data_19847
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19847
_Entry.PDB_ID 2MM6
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 19847
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.834 -0.158 19847
2 1 1 . 1 1 2 2 ARG H H 2 9.233 9.233 8.614 0.619 19847
3 1 1 . 1 1 3 3 PRO HA H 3 4.474 4.474 4.722 -0.248 19847
4 1 1 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.031 0.658 19847
5 1 1 . 1 1 4 4 TYR H H 4 7.189 7.189 7.300 -0.111 19847
6 1 1 . 1 1 5 5 GLY H H 5 9.269 9.269 8.424 0.845 19847
7 1 1 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.549 -0.155 19847
8 1 1 . 1 1 6 6 TYR H H 6 7.861 7.861 7.571 0.290 19847
9 1 1 . 1 1 7 7 ARG HA H 7 4.677 4.677 4.843 -0.166 19847
10 1 1 . 1 1 7 7 ARG H H 7 8.225 8.225 8.194 0.031 19847
11 1 1 . 1 1 8 8 CYS HA H 8 4.979 4.979 5.102 -0.123 19847
12 1 1 . 1 1 8 8 CYS H H 8 8.570 8.570 8.170 0.400 19847
13 1 1 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.897 0.019 19847
14 1 1 . 1 1 9 9 ASP H H 9 8.540 8.540 8.755 -0.215 19847
15 1 1 . 1 1 10 10 GLY H H 10 8.269 8.269 7.966 0.303 19847
16 1 1 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.205 -0.123 19847
17 1 1 . 1 1 11 11 VAL H H 11 8.329 8.329 8.290 0.039 19847
18 1 1 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.194 -0.040 19847
19 1 1 . 1 1 12 12 ILE H H 12 8.144 8.144 8.009 0.135 19847
20 1 1 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.990 -0.157 19847
21 1 1 . 1 1 13 13 ASN H H 13 8.780 8.780 7.956 0.824 19847
22 1 1 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.520 -0.045 19847
23 1 1 . 1 1 14 14 GLN H H 14 8.546 8.546 8.111 0.435 19847
24 1 1 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.510 -0.045 19847
25 1 1 . 1 1 15 15 CYS H H 15 7.691 7.691 8.523 -0.832 19847
26 1 1 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.448 0.131 19847
27 1 1 . 1 1 16 16 CYS H H 16 9.687 9.687 8.452 1.235 19847
28 1 1 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.283 -0.663 19847
29 1 1 . 1 1 17 17 ASP H H 17 8.820 8.820 8.397 0.423 19847
30 1 1 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.348 0.263 19847
31 1 1 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.384 0.331 19847
32 1 1 . 1 1 19 19 TYR H H 19 8.527 8.527 7.485 1.042 19847
33 1 1 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.954 -0.056 19847
34 1 1 . 1 1 20 20 HIS H H 20 9.161 9.161 8.312 0.849 19847
35 1 1 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.687 -0.260 19847
36 1 1 . 1 1 21 21 CYS H H 21 8.928 8.928 9.115 -0.187 19847
37 1 1 . 1 1 22 22 THR HA H 22 4.390 4.390 4.846 -0.456 19847
38 1 1 . 1 1 22 22 THR H H 22 9.120 9.120 9.140 -0.020 19847
39 1 1 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.733 0.368 19847
40 1 1 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.557 -0.557 19847
41 1 1 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.425 -0.465 19847
42 1 1 . 1 1 25 25 LEU H H 25 8.119 8.119 7.635 0.484 19847
43 1 1 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.513 -0.004 19847
44 1 1 . 1 1 26 26 ILE H H 26 7.504 7.504 7.455 0.049 19847
45 1 1 . 1 1 27 27 GLY H H 27 7.859 7.859 8.514 -0.655 19847
46 1 1 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.069 -0.161 19847
47 1 1 . 1 1 28 28 ILE H H 28 8.019 8.019 7.842 0.177 19847
48 1 1 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.803 -0.145 19847
49 1 1 . 1 1 29 29 CYS H H 29 8.400 8.400 8.481 -0.081 19847
50 1 2 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.932 -0.256 19847
51 1 2 . 1 1 2 2 ARG H H 2 9.233 9.233 8.624 0.609 19847
52 1 2 . 1 1 3 3 PRO HA H 3 4.474 4.474 4.885 -0.411 19847
53 1 2 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.063 0.626 19847
54 1 2 . 1 1 4 4 TYR H H 4 7.189 7.189 7.374 -0.185 19847
55 1 2 . 1 1 5 5 GLY H H 5 9.269 9.269 8.282 0.987 19847
56 1 2 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.529 -0.135 19847
57 1 2 . 1 1 6 6 TYR H H 6 7.861 7.861 7.707 0.154 19847
58 1 2 . 1 1 7 7 ARG HA H 7 4.677 4.677 4.710 -0.033 19847
59 1 2 . 1 1 7 7 ARG H H 7 8.225 8.225 8.595 -0.370 19847
60 1 2 . 1 1 8 8 CYS HA H 8 4.979 4.979 5.049 -0.070 19847
61 1 2 . 1 1 8 8 CYS H H 8 8.570 8.570 8.200 0.370 19847
62 1 2 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.656 0.260 19847
63 1 2 . 1 1 9 9 ASP H H 9 8.540 8.540 8.871 -0.331 19847
64 1 2 . 1 1 10 10 GLY H H 10 8.269 8.269 8.039 0.230 19847
65 1 2 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.100 -0.018 19847
66 1 2 . 1 1 11 11 VAL H H 11 8.329 8.329 8.249 0.080 19847
67 1 2 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.102 0.052 19847
68 1 2 . 1 1 12 12 ILE H H 12 8.144 8.144 7.909 0.235 19847
69 1 2 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.841 -0.008 19847
70 1 2 . 1 1 13 13 ASN H H 13 8.780 8.780 7.710 1.070 19847
71 1 2 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.470 0.005 19847
72 1 2 . 1 1 14 14 GLN H H 14 8.546 8.546 8.038 0.508 19847
73 1 2 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.562 -0.097 19847
74 1 2 . 1 1 15 15 CYS H H 15 7.691 7.691 8.471 -0.780 19847
75 1 2 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.449 0.130 19847
76 1 2 . 1 1 16 16 CYS H H 16 9.687 9.687 8.458 1.229 19847
77 1 2 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.315 -0.695 19847
78 1 2 . 1 1 17 17 ASP H H 17 8.820 8.820 8.423 0.397 19847
79 1 2 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.362 0.249 19847
80 1 2 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.422 0.293 19847
81 1 2 . 1 1 19 19 TYR H H 19 8.527 8.527 7.473 1.054 19847
82 1 2 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.914 -0.016 19847
83 1 2 . 1 1 20 20 HIS H H 20 9.161 9.161 8.330 0.831 19847
84 1 2 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.645 -0.218 19847
85 1 2 . 1 1 21 21 CYS H H 21 8.928 8.928 9.157 -0.229 19847
86 1 2 . 1 1 22 22 THR HA H 22 4.390 4.390 4.945 -0.555 19847
87 1 2 . 1 1 22 22 THR H H 22 9.120 9.120 9.152 -0.032 19847
88 1 2 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.746 0.355 19847
89 1 2 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.641 -0.641 19847
90 1 2 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.565 -0.605 19847
91 1 2 . 1 1 25 25 LEU H H 25 8.119 8.119 8.549 -0.430 19847
92 1 2 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.622 -0.113 19847
93 1 2 . 1 1 26 26 ILE H H 26 7.504 7.504 7.612 -0.108 19847
94 1 2 . 1 1 27 27 GLY H H 27 7.859 7.859 8.536 -0.677 19847
95 1 2 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.062 -0.154 19847
96 1 2 . 1 1 28 28 ILE H H 28 8.019 8.019 7.829 0.190 19847
97 1 2 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.888 -0.230 19847
98 1 2 . 1 1 29 29 CYS H H 29 8.400 8.400 8.541 -0.141 19847
99 1 3 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.873 -0.197 19847
100 1 3 . 1 1 2 2 ARG H H 2 9.233 9.233 8.650 0.583 19847
101 1 3 . 1 1 3 3 PRO HA H 3 4.474 4.474 4.672 -0.198 19847
102 1 3 . 1 1 4 4 TYR HA H 4 4.689 4.689 3.980 0.709 19847
103 1 3 . 1 1 4 4 TYR H H 4 7.189 7.189 7.361 -0.172 19847
104 1 3 . 1 1 5 5 GLY H H 5 9.269 9.269 8.284 0.985 19847
105 1 3 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.505 -0.111 19847
106 1 3 . 1 1 6 6 TYR H H 6 7.861 7.861 7.398 0.463 19847
107 1 3 . 1 1 7 7 ARG HA H 7 4.677 4.677 5.143 -0.466 19847
108 1 3 . 1 1 7 7 ARG H H 7 8.225 8.225 8.316 -0.091 19847
109 1 3 . 1 1 8 8 CYS HA H 8 4.979 4.979 5.051 -0.072 19847
110 1 3 . 1 1 8 8 CYS H H 8 8.570 8.570 8.412 0.158 19847
111 1 3 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.867 0.049 19847
112 1 3 . 1 1 9 9 ASP H H 9 8.540 8.540 8.586 -0.046 19847
113 1 3 . 1 1 10 10 GLY H H 10 8.269 8.269 8.192 0.077 19847
114 1 3 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.242 -0.160 19847
115 1 3 . 1 1 11 11 VAL H H 11 8.329 8.329 8.226 0.103 19847
116 1 3 . 1 1 12 12 ILE HA H 12 4.154 4.154 3.926 0.228 19847
117 1 3 . 1 1 12 12 ILE H H 12 8.144 8.144 7.940 0.204 19847
118 1 3 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.848 -0.015 19847
119 1 3 . 1 1 13 13 ASN H H 13 8.780 8.780 8.017 0.763 19847
120 1 3 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.489 -0.014 19847
121 1 3 . 1 1 14 14 GLN H H 14 8.546 8.546 8.355 0.191 19847
122 1 3 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.930 -0.465 19847
123 1 3 . 1 1 15 15 CYS H H 15 7.691 7.691 8.182 -0.491 19847
124 1 3 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.468 0.111 19847
125 1 3 . 1 1 16 16 CYS H H 16 9.687 9.687 8.496 1.191 19847
126 1 3 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.261 -0.641 19847
127 1 3 . 1 1 17 17 ASP H H 17 8.820 8.820 8.410 0.410 19847
128 1 3 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.237 0.374 19847
129 1 3 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.354 0.361 19847
130 1 3 . 1 1 19 19 TYR H H 19 8.527 8.527 7.348 1.179 19847
131 1 3 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.896 0.002 19847
132 1 3 . 1 1 20 20 HIS H H 20 9.161 9.161 8.278 0.883 19847
133 1 3 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.931 -0.504 19847
134 1 3 . 1 1 21 21 CYS H H 21 8.928 8.928 9.359 -0.431 19847
135 1 3 . 1 1 22 22 THR HA H 22 4.390 4.390 4.841 -0.451 19847
136 1 3 . 1 1 22 22 THR H H 22 9.120 9.120 9.135 -0.015 19847
137 1 3 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.722 0.379 19847
138 1 3 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.552 -0.552 19847
139 1 3 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.442 -0.482 19847
140 1 3 . 1 1 25 25 LEU H H 25 8.119 8.119 7.621 0.498 19847
141 1 3 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.662 -0.153 19847
142 1 3 . 1 1 26 26 ILE H H 26 7.504 7.504 7.491 0.013 19847
143 1 3 . 1 1 27 27 GLY H H 27 7.859 7.859 8.566 -0.707 19847
144 1 3 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.363 -0.455 19847
145 1 3 . 1 1 28 28 ILE H H 28 8.019 8.019 7.891 0.128 19847
146 1 3 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.940 -0.282 19847
147 1 3 . 1 1 29 29 CYS H H 29 8.400 8.400 8.406 -0.006 19847
148 1 4 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.961 -0.285 19847
149 1 4 . 1 1 2 2 ARG H H 2 9.233 9.233 8.632 0.601 19847
150 1 4 . 1 1 3 3 PRO HA H 3 4.474 4.474 4.861 -0.387 19847
151 1 4 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.057 0.632 19847
152 1 4 . 1 1 4 4 TYR H H 4 7.189 7.189 7.287 -0.098 19847
153 1 4 . 1 1 5 5 GLY H H 5 9.269 9.269 8.252 1.017 19847
154 1 4 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.524 -0.130 19847
155 1 4 . 1 1 6 6 TYR H H 6 7.861 7.861 7.702 0.160 19847
156 1 4 . 1 1 7 7 ARG HA H 7 4.677 4.677 4.682 -0.005 19847
157 1 4 . 1 1 7 7 ARG H H 7 8.225 8.225 8.575 -0.350 19847
158 1 4 . 1 1 8 8 CYS HA H 8 4.979 4.979 5.045 -0.066 19847
159 1 4 . 1 1 8 8 CYS H H 8 8.570 8.570 8.359 0.211 19847
160 1 4 . 1 1 9 9 ASP HA H 9 4.916 4.916 5.003 -0.087 19847
161 1 4 . 1 1 9 9 ASP H H 9 8.540 8.540 8.587 -0.047 19847
162 1 4 . 1 1 10 10 GLY H H 10 8.269 8.269 8.403 -0.134 19847
163 1 4 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.257 -0.175 19847
164 1 4 . 1 1 11 11 VAL H H 11 8.329 8.329 8.277 0.052 19847
165 1 4 . 1 1 12 12 ILE HA H 12 4.154 4.154 3.897 0.257 19847
166 1 4 . 1 1 12 12 ILE H H 12 8.144 8.144 8.106 0.038 19847
167 1 4 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.822 0.011 19847
168 1 4 . 1 1 13 13 ASN H H 13 8.780 8.780 7.991 0.789 19847
169 1 4 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.487 -0.012 19847
170 1 4 . 1 1 14 14 GLN H H 14 8.546 8.546 7.967 0.579 19847
171 1 4 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.549 -0.084 19847
172 1 4 . 1 1 15 15 CYS H H 15 7.691 7.691 8.509 -0.818 19847
173 1 4 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.438 0.141 19847
174 1 4 . 1 1 16 16 CYS H H 16 9.687 9.687 8.477 1.210 19847
175 1 4 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.278 -0.658 19847
176 1 4 . 1 1 17 17 ASP H H 17 8.820 8.820 8.449 0.371 19847
177 1 4 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.318 0.293 19847
178 1 4 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.410 0.305 19847
179 1 4 . 1 1 19 19 TYR H H 19 8.527 8.527 7.469 1.058 19847
180 1 4 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.903 -0.005 19847
181 1 4 . 1 1 20 20 HIS H H 20 9.161 9.161 8.286 0.875 19847
182 1 4 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.701 -0.274 19847
183 1 4 . 1 1 21 21 CYS H H 21 8.928 8.928 9.365 -0.437 19847
184 1 4 . 1 1 22 22 THR HA H 22 4.390 4.390 4.935 -0.545 19847
185 1 4 . 1 1 22 22 THR H H 22 9.120 9.120 9.203 -0.083 19847
186 1 4 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.711 0.390 19847
187 1 4 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.642 -0.642 19847
188 1 4 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.732 -0.772 19847
189 1 4 . 1 1 25 25 LEU H H 25 8.119 8.119 8.579 -0.460 19847
190 1 4 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.707 -0.198 19847
191 1 4 . 1 1 26 26 ILE H H 26 7.504 7.504 7.609 -0.105 19847
192 1 4 . 1 1 27 27 GLY H H 27 7.859 7.859 8.524 -0.665 19847
193 1 4 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.004 -0.096 19847
194 1 4 . 1 1 28 28 ILE H H 28 8.019 8.019 7.867 0.152 19847
195 1 4 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.872 -0.214 19847
196 1 4 . 1 1 29 29 CYS H H 29 8.400 8.400 8.554 -0.154 19847
197 1 5 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.865 -0.189 19847
198 1 5 . 1 1 2 2 ARG H H 2 9.233 9.233 8.657 0.576 19847
199 1 5 . 1 1 3 3 PRO HA H 3 4.474 4.474 4.623 -0.149 19847
200 1 5 . 1 1 4 4 TYR HA H 4 4.689 4.689 3.986 0.703 19847
201 1 5 . 1 1 4 4 TYR H H 4 7.189 7.189 7.308 -0.119 19847
202 1 5 . 1 1 5 5 GLY H H 5 9.269 9.269 8.301 0.968 19847
203 1 5 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.512 -0.118 19847
204 1 5 . 1 1 6 6 TYR H H 6 7.861 7.861 7.754 0.107 19847
205 1 5 . 1 1 7 7 ARG HA H 7 4.677 4.677 4.943 -0.266 19847
206 1 5 . 1 1 7 7 ARG H H 7 8.225 8.225 8.357 -0.132 19847
207 1 5 . 1 1 8 8 CYS HA H 8 4.979 4.979 4.820 0.159 19847
208 1 5 . 1 1 8 8 CYS H H 8 8.570 8.570 8.350 0.220 19847
209 1 5 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.983 -0.067 19847
210 1 5 . 1 1 9 9 ASP H H 9 8.540 8.540 8.595 -0.055 19847
211 1 5 . 1 1 10 10 GLY H H 10 8.269 8.269 8.256 0.013 19847
212 1 5 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.155 -0.073 19847
213 1 5 . 1 1 11 11 VAL H H 11 8.329 8.329 8.230 0.099 19847
214 1 5 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.061 0.093 19847
215 1 5 . 1 1 12 12 ILE H H 12 8.144 8.144 7.977 0.167 19847
216 1 5 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.741 0.092 19847
217 1 5 . 1 1 13 13 ASN H H 13 8.780 8.780 7.772 1.008 19847
218 1 5 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.519 -0.044 19847
219 1 5 . 1 1 14 14 GLN H H 14 8.546 8.546 8.344 0.202 19847
220 1 5 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.927 -0.462 19847
221 1 5 . 1 1 15 15 CYS H H 15 7.691 7.691 8.152 -0.461 19847
222 1 5 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.481 0.098 19847
223 1 5 . 1 1 16 16 CYS H H 16 9.687 9.687 8.517 1.170 19847
224 1 5 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.312 -0.692 19847
225 1 5 . 1 1 17 17 ASP H H 17 8.820 8.820 8.363 0.458 19847
226 1 5 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.345 0.266 19847
227 1 5 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.386 0.329 19847
228 1 5 . 1 1 19 19 TYR H H 19 8.527 8.527 7.480 1.047 19847
229 1 5 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.884 0.014 19847
230 1 5 . 1 1 20 20 HIS H H 20 9.161 9.161 8.274 0.887 19847
231 1 5 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.789 -0.362 19847
232 1 5 . 1 1 21 21 CYS H H 21 8.928 8.928 9.473 -0.545 19847
233 1 5 . 1 1 22 22 THR HA H 22 4.390 4.390 4.922 -0.532 19847
234 1 5 . 1 1 22 22 THR H H 22 9.120 9.120 9.117 0.003 19847
235 1 5 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.760 0.341 19847
236 1 5 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.636 -0.636 19847
237 1 5 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.683 -0.723 19847
238 1 5 . 1 1 25 25 LEU H H 25 8.119 8.119 8.432 -0.313 19847
239 1 5 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.667 -0.158 19847
240 1 5 . 1 1 26 26 ILE H H 26 7.504 7.504 7.657 -0.153 19847
241 1 5 . 1 1 27 27 GLY H H 27 7.859 7.859 8.449 -0.590 19847
242 1 5 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.020 -0.112 19847
243 1 5 . 1 1 28 28 ILE H H 28 8.019 8.019 7.873 0.146 19847
244 1 5 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.763 -0.105 19847
245 1 5 . 1 1 29 29 CYS H H 29 8.400 8.400 8.460 -0.060 19847
246 1 6 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.852 -0.176 19847
247 1 6 . 1 1 2 2 ARG H H 2 9.233 9.233 8.574 0.659 19847
248 1 6 . 1 1 3 3 PRO HA H 3 4.474 4.474 4.392 0.082 19847
249 1 6 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.147 0.542 19847
250 1 6 . 1 1 4 4 TYR H H 4 7.189 7.189 7.518 -0.329 19847
251 1 6 . 1 1 5 5 GLY H H 5 9.269 9.269 8.273 0.996 19847
252 1 6 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.472 -0.078 19847
253 1 6 . 1 1 6 6 TYR H H 6 7.861 7.861 7.327 0.534 19847
254 1 6 . 1 1 7 7 ARG HA H 7 4.677 4.677 5.136 -0.459 19847
255 1 6 . 1 1 7 7 ARG H H 7 8.225 8.225 8.428 -0.203 19847
256 1 6 . 1 1 8 8 CYS HA H 8 4.979 4.979 4.880 0.099 19847
257 1 6 . 1 1 8 8 CYS H H 8 8.570 8.570 8.219 0.351 19847
258 1 6 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.888 0.028 19847
259 1 6 . 1 1 9 9 ASP H H 9 8.540 8.540 8.762 -0.222 19847
260 1 6 . 1 1 10 10 GLY H H 10 8.269 8.269 8.399 -0.130 19847
261 1 6 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.353 -0.271 19847
262 1 6 . 1 1 11 11 VAL H H 11 8.329 8.329 8.086 0.243 19847
263 1 6 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.433 -0.279 19847
264 1 6 . 1 1 12 12 ILE H H 12 8.144 8.144 7.859 0.285 19847
265 1 6 . 1 1 13 13 ASN HA H 13 4.833 4.833 5.029 -0.196 19847
266 1 6 . 1 1 13 13 ASN H H 13 8.780 8.780 8.017 0.763 19847
267 1 6 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.546 -0.071 19847
268 1 6 . 1 1 14 14 GLN H H 14 8.546 8.546 8.500 0.046 19847
269 1 6 . 1 1 15 15 CYS HA H 15 4.465 4.465 5.072 -0.607 19847
270 1 6 . 1 1 15 15 CYS H H 15 7.691 7.691 8.262 -0.571 19847
271 1 6 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.405 0.174 19847
272 1 6 . 1 1 16 16 CYS H H 16 9.687 9.687 8.504 1.183 19847
273 1 6 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.394 -0.774 19847
274 1 6 . 1 1 17 17 ASP H H 17 8.820 8.820 8.193 0.627 19847
275 1 6 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.310 0.301 19847
276 1 6 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.292 0.423 19847
277 1 6 . 1 1 19 19 TYR H H 19 8.527 8.527 7.234 1.293 19847
278 1 6 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.935 -0.037 19847
279 1 6 . 1 1 20 20 HIS H H 20 9.161 9.161 8.104 1.057 19847
280 1 6 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.849 -0.422 19847
281 1 6 . 1 1 21 21 CYS H H 21 8.928 8.928 8.882 0.046 19847
282 1 6 . 1 1 22 22 THR HA H 22 4.390 4.390 4.981 -0.591 19847
283 1 6 . 1 1 22 22 THR H H 22 9.120 9.120 9.210 -0.090 19847
284 1 6 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.724 0.377 19847
285 1 6 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.581 -0.581 19847
286 1 6 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.527 -0.567 19847
287 1 6 . 1 1 25 25 LEU H H 25 8.119 8.119 8.624 -0.505 19847
288 1 6 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.622 -0.113 19847
289 1 6 . 1 1 26 26 ILE H H 26 7.504 7.504 7.633 -0.129 19847
290 1 6 . 1 1 27 27 GLY H H 27 7.859 7.859 8.516 -0.657 19847
291 1 6 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.316 -0.408 19847
292 1 6 . 1 1 28 28 ILE H H 28 8.019 8.019 7.822 0.197 19847
293 1 6 . 1 1 29 29 CYS HA H 29 4.658 4.658 5.286 -0.628 19847
294 1 6 . 1 1 29 29 CYS H H 29 8.400 8.400 8.757 -0.357 19847
295 1 7 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.878 -0.202 19847
296 1 7 . 1 1 2 2 ARG H H 2 9.233 9.233 8.626 0.607 19847
297 1 7 . 1 1 3 3 PRO HA H 3 4.474 4.474 3.918 0.556 19847
298 1 7 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.444 0.245 19847
299 1 7 . 1 1 4 4 TYR H H 4 7.189 7.189 7.391 -0.202 19847
300 1 7 . 1 1 5 5 GLY H H 5 9.269 9.269 8.261 1.008 19847
301 1 7 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.512 -0.118 19847
302 1 7 . 1 1 6 6 TYR H H 6 7.861 7.861 7.796 0.065 19847
303 1 7 . 1 1 7 7 ARG HA H 7 4.677 4.677 5.085 -0.408 19847
304 1 7 . 1 1 7 7 ARG H H 7 8.225 8.225 8.559 -0.334 19847
305 1 7 . 1 1 8 8 CYS HA H 8 4.979 4.979 5.005 -0.026 19847
306 1 7 . 1 1 8 8 CYS H H 8 8.570 8.570 8.365 0.205 19847
307 1 7 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.864 0.052 19847
308 1 7 . 1 1 9 9 ASP H H 9 8.540 8.540 8.726 -0.186 19847
309 1 7 . 1 1 10 10 GLY H H 10 8.269 8.269 8.122 0.147 19847
310 1 7 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.109 -0.027 19847
311 1 7 . 1 1 11 11 VAL H H 11 8.329 8.329 8.257 0.072 19847
312 1 7 . 1 1 12 12 ILE HA H 12 4.154 4.154 3.932 0.222 19847
313 1 7 . 1 1 12 12 ILE H H 12 8.144 8.144 7.876 0.268 19847
314 1 7 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.998 -0.165 19847
315 1 7 . 1 1 13 13 ASN H H 13 8.780 8.780 8.085 0.695 19847
316 1 7 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.379 0.096 19847
317 1 7 . 1 1 14 14 GLN H H 14 8.546 8.546 8.491 0.055 19847
318 1 7 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.795 -0.330 19847
319 1 7 . 1 1 15 15 CYS H H 15 7.691 7.691 8.101 -0.410 19847
320 1 7 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.573 0.006 19847
321 1 7 . 1 1 16 16 CYS H H 16 9.687 9.687 8.566 1.121 19847
322 1 7 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.386 -0.766 19847
323 1 7 . 1 1 17 17 ASP H H 17 8.820 8.820 8.483 0.337 19847
324 1 7 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.359 0.252 19847
325 1 7 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.343 0.372 19847
326 1 7 . 1 1 19 19 TYR H H 19 8.527 8.527 7.243 1.284 19847
327 1 7 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.898 -0.000 19847
328 1 7 . 1 1 20 20 HIS H H 20 9.161 9.161 8.258 0.902 19847
329 1 7 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.836 -0.409 19847
330 1 7 . 1 1 21 21 CYS H H 21 8.928 8.928 9.297 -0.369 19847
331 1 7 . 1 1 22 22 THR HA H 22 4.390 4.390 4.935 -0.545 19847
332 1 7 . 1 1 22 22 THR H H 22 9.120 9.120 9.158 -0.038 19847
333 1 7 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.780 0.321 19847
334 1 7 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.564 -0.564 19847
335 1 7 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.434 -0.474 19847
336 1 7 . 1 1 25 25 LEU H H 25 8.119 8.119 7.635 0.484 19847
337 1 7 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.551 -0.042 19847
338 1 7 . 1 1 26 26 ILE H H 26 7.504 7.504 7.612 -0.108 19847
339 1 7 . 1 1 27 27 GLY H H 27 7.859 7.859 8.396 -0.537 19847
340 1 7 . 1 1 28 28 ILE HA H 28 4.908 4.908 4.959 -0.051 19847
341 1 7 . 1 1 28 28 ILE H H 28 8.019 8.019 7.803 0.216 19847
342 1 7 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.743 -0.085 19847
343 1 7 . 1 1 29 29 CYS H H 29 8.400 8.400 8.548 -0.148 19847
344 1 8 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.887 -0.211 19847
345 1 8 . 1 1 2 2 ARG H H 2 9.233 9.233 8.587 0.646 19847
346 1 8 . 1 1 3 3 PRO HA H 3 4.474 4.474 3.628 0.846 19847
347 1 8 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.094 0.595 19847
348 1 8 . 1 1 4 4 TYR H H 4 7.189 7.189 7.291 -0.102 19847
349 1 8 . 1 1 5 5 GLY H H 5 9.269 9.269 8.369 0.900 19847
350 1 8 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.627 -0.233 19847
351 1 8 . 1 1 6 6 TYR H H 6 7.861 7.861 7.523 0.338 19847
352 1 8 . 1 1 7 7 ARG HA H 7 4.677 4.677 5.123 -0.446 19847
353 1 8 . 1 1 7 7 ARG H H 7 8.225 8.225 8.669 -0.444 19847
354 1 8 . 1 1 8 8 CYS HA H 8 4.979 4.979 4.821 0.158 19847
355 1 8 . 1 1 8 8 CYS H H 8 8.570 8.570 8.185 0.385 19847
356 1 8 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.899 0.017 19847
357 1 8 . 1 1 9 9 ASP H H 9 8.540 8.540 8.821 -0.281 19847
358 1 8 . 1 1 10 10 GLY H H 10 8.269 8.269 7.957 0.312 19847
359 1 8 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.107 -0.025 19847
360 1 8 . 1 1 11 11 VAL H H 11 8.329 8.329 8.293 0.036 19847
361 1 8 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.234 -0.080 19847
362 1 8 . 1 1 12 12 ILE H H 12 8.144 8.144 7.757 0.387 19847
363 1 8 . 1 1 13 13 ASN HA H 13 4.833 4.833 5.037 -0.204 19847
364 1 8 . 1 1 13 13 ASN H H 13 8.780 8.780 8.003 0.777 19847
365 1 8 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.470 0.005 19847
366 1 8 . 1 1 14 14 GLN H H 14 8.546 8.546 8.210 0.336 19847
367 1 8 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.493 -0.028 19847
368 1 8 . 1 1 15 15 CYS H H 15 7.691 7.691 8.491 -0.800 19847
369 1 8 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.561 0.018 19847
370 1 8 . 1 1 16 16 CYS H H 16 9.687 9.687 8.547 1.140 19847
371 1 8 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.294 -0.674 19847
372 1 8 . 1 1 17 17 ASP H H 17 8.820 8.820 8.474 0.346 19847
373 1 8 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.297 0.314 19847
374 1 8 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.277 0.438 19847
375 1 8 . 1 1 19 19 TYR H H 19 8.527 8.527 7.084 1.443 19847
376 1 8 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.901 -0.003 19847
377 1 8 . 1 1 20 20 HIS H H 20 9.161 9.161 8.158 1.003 19847
378 1 8 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.565 -0.138 19847
379 1 8 . 1 1 21 21 CYS H H 21 8.928 8.928 9.193 -0.265 19847
380 1 8 . 1 1 22 22 THR HA H 22 4.390 4.390 4.873 -0.483 19847
381 1 8 . 1 1 22 22 THR H H 22 9.120 9.120 8.677 0.443 19847
382 1 8 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.803 0.298 19847
383 1 8 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.620 -0.620 19847
384 1 8 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.514 -0.554 19847
385 1 8 . 1 1 25 25 LEU H H 25 8.119 8.119 8.508 -0.389 19847
386 1 8 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.585 -0.076 19847
387 1 8 . 1 1 26 26 ILE H H 26 7.504 7.504 7.768 -0.264 19847
388 1 8 . 1 1 27 27 GLY H H 27 7.859 7.859 8.730 -0.871 19847
389 1 8 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.478 -0.570 19847
390 1 8 . 1 1 28 28 ILE H H 28 8.019 8.019 8.074 -0.055 19847
391 1 8 . 1 1 29 29 CYS HA H 29 4.658 4.658 5.091 -0.433 19847
392 1 8 . 1 1 29 29 CYS H H 29 8.400 8.400 8.501 -0.101 19847
393 1 9 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.989 -0.313 19847
394 1 9 . 1 1 2 2 ARG H H 2 9.233 9.233 8.620 0.613 19847
395 1 9 . 1 1 3 3 PRO HA H 3 4.474 4.474 3.826 0.648 19847
396 1 9 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.100 0.589 19847
397 1 9 . 1 1 4 4 TYR H H 4 7.189 7.189 7.332 -0.143 19847
398 1 9 . 1 1 5 5 GLY H H 5 9.269 9.269 8.412 0.857 19847
399 1 9 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.630 -0.236 19847
400 1 9 . 1 1 6 6 TYR H H 6 7.861 7.861 7.562 0.299 19847
401 1 9 . 1 1 7 7 ARG HA H 7 4.677 4.677 5.245 -0.568 19847
402 1 9 . 1 1 7 7 ARG H H 7 8.225 8.225 8.702 -0.477 19847
403 1 9 . 1 1 8 8 CYS HA H 8 4.979 4.979 5.033 -0.054 19847
404 1 9 . 1 1 8 8 CYS H H 8 8.570 8.570 8.701 -0.131 19847
405 1 9 . 1 1 9 9 ASP HA H 9 4.916 4.916 5.006 -0.090 19847
406 1 9 . 1 1 9 9 ASP H H 9 8.540 8.540 8.678 -0.138 19847
407 1 9 . 1 1 10 10 GLY H H 10 8.269 8.269 8.053 0.216 19847
408 1 9 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.245 -0.163 19847
409 1 9 . 1 1 11 11 VAL H H 11 8.329 8.329 8.194 0.135 19847
410 1 9 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.134 0.020 19847
411 1 9 . 1 1 12 12 ILE H H 12 8.144 8.144 8.006 0.138 19847
412 1 9 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.911 -0.078 19847
413 1 9 . 1 1 13 13 ASN H H 13 8.780 8.780 7.953 0.827 19847
414 1 9 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.460 0.016 19847
415 1 9 . 1 1 14 14 GLN H H 14 8.546 8.546 8.428 0.118 19847
416 1 9 . 1 1 15 15 CYS HA H 15 4.465 4.465 5.105 -0.640 19847
417 1 9 . 1 1 15 15 CYS H H 15 7.691 7.691 8.210 -0.519 19847
418 1 9 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.462 0.117 19847
419 1 9 . 1 1 16 16 CYS H H 16 9.687 9.687 8.683 1.004 19847
420 1 9 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.275 -0.655 19847
421 1 9 . 1 1 17 17 ASP H H 17 8.820 8.820 8.102 0.718 19847
422 1 9 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.377 0.234 19847
423 1 9 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.276 0.439 19847
424 1 9 . 1 1 19 19 TYR H H 19 8.527 8.527 7.302 1.225 19847
425 1 9 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.892 0.006 19847
426 1 9 . 1 1 20 20 HIS H H 20 9.161 9.161 8.227 0.934 19847
427 1 9 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.852 -0.425 19847
428 1 9 . 1 1 21 21 CYS H H 21 8.928 8.928 9.112 -0.184 19847
429 1 9 . 1 1 22 22 THR HA H 22 4.390 4.390 4.902 -0.512 19847
430 1 9 . 1 1 22 22 THR H H 22 9.120 9.120 8.816 0.304 19847
431 1 9 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.744 0.357 19847
432 1 9 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.610 -0.610 19847
433 1 9 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.504 -0.544 19847
434 1 9 . 1 1 25 25 LEU H H 25 8.119 8.119 8.455 -0.336 19847
435 1 9 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.875 -0.366 19847
436 1 9 . 1 1 26 26 ILE H H 26 7.504 7.504 7.827 -0.323 19847
437 1 9 . 1 1 27 27 GLY H H 27 7.859 7.859 8.678 -0.819 19847
438 1 9 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.140 -0.232 19847
439 1 9 . 1 1 28 28 ILE H H 28 8.019 8.019 8.031 -0.012 19847
440 1 9 . 1 1 29 29 CYS HA H 29 4.658 4.658 5.209 -0.551 19847
441 1 9 . 1 1 29 29 CYS H H 29 8.400 8.400 8.250 0.150 19847
442 1 10 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.816 -0.140 19847
443 1 10 . 1 1 2 2 ARG H H 2 9.233 9.233 8.522 0.711 19847
444 1 10 . 1 1 3 3 PRO HA H 3 4.474 4.474 3.774 0.700 19847
445 1 10 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.407 0.282 19847
446 1 10 . 1 1 4 4 TYR H H 4 7.189 7.189 7.213 -0.024 19847
447 1 10 . 1 1 5 5 GLY H H 5 9.269 9.269 8.368 0.901 19847
448 1 10 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.530 -0.136 19847
449 1 10 . 1 1 6 6 TYR H H 6 7.861 7.861 7.795 0.066 19847
450 1 10 . 1 1 7 7 ARG HA H 7 4.677 4.677 4.842 -0.165 19847
451 1 10 . 1 1 7 7 ARG H H 7 8.225 8.225 8.552 -0.327 19847
452 1 10 . 1 1 8 8 CYS HA H 8 4.979 4.979 4.870 0.108 19847
453 1 10 . 1 1 8 8 CYS H H 8 8.570 8.570 8.085 0.485 19847
454 1 10 . 1 1 9 9 ASP HA H 9 4.916 4.916 5.118 -0.202 19847
455 1 10 . 1 1 9 9 ASP H H 9 8.540 8.540 8.772 -0.232 19847
456 1 10 . 1 1 10 10 GLY H H 10 8.269 8.269 8.105 0.164 19847
457 1 10 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.072 0.010 19847
458 1 10 . 1 1 11 11 VAL H H 11 8.329 8.329 8.313 0.016 19847
459 1 10 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.299 -0.145 19847
460 1 10 . 1 1 12 12 ILE H H 12 8.144 8.144 7.728 0.416 19847
461 1 10 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.813 0.020 19847
462 1 10 . 1 1 13 13 ASN H H 13 8.780 8.780 8.273 0.507 19847
463 1 10 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.612 -0.137 19847
464 1 10 . 1 1 14 14 GLN H H 14 8.546 8.546 7.832 0.714 19847
465 1 10 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.463 0.002 19847
466 1 10 . 1 1 15 15 CYS H H 15 7.691 7.691 8.581 -0.890 19847
467 1 10 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.364 0.215 19847
468 1 10 . 1 1 16 16 CYS H H 16 9.687 9.687 8.474 1.213 19847
469 1 10 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.342 -0.722 19847
470 1 10 . 1 1 17 17 ASP H H 17 8.820 8.820 8.487 0.333 19847
471 1 10 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.339 0.272 19847
472 1 10 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.335 0.380 19847
473 1 10 . 1 1 19 19 TYR H H 19 8.527 8.527 7.195 1.332 19847
474 1 10 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.912 -0.014 19847
475 1 10 . 1 1 20 20 HIS H H 20 9.161 9.161 8.247 0.914 19847
476 1 10 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.780 -0.353 19847
477 1 10 . 1 1 21 21 CYS H H 21 8.928 8.928 9.369 -0.441 19847
478 1 10 . 1 1 22 22 THR HA H 22 4.390 4.390 4.854 -0.464 19847
479 1 10 . 1 1 22 22 THR H H 22 9.120 9.120 9.080 0.040 19847
480 1 10 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.717 0.384 19847
481 1 10 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.567 -0.567 19847
482 1 10 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.452 -0.492 19847
483 1 10 . 1 1 25 25 LEU H H 25 8.119 8.119 7.705 0.414 19847
484 1 10 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.864 -0.355 19847
485 1 10 . 1 1 26 26 ILE H H 26 7.504 7.504 7.621 -0.117 19847
486 1 10 . 1 1 27 27 GLY H H 27 7.859 7.859 8.452 -0.593 19847
487 1 10 . 1 1 28 28 ILE HA H 28 4.908 4.908 4.977 -0.069 19847
488 1 10 . 1 1 28 28 ILE H H 28 8.019 8.019 7.779 0.240 19847
489 1 10 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.879 -0.221 19847
490 1 10 . 1 1 29 29 CYS H H 29 8.400 8.400 8.699 -0.299 19847
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 0 0.000 0.000 0.000 19847
2 1 1 "Average Difference" HA 31 0.304 0.060 0.303 19847
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19847
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19847
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19847
6 1 1 "Average Difference" HN 24 0.552 -0.253 0.501 19847
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19847
8 1 2 "Average Difference" HA 31 0.335 0.046 0.337 19847
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19847
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19847
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19847
12 1 2 "Average Difference" HN 24 0.583 -0.194 0.561 19847
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19847
14 1 3 "Average Difference" HA 31 0.356 0.090 0.350 19847
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19847
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19847
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19847
18 1 3 "Average Difference" HN 24 0.548 -0.245 0.501 19847
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19847
20 1 4 "Average Difference" HA 31 0.342 0.065 0.342 19847
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19847
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19847
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19847
24 1 4 "Average Difference" HN 24 0.564 -0.157 0.554 19847
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19847
26 1 5 "Average Difference" HA 31 0.346 0.080 0.342 19847
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19847
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19847
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19847
30 1 5 "Average Difference" HN 24 0.537 -0.193 0.512 19847
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19847
32 1 6 "Average Difference" HA 31 0.387 0.107 0.379 19847
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19847
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19847
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19847
36 1 6 "Average Difference" HN 24 0.597 -0.212 0.570 19847
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19847
38 1 7 "Average Difference" HA 31 0.331 0.061 0.331 19847
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19847
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19847
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19847
42 1 7 "Average Difference" HN 24 0.538 -0.214 0.504 19847
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19847
44 1 8 "Average Difference" HA 31 0.387 0.021 0.392 19847
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19847
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19847
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19847
48 1 8 "Average Difference" HN 24 0.617 -0.205 0.595 19847
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19847
50 1 9 "Average Difference" HA 31 0.399 0.082 0.397 19847
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19847
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19847
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19847
54 1 9 "Average Difference" HN 24 0.558 -0.186 0.537 19847
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19847
56 1 10 "Average Difference" HA 31 0.333 0.038 0.337 19847
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19847
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19847
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19847
60 1 10 "Average Difference" HN 24 0.597 -0.231 0.562 19847
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 19847
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ARG HA H 2 4.676 4.676 4.889 -0.213 19847
2 1 . 1 1 2 2 ARG H H 2 9.233 9.233 8.611 0.622 19847
3 1 . 1 1 3 3 PRO HA H 3 4.474 4.474 4.330 0.144 19847
4 1 . 1 1 4 4 TYR HA H 4 4.689 4.689 4.131 0.558 19847
5 1 . 1 1 4 4 TYR H H 4 7.189 7.189 7.337 -0.149 19847
6 1 . 1 1 5 5 GLY H H 5 9.269 9.269 8.323 0.946 19847
7 1 . 1 1 6 6 TYR HA H 6 4.394 4.394 4.539 -0.145 19847
8 1 . 1 1 6 6 TYR H H 6 7.861 7.861 7.613 0.248 19847
9 1 . 1 1 7 7 ARG HA H 7 4.677 4.677 4.975 -0.298 19847
10 1 . 1 1 7 7 ARG H H 7 8.225 8.225 8.495 -0.270 19847
11 1 . 1 1 8 8 CYS HA H 8 4.979 4.979 4.968 0.011 19847
12 1 . 1 1 8 8 CYS H H 8 8.570 8.570 8.305 0.265 19847
13 1 . 1 1 9 9 ASP HA H 9 4.916 4.916 4.918 -0.002 19847
14 1 . 1 1 9 9 ASP H H 9 8.540 8.540 8.715 -0.175 19847
15 1 . 1 1 10 10 GLY H H 10 8.269 8.269 8.149 0.120 19847
16 1 . 1 1 11 11 VAL HA H 11 4.082 4.082 4.185 -0.102 19847
17 1 . 1 1 11 11 VAL H H 11 8.329 8.329 8.242 0.087 19847
18 1 . 1 1 12 12 ILE HA H 12 4.154 4.154 4.121 0.033 19847
19 1 . 1 1 12 12 ILE H H 12 8.144 8.144 7.917 0.227 19847
20 1 . 1 1 13 13 ASN HA H 13 4.833 4.833 4.903 -0.070 19847
21 1 . 1 1 13 13 ASN H H 13 8.780 8.780 7.978 0.802 19847
22 1 . 1 1 14 14 GLN HA H 14 4.475 4.475 4.495 -0.020 19847
23 1 . 1 1 14 14 GLN H H 14 8.546 8.546 8.228 0.318 19847
24 1 . 1 1 15 15 CYS HA H 15 4.465 4.465 4.741 -0.276 19847
25 1 . 1 1 15 15 CYS H H 15 7.691 7.691 8.348 -0.657 19847
26 1 . 1 1 16 16 CYS HA H 16 4.579 4.579 4.465 0.114 19847
27 1 . 1 1 16 16 CYS H H 16 9.687 9.687 8.517 1.170 19847
28 1 . 1 1 17 17 ASP HA H 17 4.620 4.620 5.314 -0.694 19847
29 1 . 1 1 17 17 ASP H H 17 8.820 8.820 8.378 0.442 19847
30 1 . 1 1 18 18 PRO HA H 18 4.611 4.611 4.329 0.282 19847
31 1 . 1 1 19 19 TYR HA H 19 4.715 4.715 4.348 0.367 19847
32 1 . 1 1 19 19 TYR H H 19 8.527 8.527 7.331 1.196 19847
33 1 . 1 1 20 20 HIS HA H 20 4.898 4.898 4.909 -0.011 19847
34 1 . 1 1 20 20 HIS H H 20 9.161 9.161 8.247 0.913 19847
35 1 . 1 1 21 21 CYS HA H 21 4.427 4.427 4.764 -0.336 19847
36 1 . 1 1 21 21 CYS H H 21 8.928 8.928 9.232 -0.304 19847
37 1 . 1 1 22 22 THR HA H 22 4.390 4.390 4.903 -0.513 19847
38 1 . 1 1 22 22 THR H H 22 9.120 9.120 9.069 0.051 19847
39 1 . 1 1 23 23 PRO HA H 23 5.101 5.101 4.744 0.357 19847
40 1 . 1 1 24 24 PRO HA H 24 4.000 4.000 4.597 -0.597 19847
41 1 . 1 1 25 25 LEU HA H 25 3.960 3.960 4.528 -0.568 19847
42 1 . 1 1 25 25 LEU H H 25 8.119 8.119 8.174 -0.055 19847
43 1 . 1 1 26 26 ILE HA H 26 4.509 4.509 4.667 -0.158 19847
44 1 . 1 1 26 26 ILE H H 26 7.504 7.504 7.628 -0.125 19847
45 1 . 1 1 27 27 GLY H H 27 7.859 7.859 8.536 -0.677 19847
46 1 . 1 1 28 28 ILE HA H 28 4.908 4.908 5.139 -0.231 19847
47 1 . 1 1 28 28 ILE H H 28 8.019 8.019 7.881 0.138 19847
48 1 . 1 1 29 29 CYS HA H 29 4.658 4.658 4.947 -0.289 19847
49 1 . 1 1 29 29 CYS H H 29 8.400 8.400 8.520 -0.120 19847
stop_
save_