data_17540
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 17540
_Entry.PDB_ID 2LAY
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 17540
_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 171 4.021 4.021 4.034 -0.013 17540
2 1 1 . 1 1 2 2 VAL H H 171 7.178 7.178 8.091 -0.913 17540
3 1 1 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.280 -0.146 17540
4 1 1 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.588 -0.580 17540
5 1 1 . 1 1 4 4 LEU H H 173 8.380 8.380 7.480 0.900 17540
6 1 1 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.508 -0.238 17540
7 1 1 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.279 -0.293 17540
8 1 1 . 1 1 6 6 ALA H H 175 8.264 8.264 8.562 -0.298 17540
9 1 1 . 1 1 7 7 GLY H H 176 8.592 8.592 8.372 0.220 17540
10 1 1 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.410 0.097 17540
11 1 1 . 1 1 8 8 TRP H H 177 7.519 7.519 7.394 0.125 17540
12 1 1 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.668 -0.141 17540
13 1 1 . 1 1 9 9 GLU H H 178 9.269 9.269 8.068 1.201 17540
14 1 1 . 1 1 10 10 MET HA H 179 4.228 4.228 4.583 -0.355 17540
15 1 1 . 1 1 10 10 MET H H 179 8.833 8.833 8.549 0.284 17540
16 1 1 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.516 -0.366 17540
17 1 1 . 1 1 11 11 ALA H H 180 8.195 8.195 8.495 -0.300 17540
18 1 1 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.637 0.608 17540
19 1 1 . 1 1 12 12 LYS H H 181 7.878 7.878 8.311 -0.433 17540
20 1 1 . 1 1 13 13 THR HA H 182 4.232 4.232 4.670 -0.438 17540
21 1 1 . 1 1 13 13 THR H H 182 9.008 9.008 8.416 0.592 17540
22 1 1 . 1 1 14 14 SER HA H 183 4.065 4.065 4.311 -0.246 17540
23 1 1 . 1 1 14 14 SER H H 183 8.473 8.473 9.023 -0.550 17540
24 1 1 . 1 1 15 15 SER HA H 184 4.405 4.405 4.505 -0.100 17540
25 1 1 . 1 1 15 15 SER H H 184 7.975 7.975 7.812 0.163 17540
26 1 1 . 1 1 16 16 GLY H H 185 7.972 7.972 7.936 0.036 17540
27 1 1 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.765 -0.544 17540
28 1 1 . 1 1 17 17 GLN H H 186 7.379 7.379 7.876 -0.497 17540
29 1 1 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.541 -0.302 17540
30 1 1 . 1 1 18 18 ARG H H 187 8.775 8.775 8.901 -0.126 17540
31 1 1 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.197 0.270 17540
32 1 1 . 1 1 19 19 TYR H H 188 8.452 8.452 7.567 0.885 17540
33 1 1 . 1 1 20 20 PHE HA H 189 5.102 5.102 4.857 0.245 17540
34 1 1 . 1 1 20 20 PHE H H 189 8.695 8.695 8.185 0.510 17540
35 1 1 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.514 0.017 17540
36 1 1 . 1 1 21 21 LEU H H 190 9.185 9.185 7.794 1.391 17540
37 1 1 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.679 -0.988 17540
38 1 1 . 1 1 22 22 ASN H H 191 8.135 8.135 8.720 -0.585 17540
39 1 1 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.374 -0.298 17540
40 1 1 . 1 1 23 23 HIS H H 192 8.502 8.502 8.563 -0.061 17540
41 1 1 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.011 -0.400 17540
42 1 1 . 1 1 24 24 ILE H H 193 8.024 8.024 8.000 0.024 17540
43 1 1 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.618 -0.266 17540
44 1 1 . 1 1 25 25 ASP H H 194 6.873 6.873 7.822 -0.949 17540
45 1 1 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.927 -0.307 17540
46 1 1 . 1 1 26 26 GLN H H 195 7.575 7.575 8.065 -0.490 17540
47 1 1 . 1 1 27 27 THR HA H 196 4.413 4.413 4.606 -0.193 17540
48 1 1 . 1 1 27 27 THR H H 196 7.632 7.632 7.429 0.203 17540
49 1 1 . 1 1 28 28 THR HA H 197 5.298 5.298 4.869 0.429 17540
50 1 1 . 1 1 28 28 THR H H 197 8.056 8.056 8.408 -0.352 17540
51 1 1 . 1 1 29 29 THR HA H 198 4.633 4.633 4.745 -0.112 17540
52 1 1 . 1 1 29 29 THR H H 198 9.007 9.007 8.877 0.130 17540
53 1 1 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.622 0.264 17540
54 1 1 . 1 1 30 30 TRP H H 199 8.518 8.518 8.852 -0.334 17540
55 1 1 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.366 -0.349 17540
56 1 1 . 1 1 31 31 GLN H H 200 8.453 8.453 7.619 0.834 17540
57 1 1 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.727 -2.363 17540
58 1 1 . 1 1 32 32 ASP H H 201 8.083 8.083 8.662 -0.579 17540
59 1 1 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.329 -0.543 17540
60 1 1 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.329 -0.611 17540
61 1 1 . 1 1 34 34 ARG H H 203 8.145 8.145 8.247 -0.102 17540
62 1 1 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.206 -0.471 17540
63 1 1 . 1 1 35 35 LYS H H 204 6.954 6.954 7.707 -0.753 17540
64 1 2 . 1 1 2 2 VAL HA H 171 4.021 4.021 3.956 0.065 17540
65 1 2 . 1 1 2 2 VAL H H 171 7.178 7.178 8.005 -0.827 17540
66 1 2 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.250 -0.116 17540
67 1 2 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.604 -0.596 17540
68 1 2 . 1 1 4 4 LEU H H 173 8.380 8.380 7.564 0.816 17540
69 1 2 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.444 -0.174 17540
70 1 2 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.407 -0.421 17540
71 1 2 . 1 1 6 6 ALA H H 175 8.264 8.264 8.505 -0.241 17540
72 1 2 . 1 1 7 7 GLY H H 176 8.592 8.592 8.565 0.027 17540
73 1 2 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.773 -0.266 17540
74 1 2 . 1 1 8 8 TRP H H 177 7.519 7.519 7.636 -0.117 17540
75 1 2 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.827 -0.300 17540
76 1 2 . 1 1 9 9 GLU H H 178 9.269 9.269 9.134 0.135 17540
77 1 2 . 1 1 10 10 MET HA H 179 4.228 4.228 4.829 -0.601 17540
78 1 2 . 1 1 10 10 MET H H 179 8.833 8.833 8.892 -0.059 17540
79 1 2 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.414 -0.264 17540
80 1 2 . 1 1 11 11 ALA H H 180 8.195 8.195 8.427 -0.232 17540
81 1 2 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.572 0.673 17540
82 1 2 . 1 1 12 12 LYS H H 181 7.878 7.878 8.265 -0.387 17540
83 1 2 . 1 1 13 13 THR HA H 182 4.232 4.232 4.592 -0.360 17540
84 1 2 . 1 1 13 13 THR H H 182 9.008 9.008 8.588 0.420 17540
85 1 2 . 1 1 14 14 SER HA H 183 4.065 4.065 4.325 -0.260 17540
86 1 2 . 1 1 14 14 SER H H 183 8.473 8.473 8.878 -0.405 17540
87 1 2 . 1 1 15 15 SER HA H 184 4.405 4.405 4.409 -0.004 17540
88 1 2 . 1 1 15 15 SER H H 184 7.975 7.975 7.864 0.111 17540
89 1 2 . 1 1 16 16 GLY H H 185 7.972 7.972 7.703 0.269 17540
90 1 2 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.740 -0.519 17540
91 1 2 . 1 1 17 17 GLN H H 186 7.379 7.379 7.877 -0.498 17540
92 1 2 . 1 1 18 18 ARG HA H 187 4.239 4.239 5.108 -0.869 17540
93 1 2 . 1 1 18 18 ARG H H 187 8.775 8.775 8.836 -0.061 17540
94 1 2 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.449 0.018 17540
95 1 2 . 1 1 19 19 TYR H H 188 8.452 8.452 7.939 0.513 17540
96 1 2 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.499 -0.397 17540
97 1 2 . 1 1 20 20 PHE H H 189 8.695 8.695 8.825 -0.130 17540
98 1 2 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.763 -0.232 17540
99 1 2 . 1 1 21 21 LEU H H 190 9.185 9.185 8.511 0.674 17540
100 1 2 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.431 -0.740 17540
101 1 2 . 1 1 22 22 ASN H H 191 8.135 8.135 8.700 -0.565 17540
102 1 2 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.639 -0.563 17540
103 1 2 . 1 1 23 23 HIS H H 192 8.502 8.502 8.637 -0.135 17540
104 1 2 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.947 -0.336 17540
105 1 2 . 1 1 24 24 ILE H H 193 8.024 8.024 7.907 0.117 17540
106 1 2 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.625 -0.273 17540
107 1 2 . 1 1 25 25 ASP H H 194 6.873 6.873 8.156 -1.283 17540
108 1 2 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.962 -0.342 17540
109 1 2 . 1 1 26 26 GLN H H 195 7.575 7.575 8.157 -0.582 17540
110 1 2 . 1 1 27 27 THR HA H 196 4.413 4.413 4.544 -0.131 17540
111 1 2 . 1 1 27 27 THR H H 196 7.632 7.632 7.377 0.255 17540
112 1 2 . 1 1 28 28 THR HA H 197 5.298 5.298 4.601 0.697 17540
113 1 2 . 1 1 28 28 THR H H 197 8.056 8.056 8.352 -0.296 17540
114 1 2 . 1 1 29 29 THR HA H 198 4.633 4.633 4.753 -0.120 17540
115 1 2 . 1 1 29 29 THR H H 198 9.007 9.007 8.744 0.263 17540
116 1 2 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.865 0.021 17540
117 1 2 . 1 1 30 30 TRP H H 199 8.518 8.518 8.747 -0.229 17540
118 1 2 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.598 -0.581 17540
119 1 2 . 1 1 31 31 GLN H H 200 8.453 8.453 7.735 0.718 17540
120 1 2 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.831 -2.467 17540
121 1 2 . 1 1 32 32 ASP H H 201 8.083 8.083 8.605 -0.522 17540
122 1 2 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.292 -0.506 17540
123 1 2 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.223 -0.505 17540
124 1 2 . 1 1 34 34 ARG H H 203 8.145 8.145 8.552 -0.407 17540
125 1 2 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.264 -0.529 17540
126 1 2 . 1 1 35 35 LYS H H 204 6.954 6.954 7.950 -0.996 17540
127 1 3 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.098 -0.077 17540
128 1 3 . 1 1 2 2 VAL H H 171 7.178 7.178 7.950 -0.772 17540
129 1 3 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.308 -0.174 17540
130 1 3 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.669 -0.661 17540
131 1 3 . 1 1 4 4 LEU H H 173 8.380 8.380 7.189 1.191 17540
132 1 3 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.431 -0.161 17540
133 1 3 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.401 -0.415 17540
134 1 3 . 1 1 6 6 ALA H H 175 8.264 8.264 8.510 -0.246 17540
135 1 3 . 1 1 7 7 GLY H H 176 8.592 8.592 8.465 0.127 17540
136 1 3 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.781 -0.274 17540
137 1 3 . 1 1 8 8 TRP H H 177 7.519 7.519 7.658 -0.139 17540
138 1 3 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.702 -0.175 17540
139 1 3 . 1 1 9 9 GLU H H 178 9.269 9.269 8.942 0.327 17540
140 1 3 . 1 1 10 10 MET HA H 179 4.228 4.228 4.733 -0.505 17540
141 1 3 . 1 1 10 10 MET H H 179 8.833 8.833 8.796 0.037 17540
142 1 3 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.436 -0.286 17540
143 1 3 . 1 1 11 11 ALA H H 180 8.195 8.195 8.380 -0.185 17540
144 1 3 . 1 1 12 12 LYS HA H 181 5.245 5.245 5.078 0.167 17540
145 1 3 . 1 1 12 12 LYS H H 181 7.878 7.878 8.217 -0.339 17540
146 1 3 . 1 1 13 13 THR HA H 182 4.232 4.232 4.665 -0.433 17540
147 1 3 . 1 1 13 13 THR H H 182 9.008 9.008 8.554 0.454 17540
148 1 3 . 1 1 14 14 SER HA H 183 4.065 4.065 4.284 -0.219 17540
149 1 3 . 1 1 14 14 SER H H 183 8.473 8.473 8.863 -0.390 17540
150 1 3 . 1 1 15 15 SER HA H 184 4.405 4.405 4.465 -0.060 17540
151 1 3 . 1 1 15 15 SER H H 184 7.975 7.975 7.749 0.226 17540
152 1 3 . 1 1 16 16 GLY H H 185 7.972 7.972 7.967 0.005 17540
153 1 3 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.701 -0.480 17540
154 1 3 . 1 1 17 17 GLN H H 186 7.379 7.379 7.753 -0.374 17540
155 1 3 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.970 -0.731 17540
156 1 3 . 1 1 18 18 ARG H H 187 8.775 8.775 8.951 -0.176 17540
157 1 3 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.827 -0.360 17540
158 1 3 . 1 1 19 19 TYR H H 188 8.452 8.452 7.451 1.001 17540
159 1 3 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.413 -0.311 17540
160 1 3 . 1 1 20 20 PHE H H 189 8.695 8.695 8.797 -0.102 17540
161 1 3 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.824 -0.293 17540
162 1 3 . 1 1 21 21 LEU H H 190 9.185 9.185 8.730 0.455 17540
163 1 3 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.379 -0.688 17540
164 1 3 . 1 1 22 22 ASN H H 191 8.135 8.135 8.646 -0.511 17540
165 1 3 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.386 -0.310 17540
166 1 3 . 1 1 23 23 HIS H H 192 8.502 8.502 8.988 -0.486 17540
167 1 3 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.940 -0.329 17540
168 1 3 . 1 1 24 24 ILE H H 193 8.024 8.024 7.701 0.323 17540
169 1 3 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.576 -0.224 17540
170 1 3 . 1 1 25 25 ASP H H 194 6.873 6.873 7.897 -1.024 17540
171 1 3 . 1 1 26 26 GLN HA H 195 3.620 3.620 4.003 -0.383 17540
172 1 3 . 1 1 26 26 GLN H H 195 7.575 7.575 8.165 -0.590 17540
173 1 3 . 1 1 27 27 THR HA H 196 4.413 4.413 4.683 -0.270 17540
174 1 3 . 1 1 27 27 THR H H 196 7.632 7.632 7.413 0.219 17540
175 1 3 . 1 1 28 28 THR HA H 197 5.298 5.298 4.873 0.425 17540
176 1 3 . 1 1 28 28 THR H H 197 8.056 8.056 8.429 -0.373 17540
177 1 3 . 1 1 29 29 THR HA H 198 4.633 4.633 4.741 -0.108 17540
178 1 3 . 1 1 29 29 THR H H 198 9.007 9.007 8.492 0.515 17540
179 1 3 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.719 0.167 17540
180 1 3 . 1 1 30 30 TRP H H 199 8.518 8.518 8.698 -0.180 17540
181 1 3 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.418 -0.401 17540
182 1 3 . 1 1 31 31 GLN H H 200 8.453 8.453 7.934 0.519 17540
183 1 3 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.670 -2.306 17540
184 1 3 . 1 1 32 32 ASP H H 201 8.083 8.083 8.625 -0.542 17540
185 1 3 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.275 -0.489 17540
186 1 3 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.143 -0.425 17540
187 1 3 . 1 1 34 34 ARG H H 203 8.145 8.145 8.075 0.070 17540
188 1 3 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.198 -0.463 17540
189 1 3 . 1 1 35 35 LYS H H 204 6.954 6.954 7.988 -1.034 17540
190 1 4 . 1 1 2 2 VAL HA H 171 4.021 4.021 3.877 0.144 17540
191 1 4 . 1 1 2 2 VAL H H 171 7.178 7.178 7.957 -0.779 17540
192 1 4 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.259 -0.125 17540
193 1 4 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.562 -0.554 17540
194 1 4 . 1 1 4 4 LEU H H 173 8.380 8.380 7.110 1.270 17540
195 1 4 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.426 -0.156 17540
196 1 4 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.370 -0.384 17540
197 1 4 . 1 1 6 6 ALA H H 175 8.264 8.264 8.498 -0.234 17540
198 1 4 . 1 1 7 7 GLY H H 176 8.592 8.592 8.517 0.075 17540
199 1 4 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.639 -0.132 17540
200 1 4 . 1 1 8 8 TRP H H 177 7.519 7.519 7.500 0.019 17540
201 1 4 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.768 -0.241 17540
202 1 4 . 1 1 9 9 GLU H H 178 9.269 9.269 8.833 0.436 17540
203 1 4 . 1 1 10 10 MET HA H 179 4.228 4.228 4.637 -0.409 17540
204 1 4 . 1 1 10 10 MET H H 179 8.833 8.833 8.721 0.112 17540
205 1 4 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.470 -0.320 17540
206 1 4 . 1 1 11 11 ALA H H 180 8.195 8.195 8.481 -0.286 17540
207 1 4 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.713 0.532 17540
208 1 4 . 1 1 12 12 LYS H H 181 7.878 7.878 8.327 -0.449 17540
209 1 4 . 1 1 13 13 THR HA H 182 4.232 4.232 4.635 -0.403 17540
210 1 4 . 1 1 13 13 THR H H 182 9.008 9.008 8.935 0.073 17540
211 1 4 . 1 1 14 14 SER HA H 183 4.065 4.065 4.474 -0.409 17540
212 1 4 . 1 1 14 14 SER H H 183 8.473 8.473 8.821 -0.348 17540
213 1 4 . 1 1 15 15 SER HA H 184 4.405 4.405 4.478 -0.073 17540
214 1 4 . 1 1 15 15 SER H H 184 7.975 7.975 7.947 0.028 17540
215 1 4 . 1 1 16 16 GLY H H 185 7.972 7.972 7.642 0.330 17540
216 1 4 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.823 -0.602 17540
217 1 4 . 1 1 17 17 GLN H H 186 7.379 7.379 7.796 -0.417 17540
218 1 4 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.917 -0.678 17540
219 1 4 . 1 1 18 18 ARG H H 187 8.775 8.775 8.796 -0.021 17540
220 1 4 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.671 -0.204 17540
221 1 4 . 1 1 19 19 TYR H H 188 8.452 8.452 7.991 0.461 17540
222 1 4 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.285 -0.183 17540
223 1 4 . 1 1 20 20 PHE H H 189 8.695 8.695 8.404 0.291 17540
224 1 4 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.641 -0.110 17540
225 1 4 . 1 1 21 21 LEU H H 190 9.185 9.185 8.421 0.764 17540
226 1 4 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.112 -0.421 17540
227 1 4 . 1 1 22 22 ASN H H 191 8.135 8.135 8.556 -0.421 17540
228 1 4 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.316 -0.240 17540
229 1 4 . 1 1 23 23 HIS H H 192 8.502 8.502 8.813 -0.311 17540
230 1 4 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.164 -0.553 17540
231 1 4 . 1 1 24 24 ILE H H 193 8.024 8.024 7.671 0.353 17540
232 1 4 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.579 -0.227 17540
233 1 4 . 1 1 25 25 ASP H H 194 6.873 6.873 7.372 -0.499 17540
234 1 4 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.917 -0.297 17540
235 1 4 . 1 1 26 26 GLN H H 195 7.575 7.575 8.093 -0.518 17540
236 1 4 . 1 1 27 27 THR HA H 196 4.413 4.413 4.550 -0.137 17540
237 1 4 . 1 1 27 27 THR H H 196 7.632 7.632 7.332 0.300 17540
238 1 4 . 1 1 28 28 THR HA H 197 5.298 5.298 4.456 0.842 17540
239 1 4 . 1 1 28 28 THR H H 197 8.056 8.056 8.445 -0.389 17540
240 1 4 . 1 1 29 29 THR HA H 198 4.633 4.633 4.738 -0.105 17540
241 1 4 . 1 1 29 29 THR H H 198 9.007 9.007 8.090 0.917 17540
242 1 4 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.780 0.106 17540
243 1 4 . 1 1 30 30 TRP H H 199 8.518 8.518 8.689 -0.171 17540
244 1 4 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.373 -0.356 17540
245 1 4 . 1 1 31 31 GLN H H 200 8.453 8.453 7.720 0.733 17540
246 1 4 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.699 -2.335 17540
247 1 4 . 1 1 32 32 ASP H H 201 8.083 8.083 8.468 -0.385 17540
248 1 4 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.220 -0.434 17540
249 1 4 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.276 -0.558 17540
250 1 4 . 1 1 34 34 ARG H H 203 8.145 8.145 8.307 -0.162 17540
251 1 4 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.255 -0.520 17540
252 1 4 . 1 1 35 35 LYS H H 204 6.954 6.954 7.736 -0.782 17540
253 1 5 . 1 1 2 2 VAL HA H 171 4.021 4.021 3.980 0.041 17540
254 1 5 . 1 1 2 2 VAL H H 171 7.178 7.178 8.027 -0.849 17540
255 1 5 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.297 -0.163 17540
256 1 5 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.624 -0.616 17540
257 1 5 . 1 1 4 4 LEU H H 173 8.380 8.380 7.245 1.135 17540
258 1 5 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.490 -0.220 17540
259 1 5 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.383 -0.397 17540
260 1 5 . 1 1 6 6 ALA H H 175 8.264 8.264 8.384 -0.120 17540
261 1 5 . 1 1 7 7 GLY H H 176 8.592 8.592 8.405 0.187 17540
262 1 5 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.674 -0.167 17540
263 1 5 . 1 1 8 8 TRP H H 177 7.519 7.519 7.520 -0.001 17540
264 1 5 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.650 -0.123 17540
265 1 5 . 1 1 9 9 GLU H H 178 9.269 9.269 8.968 0.301 17540
266 1 5 . 1 1 10 10 MET HA H 179 4.228 4.228 4.751 -0.523 17540
267 1 5 . 1 1 10 10 MET H H 179 8.833 8.833 8.858 -0.025 17540
268 1 5 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.394 -0.244 17540
269 1 5 . 1 1 11 11 ALA H H 180 8.195 8.195 8.320 -0.125 17540
270 1 5 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.798 0.447 17540
271 1 5 . 1 1 12 12 LYS H H 181 7.878 7.878 8.180 -0.302 17540
272 1 5 . 1 1 13 13 THR HA H 182 4.232 4.232 4.782 -0.550 17540
273 1 5 . 1 1 13 13 THR H H 182 9.008 9.008 8.685 0.323 17540
274 1 5 . 1 1 14 14 SER HA H 183 4.065 4.065 4.326 -0.261 17540
275 1 5 . 1 1 14 14 SER H H 183 8.473 8.473 8.789 -0.316 17540
276 1 5 . 1 1 15 15 SER HA H 184 4.405 4.405 4.463 -0.058 17540
277 1 5 . 1 1 15 15 SER H H 184 7.975 7.975 7.834 0.141 17540
278 1 5 . 1 1 16 16 GLY H H 185 7.972 7.972 8.048 -0.076 17540
279 1 5 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.739 -0.518 17540
280 1 5 . 1 1 17 17 GLN H H 186 7.379 7.379 7.860 -0.481 17540
281 1 5 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.951 -0.712 17540
282 1 5 . 1 1 18 18 ARG H H 187 8.775 8.775 8.895 -0.120 17540
283 1 5 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.520 -0.053 17540
284 1 5 . 1 1 19 19 TYR H H 188 8.452 8.452 7.569 0.883 17540
285 1 5 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.331 -0.229 17540
286 1 5 . 1 1 20 20 PHE H H 189 8.695 8.695 8.452 0.243 17540
287 1 5 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.808 -0.277 17540
288 1 5 . 1 1 21 21 LEU H H 190 9.185 9.185 8.832 0.353 17540
289 1 5 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.426 -0.735 17540
290 1 5 . 1 1 22 22 ASN H H 191 8.135 8.135 8.606 -0.471 17540
291 1 5 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.508 -0.432 17540
292 1 5 . 1 1 23 23 HIS H H 192 8.502 8.502 8.627 -0.125 17540
293 1 5 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.955 -0.344 17540
294 1 5 . 1 1 24 24 ILE H H 193 8.024 8.024 7.807 0.217 17540
295 1 5 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.563 -0.211 17540
296 1 5 . 1 1 25 25 ASP H H 194 6.873 6.873 8.095 -1.222 17540
297 1 5 . 1 1 26 26 GLN HA H 195 3.620 3.620 4.001 -0.381 17540
298 1 5 . 1 1 26 26 GLN H H 195 7.575 7.575 8.161 -0.586 17540
299 1 5 . 1 1 27 27 THR HA H 196 4.413 4.413 4.512 -0.099 17540
300 1 5 . 1 1 27 27 THR H H 196 7.632 7.632 7.428 0.204 17540
301 1 5 . 1 1 28 28 THR HA H 197 5.298 5.298 4.459 0.839 17540
302 1 5 . 1 1 28 28 THR H H 197 8.056 8.056 8.410 -0.354 17540
303 1 5 . 1 1 29 29 THR HA H 198 4.633 4.633 4.746 -0.113 17540
304 1 5 . 1 1 29 29 THR H H 198 9.007 9.007 8.207 0.800 17540
305 1 5 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.815 0.071 17540
306 1 5 . 1 1 30 30 TRP H H 199 8.518 8.518 8.688 -0.170 17540
307 1 5 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.473 -0.456 17540
308 1 5 . 1 1 31 31 GLN H H 200 8.453 8.453 7.652 0.801 17540
309 1 5 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.895 -2.531 17540
310 1 5 . 1 1 32 32 ASP H H 201 8.083 8.083 8.581 -0.498 17540
311 1 5 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.451 -0.665 17540
312 1 5 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.200 -0.482 17540
313 1 5 . 1 1 34 34 ARG H H 203 8.145 8.145 7.870 0.275 17540
314 1 5 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.100 -0.365 17540
315 1 5 . 1 1 35 35 LYS H H 204 6.954 6.954 7.997 -1.043 17540
316 1 6 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.358 -0.337 17540
317 1 6 . 1 1 2 2 VAL H H 171 7.178 7.178 7.977 -0.799 17540
318 1 6 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.242 -0.108 17540
319 1 6 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.624 -0.616 17540
320 1 6 . 1 1 4 4 LEU H H 173 8.380 8.380 7.921 0.459 17540
321 1 6 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.457 -0.187 17540
322 1 6 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.591 -0.605 17540
323 1 6 . 1 1 6 6 ALA H H 175 8.264 8.264 8.430 -0.166 17540
324 1 6 . 1 1 7 7 GLY H H 176 8.592 8.592 8.568 0.024 17540
325 1 6 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.446 0.061 17540
326 1 6 . 1 1 8 8 TRP H H 177 7.519 7.519 7.657 -0.138 17540
327 1 6 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.754 -0.227 17540
328 1 6 . 1 1 9 9 GLU H H 178 9.269 9.269 9.075 0.194 17540
329 1 6 . 1 1 10 10 MET HA H 179 4.228 4.228 3.201 1.027 17540
330 1 6 . 1 1 10 10 MET H H 179 8.833 8.833 8.587 0.246 17540
331 1 6 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.183 -0.033 17540
332 1 6 . 1 1 11 11 ALA H H 180 8.195 8.195 8.007 0.188 17540
333 1 6 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.450 0.795 17540
334 1 6 . 1 1 12 12 LYS H H 181 7.878 7.878 7.822 0.056 17540
335 1 6 . 1 1 13 13 THR HA H 182 4.232 4.232 4.499 -0.267 17540
336 1 6 . 1 1 13 13 THR H H 182 9.008 9.008 8.643 0.365 17540
337 1 6 . 1 1 14 14 SER HA H 183 4.065 4.065 4.277 -0.212 17540
338 1 6 . 1 1 14 14 SER H H 183 8.473 8.473 9.104 -0.631 17540
339 1 6 . 1 1 15 15 SER HA H 184 4.405 4.405 4.470 -0.065 17540
340 1 6 . 1 1 15 15 SER H H 184 7.975 7.975 8.044 -0.069 17540
341 1 6 . 1 1 16 16 GLY H H 185 7.972 7.972 7.925 0.047 17540
342 1 6 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.809 -0.588 17540
343 1 6 . 1 1 17 17 GLN H H 186 7.379 7.379 7.790 -0.411 17540
344 1 6 . 1 1 18 18 ARG HA H 187 4.239 4.239 5.194 -0.955 17540
345 1 6 . 1 1 18 18 ARG H H 187 8.775 8.775 8.900 -0.125 17540
346 1 6 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.972 -0.505 17540
347 1 6 . 1 1 19 19 TYR H H 188 8.452 8.452 7.632 0.820 17540
348 1 6 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.244 -0.142 17540
349 1 6 . 1 1 20 20 PHE H H 189 8.695 8.695 9.151 -0.456 17540
350 1 6 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.728 -0.197 17540
351 1 6 . 1 1 21 21 LEU H H 190 9.185 9.185 8.628 0.557 17540
352 1 6 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.086 -0.395 17540
353 1 6 . 1 1 22 22 ASN H H 191 8.135 8.135 8.703 -0.568 17540
354 1 6 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.397 -0.321 17540
355 1 6 . 1 1 23 23 HIS H H 192 8.502 8.502 8.176 0.326 17540
356 1 6 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.975 -0.364 17540
357 1 6 . 1 1 24 24 ILE H H 193 8.024 8.024 7.757 0.267 17540
358 1 6 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.577 -0.225 17540
359 1 6 . 1 1 25 25 ASP H H 194 6.873 6.873 8.062 -1.189 17540
360 1 6 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.973 -0.353 17540
361 1 6 . 1 1 26 26 GLN H H 195 7.575 7.575 8.206 -0.631 17540
362 1 6 . 1 1 27 27 THR HA H 196 4.413 4.413 4.505 -0.092 17540
363 1 6 . 1 1 27 27 THR H H 196 7.632 7.632 7.331 0.301 17540
364 1 6 . 1 1 28 28 THR HA H 197 5.298 5.298 4.533 0.765 17540
365 1 6 . 1 1 28 28 THR H H 197 8.056 8.056 8.403 -0.347 17540
366 1 6 . 1 1 29 29 THR HA H 198 4.633 4.633 4.768 -0.135 17540
367 1 6 . 1 1 29 29 THR H H 198 9.007 9.007 8.255 0.752 17540
368 1 6 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.874 0.012 17540
369 1 6 . 1 1 30 30 TRP H H 199 8.518 8.518 8.662 -0.144 17540
370 1 6 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.410 -0.393 17540
371 1 6 . 1 1 31 31 GLN H H 200 8.453 8.453 7.779 0.674 17540
372 1 6 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.175 -1.811 17540
373 1 6 . 1 1 32 32 ASP H H 201 8.083 8.083 8.503 -0.420 17540
374 1 6 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.122 -0.336 17540
375 1 6 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.131 -0.413 17540
376 1 6 . 1 1 34 34 ARG H H 203 8.145 8.145 7.592 0.553 17540
377 1 6 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.327 -0.592 17540
378 1 6 . 1 1 35 35 LYS H H 204 6.954 6.954 7.927 -0.973 17540
379 1 7 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.058 -0.037 17540
380 1 7 . 1 1 2 2 VAL H H 171 7.178 7.178 8.176 -0.998 17540
381 1 7 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.360 -0.226 17540
382 1 7 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.607 -0.599 17540
383 1 7 . 1 1 4 4 LEU H H 173 8.380 8.380 7.253 1.127 17540
384 1 7 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.342 -0.072 17540
385 1 7 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.358 -0.372 17540
386 1 7 . 1 1 6 6 ALA H H 175 8.264 8.264 8.513 -0.249 17540
387 1 7 . 1 1 7 7 GLY H H 176 8.592 8.592 8.488 0.104 17540
388 1 7 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.853 -0.346 17540
389 1 7 . 1 1 8 8 TRP H H 177 7.519 7.519 7.743 -0.224 17540
390 1 7 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.744 -0.217 17540
391 1 7 . 1 1 9 9 GLU H H 178 9.269 9.269 9.143 0.126 17540
392 1 7 . 1 1 10 10 MET HA H 179 4.228 4.228 4.794 -0.566 17540
393 1 7 . 1 1 10 10 MET H H 179 8.833 8.833 8.687 0.146 17540
394 1 7 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.413 -0.263 17540
395 1 7 . 1 1 11 11 ALA H H 180 8.195 8.195 8.415 -0.220 17540
396 1 7 . 1 1 12 12 LYS HA H 181 5.245 5.245 5.057 0.188 17540
397 1 7 . 1 1 12 12 LYS H H 181 7.878 7.878 8.231 -0.353 17540
398 1 7 . 1 1 13 13 THR HA H 182 4.232 4.232 4.646 -0.414 17540
399 1 7 . 1 1 13 13 THR H H 182 9.008 9.008 8.968 0.040 17540
400 1 7 . 1 1 14 14 SER HA H 183 4.065 4.065 4.315 -0.250 17540
401 1 7 . 1 1 14 14 SER H H 183 8.473 8.473 8.928 -0.456 17540
402 1 7 . 1 1 15 15 SER HA H 184 4.405 4.405 4.489 -0.084 17540
403 1 7 . 1 1 15 15 SER H H 184 7.975 7.975 7.898 0.077 17540
404 1 7 . 1 1 16 16 GLY H H 185 7.972 7.972 8.085 -0.113 17540
405 1 7 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.740 -0.519 17540
406 1 7 . 1 1 17 17 GLN H H 186 7.379 7.379 7.937 -0.558 17540
407 1 7 . 1 1 18 18 ARG HA H 187 4.239 4.239 5.029 -0.790 17540
408 1 7 . 1 1 18 18 ARG H H 187 8.775 8.775 8.700 0.075 17540
409 1 7 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.589 -0.122 17540
410 1 7 . 1 1 19 19 TYR H H 188 8.452 8.452 7.853 0.599 17540
411 1 7 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.552 -0.450 17540
412 1 7 . 1 1 20 20 PHE H H 189 8.695 8.695 8.778 -0.083 17540
413 1 7 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.818 -0.287 17540
414 1 7 . 1 1 21 21 LEU H H 190 9.185 9.185 8.211 0.974 17540
415 1 7 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.550 -0.859 17540
416 1 7 . 1 1 22 22 ASN H H 191 8.135 8.135 8.602 -0.467 17540
417 1 7 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.336 -0.260 17540
418 1 7 . 1 1 23 23 HIS H H 192 8.502 8.502 9.018 -0.516 17540
419 1 7 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.009 -0.398 17540
420 1 7 . 1 1 24 24 ILE H H 193 8.024 8.024 7.980 0.044 17540
421 1 7 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.640 -0.288 17540
422 1 7 . 1 1 25 25 ASP H H 194 6.873 6.873 7.850 -0.977 17540
423 1 7 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.882 -0.262 17540
424 1 7 . 1 1 26 26 GLN H H 195 7.575 7.575 8.197 -0.622 17540
425 1 7 . 1 1 27 27 THR HA H 196 4.413 4.413 4.570 -0.157 17540
426 1 7 . 1 1 27 27 THR H H 196 7.632 7.632 7.270 0.362 17540
427 1 7 . 1 1 28 28 THR HA H 197 5.298 5.298 4.521 0.777 17540
428 1 7 . 1 1 28 28 THR H H 197 8.056 8.056 8.401 -0.345 17540
429 1 7 . 1 1 29 29 THR HA H 198 4.633 4.633 4.740 -0.107 17540
430 1 7 . 1 1 29 29 THR H H 198 9.007 9.007 8.685 0.322 17540
431 1 7 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.591 0.295 17540
432 1 7 . 1 1 30 30 TRP H H 199 8.518 8.518 8.931 -0.413 17540
433 1 7 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.404 -0.387 17540
434 1 7 . 1 1 31 31 GLN H H 200 8.453 8.453 7.894 0.559 17540
435 1 7 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.768 -2.404 17540
436 1 7 . 1 1 32 32 ASP H H 201 8.083 8.083 8.583 -0.500 17540
437 1 7 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.324 -0.538 17540
438 1 7 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.333 -0.616 17540
439 1 7 . 1 1 34 34 ARG H H 203 8.145 8.145 7.998 0.147 17540
440 1 7 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.334 -0.599 17540
441 1 7 . 1 1 35 35 LYS H H 204 6.954 6.954 7.800 -0.846 17540
442 1 8 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.102 -0.081 17540
443 1 8 . 1 1 2 2 VAL H H 171 7.178 7.178 8.094 -0.916 17540
444 1 8 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.265 -0.131 17540
445 1 8 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.569 -0.561 17540
446 1 8 . 1 1 4 4 LEU H H 173 8.380 8.380 7.607 0.773 17540
447 1 8 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.664 -0.394 17540
448 1 8 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.320 -0.334 17540
449 1 8 . 1 1 6 6 ALA H H 175 8.264 8.264 8.540 -0.276 17540
450 1 8 . 1 1 7 7 GLY H H 176 8.592 8.592 8.500 0.092 17540
451 1 8 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.579 -0.072 17540
452 1 8 . 1 1 8 8 TRP H H 177 7.519 7.519 7.445 0.074 17540
453 1 8 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.517 0.010 17540
454 1 8 . 1 1 9 9 GLU H H 178 9.269 9.269 8.900 0.368 17540
455 1 8 . 1 1 10 10 MET HA H 179 4.228 4.228 4.568 -0.340 17540
456 1 8 . 1 1 10 10 MET H H 179 8.833 8.833 8.673 0.160 17540
457 1 8 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.441 -0.291 17540
458 1 8 . 1 1 11 11 ALA H H 180 8.195 8.195 8.395 -0.200 17540
459 1 8 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.604 0.641 17540
460 1 8 . 1 1 12 12 LYS H H 181 7.878 7.878 8.366 -0.488 17540
461 1 8 . 1 1 13 13 THR HA H 182 4.232 4.232 4.641 -0.409 17540
462 1 8 . 1 1 13 13 THR H H 182 9.008 9.008 8.491 0.517 17540
463 1 8 . 1 1 14 14 SER HA H 183 4.065 4.065 4.264 -0.199 17540
464 1 8 . 1 1 14 14 SER H H 183 8.473 8.473 9.110 -0.637 17540
465 1 8 . 1 1 15 15 SER HA H 184 4.405 4.405 4.455 -0.050 17540
466 1 8 . 1 1 15 15 SER H H 184 7.975 7.975 7.985 -0.010 17540
467 1 8 . 1 1 16 16 GLY H H 185 7.972 7.972 8.007 -0.035 17540
468 1 8 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.740 -0.519 17540
469 1 8 . 1 1 17 17 GLN H H 186 7.379 7.379 7.992 -0.613 17540
470 1 8 . 1 1 18 18 ARG HA H 187 4.239 4.239 5.103 -0.864 17540
471 1 8 . 1 1 18 18 ARG H H 187 8.775 8.775 8.784 -0.009 17540
472 1 8 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.483 -0.016 17540
473 1 8 . 1 1 19 19 TYR H H 188 8.452 8.452 7.691 0.761 17540
474 1 8 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.223 -0.121 17540
475 1 8 . 1 1 20 20 PHE H H 189 8.695 8.695 8.102 0.593 17540
476 1 8 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.577 -0.046 17540
477 1 8 . 1 1 21 21 LEU H H 190 9.185 9.185 8.927 0.258 17540
478 1 8 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.313 -0.622 17540
479 1 8 . 1 1 22 22 ASN H H 191 8.135 8.135 8.681 -0.546 17540
480 1 8 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.531 -0.455 17540
481 1 8 . 1 1 23 23 HIS H H 192 8.502 8.502 8.398 0.104 17540
482 1 8 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.086 -0.475 17540
483 1 8 . 1 1 24 24 ILE H H 193 8.024 8.024 7.626 0.398 17540
484 1 8 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.644 -0.292 17540
485 1 8 . 1 1 25 25 ASP H H 194 6.873 6.873 7.766 -0.893 17540
486 1 8 . 1 1 26 26 GLN HA H 195 3.620 3.620 4.004 -0.384 17540
487 1 8 . 1 1 26 26 GLN H H 195 7.575 7.575 8.359 -0.784 17540
488 1 8 . 1 1 27 27 THR HA H 196 4.413 4.413 4.537 -0.124 17540
489 1 8 . 1 1 27 27 THR H H 196 7.632 7.632 7.498 0.134 17540
490 1 8 . 1 1 28 28 THR HA H 197 5.298 5.298 4.509 0.789 17540
491 1 8 . 1 1 28 28 THR H H 197 8.056 8.056 8.314 -0.258 17540
492 1 8 . 1 1 29 29 THR HA H 198 4.633 4.633 4.746 -0.113 17540
493 1 8 . 1 1 29 29 THR H H 198 9.007 9.007 8.131 0.876 17540
494 1 8 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.677 0.209 17540
495 1 8 . 1 1 30 30 TRP H H 199 8.518 8.518 8.699 -0.181 17540
496 1 8 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.416 -0.399 17540
497 1 8 . 1 1 31 31 GLN H H 200 8.453 8.453 7.711 0.742 17540
498 1 8 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.839 -2.475 17540
499 1 8 . 1 1 32 32 ASP H H 201 8.083 8.083 8.616 -0.533 17540
500 1 8 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.318 -0.532 17540
501 1 8 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.199 -0.481 17540
502 1 8 . 1 1 34 34 ARG H H 203 8.145 8.145 7.990 0.155 17540
503 1 8 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.186 -0.451 17540
504 1 8 . 1 1 35 35 LYS H H 204 6.954 6.954 7.674 -0.720 17540
505 1 9 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.004 0.017 17540
506 1 9 . 1 1 2 2 VAL H H 171 7.178 7.178 7.997 -0.819 17540
507 1 9 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.205 -0.071 17540
508 1 9 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.494 -0.486 17540
509 1 9 . 1 1 4 4 LEU H H 173 8.380 8.380 7.506 0.874 17540
510 1 9 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.657 -0.387 17540
511 1 9 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.318 -0.332 17540
512 1 9 . 1 1 6 6 ALA H H 175 8.264 8.264 8.678 -0.414 17540
513 1 9 . 1 1 7 7 GLY H H 176 8.592 8.592 8.623 -0.031 17540
514 1 9 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.662 -0.155 17540
515 1 9 . 1 1 8 8 TRP H H 177 7.519 7.519 7.494 0.025 17540
516 1 9 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.690 -0.163 17540
517 1 9 . 1 1 9 9 GLU H H 178 9.269 9.269 8.598 0.671 17540
518 1 9 . 1 1 10 10 MET HA H 179 4.228 4.228 4.740 -0.512 17540
519 1 9 . 1 1 10 10 MET H H 179 8.833 8.833 8.687 0.146 17540
520 1 9 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.453 -0.303 17540
521 1 9 . 1 1 11 11 ALA H H 180 8.195 8.195 8.391 -0.196 17540
522 1 9 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.850 0.395 17540
523 1 9 . 1 1 12 12 LYS H H 181 7.878 7.878 8.379 -0.501 17540
524 1 9 . 1 1 13 13 THR HA H 182 4.232 4.232 4.690 -0.458 17540
525 1 9 . 1 1 13 13 THR H H 182 9.008 9.008 8.917 0.091 17540
526 1 9 . 1 1 14 14 SER HA H 183 4.065 4.065 4.313 -0.248 17540
527 1 9 . 1 1 14 14 SER H H 183 8.473 8.473 8.799 -0.326 17540
528 1 9 . 1 1 15 15 SER HA H 184 4.405 4.405 4.428 -0.023 17540
529 1 9 . 1 1 15 15 SER H H 184 7.975 7.975 7.873 0.102 17540
530 1 9 . 1 1 16 16 GLY H H 185 7.972 7.972 7.806 0.166 17540
531 1 9 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.756 -0.535 17540
532 1 9 . 1 1 17 17 GLN H H 186 7.379 7.379 7.805 -0.426 17540
533 1 9 . 1 1 18 18 ARG HA H 187 4.239 4.239 5.394 -1.155 17540
534 1 9 . 1 1 18 18 ARG H H 187 8.775 8.775 8.921 -0.146 17540
535 1 9 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.307 0.160 17540
536 1 9 . 1 1 19 19 TYR H H 188 8.452 8.452 7.992 0.460 17540
537 1 9 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.361 -0.259 17540
538 1 9 . 1 1 20 20 PHE H H 189 8.695 8.695 8.741 -0.046 17540
539 1 9 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.779 -0.248 17540
540 1 9 . 1 1 21 21 LEU H H 190 9.185 9.185 7.963 1.222 17540
541 1 9 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.656 -0.965 17540
542 1 9 . 1 1 22 22 ASN H H 191 8.135 8.135 8.502 -0.367 17540
543 1 9 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.398 -0.322 17540
544 1 9 . 1 1 23 23 HIS H H 192 8.502 8.502 8.928 -0.426 17540
545 1 9 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.075 -0.464 17540
546 1 9 . 1 1 24 24 ILE H H 193 8.024 8.024 7.556 0.468 17540
547 1 9 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.692 -0.340 17540
548 1 9 . 1 1 25 25 ASP H H 194 6.873 6.873 8.104 -1.231 17540
549 1 9 . 1 1 26 26 GLN HA H 195 3.620 3.620 4.022 -0.402 17540
550 1 9 . 1 1 26 26 GLN H H 195 7.575 7.575 8.404 -0.829 17540
551 1 9 . 1 1 27 27 THR HA H 196 4.413 4.413 4.524 -0.111 17540
552 1 9 . 1 1 27 27 THR H H 196 7.632 7.632 7.403 0.229 17540
553 1 9 . 1 1 28 28 THR HA H 197 5.298 5.298 4.525 0.773 17540
554 1 9 . 1 1 28 28 THR H H 197 8.056 8.056 8.427 -0.371 17540
555 1 9 . 1 1 29 29 THR HA H 198 4.633 4.633 4.799 -0.166 17540
556 1 9 . 1 1 29 29 THR H H 198 9.007 9.007 8.414 0.593 17540
557 1 9 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.870 0.016 17540
558 1 9 . 1 1 30 30 TRP H H 199 8.518 8.518 8.743 -0.225 17540
559 1 9 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.493 -0.476 17540
560 1 9 . 1 1 31 31 GLN H H 200 8.453 8.453 7.724 0.729 17540
561 1 9 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.904 -2.540 17540
562 1 9 . 1 1 32 32 ASP H H 201 8.083 8.083 8.577 -0.494 17540
563 1 9 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.322 -0.536 17540
564 1 9 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.234 -0.516 17540
565 1 9 . 1 1 34 34 ARG H H 203 8.145 8.145 8.632 -0.487 17540
566 1 9 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.280 -0.545 17540
567 1 9 . 1 1 35 35 LYS H H 204 6.954 6.954 7.674 -0.720 17540
568 1 10 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.065 -0.044 17540
569 1 10 . 1 1 2 2 VAL H H 171 7.178 7.178 8.085 -0.907 17540
570 1 10 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.262 -0.128 17540
571 1 10 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.624 -0.616 17540
572 1 10 . 1 1 4 4 LEU H H 173 8.380 8.380 7.588 0.792 17540
573 1 10 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.697 -0.427 17540
574 1 10 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.393 -0.407 17540
575 1 10 . 1 1 6 6 ALA H H 175 8.264 8.264 8.713 -0.449 17540
576 1 10 . 1 1 7 7 GLY H H 176 8.592 8.592 8.789 -0.197 17540
577 1 10 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.554 -0.047 17540
578 1 10 . 1 1 8 8 TRP H H 177 7.519 7.519 7.544 -0.025 17540
579 1 10 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.744 -0.217 17540
580 1 10 . 1 1 9 9 GLU H H 178 9.269 9.269 8.810 0.459 17540
581 1 10 . 1 1 10 10 MET HA H 179 4.228 4.228 4.697 -0.469 17540
582 1 10 . 1 1 10 10 MET H H 179 8.833 8.833 8.823 0.010 17540
583 1 10 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.317 -0.167 17540
584 1 10 . 1 1 11 11 ALA H H 180 8.195 8.195 8.376 -0.181 17540
585 1 10 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.888 0.357 17540
586 1 10 . 1 1 12 12 LYS H H 181 7.878 7.878 7.841 0.036 17540
587 1 10 . 1 1 13 13 THR HA H 182 4.232 4.232 4.583 -0.351 17540
588 1 10 . 1 1 13 13 THR H H 182 9.008 9.008 8.883 0.125 17540
589 1 10 . 1 1 14 14 SER HA H 183 4.065 4.065 4.289 -0.224 17540
590 1 10 . 1 1 14 14 SER H H 183 8.473 8.473 8.925 -0.452 17540
591 1 10 . 1 1 15 15 SER HA H 184 4.405 4.405 4.469 -0.064 17540
592 1 10 . 1 1 15 15 SER H H 184 7.975 7.975 7.895 0.080 17540
593 1 10 . 1 1 16 16 GLY H H 185 7.972 7.972 7.864 0.108 17540
594 1 10 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.746 -0.525 17540
595 1 10 . 1 1 17 17 GLN H H 186 7.379 7.379 7.790 -0.411 17540
596 1 10 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.936 -0.697 17540
597 1 10 . 1 1 18 18 ARG H H 187 8.775 8.775 8.923 -0.148 17540
598 1 10 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.648 -0.181 17540
599 1 10 . 1 1 19 19 TYR H H 188 8.452 8.452 7.621 0.831 17540
600 1 10 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.291 -0.189 17540
601 1 10 . 1 1 20 20 PHE H H 189 8.695 8.695 8.582 0.113 17540
602 1 10 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.632 -0.101 17540
603 1 10 . 1 1 21 21 LEU H H 190 9.185 9.185 8.234 0.951 17540
604 1 10 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.294 -0.603 17540
605 1 10 . 1 1 22 22 ASN H H 191 8.135 8.135 8.659 -0.524 17540
606 1 10 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.287 -0.211 17540
607 1 10 . 1 1 23 23 HIS H H 192 8.502 8.502 8.546 -0.044 17540
608 1 10 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.218 -0.607 17540
609 1 10 . 1 1 24 24 ILE H H 193 8.024 8.024 7.674 0.350 17540
610 1 10 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.627 -0.275 17540
611 1 10 . 1 1 25 25 ASP H H 194 6.873 6.873 7.482 -0.609 17540
612 1 10 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.958 -0.338 17540
613 1 10 . 1 1 26 26 GLN H H 195 7.575 7.575 8.466 -0.891 17540
614 1 10 . 1 1 27 27 THR HA H 196 4.413 4.413 4.550 -0.137 17540
615 1 10 . 1 1 27 27 THR H H 196 7.632 7.632 7.369 0.263 17540
616 1 10 . 1 1 28 28 THR HA H 197 5.298 5.298 4.471 0.827 17540
617 1 10 . 1 1 28 28 THR H H 197 8.056 8.056 8.413 -0.357 17540
618 1 10 . 1 1 29 29 THR HA H 198 4.633 4.633 4.742 -0.109 17540
619 1 10 . 1 1 29 29 THR H H 198 9.007 9.007 8.184 0.823 17540
620 1 10 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.710 0.176 17540
621 1 10 . 1 1 30 30 TRP H H 199 8.518 8.518 8.605 -0.087 17540
622 1 10 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.372 -0.355 17540
623 1 10 . 1 1 31 31 GLN H H 200 8.453 8.453 7.724 0.729 17540
624 1 10 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.745 -2.381 17540
625 1 10 . 1 1 32 32 ASP H H 201 8.083 8.083 8.562 -0.479 17540
626 1 10 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.373 -0.587 17540
627 1 10 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.343 -0.625 17540
628 1 10 . 1 1 34 34 ARG H H 203 8.145 8.145 8.177 -0.032 17540
629 1 10 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.320 -0.585 17540
630 1 10 . 1 1 35 35 LYS H H 204 6.954 6.954 7.716 -0.762 17540
631 1 11 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.171 -0.150 17540
632 1 11 . 1 1 2 2 VAL H H 171 7.178 7.178 8.064 -0.886 17540
633 1 11 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.357 -0.223 17540
634 1 11 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.850 -0.842 17540
635 1 11 . 1 1 4 4 LEU H H 173 8.380 8.380 7.203 1.177 17540
636 1 11 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.415 -0.145 17540
637 1 11 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.461 -0.475 17540
638 1 11 . 1 1 6 6 ALA H H 175 8.264 8.264 8.375 -0.111 17540
639 1 11 . 1 1 7 7 GLY H H 176 8.592 8.592 8.346 0.246 17540
640 1 11 . 1 1 8 8 TRP HA H 177 5.507 5.507 4.767 0.740 17540
641 1 11 . 1 1 8 8 TRP H H 177 7.519 7.519 7.400 0.119 17540
642 1 11 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.211 0.316 17540
643 1 11 . 1 1 9 9 GLU H H 178 9.269 9.269 8.542 0.727 17540
644 1 11 . 1 1 10 10 MET HA H 179 4.228 4.228 4.163 0.065 17540
645 1 11 . 1 1 10 10 MET H H 179 8.833 8.833 8.432 0.401 17540
646 1 11 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.205 -0.055 17540
647 1 11 . 1 1 11 11 ALA H H 180 8.195 8.195 8.341 -0.146 17540
648 1 11 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.750 0.495 17540
649 1 11 . 1 1 12 12 LYS H H 181 7.878 7.878 7.791 0.087 17540
650 1 11 . 1 1 13 13 THR HA H 182 4.232 4.232 4.641 -0.409 17540
651 1 11 . 1 1 13 13 THR H H 182 9.008 9.008 8.702 0.306 17540
652 1 11 . 1 1 14 14 SER HA H 183 4.065 4.065 4.442 -0.377 17540
653 1 11 . 1 1 14 14 SER H H 183 8.473 8.473 8.923 -0.450 17540
654 1 11 . 1 1 15 15 SER HA H 184 4.405 4.405 4.342 0.063 17540
655 1 11 . 1 1 15 15 SER H H 184 7.975 7.975 7.591 0.384 17540
656 1 11 . 1 1 16 16 GLY H H 185 7.972 7.972 7.716 0.256 17540
657 1 11 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.781 -0.560 17540
658 1 11 . 1 1 17 17 GLN H H 186 7.379 7.379 7.706 -0.327 17540
659 1 11 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.751 -0.512 17540
660 1 11 . 1 1 18 18 ARG H H 187 8.775 8.775 8.813 -0.038 17540
661 1 11 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.489 -0.022 17540
662 1 11 . 1 1 19 19 TYR H H 188 8.452 8.452 7.956 0.496 17540
663 1 11 . 1 1 20 20 PHE HA H 189 5.102 5.102 4.980 0.122 17540
664 1 11 . 1 1 20 20 PHE H H 189 8.695 8.695 9.006 -0.311 17540
665 1 11 . 1 1 21 21 LEU HA H 190 4.531 4.531 5.155 -0.624 17540
666 1 11 . 1 1 21 21 LEU H H 190 9.185 9.185 8.496 0.689 17540
667 1 11 . 1 1 22 22 ASN HA H 191 3.691 3.691 5.254 -1.563 17540
668 1 11 . 1 1 22 22 ASN H H 191 8.135 8.135 8.383 -0.248 17540
669 1 11 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.568 -0.492 17540
670 1 11 . 1 1 23 23 HIS H H 192 8.502 8.502 8.984 -0.482 17540
671 1 11 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.128 -0.517 17540
672 1 11 . 1 1 24 24 ILE H H 193 8.024 8.024 7.845 0.179 17540
673 1 11 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.684 -0.332 17540
674 1 11 . 1 1 25 25 ASP H H 194 6.873 6.873 7.881 -1.008 17540
675 1 11 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.996 -0.376 17540
676 1 11 . 1 1 26 26 GLN H H 195 7.575 7.575 8.450 -0.875 17540
677 1 11 . 1 1 27 27 THR HA H 196 4.413 4.413 4.490 -0.077 17540
678 1 11 . 1 1 27 27 THR H H 196 7.632 7.632 7.507 0.125 17540
679 1 11 . 1 1 28 28 THR HA H 197 5.298 5.298 4.793 0.505 17540
680 1 11 . 1 1 28 28 THR H H 197 8.056 8.056 8.282 -0.226 17540
681 1 11 . 1 1 29 29 THR HA H 198 4.633 4.633 4.722 -0.089 17540
682 1 11 . 1 1 29 29 THR H H 198 9.007 9.007 9.045 -0.038 17540
683 1 11 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.854 0.032 17540
684 1 11 . 1 1 30 30 TRP H H 199 8.518 8.518 8.696 -0.178 17540
685 1 11 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.523 -0.506 17540
686 1 11 . 1 1 31 31 GLN H H 200 8.453 8.453 7.762 0.691 17540
687 1 11 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.588 -2.224 17540
688 1 11 . 1 1 32 32 ASP H H 201 8.083 8.083 8.723 -0.640 17540
689 1 11 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.261 -0.475 17540
690 1 11 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.290 -0.572 17540
691 1 11 . 1 1 34 34 ARG H H 203 8.145 8.145 8.290 -0.145 17540
692 1 11 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.133 -0.398 17540
693 1 11 . 1 1 35 35 LYS H H 204 6.954 6.954 7.678 -0.724 17540
694 1 12 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.149 -0.128 17540
695 1 12 . 1 1 2 2 VAL H H 171 7.178 7.178 8.059 -0.881 17540
696 1 12 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.152 -0.018 17540
697 1 12 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.600 -0.592 17540
698 1 12 . 1 1 4 4 LEU H H 173 8.380 8.380 7.163 1.217 17540
699 1 12 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.393 -0.123 17540
700 1 12 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.377 -0.391 17540
701 1 12 . 1 1 6 6 ALA H H 175 8.264 8.264 8.534 -0.270 17540
702 1 12 . 1 1 7 7 GLY H H 176 8.592 8.592 8.391 0.201 17540
703 1 12 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.690 -0.183 17540
704 1 12 . 1 1 8 8 TRP H H 177 7.519 7.519 7.589 -0.070 17540
705 1 12 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.698 -0.171 17540
706 1 12 . 1 1 9 9 GLU H H 178 9.269 9.269 9.059 0.210 17540
707 1 12 . 1 1 10 10 MET HA H 179 4.228 4.228 4.800 -0.572 17540
708 1 12 . 1 1 10 10 MET H H 179 8.833 8.833 8.894 -0.061 17540
709 1 12 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.454 -0.304 17540
710 1 12 . 1 1 11 11 ALA H H 180 8.195 8.195 8.272 -0.077 17540
711 1 12 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.762 0.483 17540
712 1 12 . 1 1 12 12 LYS H H 181 7.878 7.878 8.250 -0.372 17540
713 1 12 . 1 1 13 13 THR HA H 182 4.232 4.232 4.609 -0.377 17540
714 1 12 . 1 1 13 13 THR H H 182 9.008 9.008 8.576 0.432 17540
715 1 12 . 1 1 14 14 SER HA H 183 4.065 4.065 4.260 -0.195 17540
716 1 12 . 1 1 14 14 SER H H 183 8.473 8.473 8.832 -0.359 17540
717 1 12 . 1 1 15 15 SER HA H 184 4.405 4.405 4.468 -0.063 17540
718 1 12 . 1 1 15 15 SER H H 184 7.975 7.975 7.705 0.270 17540
719 1 12 . 1 1 16 16 GLY H H 185 7.972 7.972 8.135 -0.163 17540
720 1 12 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.666 -0.445 17540
721 1 12 . 1 1 17 17 GLN H H 186 7.379 7.379 7.807 -0.428 17540
722 1 12 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.615 -0.376 17540
723 1 12 . 1 1 18 18 ARG H H 187 8.775 8.775 8.979 -0.204 17540
724 1 12 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.493 -0.026 17540
725 1 12 . 1 1 19 19 TYR H H 188 8.452 8.452 7.370 1.082 17540
726 1 12 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.394 -0.292 17540
727 1 12 . 1 1 20 20 PHE H H 189 8.695 8.695 8.762 -0.067 17540
728 1 12 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.734 -0.203 17540
729 1 12 . 1 1 21 21 LEU H H 190 9.185 9.185 8.294 0.891 17540
730 1 12 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.445 -0.754 17540
731 1 12 . 1 1 22 22 ASN H H 191 8.135 8.135 8.562 -0.427 17540
732 1 12 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.365 -0.289 17540
733 1 12 . 1 1 23 23 HIS H H 192 8.502 8.502 8.899 -0.397 17540
734 1 12 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.956 -0.345 17540
735 1 12 . 1 1 24 24 ILE H H 193 8.024 8.024 7.786 0.238 17540
736 1 12 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.602 -0.250 17540
737 1 12 . 1 1 25 25 ASP H H 194 6.873 6.873 8.122 -1.249 17540
738 1 12 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.974 -0.354 17540
739 1 12 . 1 1 26 26 GLN H H 195 7.575 7.575 8.284 -0.709 17540
740 1 12 . 1 1 27 27 THR HA H 196 4.413 4.413 4.450 -0.037 17540
741 1 12 . 1 1 27 27 THR H H 196 7.632 7.632 7.344 0.288 17540
742 1 12 . 1 1 28 28 THR HA H 197 5.298 5.298 4.602 0.696 17540
743 1 12 . 1 1 28 28 THR H H 197 8.056 8.056 8.374 -0.318 17540
744 1 12 . 1 1 29 29 THR HA H 198 4.633 4.633 4.775 -0.142 17540
745 1 12 . 1 1 29 29 THR H H 198 9.007 9.007 8.446 0.561 17540
746 1 12 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.882 0.004 17540
747 1 12 . 1 1 30 30 TRP H H 199 8.518 8.518 8.690 -0.172 17540
748 1 12 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.504 -0.487 17540
749 1 12 . 1 1 31 31 GLN H H 200 8.453 8.453 7.733 0.720 17540
750 1 12 . 1 1 32 32 ASP HA H 201 2.364 2.364 5.131 -2.767 17540
751 1 12 . 1 1 32 32 ASP H H 201 8.083 8.083 8.671 -0.588 17540
752 1 12 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.430 -0.644 17540
753 1 12 . 1 1 34 34 ARG HA H 203 3.718 3.718 3.964 -0.246 17540
754 1 12 . 1 1 34 34 ARG H H 203 8.145 8.145 7.834 0.311 17540
755 1 12 . 1 1 35 35 LYS HA H 204 3.735 3.735 3.978 -0.243 17540
756 1 12 . 1 1 35 35 LYS H H 204 6.954 6.954 7.570 -0.616 17540
757 1 13 . 1 1 2 2 VAL HA H 171 4.021 4.021 3.978 0.043 17540
758 1 13 . 1 1 2 2 VAL H H 171 7.178 7.178 8.025 -0.847 17540
759 1 13 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.241 -0.107 17540
760 1 13 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.566 -0.558 17540
761 1 13 . 1 1 4 4 LEU H H 173 8.380 8.380 7.586 0.794 17540
762 1 13 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.714 -0.444 17540
763 1 13 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.312 -0.326 17540
764 1 13 . 1 1 6 6 ALA H H 175 8.264 8.264 8.573 -0.309 17540
765 1 13 . 1 1 7 7 GLY H H 176 8.592 8.592 8.533 0.059 17540
766 1 13 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.726 -0.219 17540
767 1 13 . 1 1 8 8 TRP H H 177 7.519 7.519 7.487 0.032 17540
768 1 13 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.710 -0.183 17540
769 1 13 . 1 1 9 9 GLU H H 178 9.269 9.269 9.090 0.179 17540
770 1 13 . 1 1 10 10 MET HA H 179 4.228 4.228 4.802 -0.574 17540
771 1 13 . 1 1 10 10 MET H H 179 8.833 8.833 8.737 0.096 17540
772 1 13 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.478 -0.328 17540
773 1 13 . 1 1 11 11 ALA H H 180 8.195 8.195 8.480 -0.285 17540
774 1 13 . 1 1 12 12 LYS HA H 181 5.245 5.245 5.108 0.137 17540
775 1 13 . 1 1 12 12 LYS H H 181 7.878 7.878 8.353 -0.475 17540
776 1 13 . 1 1 13 13 THR HA H 182 4.232 4.232 4.727 -0.495 17540
777 1 13 . 1 1 13 13 THR H H 182 9.008 9.008 8.963 0.045 17540
778 1 13 . 1 1 14 14 SER HA H 183 4.065 4.065 4.275 -0.210 17540
779 1 13 . 1 1 14 14 SER H H 183 8.473 8.473 8.820 -0.347 17540
780 1 13 . 1 1 15 15 SER HA H 184 4.405 4.405 4.407 -0.002 17540
781 1 13 . 1 1 15 15 SER H H 184 7.975 7.975 7.916 0.059 17540
782 1 13 . 1 1 16 16 GLY H H 185 7.972 7.972 7.893 0.079 17540
783 1 13 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.739 -0.518 17540
784 1 13 . 1 1 17 17 GLN H H 186 7.379 7.379 7.764 -0.385 17540
785 1 13 . 1 1 18 18 ARG HA H 187 4.239 4.239 5.333 -1.094 17540
786 1 13 . 1 1 18 18 ARG H H 187 8.775 8.775 8.923 -0.148 17540
787 1 13 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.520 -0.053 17540
788 1 13 . 1 1 19 19 TYR H H 188 8.452 8.452 7.864 0.588 17540
789 1 13 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.531 -0.429 17540
790 1 13 . 1 1 20 20 PHE H H 189 8.695 8.695 9.033 -0.338 17540
791 1 13 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.646 -0.115 17540
792 1 13 . 1 1 21 21 LEU H H 190 9.185 9.185 8.541 0.644 17540
793 1 13 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.774 -1.083 17540
794 1 13 . 1 1 22 22 ASN H H 191 8.135 8.135 8.572 -0.437 17540
795 1 13 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.434 -0.358 17540
796 1 13 . 1 1 23 23 HIS H H 192 8.502 8.502 8.921 -0.419 17540
797 1 13 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.191 -0.580 17540
798 1 13 . 1 1 24 24 ILE H H 193 8.024 8.024 7.788 0.236 17540
799 1 13 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.618 -0.266 17540
800 1 13 . 1 1 25 25 ASP H H 194 6.873 6.873 7.655 -0.782 17540
801 1 13 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.815 -0.195 17540
802 1 13 . 1 1 26 26 GLN H H 195 7.575 7.575 8.222 -0.647 17540
803 1 13 . 1 1 27 27 THR HA H 196 4.413 4.413 4.481 -0.068 17540
804 1 13 . 1 1 27 27 THR H H 196 7.632 7.632 7.348 0.284 17540
805 1 13 . 1 1 28 28 THR HA H 197 5.298 5.298 4.543 0.755 17540
806 1 13 . 1 1 28 28 THR H H 197 8.056 8.056 8.468 -0.412 17540
807 1 13 . 1 1 29 29 THR HA H 198 4.633 4.633 4.733 -0.100 17540
808 1 13 . 1 1 29 29 THR H H 198 9.007 9.007 8.773 0.234 17540
809 1 13 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.715 0.171 17540
810 1 13 . 1 1 30 30 TRP H H 199 8.518 8.518 8.725 -0.207 17540
811 1 13 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.488 -0.471 17540
812 1 13 . 1 1 31 31 GLN H H 200 8.453 8.453 7.684 0.769 17540
813 1 13 . 1 1 32 32 ASP HA H 201 2.364 2.364 5.032 -2.668 17540
814 1 13 . 1 1 32 32 ASP H H 201 8.083 8.083 8.636 -0.553 17540
815 1 13 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.369 -0.583 17540
816 1 13 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.369 -0.651 17540
817 1 13 . 1 1 34 34 ARG H H 203 8.145 8.145 8.353 -0.208 17540
818 1 13 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.148 -0.413 17540
819 1 13 . 1 1 35 35 LYS H H 204 6.954 6.954 7.794 -0.840 17540
820 1 14 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.063 -0.042 17540
821 1 14 . 1 1 2 2 VAL H H 171 7.178 7.178 8.121 -0.943 17540
822 1 14 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.305 -0.171 17540
823 1 14 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.669 -0.661 17540
824 1 14 . 1 1 4 4 LEU H H 173 8.380 8.380 7.247 1.133 17540
825 1 14 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.407 -0.137 17540
826 1 14 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.686 -0.700 17540
827 1 14 . 1 1 6 6 ALA H H 175 8.264 8.264 8.546 -0.282 17540
828 1 14 . 1 1 7 7 GLY H H 176 8.592 8.592 8.457 0.135 17540
829 1 14 . 1 1 8 8 TRP HA H 177 5.507 5.507 4.898 0.609 17540
830 1 14 . 1 1 8 8 TRP H H 177 7.519 7.519 7.218 0.301 17540
831 1 14 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.414 0.113 17540
832 1 14 . 1 1 9 9 GLU H H 178 9.269 9.269 8.725 0.544 17540
833 1 14 . 1 1 10 10 MET HA H 179 4.228 4.228 4.109 0.119 17540
834 1 14 . 1 1 10 10 MET H H 179 8.833 8.833 8.472 0.361 17540
835 1 14 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.232 -0.082 17540
836 1 14 . 1 1 11 11 ALA H H 180 8.195 8.195 8.374 -0.179 17540
837 1 14 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.596 0.649 17540
838 1 14 . 1 1 12 12 LYS H H 181 7.878 7.878 7.834 0.044 17540
839 1 14 . 1 1 13 13 THR HA H 182 4.232 4.232 4.596 -0.364 17540
840 1 14 . 1 1 13 13 THR H H 182 9.008 9.008 8.761 0.247 17540
841 1 14 . 1 1 14 14 SER HA H 183 4.065 4.065 4.336 -0.271 17540
842 1 14 . 1 1 14 14 SER H H 183 8.473 8.473 8.790 -0.317 17540
843 1 14 . 1 1 15 15 SER HA H 184 4.405 4.405 4.399 0.006 17540
844 1 14 . 1 1 15 15 SER H H 184 7.975 7.975 7.969 0.006 17540
845 1 14 . 1 1 16 16 GLY H H 185 7.972 7.972 7.907 0.065 17540
846 1 14 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.719 -0.498 17540
847 1 14 . 1 1 17 17 GLN H H 186 7.379 7.379 7.914 -0.535 17540
848 1 14 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.845 -0.606 17540
849 1 14 . 1 1 18 18 ARG H H 187 8.775 8.775 8.905 -0.130 17540
850 1 14 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.285 0.182 17540
851 1 14 . 1 1 19 19 TYR H H 188 8.452 8.452 8.284 0.168 17540
852 1 14 . 1 1 20 20 PHE HA H 189 5.102 5.102 4.968 0.134 17540
853 1 14 . 1 1 20 20 PHE H H 189 8.695 8.695 8.927 -0.232 17540
854 1 14 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.789 -0.258 17540
855 1 14 . 1 1 21 21 LEU H H 190 9.185 9.185 8.158 1.027 17540
856 1 14 . 1 1 22 22 ASN HA H 191 3.691 3.691 5.121 -1.430 17540
857 1 14 . 1 1 22 22 ASN H H 191 8.135 8.135 8.168 -0.033 17540
858 1 14 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.530 -0.454 17540
859 1 14 . 1 1 23 23 HIS H H 192 8.502 8.502 8.685 -0.183 17540
860 1 14 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.166 -0.555 17540
861 1 14 . 1 1 24 24 ILE H H 193 8.024 8.024 7.794 0.230 17540
862 1 14 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.696 -0.344 17540
863 1 14 . 1 1 25 25 ASP H H 194 6.873 6.873 7.856 -0.983 17540
864 1 14 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.997 -0.377 17540
865 1 14 . 1 1 26 26 GLN H H 195 7.575 7.575 8.235 -0.660 17540
866 1 14 . 1 1 27 27 THR HA H 196 4.413 4.413 4.457 -0.044 17540
867 1 14 . 1 1 27 27 THR H H 196 7.632 7.632 7.453 0.179 17540
868 1 14 . 1 1 28 28 THR HA H 197 5.298 5.298 4.588 0.710 17540
869 1 14 . 1 1 28 28 THR H H 197 8.056 8.056 8.411 -0.355 17540
870 1 14 . 1 1 29 29 THR HA H 198 4.633 4.633 4.606 0.027 17540
871 1 14 . 1 1 29 29 THR H H 198 9.007 9.007 8.627 0.380 17540
872 1 14 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.950 -0.064 17540
873 1 14 . 1 1 30 30 TRP H H 199 8.518 8.518 8.975 -0.457 17540
874 1 14 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.599 -0.582 17540
875 1 14 . 1 1 31 31 GLN H H 200 8.453 8.453 8.204 0.249 17540
876 1 14 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.547 -2.183 17540
877 1 14 . 1 1 32 32 ASP H H 201 8.083 8.083 8.750 -0.667 17540
878 1 14 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.225 -0.439 17540
879 1 14 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.237 -0.519 17540
880 1 14 . 1 1 34 34 ARG H H 203 8.145 8.145 8.177 -0.032 17540
881 1 14 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.192 -0.457 17540
882 1 14 . 1 1 35 35 LYS H H 204 6.954 6.954 8.207 -1.253 17540
883 1 15 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.171 -0.150 17540
884 1 15 . 1 1 2 2 VAL H H 171 7.178 7.178 8.043 -0.865 17540
885 1 15 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.283 -0.149 17540
886 1 15 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.588 -0.581 17540
887 1 15 . 1 1 4 4 LEU H H 173 8.380 8.380 7.253 1.127 17540
888 1 15 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.408 -0.138 17540
889 1 15 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.408 -0.422 17540
890 1 15 . 1 1 6 6 ALA H H 175 8.264 8.264 8.546 -0.282 17540
891 1 15 . 1 1 7 7 GLY H H 176 8.592 8.592 8.582 0.010 17540
892 1 15 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.791 -0.284 17540
893 1 15 . 1 1 8 8 TRP H H 177 7.519 7.519 7.618 -0.099 17540
894 1 15 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.769 -0.242 17540
895 1 15 . 1 1 9 9 GLU H H 178 9.269 9.269 9.009 0.260 17540
896 1 15 . 1 1 10 10 MET HA H 179 4.228 4.228 4.758 -0.530 17540
897 1 15 . 1 1 10 10 MET H H 179 8.833 8.833 8.859 -0.026 17540
898 1 15 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.359 -0.209 17540
899 1 15 . 1 1 11 11 ALA H H 180 8.195 8.195 8.329 -0.134 17540
900 1 15 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.904 0.341 17540
901 1 15 . 1 1 12 12 LYS H H 181 7.878 7.878 8.017 -0.139 17540
902 1 15 . 1 1 13 13 THR HA H 182 4.232 4.232 4.716 -0.484 17540
903 1 15 . 1 1 13 13 THR H H 182 9.008 9.008 8.486 0.522 17540
904 1 15 . 1 1 14 14 SER HA H 183 4.065 4.065 4.337 -0.272 17540
905 1 15 . 1 1 14 14 SER H H 183 8.473 8.473 8.788 -0.315 17540
906 1 15 . 1 1 15 15 SER HA H 184 4.405 4.405 4.451 -0.046 17540
907 1 15 . 1 1 15 15 SER H H 184 7.975 7.975 7.741 0.234 17540
908 1 15 . 1 1 16 16 GLY H H 185 7.972 7.972 7.829 0.143 17540
909 1 15 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.760 -0.539 17540
910 1 15 . 1 1 17 17 GLN H H 186 7.379 7.379 7.760 -0.381 17540
911 1 15 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.647 -0.408 17540
912 1 15 . 1 1 18 18 ARG H H 187 8.775 8.775 8.842 -0.067 17540
913 1 15 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.553 -0.086 17540
914 1 15 . 1 1 19 19 TYR H H 188 8.452 8.452 7.412 1.040 17540
915 1 15 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.392 -0.290 17540
916 1 15 . 1 1 20 20 PHE H H 189 8.695 8.695 8.739 -0.044 17540
917 1 15 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.828 -0.297 17540
918 1 15 . 1 1 21 21 LEU H H 190 9.185 9.185 8.667 0.518 17540
919 1 15 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.396 -0.705 17540
920 1 15 . 1 1 22 22 ASN H H 191 8.135 8.135 8.519 -0.384 17540
921 1 15 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.387 -0.311 17540
922 1 15 . 1 1 23 23 HIS H H 192 8.502 8.502 8.951 -0.449 17540
923 1 15 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.091 -0.480 17540
924 1 15 . 1 1 24 24 ILE H H 193 8.024 8.024 7.709 0.315 17540
925 1 15 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.505 -0.153 17540
926 1 15 . 1 1 25 25 ASP H H 194 6.873 6.873 7.596 -0.723 17540
927 1 15 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.874 -0.254 17540
928 1 15 . 1 1 26 26 GLN H H 195 7.575 7.575 7.885 -0.310 17540
929 1 15 . 1 1 27 27 THR HA H 196 4.413 4.413 4.607 -0.194 17540
930 1 15 . 1 1 27 27 THR H H 196 7.632 7.632 7.697 -0.065 17540
931 1 15 . 1 1 28 28 THR HA H 197 5.298 5.298 4.582 0.716 17540
932 1 15 . 1 1 28 28 THR H H 197 8.056 8.056 8.395 -0.339 17540
933 1 15 . 1 1 29 29 THR HA H 198 4.633 4.633 4.722 -0.089 17540
934 1 15 . 1 1 29 29 THR H H 198 9.007 9.007 8.573 0.434 17540
935 1 15 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.763 0.123 17540
936 1 15 . 1 1 30 30 TRP H H 199 8.518 8.518 8.730 -0.212 17540
937 1 15 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.453 -0.436 17540
938 1 15 . 1 1 31 31 GLN H H 200 8.453 8.453 7.788 0.664 17540
939 1 15 . 1 1 32 32 ASP HA H 201 2.364 2.364 5.031 -2.667 17540
940 1 15 . 1 1 32 32 ASP H H 201 8.083 8.083 8.586 -0.503 17540
941 1 15 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.453 -0.667 17540
942 1 15 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.402 -0.684 17540
943 1 15 . 1 1 34 34 ARG H H 203 8.145 8.145 8.073 0.072 17540
944 1 15 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.347 -0.612 17540
945 1 15 . 1 1 35 35 LYS H H 204 6.954 6.954 7.745 -0.791 17540
946 1 16 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.245 -0.224 17540
947 1 16 . 1 1 2 2 VAL H H 171 7.178 7.178 8.026 -0.848 17540
948 1 16 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.421 -0.287 17540
949 1 16 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.706 -0.698 17540
950 1 16 . 1 1 4 4 LEU H H 173 8.380 8.380 7.492 0.888 17540
951 1 16 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.424 -0.154 17540
952 1 16 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.293 -0.307 17540
953 1 16 . 1 1 6 6 ALA H H 175 8.264 8.264 8.525 -0.261 17540
954 1 16 . 1 1 7 7 GLY H H 176 8.592 8.592 8.410 0.182 17540
955 1 16 . 1 1 8 8 TRP HA H 177 5.507 5.507 4.932 0.575 17540
956 1 16 . 1 1 8 8 TRP H H 177 7.519 7.519 7.456 0.063 17540
957 1 16 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.368 0.159 17540
958 1 16 . 1 1 9 9 GLU H H 178 9.269 9.269 8.203 1.066 17540
959 1 16 . 1 1 10 10 MET HA H 179 4.228 4.228 4.226 0.002 17540
960 1 16 . 1 1 10 10 MET H H 179 8.833 8.833 8.396 0.437 17540
961 1 16 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.403 -0.253 17540
962 1 16 . 1 1 11 11 ALA H H 180 8.195 8.195 8.412 -0.217 17540
963 1 16 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.538 0.707 17540
964 1 16 . 1 1 12 12 LYS H H 181 7.878 7.878 8.295 -0.417 17540
965 1 16 . 1 1 13 13 THR HA H 182 4.232 4.232 4.686 -0.454 17540
966 1 16 . 1 1 13 13 THR H H 182 9.008 9.008 8.657 0.351 17540
967 1 16 . 1 1 14 14 SER HA H 183 4.065 4.065 4.286 -0.221 17540
968 1 16 . 1 1 14 14 SER H H 183 8.473 8.473 8.995 -0.522 17540
969 1 16 . 1 1 15 15 SER HA H 184 4.405 4.405 4.408 -0.003 17540
970 1 16 . 1 1 15 15 SER H H 184 7.975 7.975 7.954 0.021 17540
971 1 16 . 1 1 16 16 GLY H H 185 7.972 7.972 8.185 -0.213 17540
972 1 16 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.646 -0.425 17540
973 1 16 . 1 1 17 17 GLN H H 186 7.379 7.379 7.839 -0.460 17540
974 1 16 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.674 -0.435 17540
975 1 16 . 1 1 18 18 ARG H H 187 8.775 8.775 8.789 -0.014 17540
976 1 16 . 1 1 19 19 TYR HA H 188 4.467 4.467 3.920 0.547 17540
977 1 16 . 1 1 19 19 TYR H H 188 8.452 8.452 7.695 0.757 17540
978 1 16 . 1 1 20 20 PHE HA H 189 5.102 5.102 4.527 0.575 17540
979 1 16 . 1 1 20 20 PHE H H 189 8.695 8.695 8.540 0.155 17540
980 1 16 . 1 1 21 21 LEU HA H 190 4.531 4.531 5.132 -0.601 17540
981 1 16 . 1 1 21 21 LEU H H 190 9.185 9.185 7.790 1.395 17540
982 1 16 . 1 1 22 22 ASN HA H 191 3.691 3.691 5.560 -1.869 17540
983 1 16 . 1 1 22 22 ASN H H 191 8.135 8.135 8.755 -0.620 17540
984 1 16 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.466 -0.390 17540
985 1 16 . 1 1 23 23 HIS H H 192 8.502 8.502 8.897 -0.395 17540
986 1 16 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.141 -0.530 17540
987 1 16 . 1 1 24 24 ILE H H 193 8.024 8.024 7.937 0.087 17540
988 1 16 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.685 -0.333 17540
989 1 16 . 1 1 25 25 ASP H H 194 6.873 6.873 7.878 -1.004 17540
990 1 16 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.879 -0.259 17540
991 1 16 . 1 1 26 26 GLN H H 195 7.575 7.575 8.309 -0.734 17540
992 1 16 . 1 1 27 27 THR HA H 196 4.413 4.413 4.565 -0.152 17540
993 1 16 . 1 1 27 27 THR H H 196 7.632 7.632 7.404 0.228 17540
994 1 16 . 1 1 28 28 THR HA H 197 5.298 5.298 4.789 0.509 17540
995 1 16 . 1 1 28 28 THR H H 197 8.056 8.056 8.424 -0.368 17540
996 1 16 . 1 1 29 29 THR HA H 198 4.633 4.633 4.819 -0.186 17540
997 1 16 . 1 1 29 29 THR H H 198 9.007 9.007 8.988 0.019 17540
998 1 16 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.864 0.022 17540
999 1 16 . 1 1 30 30 TRP H H 199 8.518 8.518 8.773 -0.255 17540
1000 1 16 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.535 -0.518 17540
1001 1 16 . 1 1 31 31 GLN H H 200 8.453 8.453 7.682 0.771 17540
1002 1 16 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.896 -2.532 17540
1003 1 16 . 1 1 32 32 ASP H H 201 8.083 8.083 8.576 -0.493 17540
1004 1 16 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.382 -0.596 17540
1005 1 16 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.292 -0.574 17540
1006 1 16 . 1 1 34 34 ARG H H 203 8.145 8.145 8.752 -0.607 17540
1007 1 16 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.377 -0.642 17540
1008 1 16 . 1 1 35 35 LYS H H 204 6.954 6.954 7.946 -0.992 17540
1009 1 17 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.106 -0.085 17540
1010 1 17 . 1 1 2 2 VAL H H 171 7.178 7.178 8.001 -0.823 17540
1011 1 17 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.343 -0.209 17540
1012 1 17 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.659 -0.651 17540
1013 1 17 . 1 1 4 4 LEU H H 173 8.380 8.380 7.433 0.947 17540
1014 1 17 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.662 -0.392 17540
1015 1 17 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.335 -0.349 17540
1016 1 17 . 1 1 6 6 ALA H H 175 8.264 8.264 8.377 -0.113 17540
1017 1 17 . 1 1 7 7 GLY H H 176 8.592 8.592 8.572 0.020 17540
1018 1 17 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.743 -0.236 17540
1019 1 17 . 1 1 8 8 TRP H H 177 7.519 7.519 7.426 0.093 17540
1020 1 17 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.630 -0.103 17540
1021 1 17 . 1 1 9 9 GLU H H 178 9.269 9.269 9.002 0.267 17540
1022 1 17 . 1 1 10 10 MET HA H 179 4.228 4.228 4.528 -0.300 17540
1023 1 17 . 1 1 10 10 MET H H 179 8.833 8.833 8.690 0.143 17540
1024 1 17 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.359 -0.209 17540
1025 1 17 . 1 1 11 11 ALA H H 180 8.195 8.195 8.357 -0.162 17540
1026 1 17 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.888 0.357 17540
1027 1 17 . 1 1 12 12 LYS H H 181 7.878 7.878 7.973 -0.095 17540
1028 1 17 . 1 1 13 13 THR HA H 182 4.232 4.232 4.685 -0.453 17540
1029 1 17 . 1 1 13 13 THR H H 182 9.008 9.008 8.776 0.232 17540
1030 1 17 . 1 1 14 14 SER HA H 183 4.065 4.065 4.331 -0.266 17540
1031 1 17 . 1 1 14 14 SER H H 183 8.473 8.473 8.946 -0.473 17540
1032 1 17 . 1 1 15 15 SER HA H 184 4.405 4.405 4.465 -0.060 17540
1033 1 17 . 1 1 15 15 SER H H 184 7.975 7.975 7.985 -0.010 17540
1034 1 17 . 1 1 16 16 GLY H H 185 7.972 7.972 8.071 -0.099 17540
1035 1 17 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.693 -0.472 17540
1036 1 17 . 1 1 17 17 GLN H H 186 7.379 7.379 7.930 -0.551 17540
1037 1 17 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.980 -0.741 17540
1038 1 17 . 1 1 18 18 ARG H H 187 8.775 8.775 8.858 -0.083 17540
1039 1 17 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.858 -0.391 17540
1040 1 17 . 1 1 19 19 TYR H H 188 8.452 8.452 7.899 0.553 17540
1041 1 17 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.445 -0.343 17540
1042 1 17 . 1 1 20 20 PHE H H 189 8.695 8.695 8.390 0.305 17540
1043 1 17 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.738 -0.207 17540
1044 1 17 . 1 1 21 21 LEU H H 190 9.185 9.185 8.383 0.802 17540
1045 1 17 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.510 -0.819 17540
1046 1 17 . 1 1 22 22 ASN H H 191 8.135 8.135 8.748 -0.613 17540
1047 1 17 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.399 -0.323 17540
1048 1 17 . 1 1 23 23 HIS H H 192 8.502 8.502 9.051 -0.549 17540
1049 1 17 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.933 -0.322 17540
1050 1 17 . 1 1 24 24 ILE H H 193 8.024 8.024 7.797 0.227 17540
1051 1 17 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.578 -0.226 17540
1052 1 17 . 1 1 25 25 ASP H H 194 6.873 6.873 8.109 -1.236 17540
1053 1 17 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.923 -0.303 17540
1054 1 17 . 1 1 26 26 GLN H H 195 7.575 7.575 8.166 -0.591 17540
1055 1 17 . 1 1 27 27 THR HA H 196 4.413 4.413 4.471 -0.058 17540
1056 1 17 . 1 1 27 27 THR H H 196 7.632 7.632 7.386 0.246 17540
1057 1 17 . 1 1 28 28 THR HA H 197 5.298 5.298 4.428 0.870 17540
1058 1 17 . 1 1 28 28 THR H H 197 8.056 8.056 8.455 -0.399 17540
1059 1 17 . 1 1 29 29 THR HA H 198 4.633 4.633 4.741 -0.108 17540
1060 1 17 . 1 1 29 29 THR H H 198 9.007 9.007 8.418 0.589 17540
1061 1 17 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.692 0.194 17540
1062 1 17 . 1 1 30 30 TRP H H 199 8.518 8.518 8.714 -0.196 17540
1063 1 17 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.399 -0.382 17540
1064 1 17 . 1 1 31 31 GLN H H 200 8.453 8.453 7.851 0.602 17540
1065 1 17 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.500 -2.136 17540
1066 1 17 . 1 1 32 32 ASP H H 201 8.083 8.083 8.639 -0.556 17540
1067 1 17 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.396 -0.610 17540
1068 1 17 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.297 -0.579 17540
1069 1 17 . 1 1 34 34 ARG H H 203 8.145 8.145 8.255 -0.110 17540
1070 1 17 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.187 -0.452 17540
1071 1 17 . 1 1 35 35 LYS H H 204 6.954 6.954 8.385 -1.431 17540
1072 1 18 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.223 -0.202 17540
1073 1 18 . 1 1 2 2 VAL H H 171 7.178 7.178 7.898 -0.720 17540
1074 1 18 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.253 -0.119 17540
1075 1 18 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.611 -0.603 17540
1076 1 18 . 1 1 4 4 LEU H H 173 8.380 8.380 7.239 1.141 17540
1077 1 18 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.425 -0.155 17540
1078 1 18 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.354 -0.368 17540
1079 1 18 . 1 1 6 6 ALA H H 175 8.264 8.264 8.467 -0.203 17540
1080 1 18 . 1 1 7 7 GLY H H 176 8.592 8.592 8.722 -0.130 17540
1081 1 18 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.778 -0.271 17540
1082 1 18 . 1 1 8 8 TRP H H 177 7.519 7.519 7.512 0.007 17540
1083 1 18 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.783 -0.256 17540
1084 1 18 . 1 1 9 9 GLU H H 178 9.269 9.269 9.053 0.216 17540
1085 1 18 . 1 1 10 10 MET HA H 179 4.228 4.228 4.712 -0.484 17540
1086 1 18 . 1 1 10 10 MET H H 179 8.833 8.833 8.820 0.013 17540
1087 1 18 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.479 -0.329 17540
1088 1 18 . 1 1 11 11 ALA H H 180 8.195 8.195 8.577 -0.382 17540
1089 1 18 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.928 0.317 17540
1090 1 18 . 1 1 12 12 LYS H H 181 7.878 7.878 8.167 -0.289 17540
1091 1 18 . 1 1 13 13 THR HA H 182 4.232 4.232 4.617 -0.385 17540
1092 1 18 . 1 1 13 13 THR H H 182 9.008 9.008 8.760 0.248 17540
1093 1 18 . 1 1 14 14 SER HA H 183 4.065 4.065 4.299 -0.234 17540
1094 1 18 . 1 1 14 14 SER H H 183 8.473 8.473 8.796 -0.323 17540
1095 1 18 . 1 1 15 15 SER HA H 184 4.405 4.405 4.465 -0.060 17540
1096 1 18 . 1 1 15 15 SER H H 184 7.975 7.975 7.850 0.125 17540
1097 1 18 . 1 1 16 16 GLY H H 185 7.972 7.972 8.012 -0.040 17540
1098 1 18 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.694 -0.473 17540
1099 1 18 . 1 1 17 17 GLN H H 186 7.379 7.379 7.717 -0.338 17540
1100 1 18 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.963 -0.724 17540
1101 1 18 . 1 1 18 18 ARG H H 187 8.775 8.775 8.956 -0.181 17540
1102 1 18 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.738 -0.271 17540
1103 1 18 . 1 1 19 19 TYR H H 188 8.452 8.452 7.733 0.719 17540
1104 1 18 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.529 -0.427 17540
1105 1 18 . 1 1 20 20 PHE H H 189 8.695 8.695 9.045 -0.350 17540
1106 1 18 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.906 -0.375 17540
1107 1 18 . 1 1 21 21 LEU H H 190 9.185 9.185 8.720 0.465 17540
1108 1 18 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.592 -0.901 17540
1109 1 18 . 1 1 22 22 ASN H H 191 8.135 8.135 8.668 -0.533 17540
1110 1 18 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.447 -0.371 17540
1111 1 18 . 1 1 23 23 HIS H H 192 8.502 8.502 9.014 -0.512 17540
1112 1 18 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.001 -0.390 17540
1113 1 18 . 1 1 24 24 ILE H H 193 8.024 8.024 7.733 0.291 17540
1114 1 18 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.640 -0.288 17540
1115 1 18 . 1 1 25 25 ASP H H 194 6.873 6.873 8.017 -1.144 17540
1116 1 18 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.945 -0.325 17540
1117 1 18 . 1 1 26 26 GLN H H 195 7.575 7.575 8.272 -0.697 17540
1118 1 18 . 1 1 27 27 THR HA H 196 4.413 4.413 4.508 -0.095 17540
1119 1 18 . 1 1 27 27 THR H H 196 7.632 7.632 7.366 0.266 17540
1120 1 18 . 1 1 28 28 THR HA H 197 5.298 5.298 4.867 0.431 17540
1121 1 18 . 1 1 28 28 THR H H 197 8.056 8.056 8.352 -0.296 17540
1122 1 18 . 1 1 29 29 THR HA H 198 4.633 4.633 4.739 -0.106 17540
1123 1 18 . 1 1 29 29 THR H H 198 9.007 9.007 9.052 -0.045 17540
1124 1 18 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.699 0.187 17540
1125 1 18 . 1 1 30 30 TRP H H 199 8.518 8.518 8.639 -0.121 17540
1126 1 18 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.430 -0.413 17540
1127 1 18 . 1 1 31 31 GLN H H 200 8.453 8.453 7.708 0.745 17540
1128 1 18 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.848 -2.484 17540
1129 1 18 . 1 1 32 32 ASP H H 201 8.083 8.083 8.621 -0.538 17540
1130 1 18 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.402 -0.616 17540
1131 1 18 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.027 -0.309 17540
1132 1 18 . 1 1 34 34 ARG H H 203 8.145 8.145 8.234 -0.089 17540
1133 1 18 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.183 -0.448 17540
1134 1 18 . 1 1 35 35 LYS H H 204 6.954 6.954 7.813 -0.859 17540
1135 1 19 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.164 -0.143 17540
1136 1 19 . 1 1 2 2 VAL H H 171 7.178 7.178 7.992 -0.814 17540
1137 1 19 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.259 -0.125 17540
1138 1 19 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.531 -0.523 17540
1139 1 19 . 1 1 4 4 LEU H H 173 8.380 8.380 7.182 1.198 17540
1140 1 19 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.424 -0.154 17540
1141 1 19 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.368 -0.382 17540
1142 1 19 . 1 1 6 6 ALA H H 175 8.264 8.264 8.409 -0.145 17540
1143 1 19 . 1 1 7 7 GLY H H 176 8.592 8.592 8.404 0.188 17540
1144 1 19 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.689 -0.182 17540
1145 1 19 . 1 1 8 8 TRP H H 177 7.519 7.519 7.534 -0.015 17540
1146 1 19 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.719 -0.192 17540
1147 1 19 . 1 1 9 9 GLU H H 178 9.269 9.269 9.141 0.128 17540
1148 1 19 . 1 1 10 10 MET HA H 179 4.228 4.228 4.864 -0.636 17540
1149 1 19 . 1 1 10 10 MET H H 179 8.833 8.833 8.708 0.125 17540
1150 1 19 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.421 -0.271 17540
1151 1 19 . 1 1 11 11 ALA H H 180 8.195 8.195 8.369 -0.174 17540
1152 1 19 . 1 1 12 12 LYS HA H 181 5.245 5.245 5.307 -0.062 17540
1153 1 19 . 1 1 12 12 LYS H H 181 7.878 7.878 8.080 -0.202 17540
1154 1 19 . 1 1 13 13 THR HA H 182 4.232 4.232 4.687 -0.455 17540
1155 1 19 . 1 1 13 13 THR H H 182 9.008 9.008 8.996 0.012 17540
1156 1 19 . 1 1 14 14 SER HA H 183 4.065 4.065 4.282 -0.217 17540
1157 1 19 . 1 1 14 14 SER H H 183 8.473 8.473 8.949 -0.476 17540
1158 1 19 . 1 1 15 15 SER HA H 184 4.405 4.405 4.468 -0.063 17540
1159 1 19 . 1 1 15 15 SER H H 184 7.975 7.975 7.773 0.202 17540
1160 1 19 . 1 1 16 16 GLY H H 185 7.972 7.972 7.869 0.103 17540
1161 1 19 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.786 -0.565 17540
1162 1 19 . 1 1 17 17 GLN H H 186 7.379 7.379 7.866 -0.487 17540
1163 1 19 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.997 -0.758 17540
1164 1 19 . 1 1 18 18 ARG H H 187 8.775 8.775 8.841 -0.066 17540
1165 1 19 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.705 -0.238 17540
1166 1 19 . 1 1 19 19 TYR H H 188 8.452 8.452 7.788 0.664 17540
1167 1 19 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.405 -0.303 17540
1168 1 19 . 1 1 20 20 PHE H H 189 8.695 8.695 8.816 -0.121 17540
1169 1 19 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.877 -0.346 17540
1170 1 19 . 1 1 21 21 LEU H H 190 9.185 9.185 8.162 1.023 17540
1171 1 19 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.689 -0.998 17540
1172 1 19 . 1 1 22 22 ASN H H 191 8.135 8.135 8.745 -0.610 17540
1173 1 19 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.361 -0.285 17540
1174 1 19 . 1 1 23 23 HIS H H 192 8.502 8.502 8.859 -0.357 17540
1175 1 19 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.981 -0.370 17540
1176 1 19 . 1 1 24 24 ILE H H 193 8.024 8.024 7.856 0.168 17540
1177 1 19 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.666 -0.314 17540
1178 1 19 . 1 1 25 25 ASP H H 194 6.873 6.873 8.208 -1.335 17540
1179 1 19 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.992 -0.372 17540
1180 1 19 . 1 1 26 26 GLN H H 195 7.575 7.575 8.320 -0.745 17540
1181 1 19 . 1 1 27 27 THR HA H 196 4.413 4.413 4.508 -0.095 17540
1182 1 19 . 1 1 27 27 THR H H 196 7.632 7.632 7.409 0.223 17540
1183 1 19 . 1 1 28 28 THR HA H 197 5.298 5.298 4.877 0.421 17540
1184 1 19 . 1 1 28 28 THR H H 197 8.056 8.056 8.525 -0.469 17540
1185 1 19 . 1 1 29 29 THR HA H 198 4.633 4.633 4.712 -0.079 17540
1186 1 19 . 1 1 29 29 THR H H 198 9.007 9.007 9.025 -0.018 17540
1187 1 19 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.716 0.170 17540
1188 1 19 . 1 1 30 30 TRP H H 199 8.518 8.518 8.712 -0.194 17540
1189 1 19 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.450 -0.433 17540
1190 1 19 . 1 1 31 31 GLN H H 200 8.453 8.453 7.738 0.715 17540
1191 1 19 . 1 1 32 32 ASP HA H 201 2.364 2.364 5.077 -2.713 17540
1192 1 19 . 1 1 32 32 ASP H H 201 8.083 8.083 8.656 -0.573 17540
1193 1 19 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.298 -0.512 17540
1194 1 19 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.246 -0.528 17540
1195 1 19 . 1 1 34 34 ARG H H 203 8.145 8.145 8.614 -0.469 17540
1196 1 19 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.353 -0.618 17540
1197 1 19 . 1 1 35 35 LYS H H 204 6.954 6.954 7.764 -0.810 17540
1198 1 20 . 1 1 2 2 VAL HA H 171 4.021 4.021 4.138 -0.117 17540
1199 1 20 . 1 1 2 2 VAL H H 171 7.178 7.178 7.984 -0.806 17540
1200 1 20 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.282 -0.148 17540
1201 1 20 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.674 -0.666 17540
1202 1 20 . 1 1 4 4 LEU H H 173 8.380 8.380 7.383 0.997 17540
1203 1 20 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.428 -0.158 17540
1204 1 20 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.383 -0.397 17540
1205 1 20 . 1 1 6 6 ALA H H 175 8.264 8.264 8.487 -0.223 17540
1206 1 20 . 1 1 7 7 GLY H H 176 8.592 8.592 8.567 0.025 17540
1207 1 20 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.807 -0.300 17540
1208 1 20 . 1 1 8 8 TRP H H 177 7.519 7.519 7.577 -0.058 17540
1209 1 20 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.734 -0.207 17540
1210 1 20 . 1 1 9 9 GLU H H 178 9.269 9.269 8.837 0.432 17540
1211 1 20 . 1 1 10 10 MET HA H 179 4.228 4.228 4.685 -0.457 17540
1212 1 20 . 1 1 10 10 MET H H 179 8.833 8.833 8.785 0.048 17540
1213 1 20 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.490 -0.340 17540
1214 1 20 . 1 1 11 11 ALA H H 180 8.195 8.195 8.444 -0.249 17540
1215 1 20 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.634 0.611 17540
1216 1 20 . 1 1 12 12 LYS H H 181 7.878 7.878 8.393 -0.515 17540
1217 1 20 . 1 1 13 13 THR HA H 182 4.232 4.232 4.645 -0.413 17540
1218 1 20 . 1 1 13 13 THR H H 182 9.008 9.008 8.517 0.491 17540
1219 1 20 . 1 1 14 14 SER HA H 183 4.065 4.065 4.282 -0.217 17540
1220 1 20 . 1 1 14 14 SER H H 183 8.473 8.473 8.940 -0.467 17540
1221 1 20 . 1 1 15 15 SER HA H 184 4.405 4.405 4.425 -0.020 17540
1222 1 20 . 1 1 15 15 SER H H 184 7.975 7.975 7.993 -0.018 17540
1223 1 20 . 1 1 16 16 GLY H H 185 7.972 7.972 7.752 0.220 17540
1224 1 20 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.754 -0.533 17540
1225 1 20 . 1 1 17 17 GLN H H 186 7.379 7.379 7.778 -0.399 17540
1226 1 20 . 1 1 18 18 ARG HA H 187 4.239 4.239 5.179 -0.940 17540
1227 1 20 . 1 1 18 18 ARG H H 187 8.775 8.775 8.857 -0.082 17540
1228 1 20 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.669 -0.202 17540
1229 1 20 . 1 1 19 19 TYR H H 188 8.452 8.452 7.857 0.595 17540
1230 1 20 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.339 -0.237 17540
1231 1 20 . 1 1 20 20 PHE H H 189 8.695 8.695 8.278 0.417 17540
1232 1 20 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.759 -0.228 17540
1233 1 20 . 1 1 21 21 LEU H H 190 9.185 9.185 8.695 0.490 17540
1234 1 20 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.232 -0.541 17540
1235 1 20 . 1 1 22 22 ASN H H 191 8.135 8.135 8.360 -0.225 17540
1236 1 20 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.456 -0.380 17540
1237 1 20 . 1 1 23 23 HIS H H 192 8.502 8.502 8.822 -0.320 17540
1238 1 20 . 1 1 24 24 ILE HA H 193 3.611 3.611 3.970 -0.359 17540
1239 1 20 . 1 1 24 24 ILE H H 193 8.024 8.024 7.668 0.356 17540
1240 1 20 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.510 -0.158 17540
1241 1 20 . 1 1 25 25 ASP H H 194 6.873 6.873 7.798 -0.925 17540
1242 1 20 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.941 -0.321 17540
1243 1 20 . 1 1 26 26 GLN H H 195 7.575 7.575 8.002 -0.427 17540
1244 1 20 . 1 1 27 27 THR HA H 196 4.413 4.413 4.571 -0.158 17540
1245 1 20 . 1 1 27 27 THR H H 196 7.632 7.632 7.374 0.258 17540
1246 1 20 . 1 1 28 28 THR HA H 197 5.298 5.298 4.534 0.764 17540
1247 1 20 . 1 1 28 28 THR H H 197 8.056 8.056 8.468 -0.412 17540
1248 1 20 . 1 1 29 29 THR HA H 198 4.633 4.633 4.673 -0.040 17540
1249 1 20 . 1 1 29 29 THR H H 198 9.007 9.007 8.193 0.814 17540
1250 1 20 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.717 0.169 17540
1251 1 20 . 1 1 30 30 TRP H H 199 8.518 8.518 8.694 -0.176 17540
1252 1 20 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.377 -0.360 17540
1253 1 20 . 1 1 31 31 GLN H H 200 8.453 8.453 7.671 0.782 17540
1254 1 20 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.733 -2.369 17540
1255 1 20 . 1 1 32 32 ASP H H 201 8.083 8.083 8.630 -0.547 17540
1256 1 20 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.347 -0.561 17540
1257 1 20 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.207 -0.489 17540
1258 1 20 . 1 1 34 34 ARG H H 203 8.145 8.145 8.147 -0.002 17540
1259 1 20 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.163 -0.428 17540
1260 1 20 . 1 1 35 35 LYS H H 204 6.954 6.954 8.050 -1.096 17540
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 17540
2 1 1 "Average Difference" HA 34 0.562 0.285 0.491 17540
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17540
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 17540
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17540
6 1 1 "Average Difference" HN 31 0.593 -0.006 0.603 17540
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 17540
8 1 2 "Average Difference" HA 34 0.611 0.356 0.504 17540
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17540
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 17540
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17540
12 1 2 "Average Difference" HN 31 0.496 0.118 0.489 17540
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 17540
14 1 3 "Average Difference" HA 34 0.555 0.363 0.426 17540
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17540
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 17540
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17540
18 1 3 "Average Difference" HN 31 0.517 0.064 0.521 17540
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 17540
20 1 4 "Average Difference" HA 34 0.564 0.314 0.476 17540
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17540
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 17540
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17540
24 1 4 "Average Difference" HN 31 0.489 0.000 0.497 17540
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 17540
26 1 5 "Average Difference" HA 34 0.599 0.338 0.502 17540
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17540
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 17540
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17540
30 1 5 "Average Difference" HN 31 0.530 0.033 0.538 17540
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 17540
32 1 6 "Average Difference" HA 34 0.543 0.257 0.486 17540
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17540
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 17540
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17540
36 1 6 "Average Difference" HN 31 0.506 0.040 0.513 17540
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 17540
38 1 7 "Average Difference" HA 34 0.598 0.363 0.481 17540
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17540
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 17540
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17540
42 1 7 "Average Difference" HN 31 0.511 0.104 0.509 17540
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 17540
44 1 8 "Average Difference" HA 34 0.587 0.309 0.506 17540
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17540
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 17540
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17540
48 1 8 "Average Difference" HN 31 0.513 0.035 0.520 17540
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 17540
50 1 9 "Average Difference" HA 34 0.623 0.359 0.517 17540
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17540
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 17540
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17540
54 1 9 "Average Difference" HN 31 0.547 0.074 0.551 17540
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 17540
56 1 10 "Average Difference" HA 34 0.578 0.333 0.479 17540
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17540
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 17540
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17540
60 1 10 "Average Difference" HN 31 0.500 0.029 0.508 17540
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 17540
62 1 11 "Average Difference" HA 34 0.626 0.317 0.548 17540
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17540
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 17540
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17540
66 1 11 "Average Difference" HN 31 0.510 0.031 0.517 17540
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 17540
68 1 12 "Average Difference" HA 34 0.603 0.318 0.520 17540
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17540
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 17540
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17540
72 1 12 "Average Difference" HN 31 0.554 0.032 0.562 17540
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 17540
74 1 13 "Average Difference" HA 34 0.646 0.378 0.532 17540
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17540
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 17540
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17540
78 1 13 "Average Difference" HN 31 0.455 0.114 0.448 17540
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 17540
80 1 14 "Average Difference" HA 34 0.607 0.288 0.543 17540
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17540
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 17540
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17540
84 1 14 "Average Difference" HN 31 0.524 0.070 0.528 17540
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 17540
86 1 15 "Average Difference" HA 34 0.615 0.361 0.506 17540
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17540
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 17540
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17540
90 1 15 "Average Difference" HN 31 0.472 0.025 0.479 17540
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 17540
92 1 16 "Average Difference" HA 34 0.685 0.308 0.621 17540
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17540
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 17540
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 17540
96 1 16 "Average Difference" HN 31 0.593 0.065 0.599 17540
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 17540
98 1 17 "Average Difference" HA 34 0.552 0.331 0.448 17540
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17540
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 17540
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 17540
102 1 17 "Average Difference" HN 31 0.548 0.099 0.548 17540
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 17540
104 1 18 "Average Difference" HA 34 0.585 0.368 0.461 17540
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17540
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 17540
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 17540
108 1 18 "Average Difference" HN 31 0.493 0.115 0.487 17540
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 17540
110 1 19 "Average Difference" HA 34 0.621 0.391 0.489 17540
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17540
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 17540
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 17540
114 1 19 "Average Difference" HN 31 0.544 0.107 0.542 17540
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 17540
116 1 20 "Average Difference" HA 34 0.582 0.330 0.487 17540
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17540
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 17540
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 17540
120 1 20 "Average Difference" HN 31 0.509 0.033 0.516 17540
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 17540
_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 171 4.021 4.021 4.097 -0.076 17540
2 1 . 1 1 2 2 VAL H H 171 7.178 7.178 8.029 -0.851 17540
3 1 . 1 1 3 3 PRO HA H 172 4.134 4.134 4.281 -0.147 17540
4 1 . 1 1 4 4 LEU HA H 173 4.008 4.008 4.621 -0.613 17540
5 1 . 1 1 4 4 LEU H H 173 8.380 8.380 7.382 0.998 17540
6 1 . 1 1 5 5 PRO HA H 174 4.270 4.270 4.491 -0.221 17540
7 1 . 1 1 6 6 ALA HA H 175 3.986 3.986 4.390 -0.404 17540
8 1 . 1 1 6 6 ALA H H 175 8.264 8.264 8.509 -0.245 17540
9 1 . 1 1 7 7 GLY H H 176 8.592 8.592 8.514 0.078 17540
10 1 . 1 1 8 8 TRP HA H 177 5.507 5.507 5.560 -0.053 17540
11 1 . 1 1 8 8 TRP H H 177 7.519 7.519 7.520 -0.001 17540
12 1 . 1 1 9 9 GLU HA H 178 4.527 4.527 4.655 -0.128 17540
13 1 . 1 1 9 9 GLU H H 178 9.269 9.269 8.857 0.412 17540
14 1 . 1 1 10 10 MET HA H 179 4.228 4.228 4.559 -0.331 17540
15 1 . 1 1 10 10 MET H H 179 8.833 8.833 8.703 0.130 17540
16 1 . 1 1 11 11 ALA HA H 180 4.150 4.150 4.396 -0.246 17540
17 1 . 1 1 11 11 ALA H H 180 8.195 8.195 8.382 -0.187 17540
18 1 . 1 1 12 12 LYS HA H 181 5.245 5.245 4.803 0.442 17540
19 1 . 1 1 12 12 LYS H H 181 7.878 7.878 8.155 -0.277 17540
20 1 . 1 1 13 13 THR HA H 182 4.232 4.232 4.651 -0.419 17540
21 1 . 1 1 13 13 THR H H 182 9.008 9.008 8.714 0.294 17540
22 1 . 1 1 14 14 SER HA H 183 4.065 4.065 4.315 -0.250 17540
23 1 . 1 1 14 14 SER H H 183 8.473 8.473 8.901 -0.428 17540
24 1 . 1 1 15 15 SER HA H 184 4.405 4.405 4.446 -0.041 17540
25 1 . 1 1 15 15 SER H H 184 7.975 7.975 7.869 0.106 17540
26 1 . 1 1 16 16 GLY H H 185 7.972 7.972 7.918 0.054 17540
27 1 . 1 1 17 17 GLN HA H 186 4.221 4.221 4.740 -0.519 17540
28 1 . 1 1 17 17 GLN H H 186 7.379 7.379 7.828 -0.449 17540
29 1 . 1 1 18 18 ARG HA H 187 4.239 4.239 4.956 -0.717 17540
30 1 . 1 1 18 18 ARG H H 187 8.775 8.775 8.869 -0.094 17540
31 1 . 1 1 19 19 TYR HA H 188 4.467 4.467 4.545 -0.078 17540
32 1 . 1 1 19 19 TYR H H 188 8.452 8.452 7.758 0.694 17540
33 1 . 1 1 20 20 PHE HA H 189 5.102 5.102 5.278 -0.176 17540
34 1 . 1 1 20 20 PHE H H 189 8.695 8.695 8.678 0.017 17540
35 1 . 1 1 21 21 LEU HA H 190 4.531 4.531 4.782 -0.251 17540
36 1 . 1 1 21 21 LEU H H 190 9.185 9.185 8.408 0.777 17540
37 1 . 1 1 22 22 ASN HA H 191 3.691 3.691 4.575 -0.884 17540
38 1 . 1 1 22 22 ASN H H 191 8.135 8.135 8.593 -0.458 17540
39 1 . 1 1 23 23 HIS HA H 192 4.076 4.076 4.429 -0.353 17540
40 1 . 1 1 23 23 HIS H H 192 8.502 8.502 8.789 -0.287 17540
41 1 . 1 1 24 24 ILE HA H 193 3.611 3.611 4.047 -0.436 17540
42 1 . 1 1 24 24 ILE H H 193 8.024 8.024 7.780 0.244 17540
43 1 . 1 1 25 25 ASP HA H 194 4.352 4.352 4.616 -0.264 17540
44 1 . 1 1 25 25 ASP H H 194 6.873 6.873 7.886 -1.013 17540
45 1 . 1 1 26 26 GLN HA H 195 3.620 3.620 3.949 -0.329 17540
46 1 . 1 1 26 26 GLN H H 195 7.575 7.575 8.221 -0.646 17540
47 1 . 1 1 27 27 THR HA H 196 4.413 4.413 4.534 -0.121 17540
48 1 . 1 1 27 27 THR H H 196 7.632 7.632 7.407 0.225 17540
49 1 . 1 1 28 28 THR HA H 197 5.298 5.298 4.621 0.677 17540
50 1 . 1 1 28 28 THR H H 197 8.056 8.056 8.408 -0.352 17540
51 1 . 1 1 29 29 THR HA H 198 4.633 4.633 4.738 -0.105 17540
52 1 . 1 1 29 29 THR H H 198 9.007 9.007 8.561 0.446 17540
53 1 . 1 1 30 30 TRP HA H 199 4.886 4.886 4.769 0.117 17540
54 1 . 1 1 30 30 TRP H H 199 8.518 8.518 8.733 -0.215 17540
55 1 . 1 1 31 31 GLN HA H 200 4.017 4.017 4.454 -0.437 17540
56 1 . 1 1 31 31 GLN H H 200 8.453 8.453 7.766 0.687 17540
57 1 . 1 1 32 32 ASP HA H 201 2.364 2.364 4.782 -2.418 17540
58 1 . 1 1 32 32 ASP H H 201 8.083 8.083 8.614 -0.530 17540
59 1 . 1 1 33 33 PRO HA H 202 3.786 3.786 4.329 -0.543 17540
60 1 . 1 1 34 34 ARG HA H 203 3.718 3.718 4.237 -0.519 17540
61 1 . 1 1 34 34 ARG H H 203 8.145 8.145 8.208 -0.063 17540
62 1 . 1 1 35 35 LYS HA H 204 3.735 3.735 4.227 -0.492 17540
63 1 . 1 1 35 35 LYS H H 204 6.954 6.954 7.856 -0.902 17540
stop_
save_