . . . . . LYS H . 6501 1
196 . 1 1 52 52 LYS CA C 13 56.2 0.4 . 1 . . . . . LYS CA . 6501 1
197 . 1 1 52 52 LYS CB C 13 36.3 0.4 . 1 . . . . . LYS CB . 6501 1
198 . 1 1 52 52 LYS N N 15 118.6 0.1 . 1 . . . . . LYS N . 6501 1
199 . 1 1 53 53 TRP H H 1 7.952 0.01 . 1 . . . . . TRP H . 6501 1
200 . 1 1 53 53 TRP CA C 13 55.3 0.4 . 1 . . . . . TRP CA . 6501 1
201 . 1 1 53 53 TRP CB C 13 34.0 0.4 . 1 . . . . . TRP CB . 6501 1
202 . 1 1 53 53 TRP N N 15 117.9 0.1 . 1 . . . . . TRP N . 6501 1
203 . 1 1 54 54 ALA H H 1 9.127 0.01 . 1 . . . . . ALA H . 6501 1
204 . 1 1 54 54 ALA CA C 13 50.2 0.4 . 1 . . . . . ALA CA . 6501 1
205 . 1 1 54 54 ALA CB C 13 23.4 0.4 . 1 . . . . . ALA CB . 6501 1
206 . 1 1 54 54 ALA N N 15 122.1 0.1 . 1 . . . . . ALA N . 6501 1
207 . 1 1 55 55 ARG H H 1 8.189 0.01 . 1 . . . . . ARG H . 6501 1
208 . 1 1 55 55 ARG CA C 13 53.8 0.4 . 1 . . . . . ARG CA . 6501 1
209 . 1 1 55 55 ARG CB C 13 32.9 0.4 . 1 . . . . . ARG CB . 6501 1
210 . 1 1 55 55 ARG N N 15 121.3 0.1 . 1 . . . . . ARG N . 6501 1
211 . 1 1 56 56 PHE H H 1 8.681 0.01 . 1 . . . . . PHE H . 6501 1
212 . 1 1 56 56 PHE CA C 13 54.1 0.4 . 1 . . . . . PHE CA . 6501 1
213 . 1 1 56 56 PHE CB C 13 40.2 0.4 . 1 . . . . . PHE CB . 6501 1
214 . 1 1 56 56 PHE N N 15 122.9 0.1 . 1 . . . . . PHE N . 6501 1
215 . 1 1 57 57 PRO CA C 13 63.1 0.4 . 1 . . . . . PRO CA . 6501 1
216 . 1 1 57 57 PRO CB C 13 31.3 0.4 . 1 . . . . . PRO CB . 6501 1
217 . 1 1 58 58 LYS H H 1 7.993 0.01 . 1 . . . . . LYS H . 6501 1
218 . 1 1 58 58 LYS CA C 13 57.1 0.4 . 1 . . . . . LYS CA . 6501 1
219 . 1 1 58 58 LYS CB C 13 31.0 0.4 . 1 . . . . . LYS CB . 6501 1
220 . 1 1 58 58 LYS N N 15 127.3 0.1 . 1 . . . . . LYS N . 6501 1
221 . 1 1 59 59 SER CA C 13 60.6 0.4 . 1 . . . . . SER CA . 6501 1
222 . 1 1 60 60 ASP H H 1 7.780 0.01 . 1 . . . . . ASP H . 6501 1
223 . 1 1 60 60 ASP CA C 13 53.0 0.4 . 1 . . . . . ASP CA . 6501 1
224 . 1 1 60 60 ASP CB C 13 40.1 0.4 . 1 . . . . . ASP CB . 6501 1
225 . 1 1 60 60 ASP N N 15 118.9 0.1 . 1 . . . . . ASP N . 6501 1
226 . 1 1 61 61 GLY H H 1 7.988 0.01 . 1 . . . . . GLY H . 6501 1
227 . 1 1 61 61 GLY CA C 13 45.5 0.4 . 1 . . . . . GLY CA . 6501 1
228 . 1 1 61 61 GLY N N 15 107.2 0.1 . 1 . . . . . GLY N . 6501 1
229 . 1 1 62 62 THR H H 1 8.025 0.01 . 1 . . . . . THR H . 6501 1
230 . 1 1 62 62 THR CA C 13 62.0 0.4 . 1 . . . . . THR CA . 6501 1
231 . 1 1 62 62 THR CB C 13 69.9 0.4 . 1 . . . . . THR CB . 6501 1
232 . 1 1 62 62 THR N N 15 110.9 0.1 . 1 . . . . . THR N . 6501 1
233 . 1 1 63 63 GLY H H 1 7.896 0.01 . 1 . . . . . GLY H . 6501 1
234 . 1 1 63 63 GLY CA C 13 44.6 0.4 . 1 . . . . . GLY CA . 6501 1
235 . 1 1 63 63 GLY N N 15 108.8 0.1 . 1 . . . . . GLY N . 6501 1
236 . 1 1 64 64 THR H H 1 8.530 0.01 . 1 . . . . . THR H . 6501 1
237 . 1 1 64 64 THR CA C 13 61.4 0.4 . 1 . . . . . THR CA . 6501 1
238 . 1 1 64 64 THR CB C 13 71.6 0.4 . 1 . . . . . THR CB . 6501 1
239 . 1 1 64 64 THR N N 15 116.5 0.1 . 1 . . . . . THR N . 6501 1
240 . 1 1 65 65 ILE H H 1 8.910 0.01 . 1 . . . . . ILE H . 6501 1
241 . 1 1 65 65 ILE CA C 13 59.5 0.4 . 1 . . . . . ILE CA . 6501 1
242 . 1 1 65 65 ILE CB C 13 40.1 0.4 . 1 . . . . . ILE CB . 6501 1
243 . 1 1 65 65 ILE N N 15 124.1 0.1 . 1 . . . . . ILE N . 6501 1
244 . 1 1 66 66 TYR H H 1 8.544 0.01 . 1 . . . . . TYR H . 6501 1
245 . 1 1 66 66 TYR CA C 13 56.7 0.4 . 1 . . . . . TYR CA . 6501 1
246 . 1 1 66 66 TYR CB C 13 40.5 0.4 . 1 . . . . . TYR CB . 6501 1
247 . 1 1 66 66 TYR N N 15 122.8 0.1 . 1 . . . . . TYR N . 6501 1
248 . 1 1 67 67 THR H H 1 9.456 0.01 . 1 . . . . . THR H . 6501 1
249 . 1 1 67 67 THR CA C 13 60.8 0.4 . 1 . . . . . THR CA . 6501 1
250 . 1 1 67 67 THR CB C 13 71.4 0.4 . 1 . . . . . THR CB . 6501 1
251 . 1 1 67 67 THR N N 15 119.1 0.1 . 1 . . . . . THR N . 6501 1
252 . 1 1 68 68 GLU H H 1 8.957 0.01 . 1 . . . . . GLU H . 6501 1
253 . 1 1 68 68 GLU CA C 13 56.0 0.4 . 1 . . . . . GLU CA . 6501 1
254 . 1 1 68 68 GLU CB C 13 29.9 0.4 . 1 . . . . . GLU CB . 6501 1
255 . 1 1 68 68 GLU N N 15 130.4 0.1 . 1 . . . . . GLU N . 6501 1
256 . 1 1 69 69 LEU H H 1 7.313 0.01 . 1 . . . . . LEU H . 6501 1
257 . 1 1 69 69 LEU CA C 13 52.8 0.4 . 1 . . . . . LEU CA . 6501 1
258 . 1 1 69 69 LEU CB C 13 42.8 0.4 . 1 . . . . . LEU CB . 6501 1
259 . 1 1 69 69 LEU N N 15 122.3 0.1 . 1 . . . . . LEU N . 6501 1
260 . 1 1 70 70 GLU H H 1 8.621 0.01 . 1 . . . . . GLU H . 6501 1
261 . 1 1 70 70 GLU CA C 13 55.1 0.4 . 1 . . . . . GLU CA . 6501 1
262 . 1 1 70 70 GLU CB C 13 28.0 0.4 . 1 . . . . . GLU CB . 6501 1
263 . 1 1 70 70 GLU N N 15 121.4 0.1 . 1 . . . . . GLU N . 6501 1
264 . 1 1 72 72 PRO CA C 13 63.3 0.4 . 1 . . . . . PRO CA . 6501 1
265 . 1 1 73 73 CYS H H 1 8.364 0.01 . 1 . . . . . CYS H . 6501 1
266 . 1 1 73 73 CYS CA C 13 56.8 0.4 . 1 . . . . . CYS CA . 6501 1
267 . 1 1 73 73 CYS CB C 13 32.9 0.4 . 1 . . . . . CYS CB . 6501 1
268 . 1 1 73 73 CYS N N 15 122.4 0.1 . 1 . . . . . CYS N . 6501 1
269 . 1 1 74 74 ARG H H 1 8.685 0.01 . 1 . . . . . ARG H . 6501 1
270 . 1 1 74 74 ARG CA C 13 56.3 0.4 . 1 . . . . . ARG CA . 6501 1
271 . 1 1 74 74 ARG N N 15 126.2 0.1 . 1 . . . . . ARG N . 6501 1
272 . 1 1 76 76 VAL H H 1 8.541 0.01 . 1 . . . . . VAL H . 6501 1
273 . 1 1 76 76 VAL CA C 13 61.5 0.4 . 1 . . . . . VAL CA . 6501 1
274 . 1 1 76 76 VAL N N 15 123.7 0.1 . 1 . . . . . VAL N . 6501 1
275 . 1 1 77 77 THR H H 1 8.595 0.01 . 1 . . . . . THR H . 6501 1
276 . 1 1 77 77 THR CA C 13 59.1 0.4 . 1 . . . . . THR CA . 6501 1
277 . 1 1 77 77 THR CB C 13 70.9 0.4 . 1 . . . . . THR CB . 6501 1
278 . 1 1 77 77 THR N N 15 119.9 0.1 . 1 . . . . . THR N . 6501 1
279 . 1 1 78 78 ASP H H 1 8.564 0.01 . 1 . . . . . ASP H . 6501 1
280 . 1 1 78 78 ASP CA C 13 54.5 0.4 . 1 . . . . . ASP CA . 6501 1
281 . 1 1 78 78 ASP CB C 13 41.8 0.4 . 1 . . . . . ASP CB . 6501 1
282 . 1 1 78 78 ASP N N 15 124.6 0.1 . 1 . . . . . ASP N . 6501 1
283 . 1 1 79 79 THR H H 1 7.568 0.01 . 1 . . . . . THR H . 6501 1
284 . 1 1 79 79 THR CA C 13 59.7 0.4 . 1 . . . . . THR CA . 6501 1
285 . 1 1 79 79 THR CB C 13 70.7 0.4 . 1 . . . . . THR CB . 6501 1
286 . 1 1 79 79 THR N N 15 115.1 0.1 . 1 . . . . . THR N . 6501 1
287 . 1 1 80 80 PRO CA C 13 64.7 0.4 . 1 . . . . . PRO CA . 6501 1
288 . 1 1 80 80 PRO CB C 13 31.4 0.4 . 1 . . . . . PRO CB . 6501 1
289 . 1 1 81 81 LYS H H 1 7.667 0.01 . 1 . . . . . LYS H . 6501 1
290 . 1 1 81 81 LYS CA C 13 54.6 0.4 . 1 . . . . . LYS CA . 6501 1
291 . 1 1 81 81 LYS CB C 13 31.7 0.4 . 1 . . . . . LYS CB . 6501 1
292 . 1 1 81 81 LYS N N 15 114.8 0.1 . 1 . . . . . LYS N . 6501 1
293 . 1 1 82 82 GLY H H 1 7.748 0.01 . 1 . . . . . GLY H . 6501 1
294 . 1 1 82 82 GLY CA C 13 43.5 0.4 . 1 . . . . . GLY CA . 6501 1
295 . 1 1 82 82 GLY N N 15 110.1 0.1 . 1 . . . . . GLY N . 6501 1
296 . 1 1 83 83 PRO CA C 13 62.9 0.4 . 1 . . . . . PRO CA . 6501 1
297 . 1 1 83 83 PRO CB C 13 31.3 0.4 . 1 . . . . . PRO CB . 6501 1
298 . 1 1 84 84 LYS H H 1 8.967 0.01 . 1 . . . . . LYS H . 6501 1
299 . 1 1 84 84 LYS CA C 13 54.0 0.4 . 1 . . . . . LYS CA . 6501 1
300 . 1 1 84 84 LYS CB C 13 34.6 0.4 . 1 . . . . . LYS CB . 6501 1
301 . 1 1 84 84 LYS N N 15 124.4 0.1 . 1 . . . . . LYS N . 6501 1
302 . 1 1 85 85 VAL H H 1 8.685 0.01 . 1 . . . . . VAL H . 6501 1
303 . 1 1 85 85 VAL CA C 13 62.5 0.4 . 1 . . . . . VAL CA . 6501 1
304 . 1 1 85 85 VAL CB C 13 54.0 0.4 . 1 . . . . . VAL CB . 6501 1
305 . 1 1 85 85 VAL N N 15 127.3 0.1 . 1 . . . . . VAL N . 6501 1
306 . 1 1 86 86 LYS H H 1 8.136 0.01 . 1 . . . . . LYS H . 6501 1
307 . 1 1 86 86 LYS CA C 13 57.3 0.4 . 1 . . . . . LYS CA . 6501 1
308 . 1 1 86 86 LYS CB C 13 30.4 0.4 . 1 . . . . . LYS CB . 6501 1
309 . 1 1 86 86 LYS N N 15 126.2 0.1 . 1 . . . . . LYS N . 6501 1
310 . 1 1 87 87 TYR CA C 13 57.4 0.4 . 1 . . . . . TYR CA . 6501 1
311 . 1 1 88 88 LEU H H 1 8.855 0.01 . 1 . . . . . LEU H . 6501 1
312 . 1 1 88 88 LEU CA C 13 52.8 0.4 . 1 . . . . . LEU CA . 6501 1
313 . 1 1 88 88 LEU CB C 13 43.8 0.4 . 1 . . . . . LEU CB . 6501 1
314 . 1 1 88 88 LEU N N 15 125.8 0.1 . 1 . . . . . LEU N . 6501 1
315 . 1 1 89 89 TYR H H 1 9.916 0.01 . 1 . . . . . TYR H . 6501 1
316 . 1 1 89 89 TYR CA C 13 55.1 0.4 . 1 . . . . . TYR CA . 6501 1
317 . 1 1 89 89 TYR CB C 13 40.2 0.4 . 1 . . . . . TYR CB . 6501 1
318 . 1 1 89 89 TYR N N 15 127.7 0.1 . 1 . . . . . TYR N . 6501 1
319 . 1 1 90 90 PHE H H 1 8.921 0.01 . 1 . . . . . PHE H . 6501 1
320 . 1 1 90 90 PHE CA C 13 58.4 0.4 . 1 . . . . . PHE CA . 6501 1
321 . 1 1 90 90 PHE CB C 13 38.8 0.4 . 1 . . . . . PHE CB . 6501 1
322 . 1 1 90 90 PHE N N 15 123.3 0.1 . 1 . . . . . PHE N . 6501 1
323 . 1 1 91 91 ILE H H 1 7.515 0.01 . 1 . . . . . ILE H . 6501 1
324 . 1 1 91 91 ILE CA C 13 60.9 0.4 . 1 . . . . . ILE CA . 6501 1
325 . 1 1 91 91 ILE CB C 13 37.2 0.4 . 1 . . . . . ILE CB . 6501 1
326 . 1 1 91 91 ILE N N 15 119.7 0.1 . 1 . . . . . ILE N . 6501 1
327 . 1 1 92 92 LYS CA C 13 57.6 0.4 . 1 . . . . . LYS CA . 6501 1
328 . 1 1 92 92 LYS CB C 13 30.6 0.4 . 1 . . . . . LYS CB . 6501 1
329 . 1 1 93 93 GLY H H 1 8.443 0.01 . 1 . . . . . GLY H . 6501 1
330 . 1 1 93 93 GLY CA C 13 44.9 0.4 . 1 . . . . . GLY CA . 6501 1
331 . 1 1 93 93 GLY N N 15 108.1 0.1 . 1 . . . . . GLY N . 6501 1
332 . 1 1 94 94 LEU H H 1 8.092 0.01 . 1 . . . . . LEU H . 6501 1
333 . 1 1 94 94 LEU CA C 13 54.7 0.4 . 1 . . . . . LEU CA . 6501 1
334 . 1 1 94 94 LEU CB C 13 41.5 0.4 . 1 . . . . . LEU CB . 6501 1
335 . 1 1 94 94 LEU N N 15 122.2 0.1 . 1 . . . . . LEU N . 6501 1
336 . 1 1 95 95 ASN H H 1 7.998 0.01 . 1 . . . . . ASN H . 6501 1
337 . 1 1 95 95 ASN CA C 13 57.1 0.4 . 1 . . . . . ASN CA . 6501 1
338 . 1 1 95 95 ASN CB C 13 30.1 0.4 . 1 . . . . . ASN CB . 6501 1
339 . 1 1 95 95 ASN N N 15 126.1 0.1 . 1 . . . . . ASN N . 6501 1
340 . 1 1 98 98 ASN H H 1 8.120 0.01 . 1 . . . . . ASN H . 6501 1
341 . 1 1 98 98 ASN CA C 13 54.8 0.4 . 1 . . . . . ASN CA . 6501 1
342 . 1 1 98 98 ASN CB C 13 41.5 0.4 . 1 . . . . . ASN CB . 6501 1
343 . 1 1 98 98 ASN N N 15 123.5 0.1 . 1 . . . . . ASN N . 6501 1
344 . 1 1 99 99 ARG H H 1 8.117 0.01 . 1 . . . . . ARG H . 6501 1
345 . 1 1 99 99 ARG CA C 13 57.9 0.4 . 1 . . . . . ARG CA . 6501 1
346 . 1 1 99 99 ARG CB C 13 32.1 0.4 . 1 . . . . . ARG CB . 6501 1
347 . 1 1 99 99 ARG N N 15 123.7 0.1 . 1 . . . . . ARG N . 6501 1
348 . 1 1 100 100 GLY H H 1 9.157 0.01 . 1 . . . . . GLY H . 6501 1
349 . 1 1 100 100 GLY CA C 13 44.7 0.4 . 1 . . . . . GLY CA . 6501 1
350 . 1 1 100 100 GLY N N 15 114.6 0.1 . 1 . . . . . GLY N . 6501 1
351 . 1 1 101 101 MET H H 1 7.737 0.01 . 1 . . . . . MET H . 6501 1
352 . 1 1 101 101 MET CA C 13 55.7 0.4 . 1 . . . . . MET CA . 6501 1
353 . 1 1 101 101 MET CB C 13 41.4 0.4 . 1 . . . . . MET CB . 6501 1
354 . 1 1 101 101 MET N N 15 123.2 0.1 . 1 . . . . . MET N . 6501 1
355 . 1 1 102 102 VAL H H 1 8.929 0.01 . 1 . . . . . VAL H . 6501 1
356 . 1 1 102 102 VAL CA C 13 52.4 0.4 . 1 . . . . . VAL CA . 6501 1
357 . 1 1 102 102 VAL CB C 13 37.6 0.4 . 1 . . . . . VAL CB . 6501 1
358 . 1 1 102 102 VAL N N 15 126.3 0.1 . 1 . . . . . VAL N . 6501 1
359 . 1 1 104 104 GLY H H 1 8.084 0.01 . 1 . . . . . GLY H . 6501 1
360 . 1 1 104 104 GLY CA C 13 45.7 0.4 . 1 . . . . . GLY CA . 6501 1
361 . 1 1 104 104 GLY N N 15 117.4 0.1 . 1 . . . . . GLY N . 6501 1
362 . 1 1 105 105 SER CA C 13 62.5 0.4 . 1 . . . . . SER CA . 6501 1
363 . 1 1 106 106 LEU H H 1 8.576 0.01 . 1 . . . . . LEU H . 6501 1
364 . 1 1 106 106 LEU CA C 13 52.8 0.4 . 1 . . . . . LEU CA . 6501 1
365 . 1 1 106 106 LEU CB C 13 36.0 0.4 . 1 . . . . . LEU CB . 6501 1
366 . 1 1 106 106 LEU N N 15 127.5 0.1 . 1 . . . . . LEU N . 6501 1
367 . 1 1 107 107 ALA H H 1 7.877 0.01 . 1 . . . . . ALA H . 6501 1
368 . 1 1 107 107 ALA N N 15 110.4 0.1 . 1 . . . . . ALA N . 6501 1
369 . 1 1 110 110 VAL H H 1 7.955 0.01 . 1 . . . . . VAL H . 6501 1
370 . 1 1 110 110 VAL CA C 13 61.7 0.4 . 1 . . . . . VAL CA . 6501 1
371 . 1 1 110 110 VAL CB C 13 32.3 0.4 . 1 . . . . . VAL CB . 6501 1
372 . 1 1 110 110 VAL N N 15 121.9 0.1 . 1 . . . . . VAL N . 6501 1
373 . 1 1 111 111 ARG H H 1 8.346 0.01 . 1 . . . . . ARG H . 6501 1
374 . 1 1 111 111 ARG CA C 13 55.3 0.4 . 1 . . . . . ARG CA . 6501 1
375 . 1 1 111 111 ARG CB C 13 29.8 0.4 . 1 . . . . . ARG CB . 6501 1
376 . 1 1 111 111 ARG N N 15 124.1 0.1 . 1 . . . . . ARG N . 6501 1
377 . 1 1 112 112 LEU H H 1 8.392 0.01 . 1 . . . . . LEU H . 6501 1
378 . 1 1 112 112 LEU CA C 13 54.8 0.4 . 1 . . . . . LEU CA . 6501 1
379 . 1 1 112 112 LEU CB C 13 41.5 0.4 . 1 . . . . . LEU CB . 6501 1
380 . 1 1 112 112 LEU N N 15 125.5 0.1 . 1 . . . . . LEU N . 6501 1
381 . 1 1 113 113 GLN H H 1 7.780 0.01 . 1 . . . . . GLN H . 6501 1
382 . 1 1 113 113 GLN CA C 13 58.7 0.4 . 1 . . . . . GLN CA . 6501 1
383 . 1 1 113 113 GLN N N 15 118.9 0.1 . 1 . . . . . GLN N . 6501 1
stop_
save_