data_19729
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19729
_Entry.PDB_ID 2MJK
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 19729
_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 VAL HA H 2 4.431 4.431 4.968 -0.537 19729
2 1 1 . 1 1 2 2 VAL H H 2 8.658 8.658 7.980 0.678 19729
3 1 1 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.850 -0.258 19729
4 1 1 . 1 1 3 3 LEU H H 3 8.823 8.823 9.294 -0.471 19729
5 1 1 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.186 -0.197 19729
6 1 1 . 1 1 4 4 LYS H H 4 8.943 8.943 8.759 0.184 19729
7 1 1 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.610 0.039 19729
8 1 1 . 1 1 5 5 TYR H H 5 7.196 7.196 7.045 0.151 19729
9 1 1 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.522 0.522 19729
10 1 1 . 1 1 6 6 CYS H H 6 9.152 9.152 8.757 0.395 19729
11 1 1 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.601 -0.077 19729
12 1 1 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.977 0.166 19729
13 1 1 . 1 1 8 8 LYS H H 8 8.703 8.703 8.630 0.073 19729
14 1 1 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.984 0.357 19729
15 1 1 . 1 1 9 9 ILE H H 9 7.171 7.171 7.951 -0.780 19729
16 1 1 . 1 1 10 10 GLY H H 10 8.237 8.237 7.463 0.774 19729
17 1 1 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.958 -0.191 19729
18 1 1 . 1 1 11 11 TYR H H 11 7.230 7.230 8.043 -0.813 19729
19 1 1 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.391 0.506 19729
20 1 1 . 1 1 12 12 CYS H H 12 8.956 8.956 8.701 0.255 19729
21 1 1 . 1 1 13 13 SER HA H 13 4.692 4.692 4.723 -0.031 19729
22 1 1 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.536 0.221 19729
23 1 1 . 1 1 14 14 ASN H H 14 8.721 8.721 8.819 -0.098 19729
24 1 1 . 1 1 15 15 THR HA H 15 4.111 4.111 3.516 0.595 19729
25 1 1 . 1 1 15 15 THR H H 15 7.640 7.640 7.362 0.278 19729
26 1 1 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.437 0.421 19729
27 1 1 . 1 1 16 16 CYS H H 16 4.379 4.379 6.468 -2.089 19729
28 1 1 . 1 1 17 17 SER HA H 17 4.639 4.639 4.388 0.251 19729
29 1 1 . 1 1 17 17 SER H H 17 8.375 8.375 9.138 -0.763 19729
30 1 1 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.134 0.272 19729
31 1 1 . 1 1 18 18 LYS H H 18 8.794 8.794 8.833 -0.039 19729
32 1 1 . 1 1 19 19 THR HA H 19 4.471 4.471 4.130 0.341 19729
33 1 1 . 1 1 19 19 THR H H 19 8.057 8.057 8.217 -0.160 19729
34 1 1 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.552 0.025 19729
35 1 1 . 1 1 20 20 GLN H H 20 7.264 7.264 7.742 -0.478 19729
36 1 1 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.186 0.081 19729
37 1 1 . 1 1 21 21 ILE H H 21 9.161 9.161 8.126 1.035 19729
38 1 1 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.572 0.322 19729
39 1 1 . 1 1 22 22 TRP H H 22 9.220 9.220 9.027 0.193 19729
40 1 1 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.281 0.576 19729
41 1 1 . 1 1 23 23 ALA H H 23 8.124 8.124 8.315 -0.191 19729
42 1 1 . 1 1 24 24 THR HA H 24 4.686 4.686 4.272 0.414 19729
43 1 1 . 1 1 24 24 THR H H 24 8.577 8.577 8.343 0.234 19729
44 1 1 . 1 1 25 25 SER HA H 25 5.093 5.093 4.854 0.239 19729
45 1 1 . 1 1 25 25 SER H H 25 9.536 9.536 8.383 1.153 19729
46 1 1 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.205 0.292 19729
47 1 1 . 1 1 26 26 HIS H H 26 7.845 7.845 9.141 -1.296 19729
48 1 1 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.778 0.361 19729
49 1 1 . 1 1 28 28 CYS H H 28 7.329 7.329 7.357 -0.028 19729
50 1 1 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.109 -0.048 19729
51 1 1 . 1 1 29 29 LYS H H 29 9.020 9.020 8.507 0.513 19729
52 1 1 . 1 1 30 30 MET HA H 30 4.501 4.501 4.595 -0.094 19729
53 1 1 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.486 0.629 19729
54 1 1 . 1 1 31 31 TYR H H 31 7.863 7.863 8.180 -0.317 19729
55 1 1 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.644 0.236 19729
56 1 1 . 1 1 32 32 CYS H H 32 8.876 8.876 8.680 0.196 19729
57 1 1 . 1 1 33 33 CYS HA H 33 4.890 4.890 4.643 0.247 19729
58 1 1 . 1 1 33 33 CYS H H 33 8.657 8.657 8.926 -0.269 19729
59 1 1 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.454 0.249 19729
60 1 1 . 1 1 34 34 LEU H H 34 8.783 8.783 7.952 0.831 19729
61 1 1 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.334 0.287 19729
62 1 1 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.024 0.148 19729
63 1 1 . 1 1 36 36 ALA H H 36 8.623 8.623 8.773 -0.150 19729
64 1 1 . 1 1 37 37 SER HA H 37 4.281 4.281 4.330 -0.049 19729
65 1 1 . 1 1 37 37 SER H H 37 7.771 7.771 7.933 -0.162 19729
66 1 1 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.454 -0.237 19729
67 1 1 . 1 1 38 38 TRP H H 38 8.073 8.073 7.907 0.166 19729
68 1 1 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.199 -0.140 19729
69 1 1 . 1 1 39 39 LYS H H 39 7.190 7.190 7.846 -0.656 19729
70 1 1 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.417 0.784 19729
71 1 1 . 1 1 40 40 TRP H H 40 7.669 7.669 8.064 -0.395 19729
72 1 2 . 1 1 2 2 VAL HA H 2 4.431 4.431 4.972 -0.541 19729
73 1 2 . 1 1 2 2 VAL H H 2 8.658 8.658 8.026 0.632 19729
74 1 2 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.881 -0.289 19729
75 1 2 . 1 1 3 3 LEU H H 3 8.823 8.823 8.565 0.258 19729
76 1 2 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.423 -0.434 19729
77 1 2 . 1 1 4 4 LYS H H 4 8.943 8.943 8.773 0.170 19729
78 1 2 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.671 -0.022 19729
79 1 2 . 1 1 5 5 TYR H H 5 7.196 7.196 7.175 0.021 19729
80 1 2 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.480 0.564 19729
81 1 2 . 1 1 6 6 CYS H H 6 9.152 9.152 8.600 0.552 19729
82 1 2 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.626 -0.102 19729
83 1 2 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.883 0.260 19729
84 1 2 . 1 1 8 8 LYS H H 8 8.703 8.703 8.570 0.133 19729
85 1 2 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.853 0.488 19729
86 1 2 . 1 1 9 9 ILE H H 9 7.171 7.171 7.638 -0.467 19729
87 1 2 . 1 1 10 10 GLY H H 10 8.237 8.237 7.237 1.000 19729
88 1 2 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.711 0.056 19729
89 1 2 . 1 1 11 11 TYR H H 11 7.230 7.230 8.382 -1.152 19729
90 1 2 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.464 0.433 19729
91 1 2 . 1 1 12 12 CYS H H 12 8.956 8.956 8.477 0.479 19729
92 1 2 . 1 1 13 13 SER HA H 13 4.692 4.692 4.692 -0.000 19729
93 1 2 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.487 0.270 19729
94 1 2 . 1 1 14 14 ASN H H 14 8.721 8.721 8.764 -0.043 19729
95 1 2 . 1 1 15 15 THR HA H 15 4.111 4.111 3.466 0.645 19729
96 1 2 . 1 1 15 15 THR H H 15 7.640 7.640 7.441 0.199 19729
97 1 2 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.137 0.721 19729
98 1 2 . 1 1 16 16 CYS H H 16 4.379 4.379 6.110 -1.731 19729
99 1 2 . 1 1 17 17 SER HA H 17 4.639 4.639 4.317 0.322 19729
100 1 2 . 1 1 17 17 SER H H 17 8.375 8.375 8.471 -0.096 19729
101 1 2 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.179 0.227 19729
102 1 2 . 1 1 18 18 LYS H H 18 8.794 8.794 8.958 -0.164 19729
103 1 2 . 1 1 19 19 THR HA H 19 4.471 4.471 4.179 0.292 19729
104 1 2 . 1 1 19 19 THR H H 19 8.057 8.057 7.953 0.104 19729
105 1 2 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.624 -0.047 19729
106 1 2 . 1 1 20 20 GLN H H 20 7.264 7.264 7.678 -0.414 19729
107 1 2 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.162 0.105 19729
108 1 2 . 1 1 21 21 ILE H H 21 9.161 9.161 8.728 0.433 19729
109 1 2 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.574 0.320 19729
110 1 2 . 1 1 22 22 TRP H H 22 9.220 9.220 8.961 0.259 19729
111 1 2 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.514 0.343 19729
112 1 2 . 1 1 23 23 ALA H H 23 8.124 8.124 8.117 0.007 19729
113 1 2 . 1 1 24 24 THR HA H 24 4.686 4.686 4.255 0.431 19729
114 1 2 . 1 1 24 24 THR H H 24 8.577 8.577 8.371 0.206 19729
115 1 2 . 1 1 25 25 SER HA H 25 5.093 5.093 4.567 0.526 19729
116 1 2 . 1 1 25 25 SER H H 25 9.536 9.536 8.640 0.896 19729
117 1 2 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.502 -0.005 19729
118 1 2 . 1 1 26 26 HIS H H 26 7.845 7.845 9.064 -1.219 19729
119 1 2 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.830 0.309 19729
120 1 2 . 1 1 28 28 CYS H H 28 7.329 7.329 7.575 -0.246 19729
121 1 2 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.075 -0.014 19729
122 1 2 . 1 1 29 29 LYS H H 29 9.020 9.020 8.534 0.486 19729
123 1 2 . 1 1 30 30 MET HA H 30 4.501 4.501 4.612 -0.111 19729
124 1 2 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.433 0.682 19729
125 1 2 . 1 1 31 31 TYR H H 31 7.863 7.863 8.253 -0.390 19729
126 1 2 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.674 0.206 19729
127 1 2 . 1 1 32 32 CYS H H 32 8.876 8.876 8.647 0.229 19729
128 1 2 . 1 1 33 33 CYS HA H 33 4.890 4.890 5.263 -0.373 19729
129 1 2 . 1 1 33 33 CYS H H 33 8.657 8.657 8.920 -0.263 19729
130 1 2 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.636 0.067 19729
131 1 2 . 1 1 34 34 LEU H H 34 8.783 8.783 7.964 0.819 19729
132 1 2 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.398 0.223 19729
133 1 2 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.072 0.100 19729
134 1 2 . 1 1 36 36 ALA H H 36 8.623 8.623 8.406 0.217 19729
135 1 2 . 1 1 37 37 SER HA H 37 4.281 4.281 4.372 -0.091 19729
136 1 2 . 1 1 37 37 SER H H 37 7.771 7.771 7.946 -0.175 19729
137 1 2 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.461 -0.244 19729
138 1 2 . 1 1 38 38 TRP H H 38 8.073 8.073 7.774 0.299 19729
139 1 2 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.074 -0.015 19729
140 1 2 . 1 1 39 39 LYS H H 39 7.190 7.190 8.133 -0.943 19729
141 1 2 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.764 0.438 19729
142 1 2 . 1 1 40 40 TRP H H 40 7.669 7.669 8.258 -0.589 19729
143 1 3 . 1 1 2 2 VAL HA H 2 4.431 4.431 5.222 -0.791 19729
144 1 3 . 1 1 2 2 VAL H H 2 8.658 8.658 8.138 0.520 19729
145 1 3 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.829 -0.237 19729
146 1 3 . 1 1 3 3 LEU H H 3 8.823 8.823 9.139 -0.316 19729
147 1 3 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.138 -0.149 19729
148 1 3 . 1 1 4 4 LYS H H 4 8.943 8.943 8.865 0.078 19729
149 1 3 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.717 -0.068 19729
150 1 3 . 1 1 5 5 TYR H H 5 7.196 7.196 7.042 0.154 19729
151 1 3 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.595 0.449 19729
152 1 3 . 1 1 6 6 CYS H H 6 9.152 9.152 8.892 0.260 19729
153 1 3 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.460 0.064 19729
154 1 3 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.892 0.251 19729
155 1 3 . 1 1 8 8 LYS H H 8 8.703 8.703 8.600 0.103 19729
156 1 3 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.776 0.565 19729
157 1 3 . 1 1 9 9 ILE H H 9 7.171 7.171 7.707 -0.536 19729
158 1 3 . 1 1 10 10 GLY H H 10 8.237 8.237 7.357 0.880 19729
159 1 3 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.809 -0.042 19729
160 1 3 . 1 1 11 11 TYR H H 11 7.230 7.230 7.994 -0.764 19729
161 1 3 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.543 0.354 19729
162 1 3 . 1 1 12 12 CYS H H 12 8.956 8.956 8.891 0.065 19729
163 1 3 . 1 1 13 13 SER HA H 13 4.692 4.692 4.759 -0.067 19729
164 1 3 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.679 0.078 19729
165 1 3 . 1 1 14 14 ASN H H 14 8.721 8.721 8.680 0.041 19729
166 1 3 . 1 1 15 15 THR HA H 15 4.111 4.111 3.743 0.368 19729
167 1 3 . 1 1 15 15 THR H H 15 7.640 7.640 7.265 0.375 19729
168 1 3 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.350 0.508 19729
169 1 3 . 1 1 16 16 CYS H H 16 4.379 4.379 6.296 -1.917 19729
170 1 3 . 1 1 17 17 SER HA H 17 4.639 4.639 4.239 0.400 19729
171 1 3 . 1 1 17 17 SER H H 17 8.375 8.375 8.600 -0.225 19729
172 1 3 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.221 0.185 19729
173 1 3 . 1 1 18 18 LYS H H 18 8.794 8.794 8.780 0.014 19729
174 1 3 . 1 1 19 19 THR HA H 19 4.471 4.471 4.333 0.138 19729
175 1 3 . 1 1 19 19 THR H H 19 8.057 8.057 8.093 -0.036 19729
176 1 3 . 1 1 20 20 GLN HA H 20 4.577 4.577 5.006 -0.429 19729
177 1 3 . 1 1 20 20 GLN H H 20 7.264 7.264 7.327 -0.063 19729
178 1 3 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.229 0.038 19729
179 1 3 . 1 1 21 21 ILE H H 21 9.161 9.161 8.755 0.406 19729
180 1 3 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.588 0.306 19729
181 1 3 . 1 1 22 22 TRP H H 22 9.220 9.220 8.942 0.278 19729
182 1 3 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.320 0.537 19729
183 1 3 . 1 1 23 23 ALA H H 23 8.124 8.124 8.011 0.113 19729
184 1 3 . 1 1 24 24 THR HA H 24 4.686 4.686 4.396 0.290 19729
185 1 3 . 1 1 24 24 THR H H 24 8.577 8.577 8.392 0.185 19729
186 1 3 . 1 1 25 25 SER HA H 25 5.093 5.093 5.028 0.065 19729
187 1 3 . 1 1 25 25 SER H H 25 9.536 9.536 8.545 0.991 19729
188 1 3 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.294 0.203 19729
189 1 3 . 1 1 26 26 HIS H H 26 7.845 7.845 9.133 -1.288 19729
190 1 3 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.555 0.584 19729
191 1 3 . 1 1 28 28 CYS H H 28 7.329 7.329 7.152 0.176 19729
192 1 3 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.033 0.028 19729
193 1 3 . 1 1 29 29 LYS H H 29 9.020 9.020 8.393 0.627 19729
194 1 3 . 1 1 30 30 MET HA H 30 4.501 4.501 4.333 0.168 19729
195 1 3 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.628 0.487 19729
196 1 3 . 1 1 31 31 TYR H H 31 7.863 7.863 8.163 -0.300 19729
197 1 3 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.816 0.064 19729
198 1 3 . 1 1 32 32 CYS H H 32 8.876 8.876 8.867 0.009 19729
199 1 3 . 1 1 33 33 CYS HA H 33 4.890 4.890 4.882 0.008 19729
200 1 3 . 1 1 33 33 CYS H H 33 8.657 8.657 8.725 -0.068 19729
201 1 3 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.693 0.010 19729
202 1 3 . 1 1 34 34 LEU H H 34 8.783 8.783 8.017 0.766 19729
203 1 3 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.624 -0.003 19729
204 1 3 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.052 0.120 19729
205 1 3 . 1 1 36 36 ALA H H 36 8.623 8.623 8.117 0.506 19729
206 1 3 . 1 1 37 37 SER HA H 37 4.281 4.281 4.332 -0.051 19729
207 1 3 . 1 1 37 37 SER H H 37 7.771 7.771 8.009 -0.238 19729
208 1 3 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.451 -0.234 19729
209 1 3 . 1 1 38 38 TRP H H 38 8.073 8.073 7.712 0.361 19729
210 1 3 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.117 -0.058 19729
211 1 3 . 1 1 39 39 LYS H H 39 7.190 7.190 7.979 -0.789 19729
212 1 3 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.633 0.569 19729
213 1 3 . 1 1 40 40 TRP H H 40 7.669 7.669 8.082 -0.413 19729
214 1 4 . 1 1 2 2 VAL HA H 2 4.431 4.431 4.681 -0.250 19729
215 1 4 . 1 1 2 2 VAL H H 2 8.658 8.658 8.061 0.597 19729
216 1 4 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.919 -0.327 19729
217 1 4 . 1 1 3 3 LEU H H 3 8.823 8.823 8.896 -0.073 19729
218 1 4 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.127 -0.138 19729
219 1 4 . 1 1 4 4 LYS H H 4 8.943 8.943 8.656 0.287 19729
220 1 4 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.668 -0.019 19729
221 1 4 . 1 1 5 5 TYR H H 5 7.196 7.196 6.869 0.327 19729
222 1 4 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.632 0.412 19729
223 1 4 . 1 1 6 6 CYS H H 6 9.152 9.152 8.715 0.437 19729
224 1 4 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.506 0.018 19729
225 1 4 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.908 0.235 19729
226 1 4 . 1 1 8 8 LYS H H 8 8.703 8.703 8.602 0.101 19729
227 1 4 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.848 0.493 19729
228 1 4 . 1 1 9 9 ILE H H 9 7.171 7.171 7.656 -0.485 19729
229 1 4 . 1 1 10 10 GLY H H 10 8.237 8.237 7.350 0.887 19729
230 1 4 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.851 -0.084 19729
231 1 4 . 1 1 11 11 TYR H H 11 7.230 7.230 7.884 -0.654 19729
232 1 4 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.308 0.589 19729
233 1 4 . 1 1 12 12 CYS H H 12 8.956 8.956 8.721 0.235 19729
234 1 4 . 1 1 13 13 SER HA H 13 4.692 4.692 4.742 -0.050 19729
235 1 4 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.516 0.241 19729
236 1 4 . 1 1 14 14 ASN H H 14 8.721 8.721 8.738 -0.017 19729
237 1 4 . 1 1 15 15 THR HA H 15 4.111 4.111 3.446 0.665 19729
238 1 4 . 1 1 15 15 THR H H 15 7.640 7.640 7.272 0.368 19729
239 1 4 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.230 0.628 19729
240 1 4 . 1 1 16 16 CYS H H 16 4.379 4.379 5.929 -1.550 19729
241 1 4 . 1 1 17 17 SER HA H 17 4.639 4.639 4.328 0.311 19729
242 1 4 . 1 1 17 17 SER H H 17 8.375 8.375 8.403 -0.028 19729
243 1 4 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.159 0.247 19729
244 1 4 . 1 1 18 18 LYS H H 18 8.794 8.794 8.793 0.001 19729
245 1 4 . 1 1 19 19 THR HA H 19 4.471 4.471 4.311 0.160 19729
246 1 4 . 1 1 19 19 THR H H 19 8.057 8.057 8.075 -0.018 19729
247 1 4 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.903 -0.326 19729
248 1 4 . 1 1 20 20 GLN H H 20 7.264 7.264 7.315 -0.051 19729
249 1 4 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.243 0.024 19729
250 1 4 . 1 1 21 21 ILE H H 21 9.161 9.161 8.818 0.343 19729
251 1 4 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.633 0.261 19729
252 1 4 . 1 1 22 22 TRP H H 22 9.220 9.220 9.069 0.151 19729
253 1 4 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.369 0.488 19729
254 1 4 . 1 1 23 23 ALA H H 23 8.124 8.124 8.217 -0.093 19729
255 1 4 . 1 1 24 24 THR HA H 24 4.686 4.686 4.391 0.295 19729
256 1 4 . 1 1 24 24 THR H H 24 8.577 8.577 8.444 0.133 19729
257 1 4 . 1 1 25 25 SER HA H 25 5.093 5.093 4.963 0.130 19729
258 1 4 . 1 1 25 25 SER H H 25 9.536 9.536 8.721 0.815 19729
259 1 4 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.507 -0.010 19729
260 1 4 . 1 1 26 26 HIS H H 26 7.845 7.845 9.114 -1.269 19729
261 1 4 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.855 0.284 19729
262 1 4 . 1 1 28 28 CYS H H 28 7.329 7.329 7.677 -0.348 19729
263 1 4 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.038 0.023 19729
264 1 4 . 1 1 29 29 LYS H H 29 9.020 9.020 8.460 0.560 19729
265 1 4 . 1 1 30 30 MET HA H 30 4.501 4.501 4.367 0.134 19729
266 1 4 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.440 0.675 19729
267 1 4 . 1 1 31 31 TYR H H 31 7.863 7.863 8.244 -0.381 19729
268 1 4 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.701 0.179 19729
269 1 4 . 1 1 32 32 CYS H H 32 8.876 8.876 8.988 -0.112 19729
270 1 4 . 1 1 33 33 CYS HA H 33 4.890 4.890 5.505 -0.615 19729
271 1 4 . 1 1 33 33 CYS H H 33 8.657 8.657 8.847 -0.190 19729
272 1 4 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.534 0.169 19729
273 1 4 . 1 1 34 34 LEU H H 34 8.783 8.783 8.070 0.713 19729
274 1 4 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.477 0.144 19729
275 1 4 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.097 0.075 19729
276 1 4 . 1 1 36 36 ALA H H 36 8.623 8.623 8.256 0.367 19729
277 1 4 . 1 1 37 37 SER HA H 37 4.281 4.281 4.360 -0.079 19729
278 1 4 . 1 1 37 37 SER H H 37 7.771 7.771 8.177 -0.406 19729
279 1 4 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.424 -0.207 19729
280 1 4 . 1 1 38 38 TRP H H 38 8.073 8.073 7.845 0.228 19729
281 1 4 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.185 -0.126 19729
282 1 4 . 1 1 39 39 LYS H H 39 7.190 7.190 7.990 -0.800 19729
283 1 4 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.886 0.316 19729
284 1 4 . 1 1 40 40 TRP H H 40 7.669 7.669 8.460 -0.791 19729
285 1 5 . 1 1 2 2 VAL HA H 2 4.431 4.431 4.895 -0.464 19729
286 1 5 . 1 1 2 2 VAL H H 2 8.658 8.658 7.968 0.690 19729
287 1 5 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.842 -0.250 19729
288 1 5 . 1 1 3 3 LEU H H 3 8.823 8.823 9.207 -0.384 19729
289 1 5 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.239 -0.250 19729
290 1 5 . 1 1 4 4 LYS H H 4 8.943 8.943 8.884 0.059 19729
291 1 5 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.626 0.023 19729
292 1 5 . 1 1 5 5 TYR H H 5 7.196 7.196 7.160 0.036 19729
293 1 5 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.584 0.460 19729
294 1 5 . 1 1 6 6 CYS H H 6 9.152 9.152 8.779 0.373 19729
295 1 5 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.570 -0.046 19729
296 1 5 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.869 0.274 19729
297 1 5 . 1 1 8 8 LYS H H 8 8.703 8.703 8.566 0.137 19729
298 1 5 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.726 0.615 19729
299 1 5 . 1 1 9 9 ILE H H 9 7.171 7.171 7.741 -0.570 19729
300 1 5 . 1 1 10 10 GLY H H 10 8.237 8.237 7.349 0.888 19729
301 1 5 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.578 0.189 19729
302 1 5 . 1 1 11 11 TYR H H 11 7.230 7.230 8.770 -1.540 19729
303 1 5 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.314 0.583 19729
304 1 5 . 1 1 12 12 CYS H H 12 8.956 8.956 8.711 0.245 19729
305 1 5 . 1 1 13 13 SER HA H 13 4.692 4.692 4.702 -0.010 19729
306 1 5 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.577 0.180 19729
307 1 5 . 1 1 14 14 ASN H H 14 8.721 8.721 8.784 -0.063 19729
308 1 5 . 1 1 15 15 THR HA H 15 4.111 4.111 3.386 0.725 19729
309 1 5 . 1 1 15 15 THR H H 15 7.640 7.640 7.508 0.132 19729
310 1 5 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.543 0.315 19729
311 1 5 . 1 1 16 16 CYS H H 16 4.379 4.379 6.758 -2.379 19729
312 1 5 . 1 1 17 17 SER HA H 17 4.639 4.639 4.380 0.259 19729
313 1 5 . 1 1 17 17 SER H H 17 8.375 8.375 8.423 -0.048 19729
314 1 5 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.094 0.312 19729
315 1 5 . 1 1 18 18 LYS H H 18 8.794 8.794 8.839 -0.045 19729
316 1 5 . 1 1 19 19 THR HA H 19 4.471 4.471 4.103 0.368 19729
317 1 5 . 1 1 19 19 THR H H 19 8.057 8.057 7.794 0.263 19729
318 1 5 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.516 0.061 19729
319 1 5 . 1 1 20 20 GLN H H 20 7.264 7.264 7.708 -0.444 19729
320 1 5 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.116 0.151 19729
321 1 5 . 1 1 21 21 ILE H H 21 9.161 9.161 8.727 0.433 19729
322 1 5 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.660 0.234 19729
323 1 5 . 1 1 22 22 TRP H H 22 9.220 9.220 8.786 0.434 19729
324 1 5 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.503 0.354 19729
325 1 5 . 1 1 23 23 ALA H H 23 8.124 8.124 8.274 -0.150 19729
326 1 5 . 1 1 24 24 THR HA H 24 4.686 4.686 4.333 0.353 19729
327 1 5 . 1 1 24 24 THR H H 24 8.577 8.577 8.207 0.370 19729
328 1 5 . 1 1 25 25 SER HA H 25 5.093 5.093 4.961 0.132 19729
329 1 5 . 1 1 25 25 SER H H 25 9.536 9.536 8.722 0.814 19729
330 1 5 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.444 0.053 19729
331 1 5 . 1 1 26 26 HIS H H 26 7.845 7.845 9.227 -1.382 19729
332 1 5 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.648 0.491 19729
333 1 5 . 1 1 28 28 CYS H H 28 7.329 7.329 8.052 -0.723 19729
334 1 5 . 1 1 29 29 LYS HA H 29 4.061 4.061 3.986 0.075 19729
335 1 5 . 1 1 29 29 LYS H H 29 9.020 9.020 8.643 0.377 19729
336 1 5 . 1 1 30 30 MET HA H 30 4.501 4.501 4.416 0.085 19729
337 1 5 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.504 0.611 19729
338 1 5 . 1 1 31 31 TYR H H 31 7.863 7.863 8.219 -0.356 19729
339 1 5 . 1 1 32 32 CYS HA H 32 4.880 4.880 5.204 -0.324 19729
340 1 5 . 1 1 32 32 CYS H H 32 8.876 8.876 8.384 0.492 19729
341 1 5 . 1 1 33 33 CYS HA H 33 4.890 4.890 5.385 -0.495 19729
342 1 5 . 1 1 33 33 CYS H H 33 8.657 8.657 8.600 0.057 19729
343 1 5 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.831 -0.128 19729
344 1 5 . 1 1 34 34 LEU H H 34 8.783 8.783 7.987 0.796 19729
345 1 5 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.342 0.279 19729
346 1 5 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.066 0.106 19729
347 1 5 . 1 1 36 36 ALA H H 36 8.623 8.623 8.243 0.380 19729
348 1 5 . 1 1 37 37 SER HA H 37 4.281 4.281 4.361 -0.080 19729
349 1 5 . 1 1 37 37 SER H H 37 7.771 7.771 7.916 -0.145 19729
350 1 5 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.454 -0.237 19729
351 1 5 . 1 1 38 38 TRP H H 38 8.073 8.073 7.808 0.265 19729
352 1 5 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.142 -0.083 19729
353 1 5 . 1 1 39 39 LYS H H 39 7.190 7.190 7.958 -0.768 19729
354 1 5 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.595 0.607 19729
355 1 5 . 1 1 40 40 TRP H H 40 7.669 7.669 8.085 -0.416 19729
356 1 6 . 1 1 2 2 VAL HA H 2 4.431 4.431 4.718 -0.287 19729
357 1 6 . 1 1 2 2 VAL H H 2 8.658 8.658 7.913 0.745 19729
358 1 6 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.817 -0.225 19729
359 1 6 . 1 1 3 3 LEU H H 3 8.823 8.823 8.827 -0.004 19729
360 1 6 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.183 -0.194 19729
361 1 6 . 1 1 4 4 LYS H H 4 8.943 8.943 8.580 0.363 19729
362 1 6 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.681 -0.032 19729
363 1 6 . 1 1 5 5 TYR H H 5 7.196 7.196 7.053 0.143 19729
364 1 6 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.537 0.507 19729
365 1 6 . 1 1 6 6 CYS H H 6 9.152 9.152 8.718 0.434 19729
366 1 6 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.485 0.039 19729
367 1 6 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.836 0.307 19729
368 1 6 . 1 1 8 8 LYS H H 8 8.703 8.703 8.599 0.104 19729
369 1 6 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.776 0.565 19729
370 1 6 . 1 1 9 9 ILE H H 9 7.171 7.171 7.648 -0.477 19729
371 1 6 . 1 1 10 10 GLY H H 10 8.237 8.237 7.358 0.879 19729
372 1 6 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.730 0.037 19729
373 1 6 . 1 1 11 11 TYR H H 11 7.230 7.230 8.377 -1.147 19729
374 1 6 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.646 0.251 19729
375 1 6 . 1 1 12 12 CYS H H 12 8.956 8.956 8.769 0.187 19729
376 1 6 . 1 1 13 13 SER HA H 13 4.692 4.692 4.732 -0.040 19729
377 1 6 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.496 0.261 19729
378 1 6 . 1 1 14 14 ASN H H 14 8.721 8.721 8.746 -0.025 19729
379 1 6 . 1 1 15 15 THR HA H 15 4.111 4.111 3.999 0.112 19729
380 1 6 . 1 1 15 15 THR H H 15 7.640 7.640 7.380 0.260 19729
381 1 6 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.170 0.688 19729
382 1 6 . 1 1 16 16 CYS H H 16 4.379 4.379 6.808 -2.429 19729
383 1 6 . 1 1 17 17 SER HA H 17 4.639 4.639 4.252 0.387 19729
384 1 6 . 1 1 17 17 SER H H 17 8.375 8.375 8.140 0.235 19729
385 1 6 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.316 0.090 19729
386 1 6 . 1 1 18 18 LYS H H 18 8.794 8.794 8.817 -0.023 19729
387 1 6 . 1 1 19 19 THR HA H 19 4.471 4.471 4.347 0.124 19729
388 1 6 . 1 1 19 19 THR H H 19 8.057 8.057 8.117 -0.060 19729
389 1 6 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.713 -0.136 19729
390 1 6 . 1 1 20 20 GLN H H 20 7.264 7.264 7.814 -0.550 19729
391 1 6 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.312 -0.045 19729
392 1 6 . 1 1 21 21 ILE H H 21 9.161 9.161 8.776 0.385 19729
393 1 6 . 1 1 22 22 TRP HA H 22 4.894 4.894 5.215 -0.321 19729
394 1 6 . 1 1 22 22 TRP H H 22 9.220 9.220 8.529 0.691 19729
395 1 6 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.723 0.134 19729
396 1 6 . 1 1 23 23 ALA H H 23 8.124 8.124 8.792 -0.668 19729
397 1 6 . 1 1 24 24 THR HA H 24 4.686 4.686 4.351 0.335 19729
398 1 6 . 1 1 24 24 THR H H 24 8.577 8.577 8.713 -0.136 19729
399 1 6 . 1 1 25 25 SER HA H 25 5.093 5.093 4.978 0.115 19729
400 1 6 . 1 1 25 25 SER H H 25 9.536 9.536 8.660 0.876 19729
401 1 6 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.132 0.365 19729
402 1 6 . 1 1 26 26 HIS H H 26 7.845 7.845 9.147 -1.302 19729
403 1 6 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.665 0.474 19729
404 1 6 . 1 1 28 28 CYS H H 28 7.329 7.329 7.694 -0.365 19729
405 1 6 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.028 0.033 19729
406 1 6 . 1 1 29 29 LYS H H 29 9.020 9.020 8.430 0.590 19729
407 1 6 . 1 1 30 30 MET HA H 30 4.501 4.501 4.380 0.121 19729
408 1 6 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.756 0.359 19729
409 1 6 . 1 1 31 31 TYR H H 31 7.863 7.863 8.213 -0.350 19729
410 1 6 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.851 0.029 19729
411 1 6 . 1 1 32 32 CYS H H 32 8.876 8.876 8.994 -0.118 19729
412 1 6 . 1 1 33 33 CYS HA H 33 4.890 4.890 5.335 -0.446 19729
413 1 6 . 1 1 33 33 CYS H H 33 8.657 8.657 8.938 -0.281 19729
414 1 6 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.681 0.022 19729
415 1 6 . 1 1 34 34 LEU H H 34 8.783 8.783 8.320 0.463 19729
416 1 6 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.424 0.197 19729
417 1 6 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.118 0.054 19729
418 1 6 . 1 1 36 36 ALA H H 36 8.623 8.623 8.422 0.201 19729
419 1 6 . 1 1 37 37 SER HA H 37 4.281 4.281 4.355 -0.074 19729
420 1 6 . 1 1 37 37 SER H H 37 7.771 7.771 8.230 -0.459 19729
421 1 6 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.455 -0.238 19729
422 1 6 . 1 1 38 38 TRP H H 38 8.073 8.073 7.863 0.210 19729
423 1 6 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.157 -0.098 19729
424 1 6 . 1 1 39 39 LYS H H 39 7.190 7.190 8.082 -0.892 19729
425 1 6 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.528 0.674 19729
426 1 6 . 1 1 40 40 TRP H H 40 7.669 7.669 7.601 0.068 19729
427 1 7 . 1 1 2 2 VAL HA H 2 4.431 4.431 5.246 -0.815 19729
428 1 7 . 1 1 2 2 VAL H H 2 8.658 8.658 8.475 0.183 19729
429 1 7 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.896 -0.304 19729
430 1 7 . 1 1 3 3 LEU H H 3 8.823 8.823 8.862 -0.039 19729
431 1 7 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.183 -0.194 19729
432 1 7 . 1 1 4 4 LYS H H 4 8.943 8.943 8.946 -0.003 19729
433 1 7 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.756 -0.107 19729
434 1 7 . 1 1 5 5 TYR H H 5 7.196 7.196 7.177 0.019 19729
435 1 7 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.605 0.439 19729
436 1 7 . 1 1 6 6 CYS H H 6 9.152 9.152 8.666 0.486 19729
437 1 7 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.664 -0.140 19729
438 1 7 . 1 1 8 8 LYS HA H 8 4.143 4.143 4.027 0.116 19729
439 1 7 . 1 1 8 8 LYS H H 8 8.703 8.703 8.738 -0.035 19729
440 1 7 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.990 0.351 19729
441 1 7 . 1 1 9 9 ILE H H 9 7.171 7.171 7.719 -0.548 19729
442 1 7 . 1 1 10 10 GLY H H 10 8.237 8.237 7.670 0.567 19729
443 1 7 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.807 -0.040 19729
444 1 7 . 1 1 11 11 TYR H H 11 7.230 7.230 7.597 -0.367 19729
445 1 7 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.364 0.533 19729
446 1 7 . 1 1 12 12 CYS H H 12 8.956 8.956 8.721 0.235 19729
447 1 7 . 1 1 13 13 SER HA H 13 4.692 4.692 4.791 -0.099 19729
448 1 7 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.486 0.271 19729
449 1 7 . 1 1 14 14 ASN H H 14 8.721 8.721 8.757 -0.036 19729
450 1 7 . 1 1 15 15 THR HA H 15 4.111 4.111 3.587 0.524 19729
451 1 7 . 1 1 15 15 THR H H 15 7.640 7.640 7.324 0.316 19729
452 1 7 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.356 0.502 19729
453 1 7 . 1 1 16 16 CYS H H 16 4.379 4.379 6.434 -2.055 19729
454 1 7 . 1 1 17 17 SER HA H 17 4.639 4.639 4.381 0.258 19729
455 1 7 . 1 1 17 17 SER H H 17 8.375 8.375 8.650 -0.275 19729
456 1 7 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.207 0.199 19729
457 1 7 . 1 1 18 18 LYS H H 18 8.794 8.794 8.865 -0.071 19729
458 1 7 . 1 1 19 19 THR HA H 19 4.471 4.471 4.090 0.381 19729
459 1 7 . 1 1 19 19 THR H H 19 8.057 8.057 7.994 0.063 19729
460 1 7 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.897 -0.320 19729
461 1 7 . 1 1 20 20 GLN H H 20 7.264 7.264 7.752 -0.488 19729
462 1 7 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.147 0.120 19729
463 1 7 . 1 1 21 21 ILE H H 21 9.161 9.161 8.793 0.368 19729
464 1 7 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.565 0.329 19729
465 1 7 . 1 1 22 22 TRP H H 22 9.220 9.220 8.864 0.356 19729
466 1 7 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.233 0.624 19729
467 1 7 . 1 1 23 23 ALA H H 23 8.124 8.124 8.207 -0.083 19729
468 1 7 . 1 1 24 24 THR HA H 24 4.686 4.686 4.381 0.305 19729
469 1 7 . 1 1 24 24 THR H H 24 8.577 8.577 8.187 0.390 19729
470 1 7 . 1 1 25 25 SER HA H 25 5.093 5.093 5.085 0.008 19729
471 1 7 . 1 1 25 25 SER H H 25 9.536 9.536 8.364 1.172 19729
472 1 7 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.231 0.266 19729
473 1 7 . 1 1 26 26 HIS H H 26 7.845 7.845 9.157 -1.312 19729
474 1 7 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.558 0.581 19729
475 1 7 . 1 1 28 28 CYS H H 28 7.329 7.329 7.639 -0.310 19729
476 1 7 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.088 -0.027 19729
477 1 7 . 1 1 29 29 LYS H H 29 9.020 9.020 8.568 0.452 19729
478 1 7 . 1 1 30 30 MET HA H 30 4.501 4.501 4.353 0.148 19729
479 1 7 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.540 0.575 19729
480 1 7 . 1 1 31 31 TYR H H 31 7.863 7.863 7.957 -0.094 19729
481 1 7 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.789 0.091 19729
482 1 7 . 1 1 32 32 CYS H H 32 8.876 8.876 8.446 0.430 19729
483 1 7 . 1 1 33 33 CYS HA H 33 4.890 4.890 4.698 0.192 19729
484 1 7 . 1 1 33 33 CYS H H 33 8.657 8.657 8.588 0.069 19729
485 1 7 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.538 0.165 19729
486 1 7 . 1 1 34 34 LEU H H 34 8.783 8.783 7.888 0.895 19729
487 1 7 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.297 0.324 19729
488 1 7 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.068 0.104 19729
489 1 7 . 1 1 36 36 ALA H H 36 8.623 8.623 8.625 -0.002 19729
490 1 7 . 1 1 37 37 SER HA H 37 4.281 4.281 4.357 -0.076 19729
491 1 7 . 1 1 37 37 SER H H 37 7.771 7.771 8.037 -0.266 19729
492 1 7 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.408 -0.191 19729
493 1 7 . 1 1 38 38 TRP H H 38 8.073 8.073 7.873 0.200 19729
494 1 7 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.082 -0.023 19729
495 1 7 . 1 1 39 39 LYS H H 39 7.190 7.190 8.002 -0.812 19729
496 1 7 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.313 0.889 19729
497 1 7 . 1 1 40 40 TRP H H 40 7.669 7.669 7.917 -0.248 19729
498 1 8 . 1 1 2 2 VAL HA H 2 4.431 4.431 4.648 -0.217 19729
499 1 8 . 1 1 2 2 VAL H H 2 8.658 8.658 7.881 0.777 19729
500 1 8 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.749 -0.157 19729
501 1 8 . 1 1 3 3 LEU H H 3 8.823 8.823 9.215 -0.392 19729
502 1 8 . 1 1 4 4 LYS HA H 4 3.989 3.989 3.967 0.022 19729
503 1 8 . 1 1 4 4 LYS H H 4 8.943 8.943 8.755 0.188 19729
504 1 8 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.651 -0.002 19729
505 1 8 . 1 1 5 5 TYR H H 5 7.196 7.196 6.987 0.209 19729
506 1 8 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.559 0.485 19729
507 1 8 . 1 1 6 6 CYS H H 6 9.152 9.152 8.744 0.408 19729
508 1 8 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.541 -0.017 19729
509 1 8 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.886 0.257 19729
510 1 8 . 1 1 8 8 LYS H H 8 8.703 8.703 8.677 0.026 19729
511 1 8 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.847 0.494 19729
512 1 8 . 1 1 9 9 ILE H H 9 7.171 7.171 7.765 -0.594 19729
513 1 8 . 1 1 10 10 GLY H H 10 8.237 8.237 7.549 0.688 19729
514 1 8 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.687 0.080 19729
515 1 8 . 1 1 11 11 TYR H H 11 7.230 7.230 8.037 -0.807 19729
516 1 8 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.574 0.323 19729
517 1 8 . 1 1 12 12 CYS H H 12 8.956 8.956 8.703 0.253 19729
518 1 8 . 1 1 13 13 SER HA H 13 4.692 4.692 4.731 -0.039 19729
519 1 8 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.675 0.082 19729
520 1 8 . 1 1 14 14 ASN H H 14 8.721 8.721 8.847 -0.126 19729
521 1 8 . 1 1 15 15 THR HA H 15 4.111 4.111 3.352 0.759 19729
522 1 8 . 1 1 15 15 THR H H 15 7.640 7.640 7.498 0.142 19729
523 1 8 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.479 0.379 19729
524 1 8 . 1 1 16 16 CYS H H 16 4.379 4.379 7.490 -3.111 19729
525 1 8 . 1 1 17 17 SER HA H 17 4.639 4.639 4.347 0.292 19729
526 1 8 . 1 1 17 17 SER H H 17 8.375 8.375 8.845 -0.470 19729
527 1 8 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.043 0.363 19729
528 1 8 . 1 1 18 18 LYS H H 18 8.794 8.794 8.813 -0.019 19729
529 1 8 . 1 1 19 19 THR HA H 19 4.471 4.471 4.016 0.455 19729
530 1 8 . 1 1 19 19 THR H H 19 8.057 8.057 7.872 0.185 19729
531 1 8 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.622 -0.045 19729
532 1 8 . 1 1 20 20 GLN H H 20 7.264 7.264 7.698 -0.434 19729
533 1 8 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.142 0.125 19729
534 1 8 . 1 1 21 21 ILE H H 21 9.161 9.161 8.637 0.524 19729
535 1 8 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.541 0.353 19729
536 1 8 . 1 1 22 22 TRP H H 22 9.220 9.220 8.850 0.370 19729
537 1 8 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.200 0.657 19729
538 1 8 . 1 1 23 23 ALA H H 23 8.124 8.124 7.914 0.210 19729
539 1 8 . 1 1 24 24 THR HA H 24 4.686 4.686 4.318 0.368 19729
540 1 8 . 1 1 24 24 THR H H 24 8.577 8.577 8.158 0.419 19729
541 1 8 . 1 1 25 25 SER HA H 25 5.093 5.093 5.078 0.015 19729
542 1 8 . 1 1 25 25 SER H H 25 9.536 9.536 8.610 0.926 19729
543 1 8 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.311 0.186 19729
544 1 8 . 1 1 26 26 HIS H H 26 7.845 7.845 8.703 -0.858 19729
545 1 8 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.607 0.532 19729
546 1 8 . 1 1 28 28 CYS H H 28 7.329 7.329 7.635 -0.306 19729
547 1 8 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.015 0.046 19729
548 1 8 . 1 1 29 29 LYS H H 29 9.020 9.020 8.647 0.373 19729
549 1 8 . 1 1 30 30 MET HA H 30 4.501 4.501 4.618 -0.117 19729
550 1 8 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.506 0.609 19729
551 1 8 . 1 1 31 31 TYR H H 31 7.863 7.863 8.044 -0.181 19729
552 1 8 . 1 1 32 32 CYS HA H 32 4.880 4.880 5.167 -0.287 19729
553 1 8 . 1 1 32 32 CYS H H 32 8.876 8.876 8.919 -0.043 19729
554 1 8 . 1 1 33 33 CYS HA H 33 4.890 4.890 5.369 -0.479 19729
555 1 8 . 1 1 33 33 CYS H H 33 8.657 8.657 9.150 -0.493 19729
556 1 8 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.686 0.017 19729
557 1 8 . 1 1 34 34 LEU H H 34 8.783 8.783 7.882 0.901 19729
558 1 8 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.275 0.346 19729
559 1 8 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.204 -0.032 19729
560 1 8 . 1 1 36 36 ALA H H 36 8.623 8.623 8.596 0.027 19729
561 1 8 . 1 1 37 37 SER HA H 37 4.281 4.281 4.367 -0.086 19729
562 1 8 . 1 1 37 37 SER H H 37 7.771 7.771 8.013 -0.242 19729
563 1 8 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.430 -0.213 19729
564 1 8 . 1 1 38 38 TRP H H 38 8.073 8.073 7.845 0.228 19729
565 1 8 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.263 -0.204 19729
566 1 8 . 1 1 39 39 LYS H H 39 7.190 7.190 7.946 -0.756 19729
567 1 8 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.690 0.512 19729
568 1 8 . 1 1 40 40 TRP H H 40 7.669 7.669 8.169 -0.500 19729
569 1 9 . 1 1 2 2 VAL HA H 2 4.431 4.431 5.160 -0.729 19729
570 1 9 . 1 1 2 2 VAL H H 2 8.658 8.658 8.420 0.238 19729
571 1 9 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.799 -0.207 19729
572 1 9 . 1 1 3 3 LEU H H 3 8.823 8.823 9.032 -0.209 19729
573 1 9 . 1 1 4 4 LYS HA H 4 3.989 3.989 3.997 -0.008 19729
574 1 9 . 1 1 4 4 LYS H H 4 8.943 8.943 8.883 0.060 19729
575 1 9 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.654 -0.005 19729
576 1 9 . 1 1 5 5 TYR H H 5 7.196 7.196 7.164 0.032 19729
577 1 9 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.620 0.424 19729
578 1 9 . 1 1 6 6 CYS H H 6 9.152 9.152 8.831 0.321 19729
579 1 9 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.461 0.063 19729
580 1 9 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.861 0.282 19729
581 1 9 . 1 1 8 8 LYS H H 8 8.703 8.703 8.720 -0.017 19729
582 1 9 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.756 0.585 19729
583 1 9 . 1 1 9 9 ILE H H 9 7.171 7.171 7.627 -0.456 19729
584 1 9 . 1 1 10 10 GLY H H 10 8.237 8.237 7.469 0.768 19729
585 1 9 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.696 0.071 19729
586 1 9 . 1 1 11 11 TYR H H 11 7.230 7.230 7.954 -0.724 19729
587 1 9 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.504 0.393 19729
588 1 9 . 1 1 12 12 CYS H H 12 8.956 8.956 8.731 0.225 19729
589 1 9 . 1 1 13 13 SER HA H 13 4.692 4.692 4.684 0.008 19729
590 1 9 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.704 0.053 19729
591 1 9 . 1 1 14 14 ASN H H 14 8.721 8.721 8.899 -0.178 19729
592 1 9 . 1 1 15 15 THR HA H 15 4.111 4.111 3.547 0.564 19729
593 1 9 . 1 1 15 15 THR H H 15 7.640 7.640 7.356 0.284 19729
594 1 9 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.284 0.574 19729
595 1 9 . 1 1 16 16 CYS H H 16 4.379 4.379 6.235 -1.856 19729
596 1 9 . 1 1 17 17 SER HA H 17 4.639 4.639 4.310 0.329 19729
597 1 9 . 1 1 17 17 SER H H 17 8.375 8.375 8.832 -0.457 19729
598 1 9 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.170 0.236 19729
599 1 9 . 1 1 18 18 LYS H H 18 8.794 8.794 8.730 0.063 19729
600 1 9 . 1 1 19 19 THR HA H 19 4.471 4.471 4.355 0.116 19729
601 1 9 . 1 1 19 19 THR H H 19 8.057 8.057 8.239 -0.182 19729
602 1 9 . 1 1 20 20 GLN HA H 20 4.577 4.577 5.145 -0.568 19729
603 1 9 . 1 1 20 20 GLN H H 20 7.264 7.264 7.868 -0.604 19729
604 1 9 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.267 -0.000 19729
605 1 9 . 1 1 21 21 ILE H H 21 9.161 9.161 8.563 0.598 19729
606 1 9 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.564 0.330 19729
607 1 9 . 1 1 22 22 TRP H H 22 9.220 9.220 9.018 0.202 19729
608 1 9 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.421 0.436 19729
609 1 9 . 1 1 23 23 ALA H H 23 8.124 8.124 7.963 0.161 19729
610 1 9 . 1 1 24 24 THR HA H 24 4.686 4.686 4.477 0.209 19729
611 1 9 . 1 1 24 24 THR H H 24 8.577 8.577 8.105 0.472 19729
612 1 9 . 1 1 25 25 SER HA H 25 5.093 5.093 4.916 0.177 19729
613 1 9 . 1 1 25 25 SER H H 25 9.536 9.536 8.766 0.770 19729
614 1 9 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.545 -0.048 19729
615 1 9 . 1 1 26 26 HIS H H 26 7.845 7.845 9.046 -1.201 19729
616 1 9 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.638 0.501 19729
617 1 9 . 1 1 28 28 CYS H H 28 7.329 7.329 7.815 -0.486 19729
618 1 9 . 1 1 29 29 LYS HA H 29 4.061 4.061 3.976 0.085 19729
619 1 9 . 1 1 29 29 LYS H H 29 9.020 9.020 8.688 0.332 19729
620 1 9 . 1 1 30 30 MET HA H 30 4.501 4.501 4.544 -0.043 19729
621 1 9 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.482 0.633 19729
622 1 9 . 1 1 31 31 TYR H H 31 7.863 7.863 8.201 -0.338 19729
623 1 9 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.976 -0.096 19729
624 1 9 . 1 1 32 32 CYS H H 32 8.876 8.876 8.699 0.177 19729
625 1 9 . 1 1 33 33 CYS HA H 33 4.890 4.890 4.921 -0.031 19729
626 1 9 . 1 1 33 33 CYS H H 33 8.657 8.657 9.031 -0.374 19729
627 1 9 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.671 0.032 19729
628 1 9 . 1 1 34 34 LEU H H 34 8.783 8.783 8.071 0.712 19729
629 1 9 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.446 0.175 19729
630 1 9 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.063 0.109 19729
631 1 9 . 1 1 36 36 ALA H H 36 8.623 8.623 8.328 0.295 19729
632 1 9 . 1 1 37 37 SER HA H 37 4.281 4.281 4.349 -0.068 19729
633 1 9 . 1 1 37 37 SER H H 37 7.771 7.771 7.919 -0.148 19729
634 1 9 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.442 -0.225 19729
635 1 9 . 1 1 38 38 TRP H H 38 8.073 8.073 7.822 0.251 19729
636 1 9 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.159 -0.100 19729
637 1 9 . 1 1 39 39 LYS H H 39 7.190 7.190 7.641 -0.451 19729
638 1 9 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.802 0.400 19729
639 1 9 . 1 1 40 40 TRP H H 40 7.669 7.669 8.214 -0.545 19729
640 1 10 . 1 1 2 2 VAL HA H 2 4.431 4.431 4.516 -0.085 19729
641 1 10 . 1 1 2 2 VAL H H 2 8.658 8.658 8.530 0.128 19729
642 1 10 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.761 -0.169 19729
643 1 10 . 1 1 3 3 LEU H H 3 8.823 8.823 9.029 -0.206 19729
644 1 10 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.398 -0.409 19729
645 1 10 . 1 1 4 4 LYS H H 4 8.943 8.943 8.792 0.151 19729
646 1 10 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.599 0.050 19729
647 1 10 . 1 1 5 5 TYR H H 5 7.196 7.196 7.057 0.139 19729
648 1 10 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.534 0.510 19729
649 1 10 . 1 1 6 6 CYS H H 6 9.152 9.152 8.789 0.363 19729
650 1 10 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.550 -0.026 19729
651 1 10 . 1 1 8 8 LYS HA H 8 4.143 4.143 4.029 0.114 19729
652 1 10 . 1 1 8 8 LYS H H 8 8.703 8.703 8.556 0.147 19729
653 1 10 . 1 1 9 9 ILE HA H 9 4.341 4.341 4.023 0.318 19729
654 1 10 . 1 1 9 9 ILE H H 9 7.171 7.171 7.952 -0.781 19729
655 1 10 . 1 1 10 10 GLY H H 10 8.237 8.237 7.591 0.646 19729
656 1 10 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.910 -0.143 19729
657 1 10 . 1 1 11 11 TYR H H 11 7.230 7.230 7.679 -0.449 19729
658 1 10 . 1 1 12 12 CYS HA H 12 5.897 5.897 4.627 1.270 19729
659 1 10 . 1 1 12 12 CYS H H 12 8.956 8.956 8.884 0.072 19729
660 1 10 . 1 1 13 13 SER HA H 13 4.692 4.692 4.656 0.036 19729
661 1 10 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.675 0.082 19729
662 1 10 . 1 1 14 14 ASN H H 14 8.721 8.721 8.759 -0.038 19729
663 1 10 . 1 1 15 15 THR HA H 15 4.111 4.111 3.718 0.393 19729
664 1 10 . 1 1 15 15 THR H H 15 7.640 7.640 7.541 0.099 19729
665 1 10 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.302 0.556 19729
666 1 10 . 1 1 16 16 CYS H H 16 4.379 4.379 6.432 -2.053 19729
667 1 10 . 1 1 17 17 SER HA H 17 4.639 4.639 4.293 0.346 19729
668 1 10 . 1 1 17 17 SER H H 17 8.375 8.375 8.518 -0.143 19729
669 1 10 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.242 0.164 19729
670 1 10 . 1 1 18 18 LYS H H 18 8.794 8.794 8.767 0.027 19729
671 1 10 . 1 1 19 19 THR HA H 19 4.471 4.471 4.316 0.155 19729
672 1 10 . 1 1 19 19 THR H H 19 8.057 8.057 7.944 0.113 19729
673 1 10 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.983 -0.406 19729
674 1 10 . 1 1 20 20 GLN H H 20 7.264 7.264 7.712 -0.448 19729
675 1 10 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.200 0.067 19729
676 1 10 . 1 1 21 21 ILE H H 21 9.161 9.161 8.822 0.339 19729
677 1 10 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.584 0.310 19729
678 1 10 . 1 1 22 22 TRP H H 22 9.220 9.220 9.038 0.182 19729
679 1 10 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.198 0.659 19729
680 1 10 . 1 1 23 23 ALA H H 23 8.124 8.124 8.020 0.104 19729
681 1 10 . 1 1 24 24 THR HA H 24 4.686 4.686 4.172 0.514 19729
682 1 10 . 1 1 24 24 THR H H 24 8.577 8.577 8.321 0.256 19729
683 1 10 . 1 1 25 25 SER HA H 25 5.093 5.093 5.005 0.088 19729
684 1 10 . 1 1 25 25 SER H H 25 9.536 9.536 8.637 0.899 19729
685 1 10 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.320 0.177 19729
686 1 10 . 1 1 26 26 HIS H H 26 7.845 7.845 9.089 -1.244 19729
687 1 10 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.686 0.453 19729
688 1 10 . 1 1 28 28 CYS H H 28 7.329 7.329 7.398 -0.069 19729
689 1 10 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.308 -0.247 19729
690 1 10 . 1 1 29 29 LYS H H 29 9.020 9.020 8.474 0.546 19729
691 1 10 . 1 1 30 30 MET HA H 30 4.501 4.501 3.982 0.519 19729
692 1 10 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.469 0.646 19729
693 1 10 . 1 1 31 31 TYR H H 31 7.863 7.863 7.514 0.349 19729
694 1 10 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.679 0.201 19729
695 1 10 . 1 1 32 32 CYS H H 32 8.876 8.876 8.716 0.160 19729
696 1 10 . 1 1 33 33 CYS HA H 33 4.890 4.890 4.346 0.544 19729
697 1 10 . 1 1 33 33 CYS H H 33 8.657 8.657 8.349 0.308 19729
698 1 10 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.482 0.221 19729
699 1 10 . 1 1 34 34 LEU H H 34 8.783 8.783 7.859 0.924 19729
700 1 10 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.494 0.127 19729
701 1 10 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.024 0.148 19729
702 1 10 . 1 1 36 36 ALA H H 36 8.623 8.623 8.409 0.214 19729
703 1 10 . 1 1 37 37 SER HA H 37 4.281 4.281 4.277 0.004 19729
704 1 10 . 1 1 37 37 SER H H 37 7.771 7.771 8.054 -0.283 19729
705 1 10 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.435 -0.218 19729
706 1 10 . 1 1 38 38 TRP H H 38 8.073 8.073 7.879 0.194 19729
707 1 10 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.140 -0.081 19729
708 1 10 . 1 1 39 39 LYS H H 39 7.190 7.190 7.984 -0.794 19729
709 1 10 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.449 0.753 19729
710 1 10 . 1 1 40 40 TRP H H 40 7.669 7.669 8.052 -0.383 19729
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 19729
2 1 1 "Average Difference" HA 41 0.349 -0.167 0.310 19729
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19729
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19729
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19729
6 1 1 "Average Difference" HN 34 0.645 0.060 0.652 19729
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19729
8 1 2 "Average Difference" HA 41 0.361 -0.135 0.339 19729
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19729
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19729
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19729
12 1 2 "Average Difference" HN 34 0.596 0.014 0.605 19729
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19729
14 1 3 "Average Difference" HA 41 0.343 -0.115 0.327 19729
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19729
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19729
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19729
18 1 3 "Average Difference" HN 34 0.576 0.001 0.585 19729
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19729
20 1 4 "Average Difference" HA 41 0.352 -0.139 0.327 19729
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19729
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19729
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19729
24 1 4 "Average Difference" HN 34 0.542 0.021 0.550 19729
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19729
26 1 5 "Average Difference" HA 41 0.361 -0.147 0.334 19729
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19729
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19729
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19729
30 1 5 "Average Difference" HN 34 0.687 0.064 0.695 19729
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19729
32 1 6 "Average Difference" HA 41 0.328 -0.126 0.307 19729
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19729
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19729
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19729
36 1 6 "Average Difference" HN 34 0.667 0.072 0.674 19729
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19729
38 1 7 "Average Difference" HA 41 0.379 -0.149 0.353 19729
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19729
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19729
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19729
42 1 7 "Average Difference" HN 34 0.578 0.025 0.587 19729
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19729
44 1 8 "Average Difference" HA 41 0.356 -0.146 0.329 19729
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19729
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19729
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19729
48 1 8 "Average Difference" HN 34 0.711 0.073 0.718 19729
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19729
50 1 9 "Average Difference" HA 41 0.347 -0.126 0.328 19729
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19729
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19729
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19729
54 1 9 "Average Difference" HN 34 0.549 0.067 0.553 19729
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19729
56 1 10 "Average Difference" HA 41 0.411 -0.189 0.369 19729
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19729
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19729
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19729
60 1 10 "Average Difference" HN 34 0.565 0.016 0.574 19729
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 19729
_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 VAL HA H 2 4.431 4.431 4.903 -0.472 19729
2 1 . 1 1 2 2 VAL H H 2 8.658 8.658 8.139 0.519 19729
3 1 . 1 1 3 3 LEU HA H 3 4.592 4.592 4.834 -0.242 19729
4 1 . 1 1 3 3 LEU H H 3 8.823 8.823 9.007 -0.184 19729
5 1 . 1 1 4 4 LYS HA H 4 3.989 3.989 4.184 -0.195 19729
6 1 . 1 1 4 4 LYS H H 4 8.943 8.943 8.789 0.154 19729
7 1 . 1 1 5 5 TYR HA H 5 4.649 4.649 4.663 -0.014 19729
8 1 . 1 1 5 5 TYR H H 5 7.196 7.196 7.073 0.123 19729
9 1 . 1 1 6 6 CYS HA H 6 5.044 5.044 4.567 0.477 19729
10 1 . 1 1 6 6 CYS H H 6 9.152 9.152 8.749 0.403 19729
11 1 . 1 1 7 7 PRO HA H 7 4.524 4.524 4.546 -0.022 19729
12 1 . 1 1 8 8 LYS HA H 8 4.143 4.143 3.917 0.226 19729
13 1 . 1 1 8 8 LYS H H 8 8.703 8.703 8.626 0.077 19729
14 1 . 1 1 9 9 ILE HA H 9 4.341 4.341 3.858 0.483 19729
15 1 . 1 1 9 9 ILE H H 9 7.171 7.171 7.740 -0.569 19729
16 1 . 1 1 10 10 GLY H H 10 8.237 8.237 7.439 0.798 19729
17 1 . 1 1 11 11 TYR HA H 11 4.767 4.767 4.774 -0.007 19729
18 1 . 1 1 11 11 TYR H H 11 7.230 7.230 8.072 -0.842 19729
19 1 . 1 1 12 12 CYS HA H 12 5.897 5.897 5.373 0.523 19729
20 1 . 1 1 12 12 CYS H H 12 8.956 8.956 8.731 0.225 19729
21 1 . 1 1 13 13 SER HA H 13 4.692 4.692 4.721 -0.029 19729
22 1 . 1 1 14 14 ASN HA H 14 4.757 4.757 4.583 0.174 19729
23 1 . 1 1 14 14 ASN H H 14 8.721 8.721 8.779 -0.058 19729
24 1 . 1 1 15 15 THR HA H 15 4.111 4.111 3.576 0.535 19729
25 1 . 1 1 15 15 THR H H 15 7.640 7.640 7.395 0.245 19729
26 1 . 1 1 16 16 CYS HA H 16 4.858 4.858 4.329 0.529 19729
27 1 . 1 1 16 16 CYS H H 16 4.379 4.379 6.496 -2.117 19729
28 1 . 1 1 17 17 SER HA H 17 4.639 4.639 4.324 0.316 19729
29 1 . 1 1 17 17 SER H H 17 8.375 8.375 8.602 -0.227 19729
30 1 . 1 1 18 18 LYS HA H 18 4.406 4.406 4.176 0.230 19729
31 1 . 1 1 18 18 LYS H H 18 8.794 8.794 8.819 -0.026 19729
32 1 . 1 1 19 19 THR HA H 19 4.471 4.471 4.218 0.253 19729
33 1 . 1 1 19 19 THR H H 19 8.057 8.057 8.030 0.027 19729
34 1 . 1 1 20 20 GLN HA H 20 4.577 4.577 4.796 -0.219 19729
35 1 . 1 1 20 20 GLN H H 20 7.264 7.264 7.661 -0.397 19729
36 1 . 1 1 21 21 ILE HA H 21 4.267 4.267 4.200 0.067 19729
37 1 . 1 1 21 21 ILE H H 21 9.161 9.161 8.674 0.486 19729
38 1 . 1 1 22 22 TRP HA H 22 4.894 4.894 4.650 0.244 19729
39 1 . 1 1 22 22 TRP H H 22 9.220 9.220 8.908 0.312 19729
40 1 . 1 1 23 23 ALA HA H 23 4.857 4.857 4.376 0.481 19729
41 1 . 1 1 23 23 ALA H H 23 8.124 8.124 8.183 -0.059 19729
42 1 . 1 1 24 24 THR HA H 24 4.686 4.686 4.335 0.351 19729
43 1 . 1 1 24 24 THR H H 24 8.577 8.577 8.324 0.253 19729
44 1 . 1 1 25 25 SER HA H 25 5.093 5.093 4.944 0.150 19729
45 1 . 1 1 25 25 SER H H 25 9.536 9.536 8.605 0.931 19729
46 1 . 1 1 26 26 HIS HA H 26 4.497 4.497 4.349 0.148 19729
47 1 . 1 1 26 26 HIS H H 26 7.845 7.845 9.082 -1.237 19729
48 1 . 1 1 28 28 CYS HA H 28 5.139 5.139 4.682 0.457 19729
49 1 . 1 1 28 28 CYS H H 28 7.329 7.329 7.599 -0.271 19729
50 1 . 1 1 29 29 LYS HA H 29 4.061 4.061 4.066 -0.005 19729
51 1 . 1 1 29 29 LYS H H 29 9.020 9.020 8.534 0.486 19729
52 1 . 1 1 30 30 MET HA H 30 4.501 4.501 4.420 0.081 19729
53 1 . 1 1 31 31 TYR HA H 31 5.115 5.115 4.524 0.591 19729
54 1 . 1 1 31 31 TYR H H 31 7.863 7.863 8.099 -0.236 19729
55 1 . 1 1 32 32 CYS HA H 32 4.880 4.880 4.850 0.030 19729
56 1 . 1 1 32 32 CYS H H 32 8.876 8.876 8.734 0.142 19729
57 1 . 1 1 33 33 CYS HA H 33 4.890 4.890 5.035 -0.145 19729
58 1 . 1 1 33 33 CYS H H 33 8.657 8.657 8.807 -0.150 19729
59 1 . 1 1 34 34 LEU HA H 34 4.703 4.703 4.621 0.082 19729
60 1 . 1 1 34 34 LEU H H 34 8.783 8.783 8.001 0.782 19729
61 1 . 1 1 35 35 PRO HA H 35 4.621 4.621 4.411 0.210 19729
62 1 . 1 1 36 36 ALA HA H 36 4.172 4.172 4.079 0.093 19729
63 1 . 1 1 36 36 ALA H H 36 8.623 8.623 8.418 0.205 19729
64 1 . 1 1 37 37 SER HA H 37 4.281 4.281 4.346 -0.065 19729
65 1 . 1 1 37 37 SER H H 37 7.771 7.771 8.023 -0.252 19729
66 1 . 1 1 38 38 TRP HA H 38 4.217 4.217 4.441 -0.224 19729
67 1 . 1 1 38 38 TRP H H 38 8.073 8.073 7.833 0.240 19729
68 1 . 1 1 39 39 LYS HA H 39 4.059 4.059 4.152 -0.093 19729
69 1 . 1 1 39 39 LYS H H 39 7.190 7.190 7.956 -0.766 19729
70 1 . 1 1 40 40 TRP HA H 40 4.202 4.202 3.608 0.594 19729
71 1 . 1 1 40 40 TRP H H 40 7.669 7.669 8.090 -0.421 19729
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