Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
8698 | 1mpz RC | 5410 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H CYS 1 H CYS 1 -4.350 -4.540 1.721
2 HA CYS 1 HA CYS 1 -3.433 -7.281 2.135
3 1HB CYS 1 1HB CYS 1 -3.596 -6.064 -0.178
4 2HB CYS 1 2HB CYS 1 -2.063 -5.338 0.313
5 H THR 2 H THR 2 -1.840 -7.622 3.655
6 HA THR 2 HA THR 2 0.117 -5.563 4.168
7 HB THR 2 HB THR 2 -1.934 -6.452 6.264
8 HG1 THR 2 1HG THR 2 -1.081 -4.002 4.896
9 1HG2 THR 2 1HG2 THR 2 0.406 -6.206 7.223
10 2HG2 THR 2 2HG2 THR 2 0.462 -4.562 6.542
11 3HG2 THR 2 3HG2 THR 2 -0.725 -4.961 7.808
12 H THR 3 H THR 3 0.903 -7.668 2.922
13 HA THR 3 HA THR 3 1.332 -9.953 4.564
14 HB THR 3 HB THR 3 2.511 -8.964 1.915
15 HG1 THR 3 1HG THR 3 0.520 -10.926 2.819
16 1HG2 THR 3 1HG2 THR 3 3.822 -10.823 3.318
17 2HG2 THR 3 2HG2 THR 3 2.455 -11.854 2.833
18 3HG2 THR 3 3HG2 THR 3 3.480 -11.095 1.592
19 H GLY 4 H GLY 4 3.482 -7.254 3.454
20 1HA GLY 4 1HA GLY 4 4.943 -7.444 5.953
21 2HA GLY 4 2HA GLY 4 5.844 -7.922 4.529
22 HA PRO 5 HA PRO 5 6.626 -3.657 4.062
23 1HB PRO 5 1HB PRO 5 8.151 -3.788 1.800
24 2HB PRO 5 2HB PRO 5 8.801 -4.052 3.416
25 1HG PRO 5 1HG PRO 5 8.137 -5.996 1.299
26 2HG PRO 5 2HG PRO 5 9.222 -6.210 2.720
27 1HD PRO 5 1HD PRO 5 6.572 -7.226 2.336
28 2HD PRO 5 2HD PRO 5 7.537 -7.328 3.814
29 H CYS 6 H CYS 6 4.461 -5.390 2.458
30 HA CYS 6 HA CYS 6 2.990 -4.990 0.859
31 1HB CYS 6 1HB CYS 6 1.969 -2.677 0.940
32 2HB CYS 6 2HB CYS 6 1.946 -3.623 2.430
33 H CYS 7 H CYS 7 5.087 -2.005 0.941
34 HA CYS 7 HA CYS 7 4.927 -1.164 -1.558
35 1HB CYS 7 1HB CYS 7 6.732 -0.848 0.538
36 2HB CYS 7 2HB CYS 7 7.737 -1.302 -0.842
37 H ARG 8 H ARG 8 4.707 -2.478 -3.361
38 HA ARG 8 HA ARG 8 5.492 -3.648 -5.046
39 1HB ARG 8 1HB ARG 8 7.715 -4.115 -5.243
40 2HB ARG 8 2HB ARG 8 7.887 -3.292 -3.684
41 1HG ARG 8 1HG ARG 8 7.610 -5.468 -2.521
42 2HG ARG 8 2HG ARG 8 7.443 -6.289 -4.083
43 1HD ARG 8 1HD ARG 8 9.775 -5.071 -4.565
44 2HD ARG 8 2HD ARG 8 9.888 -5.070 -2.798
45 HE ARG 8 HE ARG 8 10.136 -7.410 -2.839
46 1HH1 ARG 8 2HH2 ARG 8 9.104 -6.280 -6.035
47 2HH1 ARG 8 1HH2 ARG 8 9.370 -7.810 -6.800
48 1HH2 ARG 8 2HH1 ARG 8 10.480 -9.397 -3.836
49 2HH2 ARG 8 1HH1 ARG 8 10.156 -9.599 -5.545
50 H GLN 9 H GLN 9 5.771 -5.110 -1.759
51 HA GLN 9 HA GLN 9 5.140 -7.704 -2.724
52 1HB GLN 9 1HB GLN 9 5.444 -6.469 0.025
53 2HB GLN 9 2HB GLN 9 4.907 -8.146 -0.173
54 1HG GLN 9 1HG GLN 9 7.191 -7.726 -1.866
55 2HG GLN 9 2HG GLN 9 7.586 -7.089 -0.262
56 1HE2 GLN 9 1HE2 GLN 9 8.913 -9.234 -1.294
57 2HE2 GLN 9 2HE2 GLN 9 8.516 -10.685 -0.437
58 H CYS 10 H CYS 10 3.441 -6.026 -0.015
59 HA CYS 10 HA CYS 10 0.935 -6.825 -1.297
60 1HB CYS 10 1HB CYS 10 1.918 -7.271 1.295
61 2HB CYS 10 2HB CYS 10 0.641 -6.065 1.468
62 H LYS 11 H LYS 11 1.557 -4.720 -2.605
63 HA LYS 11 HA LYS 11 -0.094 -2.643 -1.626
64 1HB LYS 11 1HB LYS 11 1.341 -1.419 -0.483
65 2HB LYS 11 2HB LYS 11 2.678 -2.521 -0.861
66 1HG LYS 11 1HG LYS 11 3.161 -0.240 -1.653
67 2HG LYS 11 2HG LYS 11 3.014 -1.347 -3.031
68 1HD LYS 11 1HD LYS 11 0.401 -0.418 -2.594
69 2HD LYS 11 2HD LYS 11 1.410 1.016 -2.335
70 1HE LYS 11 1HE LYS 11 2.514 -0.185 -4.611
71 2HE LYS 11 2HE LYS 11 0.772 -0.422 -4.829
72 1HZ LYS 11 1HZ LYS 11 1.295 1.698 -5.724
73 2HZ LYS 11 2HZ LYS 11 0.592 2.038 -4.296
74 3HZ LYS 11 3HZ LYS 11 2.229 2.089 -4.430
75 H LEU 12 H LEU 12 -1.177 -2.924 -3.591
76 HA LEU 12 HA LEU 12 0.443 -2.371 -5.976
77 1HB LEU 12 1HB LEU 12 -1.203 -3.531 -7.243
78 2HB LEU 12 2HB LEU 12 -0.650 -4.564 -5.913
79 HG LEU 12 HG LEU 12 -2.912 -3.270 -4.909
80 1HD1 LEU 12 1HD1 LEU 12 -3.124 -3.623 -7.848
81 2HD1 LEU 12 2HD1 LEU 12 -4.508 -4.173 -6.875
82 3HD1 LEU 12 3HD1 LEU 12 -3.954 -2.486 -6.758
83 1HD2 LEU 12 1HD2 LEU 12 -2.690 -5.436 -4.238
84 2HD2 LEU 12 2HD2 LEU 12 -3.928 -5.651 -5.500
85 3HD2 LEU 12 3HD2 LEU 12 -2.221 -6.014 -5.855
86 H LYS 13 H LYS 13 -1.342 -0.797 -3.704
87 HA LYS 13 HA LYS 13 -3.331 0.563 -4.950
88 1HB LYS 13 1HB LYS 13 -1.315 1.521 -2.914
89 2HB LYS 13 2HB LYS 13 -2.777 2.423 -3.356
90 1HG LYS 13 1HG LYS 13 -3.566 1.229 -1.537
91 2HG LYS 13 2HG LYS 13 -3.957 0.080 -2.829
92 1HD LYS 13 1HD LYS 13 -1.223 -0.309 -1.940
93 2HD LYS 13 2HD LYS 13 -2.311 -0.351 -0.541
94 1HE LYS 13 1HE LYS 13 -2.770 -1.946 -3.096
95 2HE LYS 13 2HE LYS 13 -1.923 -2.600 -1.687
96 1HZ LYS 13 1HZ LYS 13 -4.430 -3.004 -1.862
97 2HZ LYS 13 2HZ LYS 13 -3.890 -2.472 -0.422
98 3HZ LYS 13 3HZ LYS 13 -4.589 -1.415 -1.468
99 HA PRO 14 HA PRO 14 -1.534 3.107 -7.936
100 1HB PRO 14 1HB PRO 14 -3.123 5.328 -7.897
101 2HB PRO 14 2HB PRO 14 -3.584 3.827 -8.700
102 1HG PRO 14 1HG PRO 14 -4.483 4.954 -6.125
103 2HG PRO 14 2HG PRO 14 -5.286 3.708 -7.146
104 1HD PRO 14 1HD PRO 14 -3.826 3.342 -4.711
105 2HD PRO 14 2HD PRO 14 -4.461 2.069 -5.761
106 H ALA 15 H ALA 15 0.034 3.091 -5.725
107 HA ALA 15 HA ALA 15 1.523 4.284 -4.592
108 1HB ALA 15 1HB ALA 15 2.110 6.469 -6.237
109 2HB ALA 15 2HB ALA 15 2.871 4.861 -6.304
110 3HB ALA 15 3HB ALA 15 1.489 5.236 -7.360
111 H GLY 16 H GLY 16 0.519 5.049 -2.749
112 1HA GLY 16 1HA GLY 16 -0.966 7.587 -2.991
113 2HA GLY 16 2HA GLY 16 -1.147 6.399 -1.716
114 H THR 17 H THR 17 0.157 6.493 0.121
115 HA THR 17 HA THR 17 2.613 7.982 0.081
116 HB THR 17 HB THR 17 0.320 9.025 1.811
117 HG1 THR 17 1HG THR 17 -0.286 9.606 -0.281
118 1HG2 THR 17 1HG2 THR 17 3.176 9.754 1.296
119 2HG2 THR 17 2HG2 THR 17 2.026 11.111 1.234
120 3HG2 THR 17 3HG2 THR 17 2.154 10.120 2.707
121 H THR 18 H THR 18 3.276 8.247 2.621
122 HA THR 18 HA THR 18 3.256 5.500 3.537
123 HB THR 18 HB THR 18 4.740 8.066 4.263
124 HG1 THR 18 1HG THR 18 5.449 5.356 3.384
125 1HG2 THR 18 1HG2 THR 18 5.747 7.066 6.097
126 2HG2 THR 18 2HG2 THR 18 4.202 6.188 6.194
127 3HG2 THR 18 3HG2 THR 18 5.605 5.433 5.400
128 H CYS 19 H CYS 19 2.036 4.649 5.110
129 HA CYS 19 HA CYS 19 0.292 4.553 6.478
130 1HB CYS 19 1HB CYS 19 2.077 6.561 7.840
131 2HB CYS 19 2HB CYS 19 0.638 5.887 8.614
132 H TRP 20 H TRP 20 -0.704 5.826 4.387
133 HA TRP 20 HA TRP 20 -1.812 8.365 5.356
134 1HB TRP 20 1HB TRP 20 -0.618 7.683 2.936
135 2HB TRP 20 2HB TRP 20 -2.346 7.730 2.577
136 HD1 TRP 20 HD TRP 20 0.160 10.085 4.466
137 HE1 TRP 20 1HE TRP 20 -0.345 12.610 3.888
138 HE3 TRP 20 3HE TRP 20 -3.822 9.144 1.448
139 HZ2 TRP 20 2HZ TRP 20 -2.309 13.900 2.269
140 HZ3 TRP 20 3HZ TRP 20 -4.978 11.093 0.407
141 HH2 TRP 20 HH TRP 20 -4.281 13.406 0.777
142 H LYS 21 H LYS 21 -2.851 5.682 3.128
143 HA LYS 21 HA LYS 21 -4.684 4.448 3.068
144 1HB LYS 21 1HB LYS 21 -4.324 3.723 5.276
145 2HB LYS 21 2HB LYS 21 -4.861 5.261 5.973
146 1HG LYS 21 1HG LYS 21 -6.708 3.565 4.273
147 2HG LYS 21 2HG LYS 21 -6.511 3.233 6.002
148 1HD LYS 21 1HD LYS 21 -6.932 5.916 6.088
149 2HD LYS 21 2HD LYS 21 -7.848 5.532 4.621
150 1HE LYS 21 1HE LYS 21 -9.497 5.176 6.198
151 2HE LYS 21 2HE LYS 21 -8.789 3.554 6.189
152 1HZ LYS 21 1HZ LYS 21 -8.971 5.290 8.350
153 2HZ LYS 21 2HZ LYS 21 -8.203 3.855 8.323
154 3HZ LYS 21 3HZ LYS 21 -7.382 5.226 7.933
155 H THR 22 H THR 22 -6.554 4.864 1.980
156 HA THR 22 HA THR 22 -7.519 7.612 2.095
157 HB THR 22 HB THR 22 -8.536 7.045 -0.052
158 HG1 THR 22 1HG THR 22 -8.494 4.729 -0.639
159 1HG2 THR 22 1HG2 THR 22 -6.646 6.006 -1.330
160 2HG2 THR 22 2HG2 THR 22 -6.058 7.276 -0.232
161 3HG2 THR 22 3HG2 THR 22 -5.867 5.562 0.207
162 H SER 23 H SER 23 -9.237 4.447 1.729
163 HA SER 23 HA SER 23 -10.514 4.195 3.978
164 1HB SER 23 1HB SER 23 -11.511 6.667 2.660
165 2HB SER 23 2HB SER 23 -12.770 5.582 3.273
166 HG SER 23 HG SER 23 -12.169 5.985 5.322
167 H LEU 24 H LEU 24 -9.820 2.738 1.652
168 HA LEU 24 HA LEU 24 -12.196 1.286 1.234
169 1HB LEU 24 1HB LEU 24 -13.013 2.769 -0.271
170 2HB LEU 24 2HB LEU 24 -11.412 3.289 -0.826
171 HG LEU 24 HG LEU 24 -11.981 0.498 -1.479
172 1HD1 LEU 24 1HD1 LEU 24 -14.287 1.216 -1.581
173 2HD1 LEU 24 2HD1 LEU 24 -13.843 2.619 -2.582
174 3HD1 LEU 24 3HD1 LEU 24 -13.661 0.969 -3.228
175 1HD2 LEU 24 1HD2 LEU 24 -10.890 0.993 -3.432
176 2HD2 LEU 24 2HD2 LEU 24 -11.524 2.654 -3.502
177 3HD2 LEU 24 3HD2 LEU 24 -10.220 2.247 -2.362
178 H THR 25 H THR 25 -8.908 2.186 0.069
179 HA THR 25 HA THR 25 -8.385 -0.698 -0.248
180 HB THR 25 HB THR 25 -7.800 1.713 -1.923
181 HG1 THR 25 1HG THR 25 -9.169 -0.219 -2.418
182 1HG2 THR 25 1HG2 THR 25 -5.880 0.008 -2.860
183 2HG2 THR 25 2HG2 THR 25 -5.504 1.364 -1.770
184 3HG2 THR 25 3HG2 THR 25 -5.702 -0.278 -1.112
185 H SER 26 H SER 26 -6.607 2.416 0.337
186 HA SER 26 HA SER 26 -5.535 2.829 2.319
187 1HB SER 26 1HB SER 26 -6.288 0.539 3.210
188 2HB SER 26 2HB SER 26 -4.784 -0.110 2.533
189 HG SER 26 HG SER 26 -4.253 2.149 3.991
190 H HIS 27 H HIS 27 -3.812 3.968 1.505
191 HA HIS 27 HA HIS 27 -2.099 2.736 -0.430
192 1HB HIS 27 1HB HIS 27 -2.000 5.468 0.868
193 2HB HIS 27 2HB HIS 27 -1.023 4.948 -0.510
194 HD1 HIS 27 1HD HIS 27 -3.740 3.387 -1.693
195 HD2 HIS 27 2HD HIS 27 -3.170 7.454 -0.829
196 HE1 HIS 27 1HE HIS 27 -5.449 4.662 -3.096
197 HE2 HIS 27 2HE HIS 27 -5.057 7.162 -2.528
198 H TYR 28 H TYR 28 -1.623 4.269 2.835
199 HA TYR 28 HA TYR 28 0.357 4.203 4.024
200 1HB TYR 28 1HB TYR 28 -1.381 1.744 3.997
201 2HB TYR 28 2HB TYR 28 0.168 1.538 4.821
202 HD1 TYR 28 1HD TYR 28 -2.080 4.529 4.698
203 HD2 TYR 28 2HD TYR 28 -0.385 1.417 7.094
204 HE1 TYR 28 1HE TYR 28 -3.064 5.593 6.788
205 HE2 TYR 28 2HE TYR 28 -1.373 2.491 9.177
206 HH TYR 28 HH TYR 28 -2.621 4.066 9.966
207 H CYS 29 H CYS 29 1.427 4.154 1.543
208 HA CYS 29 HA CYS 29 3.819 2.974 1.808
209 1HB CYS 29 1HB CYS 29 1.842 1.026 0.697
210 2HB CYS 29 2HB CYS 29 3.498 1.019 0.086
211 H THR 30 H THR 30 3.013 1.808 -1.229
212 HA THR 30 HA THR 30 2.195 3.690 -2.890
213 HB THR 30 HB THR 30 4.775 4.552 -1.614
214 HG1 THR 30 1HG THR 30 3.091 5.992 -1.334
215 1HG2 THR 30 1HG2 THR 30 5.460 4.137 -4.011
216 2HG2 THR 30 2HG2 THR 30 4.080 5.128 -4.542
217 3HG2 THR 30 3HG2 THR 30 5.404 5.872 -3.613
218 H GLY 31 H GLY 31 4.433 1.185 -2.044
219 1HA GLY 31 1HA GLY 31 4.758 -0.692 -3.362
220 2HA GLY 31 2HA GLY 31 4.308 0.209 -4.796
221 H LYS 32 H LYS 32 6.921 -0.902 -2.796
222 HA LYS 32 HA LYS 32 8.967 -0.936 -4.249
223 1HB LYS 32 1HB LYS 32 8.621 1.034 -5.489
224 2HB LYS 32 2HB LYS 32 8.421 2.029 -4.036
225 1HG LYS 32 1HG LYS 32 10.719 1.964 -5.393
226 2HG LYS 32 2HG LYS 32 10.710 2.112 -3.627
227 1HD LYS 32 1HD LYS 32 11.361 -0.111 -3.312
228 2HD LYS 32 2HD LYS 32 10.729 -0.639 -4.881
229 1HE LYS 32 1HE LYS 32 12.612 1.089 -5.749
230 2HE LYS 32 2HE LYS 32 13.352 0.657 -4.199
231 1HZ LYS 32 1HZ LYS 32 13.815 -1.402 -4.978
232 2HZ LYS 32 2HZ LYS 32 12.361 -1.608 -5.682
233 3HZ LYS 32 3HZ LYS 32 13.530 -0.751 -6.460
234 H SER 33 H SER 33 9.391 1.918 -2.197
235 HA SER 33 HA SER 33 10.514 0.120 -0.193
236 1HB SER 33 1HB SER 33 11.398 2.754 -1.317
237 2HB SER 33 2HB SER 33 11.748 2.444 0.395
238 HG SER 33 HG SER 33 13.341 1.163 -0.218
239 H CYS 34 H CYS 34 8.410 -0.063 0.879
240 HA CYS 34 HA CYS 34 7.763 2.376 2.364
241 1HB CYS 34 1HB CYS 34 5.710 0.381 1.417
242 2HB CYS 34 2HB CYS 34 5.424 1.925 2.228
243 H ASP 35 H ASP 35 5.931 1.311 4.166
244 HA ASP 35 HA ASP 35 6.607 -1.223 5.087
245 1HB ASP 35 1HB ASP 35 8.697 0.229 5.655
246 2HB ASP 35 2HB ASP 35 7.672 0.989 6.881
247 HD2 ASP 35 HD ASP 35 9.352 -2.504 7.585
248 H CYS 36 H CYS 36 4.276 0.450 4.527
249 HA CYS 36 HA CYS 36 3.198 0.725 7.240
250 1HB CYS 36 1HB CYS 36 2.935 2.490 4.850
251 2HB CYS 36 2HB CYS 36 1.564 2.353 5.955
252 HA PRO 37 HA PRO 37 0.398 -2.273 5.735
253 1HB PRO 37 1HB PRO 37 -1.404 -2.256 7.789
254 2HB PRO 37 2HB PRO 37 0.107 -3.161 7.840
255 1HG PRO 37 1HG PRO 37 -0.624 -0.615 9.139
256 2HG PRO 37 2HG PRO 37 0.703 -1.756 9.569
257 1HD PRO 37 1HD PRO 37 0.888 0.769 8.230
258 2HD PRO 37 2HD PRO 37 2.200 -0.388 8.485
259 H LEU 38 H LEU 38 -0.826 -2.035 3.983
260 HA LEU 38 HA LEU 38 -2.637 0.250 4.055
261 1HB LEU 38 1HB LEU 38 -2.787 -0.861 1.552
262 2HB LEU 38 2HB LEU 38 -1.798 0.528 2.034
263 HG LEU 38 HG LEU 38 -0.351 -1.864 2.629
264 1HD1 LEU 38 1HD1 LEU 38 -1.110 -3.306 1.098
265 2HD1 LEU 38 2HD1 LEU 38 -1.981 -2.045 0.195
266 3HD1 LEU 38 3HD1 LEU 38 -0.241 -2.295 -0.080
267 1HD2 LEU 38 1HD2 LEU 38 0.186 0.068 0.370
268 2HD2 LEU 38 2HD2 LEU 38 0.456 0.483 2.079
269 3HD2 LEU 38 3HD2 LEU 38 1.351 -0.867 1.338
270 H TYR 39 H TYR 39 -3.948 -0.970 5.725
271 HA TYR 39 HA TYR 39 -6.282 -1.889 4.660
272 1HB TYR 39 1HB TYR 39 -5.340 -3.903 3.817
273 2HB TYR 39 2HB TYR 39 -4.063 -3.926 5.037
274 HD1 TYR 39 1HD TYR 39 -4.175 -5.595 6.638
275 HD2 TYR 39 2HD TYR 39 -7.808 -4.209 4.852
276 HE1 TYR 39 1HE TYR 39 -5.491 -7.327 7.954
277 HE2 TYR 39 2HE TYR 39 -9.112 -5.947 6.174
278 HH TYR 39 HH TYR 39 -7.589 -8.514 7.766
279 HA PRO 40 HA PRO 40 -6.376 -1.186 9.062
280 1HB PRO 40 1HB PRO 40 -8.662 0.309 9.077
281 2HB PRO 40 2HB PRO 40 -7.053 1.010 8.932
282 1HG PRO 40 1HG PRO 40 -9.119 0.566 6.874
283 2HG PRO 40 2HG PRO 40 -7.715 1.692 6.831
284 1HD PRO 40 1HD PRO 40 -8.031 -0.811 5.479
285 2HD PRO 40 2HD PRO 40 -6.569 0.181 5.532
286 H GLY 41 H GLY 41 -6.935 -2.774 10.399
287 1HA GLY 41 1HA GLY 41 -9.663 -3.624 10.471
288 2HA GLY 41 2HA GLY 41 -8.639 -4.803 9.677
Start of MODEL 2
1 H CYS 1 H CYS 1 -1.823 -3.345 2.229
2 HA CYS 1 HA CYS 1 -3.790 -4.339 1.925
3 1HB CYS 1 1HB CYS 1 -4.117 -5.871 0.357
4 2HB CYS 1 2HB CYS 1 -2.405 -5.646 -0.011
5 H THR 2 H THR 2 -1.090 -6.507 3.007
6 HA THR 2 HA THR 2 -1.801 -6.615 5.648
7 HB THR 2 HB THR 2 -3.774 -7.926 4.118
8 HG1 THR 2 1HG THR 2 -2.860 -8.468 6.850
9 1HG2 THR 2 1HG2 THR 2 -2.179 -9.998 5.694
10 2HG2 THR 2 2HG2 THR 2 -3.593 -10.270 4.646
11 3HG2 THR 2 3HG2 THR 2 -2.021 -9.845 3.927
12 H THR 3 H THR 3 -0.185 -7.711 2.819
13 HA THR 3 HA THR 3 1.262 -9.870 3.813
14 HB THR 3 HB THR 3 2.201 -7.725 1.842
15 HG1 THR 3 1HG THR 3 0.442 -10.070 1.661
16 1HG2 THR 3 1HG2 THR 3 3.922 -9.261 1.690
17 2HG2 THR 3 2HG2 THR 3 2.985 -10.529 2.516
18 3HG2 THR 3 3HG2 THR 3 2.729 -10.221 0.782
19 H GLY 4 H GLY 4 3.759 -7.850 3.007
20 1HA GLY 4 1HA GLY 4 4.410 -7.438 5.860
21 2HA GLY 4 2HA GLY 4 5.567 -7.749 4.580
22 HA PRO 5 HA PRO 5 5.914 -3.407 4.353
23 1HB PRO 5 1HB PRO 5 7.740 -3.266 2.327
24 2HB PRO 5 2HB PRO 5 8.187 -3.536 4.010
25 1HG PRO 5 1HG PRO 5 8.044 -5.435 1.760
26 2HG PRO 5 2HG PRO 5 8.941 -5.600 3.311
27 1HD PRO 5 1HD PRO 5 6.501 -6.873 2.521
28 2HD PRO 5 2HD PRO 5 7.258 -6.943 4.119
29 H CYS 6 H CYS 6 4.183 -5.275 2.419
30 HA CYS 6 HA CYS 6 2.742 -4.913 0.806
31 1HB CYS 6 1HB CYS 6 1.530 -2.917 0.738
32 2HB CYS 6 2HB CYS 6 2.032 -3.117 2.420
33 H CYS 7 H CYS 7 5.332 -2.368 0.821
34 HA CYS 7 HA CYS 7 5.340 -1.642 -1.770
35 1HB CYS 7 1HB CYS 7 7.387 -1.853 0.342
36 2HB CYS 7 2HB CYS 7 8.012 -1.745 -1.307
37 H ARG 8 H ARG 8 4.928 -3.152 -3.399
38 HA ARG 8 HA ARG 8 5.662 -4.534 -4.959
39 1HB ARG 8 1HB ARG 8 7.675 -5.804 -3.070
40 2HB ARG 8 2HB ARG 8 7.714 -5.780 -4.841
41 1HG ARG 8 1HG ARG 8 7.647 -3.071 -3.776
42 2HG ARG 8 2HG ARG 8 8.991 -3.976 -3.055
43 1HD ARG 8 1HD ARG 8 8.503 -4.101 -6.037
44 2HD ARG 8 2HD ARG 8 9.337 -2.698 -5.350
45 HE ARG 8 HE ARG 8 10.432 -5.243 -4.426
46 1HH1 ARG 8 2HH2 ARG 8 10.538 -2.868 -7.054
47 2HH1 ARG 8 1HH2 ARG 8 12.129 -3.322 -7.565
48 1HH2 ARG 8 2HH1 ARG 8 12.498 -5.828 -5.094
49 2HH2 ARG 8 1HH1 ARG 8 13.256 -5.015 -6.447
50 H GLN 9 H GLN 9 4.982 -5.353 -1.619
51 HA GLN 9 HA GLN 9 4.294 -8.068 -2.305
52 1HB GLN 9 1HB GLN 9 4.662 -6.498 0.214
53 2HB GLN 9 2HB GLN 9 3.538 -7.865 0.284
54 1HG GLN 9 1HG GLN 9 6.365 -8.068 -0.826
55 2HG GLN 9 2HG GLN 9 5.977 -8.388 0.872
56 1HE2 GLN 9 1HE2 GLN 9 6.507 -10.516 0.841
57 2HE2 GLN 9 2HE2 GLN 9 5.627 -11.737 -0.018
58 H CYS 10 H CYS 10 2.454 -6.044 0.005
59 HA CYS 10 HA CYS 10 0.115 -6.449 -1.714
60 1HB CYS 10 1HB CYS 10 0.581 -6.988 1.078
61 2HB CYS 10 2HB CYS 10 -0.748 -5.837 0.892
62 H LYS 11 H LYS 11 1.258 -4.386 -2.713
63 HA LYS 11 HA LYS 11 -0.129 -2.109 -1.597
64 1HB LYS 11 1HB LYS 11 1.610 -0.904 -0.893
65 2HB LYS 11 2HB LYS 11 2.443 -2.461 -0.759
66 1HG LYS 11 1HG LYS 11 3.981 -1.559 -2.155
67 2HG LYS 11 2HG LYS 11 2.789 -1.805 -3.444
68 1HD LYS 11 1HD LYS 11 3.638 0.692 -2.048
69 2HD LYS 11 2HD LYS 11 3.134 0.461 -3.730
70 1HE LYS 11 1HE LYS 11 0.791 -0.070 -2.410
71 2HE LYS 11 2HE LYS 11 1.510 1.117 -1.313
72 1HZ LYS 11 1HZ LYS 11 0.861 1.469 -4.180
73 2HZ LYS 11 2HZ LYS 11 0.316 2.347 -2.923
74 3HZ LYS 11 3HZ LYS 11 1.893 2.461 -3.373
75 H LEU 12 H LEU 12 -0.316 -3.922 -3.954
76 HA LEU 12 HA LEU 12 0.796 -2.795 -6.218
77 1HB LEU 12 1HB LEU 12 -0.994 -3.934 -7.420
78 2HB LEU 12 2HB LEU 12 -0.199 -4.970 -6.223
79 HG LEU 12 HG LEU 12 -2.334 -3.988 -4.807
80 1HD1 LEU 12 1HD1 LEU 12 -3.771 -3.040 -6.236
81 2HD1 LEU 12 2HD1 LEU 12 -2.968 -3.741 -7.662
82 3HD1 LEU 12 3HD1 LEU 12 -4.146 -4.706 -6.739
83 1HD2 LEU 12 1HD2 LEU 12 -1.349 -6.410 -5.422
84 2HD2 LEU 12 2HD2 LEU 12 -2.922 -6.164 -4.626
85 3HD2 LEU 12 3HD2 LEU 12 -2.848 -6.451 -6.380
86 H LYS 13 H LYS 13 -1.381 -1.407 -3.989
87 HA LYS 13 HA LYS 13 -3.224 -0.034 -5.351
88 1HB LYS 13 1HB LYS 13 -1.400 1.014 -3.179
89 2HB LYS 13 2HB LYS 13 -2.914 1.784 -3.682
90 1HG LYS 13 1HG LYS 13 -3.672 0.492 -1.915
91 2HG LYS 13 2HG LYS 13 -3.902 -0.661 -3.240
92 1HD LYS 13 1HD LYS 13 -1.187 -0.835 -2.245
93 2HD LYS 13 2HD LYS 13 -2.317 -0.982 -0.888
94 1HE LYS 13 1HE LYS 13 -3.170 -2.518 -3.248
95 2HE LYS 13 2HE LYS 13 -1.578 -3.022 -2.666
96 1HZ LYS 13 1HZ LYS 13 -3.461 -2.641 -0.536
97 2HZ LYS 13 2HZ LYS 13 -3.975 -3.769 -1.591
98 3HZ LYS 13 3HZ LYS 13 -2.492 -3.920 -0.897
99 HA PRO 14 HA PRO 14 -1.306 2.637 -8.144
100 1HB PRO 14 1HB PRO 14 -2.963 4.808 -8.172
101 2HB PRO 14 2HB PRO 14 -3.319 3.314 -9.036
102 1HG PRO 14 1HG PRO 14 -4.429 4.354 -6.507
103 2HG PRO 14 2HG PRO 14 -5.120 3.109 -7.609
104 1HD PRO 14 1HD PRO 14 -3.824 2.728 -5.084
105 2HD PRO 14 2HD PRO 14 -4.344 1.463 -6.205
106 H ALA 15 H ALA 15 -0.160 2.670 -5.542
107 HA ALA 15 HA ALA 15 1.281 3.866 -4.366
108 1HB ALA 15 1HB ALA 15 2.782 4.558 -5.892
109 2HB ALA 15 2HB ALA 15 1.508 4.818 -7.108
110 3HB ALA 15 3HB ALA 15 1.909 6.108 -5.949
111 H GLY 16 H GLY 16 1.049 5.269 -2.657
112 1HA GLY 16 1HA GLY 16 -0.738 7.573 -2.988
113 2HA GLY 16 2HA GLY 16 -1.137 6.371 -1.778
114 H THR 17 H THR 17 -0.549 7.035 0.237
115 HA THR 17 HA THR 17 2.081 8.340 0.486
116 HB THR 17 HB THR 17 -0.597 8.974 1.827
117 HG1 THR 17 1HG THR 17 0.025 9.838 -0.351
118 1HG2 THR 17 1HG2 THR 17 2.195 10.134 2.335
119 2HG2 THR 17 2HG2 THR 17 0.673 10.808 2.968
120 3HG2 THR 17 3HG2 THR 17 1.232 9.207 3.510
121 H THR 18 H THR 18 2.983 8.171 2.764
122 HA THR 18 HA THR 18 2.826 5.379 3.502
123 HB THR 18 HB THR 18 4.615 7.760 4.034
124 HG1 THR 18 1HG THR 18 6.071 6.130 3.208
125 1HG2 THR 18 1HG2 THR 18 4.279 6.739 6.303
126 2HG2 THR 18 2HG2 THR 18 4.638 5.136 5.618
127 3HG2 THR 18 3HG2 THR 18 5.903 6.387 5.665
128 H CYS 19 H CYS 19 2.009 4.494 5.356
129 HA CYS 19 HA CYS 19 0.388 4.379 6.884
130 1HB CYS 19 1HB CYS 19 1.878 6.585 8.277
131 2HB CYS 19 2HB CYS 19 1.058 5.189 8.982
132 H TRP 20 H TRP 20 -0.805 5.699 4.891
133 HA TRP 20 HA TRP 20 -1.931 8.128 6.110
134 1HB TRP 20 1HB TRP 20 -0.629 8.176 3.857
135 2HB TRP 20 2HB TRP 20 -2.116 7.502 3.185
136 HD1 TRP 20 HD TRP 20 -3.838 9.318 2.438
137 HE1 TRP 20 1HE TRP 20 -4.330 11.873 2.871
138 HE3 TRP 20 3HE TRP 20 -0.260 9.945 5.995
139 HZ2 TRP 20 2HZ TRP 20 -3.194 13.827 4.613
140 HZ3 TRP 20 3HZ TRP 20 -0.017 12.208 7.012
141 HH2 TRP 20 HH TRP 20 -1.411 14.111 6.376
142 H LYS 21 H LYS 21 -2.797 5.528 3.706
143 HA LYS 21 HA LYS 21 -4.554 4.190 3.571
144 1HB LYS 21 1HB LYS 21 -4.394 3.400 5.732
145 2HB LYS 21 2HB LYS 21 -4.787 4.965 6.465
146 1HG LYS 21 1HG LYS 21 -6.741 3.661 6.756
147 2HG LYS 21 2HG LYS 21 -7.122 4.681 5.358
148 1HD LYS 21 1HD LYS 21 -6.818 2.892 3.835
149 2HD LYS 21 2HD LYS 21 -5.910 1.918 5.004
150 1HE LYS 21 1HE LYS 21 -8.543 2.543 6.058
151 2HE LYS 21 2HE LYS 21 -8.706 1.827 4.447
152 1HZ LYS 21 1HZ LYS 21 -6.905 0.198 5.529
153 2HZ LYS 21 2HZ LYS 21 -7.680 0.629 6.896
154 3HZ LYS 21 3HZ LYS 21 -8.530 -0.025 5.647
155 H THR 22 H THR 22 -6.080 4.739 2.121
156 HA THR 22 HA THR 22 -7.231 7.367 2.197
157 HB THR 22 HB THR 22 -8.174 6.663 0.042
158 HG1 THR 22 1HG THR 22 -8.400 4.439 -0.328
159 1HG2 THR 22 1HG2 THR 22 -6.211 5.920 -1.162
160 2HG2 THR 22 2HG2 THR 22 -5.597 6.922 0.176
161 3HG2 THR 22 3HG2 THR 22 -5.531 5.147 0.291
162 H SER 23 H SER 23 -7.972 4.352 3.679
163 HA SER 23 HA SER 23 -9.573 4.127 5.233
164 1HB SER 23 1HB SER 23 -10.168 6.629 4.821
165 2HB SER 23 2HB SER 23 -11.455 6.004 3.776
166 HG SER 23 HG SER 23 -11.052 5.378 6.578
167 H LEU 24 H LEU 24 -9.605 3.858 1.836
168 HA LEU 24 HA LEU 24 -11.847 1.963 1.959
169 1HB LEU 24 1HB LEU 24 -12.289 3.934 0.586
170 2HB LEU 24 2HB LEU 24 -10.865 3.570 -0.404
171 HG LEU 24 HG LEU 24 -12.682 1.304 -0.247
172 1HD1 LEU 24 1HD1 LEU 24 -14.619 2.451 -0.198
173 2HD1 LEU 24 2HD1 LEU 24 -13.862 3.973 -0.727
174 3HD1 LEU 24 3HD1 LEU 24 -14.270 2.721 -1.923
175 1HD2 LEU 24 1HD2 LEU 24 -10.766 1.944 -1.905
176 2HD2 LEU 24 2HD2 LEU 24 -12.212 1.090 -2.494
177 3HD2 LEU 24 3HD2 LEU 24 -12.053 2.845 -2.743
178 H THR 25 H THR 25 -9.004 2.607 -0.211
179 HA THR 25 HA THR 25 -8.525 -0.269 -0.268
180 HB THR 25 HB THR 25 -7.984 2.123 -1.976
181 HG1 THR 25 1HG THR 25 -8.584 0.466 -3.475
182 1HG2 THR 25 1HG2 THR 25 -5.636 1.284 -1.425
183 2HG2 THR 25 2HG2 THR 25 -6.136 -0.316 -2.024
184 3HG2 THR 25 3HG2 THR 25 -6.092 1.077 -3.133
185 H SER 26 H SER 26 -6.827 2.802 0.597
186 HA SER 26 HA SER 26 -5.479 3.015 2.382
187 1HB SER 26 1HB SER 26 -4.690 0.091 2.220
188 2HB SER 26 2HB SER 26 -4.492 1.196 3.592
189 HG SER 26 HG SER 26 -7.122 1.126 2.973
190 H HIS 27 H HIS 27 -3.410 3.877 2.121
191 HA HIS 27 HA HIS 27 -1.964 2.904 -0.232
192 1HB HIS 27 1HB HIS 27 -2.083 5.634 1.055
193 2HB HIS 27 2HB HIS 27 -0.917 5.201 -0.201
194 HD1 HIS 27 1HD HIS 27 -2.966 7.462 -0.687
195 HD2 HIS 27 2HD HIS 27 -3.596 3.455 -1.757
196 HE1 HIS 27 1HE HIS 27 -4.714 7.485 -2.547
197 HE2 HIS 27 2HE HIS 27 -5.069 4.993 -3.170
198 H TYR 28 H TYR 28 -1.538 4.269 3.104
199 HA TYR 28 HA TYR 28 0.419 4.295 4.306
200 1HB TYR 28 1HB TYR 28 -1.045 1.710 4.009
201 2HB TYR 28 2HB TYR 28 0.582 1.490 4.662
202 HD1 TYR 28 1HD TYR 28 -2.338 3.807 5.177
203 HD2 TYR 28 2HD TYR 28 0.733 1.427 6.969
204 HE1 TYR 28 1HE TYR 28 -3.190 4.435 7.489
205 HE2 TYR 28 2HE TYR 28 -0.128 2.063 9.273
206 HH TYR 28 HH TYR 28 -2.098 4.601 9.823
207 H CYS 29 H CYS 29 1.122 4.292 1.454
208 HA CYS 29 HA CYS 29 3.746 3.936 1.502
209 1HB CYS 29 1HB CYS 29 3.957 1.651 0.264
210 2HB CYS 29 2HB CYS 29 3.960 1.732 2.027
211 H THR 30 H THR 30 4.444 2.961 -1.014
212 HA THR 30 HA THR 30 2.439 4.012 -2.870
213 HB THR 30 HB THR 30 3.998 5.881 -2.200
214 HG1 THR 30 1HG THR 30 3.332 6.079 -4.340
215 1HG2 THR 30 1HG2 THR 30 6.072 4.497 -1.818
216 2HG2 THR 30 2HG2 THR 30 6.094 4.101 -3.553
217 3HG2 THR 30 3HG2 THR 30 6.338 5.782 -3.021
218 H GLY 31 H GLY 31 5.531 2.260 -2.318
219 1HA GLY 31 1HA GLY 31 5.137 -0.044 -3.476
220 2HA GLY 31 2HA GLY 31 5.217 0.946 -4.920
221 H LYS 32 H LYS 32 7.035 -0.938 -2.803
222 HA LYS 32 HA LYS 32 9.206 -1.399 -2.775
223 1HB LYS 32 1HB LYS 32 9.183 -0.719 -5.181
224 2HB LYS 32 2HB LYS 32 9.676 0.908 -4.681
225 1HG LYS 32 1HG LYS 32 11.491 -0.865 -5.380
226 2HG LYS 32 2HG LYS 32 11.799 0.180 -3.982
227 1HD LYS 32 1HD LYS 32 11.227 -1.566 -2.443
228 2HD LYS 32 2HD LYS 32 10.514 -2.570 -3.717
229 1HE LYS 32 1HE LYS 32 12.531 -3.609 -3.781
230 2HE LYS 32 2HE LYS 32 13.116 -2.172 -4.632
231 1HZ LYS 32 1HZ LYS 32 14.407 -2.824 -2.589
232 2HZ LYS 32 2HZ LYS 32 13.892 -1.280 -2.569
233 3HZ LYS 32 3HZ LYS 32 13.077 -2.421 -1.708
234 H SER 33 H SER 33 9.364 2.200 -3.185
235 HA SER 33 HA SER 33 10.850 2.318 -0.746
236 1HB SER 33 1HB SER 33 11.078 3.705 -3.012
237 2HB SER 33 2HB SER 33 9.929 4.787 -2.205
238 HG SER 33 HG SER 33 11.423 5.277 -0.657
239 H CYS 34 H CYS 34 9.020 1.512 0.635
240 HA CYS 34 HA CYS 34 7.467 3.776 1.543
241 1HB CYS 34 1HB CYS 34 5.364 2.752 1.450
242 2HB CYS 34 2HB CYS 34 6.068 2.571 -0.159
243 H ASP 35 H ASP 35 5.849 2.144 3.355
244 HA ASP 35 HA ASP 35 7.143 0.183 4.670
245 1HB ASP 35 1HB ASP 35 8.685 2.454 4.960
246 2HB ASP 35 2HB ASP 35 7.676 2.534 6.413
247 HD2 ASP 35 HD ASP 35 10.656 1.808 6.227
248 H CYS 36 H CYS 36 4.690 -0.027 4.599
249 HA CYS 36 HA CYS 36 3.519 0.319 7.021
250 1HB CYS 36 1HB CYS 36 3.615 2.817 5.682
251 2HB CYS 36 2HB CYS 36 1.932 2.283 5.680
252 HA PRO 37 HA PRO 37 0.913 -2.213 4.590
253 1HB PRO 37 1HB PRO 37 -0.885 -2.948 6.509
254 2HB PRO 37 2HB PRO 37 0.677 -3.734 6.303
255 1HG PRO 37 1HG PRO 37 -0.206 -1.776 8.324
256 2HG PRO 37 2HG PRO 37 1.187 -2.914 8.397
257 1HD PRO 37 1HD PRO 37 1.219 -0.091 7.925
258 2HD PRO 37 2HD PRO 37 2.599 -1.191 7.829
259 H LEU 38 H LEU 38 -0.966 -2.237 3.357
260 HA LEU 38 HA LEU 38 -2.480 0.241 3.756
261 1HB LEU 38 1HB LEU 38 -2.535 -1.419 1.272
262 2HB LEU 38 2HB LEU 38 -2.873 0.309 1.477
263 HG LEU 38 HG LEU 38 -0.384 0.560 2.005
264 1HD1 LEU 38 1HD1 LEU 38 -0.520 -2.320 1.506
265 2HD1 LEU 38 2HD1 LEU 38 0.726 -1.494 0.541
266 3HD1 LEU 38 3HD1 LEU 38 0.733 -1.347 2.315
267 1HD2 LEU 38 1HD2 LEU 38 -0.416 -0.327 -0.784
268 2HD2 LEU 38 2HD2 LEU 38 -1.804 0.700 -0.351
269 3HD2 LEU 38 3HD2 LEU 38 -0.145 1.289 -0.092
270 H TYR 39 H TYR 39 -3.736 -0.698 5.513
271 HA TYR 39 HA TYR 39 -6.168 -1.737 4.647
272 1HB TYR 39 1HB TYR 39 -4.092 -3.637 4.742
273 2HB TYR 39 2HB TYR 39 -4.829 -3.816 6.338
274 HD1 TYR 39 1HD TYR 39 -5.915 -5.898 6.201
275 HD2 TYR 39 2HD TYR 39 -6.489 -3.027 3.081
276 HE1 TYR 39 1HE TYR 39 -7.723 -7.362 5.176
277 HE2 TYR 39 2HE TYR 39 -8.295 -4.501 2.067
278 HH TYR 39 HH TYR 39 -8.665 -7.296 2.277
279 HA PRO 40 HA PRO 40 -7.093 -0.501 8.687
280 1HB PRO 40 1HB PRO 40 -9.506 -1.709 9.111
281 2HB PRO 40 2HB PRO 40 -9.322 -0.225 8.182
282 1HG PRO 40 1HG PRO 40 -9.767 -2.993 7.264
283 2HG PRO 40 2HG PRO 40 -10.060 -1.455 6.376
284 1HD PRO 40 1HD PRO 40 -7.922 -3.328 6.033
285 2HD PRO 40 2HD PRO 40 -8.079 -1.752 5.247
286 H GLY 41 H GLY 41 -7.861 -3.935 8.318
287 1HA GLY 41 1HA GLY 41 -6.721 -4.334 11.013
288 2HA GLY 41 2HA GLY 41 -7.912 -5.358 10.238
Start of MODEL 3
1 H CYS 1 H CYS 1 -4.121 -2.876 1.644
2 HA CYS 1 HA CYS 1 -2.851 -4.965 0.395
3 1HB CYS 1 1HB CYS 1 -1.456 -3.224 0.465
4 2HB CYS 1 2HB CYS 1 -2.057 -2.646 2.022
5 H THR 2 H THR 2 -1.091 -6.399 1.572
6 HA THR 2 HA THR 2 -1.110 -7.111 4.174
7 HB THR 2 HB THR 2 -3.529 -7.474 4.125
8 HG1 THR 2 1HG THR 2 -2.098 -10.002 3.706
9 1HG2 THR 2 1HG2 THR 2 -4.333 -7.958 1.992
10 2HG2 THR 2 2HG2 THR 2 -2.865 -8.854 1.536
11 3HG2 THR 2 3HG2 THR 2 -4.100 -9.630 2.556
12 H THR 3 H THR 3 1.023 -7.190 3.025
13 HA THR 3 HA THR 3 1.527 -9.973 2.320
14 HB THR 3 HB THR 3 2.470 -7.646 0.572
15 HG1 THR 3 1HG THR 3 0.079 -8.080 0.636
16 1HG2 THR 3 1HG2 THR 3 2.317 -9.926 -0.974
17 2HG2 THR 3 2HG2 THR 3 3.815 -9.370 -0.187
18 3HG2 THR 3 3HG2 THR 3 2.808 -10.616 0.591
19 H GLY 4 H GLY 4 4.178 -8.296 1.332
20 1HA GLY 4 1HA GLY 4 5.507 -8.776 3.885
21 2HA GLY 4 2HA GLY 4 6.254 -8.478 2.328
22 HA PRO 5 HA PRO 5 6.795 -4.504 4.179
23 1HB PRO 5 1HB PRO 5 8.871 -3.710 2.594
24 2HB PRO 5 2HB PRO 5 9.092 -4.614 4.090
25 1HG PRO 5 1HG PRO 5 9.238 -5.521 1.286
26 2HG PRO 5 2HG PRO 5 9.924 -6.302 2.755
27 1HD PRO 5 1HD PRO 5 7.604 -7.057 1.256
28 2HD PRO 5 2HD PRO 5 8.146 -7.760 2.785
29 H CYS 6 H CYS 6 4.531 -4.594 2.934
30 HA CYS 6 HA CYS 6 3.674 -3.811 0.797
31 1HB CYS 6 1HB CYS 6 2.122 -2.562 1.766
32 2HB CYS 6 2HB CYS 6 2.972 -2.932 3.269
33 H CYS 7 H CYS 7 4.898 -3.222 -0.988
34 HA CYS 7 HA CYS 7 5.450 -0.727 -1.674
35 1HB CYS 7 1HB CYS 7 7.235 -1.373 0.438
36 2HB CYS 7 2HB CYS 7 8.186 -1.238 -1.045
37 H ARG 8 H ARG 8 4.700 -3.170 -2.826
38 HA ARG 8 HA ARG 8 5.763 -3.303 -5.150
39 1HB ARG 8 1HB ARG 8 8.048 -3.510 -4.603
40 2HB ARG 8 2HB ARG 8 7.737 -4.631 -3.266
41 1HG ARG 8 1HG ARG 8 8.670 -5.949 -5.019
42 2HG ARG 8 2HG ARG 8 6.934 -6.303 -5.053
43 1HD ARG 8 1HD ARG 8 8.302 -4.228 -6.820
44 2HD ARG 8 2HD ARG 8 7.968 -5.887 -7.336
45 HE ARG 8 HE ARG 8 5.499 -5.133 -6.576
46 1HH1 ARG 8 2HH2 ARG 8 7.897 -3.309 -8.440
47 2HH1 ARG 8 1HH2 ARG 8 6.710 -2.397 -9.310
48 1HH2 ARG 8 2HH1 ARG 8 3.960 -3.945 -7.708
49 2HH2 ARG 8 1HH1 ARG 8 4.456 -2.756 -8.895
50 H GLN 9 H GLN 9 4.502 -4.862 -2.362
51 HA GLN 9 HA GLN 9 3.306 -6.869 -4.073
52 1HB GLN 9 1HB GLN 9 5.006 -7.366 -1.657
53 2HB GLN 9 2HB GLN 9 3.585 -8.403 -1.880
54 1HG GLN 9 1HG GLN 9 5.236 -7.967 -4.314
55 2HG GLN 9 2HG GLN 9 6.054 -8.853 -3.020
56 1HE2 GLN 9 1HE2 GLN 9 5.782 -10.269 -5.142
57 2HE2 GLN 9 2HE2 GLN 9 4.479 -11.411 -5.084
58 H CYS 10 H CYS 10 3.372 -6.131 -0.510
59 HA CYS 10 HA CYS 10 0.692 -6.533 -0.110
60 1HB CYS 10 1HB CYS 10 2.119 -6.451 1.749
61 2HB CYS 10 2HB CYS 10 2.713 -4.838 1.345
62 H LYS 11 H LYS 11 2.523 -3.490 -0.868
63 HA LYS 11 HA LYS 11 0.115 -1.949 -0.997
64 1HB LYS 11 1HB LYS 11 1.477 -0.130 -1.191
65 2HB LYS 11 2HB LYS 11 2.572 -1.253 -0.364
66 1HG LYS 11 1HG LYS 11 4.007 -0.744 -2.050
67 2HG LYS 11 2HG LYS 11 3.041 -1.877 -3.013
68 1HD LYS 11 1HD LYS 11 1.539 0.340 -3.340
69 2HD LYS 11 2HD LYS 11 3.100 1.128 -3.055
70 1HE LYS 11 1HE LYS 11 4.053 0.215 -4.984
71 2HE LYS 11 2HE LYS 11 2.951 -1.170 -5.014
72 1HZ LYS 11 1HZ LYS 11 1.201 0.268 -5.775
73 2HZ LYS 11 2HZ LYS 11 2.081 1.619 -5.546
74 3HZ LYS 11 3HZ LYS 11 2.532 0.540 -6.704
75 H LEU 12 H LEU 12 -0.520 -4.011 -2.556
76 HA LEU 12 HA LEU 12 0.345 -3.887 -5.206
77 1HB LEU 12 1HB LEU 12 -1.299 -5.425 -5.659
78 2HB LEU 12 2HB LEU 12 -0.899 -5.729 -3.960
79 HG LEU 12 HG LEU 12 -2.989 -3.972 -3.738
80 1HD1 LEU 12 1HD1 LEU 12 -3.567 -5.718 -6.149
81 2HD1 LEU 12 2HD1 LEU 12 -4.758 -4.731 -5.267
82 3HD1 LEU 12 3HD1 LEU 12 -3.416 -3.945 -6.132
83 1HD2 LEU 12 1HD2 LEU 12 -4.285 -5.846 -2.994
84 2HD2 LEU 12 2HD2 LEU 12 -3.282 -6.980 -3.931
85 3HD2 LEU 12 3HD2 LEU 12 -2.588 -6.122 -2.534
86 H LYS 13 H LYS 13 -1.343 -1.592 -3.367
87 HA LYS 13 HA LYS 13 -3.225 -0.679 -5.226
88 1HB LYS 13 1HB LYS 13 -2.903 1.498 -3.873
89 2HB LYS 13 2HB LYS 13 -3.556 0.066 -3.057
90 1HG LYS 13 1HG LYS 13 -0.665 0.015 -2.946
91 2HG LYS 13 2HG LYS 13 -1.236 1.590 -2.366
92 1HD LYS 13 1HD LYS 13 -1.012 -0.457 -0.708
93 2HD LYS 13 2HD LYS 13 -2.395 0.640 -0.564
94 1HE LYS 13 1HE LYS 13 -2.835 -1.556 -2.484
95 2HE LYS 13 2HE LYS 13 -2.528 -2.134 -0.838
96 1HZ LYS 13 1HZ LYS 13 -4.279 -0.045 -0.537
97 2HZ LYS 13 2HZ LYS 13 -4.837 -0.798 -1.869
98 3HZ LYS 13 3HZ LYS 13 -4.625 -1.652 -0.481
99 HA PRO 14 HA PRO 14 -0.835 1.521 -8.070
100 1HB PRO 14 1HB PRO 14 -2.379 3.694 -8.667
101 2HB PRO 14 2HB PRO 14 -2.672 2.089 -9.338
102 1HG PRO 14 1HG PRO 14 -4.085 3.533 -7.188
103 2HG PRO 14 2HG PRO 14 -4.663 2.145 -8.177
104 1HD PRO 14 1HD PRO 14 -3.756 2.140 -5.461
105 2HD PRO 14 2HD PRO 14 -4.164 0.724 -6.440
106 H ALA 15 H ALA 15 0.008 1.906 -5.416
107 HA ALA 15 HA ALA 15 1.333 3.236 -4.247
108 1HB ALA 15 1HB ALA 15 1.678 4.756 -6.863
109 2HB ALA 15 2HB ALA 15 2.778 4.788 -5.465
110 3HB ALA 15 3HB ALA 15 2.581 3.291 -6.407
111 H GLY 16 H GLY 16 0.697 4.641 -2.688
112 1HA GLY 16 1HA GLY 16 -1.003 6.913 -3.518
113 2HA GLY 16 2HA GLY 16 -1.422 5.892 -2.157
114 H THR 17 H THR 17 -0.291 6.063 -0.168
115 HA THR 17 HA THR 17 2.034 7.770 -0.027
116 HB THR 17 HB THR 17 -0.635 8.548 1.262
117 HG1 THR 17 1HG THR 17 -0.028 10.465 -0.197
118 1HG2 THR 17 1HG2 THR 17 2.008 10.083 1.220
119 2HG2 THR 17 2HG2 THR 17 0.527 10.499 2.116
120 3HG2 THR 17 3HG2 THR 17 1.502 9.094 2.611
121 H THR 18 H THR 18 3.153 7.617 1.992
122 HA THR 18 HA THR 18 2.801 5.044 3.183
123 HB THR 18 HB THR 18 4.724 7.366 3.314
124 HG1 THR 18 1HG THR 18 4.895 4.436 3.264
125 1HG2 THR 18 1HG2 THR 18 4.165 5.435 5.547
126 2HG2 THR 18 2HG2 THR 18 5.868 5.597 5.058
127 3HG2 THR 18 3HG2 THR 18 4.959 7.027 5.604
128 H CYS 19 H CYS 19 1.871 4.440 5.070
129 HA CYS 19 HA CYS 19 0.222 4.668 6.576
130 1HB CYS 19 1HB CYS 19 2.095 6.649 7.845
131 2HB CYS 19 2HB CYS 19 1.045 5.464 8.628
132 H TRP 20 H TRP 20 -0.831 6.041 4.579
133 HA TRP 20 HA TRP 20 -1.492 8.690 5.674
134 1HB TRP 20 1HB TRP 20 -0.229 8.534 3.462
135 2HB TRP 20 2HB TRP 20 -1.726 7.899 2.778
136 HD1 TRP 20 HD TRP 20 -3.121 9.795 1.667
137 HE1 TRP 20 1HE TRP 20 -3.550 12.382 1.961
138 HE3 TRP 20 3HE TRP 20 -0.100 10.368 5.717
139 HZ2 TRP 20 2HZ TRP 20 -2.598 14.334 3.812
140 HZ3 TRP 20 3HZ TRP 20 0.095 12.647 6.707
141 HH2 TRP 20 HH TRP 20 -1.092 14.590 5.820
142 H LYS 21 H LYS 21 -2.807 6.137 3.428
143 HA LYS 21 HA LYS 21 -4.753 5.080 3.407
144 1HB LYS 21 1HB LYS 21 -4.990 4.374 5.514
145 2HB LYS 21 2HB LYS 21 -4.614 5.956 6.220
146 1HG LYS 21 1HG LYS 21 -6.903 5.498 6.749
147 2HG LYS 21 2HG LYS 21 -6.942 6.707 5.454
148 1HD LYS 21 1HD LYS 21 -7.506 5.054 3.811
149 2HD LYS 21 2HD LYS 21 -7.124 3.714 4.909
150 1HE LYS 21 1HE LYS 21 -9.534 3.936 4.791
151 2HE LYS 21 2HE LYS 21 -9.029 4.497 6.392
152 1HZ LYS 21 1HZ LYS 21 -10.640 5.953 5.033
153 2HZ LYS 21 2HZ LYS 21 -9.399 6.711 5.765
154 3HZ LYS 21 3HZ LYS 21 -9.307 6.360 4.160
155 H THR 22 H THR 22 -6.399 5.628 2.069
156 HA THR 22 HA THR 22 -7.389 8.396 2.282
157 HB THR 22 HB THR 22 -7.700 8.171 -0.234
158 HG1 THR 22 1HG THR 22 -5.955 5.868 0.195
159 1HG2 THR 22 1HG2 THR 22 -5.652 9.234 -0.098
160 2HG2 THR 22 2HG2 THR 22 -5.061 8.125 1.163
161 3HG2 THR 22 3HG2 THR 22 -5.006 7.636 -0.548
162 H SER 23 H SER 23 -9.629 8.598 1.135
163 HA SER 23 HA SER 23 -11.284 6.763 2.547
164 1HB SER 23 1HB SER 23 -11.483 9.424 1.577
165 2HB SER 23 2HB SER 23 -12.754 8.507 0.748
166 HG SER 23 HG SER 23 -13.518 7.802 2.836
167 H LEU 24 H LEU 24 -9.624 6.487 -0.295
168 HA LEU 24 HA LEU 24 -11.816 5.079 -1.648
169 1HB LEU 24 1HB LEU 24 -11.139 6.664 -3.132
170 2HB LEU 24 2HB LEU 24 -9.445 6.610 -2.614
171 HG LEU 24 HG LEU 24 -9.440 4.249 -3.685
172 1HD1 LEU 24 1HD1 LEU 24 -11.240 4.794 -5.771
173 2HD1 LEU 24 2HD1 LEU 24 -11.354 3.518 -4.535
174 3HD1 LEU 24 3HD1 LEU 24 -12.138 5.092 -4.264
175 1HD2 LEU 24 1HD2 LEU 24 -9.267 5.453 -6.041
176 2HD2 LEU 24 2HD2 LEU 24 -9.331 6.914 -5.026
177 3HD2 LEU 24 3HD2 LEU 24 -8.053 5.703 -4.764
178 H THR 25 H THR 25 -8.345 4.921 -0.661
179 HA THR 25 HA THR 25 -8.630 2.103 -0.182
180 HB THR 25 HB THR 25 -6.885 3.176 -2.460
181 HG1 THR 25 1HG THR 25 -9.030 1.196 -2.126
182 1HG2 THR 25 1HG2 THR 25 -6.762 0.657 -0.838
183 2HG2 THR 25 2HG2 THR 25 -6.761 0.437 -2.604
184 3HG2 THR 25 3HG2 THR 25 -5.498 1.424 -1.829
185 H SER 26 H SER 26 -7.692 1.794 1.727
186 HA SER 26 HA SER 26 -6.239 3.653 3.030
187 1HB SER 26 1HB SER 26 -7.269 1.454 3.873
188 2HB SER 26 2HB SER 26 -5.755 0.672 3.385
189 HG SER 26 HG SER 26 -4.621 2.063 4.850
190 H HIS 27 H HIS 27 -4.642 4.633 1.651
191 HA HIS 27 HA HIS 27 -2.541 2.892 0.674
192 1HB HIS 27 1HB HIS 27 -3.122 5.833 0.266
193 2HB HIS 27 2HB HIS 27 -1.729 4.994 -0.427
194 HD1 HIS 27 1HD HIS 27 -4.400 6.347 -1.857
195 HD2 HIS 27 2HD HIS 27 -3.390 2.292 -1.492
196 HE1 HIS 27 1HE HIS 27 -5.642 5.129 -3.725
197 HE2 HIS 27 2HE HIS 27 -4.989 2.635 -3.453
198 H TYR 28 H TYR 28 -1.232 2.265 2.369
199 HA TYR 28 HA TYR 28 -0.254 4.419 4.112
200 1HB TYR 28 1HB TYR 28 -1.143 1.610 4.348
201 2HB TYR 28 2HB TYR 28 0.484 1.795 5.013
202 HD1 TYR 28 1HD TYR 28 -2.762 3.697 5.104
203 HD2 TYR 28 2HD TYR 28 0.558 2.130 7.298
204 HE1 TYR 28 1HE TYR 28 -3.758 4.591 7.265
205 HE2 TYR 28 2HE TYR 28 -0.449 3.027 9.452
206 HH TYR 28 HH TYR 28 -2.013 4.243 10.335
207 H CYS 29 H CYS 29 0.692 3.727 1.306
208 HA CYS 29 HA CYS 29 3.454 3.799 1.928
209 1HB CYS 29 1HB CYS 29 2.871 1.479 0.175
210 2HB CYS 29 2HB CYS 29 4.233 1.772 1.261
211 H THR 30 H THR 30 4.187 2.786 -0.802
212 HA THR 30 HA THR 30 2.575 4.285 -2.653
213 HB THR 30 HB THR 30 5.332 5.239 -1.737
214 HG1 THR 30 1HG THR 30 2.701 6.456 -2.200
215 1HG2 THR 30 1HG2 THR 30 3.763 6.606 -3.923
216 2HG2 THR 30 2HG2 THR 30 5.518 6.611 -3.626
217 3HG2 THR 30 3HG2 THR 30 4.747 5.195 -4.380
218 H GLY 31 H GLY 31 5.457 2.340 -1.852
219 1HA GLY 31 1HA GLY 31 5.383 0.281 -3.347
220 2HA GLY 31 2HA GLY 31 5.541 1.431 -4.660
221 H LYS 32 H LYS 32 7.274 -0.659 -2.730
222 HA LYS 32 HA LYS 32 9.409 -0.943 -2.250
223 1HB LYS 32 1HB LYS 32 10.049 -0.954 -4.429
224 2HB LYS 32 2HB LYS 32 9.486 0.697 -4.740
225 1HG LYS 32 1HG LYS 32 11.729 0.383 -2.788
226 2HG LYS 32 2HG LYS 32 12.115 0.032 -4.482
227 1HD LYS 32 1HD LYS 32 10.571 2.413 -4.500
228 2HD LYS 32 2HD LYS 32 11.727 2.604 -3.170
229 1HE LYS 32 1HE LYS 32 13.179 1.460 -5.326
230 2HE LYS 32 2HE LYS 32 12.180 2.731 -6.045
231 1HZ LYS 32 1HZ LYS 32 13.317 3.671 -3.640
232 2HZ LYS 32 2HZ LYS 32 14.513 3.055 -4.556
233 3HZ LYS 32 3HZ LYS 32 13.520 4.206 -5.180
234 H SER 33 H SER 33 10.414 -0.311 -0.421
235 HA SER 33 HA SER 33 11.519 1.027 0.944
236 1HB SER 33 1HB SER 33 11.346 2.721 -1.286
237 2HB SER 33 2HB SER 33 10.689 3.691 0.043
238 HG SER 33 HG SER 33 13.168 2.235 0.284
239 H CYS 34 H CYS 34 8.964 -0.037 1.414
240 HA CYS 34 HA CYS 34 7.998 1.857 3.343
241 1HB CYS 34 1HB CYS 34 5.767 0.788 1.769
242 2HB CYS 34 2HB CYS 34 5.989 2.379 2.501
243 H ASP 35 H ASP 35 6.293 0.712 4.769
244 HA ASP 35 HA ASP 35 6.122 -2.104 4.449
245 1HB ASP 35 1HB ASP 35 8.396 -1.688 5.536
246 2HB ASP 35 2HB ASP 35 7.532 -1.023 6.930
247 HD2 ASP 35 HD ASP 35 6.484 -4.178 8.010
248 H CYS 36 H CYS 36 4.319 0.214 4.613
249 HA CYS 36 HA CYS 36 3.168 -0.091 7.279
250 1HB CYS 36 1HB CYS 36 3.474 2.124 5.469
251 2HB CYS 36 2HB CYS 36 1.764 1.880 5.838
252 HA PRO 37 HA PRO 37 -0.058 -2.396 5.468
253 1HB PRO 37 1HB PRO 37 -2.012 -2.114 7.358
254 2HB PRO 37 2HB PRO 37 -0.684 -3.264 7.506
255 1HG PRO 37 1HG PRO 37 -1.094 -0.660 8.830
256 2HG PRO 37 2HG PRO 37 -0.022 -2.016 9.329
257 1HD PRO 37 1HD PRO 37 0.705 0.467 8.103
258 2HD PRO 37 2HD PRO 37 1.776 -0.902 8.430
259 H LEU 38 H LEU 38 -1.338 -2.102 3.756
260 HA LEU 38 HA LEU 38 -2.665 0.513 3.717
261 1HB LEU 38 1HB LEU 38 -2.156 -1.213 1.326
262 2HB LEU 38 2HB LEU 38 -2.468 0.529 1.399
263 HG LEU 38 HG LEU 38 -0.120 0.265 2.823
264 1HD1 LEU 38 1HD1 LEU 38 0.475 -1.908 2.378
265 2HD1 LEU 38 2HD1 LEU 38 -0.270 -1.904 0.762
266 3HD1 LEU 38 3HD1 LEU 38 1.273 -1.058 1.033
267 1HD2 LEU 38 1HD2 LEU 38 0.538 0.745 0.087
268 2HD2 LEU 38 2HD2 LEU 38 -1.049 1.477 0.425
269 3HD2 LEU 38 3HD2 LEU 38 0.360 1.910 1.420
270 H TYR 39 H TYR 39 -3.707 -1.705 5.255
271 HA TYR 39 HA TYR 39 -5.580 -3.216 3.856
272 1HB TYR 39 1HB TYR 39 -4.684 -3.364 6.280
273 2HB TYR 39 2HB TYR 39 -5.714 -1.986 6.680
274 HD1 TYR 39 1HD TYR 39 -8.183 -2.246 6.693
275 HD2 TYR 39 2HD TYR 39 -5.582 -5.577 6.025
276 HE1 TYR 39 1HE TYR 39 -10.096 -3.848 7.182
277 HE2 TYR 39 2HE TYR 39 -7.503 -7.166 6.516
278 HH TYR 39 HH TYR 39 -9.537 -7.290 7.464
279 HA PRO 40 HA PRO 40 -8.378 0.037 2.923
280 1HB PRO 40 1HB PRO 40 -9.947 -1.387 1.197
281 2HB PRO 40 2HB PRO 40 -8.487 -0.537 0.696
282 1HG PRO 40 1HG PRO 40 -8.944 -3.416 1.151
283 2HG PRO 40 2HG PRO 40 -7.640 -2.623 0.196
284 1HD PRO 40 1HD PRO 40 -7.470 -3.819 2.792
285 2HD PRO 40 2HD PRO 40 -6.198 -2.911 1.963
286 H GLY 41 H GLY 41 -9.983 -3.113 3.031
287 1HA GLY 41 1HA GLY 41 -11.558 -2.101 5.303
288 2HA GLY 41 2HA GLY 41 -12.375 -2.707 3.876
Start of MODEL 4
1 H CYS 1 H CYS 1 -3.256 -3.883 2.864
2 HA CYS 1 HA CYS 1 -3.596 -6.668 3.075
3 1HB CYS 1 1HB CYS 1 -3.127 -7.122 0.915
4 2HB CYS 1 2HB CYS 1 -2.194 -5.644 0.670
5 H THR 2 H THR 2 -1.647 -7.626 4.172
6 HA THR 2 HA THR 2 0.315 -5.655 5.069
7 HB THR 2 HB THR 2 -0.120 -6.320 7.443
8 HG1 THR 2 1HG THR 2 -2.373 -7.675 6.135
9 1HG2 THR 2 1HG2 THR 2 -2.052 -5.026 7.782
10 2HG2 THR 2 2HG2 THR 2 -1.614 -4.500 6.138
11 3HG2 THR 2 3HG2 THR 2 -2.885 -5.724 6.372
12 H THR 3 H THR 3 0.047 -8.170 3.272
13 HA THR 3 HA THR 3 1.169 -10.388 4.307
14 HB THR 3 HB THR 3 1.739 -8.927 1.679
15 HG1 THR 3 1HG THR 3 0.086 -11.200 2.529
16 1HG2 THR 3 1HG2 THR 3 1.843 -11.793 1.454
17 2HG2 THR 3 2HG2 THR 3 3.147 -10.631 1.111
18 3HG2 THR 3 3HG2 THR 3 2.979 -11.323 2.742
19 H GLY 4 H GLY 4 3.212 -7.723 2.927
20 1HA GLY 4 1HA GLY 4 5.180 -8.327 5.040
21 2HA GLY 4 2HA GLY 4 5.663 -8.275 3.356
22 HA PRO 5 HA PRO 5 6.260 -4.027 4.351
23 1HB PRO 5 1HB PRO 5 7.845 -3.423 2.209
24 2HB PRO 5 2HB PRO 5 8.475 -4.063 3.724
25 1HG PRO 5 1HG PRO 5 8.031 -5.405 1.135
26 2HG PRO 5 2HG PRO 5 9.097 -5.912 2.495
27 1HD PRO 5 1HD PRO 5 6.554 -6.986 1.731
28 2HD PRO 5 2HD PRO 5 7.489 -7.411 3.170
29 H CYS 6 H CYS 6 4.122 -5.339 2.514
30 HA CYS 6 HA CYS 6 2.455 -4.605 1.291
31 1HB CYS 6 1HB CYS 6 1.518 -2.539 1.698
32 2HB CYS 6 2HB CYS 6 2.419 -2.880 3.178
33 H CYS 7 H CYS 7 5.308 -2.371 1.001
34 HA CYS 7 HA CYS 7 4.911 -1.460 -1.518
35 1HB CYS 7 1HB CYS 7 7.177 -1.793 0.277
36 2HB CYS 7 2HB CYS 7 7.651 -1.887 -1.421
37 H ARG 8 H ARG 8 4.721 -2.457 -3.499
38 HA ARG 8 HA ARG 8 4.931 -3.893 -5.102
39 1HB ARG 8 1HB ARG 8 7.276 -4.032 -5.023
40 2HB ARG 8 2HB ARG 8 7.290 -4.777 -3.416
41 1HG ARG 8 1HG ARG 8 7.907 -6.359 -5.254
42 2HG ARG 8 2HG ARG 8 6.479 -6.894 -4.349
43 1HD ARG 8 1HD ARG 8 5.173 -5.556 -6.232
44 2HD ARG 8 2HD ARG 8 6.667 -5.775 -7.155
45 HE ARG 8 HE ARG 8 4.728 -7.844 -6.403
46 1HH1 ARG 8 2HH2 ARG 8 8.072 -7.230 -7.405
47 2HH1 ARG 8 1HH2 ARG 8 8.315 -8.832 -8.015
48 1HH2 ARG 8 2HH1 ARG 8 5.048 -9.924 -7.196
49 2HH2 ARG 8 1HH1 ARG 8 6.587 -10.379 -7.898
50 H GLN 9 H GLN 9 3.840 -4.552 -2.071
51 HA GLN 9 HA GLN 9 2.947 -7.205 -2.881
52 1HB GLN 9 1HB GLN 9 4.127 -6.297 -0.274
53 2HB GLN 9 2HB GLN 9 2.868 -7.544 -0.232
54 1HG GLN 9 1HG GLN 9 4.377 -8.602 -2.175
55 2HG GLN 9 2HG GLN 9 5.647 -7.647 -1.395
56 1HE2 GLN 9 1HE2 GLN 9 5.008 -10.588 -1.628
57 2HE2 GLN 9 2HE2 GLN 9 5.072 -11.209 -0.012
58 H CYS 10 H CYS 10 2.141 -5.483 0.155
59 HA CYS 10 HA CYS 10 -0.610 -5.712 -0.368
60 1HB CYS 10 1HB CYS 10 0.652 -3.888 1.668
61 2HB CYS 10 2HB CYS 10 -0.947 -4.635 1.714
62 H LYS 11 H LYS 11 1.902 -3.336 -1.083
63 HA LYS 11 HA LYS 11 0.037 -1.194 -1.532
64 1HB LYS 11 1HB LYS 11 1.839 0.137 -1.595
65 2HB LYS 11 2HB LYS 11 2.639 -1.241 -0.817
66 1HG LYS 11 1HG LYS 11 4.113 -0.971 -2.548
67 2HG LYS 11 2HG LYS 11 2.932 -1.952 -3.431
68 1HD LYS 11 1HD LYS 11 1.816 0.426 -3.885
69 2HD LYS 11 2HD LYS 11 3.458 1.016 -3.567
70 1HE LYS 11 1HE LYS 11 4.259 -0.708 -5.285
71 2HE LYS 11 2HE LYS 11 2.558 -0.961 -5.709
72 1HZ LYS 11 1HZ LYS 11 3.260 0.705 -7.167
73 2HZ LYS 11 2HZ LYS 11 2.569 1.598 -5.993
74 3HZ LYS 11 3HZ LYS 11 4.204 1.426 -6.030
75 H LEU 12 H LEU 12 -0.656 -3.589 -2.941
76 HA LEU 12 HA LEU 12 0.306 -3.687 -5.535
77 1HB LEU 12 1HB LEU 12 -1.811 -4.840 -6.033
78 2HB LEU 12 2HB LEU 12 -0.941 -5.485 -4.629
79 HG LEU 12 HG LEU 12 -2.869 -3.498 -3.800
80 1HD1 LEU 12 1HD1 LEU 12 -4.212 -3.918 -5.678
81 2HD1 LEU 12 2HD1 LEU 12 -3.875 -5.666 -5.643
82 3HD1 LEU 12 3HD1 LEU 12 -4.900 -4.931 -4.387
83 1HD2 LEU 12 1HD2 LEU 12 -3.739 -5.841 -2.755
84 2HD2 LEU 12 2HD2 LEU 12 -2.056 -6.265 -3.147
85 3HD2 LEU 12 3HD2 LEU 12 -2.401 -4.878 -2.085
86 H LYS 13 H LYS 13 -1.095 -1.068 -4.008
87 HA LYS 13 HA LYS 13 -2.584 -0.176 -6.338
88 1HB LYS 13 1HB LYS 13 -3.395 1.570 -4.958
89 2HB LYS 13 2HB LYS 13 -3.468 0.080 -4.001
90 1HG LYS 13 1HG LYS 13 -1.066 1.922 -3.869
91 2HG LYS 13 2HG LYS 13 -2.505 2.246 -2.889
92 1HD LYS 13 1HD LYS 13 -0.540 -0.030 -2.742
93 2HD LYS 13 2HD LYS 13 -1.220 0.941 -1.424
94 1HE LYS 13 1HE LYS 13 -2.643 -1.209 -3.051
95 2HE LYS 13 2HE LYS 13 -2.169 -1.322 -1.351
96 1HZ LYS 13 1HZ LYS 13 -4.025 0.771 -2.322
97 2HZ LYS 13 2HZ LYS 13 -4.566 -0.684 -1.828
98 3HZ LYS 13 3HZ LYS 13 -3.731 0.274 -0.783
99 HA PRO 14 HA PRO 14 0.609 2.313 -7.826
100 1HB PRO 14 1HB PRO 14 -0.736 4.402 -8.961
101 2HB PRO 14 2HB PRO 14 -0.561 2.831 -9.741
102 1HG PRO 14 1HG PRO 14 -2.883 4.016 -8.360
103 2HG PRO 14 2HG PRO 14 -2.853 2.659 -9.544
104 1HD PRO 14 1HD PRO 14 -3.186 2.534 -6.703
105 2HD PRO 14 2HD PRO 14 -3.002 1.164 -7.805
106 H ALA 15 H ALA 15 0.717 2.520 -5.206
107 HA ALA 15 HA ALA 15 1.452 3.848 -3.596
108 1HB ALA 15 1HB ALA 15 2.496 6.014 -4.218
109 2HB ALA 15 2HB ALA 15 3.020 4.692 -5.287
110 3HB ALA 15 3HB ALA 15 1.807 5.865 -5.852
111 H GLY 16 H GLY 16 0.993 6.183 -2.531
112 1HA GLY 16 1HA GLY 16 -1.122 7.766 -3.054
113 2HA GLY 16 2HA GLY 16 -1.893 6.344 -2.379
114 H THR 17 H THR 17 1.322 7.830 -1.590
115 HA THR 17 HA THR 17 2.014 8.899 0.262
116 HB THR 17 HB THR 17 -0.712 8.526 1.563
117 HG1 THR 17 1HG THR 17 -1.190 10.534 0.285
118 1HG2 THR 17 1HG2 THR 17 0.283 9.985 3.025
119 2HG2 THR 17 2HG2 THR 17 1.672 10.226 1.938
120 3HG2 THR 17 3HG2 THR 17 0.192 11.190 1.720
121 H THR 18 H THR 18 2.198 8.399 2.790
122 HA THR 18 HA THR 18 2.317 5.461 3.001
123 HB THR 18 HB THR 18 4.468 7.194 2.793
124 HG1 THR 18 1HG THR 18 5.449 5.218 3.276
125 1HG2 THR 18 1HG2 THR 18 3.810 8.087 5.148
126 2HG2 THR 18 2HG2 THR 18 4.216 6.462 5.746
127 3HG2 THR 18 3HG2 THR 18 5.467 7.462 4.971
128 H CYS 19 H CYS 19 1.835 4.507 5.001
129 HA CYS 19 HA CYS 19 0.368 4.340 6.675
130 1HB CYS 19 1HB CYS 19 2.564 6.146 7.492
131 2HB CYS 19 2HB CYS 19 1.181 6.057 8.587
132 H TRP 20 H TRP 20 -1.214 5.463 4.972
133 HA TRP 20 HA TRP 20 -2.328 7.816 6.332
134 1HB TRP 20 1HB TRP 20 -1.061 8.233 4.113
135 2HB TRP 20 2HB TRP 20 -2.472 7.498 3.350
136 HD1 TRP 20 HD TRP 20 -1.450 10.649 5.329
137 HE1 TRP 20 1HE TRP 20 -3.256 12.557 5.084
138 HE3 TRP 20 3HE TRP 20 -4.892 7.802 2.900
139 HZ2 TRP 20 2HZ TRP 20 -5.862 12.662 3.926
140 HZ3 TRP 20 3HZ TRP 20 -7.041 8.885 2.247
141 HH2 TRP 20 HH TRP 20 -7.552 11.227 2.723
142 H LYS 21 H LYS 21 -3.017 5.390 3.699
143 HA LYS 21 HA LYS 21 -4.678 3.951 3.443
144 1HB LYS 21 1HB LYS 21 -4.712 4.386 6.347
145 2HB LYS 21 2HB LYS 21 -6.259 3.834 5.679
146 1HG LYS 21 1HG LYS 21 -5.290 1.854 4.797
147 2HG LYS 21 2HG LYS 21 -3.639 2.488 4.927
148 1HD LYS 21 1HD LYS 21 -3.784 0.996 6.736
149 2HD LYS 21 2HD LYS 21 -4.127 2.556 7.505
150 1HE LYS 21 1HE LYS 21 -6.528 1.229 6.414
151 2HE LYS 21 2HE LYS 21 -5.719 0.269 7.663
152 1HZ LYS 21 1HZ LYS 21 -7.144 1.686 8.842
153 2HZ LYS 21 2HZ LYS 21 -5.726 2.480 8.960
154 3HZ LYS 21 3HZ LYS 21 -6.836 2.961 7.848
155 H THR 22 H THR 22 -6.326 4.393 2.083
156 HA THR 22 HA THR 22 -7.764 6.906 2.513
157 HB THR 22 HB THR 22 -8.445 6.388 0.069
158 HG1 THR 22 1HG THR 22 -7.737 4.032 0.619
159 1HG2 THR 22 1HG2 THR 22 -5.444 6.487 0.682
160 2HG2 THR 22 2HG2 THR 22 -6.196 6.886 -0.881
161 3HG2 THR 22 3HG2 THR 22 -6.504 7.909 0.542
162 H SER 23 H SER 23 -10.153 6.783 1.633
163 HA SER 23 HA SER 23 -11.343 4.696 3.242
164 1HB SER 23 1HB SER 23 -11.978 7.460 2.581
165 2HB SER 23 2HB SER 23 -13.374 6.410 2.277
166 HG SER 23 HG SER 23 -11.983 5.982 4.706
167 H LEU 24 H LEU 24 -10.198 4.656 0.279
168 HA LEU 24 HA LEU 24 -12.621 3.493 -0.912
169 1HB LEU 24 1HB LEU 24 -11.168 3.930 -3.060
170 2HB LEU 24 2HB LEU 24 -12.240 5.162 -2.373
171 HG LEU 24 HG LEU 24 -9.430 5.156 -1.411
172 1HD1 LEU 24 1HD1 LEU 24 -8.831 6.562 -3.496
173 2HD1 LEU 24 2HD1 LEU 24 -8.797 4.787 -3.615
174 3HD1 LEU 24 3HD1 LEU 24 -10.178 5.696 -4.275
175 1HD2 LEU 24 1HD2 LEU 24 -11.040 6.807 -0.617
176 2HD2 LEU 24 2HD2 LEU 24 -9.734 7.584 -1.541
177 3HD2 LEU 24 3HD2 LEU 24 -11.334 7.347 -2.287
178 H THR 25 H THR 25 -9.016 3.274 -0.640
179 HA THR 25 HA THR 25 -9.328 0.363 -0.982
180 HB THR 25 HB THR 25 -7.646 2.370 -2.414
181 HG1 THR 25 1HG THR 25 -8.390 0.951 -3.958
182 1HG2 THR 25 1HG2 THR 25 -6.467 -0.019 -1.028
183 2HG2 THR 25 2HG2 THR 25 -6.088 0.146 -2.759
184 3HG2 THR 25 3HG2 THR 25 -5.662 1.451 -1.626
185 H SER 26 H SER 26 -6.440 2.350 -0.196
186 HA SER 26 HA SER 26 -6.343 2.488 2.375
187 1HB SER 26 1HB SER 26 -5.186 0.122 2.951
188 2HB SER 26 2HB SER 26 -6.924 0.403 3.155
189 HG SER 26 HG SER 26 -7.341 -0.982 1.567
190 H HIS 27 H HIS 27 -4.714 3.965 1.718
191 HA HIS 27 HA HIS 27 -2.391 2.897 0.377
192 1HB HIS 27 1HB HIS 27 -3.103 5.706 1.249
193 2HB HIS 27 2HB HIS 27 -1.672 5.265 0.309
194 HD1 HIS 27 1HD HIS 27 -3.702 3.093 -1.314
195 HD2 HIS 27 2HD HIS 27 -3.873 7.276 -1.054
196 HE1 HIS 27 1HE HIS 27 -5.031 3.883 -3.343
197 HE2 HIS 27 2HE HIS 27 -5.108 6.467 -3.137
198 H TYR 28 H TYR 28 -0.163 3.658 1.261
199 HA TYR 28 HA TYR 28 0.342 4.370 3.822
200 1HB TYR 28 1HB TYR 28 -0.932 1.771 3.599
201 2HB TYR 28 2HB TYR 28 0.746 1.478 4.063
202 HD1 TYR 28 1HD TYR 28 1.160 1.317 6.335
203 HD2 TYR 28 2HD TYR 28 -2.059 3.800 5.003
204 HE1 TYR 28 1HE TYR 28 0.559 1.846 8.748
205 HE2 TYR 28 2HE TYR 28 -2.648 4.322 7.421
206 HH TYR 28 HH TYR 28 -1.813 2.587 9.891
207 H CYS 29 H CYS 29 1.334 4.132 0.960
208 HA CYS 29 HA CYS 29 4.020 4.132 1.479
209 1HB CYS 29 1HB CYS 29 4.265 1.834 -0.010
210 2HB CYS 29 2HB CYS 29 4.606 2.011 1.714
211 H THR 30 H THR 30 5.031 3.160 -1.020
212 HA THR 30 HA THR 30 3.321 4.543 -2.976
213 HB THR 30 HB THR 30 6.284 4.902 -2.339
214 HG1 THR 30 1HG THR 30 5.334 7.169 -2.485
215 1HG2 THR 30 1HG2 THR 30 6.481 6.269 -4.353
216 2HG2 THR 30 2HG2 THR 30 5.903 4.665 -4.866
217 3HG2 THR 30 3HG2 THR 30 4.762 6.027 -4.744
218 H GLY 31 H GLY 31 5.909 2.136 -2.322
219 1HA GLY 31 1HA GLY 31 5.321 -0.031 -3.444
220 2HA GLY 31 2HA GLY 31 5.256 0.901 -4.927
221 H LYS 32 H LYS 32 7.257 -0.941 -2.855
222 HA LYS 32 HA LYS 32 9.356 -1.373 -4.238
223 1HB LYS 32 1HB LYS 32 9.421 1.543 -3.678
224 2HB LYS 32 2HB LYS 32 10.959 0.668 -3.558
225 1HG LYS 32 1HG LYS 32 11.047 0.271 -5.806
226 2HG LYS 32 2HG LYS 32 9.299 0.004 -5.944
227 1HD LYS 32 1HD LYS 32 9.148 2.055 -6.861
228 2HD LYS 32 2HD LYS 32 9.582 2.741 -5.286
229 1HE LYS 32 1HE LYS 32 11.119 3.632 -6.918
230 2HE LYS 32 2HE LYS 32 12.026 2.462 -5.945
231 1HZ LYS 32 1HZ LYS 32 10.857 1.955 -8.630
232 2HZ LYS 32 2HZ LYS 32 12.443 2.116 -8.300
233 3HZ LYS 32 3HZ LYS 32 11.608 0.842 -7.680
234 H SER 33 H SER 33 10.419 0.763 -1.650
235 HA SER 33 HA SER 33 10.448 -1.553 0.120
236 1HB SER 33 1HB SER 33 12.649 -0.701 0.984
237 2HB SER 33 2HB SER 33 12.712 -1.261 -0.696
238 HG SER 33 HG SER 33 13.772 0.876 -0.122
239 H CYS 34 H CYS 34 8.342 -0.426 0.791
240 HA CYS 34 HA CYS 34 8.805 2.021 2.281
241 1HB CYS 34 1HB CYS 34 6.313 1.949 2.580
242 2HB CYS 34 2HB CYS 34 6.898 2.175 0.930
243 H ASP 35 H ASP 35 7.024 1.806 4.388
244 HA ASP 35 HA ASP 35 7.541 -0.711 5.683
245 1HB ASP 35 1HB ASP 35 9.366 1.189 6.137
246 2HB ASP 35 2HB ASP 35 8.140 1.789 7.263
247 HD2 ASP 35 HD ASP 35 10.331 -1.420 8.016
248 H CYS 36 H CYS 36 5.156 0.618 4.604
249 HA CYS 36 HA CYS 36 3.683 0.915 7.098
250 1HB CYS 36 1HB CYS 36 3.973 2.956 4.969
251 2HB CYS 36 2HB CYS 36 2.348 2.713 5.613
252 HA PRO 37 HA PRO 37 1.451 -1.953 4.580
253 1HB PRO 37 1HB PRO 37 -0.098 -2.995 6.575
254 2HB PRO 37 2HB PRO 37 1.511 -3.601 6.187
255 1HG PRO 37 1HG PRO 37 0.619 -1.883 8.413
256 2HG PRO 37 2HG PRO 37 2.116 -2.874 8.290
257 1HD PRO 37 1HD PRO 37 1.834 -0.037 8.028
258 2HD PRO 37 2HD PRO 37 3.301 -0.981 7.743
259 H LEU 38 H LEU 38 -0.160 -1.572 3.198
260 HA LEU 38 HA LEU 38 -2.037 0.464 4.088
261 1HB LEU 38 1HB LEU 38 -2.373 -0.515 1.389
262 2HB LEU 38 2HB LEU 38 -2.082 1.132 1.982
263 HG LEU 38 HG LEU 38 0.398 0.098 2.243
264 1HD1 LEU 38 1HD1 LEU 38 -0.227 -2.101 1.376
265 2HD1 LEU 38 2HD1 LEU 38 -0.784 -1.355 -0.141
266 3HD1 LEU 38 3HD1 LEU 38 0.939 -1.290 0.303
267 1HD2 LEU 38 1HD2 LEU 38 0.553 1.988 1.063
268 2HD2 LEU 38 2HD2 LEU 38 0.460 0.942 -0.374
269 3HD2 LEU 38 3HD2 LEU 38 -1.011 1.723 0.255
270 H TYR 39 H TYR 39 -3.796 -0.232 5.179
271 HA TYR 39 HA TYR 39 -5.757 -1.279 5.455
272 1HB TYR 39 1HB TYR 39 -5.164 -1.741 2.781
273 2HB TYR 39 2HB TYR 39 -5.152 -3.399 3.392
274 HD1 TYR 39 1HD TYR 39 -7.356 -0.725 4.708
275 HD2 TYR 39 2HD TYR 39 -7.077 -4.161 2.174
276 HE1 TYR 39 1HE TYR 39 -9.889 -0.801 4.520
277 HE2 TYR 39 2HE TYR 39 -9.611 -4.225 1.994
278 HH TYR 39 HH TYR 39 -11.467 -3.052 2.328
279 HA PRO 40 HA PRO 40 -4.323 -4.533 7.937
280 1HB PRO 40 1HB PRO 40 -6.677 -5.259 9.118
281 2HB PRO 40 2HB PRO 40 -5.699 -3.902 9.673
282 1HG PRO 40 1HG PRO 40 -8.193 -3.925 8.097
283 2HG PRO 40 2HG PRO 40 -7.483 -2.575 9.053
284 1HD PRO 40 1HD PRO 40 -7.509 -2.925 6.211
285 2HD PRO 40 2HD PRO 40 -6.657 -1.662 7.110
286 H GLY 41 H GLY 41 -4.567 -6.886 8.457
287 1HA GLY 41 1HA GLY 41 -6.018 -8.283 6.324
288 2HA GLY 41 2HA GLY 41 -4.284 -8.515 6.442
Start of MODEL 5
1 H CYS 1 H CYS 1 -2.439 -3.386 6.028
2 HA CYS 1 HA CYS 1 -0.824 -3.665 4.519
3 1HB CYS 1 1HB CYS 1 0.329 -5.028 6.536
4 2HB CYS 1 2HB CYS 1 0.097 -6.343 5.381
5 H THR 2 H THR 2 -0.130 -6.122 3.138
6 HA THR 2 HA THR 2 -2.680 -7.428 2.607
7 HB THR 2 HB THR 2 -1.378 -5.371 0.901
8 HG1 THR 2 1HG THR 2 -3.635 -5.510 1.761
9 1HG2 THR 2 1HG2 THR 2 -1.789 -6.459 -1.214
10 2HG2 THR 2 2HG2 THR 2 -0.805 -7.613 -0.281
11 3HG2 THR 2 3HG2 THR 2 -2.563 -7.853 -0.423
12 H THR 3 H THR 3 0.817 -7.116 1.736
13 HA THR 3 HA THR 3 0.865 -10.062 1.629
14 HB THR 3 HB THR 3 2.131 -7.912 -0.111
15 HG1 THR 3 1HG THR 3 0.048 -9.387 -0.343
16 1HG2 THR 3 1HG2 THR 3 4.086 -9.200 0.112
17 2HG2 THR 3 2HG2 THR 3 3.185 -10.667 0.562
18 3HG2 THR 3 3HG2 THR 3 3.233 -10.139 -1.137
19 H GLY 4 H GLY 4 3.620 -7.792 1.521
20 1HA GLY 4 1HA GLY 4 4.365 -8.724 4.227
21 2HA GLY 4 2HA GLY 4 5.500 -8.719 2.893
22 HA PRO 5 HA PRO 5 6.415 -4.625 4.038
23 1HB PRO 5 1HB PRO 5 8.023 -3.932 1.943
24 2HB PRO 5 2HB PRO 5 8.596 -4.846 3.337
25 1HG PRO 5 1HG PRO 5 7.942 -5.758 0.609
26 2HG PRO 5 2HG PRO 5 8.960 -6.572 1.849
27 1HD PRO 5 1HD PRO 5 6.288 -7.213 1.039
28 2HD PRO 5 2HD PRO 5 7.190 -7.942 2.375
29 H CYS 6 H CYS 6 4.565 -5.483 1.397
30 HA CYS 6 HA CYS 6 2.927 -4.402 0.395
31 1HB CYS 6 1HB CYS 6 1.897 -2.621 1.318
32 2HB CYS 6 2HB CYS 6 2.864 -3.139 2.702
33 H CYS 7 H CYS 7 5.715 -2.135 1.004
34 HA CYS 7 HA CYS 7 5.574 -0.745 -1.343
35 1HB CYS 7 1HB CYS 7 7.267 -0.852 0.833
36 2HB CYS 7 2HB CYS 7 8.321 -1.288 -0.515
37 H ARG 8 H ARG 8 4.779 -2.713 -2.693
38 HA ARG 8 HA ARG 8 5.994 -3.308 -4.757
39 1HB ARG 8 1HB ARG 8 7.633 -4.675 -2.617
40 2HB ARG 8 2HB ARG 8 7.529 -5.423 -4.221
41 1HG ARG 8 1HG ARG 8 8.101 -2.501 -4.186
42 2HG ARG 8 2HG ARG 8 9.384 -3.528 -3.519
43 1HD ARG 8 1HD ARG 8 10.027 -4.061 -5.613
44 2HD ARG 8 2HD ARG 8 8.434 -4.762 -5.940
45 HE ARG 8 HE ARG 8 8.446 -1.851 -6.119
46 1HH1 ARG 8 2HH2 ARG 8 9.162 -4.820 -7.914
47 2HH1 ARG 8 1HH2 ARG 8 8.956 -4.080 -9.466
48 1HH2 ARG 8 2HH1 ARG 8 8.179 -0.892 -8.136
49 2HH2 ARG 8 1HH1 ARG 8 8.393 -1.832 -9.598
50 H GLN 9 H GLN 9 4.457 -4.605 -1.925
51 HA GLN 9 HA GLN 9 3.070 -6.499 -3.624
52 1HB GLN 9 1HB GLN 9 4.312 -7.133 -0.925
53 2HB GLN 9 2HB GLN 9 3.110 -8.173 -1.709
54 1HG GLN 9 1HG GLN 9 5.342 -7.398 -3.479
55 2HG GLN 9 2HG GLN 9 5.870 -8.318 -2.063
56 1HE2 GLN 9 1HE2 GLN 9 2.762 -8.467 -3.736
57 2HE2 GLN 9 2HE2 GLN 9 2.878 -10.104 -4.297
58 H CYS 10 H CYS 10 2.924 -6.150 -0.047
59 HA CYS 10 HA CYS 10 0.273 -6.055 0.217
60 1HB CYS 10 1HB CYS 10 1.296 -6.114 2.223
61 2HB CYS 10 2HB CYS 10 2.524 -4.924 1.780
62 H LYS 11 H LYS 11 2.405 -3.575 -1.121
63 HA LYS 11 HA LYS 11 0.258 -1.605 -1.071
64 1HB LYS 11 1HB LYS 11 1.842 -0.017 -1.195
65 2HB LYS 11 2HB LYS 11 2.880 -1.302 -0.552
66 1HG LYS 11 1HG LYS 11 4.184 -0.856 -2.357
67 2HG LYS 11 2HG LYS 11 2.991 -1.795 -3.271
68 1HD LYS 11 1HD LYS 11 1.732 0.555 -3.360
69 2HD LYS 11 2HD LYS 11 3.363 1.194 -3.092
70 1HE LYS 11 1HE LYS 11 2.194 -0.154 -5.471
71 2HE LYS 11 2HE LYS 11 3.475 1.065 -5.388
72 1HZ LYS 11 1HZ LYS 11 4.245 -1.182 -6.100
73 2HZ LYS 11 2HZ LYS 11 5.029 -0.653 -4.774
74 3HZ LYS 11 3HZ LYS 11 3.813 -1.750 -4.617
75 H LEU 12 H LEU 12 -0.035 -4.075 -2.628
76 HA LEU 12 HA LEU 12 0.639 -4.000 -5.225
77 1HB LEU 12 1HB LEU 12 -1.241 -5.327 -5.672
78 2HB LEU 12 2HB LEU 12 -0.707 -5.717 -4.027
79 HG LEU 12 HG LEU 12 -2.550 -4.040 -3.294
80 1HD1 LEU 12 1HD1 LEU 12 -4.479 -4.398 -5.143
81 2HD1 LEU 12 2HD1 LEU 12 -3.433 -2.959 -5.067
82 3HD1 LEU 12 3HD1 LEU 12 -3.055 -4.276 -6.203
83 1HD2 LEU 12 1HD2 LEU 12 -3.699 -5.855 -2.685
84 2HD2 LEU 12 2HD2 LEU 12 -3.972 -6.359 -4.370
85 3HD2 LEU 12 3HD2 LEU 12 -2.450 -6.783 -3.550
86 H LYS 13 H LYS 13 -1.610 -1.835 -3.526
87 HA LYS 13 HA LYS 13 -2.983 -0.789 -5.665
88 1HB LYS 13 1HB LYS 13 -3.208 1.238 -4.237
89 2HB LYS 13 2HB LYS 13 -3.618 -0.278 -3.416
90 1HG LYS 13 1HG LYS 13 -0.782 0.676 -3.239
91 2HG LYS 13 2HG LYS 13 -1.993 1.586 -2.318
92 1HD LYS 13 1HD LYS 13 -0.938 -1.164 -1.919
93 2HD LYS 13 2HD LYS 13 -1.553 -0.011 -0.722
94 1HE LYS 13 1HE LYS 13 -3.229 -1.706 -2.626
95 2HE LYS 13 2HE LYS 13 -3.024 -2.003 -0.893
96 1HZ LYS 13 1HZ LYS 13 -3.938 0.660 -1.547
97 2HZ LYS 13 2HZ LYS 13 -4.996 -0.506 -1.961
98 3HZ LYS 13 3HZ LYS 13 -4.457 -0.410 -0.411
99 HA PRO 14 HA PRO 14 -0.158 1.606 -7.879
100 1HB PRO 14 1HB PRO 14 -1.599 3.802 -8.627
101 2HB PRO 14 2HB PRO 14 -1.737 2.241 -9.430
102 1HG PRO 14 1HG PRO 14 -3.546 3.546 -7.499
103 2HG PRO 14 2HG PRO 14 -3.909 2.216 -8.657
104 1HD PRO 14 1HD PRO 14 -3.519 2.051 -5.825
105 2HD PRO 14 2HD PRO 14 -3.717 0.696 -6.943
106 H ALA 15 H ALA 15 -0.628 2.197 -4.866
107 HA ALA 15 HA ALA 15 0.489 3.426 -3.393
108 1HB ALA 15 1HB ALA 15 1.878 4.838 -5.696
109 2HB ALA 15 2HB ALA 15 2.453 4.641 -4.024
110 3HB ALA 15 3HB ALA 15 2.369 3.232 -5.109
111 H GLY 16 H GLY 16 -0.070 5.282 -2.241
112 1HA GLY 16 1HA GLY 16 -1.498 7.373 -3.764
113 2HA GLY 16 2HA GLY 16 -2.186 6.655 -2.322
114 H THR 17 H THR 17 -0.370 6.523 -0.405
115 HA THR 17 HA THR 17 1.408 8.770 -0.370
116 HB THR 17 HB THR 17 -1.127 8.794 1.354
117 HG1 THR 17 1HG THR 17 -1.528 10.651 -0.055
118 1HG2 THR 17 1HG2 THR 17 -0.311 11.110 1.932
119 2HG2 THR 17 2HG2 THR 17 0.777 9.844 2.548
120 3HG2 THR 17 3HG2 THR 17 1.211 10.755 1.082
121 H THR 18 H THR 18 2.730 8.835 1.581
122 HA THR 18 HA THR 18 3.247 6.172 2.493
123 HB THR 18 HB THR 18 4.446 8.942 2.828
124 HG1 THR 18 1HG THR 18 4.887 7.461 0.997
125 1HG2 THR 18 1HG2 THR 18 6.294 7.256 3.983
126 2HG2 THR 18 2HG2 THR 18 5.192 8.289 4.923
127 3HG2 THR 18 3HG2 THR 18 4.784 6.581 4.637
128 H CYS 19 H CYS 19 2.371 5.129 4.160
129 HA CYS 19 HA CYS 19 0.898 4.831 5.812
130 1HB CYS 19 1HB CYS 19 3.210 6.373 6.806
131 2HB CYS 19 2HB CYS 19 1.829 6.285 7.902
132 H TRP 20 H TRP 20 -0.613 6.259 4.266
133 HA TRP 20 HA TRP 20 -1.458 8.616 5.811
134 1HB TRP 20 1HB TRP 20 -0.594 8.625 3.254
135 2HB TRP 20 2HB TRP 20 -2.319 8.353 2.998
136 HD1 TRP 20 HD TRP 20 -3.567 10.615 2.675
137 HE1 TRP 20 1HE TRP 20 -3.384 13.120 3.485
138 HE3 TRP 20 3HE TRP 20 0.519 9.916 5.621
139 HZ2 TRP 20 2HZ TRP 20 -1.591 14.497 5.227
140 HZ3 TRP 20 3HZ TRP 20 1.423 11.893 6.840
141 HH2 TRP 20 HH TRP 20 0.435 14.124 6.681
142 H LYS 21 H LYS 21 -2.682 6.098 3.475
143 HA LYS 21 HA LYS 21 -4.338 4.608 3.801
144 1HB LYS 21 1HB LYS 21 -3.997 5.421 6.396
145 2HB LYS 21 2HB LYS 21 -5.689 5.857 6.096
146 1HG LYS 21 1HG LYS 21 -4.574 3.147 5.314
147 2HG LYS 21 2HG LYS 21 -5.165 3.450 6.957
148 1HD LYS 21 1HD LYS 21 -6.894 4.188 4.598
149 2HD LYS 21 2HD LYS 21 -6.788 2.485 5.080
150 1HE LYS 21 1HE LYS 21 -7.337 4.606 7.161
151 2HE LYS 21 2HE LYS 21 -8.657 4.060 6.117
152 1HZ LYS 21 1HZ LYS 21 -8.353 2.788 8.257
153 2HZ LYS 21 2HZ LYS 21 -8.380 1.849 6.927
154 3HZ LYS 21 3HZ LYS 21 -6.941 2.225 7.631
155 H THR 22 H THR 22 -6.016 4.680 2.398
156 HA THR 22 HA THR 22 -7.038 7.276 1.662
157 HB THR 22 HB THR 22 -7.922 6.069 -0.231
158 HG1 THR 22 1HG THR 22 -8.919 4.224 0.511
159 1HG2 THR 22 1HG2 THR 22 -5.584 4.282 0.565
160 2HG2 THR 22 2HG2 THR 22 -6.077 4.784 -1.069
161 3HG2 THR 22 3HG2 THR 22 -5.320 5.960 0.032
162 H SER 23 H SER 23 -7.603 5.912 4.394
163 HA SER 23 HA SER 23 -9.251 6.016 5.810
164 1HB SER 23 1HB SER 23 -10.067 7.861 3.827
165 2HB SER 23 2HB SER 23 -11.507 6.894 4.191
166 HG SER 23 HG SER 23 -11.432 8.660 5.630
167 H LEU 24 H LEU 24 -9.044 4.056 3.183
168 HA LEU 24 HA LEU 24 -10.934 2.199 4.265
169 1HB LEU 24 1HB LEU 24 -11.815 1.990 1.750
170 2HB LEU 24 2HB LEU 24 -12.640 2.913 3.019
171 HG LEU 24 HG LEU 24 -10.636 4.453 1.515
172 1HD1 LEU 24 1HD1 LEU 24 -11.353 4.258 -0.596
173 2HD1 LEU 24 2HD1 LEU 24 -12.024 2.698 -0.065
174 3HD1 LEU 24 3HD1 LEU 24 -13.062 4.144 -0.112
175 1HD2 LEU 24 1HD2 LEU 24 -12.291 5.350 3.171
176 2HD2 LEU 24 2HD2 LEU 24 -12.299 6.161 1.586
177 3HD2 LEU 24 3HD2 LEU 24 -13.575 4.989 1.991
178 H THR 25 H THR 25 -9.662 2.511 0.904
179 HA THR 25 HA THR 25 -8.667 -0.040 0.754
180 HB THR 25 HB THR 25 -8.176 2.600 -0.627
181 HG1 THR 25 1HG THR 25 -9.945 0.974 -1.018
182 1HG2 THR 25 1HG2 THR 25 -6.484 0.080 -0.900
183 2HG2 THR 25 2HG2 THR 25 -6.785 1.137 -2.300
184 3HG2 THR 25 3HG2 THR 25 -5.939 1.773 -0.870
185 H SER 26 H SER 26 -7.000 2.924 1.948
186 HA SER 26 HA SER 26 -5.427 3.020 3.499
187 1HB SER 26 1HB SER 26 -4.803 0.070 3.178
188 2HB SER 26 2HB SER 26 -4.433 1.113 4.564
189 HG SER 26 HG SER 26 -6.240 -0.153 5.101
190 H HIS 27 H HIS 27 -4.251 4.316 1.986
191 HA HIS 27 HA HIS 27 -2.549 2.939 0.102
192 1HB HIS 27 1HB HIS 27 -3.457 5.746 0.549
193 2HB HIS 27 2HB HIS 27 -1.931 5.494 -0.307
194 HD1 HIS 27 1HD HIS 27 -4.282 6.757 -1.809
195 HD2 HIS 27 2HD HIS 27 -3.551 2.628 -1.711
196 HE1 HIS 27 1HE HIS 27 -5.431 5.779 -3.866
197 HE2 HIS 27 2HE HIS 27 -4.955 3.233 -3.758
198 H TYR 28 H TYR 28 -2.340 3.160 3.282
199 HA TYR 28 HA TYR 28 -0.107 4.575 3.982
200 1HB TYR 28 1HB TYR 28 -1.779 2.336 4.854
201 2HB TYR 28 2HB TYR 28 -0.095 1.947 5.221
202 HD1 TYR 28 1HD TYR 28 -2.540 4.774 5.584
203 HD2 TYR 28 2HD TYR 28 0.766 2.642 7.265
204 HE1 TYR 28 1HE TYR 28 -2.676 6.204 7.682
205 HE2 TYR 28 2HE TYR 28 0.620 4.079 9.356
206 HH TYR 28 HH TYR 28 -1.678 5.507 10.401
207 H CYS 29 H CYS 29 1.380 4.536 2.152
208 HA CYS 29 HA CYS 29 3.565 3.036 2.472
209 1HB CYS 29 1HB CYS 29 1.600 1.270 1.624
210 2HB CYS 29 2HB CYS 29 2.531 1.600 0.160
211 H THR 30 H THR 30 4.201 2.476 -0.367
212 HA THR 30 HA THR 30 3.495 4.834 -1.853
213 HB THR 30 HB THR 30 5.752 4.905 -0.073
214 HG1 THR 30 1HG THR 30 5.840 7.026 -1.226
215 1HG2 THR 30 1HG2 THR 30 7.057 3.779 -1.918
216 2HG2 THR 30 2HG2 THR 30 6.489 5.036 -3.045
217 3HG2 THR 30 3HG2 THR 30 7.550 5.474 -1.684
218 H GLY 31 H GLY 31 5.562 1.919 -1.462
219 1HA GLY 31 1HA GLY 31 5.311 0.180 -3.087
220 2HA GLY 31 2HA GLY 31 5.113 1.395 -4.334
221 H LYS 32 H LYS 32 7.336 -0.656 -2.707
222 HA LYS 32 HA LYS 32 9.397 -0.949 -3.928
223 1HB LYS 32 1HB LYS 32 9.279 1.164 -5.126
224 2HB LYS 32 2HB LYS 32 9.602 2.063 -3.633
225 1HG LYS 32 1HG LYS 32 11.534 1.345 -5.387
226 2HG LYS 32 2HG LYS 32 11.843 1.518 -3.649
227 1HD LYS 32 1HD LYS 32 11.634 -0.857 -3.302
228 2HD LYS 32 2HD LYS 32 10.993 -1.114 -4.934
229 1HE LYS 32 1HE LYS 32 13.631 0.235 -4.851
230 2HE LYS 32 2HE LYS 32 13.648 -1.410 -4.196
231 1HZ LYS 32 1HZ LYS 32 12.899 -2.255 -6.251
232 2HZ LYS 32 2HZ LYS 32 12.388 -0.812 -6.805
233 3HZ LYS 32 3HZ LYS 32 13.999 -1.101 -6.651
234 H SER 33 H SER 33 10.176 1.823 -1.825
235 HA SER 33 HA SER 33 11.110 -0.136 0.117
236 1HB SER 33 1HB SER 33 12.169 2.457 -0.896
237 2HB SER 33 2HB SER 33 12.392 2.164 0.839
238 HG SER 33 HG SER 33 13.701 1.056 -1.335
239 H CYS 34 H CYS 34 9.058 -0.312 1.231
240 HA CYS 34 HA CYS 34 8.571 1.973 2.954
241 1HB CYS 34 1HB CYS 34 6.288 0.581 1.563
242 2HB CYS 34 2HB CYS 34 6.218 2.004 2.608
243 H ASP 35 H ASP 35 6.061 0.557 3.920
244 HA ASP 35 HA ASP 35 6.357 -2.025 4.520
245 1HB ASP 35 1HB ASP 35 7.279 -1.804 6.952
246 2HB ASP 35 2HB ASP 35 8.439 -1.869 5.616
247 HD2 ASP 35 HD ASP 35 9.663 -0.946 7.375
248 H CYS 36 H CYS 36 4.330 -0.052 4.157
249 HA CYS 36 HA CYS 36 3.162 0.136 6.838
250 1HB CYS 36 1HB CYS 36 3.001 1.941 4.452
251 2HB CYS 36 2HB CYS 36 1.697 1.923 5.642
252 HA PRO 37 HA PRO 37 0.054 -2.490 5.280
253 1HB PRO 37 1HB PRO 37 -2.004 -1.947 6.991
254 2HB PRO 37 2HB PRO 37 -0.669 -3.023 7.400
255 1HG PRO 37 1HG PRO 37 -1.192 -0.245 8.243
256 2HG PRO 37 2HG PRO 37 -0.127 -1.473 9.020
257 1HD PRO 37 1HD PRO 37 0.627 0.788 7.434
258 2HD PRO 37 2HD PRO 37 1.700 -0.480 8.040
259 H LEU 38 H LEU 38 -1.474 -2.656 3.702
260 HA LEU 38 HA LEU 38 -2.902 -0.147 3.196
261 1HB LEU 38 1HB LEU 38 -1.596 -1.845 1.079
262 2HB LEU 38 2HB LEU 38 -2.497 -0.338 0.835
263 HG LEU 38 HG LEU 38 -0.407 0.249 2.648
264 1HD1 LEU 38 1HD1 LEU 38 1.173 -1.271 2.224
265 2HD1 LEU 38 2HD1 LEU 38 0.341 -1.871 0.771
266 3HD1 LEU 38 3HD1 LEU 38 1.384 -0.431 0.670
267 1HD2 LEU 38 1HD2 LEU 38 -1.592 1.406 0.491
268 2HD2 LEU 38 2HD2 LEU 38 -0.105 1.999 1.271
269 3HD2 LEU 38 3HD2 LEU 38 -0.002 0.976 -0.184
270 H TYR 39 H TYR 39 -4.521 -1.415 4.509
271 HA TYR 39 HA TYR 39 -6.427 -2.538 2.799
272 1HB TYR 39 1HB TYR 39 -4.566 -4.366 3.034
273 2HB TYR 39 2HB TYR 39 -5.020 -4.468 4.738
274 HD1 TYR 39 1HD TYR 39 -7.144 -5.483 5.405
275 HD2 TYR 39 2HD TYR 39 -6.021 -5.227 1.284
276 HE1 TYR 39 1HE TYR 39 -8.951 -7.166 4.800
277 HE2 TYR 39 2HE TYR 39 -7.832 -6.910 0.694
278 HH TYR 39 HH TYR 39 -9.387 -8.779 3.031
279 HA PRO 40 HA PRO 40 -8.697 -1.555 6.352
280 1HB PRO 40 1HB PRO 40 -11.125 -2.616 5.687
281 2HB PRO 40 2HB PRO 40 -10.564 -1.051 5.102
282 1HG PRO 40 1HG PRO 40 -10.709 -3.654 3.719
283 2HG PRO 40 2HG PRO 40 -10.602 -2.006 3.001
284 1HD PRO 40 1HD PRO 40 -8.547 -3.987 3.225
285 2HD PRO 40 2HD PRO 40 -8.351 -2.324 2.656
286 H GLY 41 H GLY 41 -8.643 -2.266 8.385
287 1HA GLY 41 1HA GLY 41 -9.812 -4.350 9.492
288 2HA GLY 41 2HA GLY 41 -8.488 -5.170 8.686
Start of MODEL 6
1 H CYS 1 H CYS 1 -2.916 -4.341 2.594
2 HA CYS 1 HA CYS 1 -3.437 -6.832 2.370
3 1HB CYS 1 1HB CYS 1 -2.153 -8.116 1.051
4 2HB CYS 1 2HB CYS 1 -2.087 -6.630 0.101
5 H THR 2 H THR 2 -1.112 -8.294 3.189
6 HA THR 2 HA THR 2 0.264 -6.625 5.128
7 HB THR 2 HB THR 2 -1.590 -7.150 6.515
8 HG1 THR 2 1HG THR 2 0.157 -9.505 6.608
9 1HG2 THR 2 1HG2 THR 2 -2.739 -8.748 4.945
10 2HG2 THR 2 2HG2 THR 2 -1.518 -9.981 5.340
11 3HG2 THR 2 3HG2 THR 2 -2.638 -9.403 6.598
12 H THR 3 H THR 3 0.606 -8.498 2.622
13 HA THR 3 HA THR 3 1.964 -10.776 3.341
14 HB THR 3 HB THR 3 2.645 -8.872 1.043
15 HG1 THR 3 1HG THR 3 0.577 -10.902 1.513
16 1HG2 THR 3 1HG2 THR 3 3.205 -11.722 1.694
17 2HG2 THR 3 2HG2 THR 3 2.465 -11.479 0.095
18 3HG2 THR 3 3HG2 THR 3 3.993 -10.664 0.502
19 H GLY 4 H GLY 4 3.804 -7.885 2.212
20 1HA GLY 4 1HA GLY 4 5.679 -8.377 4.446
21 2HA GLY 4 2HA GLY 4 6.222 -8.114 2.800
22 HA PRO 5 HA PRO 5 6.245 -3.955 4.318
23 1HB PRO 5 1HB PRO 5 8.111 -3.005 2.564
24 2HB PRO 5 2HB PRO 5 8.527 -3.725 4.117
25 1HG PRO 5 1HG PRO 5 8.702 -4.854 1.398
26 2HG PRO 5 2HG PRO 5 9.559 -5.383 2.892
27 1HD PRO 5 1HD PRO 5 7.329 -6.616 1.586
28 2HD PRO 5 2HD PRO 5 8.031 -7.084 3.139
29 H CYS 6 H CYS 6 4.229 -5.041 2.574
30 HA CYS 6 HA CYS 6 2.699 -4.343 1.165
31 1HB CYS 6 1HB CYS 6 2.156 -1.953 1.072
32 2HB CYS 6 2HB CYS 6 2.329 -2.564 2.720
33 H CYS 7 H CYS 7 5.602 -2.172 0.774
34 HA CYS 7 HA CYS 7 5.334 -1.682 -1.897
35 1HB CYS 7 1HB CYS 7 7.724 -1.867 -0.094
36 2HB CYS 7 2HB CYS 7 7.918 -1.521 -1.815
37 H ARG 8 H ARG 8 4.732 -3.420 -3.231
38 HA ARG 8 HA ARG 8 5.709 -4.881 -4.739
39 1HB ARG 8 1HB ARG 8 7.161 -5.963 -2.284
40 2HB ARG 8 2HB ARG 8 7.206 -6.758 -3.867
41 1HG ARG 8 1HG ARG 8 7.869 -3.845 -3.805
42 2HG ARG 8 2HG ARG 8 9.054 -4.930 -3.056
43 1HD ARG 8 1HD ARG 8 8.129 -6.012 -5.600
44 2HD ARG 8 2HD ARG 8 8.736 -4.364 -5.823
45 HE ARG 8 HE ARG 8 10.305 -6.721 -5.234
46 1HH1 ARG 8 2HH2 ARG 8 10.165 -3.238 -4.599
47 2HH1 ARG 8 1HH2 ARG 8 11.870 -3.093 -4.332
48 1HH2 ARG 8 2HH1 ARG 8 12.518 -6.528 -4.887
49 2HH2 ARG 8 1HH1 ARG 8 13.221 -4.972 -4.496
50 H GLN 9 H GLN 9 3.620 -4.805 -2.255
51 HA GLN 9 HA GLN 9 2.326 -7.190 -3.113
52 1HB GLN 9 1HB GLN 9 3.648 -7.002 -0.433
53 2HB GLN 9 2HB GLN 9 2.051 -7.769 -0.492
54 1HG GLN 9 1HG GLN 9 3.069 -9.660 -1.178
55 2HG GLN 9 2HG GLN 9 3.495 -8.841 -2.688
56 1HE2 GLN 9 1HE2 GLN 9 5.039 -10.846 -1.634
57 2HE2 GLN 9 2HE2 GLN 9 6.559 -10.226 -1.083
58 H CYS 10 H CYS 10 1.995 -5.545 0.076
59 HA CYS 10 HA CYS 10 -0.713 -5.101 -0.241
60 1HB CYS 10 1HB CYS 10 1.063 -3.412 1.500
61 2HB CYS 10 2HB CYS 10 -0.625 -3.865 1.759
62 H LYS 11 H LYS 11 2.128 -3.415 -1.445
63 HA LYS 11 HA LYS 11 0.764 -0.927 -1.878
64 1HB LYS 11 1HB LYS 11 2.795 -0.093 -2.406
65 2HB LYS 11 2HB LYS 11 3.342 -1.510 -1.492
66 1HG LYS 11 1HG LYS 11 4.603 -1.793 -3.398
67 2HG LYS 11 2HG LYS 11 3.150 -2.660 -3.922
68 1HD LYS 11 1HD LYS 11 2.527 -0.066 -4.605
69 2HD LYS 11 2HD LYS 11 4.281 -0.073 -4.859
70 1HE LYS 11 1HE LYS 11 2.770 -0.749 -6.849
71 2HE LYS 11 2HE LYS 11 4.141 -1.809 -6.488
72 1HZ LYS 11 1HZ LYS 11 1.290 -2.308 -6.137
73 2HZ LYS 11 2HZ LYS 11 2.471 -3.352 -6.543
74 3HZ LYS 11 3HZ LYS 11 2.302 -2.884 -4.976
75 H LEU 12 H LEU 12 0.138 -3.845 -3.118
76 HA LEU 12 HA LEU 12 0.420 -3.917 -5.771
77 1HB LEU 12 1HB LEU 12 -1.800 -5.007 -5.855
78 2HB LEU 12 2HB LEU 12 -0.699 -5.649 -4.622
79 HG LEU 12 HG LEU 12 -2.097 -3.833 -3.160
80 1HD1 LEU 12 1HD1 LEU 12 -3.535 -3.887 -5.536
81 2HD1 LEU 12 2HD1 LEU 12 -4.448 -4.966 -4.453
82 3HD1 LEU 12 3HD1 LEU 12 -4.103 -3.293 -3.956
83 1HD2 LEU 12 1HD2 LEU 12 -2.733 -5.638 -1.983
84 2HD2 LEU 12 2HD2 LEU 12 -3.465 -6.438 -3.395
85 3HD2 LEU 12 3HD2 LEU 12 -1.705 -6.525 -3.136
86 H LYS 13 H LYS 13 -1.549 -1.604 -3.923
87 HA LYS 13 HA LYS 13 -3.070 -0.653 -6.076
88 1HB LYS 13 1HB LYS 13 -3.477 1.282 -4.619
89 2HB LYS 13 2HB LYS 13 -3.706 -0.257 -3.772
90 1HG LYS 13 1HG LYS 13 -0.990 1.020 -3.677
91 2HG LYS 13 2HG LYS 13 -2.276 1.766 -2.713
92 1HD LYS 13 1HD LYS 13 -0.909 -0.868 -2.398
93 2HD LYS 13 2HD LYS 13 -1.537 0.228 -1.156
94 1HE LYS 13 1HE LYS 13 -3.166 -1.636 -2.936
95 2HE LYS 13 2HE LYS 13 -2.857 -1.856 -1.207
96 1HZ LYS 13 1HZ LYS 13 -4.940 -0.831 -1.279
97 2HZ LYS 13 2HZ LYS 13 -3.975 0.456 -1.029
98 3HZ LYS 13 3HZ LYS 13 -4.522 0.129 -2.546
99 HA PRO 14 HA PRO 14 -0.338 1.963 -8.158
100 1HB PRO 14 1HB PRO 14 -1.811 4.192 -8.733
101 2HB PRO 14 2HB PRO 14 -1.950 2.684 -9.636
102 1HG PRO 14 1HG PRO 14 -3.735 3.841 -7.591
103 2HG PRO 14 2HG PRO 14 -4.109 2.588 -8.828
104 1HD PRO 14 1HD PRO 14 -3.666 2.241 -6.021
105 2HD PRO 14 2HD PRO 14 -3.872 0.960 -7.223
106 H ALA 15 H ALA 15 0.127 1.995 -5.420
107 HA ALA 15 HA ALA 15 1.168 3.178 -3.868
108 1HB ALA 15 1HB ALA 15 2.982 3.580 -5.251
109 2HB ALA 15 2HB ALA 15 2.016 4.491 -6.435
110 3HB ALA 15 3HB ALA 15 2.485 5.251 -4.895
111 H GLY 16 H GLY 16 0.898 4.964 -2.411
112 1HA GLY 16 1HA GLY 16 -1.079 6.982 -3.236
113 2HA GLY 16 2HA GLY 16 -1.390 5.990 -1.825
114 H THR 17 H THR 17 -0.530 6.585 0.145
115 HA THR 17 HA THR 17 1.698 8.498 0.105
116 HB THR 17 HB THR 17 -1.074 8.781 1.303
117 HG1 THR 17 1HG THR 17 -0.561 10.944 0.415
118 1HG2 THR 17 1HG2 THR 17 -0.305 10.456 2.861
119 2HG2 THR 17 2HG2 THR 17 0.722 9.034 3.165
120 3HG2 THR 17 3HG2 THR 17 1.351 10.399 2.210
121 H THR 18 H THR 18 2.828 8.654 2.223
122 HA THR 18 HA THR 18 3.373 6.032 3.159
123 HB THR 18 HB THR 18 4.449 8.754 3.329
124 HG1 THR 18 1HG THR 18 6.212 7.406 3.030
125 1HG2 THR 18 1HG2 THR 18 3.863 8.619 5.745
126 2HG2 THR 18 2HG2 THR 18 4.558 6.982 5.827
127 3HG2 THR 18 3HG2 THR 18 5.614 8.381 5.527
128 H CYS 19 H CYS 19 2.283 4.837 4.576
129 HA CYS 19 HA CYS 19 0.481 4.446 5.898
130 1HB CYS 19 1HB CYS 19 1.840 5.948 8.048
131 2HB CYS 19 2HB CYS 19 1.294 4.269 7.995
132 H TRP 20 H TRP 20 -0.826 6.144 4.539
133 HA TRP 20 HA TRP 20 -2.359 7.673 6.284
134 1HB TRP 20 1HB TRP 20 -0.174 9.026 6.198
135 2HB TRP 20 2HB TRP 20 -0.674 9.476 4.566
136 HD1 TRP 20 HD TRP 20 -2.437 11.443 4.407
137 HE1 TRP 20 1HE TRP 20 -3.810 12.958 6.075
138 HE3 TRP 20 3HE TRP 20 -1.322 8.766 8.583
139 HZ2 TRP 20 2HZ TRP 20 -4.267 12.869 8.890
140 HZ3 TRP 20 3HZ TRP 20 -2.272 9.548 10.751
141 HH2 TRP 20 HH TRP 20 -3.699 11.524 10.946
142 H LYS 21 H LYS 21 -3.993 6.554 5.118
143 HA LYS 21 HA LYS 21 -4.913 7.836 2.808
144 1HB LYS 21 1HB LYS 21 -2.996 5.718 2.347
145 2HB LYS 21 2HB LYS 21 -4.569 5.313 1.638
146 1HG LYS 21 1HG LYS 21 -2.963 7.863 1.195
147 2HG LYS 21 2HG LYS 21 -3.207 6.564 0.014
148 1HD LYS 21 1HD LYS 21 -5.757 7.057 0.385
149 2HD LYS 21 2HD LYS 21 -5.201 8.596 1.064
150 1HE LYS 21 1HE LYS 21 -4.468 9.380 -0.980
151 2HE LYS 21 2HE LYS 21 -4.030 7.771 -1.574
152 1HZ LYS 21 1HZ LYS 21 -5.991 7.766 -2.640
153 2HZ LYS 21 2HZ LYS 21 -6.796 7.806 -1.224
154 3HZ LYS 21 3HZ LYS 21 -6.381 9.214 -1.967
155 H THR 22 H THR 22 -5.454 4.465 2.523
156 HA THR 22 HA THR 22 -7.289 3.250 2.883
157 HB THR 22 HB THR 22 -7.996 3.589 5.507
158 HG1 THR 22 1HG THR 22 -6.463 4.898 6.443
159 1HG2 THR 22 1HG2 THR 22 -6.884 1.530 4.658
160 2HG2 THR 22 2HG2 THR 22 -5.344 2.413 4.518
161 3HG2 THR 22 3HG2 THR 22 -6.055 2.112 6.122
162 H SER 23 H SER 23 -9.655 3.399 4.136
163 HA SER 23 HA SER 23 -11.621 4.335 4.158
164 1HB SER 23 1HB SER 23 -10.046 6.459 4.830
165 2HB SER 23 2HB SER 23 -10.810 7.093 3.361
166 HG SER 23 HG SER 23 -12.878 6.217 4.493
167 H LEU 24 H LEU 24 -9.661 3.927 1.572
168 HA LEU 24 HA LEU 24 -11.841 4.285 -0.279
169 1HB LEU 24 1HB LEU 24 -10.884 6.455 -0.398
170 2HB LEU 24 2HB LEU 24 -9.245 5.798 -0.558
171 HG LEU 24 HG LEU 24 -10.012 4.783 -2.753
172 1HD1 LEU 24 1HD1 LEU 24 -12.199 4.780 -3.161
173 2HD1 LEU 24 2HD1 LEU 24 -12.520 5.973 -1.879
174 3HD1 LEU 24 3HD1 LEU 24 -12.046 6.521 -3.504
175 1HD2 LEU 24 1HD2 LEU 24 -9.433 6.682 -3.969
176 2HD2 LEU 24 2HD2 LEU 24 -10.214 7.788 -2.812
177 3HD2 LEU 24 3HD2 LEU 24 -8.695 6.969 -2.376
178 H THR 25 H THR 25 -8.500 3.258 0.509
179 HA THR 25 HA THR 25 -8.958 0.758 -0.807
180 HB THR 25 HB THR 25 -7.544 2.984 -2.180
181 HG1 THR 25 1HG THR 25 -9.404 1.581 -2.881
182 1HG2 THR 25 1HG2 THR 25 -6.373 0.155 -2.190
183 2HG2 THR 25 2HG2 THR 25 -5.851 1.514 -3.214
184 3HG2 THR 25 3HG2 THR 25 -5.572 1.564 -1.456
185 H SER 26 H SER 26 -6.574 3.053 0.632
186 HA SER 26 HA SER 26 -5.534 2.632 2.597
187 1HB SER 26 1HB SER 26 -5.496 -0.337 1.966
188 2HB SER 26 2HB SER 26 -5.187 0.441 3.529
189 HG SER 26 HG SER 26 -7.620 1.244 2.827
190 H HIS 27 H HIS 27 -3.828 3.769 1.519
191 HA HIS 27 HA HIS 27 -2.031 2.153 -0.094
192 1HB HIS 27 1HB HIS 27 -2.018 5.133 0.432
193 2HB HIS 27 2HB HIS 27 -1.036 4.269 -0.757
194 HD1 HIS 27 1HD HIS 27 -4.810 4.425 -0.009
195 HD2 HIS 27 2HD HIS 27 -2.121 4.631 -3.222
196 HE1 HIS 27 1HE HIS 27 -6.226 4.753 -2.105
197 HE2 HIS 27 2HE HIS 27 -4.522 4.872 -4.058
198 H TYR 28 H TYR 28 -1.988 4.375 2.777
199 HA TYR 28 HA TYR 28 -0.139 4.764 4.111
200 1HB TYR 28 1HB TYR 28 -1.789 2.335 4.474
201 2HB TYR 28 2HB TYR 28 -0.218 2.135 5.253
202 HD1 TYR 28 1HD TYR 28 -0.178 2.649 7.506
203 HD2 TYR 28 2HD TYR 28 -2.814 4.840 4.946
204 HE1 TYR 28 1HE TYR 28 -1.022 3.981 9.501
205 HE2 TYR 28 2HE TYR 28 -3.649 6.164 6.949
206 HH TYR 28 HH TYR 28 -2.565 5.364 10.216
207 H CYS 29 H CYS 29 1.357 4.584 2.019
208 HA CYS 29 HA CYS 29 3.651 3.284 2.833
209 1HB CYS 29 1HB CYS 29 1.935 1.414 1.804
210 2HB CYS 29 2HB CYS 29 2.912 1.831 0.393
211 H THR 30 H THR 30 4.422 2.686 -0.088
212 HA THR 30 HA THR 30 3.932 5.094 -1.536
213 HB THR 30 HB THR 30 6.345 4.813 0.230
214 HG1 THR 30 1HG THR 30 5.345 6.742 0.639
215 1HG2 THR 30 1HG2 THR 30 6.418 6.060 -2.569
216 2HG2 THR 30 2HG2 THR 30 7.649 6.315 -1.307
217 3HG2 THR 30 3HG2 THR 30 7.419 4.696 -2.014
218 H GLY 31 H GLY 31 4.185 1.922 -1.446
219 1HA GLY 31 1HA GLY 31 4.655 0.314 -2.942
220 2HA GLY 31 2HA GLY 31 4.525 1.557 -4.169
221 H LYS 32 H LYS 32 6.555 -0.793 -3.019
222 HA LYS 32 HA LYS 32 8.654 -1.285 -3.552
223 1HB LYS 32 1HB LYS 32 8.764 1.464 -4.809
224 2HB LYS 32 2HB LYS 32 10.027 0.229 -4.947
225 1HG LYS 32 1HG LYS 32 8.765 -0.058 -6.911
226 2HG LYS 32 2HG LYS 32 8.108 -1.309 -5.843
227 1HD LYS 32 1HD LYS 32 6.117 -0.140 -5.489
228 2HD LYS 32 2HD LYS 32 6.843 1.436 -5.848
229 1HE LYS 32 1HE LYS 32 7.017 -0.324 -8.161
230 2HE LYS 32 2HE LYS 32 5.341 -0.224 -7.603
231 1HZ LYS 32 1HZ LYS 32 5.291 2.037 -8.030
232 2HZ LYS 32 2HZ LYS 32 6.894 2.258 -7.844
233 3HZ LYS 32 3HZ LYS 32 6.326 1.521 -9.199
234 H SER 33 H SER 33 8.830 2.269 -2.805
235 HA SER 33 HA SER 33 10.591 1.517 -0.615
236 1HB SER 33 1HB SER 33 10.935 3.364 -2.642
237 2HB SER 33 2HB SER 33 10.391 4.389 -1.302
238 HG SER 33 HG SER 33 12.117 3.498 -0.007
239 H CYS 34 H CYS 34 8.913 0.993 0.921
240 HA CYS 34 HA CYS 34 7.841 3.312 2.205
241 1HB CYS 34 1HB CYS 34 5.539 2.754 2.113
242 2HB CYS 34 2HB CYS 34 6.144 2.870 0.458
243 H ASP 35 H ASP 35 5.978 1.886 3.874
244 HA ASP 35 HA ASP 35 6.914 -0.559 4.726
245 1HB ASP 35 1HB ASP 35 7.839 0.351 7.000
246 2HB ASP 35 2HB ASP 35 8.917 0.317 5.596
247 HD2 ASP 35 HD ASP 35 8.305 2.982 7.952
248 H CYS 36 H CYS 36 4.416 -0.226 4.474
249 HA CYS 36 HA CYS 36 3.285 -0.057 7.041
250 1HB CYS 36 1HB CYS 36 3.141 2.356 5.322
251 2HB CYS 36 2HB CYS 36 1.649 1.861 6.127
252 HA PRO 37 HA PRO 37 0.406 -2.386 4.750
253 1HB PRO 37 1HB PRO 37 -1.795 -2.328 6.367
254 2HB PRO 37 2HB PRO 37 -0.422 -3.397 6.646
255 1HG PRO 37 1HG PRO 37 -1.184 -0.895 8.009
256 2HG PRO 37 2HG PRO 37 -0.096 -2.205 8.593
257 1HD PRO 37 1HD PRO 37 0.611 0.380 7.582
258 2HD PRO 37 2HD PRO 37 1.723 -0.932 7.993
259 H LEU 38 H LEU 38 -0.915 -2.244 3.009
260 HA LEU 38 HA LEU 38 -2.255 0.363 2.827
261 1HB LEU 38 1HB LEU 38 -1.868 -1.080 0.335
262 2HB LEU 38 2HB LEU 38 -1.508 0.603 0.752
263 HG LEU 38 HG LEU 38 0.232 -1.822 0.832
264 1HD1 LEU 38 1HD1 LEU 38 1.034 1.016 0.227
265 2HD1 LEU 38 2HD1 LEU 38 1.756 -0.509 -0.342
266 3HD1 LEU 38 3HD1 LEU 38 0.178 0.018 -0.973
267 1HD2 LEU 38 1HD2 LEU 38 1.791 -0.152 2.250
268 2HD2 LEU 38 2HD2 LEU 38 0.200 0.290 2.916
269 3HD2 LEU 38 3HD2 LEU 38 0.757 -1.398 2.989
270 H TYR 39 H TYR 39 -3.587 -1.458 4.347
271 HA TYR 39 HA TYR 39 -6.033 -1.668 3.138
272 1HB TYR 39 1HB TYR 39 -4.374 -3.395 1.860
273 2HB TYR 39 2HB TYR 39 -4.713 -4.414 3.262
274 HD1 TYR 39 1HD TYR 39 -6.514 -2.384 0.669
275 HD2 TYR 39 2HD TYR 39 -6.528 -5.864 3.157
276 HE1 TYR 39 1HE TYR 39 -8.665 -3.173 -0.434
277 HE2 TYR 39 2HE TYR 39 -8.679 -6.641 2.046
278 HH TYR 39 HH TYR 39 -10.438 -5.896 0.820
279 HA PRO 40 HA PRO 40 -6.859 -2.780 7.237
280 1HB PRO 40 1HB PRO 40 -9.488 -3.501 7.057
281 2HB PRO 40 2HB PRO 40 -8.954 -1.827 7.148
282 1HG PRO 40 1HG PRO 40 -9.898 -3.391 4.834
283 2HG PRO 40 2HG PRO 40 -9.821 -1.602 5.024
284 1HD PRO 40 1HD PRO 40 -8.093 -3.308 3.507
285 2HD PRO 40 2HD PRO 40 -7.881 -1.575 3.790
286 H GLY 41 H GLY 41 -7.672 -4.517 8.754
287 1HA GLY 41 1HA GLY 41 -8.191 -6.825 8.966
288 2HA GLY 41 2HA GLY 41 -7.372 -7.143 7.448
Start of MODEL 7
1 H CYS 1 H CYS 1 -2.117 -3.315 5.356
2 HA CYS 1 HA CYS 1 0.020 -3.513 3.939
3 1HB CYS 1 1HB CYS 1 1.616 -4.629 4.976
4 2HB CYS 1 2HB CYS 1 0.514 -5.240 6.215
5 H THR 2 H THR 2 -0.098 -5.288 2.199
6 HA THR 2 HA THR 2 -2.789 -6.488 2.183
7 HB THR 2 HB THR 2 -1.244 -4.857 0.157
8 HG1 THR 2 1HG THR 2 -3.991 -5.327 1.076
9 1HG2 THR 2 1HG2 THR 2 -1.792 -7.130 -0.927
10 2HG2 THR 2 2HG2 THR 2 -3.504 -6.785 -0.574
11 3HG2 THR 2 3HG2 THR 2 -2.590 -5.725 -1.675
12 H THR 3 H THR 3 0.634 -6.754 1.080
13 HA THR 3 HA THR 3 0.161 -9.654 0.858
14 HB THR 3 HB THR 3 2.101 -7.824 -0.652
15 HG1 THR 3 1HG THR 3 0.341 -7.765 -1.989
16 1HG2 THR 3 1HG2 THR 3 1.844 -10.183 -2.072
17 2HG2 THR 3 2HG2 THR 3 3.215 -9.820 -0.995
18 3HG2 THR 3 3HG2 THR 3 1.844 -10.788 -0.398
19 H GLY 4 H GLY 4 3.184 -7.700 1.013
20 1HA GLY 4 1HA GLY 4 3.918 -9.307 3.384
21 2HA GLY 4 2HA GLY 4 5.038 -8.704 2.178
22 HA PRO 5 HA PRO 5 5.446 -5.427 5.079
23 1HB PRO 5 1HB PRO 5 7.707 -4.331 4.010
24 2HB PRO 5 2HB PRO 5 7.735 -5.652 5.177
25 1HG PRO 5 1HG PRO 5 8.157 -5.690 2.258
26 2HG PRO 5 2HG PRO 5 8.652 -6.915 3.479
27 1HD PRO 5 1HD PRO 5 6.486 -7.040 1.610
28 2HD PRO 5 2HD PRO 5 6.836 -8.200 2.899
29 H CYS 6 H CYS 6 5.047 -5.227 1.699
30 HA CYS 6 HA CYS 6 3.620 -3.781 0.704
31 1HB CYS 6 1HB CYS 6 2.555 -2.109 1.732
32 2HB CYS 6 2HB CYS 6 3.162 -2.904 3.187
33 H CYS 7 H CYS 7 4.140 -2.074 -0.862
34 HA CYS 7 HA CYS 7 5.462 -0.477 -1.771
35 1HB CYS 7 1HB CYS 7 6.790 -0.710 0.634
36 2HB CYS 7 2HB CYS 7 8.030 -1.145 -0.546
37 H ARG 8 H ARG 8 4.873 -3.306 -2.407
38 HA ARG 8 HA ARG 8 6.406 -3.606 -4.616
39 1HB ARG 8 1HB ARG 8 8.324 -4.047 -3.123
40 2HB ARG 8 2HB ARG 8 7.429 -5.347 -2.317
41 1HG ARG 8 1HG ARG 8 9.048 -6.190 -4.017
42 2HG ARG 8 2HG ARG 8 7.380 -6.645 -4.405
43 1HD ARG 8 1HD ARG 8 7.237 -4.782 -6.016
44 2HD ARG 8 2HD ARG 8 8.876 -4.260 -5.597
45 HE ARG 8 HE ARG 8 9.754 -6.115 -6.794
46 1HH1 ARG 8 2HH2 ARG 8 6.216 -6.275 -6.662
47 2HH1 ARG 8 1HH2 ARG 8 6.104 -7.504 -7.876
48 1HH2 ARG 8 2HH1 ARG 8 9.603 -7.714 -8.369
49 2HH2 ARG 8 1HH1 ARG 8 8.039 -8.332 -8.855
50 H GLN 9 H GLN 9 4.141 -4.561 -2.257
51 HA GLN 9 HA GLN 9 2.718 -6.121 -4.057
52 1HB GLN 9 1HB GLN 9 4.539 -7.574 -2.197
53 2HB GLN 9 2HB GLN 9 2.897 -8.222 -2.336
54 1HG GLN 9 1HG GLN 9 3.739 -7.614 -4.980
55 2HG GLN 9 2HG GLN 9 5.122 -8.405 -4.209
56 1HE2 GLN 9 1HE2 GLN 9 5.051 -10.524 -3.715
57 2HE2 GLN 9 2HE2 GLN 9 3.746 -11.594 -4.103
58 H CYS 10 H CYS 10 3.481 -5.346 -0.629
59 HA CYS 10 HA CYS 10 0.806 -5.816 0.226
60 1HB CYS 10 1HB CYS 10 3.324 -5.417 1.435
61 2HB CYS 10 2HB CYS 10 2.273 -4.127 2.026
62 H LYS 11 H LYS 11 2.249 -3.496 -1.733
63 HA LYS 11 HA LYS 11 0.209 -1.529 -0.982
64 1HB LYS 11 1HB LYS 11 1.662 0.139 -0.734
65 2HB LYS 11 2HB LYS 11 2.868 -1.135 -0.479
66 1HG LYS 11 1HG LYS 11 2.222 0.335 -3.064
67 2HG LYS 11 2HG LYS 11 3.736 0.407 -2.146
68 1HD LYS 11 1HD LYS 11 4.493 -1.568 -3.013
69 2HD LYS 11 2HD LYS 11 2.891 -2.327 -2.976
70 1HE LYS 11 1HE LYS 11 2.461 -0.492 -4.920
71 2HE LYS 11 2HE LYS 11 4.206 -0.703 -5.132
72 1HZ LYS 11 1HZ LYS 11 3.741 -2.614 -6.187
73 2HZ LYS 11 2HZ LYS 11 3.060 -3.237 -4.846
74 3HZ LYS 11 3HZ LYS 11 2.137 -2.385 -5.906
75 H LEU 12 H LEU 12 0.335 -3.801 -2.957
76 HA LEU 12 HA LEU 12 0.926 -3.220 -5.482
77 1HB LEU 12 1HB LEU 12 -0.606 -4.773 -6.124
78 2HB LEU 12 2HB LEU 12 -0.357 -5.190 -4.419
79 HG LEU 12 HG LEU 12 -2.459 -3.856 -3.923
80 1HD1 LEU 12 1HD1 LEU 12 -3.197 -2.550 -5.577
81 2HD1 LEU 12 2HD1 LEU 12 -2.285 -3.443 -6.817
82 3HD1 LEU 12 3HD1 LEU 12 -3.875 -4.037 -6.281
83 1HD2 LEU 12 1HD2 LEU 12 -2.253 -6.384 -4.115
84 2HD2 LEU 12 2HD2 LEU 12 -3.881 -5.694 -4.309
85 3HD2 LEU 12 3HD2 LEU 12 -2.961 -6.217 -5.740
86 H LYS 13 H LYS 13 -1.528 -1.594 -3.494
87 HA LYS 13 HA LYS 13 -3.166 -0.420 -5.234
88 1HB LYS 13 1HB LYS 13 -1.756 1.131 -3.059
89 2HB LYS 13 2HB LYS 13 -3.393 1.387 -3.688
90 1HG LYS 13 1HG LYS 13 -3.979 0.138 -1.866
91 2HG LYS 13 2HG LYS 13 -3.576 -1.229 -2.920
92 1HD LYS 13 1HD LYS 13 -1.111 -0.455 -1.843
93 2HD LYS 13 2HD LYS 13 -2.233 -0.263 -0.483
94 1HE LYS 13 1HE LYS 13 -1.430 -2.733 -1.995
95 2HE LYS 13 2HE LYS 13 -1.665 -2.516 -0.254
96 1HZ LYS 13 1HZ LYS 13 -4.145 -2.130 -1.164
97 2HZ LYS 13 2HZ LYS 13 -3.621 -3.169 -2.302
98 3HZ LYS 13 3HZ LYS 13 -3.539 -3.591 -0.714
99 HA PRO 14 HA PRO 14 -0.900 2.030 -7.967
100 1HB PRO 14 1HB PRO 14 -2.669 4.022 -8.577
101 2HB PRO 14 2HB PRO 14 -2.744 2.412 -9.294
102 1HG PRO 14 1HG PRO 14 -4.394 3.624 -7.168
103 2HG PRO 14 2HG PRO 14 -4.769 2.203 -8.209
104 1HD PRO 14 1HD PRO 14 -3.965 2.233 -5.461
105 2HD PRO 14 2HD PRO 14 -4.167 0.807 -6.486
106 H ALA 15 H ALA 15 0.195 2.392 -5.596
107 HA ALA 15 HA ALA 15 1.389 3.824 -4.407
108 1HB ALA 15 1HB ALA 15 2.090 4.473 -6.777
109 2HB ALA 15 2HB ALA 15 0.965 5.843 -6.636
110 3HB ALA 15 3HB ALA 15 2.347 5.710 -5.524
111 H GLY 16 H GLY 16 0.977 5.163 -2.662
112 1HA GLY 16 1HA GLY 16 -0.894 7.276 -2.701
113 2HA GLY 16 2HA GLY 16 -1.660 5.837 -2.061
114 H THR 17 H THR 17 1.042 8.152 -1.630
115 HA THR 17 HA THR 17 2.372 8.591 0.111
116 HB THR 17 HB THR 17 -0.117 7.914 1.753
117 HG1 THR 17 1HG THR 17 -0.591 9.184 -0.201
118 1HG2 THR 17 1HG2 THR 17 2.312 9.670 2.069
119 2HG2 THR 17 2HG2 THR 17 0.751 10.341 2.604
120 3HG2 THR 17 3HG2 THR 17 1.360 8.827 3.316
121 H THR 18 H THR 18 2.960 7.764 2.548
122 HA THR 18 HA THR 18 3.341 4.856 2.242
123 HB THR 18 HB THR 18 5.352 6.515 1.893
124 HG1 THR 18 1HG THR 18 5.152 4.363 3.874
125 1HG2 THR 18 1HG2 THR 18 6.483 7.192 3.945
126 2HG2 THR 18 2HG2 THR 18 4.831 7.847 4.028
127 3HG2 THR 18 3HG2 THR 18 5.257 6.383 4.949
128 H CYS 19 H CYS 19 1.338 6.817 3.724
129 HA CYS 19 HA CYS 19 0.700 5.127 5.750
130 1HB CYS 19 1HB CYS 19 2.970 6.780 6.470
131 2HB CYS 19 2HB CYS 19 1.601 7.056 7.550
132 H TRP 20 H TRP 20 -1.040 6.134 4.204
133 HA TRP 20 HA TRP 20 -2.040 8.606 5.450
134 1HB TRP 20 1HB TRP 20 -1.265 8.948 3.148
135 2HB TRP 20 2HB TRP 20 -2.377 7.700 2.584
136 HD1 TRP 20 HD TRP 20 -5.136 8.367 3.329
137 HE1 TRP 20 1HE TRP 20 -6.414 10.657 3.037
138 HE3 TRP 20 3HE TRP 20 -0.964 11.258 3.007
139 HZ2 TRP 20 2HZ TRP 20 -5.557 13.360 2.711
140 HZ3 TRP 20 3HZ TRP 20 -1.273 13.713 2.702
141 HH2 TRP 20 HH TRP 20 -3.472 14.770 2.555
142 H LYS 21 H LYS 21 -3.199 5.872 3.336
143 HA LYS 21 HA LYS 21 -4.823 4.393 3.626
144 1HB LYS 21 1HB LYS 21 -4.471 3.590 5.680
145 2HB LYS 21 2HB LYS 21 -4.284 5.194 6.410
146 1HG LYS 21 1HG LYS 21 -7.009 4.316 5.469
147 2HG LYS 21 2HG LYS 21 -6.386 3.650 6.988
148 1HD LYS 21 1HD LYS 21 -5.857 6.441 7.060
149 2HD LYS 21 2HD LYS 21 -7.514 6.279 6.455
150 1HE LYS 21 1HE LYS 21 -7.336 6.433 8.966
151 2HE LYS 21 2HE LYS 21 -8.156 4.967 8.407
152 1HZ LYS 21 1HZ LYS 21 -5.312 4.640 8.678
153 2HZ LYS 21 2HZ LYS 21 -6.022 5.025 10.092
154 3HZ LYS 21 3HZ LYS 21 -6.558 3.726 9.239
155 H THR 22 H THR 22 -6.655 4.729 2.499
156 HA THR 22 HA THR 22 -8.213 7.135 3.186
157 HB THR 22 HB THR 22 -8.737 7.288 0.835
158 HG1 THR 22 1HG THR 22 -7.294 4.799 0.437
159 1HG2 THR 22 1HG2 THR 22 -5.865 6.254 1.108
160 2HG2 THR 22 2HG2 THR 22 -6.517 7.027 -0.357
161 3HG2 THR 22 3HG2 THR 22 -6.380 7.957 1.155
162 H SER 23 H SER 23 -10.602 6.704 2.076
163 HA SER 23 HA SER 23 -11.565 4.571 3.743
164 1HB SER 23 1HB SER 23 -12.662 7.028 2.508
165 2HB SER 23 2HB SER 23 -13.801 5.671 2.555
166 HG SER 23 HG SER 23 -12.984 5.545 4.932
167 H LEU 24 H LEU 24 -10.523 4.982 0.531
168 HA LEU 24 HA LEU 24 -12.366 2.926 -0.455
169 1HB LEU 24 1HB LEU 24 -11.650 3.622 -2.676
170 2HB LEU 24 2HB LEU 24 -12.407 4.933 -1.755
171 HG LEU 24 HG LEU 24 -9.615 5.120 -1.312
172 1HD1 LEU 24 1HD1 LEU 24 -8.514 4.872 -3.276
173 2HD1 LEU 24 2HD1 LEU 24 -9.786 3.658 -3.553
174 3HD1 LEU 24 3HD1 LEU 24 -9.939 5.285 -4.261
175 1HD2 LEU 24 1HD2 LEU 24 -9.896 7.256 -2.610
176 2HD2 LEU 24 2HD2 LEU 24 -11.573 6.755 -2.937
177 3HD2 LEU 24 3HD2 LEU 24 -11.036 7.026 -1.262
178 H THR 25 H THR 25 -8.971 3.764 0.228
179 HA THR 25 HA THR 25 -8.277 0.996 0.267
180 HB THR 25 HB THR 25 -7.390 2.795 -2.035
181 HG1 THR 25 1HG THR 25 -8.086 0.708 -3.082
182 1HG2 THR 25 1HG2 THR 25 -5.663 1.057 -0.627
183 2HG2 THR 25 2HG2 THR 25 -6.287 0.064 -1.967
184 3HG2 THR 25 3HG2 THR 25 -5.455 1.599 -2.310
185 H SER 26 H SER 26 -7.002 0.791 1.987
186 HA SER 26 HA SER 26 -6.027 2.952 3.350
187 1HB SER 26 1HB SER 26 -5.656 0.009 3.407
188 2HB SER 26 2HB SER 26 -4.348 0.933 4.166
189 HG SER 26 HG SER 26 -5.680 1.564 5.760
190 H HIS 27 H HIS 27 -4.971 4.321 1.717
191 HA HIS 27 HA HIS 27 -2.702 3.322 0.334
192 1HB HIS 27 1HB HIS 27 -3.804 6.108 0.738
193 2HB HIS 27 2HB HIS 27 -2.414 5.742 -0.288
194 HD1 HIS 27 1HD HIS 27 -4.565 7.004 -1.818
195 HD2 HIS 27 2HD HIS 27 -4.632 2.886 -1.027
196 HE1 HIS 27 1HE HIS 27 -6.098 5.965 -3.574
197 HE2 HIS 27 2HE HIS 27 -6.107 3.426 -3.043
198 H TYR 28 H TYR 28 -1.317 2.448 1.965
199 HA TYR 28 HA TYR 28 0.011 4.542 3.549
200 1HB TYR 28 1HB TYR 28 -1.452 2.114 4.266
201 2HB TYR 28 2HB TYR 28 0.245 1.881 4.694
202 HD1 TYR 28 1HD TYR 28 0.712 2.329 6.913
203 HD2 TYR 28 2HD TYR 28 -2.257 4.683 4.928
204 HE1 TYR 28 1HE TYR 28 0.331 3.661 9.046
205 HE2 TYR 28 2HE TYR 28 -2.627 6.007 7.066
206 HH TYR 28 HH TYR 28 -1.343 6.572 9.075
207 H CYS 29 H CYS 29 0.863 3.894 0.948
208 HA CYS 29 HA CYS 29 3.505 3.357 1.330
209 1HB CYS 29 1HB CYS 29 1.900 0.890 1.073
210 2HB CYS 29 2HB CYS 29 3.338 0.983 0.052
211 H THR 30 H THR 30 4.588 2.872 -0.919
212 HA THR 30 HA THR 30 2.794 3.781 -3.070
213 HB THR 30 HB THR 30 4.029 5.735 -2.761
214 HG1 THR 30 1HG THR 30 5.392 5.583 -4.529
215 1HG2 THR 30 1HG2 THR 30 6.541 4.157 -2.044
216 2HG2 THR 30 2HG2 THR 30 6.212 5.883 -1.761
217 3HG2 THR 30 3HG2 THR 30 5.367 4.647 -0.800
218 H GLY 31 H GLY 31 6.062 2.337 -2.423
219 1HA GLY 31 1HA GLY 31 5.731 -0.083 -3.563
220 2HA GLY 31 2HA GLY 31 5.975 0.949 -4.957
221 H LYS 32 H LYS 32 7.510 -0.852 -2.481
222 HA LYS 32 HA LYS 32 9.619 -1.177 -1.924
223 1HB LYS 32 1HB LYS 32 9.910 0.054 -4.631
224 2HB LYS 32 2HB LYS 32 11.364 -0.219 -3.658
225 1HG LYS 32 1HG LYS 32 9.282 -2.291 -4.468
226 2HG LYS 32 2HG LYS 32 10.937 -2.173 -5.088
227 1HD LYS 32 1HD LYS 32 11.528 -2.351 -2.483
228 2HD LYS 32 2HD LYS 32 9.946 -3.145 -2.413
229 1HE LYS 32 1HE LYS 32 10.661 -4.780 -4.094
230 2HE LYS 32 2HE LYS 32 12.207 -3.944 -4.307
231 1HZ LYS 32 1HZ LYS 32 11.754 -5.960 -2.545
232 2HZ LYS 32 2HZ LYS 32 13.005 -4.922 -2.449
233 3HZ LYS 32 3HZ LYS 32 11.625 -4.616 -1.606
234 H SER 33 H SER 33 10.695 -0.279 -0.242
235 HA SER 33 HA SER 33 11.898 1.284 0.799
236 1HB SER 33 1HB SER 33 11.964 2.575 -1.452
237 2HB SER 33 2HB SER 33 10.619 3.524 -0.800
238 HG SER 33 HG SER 33 11.998 4.599 0.434
239 H CYS 34 H CYS 34 8.977 0.317 0.999
240 HA CYS 34 HA CYS 34 8.164 2.342 2.948
241 1HB CYS 34 1HB CYS 34 6.108 0.798 1.423
242 2HB CYS 34 2HB CYS 34 5.950 2.328 2.290
243 H ASP 35 H ASP 35 6.266 1.155 4.367
244 HA ASP 35 HA ASP 35 6.510 -1.626 4.588
245 1HB ASP 35 1HB ASP 35 8.697 -0.684 5.629
246 2HB ASP 35 2HB ASP 35 7.671 -0.089 6.944
247 HD2 ASP 35 HD ASP 35 8.900 -1.737 8.375
248 H CYS 36 H CYS 36 4.637 0.812 4.507
249 HA CYS 36 HA CYS 36 3.394 0.645 7.126
250 1HB CYS 36 1HB CYS 36 3.539 2.625 5.012
251 2HB CYS 36 2HB CYS 36 1.873 2.344 5.527
252 HA PRO 37 HA PRO 37 0.402 -2.099 5.531
253 1HB PRO 37 1HB PRO 37 -1.546 -1.849 7.429
254 2HB PRO 37 2HB PRO 37 -0.122 -2.866 7.638
255 1HG PRO 37 1HG PRO 37 -0.743 -0.216 8.776
256 2HG PRO 37 2HG PRO 37 0.449 -1.436 9.354
257 1HD PRO 37 1HD PRO 37 0.943 1.004 7.939
258 2HD PRO 37 2HD PRO 37 2.133 -0.239 8.344
259 H LEU 38 H LEU 38 -1.020 -2.110 3.894
260 HA LEU 38 HA LEU 38 -2.501 0.411 3.638
261 1HB LEU 38 1HB LEU 38 -1.743 -1.570 1.498
262 2HB LEU 38 2HB LEU 38 -2.538 -0.005 1.262
263 HG LEU 38 HG LEU 38 -0.285 0.797 2.520
264 1HD1 LEU 38 1HD1 LEU 38 1.509 -0.540 2.329
265 2HD1 LEU 38 2HD1 LEU 38 0.300 -1.843 2.231
266 3HD1 LEU 38 3HD1 LEU 38 1.007 -1.171 0.742
267 1HD2 LEU 38 1HD2 LEU 38 0.334 1.733 0.514
268 2HD2 LEU 38 2HD2 LEU 38 -0.099 0.284 -0.427
269 3HD2 LEU 38 3HD2 LEU 38 -1.376 1.352 0.202
270 H TYR 39 H TYR 39 -3.705 -1.047 5.469
271 HA TYR 39 HA TYR 39 -6.145 -1.778 4.237
272 1HB TYR 39 1HB TYR 39 -4.225 -3.747 4.158
273 2HB TYR 39 2HB TYR 39 -4.838 -4.031 5.790
274 HD1 TYR 39 1HD TYR 39 -5.873 -3.808 2.211
275 HD2 TYR 39 2HD TYR 39 -6.832 -5.252 6.122
276 HE1 TYR 39 1HE TYR 39 -7.788 -5.173 1.245
277 HE2 TYR 39 2HE TYR 39 -8.743 -6.612 5.143
278 HH TYR 39 HH TYR 39 -10.113 -6.715 3.291
279 HA PRO 40 HA PRO 40 -7.361 -0.866 8.290
280 1HB PRO 40 1HB PRO 40 -9.937 -1.771 8.264
281 2HB PRO 40 2HB PRO 40 -9.456 -0.216 7.590
282 1HG PRO 40 1HG PRO 40 -10.116 -2.749 6.231
283 2HG PRO 40 2HG PRO 40 -10.103 -1.082 5.553
284 1HD PRO 40 1HD PRO 40 -8.184 -3.174 5.174
285 2HD PRO 40 2HD PRO 40 -8.045 -1.502 4.617
286 H GLY 41 H GLY 41 -5.620 -2.605 8.765
287 1HA GLY 41 1HA GLY 41 -6.747 -4.209 10.836
288 2HA GLY 41 2HA GLY 41 -6.335 -5.180 9.436
Start of MODEL 8
1 H CYS 1 H CYS 1 -3.991 -3.479 1.732
2 HA CYS 1 HA CYS 1 -3.687 -5.739 1.170
3 1HB CYS 1 1HB CYS 1 -1.237 -5.901 0.874
4 2HB CYS 1 2HB CYS 1 -1.942 -4.388 0.291
5 H THR 2 H THR 2 -0.839 -6.602 2.476
6 HA THR 2 HA THR 2 -0.898 -7.174 5.055
7 HB THR 2 HB THR 2 -3.095 -8.029 5.222
8 HG1 THR 2 1HG THR 2 -2.664 -10.461 5.130
9 1HG2 THR 2 1HG2 THR 2 -3.345 -10.076 3.270
10 2HG2 THR 2 2HG2 THR 2 -4.222 -8.527 3.292
11 3HG2 THR 2 3HG2 THR 2 -2.699 -8.674 2.385
12 H THR 3 H THR 3 0.076 -7.632 1.933
13 HA THR 3 HA THR 3 1.338 -10.127 1.994
14 HB THR 3 HB THR 3 1.927 -7.506 0.524
15 HG1 THR 3 1HG THR 3 0.644 -10.077 -0.087
16 1HG2 THR 3 1HG2 THR 3 3.833 -9.343 0.604
17 2HG2 THR 3 2HG2 THR 3 2.715 -10.292 -0.405
18 3HG2 THR 3 3HG2 THR 3 3.314 -8.718 -0.980
19 H GLY 4 H GLY 4 3.627 -7.517 1.602
20 1HA GLY 4 1HA GLY 4 4.891 -8.292 4.162
21 2HA GLY 4 2HA GLY 4 5.790 -8.157 2.664
22 HA PRO 5 HA PRO 5 6.339 -4.012 3.967
23 1HB PRO 5 1HB PRO 5 8.143 -3.284 2.050
24 2HB PRO 5 2HB PRO 5 8.602 -4.085 3.549
25 1HG PRO 5 1HG PRO 5 8.366 -5.168 0.815
26 2HG PRO 5 2HG PRO 5 9.279 -5.841 2.215
27 1HD PRO 5 1HD PRO 5 6.789 -6.734 1.119
28 2HD PRO 5 2HD PRO 5 7.565 -7.325 2.593
29 H CYS 6 H CYS 6 4.403 -5.088 1.738
30 HA CYS 6 HA CYS 6 2.897 -4.181 0.429
31 1HB CYS 6 1HB CYS 6 1.930 -2.155 0.964
32 2HB CYS 6 2HB CYS 6 2.631 -2.700 2.490
33 H CYS 7 H CYS 7 5.655 -1.821 0.756
34 HA CYS 7 HA CYS 7 5.559 -0.740 -1.732
35 1HB CYS 7 1HB CYS 7 7.500 -0.982 0.397
36 2HB CYS 7 2HB CYS 7 8.289 -1.007 -1.183
37 H ARG 8 H ARG 8 4.732 -2.717 -2.957
38 HA ARG 8 HA ARG 8 5.478 -3.757 -4.858
39 1HB ARG 8 1HB ARG 8 7.901 -3.295 -4.342
40 2HB ARG 8 2HB ARG 8 7.906 -4.688 -3.245
41 1HG ARG 8 1HG ARG 8 8.746 -5.596 -5.236
42 2HG ARG 8 2HG ARG 8 7.028 -6.017 -5.340
43 1HD ARG 8 1HD ARG 8 6.869 -3.663 -6.574
44 2HD ARG 8 2HD ARG 8 8.595 -3.927 -6.865
45 HE ARG 8 HE ARG 8 7.064 -6.290 -7.521
46 1HH1 ARG 8 2HH2 ARG 8 7.868 -3.067 -8.752
47 2HH1 ARG 8 1HH2 ARG 8 7.625 -3.503 -10.411
48 1HH2 ARG 8 2HH1 ARG 8 6.747 -6.853 -9.677
49 2HH2 ARG 8 1HH1 ARG 8 6.983 -5.669 -10.945
50 H GLN 9 H GLN 9 4.987 -4.635 -1.591
51 HA GLN 9 HA GLN 9 3.828 -7.118 -2.441
52 1HB GLN 9 1HB GLN 9 6.305 -6.952 -0.839
53 2HB GLN 9 2HB GLN 9 5.059 -7.989 -0.123
54 1HG GLN 9 1HG GLN 9 5.125 -8.551 -2.923
55 2HG GLN 9 2HG GLN 9 6.807 -8.520 -2.373
56 1HE2 GLN 9 1HE2 GLN 9 4.991 -10.703 -3.248
57 2HE2 GLN 9 2HE2 GLN 9 5.003 -11.887 -1.984
58 H CYS 10 H CYS 10 1.923 -5.734 -1.969
59 HA CYS 10 HA CYS 10 0.317 -6.164 -0.155
60 1HB CYS 10 1HB CYS 10 1.416 -6.358 1.796
61 2HB CYS 10 2HB CYS 10 2.649 -5.167 1.370
62 H LYS 11 H LYS 11 2.389 -3.541 -1.341
63 HA LYS 11 HA LYS 11 0.242 -1.603 -1.044
64 1HB LYS 11 1HB LYS 11 1.818 0.007 -1.206
65 2HB LYS 11 2HB LYS 11 2.861 -1.308 -0.636
66 1HG LYS 11 1HG LYS 11 4.117 -0.818 -2.464
67 2HG LYS 11 2HG LYS 11 2.886 -1.707 -3.376
68 1HD LYS 11 1HD LYS 11 1.653 0.650 -3.358
69 2HD LYS 11 2HD LYS 11 3.288 1.273 -3.083
70 1HE LYS 11 1HE LYS 11 2.487 1.083 -5.527
71 2HE LYS 11 2HE LYS 11 4.077 0.395 -5.162
72 1HZ LYS 11 1HZ LYS 11 2.176 -0.966 -6.422
73 2HZ LYS 11 2HZ LYS 11 3.283 -1.710 -5.488
74 3HZ LYS 11 3HZ LYS 11 1.803 -1.350 -4.867
75 H LEU 12 H LEU 12 0.030 -4.024 -2.816
76 HA LEU 12 HA LEU 12 0.478 -3.703 -5.416
77 1HB LEU 12 1HB LEU 12 -1.301 -5.105 -5.840
78 2HB LEU 12 2HB LEU 12 -0.817 -5.503 -4.181
79 HG LEU 12 HG LEU 12 -2.728 -3.810 -3.551
80 1HD1 LEU 12 1HD1 LEU 12 -3.263 -4.408 -6.438
81 2HD1 LEU 12 2HD1 LEU 12 -4.628 -4.226 -5.311
82 3HD1 LEU 12 3HD1 LEU 12 -3.467 -2.894 -5.525
83 1HD2 LEU 12 1HD2 LEU 12 -2.624 -6.246 -3.041
84 2HD2 LEU 12 2HD2 LEU 12 -4.271 -5.639 -3.337
85 3HD2 LEU 12 3HD2 LEU 12 -3.424 -6.566 -4.598
86 H LYS 13 H LYS 13 -1.673 -1.713 -3.415
87 HA LYS 13 HA LYS 13 -3.314 -0.550 -5.196
88 1HB LYS 13 1HB LYS 13 -1.752 0.971 -3.103
89 2HB LYS 13 2HB LYS 13 -3.351 1.372 -3.752
90 1HG LYS 13 1HG LYS 13 -4.030 0.285 -1.848
91 2HG LYS 13 2HG LYS 13 -3.860 -1.145 -2.882
92 1HD LYS 13 1HD LYS 13 -1.284 -0.776 -1.921
93 2HD LYS 13 2HD LYS 13 -2.271 -0.295 -0.531
94 1HE LYS 13 1HE LYS 13 -1.977 -2.963 -1.859
95 2HE LYS 13 2HE LYS 13 -2.167 -2.581 -0.142
96 1HZ LYS 13 1HZ LYS 13 -4.544 -1.867 -0.970
97 2HZ LYS 13 2HZ LYS 13 -4.238 -2.895 -2.195
98 3HZ LYS 13 3HZ LYS 13 -4.175 -3.435 -0.644
99 HA PRO 14 HA PRO 14 -0.984 1.691 -8.054
100 1HB PRO 14 1HB PRO 14 -2.484 3.926 -8.512
101 2HB PRO 14 2HB PRO 14 -2.853 2.357 -9.224
102 1HG PRO 14 1HG PRO 14 -4.132 3.762 -6.968
103 2HG PRO 14 2HG PRO 14 -4.793 2.428 -7.980
104 1HD PRO 14 1HD PRO 14 -3.777 2.299 -5.306
105 2HD PRO 14 2HD PRO 14 -4.266 0.933 -6.315
106 H ALA 15 H ALA 15 0.097 1.913 -5.530
107 HA ALA 15 HA ALA 15 1.522 3.156 -4.381
108 1HB ALA 15 1HB ALA 15 1.628 4.545 -7.074
109 2HB ALA 15 2HB ALA 15 2.638 5.072 -5.707
110 3HB ALA 15 3HB ALA 15 2.805 3.422 -6.354
111 H GLY 16 H GLY 16 0.774 4.245 -2.638
112 1HA GLY 16 1HA GLY 16 -1.007 6.554 -3.140
113 2HA GLY 16 2HA GLY 16 -1.101 5.493 -1.748
114 H THR 17 H THR 17 -0.224 6.297 0.104
115 HA THR 17 HA THR 17 2.272 7.788 -0.076
116 HB THR 17 HB THR 17 -0.395 8.870 0.941
117 HG1 THR 17 1HG THR 17 1.834 9.772 -0.746
118 1HG2 THR 17 1HG2 THR 17 0.684 10.555 2.159
119 2HG2 THR 17 2HG2 THR 17 1.802 9.207 2.482
120 3HG2 THR 17 3HG2 THR 17 2.190 10.403 1.221
121 H THR 18 H THR 18 3.665 7.222 1.489
122 HA THR 18 HA THR 18 3.431 5.086 3.055
123 HB THR 18 HB THR 18 4.899 7.717 3.299
124 HG1 THR 18 1HG THR 18 5.767 6.076 1.949
125 1HG2 THR 18 1HG2 THR 18 4.942 7.393 5.615
126 2HG2 THR 18 2HG2 THR 18 4.552 5.661 5.478
127 3HG2 THR 18 3HG2 THR 18 6.207 6.230 5.150
128 H CYS 19 H CYS 19 2.343 4.337 4.779
129 HA CYS 19 HA CYS 19 0.471 4.373 6.051
130 1HB CYS 19 1HB CYS 19 2.008 6.337 7.708
131 2HB CYS 19 2HB CYS 19 1.060 4.939 8.223
132 H TRP 20 H TRP 20 -0.396 5.876 4.041
133 HA TRP 20 HA TRP 20 -1.097 8.514 5.081
134 1HB TRP 20 1HB TRP 20 -0.143 8.499 2.886
135 2HB TRP 20 2HB TRP 20 -1.300 7.289 2.327
136 HD1 TRP 20 HD TRP 20 -3.207 8.382 0.931
137 HE1 TRP 20 1HE TRP 20 -4.485 10.686 0.772
138 HE3 TRP 20 3HE TRP 20 -0.729 10.620 4.767
139 HZ2 TRP 20 2HZ TRP 20 -4.319 13.130 2.236
140 HZ3 TRP 20 3HZ TRP 20 -1.347 12.967 5.337
141 HH2 TRP 20 HH TRP 20 -3.075 14.216 4.142
142 H LYS 21 H LYS 21 -2.669 5.730 3.328
143 HA LYS 21 HA LYS 21 -4.606 4.709 3.673
144 1HB LYS 21 1HB LYS 21 -4.909 4.330 5.826
145 2HB LYS 21 2HB LYS 21 -4.044 5.811 6.274
146 1HG LYS 21 1HG LYS 21 -6.807 6.165 5.204
147 2HG LYS 21 2HG LYS 21 -6.693 5.383 6.791
148 1HD LYS 21 1HD LYS 21 -4.959 7.431 7.171
149 2HD LYS 21 2HD LYS 21 -6.018 8.188 5.969
150 1HE LYS 21 1HE LYS 21 -7.671 6.831 7.887
151 2HE LYS 21 2HE LYS 21 -6.485 7.787 8.787
152 1HZ LYS 21 1HZ LYS 21 -7.163 9.712 7.410
153 2HZ LYS 21 2HZ LYS 21 -8.295 8.810 6.664
154 3HZ LYS 21 3HZ LYS 21 -8.402 9.075 8.283
155 H THR 22 H THR 22 -6.242 5.107 2.292
156 HA THR 22 HA THR 22 -6.877 7.812 1.611
157 HB THR 22 HB THR 22 -8.203 6.740 -0.121
158 HG1 THR 22 1HG THR 22 -7.816 4.371 1.570
159 1HG2 THR 22 1HG2 THR 22 -5.528 6.001 0.248
160 2HG2 THR 22 2HG2 THR 22 -6.359 4.433 0.129
161 3HG2 THR 22 3HG2 THR 22 -6.505 5.619 -1.190
162 H SER 23 H SER 23 -9.799 6.949 1.143
163 HA SER 23 HA SER 23 -10.623 7.673 3.841
164 1HB SER 23 1HB SER 23 -11.218 8.798 1.300
165 2HB SER 23 2HB SER 23 -12.714 8.032 1.861
166 HG SER 23 HG SER 23 -11.160 10.119 3.094
167 H LEU 24 H LEU 24 -10.064 4.920 2.533
168 HA LEU 24 HA LEU 24 -12.117 3.523 3.781
169 1HB LEU 24 1HB LEU 24 -13.585 4.294 2.086
170 2HB LEU 24 2HB LEU 24 -12.455 3.838 0.800
171 HG LEU 24 HG LEU 24 -13.472 1.703 2.628
172 1HD1 LEU 24 1HD1 LEU 24 -15.254 3.448 1.265
173 2HD1 LEU 24 2HD1 LEU 24 -15.260 1.887 0.409
174 3HD1 LEU 24 3HD1 LEU 24 -15.621 1.948 2.151
175 1HD2 LEU 24 1HD2 LEU 24 -13.497 0.493 0.360
176 2HD2 LEU 24 2HD2 LEU 24 -12.597 1.901 -0.249
177 3HD2 LEU 24 3HD2 LEU 24 -11.920 0.915 1.069
178 H THR 25 H THR 25 -10.335 3.117 0.636
179 HA THR 25 HA THR 25 -9.522 0.522 1.117
180 HB THR 25 HB THR 25 -8.538 2.842 -0.579
181 HG1 THR 25 1HG THR 25 -9.361 1.228 -2.153
182 1HG2 THR 25 1HG2 THR 25 -6.985 0.457 0.144
183 2HG2 THR 25 2HG2 THR 25 -7.424 0.432 -1.581
184 3HG2 THR 25 3HG2 THR 25 -6.521 1.813 -0.911
185 H SER 26 H SER 26 -6.779 2.693 0.810
186 HA SER 26 HA SER 26 -5.887 3.262 3.154
187 1HB SER 26 1HB SER 26 -6.404 1.198 4.227
188 2HB SER 26 2HB SER 26 -5.682 0.239 2.924
189 HG SER 26 HG SER 26 -4.443 1.671 5.060
190 H HIS 27 H HIS 27 -4.477 4.557 1.949
191 HA HIS 27 HA HIS 27 -2.695 3.225 0.088
192 1HB HIS 27 1HB HIS 27 -3.580 6.036 0.580
193 2HB HIS 27 2HB HIS 27 -2.016 5.772 -0.203
194 HD1 HIS 27 1HD HIS 27 -3.358 3.059 -1.652
195 HD2 HIS 27 2HD HIS 27 -4.524 7.079 -1.917
196 HE1 HIS 27 1HE HIS 27 -4.661 3.282 -3.833
197 HE2 HIS 27 2HE HIS 27 -5.355 5.779 -3.951
198 H TYR 28 H TYR 28 -2.436 2.662 2.948
199 HA TYR 28 HA TYR 28 -0.419 4.218 4.115
200 1HB TYR 28 1HB TYR 28 -1.962 1.749 4.468
201 2HB TYR 28 2HB TYR 28 -0.276 1.427 4.883
202 HD1 TYR 28 1HD TYR 28 -3.015 3.898 5.563
203 HD2 TYR 28 2HD TYR 28 0.450 1.876 7.050
204 HE1 TYR 28 1HE TYR 28 -3.392 4.925 7.859
205 HE2 TYR 28 2HE TYR 28 0.062 2.909 9.341
206 HH TYR 28 HH TYR 28 -2.205 3.807 10.548
207 H CYS 29 H CYS 29 0.533 4.090 1.565
208 HA CYS 29 HA CYS 29 3.098 3.182 1.899
209 1HB CYS 29 1HB CYS 29 2.031 0.929 1.847
210 2HB CYS 29 2HB CYS 29 1.532 1.248 0.183
211 H THR 30 H THR 30 4.227 3.120 -0.434
212 HA THR 30 HA THR 30 2.724 4.890 -2.239
213 HB THR 30 HB THR 30 4.190 6.449 -1.273
214 HG1 THR 30 1HG THR 30 4.786 6.307 -3.506
215 1HG2 THR 30 1HG2 THR 30 6.364 5.971 -0.366
216 2HG2 THR 30 2HG2 THR 30 5.359 4.597 0.155
217 3HG2 THR 30 3HG2 THR 30 6.466 4.417 -1.228
218 H GLY 31 H GLY 31 5.432 2.548 -1.820
219 1HA GLY 31 1HA GLY 31 5.139 0.671 -3.479
220 2HA GLY 31 2HA GLY 31 5.182 1.929 -4.699
221 H LYS 32 H LYS 32 7.051 -0.250 -2.833
222 HA LYS 32 HA LYS 32 9.218 -0.674 -2.755
223 1HB LYS 32 1HB LYS 32 9.648 -0.526 -4.972
224 2HB LYS 32 2HB LYS 32 9.074 1.145 -5.111
225 1HG LYS 32 1HG LYS 32 11.539 0.592 -3.475
226 2HG LYS 32 2HG LYS 32 11.683 0.539 -5.240
227 1HD LYS 32 1HD LYS 32 10.178 2.863 -4.671
228 2HD LYS 32 2HD LYS 32 11.469 2.846 -3.459
229 1HE LYS 32 1HE LYS 32 12.752 3.776 -5.086
230 2HE LYS 32 2HE LYS 32 12.825 2.151 -5.784
231 1HZ LYS 32 1HZ LYS 32 11.208 2.707 -7.338
232 2HZ LYS 32 2HZ LYS 32 10.554 3.902 -6.446
233 3HZ LYS 32 3HZ LYS 32 12.013 4.131 -7.167
234 H SER 33 H SER 33 10.123 -0.216 -0.827
235 HA SER 33 HA SER 33 11.452 0.956 0.520
236 1HB SER 33 1HB SER 33 11.760 2.600 -1.500
237 2HB SER 33 2HB SER 33 10.601 3.622 -0.632
238 HG SER 33 HG SER 33 12.691 4.227 0.014
239 H CYS 34 H CYS 34 8.898 0.038 1.110
240 HA CYS 34 HA CYS 34 7.998 2.116 2.946
241 1HB CYS 34 1HB CYS 34 5.971 0.430 1.520
242 2HB CYS 34 2HB CYS 34 5.745 1.938 2.410
243 H ASP 35 H ASP 35 5.852 0.537 4.045
244 HA ASP 35 HA ASP 35 6.281 -2.072 4.451
245 1HB ASP 35 1HB ASP 35 8.490 -0.726 5.502
246 2HB ASP 35 2HB ASP 35 7.476 -0.993 6.929
247 HD2 ASP 35 HD ASP 35 7.251 -3.114 7.591
248 H CYS 36 H CYS 36 4.177 -0.130 4.398
249 HA CYS 36 HA CYS 36 3.229 -0.231 7.171
250 1HB CYS 36 1HB CYS 36 3.474 1.986 5.396
251 2HB CYS 36 2HB CYS 36 1.756 1.692 5.679
252 HA PRO 37 HA PRO 37 -0.001 -2.629 5.494
253 1HB PRO 37 1HB PRO 37 -1.905 -2.361 7.436
254 2HB PRO 37 2HB PRO 37 -0.548 -3.478 7.564
255 1HG PRO 37 1HG PRO 37 -0.977 -0.861 8.857
256 2HG PRO 37 2HG PRO 37 0.139 -2.186 9.347
257 1HD PRO 37 1HD PRO 37 0.775 0.292 8.060
258 2HD PRO 37 2HD PRO 37 1.884 -1.047 8.377
259 H LEU 38 H LEU 38 -1.245 -2.333 3.764
260 HA LEU 38 HA LEU 38 -2.567 0.266 3.665
261 1HB LEU 38 1HB LEU 38 -1.961 -1.781 1.541
262 2HB LEU 38 2HB LEU 38 -2.827 -0.261 1.259
263 HG LEU 38 HG LEU 38 -0.428 0.462 2.530
264 1HD1 LEU 38 1HD1 LEU 38 1.100 -0.604 0.618
265 2HD1 LEU 38 2HD1 LEU 38 0.862 -1.377 2.204
266 3HD1 LEU 38 3HD1 LEU 38 -0.073 -1.929 0.794
267 1HD2 LEU 38 1HD2 LEU 38 -0.507 0.621 -0.422
268 2HD2 LEU 38 2HD2 LEU 38 -1.912 1.307 0.430
269 3HD2 LEU 38 3HD2 LEU 38 -0.273 1.894 0.800
270 H TYR 39 H TYR 39 -3.892 -0.999 5.522
271 HA TYR 39 HA TYR 39 -6.459 -1.199 4.695
272 1HB TYR 39 1HB TYR 39 -4.822 -3.460 3.890
273 2HB TYR 39 2HB TYR 39 -5.920 -4.037 5.147
274 HD1 TYR 39 1HD TYR 39 -8.200 -2.049 4.359
275 HD2 TYR 39 2HD TYR 39 -5.788 -4.782 2.122
276 HE1 TYR 39 1HE TYR 39 -10.044 -2.265 2.624
277 HE2 TYR 39 2HE TYR 39 -7.640 -4.990 0.393
278 HH TYR 39 HH TYR 39 -10.557 -3.005 0.628
279 HA PRO 40 HA PRO 40 -5.805 -1.481 9.117
280 1HB PRO 40 1HB PRO 40 -7.451 0.588 9.804
281 2HB PRO 40 2HB PRO 40 -5.723 0.784 9.523
282 1HG PRO 40 1HG PRO 40 -8.015 1.480 7.803
283 2HG PRO 40 2HG PRO 40 -6.329 2.107 7.733
284 1HD PRO 40 1HD PRO 40 -7.594 0.206 6.007
285 2HD PRO 40 2HD PRO 40 -5.889 0.668 5.995
286 H GLY 41 H GLY 41 -6.971 -2.445 10.785
287 1HA GLY 41 1HA GLY 41 -9.810 -2.877 10.218
288 2HA GLY 41 2HA GLY 41 -8.773 -4.288 10.283
Start of MODEL 9
1 H CYS 1 H CYS 1 -4.921 -4.353 2.962
2 HA CYS 1 HA CYS 1 -3.055 -5.304 1.001
3 1HB CYS 1 1HB CYS 1 -1.603 -3.658 1.160
4 2HB CYS 1 2HB CYS 1 -2.499 -2.882 2.470
5 H THR 2 H THR 2 -1.204 -6.543 2.369
6 HA THR 2 HA THR 2 -1.366 -7.294 4.932
7 HB THR 2 HB THR 2 -3.656 -7.915 4.939
8 HG1 THR 2 1HG THR 2 -2.306 -10.301 3.916
9 1HG2 THR 2 1HG2 THR 2 -4.381 -9.644 3.034
10 2HG2 THR 2 2HG2 THR 2 -4.456 -7.893 2.717
11 3HG2 THR 2 3HG2 THR 2 -3.080 -8.850 2.114
12 H THR 3 H THR 3 0.838 -7.250 3.954
13 HA THR 3 HA THR 3 1.559 -9.989 3.274
14 HB THR 3 HB THR 3 2.391 -7.570 1.587
15 HG1 THR 3 1HG THR 3 0.146 -8.193 1.283
16 1HG2 THR 3 1HG2 THR 3 4.057 -9.146 1.107
17 2HG2 THR 3 2HG2 THR 3 3.036 -10.519 1.597
18 3HG2 THR 3 3HG2 THR 3 2.779 -9.737 0.019
19 H GLY 4 H GLY 4 3.798 -7.359 2.700
20 1HA GLY 4 1HA GLY 4 4.919 -7.689 5.404
21 2HA GLY 4 2HA GLY 4 5.916 -8.005 3.996
22 HA PRO 5 HA PRO 5 6.767 -3.740 3.983
23 1HB PRO 5 1HB PRO 5 8.142 -3.577 1.629
24 2HB PRO 5 2HB PRO 5 8.880 -4.098 3.141
25 1HG PRO 5 1HG PRO 5 8.011 -5.685 0.811
26 2HG PRO 5 2HG PRO 5 9.174 -6.138 2.109
27 1HD PRO 5 1HD PRO 5 6.467 -7.008 1.758
28 2HD PRO 5 2HD PRO 5 7.518 -7.358 3.137
29 H CYS 6 H CYS 6 4.602 -5.240 2.011
30 HA CYS 6 HA CYS 6 2.918 -4.511 0.810
31 1HB CYS 6 1HB CYS 6 1.859 -2.516 1.309
32 2HB CYS 6 2HB CYS 6 2.701 -2.939 2.801
33 H CYS 7 H CYS 7 5.533 -1.975 0.772
34 HA CYS 7 HA CYS 7 5.151 -1.039 -1.748
35 1HB CYS 7 1HB CYS 7 7.232 -0.986 0.227
36 2HB CYS 7 2HB CYS 7 7.949 -1.157 -1.376
37 H ARG 8 H ARG 8 4.758 -2.393 -3.495
38 HA ARG 8 HA ARG 8 5.331 -3.669 -5.173
39 1HB ARG 8 1HB ARG 8 7.567 -3.732 -5.512
40 2HB ARG 8 2HB ARG 8 7.886 -3.518 -3.782
41 1HG ARG 8 1HG ARG 8 8.879 -5.594 -4.259
42 2HG ARG 8 2HG ARG 8 7.303 -6.067 -3.599
43 1HD ARG 8 1HD ARG 8 6.582 -5.916 -6.168
44 2HD ARG 8 2HD ARG 8 8.312 -6.176 -6.444
45 HE ARG 8 HE ARG 8 7.620 -8.112 -4.575
46 1HH1 ARG 8 2HH2 ARG 8 6.412 -7.248 -7.792
47 2HH1 ARG 8 1HH2 ARG 8 5.908 -8.862 -8.171
48 1HH2 ARG 8 2HH1 ARG 8 6.965 -10.206 -5.073
49 2HH2 ARG 8 1HH1 ARG 8 6.222 -10.557 -6.620
50 H GLN 9 H GLN 9 4.418 -4.470 -2.152
51 HA GLN 9 HA GLN 9 4.024 -7.244 -2.910
52 1HB GLN 9 1HB GLN 9 5.195 -6.204 -0.327
53 2HB GLN 9 2HB GLN 9 4.310 -7.740 -0.347
54 1HG GLN 9 1HG GLN 9 5.956 -8.066 -2.510
55 2HG GLN 9 2HG GLN 9 6.979 -7.045 -1.489
56 1HE2 GLN 9 1HE2 GLN 9 5.114 -10.024 -1.671
57 2HE2 GLN 9 2HE2 GLN 9 5.952 -10.906 -0.438
58 H CYS 10 H CYS 10 3.212 -6.097 0.326
59 HA CYS 10 HA CYS 10 0.533 -6.686 0.045
60 1HB CYS 10 1HB CYS 10 0.670 -6.498 2.226
61 2HB CYS 10 2HB CYS 10 2.272 -5.770 2.085
62 H LYS 11 H LYS 11 2.421 -4.014 -1.106
63 HA LYS 11 HA LYS 11 0.069 -2.292 -1.296
64 1HB LYS 11 1HB LYS 11 1.458 -0.586 -1.059
65 2HB LYS 11 2HB LYS 11 2.714 -1.765 -0.638
66 1HG LYS 11 1HG LYS 11 3.674 -0.485 -2.379
67 2HG LYS 11 2HG LYS 11 3.116 -1.951 -3.204
68 1HD LYS 11 1HD LYS 11 0.901 -0.539 -3.546
69 2HD LYS 11 2HD LYS 11 1.969 0.848 -3.268
70 1HE LYS 11 1HE LYS 11 3.448 -0.635 -5.054
71 2HE LYS 11 2HE LYS 11 1.802 -1.006 -5.592
72 1HZ LYS 11 1HZ LYS 11 1.605 1.073 -6.400
73 2HZ LYS 11 2HZ LYS 11 2.165 1.781 -5.044
74 3HZ LYS 11 3HZ LYS 11 3.227 1.213 -6.164
75 H LEU 12 H LEU 12 -0.882 -3.915 -2.844
76 HA LEU 12 HA LEU 12 0.427 -4.012 -5.422
77 1HB LEU 12 1HB LEU 12 -1.514 -5.439 -6.008
78 2HB LEU 12 2HB LEU 12 -0.498 -6.048 -4.688
79 HG LEU 12 HG LEU 12 -2.616 -4.523 -3.540
80 1HD1 LEU 12 1HD1 LEU 12 -4.207 -4.696 -5.127
81 2HD1 LEU 12 2HD1 LEU 12 -3.419 -6.077 -5.928
82 3HD1 LEU 12 3HD1 LEU 12 -4.394 -6.338 -4.462
83 1HD2 LEU 12 1HD2 LEU 12 -2.751 -6.289 -2.142
84 2HD2 LEU 12 2HD2 LEU 12 -2.742 -7.483 -3.461
85 3HD2 LEU 12 3HD2 LEU 12 -1.216 -6.743 -2.922
86 H LYS 13 H LYS 13 -0.958 -1.554 -3.923
87 HA LYS 13 HA LYS 13 -2.775 -0.847 -6.103
88 1HB LYS 13 1HB LYS 13 -2.660 1.068 -3.954
89 2HB LYS 13 2HB LYS 13 -4.036 0.125 -4.549
90 1HG LYS 13 1HG LYS 13 -3.870 -0.677 -2.378
91 2HG LYS 13 2HG LYS 13 -2.834 -1.847 -3.215
92 1HD LYS 13 1HD LYS 13 -2.130 -0.258 -1.025
93 2HD LYS 13 2HD LYS 13 -1.004 -1.158 -2.057
94 1HE LYS 13 1HE LYS 13 -0.222 1.108 -1.999
95 2HE LYS 13 2HE LYS 13 -0.971 0.899 -3.590
96 1HZ LYS 13 1HZ LYS 13 -2.197 2.684 -3.018
97 2HZ LYS 13 2HZ LYS 13 -3.010 1.742 -1.967
98 3HZ LYS 13 3HZ LYS 13 -1.704 2.598 -1.452
99 HA PRO 14 HA PRO 14 -0.174 2.321 -7.510
100 1HB PRO 14 1HB PRO 14 -1.592 4.657 -7.495
101 2HB PRO 14 2HB PRO 14 -1.800 3.411 -8.723
102 1HG PRO 14 1HG PRO 14 -3.494 4.094 -6.405
103 2HG PRO 14 2HG PRO 14 -3.939 3.179 -7.891
104 1HD PRO 14 1HD PRO 14 -3.433 2.166 -5.259
105 2HD PRO 14 2HD PRO 14 -3.711 1.211 -6.723
106 H ALA 15 H ALA 15 0.412 4.958 -7.134
107 HA ALA 15 HA ALA 15 1.783 4.731 -4.611
108 1HB ALA 15 1HB ALA 15 3.246 5.764 -6.000
109 2HB ALA 15 2HB ALA 15 1.959 6.309 -7.100
110 3HB ALA 15 3HB ALA 15 2.324 7.239 -5.627
111 H GLY 16 H GLY 16 0.921 5.378 -2.709
112 1HA GLY 16 1HA GLY 16 -1.255 7.375 -2.812
113 2HA GLY 16 2HA GLY 16 -1.082 6.116 -1.607
114 H THR 17 H THR 17 0.312 6.392 0.178
115 HA THR 17 HA THR 17 2.225 8.507 0.237
116 HB THR 17 HB THR 17 -0.432 8.807 1.729
117 HG1 THR 17 1HG THR 17 -0.676 9.981 -0.136
118 1HG2 THR 17 1HG2 THR 17 2.196 10.363 1.911
119 2HG2 THR 17 2HG2 THR 17 0.634 11.023 2.448
120 3HG2 THR 17 3HG2 THR 17 1.316 9.588 3.249
121 H THR 18 H THR 18 2.997 8.773 2.675
122 HA THR 18 HA THR 18 3.581 6.064 3.500
123 HB THR 18 HB THR 18 4.610 8.858 4.015
124 HG1 THR 18 1HG THR 18 6.206 7.819 2.882
125 1HG2 THR 18 1HG2 THR 18 4.304 7.596 6.294
126 2HG2 THR 18 2HG2 THR 18 5.524 6.465 5.663
127 3HG2 THR 18 3HG2 THR 18 5.936 8.181 5.891
128 H CYS 19 H CYS 19 2.397 4.926 4.887
129 HA CYS 19 HA CYS 19 0.724 4.508 6.293
130 1HB CYS 19 1HB CYS 19 2.258 6.478 7.992
131 2HB CYS 19 2HB CYS 19 1.157 5.228 8.579
132 H TRP 20 H TRP 20 -0.616 5.888 4.592
133 HA TRP 20 HA TRP 20 -1.744 8.215 5.991
134 1HB TRP 20 1HB TRP 20 -0.567 8.396 3.667
135 2HB TRP 20 2HB TRP 20 -2.085 7.736 3.055
136 HD1 TRP 20 HD TRP 20 -0.650 10.912 4.692
137 HE1 TRP 20 1HE TRP 20 -2.326 12.939 4.484
138 HE3 TRP 20 3HE TRP 20 -4.534 8.194 2.853
139 HZ2 TRP 20 2HZ TRP 20 -5.028 13.174 3.595
140 HZ3 TRP 20 3HZ TRP 20 -6.656 9.399 2.342
141 HH2 TRP 20 HH TRP 20 -6.939 11.803 2.684
142 H LYS 21 H LYS 21 -2.855 6.022 3.320
143 HA LYS 21 HA LYS 21 -4.484 4.466 3.351
144 1HB LYS 21 1HB LYS 21 -5.423 3.660 5.240
145 2HB LYS 21 2HB LYS 21 -4.059 4.512 5.984
146 1HG LYS 21 1HG LYS 21 -5.870 6.536 5.873
147 2HG LYS 21 2HG LYS 21 -6.983 5.162 6.009
148 1HD LYS 21 1HD LYS 21 -4.896 4.685 7.876
149 2HD LYS 21 2HD LYS 21 -5.315 6.398 8.053
150 1HE LYS 21 1HE LYS 21 -7.290 5.893 9.039
151 2HE LYS 21 2HE LYS 21 -7.702 4.701 7.797
152 1HZ LYS 21 1HZ LYS 21 -6.193 3.139 8.980
153 2HZ LYS 21 2HZ LYS 21 -5.957 4.241 10.156
154 3HZ LYS 21 3HZ LYS 21 -7.467 3.648 9.888
155 H THR 22 H THR 22 -6.086 4.882 1.933
156 HA THR 22 HA THR 22 -7.188 7.528 1.815
157 HB THR 22 HB THR 22 -8.307 6.563 -0.213
158 HG1 THR 22 1HG THR 22 -7.934 4.351 1.334
159 1HG2 THR 22 1HG2 THR 22 -6.338 6.671 -1.368
160 2HG2 THR 22 2HG2 THR 22 -5.483 6.712 0.192
161 3HG2 THR 22 3HG2 THR 22 -5.779 5.156 -0.618
162 H SER 23 H SER 23 -9.584 5.278 0.958
163 HA SER 23 HA SER 23 -10.764 5.179 3.558
164 1HB SER 23 1HB SER 23 -11.383 7.350 1.804
165 2HB SER 23 2HB SER 23 -12.806 6.295 1.853
166 HG SER 23 HG SER 23 -11.543 7.782 3.943
167 H LEU 24 H LEU 24 -9.826 3.554 1.052
168 HA LEU 24 HA LEU 24 -12.064 1.740 1.126
169 1HB LEU 24 1HB LEU 24 -12.679 3.287 -0.659
170 2HB LEU 24 2HB LEU 24 -11.152 2.943 -1.491
171 HG LEU 24 HG LEU 24 -12.587 1.596 -2.652
172 1HD1 LEU 24 1HD1 LEU 24 -10.786 0.214 -1.655
173 2HD1 LEU 24 2HD1 LEU 24 -11.903 -0.246 -0.347
174 3HD1 LEU 24 3HD1 LEU 24 -12.261 -0.710 -2.026
175 1HD2 LEU 24 1HD2 LEU 24 -14.130 1.076 -0.096
176 2HD2 LEU 24 2HD2 LEU 24 -14.601 2.156 -1.430
177 3HD2 LEU 24 3HD2 LEU 24 -14.521 0.398 -1.696
178 H THR 25 H THR 25 -9.204 2.307 -1.043
179 HA THR 25 HA THR 25 -8.395 -0.422 -0.709
180 HB THR 25 HB THR 25 -7.385 2.042 -2.189
181 HG1 THR 25 1HG THR 25 -8.132 0.685 -3.904
182 1HG2 THR 25 1HG2 THR 25 -6.173 -0.702 -2.589
183 2HG2 THR 25 2HG2 THR 25 -5.497 0.893 -2.995
184 3HG2 THR 25 3HG2 THR 25 -5.509 0.336 -1.305
185 H SER 26 H SER 26 -6.902 2.768 0.175
186 HA SER 26 HA SER 26 -6.011 3.179 2.217
187 1HB SER 26 1HB SER 26 -6.781 0.834 2.980
188 2HB SER 26 2HB SER 26 -5.167 0.275 2.509
189 HG SER 26 HG SER 26 -5.518 0.956 4.827
190 H HIS 27 H HIS 27 -4.276 4.392 1.535
191 HA HIS 27 HA HIS 27 -2.375 3.374 -0.273
192 1HB HIS 27 1HB HIS 27 -2.465 5.867 1.431
193 2HB HIS 27 2HB HIS 27 -1.181 5.536 0.263
194 HD1 HIS 27 1HD HIS 27 -3.529 4.210 -1.733
195 HD2 HIS 27 2HD HIS 27 -3.223 8.101 -0.195
196 HE1 HIS 27 1HE HIS 27 -4.876 5.707 -3.300
197 HE2 HIS 27 2HE HIS 27 -4.653 8.094 -2.309
198 H TYR 28 H TYR 28 -1.390 4.921 2.817
199 HA TYR 28 HA TYR 28 0.310 4.406 4.172
200 1HB TYR 28 1HB TYR 28 -1.749 2.301 4.046
201 2HB TYR 28 2HB TYR 28 -0.200 1.592 4.518
202 HD1 TYR 28 1HD TYR 28 -2.140 4.711 5.345
203 HD2 TYR 28 2HD TYR 28 0.061 1.342 6.801
204 HE1 TYR 28 1HE TYR 28 -2.528 5.481 7.737
205 HE2 TYR 28 2HE TYR 28 -0.335 2.124 9.188
206 HH TYR 28 HH TYR 28 -2.130 5.127 9.826
207 H CYS 29 H CYS 29 1.051 4.203 1.376
208 HA CYS 29 HA CYS 29 3.480 2.907 1.650
209 1HB CYS 29 1HB CYS 29 1.949 0.890 1.538
210 2HB CYS 29 2HB CYS 29 1.643 1.323 -0.145
211 H THR 30 H THR 30 3.067 2.042 -1.404
212 HA THR 30 HA THR 30 2.237 4.063 -2.983
213 HB THR 30 HB THR 30 4.699 4.802 -1.463
214 HG1 THR 30 1HG THR 30 3.013 6.271 -1.349
215 1HG2 THR 30 1HG2 THR 30 5.712 6.045 -3.284
216 2HG2 THR 30 2HG2 THR 30 5.543 4.372 -3.869
217 3HG2 THR 30 3HG2 THR 30 4.386 5.618 -4.392
218 H GLY 31 H GLY 31 4.670 1.627 -2.208
219 1HA GLY 31 1HA GLY 31 4.820 -0.226 -3.722
220 2HA GLY 31 2HA GLY 31 4.683 0.886 -5.069
221 H LYS 32 H LYS 32 6.843 -0.809 -3.001
222 HA LYS 32 HA LYS 32 9.046 -0.965 -2.956
223 1HB LYS 32 1HB LYS 32 8.894 0.832 -5.381
224 2HB LYS 32 2HB LYS 32 10.394 0.098 -4.790
225 1HG LYS 32 1HG LYS 32 9.726 -1.487 -6.346
226 2HG LYS 32 2HG LYS 32 8.948 -2.141 -4.895
227 1HD LYS 32 1HD LYS 32 7.320 -2.160 -6.674
228 2HD LYS 32 2HD LYS 32 6.850 -0.864 -5.560
229 1HE LYS 32 1HE LYS 32 8.706 0.002 -7.695
230 2HE LYS 32 2HE LYS 32 7.160 -0.600 -8.313
231 1HZ LYS 32 1HZ LYS 32 7.026 1.765 -7.814
232 2HZ LYS 32 2HZ LYS 32 6.057 0.968 -6.776
233 3HZ LYS 32 3HZ LYS 32 7.535 1.487 -6.275
234 H SER 33 H SER 33 9.928 -0.167 -1.130
235 HA SER 33 HA SER 33 11.127 1.312 0.020
236 1HB SER 33 1HB SER 33 11.084 2.733 -2.241
237 2HB SER 33 2HB SER 33 9.964 3.747 -1.313
238 HG SER 33 HG SER 33 12.123 4.495 -1.039
239 H CYS 34 H CYS 34 8.698 0.181 0.783
240 HA CYS 34 HA CYS 34 7.570 2.361 2.361
241 1HB CYS 34 1HB CYS 34 5.877 0.215 1.090
242 2HB CYS 34 2HB CYS 34 5.326 1.598 2.039
243 H ASP 35 H ASP 35 5.635 0.522 3.632
244 HA ASP 35 HA ASP 35 6.392 -1.845 4.441
245 1HB ASP 35 1HB ASP 35 7.669 -1.234 6.668
246 2HB ASP 35 2HB ASP 35 8.578 -1.417 5.160
247 HD2 ASP 35 HD ASP 35 9.519 0.963 7.349
248 H CYS 36 H CYS 36 4.092 -0.190 4.310
249 HA CYS 36 HA CYS 36 3.309 -0.128 7.128
250 1HB CYS 36 1HB CYS 36 3.545 2.110 5.432
251 2HB CYS 36 2HB CYS 36 1.814 1.805 5.611
252 HA PRO 37 HA PRO 37 0.006 -2.508 5.575
253 1HB PRO 37 1HB PRO 37 -1.856 -2.185 7.546
254 2HB PRO 37 2HB PRO 37 -0.506 -3.311 7.670
255 1HG PRO 37 1HG PRO 37 -0.890 -0.666 8.919
256 2HG PRO 37 2HG PRO 37 0.227 -1.990 9.414
257 1HD PRO 37 1HD PRO 37 0.855 0.457 8.065
258 2HD PRO 37 2HD PRO 37 1.961 -0.885 8.387
259 H LEU 38 H LEU 38 -1.466 -2.354 3.990
260 HA LEU 38 HA LEU 38 -2.847 0.239 3.939
261 1HB LEU 38 1HB LEU 38 -2.794 -1.052 1.392
262 2HB LEU 38 2HB LEU 38 -2.173 0.539 1.866
263 HG LEU 38 HG LEU 38 -0.623 -2.025 2.270
264 1HD1 LEU 38 1HD1 LEU 38 -1.224 -1.703 -0.136
265 2HD1 LEU 38 2HD1 LEU 38 -0.359 -0.149 -0.092
266 3HD1 LEU 38 3HD1 LEU 38 0.522 -1.667 0.200
267 1HD2 LEU 38 1HD2 LEU 38 0.288 0.863 2.119
268 2HD2 LEU 38 2HD2 LEU 38 0.058 -0.073 3.616
269 3HD2 LEU 38 3HD2 LEU 38 1.304 -0.562 2.442
270 H TYR 39 H TYR 39 -3.995 -1.569 5.580
271 HA TYR 39 HA TYR 39 -6.260 -2.500 3.962
272 1HB TYR 39 1HB TYR 39 -6.043 -4.636 4.929
273 2HB TYR 39 2HB TYR 39 -4.341 -4.164 4.999
274 HD1 TYR 39 1HD TYR 39 -3.884 -2.600 7.240
275 HD2 TYR 39 2HD TYR 39 -6.836 -5.669 6.825
276 HE1 TYR 39 1HE TYR 39 -3.921 -2.914 9.762
277 HE2 TYR 39 2HE TYR 39 -6.864 -5.972 9.349
278 HH TYR 39 HH TYR 39 -5.363 -5.593 11.223
279 HA PRO 40 HA PRO 40 -8.680 -0.732 7.082
280 1HB PRO 40 1HB PRO 40 -10.861 -2.371 7.222
281 2HB PRO 40 2HB PRO 40 -10.643 -1.161 5.959
282 1HG PRO 40 1HG PRO 40 -10.296 -4.091 5.860
283 2HG PRO 40 2HG PRO 40 -10.546 -2.942 4.494
284 1HD PRO 40 1HD PRO 40 -8.126 -4.237 5.315
285 2HD PRO 40 2HD PRO 40 -8.288 -2.995 4.067
286 H GLY 41 H GLY 41 -9.620 -0.786 9.262
287 1HA GLY 41 1HA GLY 41 -7.965 -2.527 10.881
288 2HA GLY 41 2HA GLY 41 -9.020 -1.237 11.423
Start of MODEL 10
1 H CYS 1 H CYS 1 -1.407 -4.084 2.043
2 HA CYS 1 HA CYS 1 -4.045 -4.054 2.780
3 1HB CYS 1 1HB CYS 1 -4.274 -6.109 1.681
4 2HB CYS 1 2HB CYS 1 -3.002 -5.234 0.825
5 H THR 2 H THR 2 -1.273 -6.016 4.065
6 HA THR 2 HA THR 2 -1.847 -5.937 6.685
7 HB THR 2 HB THR 2 -4.057 -6.781 6.560
8 HG1 THR 2 1HG THR 2 -3.726 -8.856 7.498
9 1HG2 THR 2 1HG2 THR 2 -4.452 -7.481 4.334
10 2HG2 THR 2 2HG2 THR 2 -2.957 -8.445 4.273
11 3HG2 THR 2 3HG2 THR 2 -4.364 -9.042 5.185
12 H THR 3 H THR 3 -0.580 -7.459 3.871
13 HA THR 3 HA THR 3 0.732 -9.648 5.006
14 HB THR 3 HB THR 3 1.524 -7.834 2.664
15 HG1 THR 3 1HG THR 3 0.160 -9.419 1.555
16 1HG2 THR 3 1HG2 THR 3 1.961 -10.835 2.928
17 2HG2 THR 3 2HG2 THR 3 2.746 -9.696 1.808
18 3HG2 THR 3 3HG2 THR 3 3.184 -9.692 3.533
19 H GLY 4 H GLY 4 3.034 -7.396 3.697
20 1HA GLY 4 1HA GLY 4 4.132 -6.992 6.415
21 2HA GLY 4 2HA GLY 4 5.118 -7.435 5.037
22 HA PRO 5 HA PRO 5 5.515 -3.093 4.596
23 1HB PRO 5 1HB PRO 5 7.459 -3.121 2.676
24 2HB PRO 5 2HB PRO 5 7.805 -3.227 4.400
25 1HG PRO 5 1HG PRO 5 7.806 -5.333 2.333
26 2HG PRO 5 2HG PRO 5 8.611 -5.339 3.944
27 1HD PRO 5 1HD PRO 5 6.228 -6.709 3.137
28 2HD PRO 5 2HD PRO 5 6.891 -6.621 4.774
29 H CYS 6 H CYS 6 3.712 -5.004 2.937
30 HA CYS 6 HA CYS 6 2.362 -4.817 1.216
31 1HB CYS 6 1HB CYS 6 1.366 -2.711 0.736
32 2HB CYS 6 2HB CYS 6 1.649 -2.818 2.476
33 H CYS 7 H CYS 7 5.131 -2.488 0.936
34 HA CYS 7 HA CYS 7 5.227 -2.190 -1.751
35 1HB CYS 7 1HB CYS 7 7.299 -2.234 0.392
36 2HB CYS 7 2HB CYS 7 7.835 -2.194 -1.290
37 H ARG 8 H ARG 8 5.312 -3.671 -3.403
38 HA ARG 8 HA ARG 8 6.013 -5.362 -4.590
39 1HB ARG 8 1HB ARG 8 7.569 -6.491 -2.231
40 2HB ARG 8 2HB ARG 8 7.858 -6.788 -3.953
41 1HG ARG 8 1HG ARG 8 7.964 -3.947 -3.027
42 2HG ARG 8 2HG ARG 8 9.287 -4.997 -2.491
43 1HD ARG 8 1HD ARG 8 9.977 -3.986 -4.566
44 2HD ARG 8 2HD ARG 8 9.591 -5.672 -4.938
45 HE ARG 8 HE ARG 8 7.327 -3.845 -5.274
46 1HH1 ARG 8 2HH2 ARG 8 10.168 -5.242 -6.866
47 2HH1 ARG 8 1HH2 ARG 8 9.556 -4.981 -8.464
48 1HH2 ARG 8 2HH1 ARG 8 6.534 -3.508 -7.351
49 2HH2 ARG 8 1HH1 ARG 8 7.476 -3.988 -8.747
50 H GLN 9 H GLN 9 4.762 -5.703 -1.325
51 HA GLN 9 HA GLN 9 3.867 -8.397 -1.855
52 1HB GLN 9 1HB GLN 9 4.148 -6.650 0.547
53 2HB GLN 9 2HB GLN 9 2.832 -7.837 0.593
54 1HG GLN 9 1HG GLN 9 4.441 -9.644 0.093
55 2HG GLN 9 2HG GLN 9 5.761 -8.468 -0.006
56 1HE2 GLN 9 1HE2 GLN 9 6.182 -10.425 1.659
57 2HE2 GLN 9 2HE2 GLN 9 5.980 -9.981 3.322
58 H CYS 10 H CYS 10 2.083 -5.828 -0.069
59 HA CYS 10 HA CYS 10 -0.032 -6.069 -2.079
60 1HB CYS 10 1HB CYS 10 -1.640 -5.750 -0.154
61 2HB CYS 10 2HB CYS 10 -0.880 -7.336 -0.317
62 H LYS 11 H LYS 11 0.794 -4.095 -3.060
63 HA LYS 11 HA LYS 11 -0.306 -1.757 -1.984
64 1HB LYS 11 1HB LYS 11 1.407 -0.606 -1.047
65 2HB LYS 11 2HB LYS 11 1.877 -2.243 -0.561
66 1HG LYS 11 1HG LYS 11 2.991 -0.519 -2.789
67 2HG LYS 11 2HG LYS 11 3.867 -1.279 -1.449
68 1HD LYS 11 1HD LYS 11 4.103 -3.235 -2.580
69 2HD LYS 11 2HD LYS 11 2.432 -3.213 -3.168
70 1HE LYS 11 1HE LYS 11 3.398 -1.218 -4.681
71 2HE LYS 11 2HE LYS 11 4.927 -2.068 -4.408
72 1HZ LYS 11 1HZ LYS 11 4.142 -3.921 -5.539
73 2HZ LYS 11 2HZ LYS 11 2.568 -3.605 -5.261
74 3HZ LYS 11 3HZ LYS 11 3.400 -2.699 -6.353
75 H LEU 12 H LEU 12 -0.176 -3.456 -4.410
76 HA LEU 12 HA LEU 12 1.453 -2.363 -6.360
77 1HB LEU 12 1HB LEU 12 -0.311 -3.228 -7.921
78 2HB LEU 12 2HB LEU 12 0.414 -4.401 -6.809
79 HG LEU 12 HG LEU 12 -2.003 -3.220 -5.704
80 1HD1 LEU 12 1HD1 LEU 12 -2.881 -2.925 -7.856
81 2HD1 LEU 12 2HD1 LEU 12 -2.159 -4.438 -8.458
82 3HD1 LEU 12 3HD1 LEU 12 -3.526 -4.494 -7.319
83 1HD2 LEU 12 1HD2 LEU 12 -0.569 -5.618 -5.576
84 2HD2 LEU 12 2HD2 LEU 12 -2.087 -5.218 -4.737
85 3HD2 LEU 12 3HD2 LEU 12 -2.133 -6.049 -6.310
86 H LYS 13 H LYS 13 -1.007 -0.863 -4.535
87 HA LYS 13 HA LYS 13 -2.424 0.702 -6.179
88 1HB LYS 13 1HB LYS 13 -2.001 2.512 -4.335
89 2HB LYS 13 2HB LYS 13 -2.890 1.027 -3.955
90 1HG LYS 13 1HG LYS 13 -0.087 0.500 -3.625
91 2HG LYS 13 2HG LYS 13 -0.448 2.018 -2.784
92 1HD LYS 13 1HD LYS 13 -0.714 -0.187 -1.463
93 2HD LYS 13 2HD LYS 13 -2.053 0.970 -1.368
94 1HE LYS 13 1HE LYS 13 -2.549 -0.660 -3.648
95 2HE LYS 13 2HE LYS 13 -2.053 -1.766 -2.357
96 1HZ LYS 13 1HZ LYS 13 -4.167 -1.533 -1.650
97 2HZ LYS 13 2HZ LYS 13 -3.780 -0.038 -1.136
98 3HZ LYS 13 3HZ LYS 13 -4.424 -0.243 -2.635
99 HA PRO 14 HA PRO 14 0.370 3.082 -8.460
100 1HB PRO 14 1HB PRO 14 -1.306 5.035 -9.376
101 2HB PRO 14 2HB PRO 14 -1.189 3.439 -10.116
102 1HG PRO 14 1HG PRO 14 -3.261 4.559 -8.341
103 2HG PRO 14 2HG PRO 14 -3.380 3.151 -9.457
104 1HD PRO 14 1HD PRO 14 -3.133 3.146 -6.604
105 2HD PRO 14 2HD PRO 14 -3.084 1.736 -7.668
106 H ALA 15 H ALA 15 0.692 3.434 -5.759
107 HA ALA 15 HA ALA 15 1.695 4.872 -4.400
108 1HB ALA 15 1HB ALA 15 3.119 6.232 -5.478
109 2HB ALA 15 2HB ALA 15 2.232 5.915 -6.989
110 3HB ALA 15 3HB ALA 15 1.781 7.300 -5.966
111 H GLY 16 H GLY 16 0.661 5.768 -2.683
112 1HA GLY 16 1HA GLY 16 -1.641 7.534 -3.255
113 2HA GLY 16 2HA GLY 16 -1.734 6.239 -2.078
114 H THR 17 H THR 17 -0.050 6.264 -0.261
115 HA THR 17 HA THR 17 1.239 8.770 0.264
116 HB THR 17 HB THR 17 -1.001 7.949 2.163
117 HG1 THR 17 1HG THR 17 -2.203 8.572 0.386
118 1HG2 THR 17 1HG2 THR 17 -0.005 9.685 3.304
119 2HG2 THR 17 2HG2 THR 17 0.919 10.206 1.876
120 3HG2 THR 17 3HG2 THR 17 -0.774 10.719 2.077
121 H THR 18 H THR 18 1.500 8.459 3.073
122 HA THR 18 HA THR 18 2.719 5.792 3.269
123 HB THR 18 HB THR 18 3.966 8.520 3.417
124 HG1 THR 18 1HG THR 18 5.749 6.915 2.790
125 1HG2 THR 18 1HG2 THR 18 4.347 7.899 5.741
126 2HG2 THR 18 2HG2 THR 18 4.644 6.201 5.295
127 3HG2 THR 18 3HG2 THR 18 5.824 7.459 4.848
128 H CYS 19 H CYS 19 2.135 4.684 5.030
129 HA CYS 19 HA CYS 19 0.883 4.264 6.819
130 1HB CYS 19 1HB CYS 19 2.276 6.447 8.288
131 2HB CYS 19 2HB CYS 19 1.967 4.776 8.768
132 H TRP 20 H TRP 20 -0.982 5.352 5.496
133 HA TRP 20 HA TRP 20 -2.112 7.439 7.199
134 1HB TRP 20 1HB TRP 20 -1.304 8.795 5.508
135 2HB TRP 20 2HB TRP 20 -1.645 7.616 4.240
136 HD1 TRP 20 HD TRP 20 -3.477 8.723 2.741
137 HE1 TRP 20 1HE TRP 20 -5.787 9.965 3.035
138 HE3 TRP 20 3HE TRP 20 -3.350 8.863 7.822
139 HZ2 TRP 20 2HZ TRP 20 -7.269 10.847 5.310
140 HZ3 TRP 20 3HZ TRP 20 -5.268 9.932 9.002
141 HH2 TRP 20 HH TRP 20 -7.180 10.903 7.830
142 H LYS 21 H LYS 21 -2.971 5.795 4.073
143 HA LYS 21 HA LYS 21 -4.384 4.005 3.845
144 1HB LYS 21 1HB LYS 21 -5.564 3.043 5.535
145 2HB LYS 21 2HB LYS 21 -4.294 3.841 6.477
146 1HG LYS 21 1HG LYS 21 -6.123 5.853 6.336
147 2HG LYS 21 2HG LYS 21 -7.214 4.459 6.273
148 1HD LYS 21 1HD LYS 21 -5.326 3.849 8.285
149 2HD LYS 21 2HD LYS 21 -5.726 5.557 8.538
150 1HE LYS 21 1HE LYS 21 -8.210 4.435 8.052
151 2HE LYS 21 2HE LYS 21 -7.391 3.129 8.921
152 1HZ LYS 21 1HZ LYS 21 -6.766 5.401 10.321
153 2HZ LYS 21 2HZ LYS 21 -8.327 5.640 9.923
154 3HZ LYS 21 3HZ LYS 21 -7.888 4.268 10.715
155 H THR 22 H THR 22 -6.191 4.130 2.538
156 HA THR 22 HA THR 22 -7.258 6.786 2.167
157 HB THR 22 HB THR 22 -8.127 5.833 0.117
158 HG1 THR 22 1HG THR 22 -8.110 3.407 0.024
159 1HG2 THR 22 1HG2 THR 22 -5.669 4.114 0.710
160 2HG2 THR 22 2HG2 THR 22 -6.238 4.683 -0.879
161 3HG2 THR 22 3HG2 THR 22 -5.548 5.838 0.286
162 H SER 23 H SER 23 -8.902 3.568 2.472
163 HA SER 23 HA SER 23 -10.298 3.806 4.638
164 1HB SER 23 1HB SER 23 -11.230 5.919 2.780
165 2HB SER 23 2HB SER 23 -12.532 4.949 3.494
166 HG SER 23 HG SER 23 -10.804 6.832 4.668
167 H LEU 24 H LEU 24 -10.143 3.115 1.237
168 HA LEU 24 HA LEU 24 -12.172 1.017 1.586
169 1HB LEU 24 1HB LEU 24 -13.198 2.170 -0.015
170 2HB LEU 24 2HB LEU 24 -11.720 2.985 -0.556
171 HG LEU 24 HG LEU 24 -11.082 0.838 -1.708
172 1HD1 LEU 24 1HD1 LEU 24 -12.418 -0.735 -0.455
173 2HD1 LEU 24 2HD1 LEU 24 -13.920 0.057 -0.991
174 3HD1 LEU 24 3HD1 LEU 24 -12.888 -0.788 -2.171
175 1HD2 LEU 24 1HD2 LEU 24 -13.046 2.814 -2.459
176 2HD2 LEU 24 2HD2 LEU 24 -11.796 2.018 -3.447
177 3HD2 LEU 24 3HD2 LEU 24 -13.393 1.255 -3.247
178 H THR 25 H THR 25 -9.272 1.881 -0.436
179 HA THR 25 HA THR 25 -8.594 -0.932 -0.598
180 HB THR 25 HB THR 25 -7.790 1.666 -1.900
181 HG1 THR 25 1HG THR 25 -9.353 -0.139 -2.591
182 1HG2 THR 25 1HG2 THR 25 -5.591 0.601 -1.216
183 2HG2 THR 25 2HG2 THR 25 -6.117 -0.896 -2.022
184 3HG2 THR 25 3HG2 THR 25 -5.853 0.583 -2.977
185 H SER 26 H SER 26 -6.602 1.979 0.240
186 HA SER 26 HA SER 26 -5.790 2.052 2.492
187 1HB SER 26 1HB SER 26 -5.190 -0.864 1.890
188 2HB SER 26 2HB SER 26 -4.430 0.002 3.237
189 HG SER 26 HG SER 26 -6.716 -1.274 3.324
190 H HIS 27 H HIS 27 -4.115 3.463 2.144
191 HA HIS 27 HA HIS 27 -2.229 2.819 0.040
192 1HB HIS 27 1HB HIS 27 -2.953 5.312 1.557
193 2HB HIS 27 2HB HIS 27 -1.453 5.226 0.627
194 HD1 HIS 27 1HD HIS 27 -3.486 7.277 -0.261
195 HD2 HIS 27 2HD HIS 27 -3.493 3.326 -1.672
196 HE1 HIS 27 1HE HIS 27 -4.733 7.315 -2.487
197 HE2 HIS 27 2HE HIS 27 -4.713 4.857 -3.314
198 H TYR 28 H TYR 28 -1.352 4.809 2.849
199 HA TYR 28 HA TYR 28 0.199 4.582 4.416
200 1HB TYR 28 1HB TYR 28 -1.091 1.981 4.055
201 2HB TYR 28 2HB TYR 28 0.617 1.706 4.412
202 HD1 TYR 28 1HD TYR 28 -2.226 3.828 5.658
203 HD2 TYR 28 2HD TYR 28 1.187 1.443 6.641
204 HE1 TYR 28 1HE TYR 28 -2.699 4.159 8.135
205 HE2 TYR 28 2HE TYR 28 0.703 1.782 9.114
206 HH TYR 28 HH TYR 28 -1.095 4.112 10.294
207 H CYS 29 H CYS 29 0.664 3.964 1.247
208 HA CYS 29 HA CYS 29 3.377 4.351 1.306
209 1HB CYS 29 1HB CYS 29 4.262 2.176 0.586
210 2HB CYS 29 2HB CYS 29 3.698 2.184 2.259
211 H THR 30 H THR 30 4.021 2.766 -1.101
212 HA THR 30 HA THR 30 1.904 3.529 -2.969
213 HB THR 30 HB THR 30 3.646 4.673 -4.386
214 HG1 THR 30 1HG THR 30 5.132 4.107 -1.918
215 1HG2 THR 30 1HG2 THR 30 3.305 6.660 -3.301
216 2HG2 THR 30 2HG2 THR 30 2.476 5.721 -2.036
217 3HG2 THR 30 3HG2 THR 30 4.207 6.100 -1.873
218 H GLY 31 H GLY 31 5.295 2.228 -2.918
219 1HA GLY 31 1HA GLY 31 4.667 -0.394 -3.494
220 2HA GLY 31 2HA GLY 31 4.746 0.414 -5.047
221 H LYS 32 H LYS 32 6.556 -1.242 -2.734
222 HA LYS 32 HA LYS 32 8.712 -1.524 -2.339
223 1HB LYS 32 1HB LYS 32 10.061 -1.839 -4.180
224 2HB LYS 32 2HB LYS 32 8.437 -1.985 -4.877
225 1HG LYS 32 1HG LYS 32 9.630 -0.568 -6.366
226 2HG LYS 32 2HG LYS 32 8.629 0.540 -5.412
227 1HD LYS 32 1HD LYS 32 10.517 1.656 -4.897
228 2HD LYS 32 2HD LYS 32 11.026 0.256 -3.937
229 1HE LYS 32 1HE LYS 32 11.807 -0.670 -6.302
230 2HE LYS 32 2HE LYS 32 11.800 1.040 -6.752
231 1HZ LYS 32 1HZ LYS 32 13.880 0.923 -5.858
232 2HZ LYS 32 2HZ LYS 32 13.118 1.126 -4.434
233 3HZ LYS 32 3HZ LYS 32 13.509 -0.390 -4.938
234 H SER 33 H SER 33 10.479 -0.477 -1.398
235 HA SER 33 HA SER 33 11.836 1.196 -0.903
236 1HB SER 33 1HB SER 33 11.339 2.171 -3.205
237 2HB SER 33 2HB SER 33 10.073 3.147 -2.438
238 HG SER 33 HG SER 33 11.571 4.475 -1.668
239 H CYS 34 H CYS 34 8.287 1.657 -0.878
240 HA CYS 34 HA CYS 34 8.114 3.602 1.066
241 1HB CYS 34 1HB CYS 34 5.862 2.977 1.334
242 2HB CYS 34 2HB CYS 34 6.264 2.734 -0.368
243 H ASP 35 H ASP 35 6.483 2.258 3.115
244 HA ASP 35 HA ASP 35 7.772 0.111 4.247
245 1HB ASP 35 1HB ASP 35 9.531 2.064 4.452
246 2HB ASP 35 2HB ASP 35 8.487 2.639 5.761
247 HD2 ASP 35 HD ASP 35 9.170 -1.042 6.252
248 H CYS 36 H CYS 36 5.212 0.217 4.122
249 HA CYS 36 HA CYS 36 4.225 0.461 6.698
250 1HB CYS 36 1HB CYS 36 4.148 2.930 5.168
251 2HB CYS 36 2HB CYS 36 2.532 2.403 5.651
252 HA PRO 37 HA PRO 37 1.544 -2.062 4.318
253 1HB PRO 37 1HB PRO 37 0.051 -3.075 6.371
254 2HB PRO 37 2HB PRO 37 1.607 -3.748 5.886
255 1HG PRO 37 1HG PRO 37 0.913 -2.038 8.189
256 2HG PRO 37 2HG PRO 37 2.353 -3.096 7.970
257 1HD PRO 37 1HD PRO 37 2.193 -0.244 7.780
258 2HD PRO 37 2HD PRO 37 3.597 -1.248 7.398
259 H LEU 38 H LEU 38 -0.616 -2.249 3.518
260 HA LEU 38 HA LEU 38 -2.034 0.240 4.101
261 1HB LEU 38 1HB LEU 38 -3.229 -1.124 1.960
262 2HB LEU 38 2HB LEU 38 -2.264 0.362 1.920
263 HG LEU 38 HG LEU 38 -0.834 -2.263 1.932
264 1HD1 LEU 38 1HD1 LEU 38 -2.709 -1.390 -0.182
265 2HD1 LEU 38 2HD1 LEU 38 -1.094 -1.894 -0.736
266 3HD1 LEU 38 3HD1 LEU 38 -2.094 -3.011 0.222
267 1HD2 LEU 38 1HD2 LEU 38 0.375 -0.104 2.020
268 2HD2 LEU 38 2HD2 LEU 38 0.772 -1.072 0.579
269 3HD2 LEU 38 3HD2 LEU 38 -0.324 0.323 0.439
270 H TYR 39 H TYR 39 -2.476 -0.977 6.274
271 HA TYR 39 HA TYR 39 -4.791 -2.748 5.906
272 1HB TYR 39 1HB TYR 39 -2.716 -3.509 7.187
273 2HB TYR 39 2HB TYR 39 -2.927 -2.142 8.288
274 HD1 TYR 39 1HD TYR 39 -3.456 -3.048 10.370
275 HD2 TYR 39 2HD TYR 39 -5.423 -4.567 6.888
276 HE1 TYR 39 1HE TYR 39 -4.956 -4.487 11.836
277 HE2 TYR 39 2HE TYR 39 -6.917 -6.000 8.364
278 HH TYR 39 HH TYR 39 -6.649 -7.030 10.729
279 HA PRO 40 HA PRO 40 -7.080 0.665 7.413
280 1HB PRO 40 1HB PRO 40 -9.561 -0.427 7.071
281 2HB PRO 40 2HB PRO 40 -8.697 0.423 5.791
282 1HG PRO 40 1HG PRO 40 -9.108 -2.469 6.207
283 2HG PRO 40 2HG PRO 40 -8.662 -1.605 4.692
284 1HD PRO 40 1HD PRO 40 -6.986 -3.168 6.409
285 2HD PRO 40 2HD PRO 40 -6.467 -2.208 5.016
286 H GLY 41 H GLY 41 -5.847 -0.076 9.448
287 1HA GLY 41 1HA GLY 41 -7.777 -0.156 11.516
288 2HA GLY 41 2HA GLY 41 -7.097 -1.754 11.280
Start of MODEL 11
1 H CYS 1 H CYS 1 -1.703 -3.654 5.813
2 HA CYS 1 HA CYS 1 -0.633 -3.771 3.300
3 1HB CYS 1 1HB CYS 1 0.923 -3.867 4.964
4 2HB CYS 1 2HB CYS 1 0.022 -5.050 5.915
5 H THR 2 H THR 2 -1.368 -4.944 1.562
6 HA THR 2 HA THR 2 -3.015 -7.255 1.961
7 HB THR 2 HB THR 2 -1.940 -5.641 -0.381
8 HG1 THR 2 1HG THR 2 -3.964 -4.863 0.054
9 1HG2 THR 2 1HG2 THR 2 -3.695 -8.144 -0.570
10 2HG2 THR 2 2HG2 THR 2 -3.177 -7.102 -1.916
11 3HG2 THR 2 3HG2 THR 2 -1.983 -8.102 -1.056
12 H THR 3 H THR 3 0.397 -6.659 1.724
13 HA THR 3 HA THR 3 0.793 -9.556 1.364
14 HB THR 3 HB THR 3 2.500 -7.229 0.328
15 HG1 THR 3 1HG THR 3 0.406 -7.779 -0.758
16 1HG2 THR 3 1HG2 THR 3 3.152 -10.010 0.808
17 2HG2 THR 3 2HG2 THR 3 2.995 -9.766 -0.949
18 3HG2 THR 3 3HG2 THR 3 4.142 -8.779 -0.011
19 H GLY 4 H GLY 4 3.601 -7.623 1.874
20 1HA GLY 4 1HA GLY 4 3.501 -8.209 4.771
21 2HA GLY 4 2HA GLY 4 4.888 -8.627 3.785
22 HA PRO 5 HA PRO 5 6.363 -4.614 4.555
23 1HB PRO 5 1HB PRO 5 8.415 -4.519 2.756
24 2HB PRO 5 2HB PRO 5 8.548 -5.301 4.329
25 1HG PRO 5 1HG PRO 5 8.214 -6.481 1.647
26 2HG PRO 5 2HG PRO 5 8.824 -7.265 3.149
27 1HD PRO 5 1HD PRO 5 6.263 -7.558 1.902
28 2HD PRO 5 2HD PRO 5 6.758 -8.222 3.464
29 H CYS 6 H CYS 6 4.452 -5.371 2.121
30 HA CYS 6 HA CYS 6 3.501 -4.280 0.460
31 1HB CYS 6 1HB CYS 6 2.671 -2.114 0.924
32 2HB CYS 6 2HB CYS 6 2.689 -3.022 2.438
33 H CYS 7 H CYS 7 4.354 -1.167 0.224
34 HA CYS 7 HA CYS 7 5.491 -0.153 -1.404
35 1HB CYS 7 1HB CYS 7 7.106 -0.785 0.805
36 2HB CYS 7 2HB CYS 7 8.127 -1.015 -0.617
37 H ARG 8 H ARG 8 4.452 -2.329 -2.618
38 HA ARG 8 HA ARG 8 5.555 -2.796 -4.825
39 1HB ARG 8 1HB ARG 8 7.762 -3.329 -4.304
40 2HB ARG 8 2HB ARG 8 7.326 -4.181 -2.812
41 1HG ARG 8 1HG ARG 8 8.104 -5.785 -4.480
42 2HG ARG 8 2HG ARG 8 6.372 -6.041 -4.205
43 1HD ARG 8 1HD ARG 8 6.681 -6.111 -6.576
44 2HD ARG 8 2HD ARG 8 5.977 -4.520 -6.249
45 HE ARG 8 HE ARG 8 8.895 -4.495 -6.221
46 1HH1 ARG 8 2HH2 ARG 8 6.060 -4.342 -8.342
47 2HH1 ARG 8 1HH2 ARG 8 6.898 -3.510 -9.608
48 1HH2 ARG 8 2HH1 ARG 8 9.980 -3.414 -7.868
49 2HH2 ARG 8 1HH1 ARG 8 9.142 -2.976 -9.342
50 H GLN 9 H GLN 9 4.629 -4.602 -1.868
51 HA GLN 9 HA GLN 9 3.121 -6.428 -3.567
52 1HB GLN 9 1HB GLN 9 4.002 -6.733 -0.670
53 2HB GLN 9 2HB GLN 9 3.086 -7.943 -1.587
54 1HG GLN 9 1HG GLN 9 5.263 -7.363 -3.241
55 2HG GLN 9 2HG GLN 9 5.971 -7.330 -1.619
56 1HE2 GLN 9 1HE2 GLN 9 6.614 -9.171 -0.816
57 2HE2 GLN 9 2HE2 GLN 9 6.093 -10.759 -1.275
58 H CYS 10 H CYS 10 2.716 -5.485 -0.095
59 HA CYS 10 HA CYS 10 0.002 -5.529 -0.097
60 1HB CYS 10 1HB CYS 10 1.392 -3.448 1.531
61 2HB CYS 10 2HB CYS 10 0.080 -4.543 1.979
62 H LYS 11 H LYS 11 2.270 -2.890 -1.033
63 HA LYS 11 HA LYS 11 0.147 -1.016 -1.460
64 1HB LYS 11 1HB LYS 11 1.776 0.513 -1.638
65 2HB LYS 11 2HB LYS 11 2.769 -0.745 -0.883
66 1HG LYS 11 1HG LYS 11 4.117 -0.387 -2.687
67 2HG LYS 11 2HG LYS 11 2.978 -1.457 -3.521
68 1HD LYS 11 1HD LYS 11 1.662 0.863 -3.854
69 2HD LYS 11 2HD LYS 11 3.296 1.531 -3.689
70 1HE LYS 11 1HE LYS 11 3.805 0.896 -5.794
71 2HE LYS 11 2HE LYS 11 3.349 -0.780 -5.456
72 1HZ LYS 11 1HZ LYS 11 0.955 0.183 -5.736
73 2HZ LYS 11 2HZ LYS 11 1.687 1.390 -6.549
74 3HZ LYS 11 3HZ LYS 11 1.880 -0.165 -7.051
75 H LEU 12 H LEU 12 -0.360 -3.485 -2.794
76 HA LEU 12 HA LEU 12 0.460 -3.334 -5.495
77 1HB LEU 12 1HB LEU 12 -0.471 -5.325 -5.654
78 2HB LEU 12 2HB LEU 12 -0.621 -5.236 -3.889
79 HG LEU 12 HG LEU 12 -2.944 -4.182 -4.392
80 1HD1 LEU 12 1HD1 LEU 12 -3.636 -4.018 -6.491
81 2HD1 LEU 12 2HD1 LEU 12 -2.035 -4.576 -7.038
82 3HD1 LEU 12 3HD1 LEU 12 -3.341 -5.753 -6.762
83 1HD2 LEU 12 1HD2 LEU 12 -2.144 -6.657 -3.660
84 2HD2 LEU 12 2HD2 LEU 12 -3.846 -6.172 -3.841
85 3HD2 LEU 12 3HD2 LEU 12 -3.023 -7.039 -5.160
86 H LYS 13 H LYS 13 -1.601 -1.383 -3.645
87 HA LYS 13 HA LYS 13 -3.688 -0.958 -5.482
88 1HB LYS 13 1HB LYS 13 -2.876 1.260 -3.704
89 2HB LYS 13 2HB LYS 13 -4.465 0.514 -3.945
90 1HG LYS 13 1HG LYS 13 -4.088 -0.393 -1.893
91 2HG LYS 13 2HG LYS 13 -3.074 -1.554 -2.768
92 1HD LYS 13 1HD LYS 13 -2.322 0.646 -0.933
93 2HD LYS 13 2HD LYS 13 -1.452 -0.851 -1.309
94 1HE LYS 13 1HE LYS 13 -0.013 0.631 -2.319
95 2HE LYS 13 2HE LYS 13 -1.134 0.440 -3.676
96 1HZ LYS 13 1HZ LYS 13 -1.398 2.657 -3.501
97 2HZ LYS 13 2HZ LYS 13 -2.240 2.413 -2.129
98 3HZ LYS 13 3HZ LYS 13 -0.621 2.696 -2.052
99 HA PRO 14 HA PRO 14 -2.033 2.014 -8.177
100 1HB PRO 14 1HB PRO 14 -3.523 4.297 -8.004
101 2HB PRO 14 2HB PRO 14 -4.059 2.859 -8.870
102 1HG PRO 14 1HG PRO 14 -4.870 3.894 -6.229
103 2HG PRO 14 2HG PRO 14 -5.742 2.737 -7.298
104 1HD PRO 14 1HD PRO 14 -4.264 2.188 -4.907
105 2HD PRO 14 2HD PRO 14 -4.970 0.997 -6.008
106 H ALA 15 H ALA 15 -0.219 1.821 -6.370
107 HA ALA 15 HA ALA 15 1.408 2.857 -5.277
108 1HB ALA 15 1HB ALA 15 2.549 4.326 -6.605
109 2HB ALA 15 2HB ALA 15 1.312 3.858 -7.796
110 3HB ALA 15 3HB ALA 15 1.126 5.363 -6.866
111 H GLY 16 H GLY 16 0.610 3.131 -3.192
112 1HA GLY 16 1HA GLY 16 -1.296 5.130 -2.517
113 2HA GLY 16 2HA GLY 16 -0.330 4.163 -1.420
114 H THR 17 H THR 17 0.040 6.030 -0.052
115 HA THR 17 HA THR 17 2.011 7.887 -1.214
116 HB THR 17 HB THR 17 -0.098 8.487 0.925
117 HG1 THR 17 1HG THR 17 -0.598 7.961 -1.528
118 1HG2 THR 17 1HG2 THR 17 2.192 9.956 -0.196
119 2HG2 THR 17 2HG2 THR 17 0.658 10.793 -0.530
120 3HG2 THR 17 3HG2 THR 17 1.117 10.415 1.148
121 H THR 18 H THR 18 1.640 8.716 1.948
122 HA THR 18 HA THR 18 3.656 6.757 2.829
123 HB THR 18 HB THR 18 3.679 9.761 2.720
124 HG1 THR 18 1HG THR 18 5.716 7.673 3.007
125 1HG2 THR 18 1HG2 THR 18 3.694 9.271 5.209
126 2HG2 THR 18 2HG2 THR 18 5.058 8.160 4.938
127 3HG2 THR 18 3HG2 THR 18 5.250 9.900 4.617
128 H CYS 19 H CYS 19 2.540 5.434 4.157
129 HA CYS 19 HA CYS 19 0.919 4.867 5.616
130 1HB CYS 19 1HB CYS 19 2.765 6.683 7.161
131 2HB CYS 19 2HB CYS 19 1.556 5.648 7.927
132 H TRP 20 H TRP 20 -0.923 5.952 4.538
133 HA TRP 20 HA TRP 20 -1.881 8.209 6.145
134 1HB TRP 20 1HB TRP 20 -1.344 8.148 3.258
135 2HB TRP 20 2HB TRP 20 -2.950 8.734 3.690
136 HD1 TRP 20 HD TRP 20 0.207 10.204 2.923
137 HE1 TRP 20 1HE TRP 20 0.697 12.528 4.072
138 HE3 TRP 20 3HE TRP 20 -3.394 9.792 6.490
139 HZ2 TRP 20 2HZ TRP 20 -0.450 13.902 6.295
140 HZ3 TRP 20 3HZ TRP 20 -3.641 11.669 8.111
141 HH2 TRP 20 HH TRP 20 -2.242 13.673 8.053
142 H LYS 21 H LYS 21 -2.802 5.923 3.458
143 HA LYS 21 HA LYS 21 -4.508 4.542 3.226
144 1HB LYS 21 1HB LYS 21 -4.170 3.212 5.000
145 2HB LYS 21 2HB LYS 21 -4.090 4.555 6.153
146 1HG LYS 21 1HG LYS 21 -6.722 3.880 4.847
147 2HG LYS 21 2HG LYS 21 -6.141 2.855 6.170
148 1HD LYS 21 1HD LYS 21 -5.853 5.694 6.803
149 2HD LYS 21 2HD LYS 21 -7.532 5.304 6.393
150 1HE LYS 21 1HE LYS 21 -7.792 4.424 8.451
151 2HE LYS 21 2HE LYS 21 -6.578 3.193 8.073
152 1HZ LYS 21 1HZ LYS 21 -5.872 4.431 9.997
153 2HZ LYS 21 2HZ LYS 21 -4.880 4.863 8.779
154 3HZ LYS 21 3HZ LYS 21 -6.114 5.859 9.217
155 H THR 22 H THR 22 -6.606 4.806 2.525
156 HA THR 22 HA THR 22 -7.868 7.324 3.348
157 HB THR 22 HB THR 22 -8.935 7.234 1.166
158 HG1 THR 22 1HG THR 22 -9.160 5.220 0.197
159 1HG2 THR 22 1HG2 THR 22 -6.253 5.919 0.578
160 2HG2 THR 22 2HG2 THR 22 -7.094 7.185 -0.350
161 3HG2 THR 22 3HG2 THR 22 -6.321 7.585 1.202
162 H SER 23 H SER 23 -10.225 5.612 1.847
163 HA SER 23 HA SER 23 -11.241 4.745 4.432
164 1HB SER 23 1HB SER 23 -12.527 5.801 1.920
165 2HB SER 23 2HB SER 23 -13.481 4.777 3.009
166 HG SER 23 HG SER 23 -12.276 7.345 3.511
167 H LEU 24 H LEU 24 -9.800 3.585 1.609
168 HA LEU 24 HA LEU 24 -10.901 0.934 2.107
169 1HB LEU 24 1HB LEU 24 -10.759 0.747 -0.519
170 2HB LEU 24 2HB LEU 24 -12.236 1.245 0.327
171 HG LEU 24 HG LEU 24 -10.430 3.453 -0.423
172 1HD1 LEU 24 1HD1 LEU 24 -11.878 1.969 -2.628
173 2HD1 LEU 24 2HD1 LEU 24 -10.873 3.430 -2.777
174 3HD1 LEU 24 3HD1 LEU 24 -10.125 1.875 -2.334
175 1HD2 LEU 24 1HD2 LEU 24 -13.226 2.974 0.084
176 2HD2 LEU 24 2HD2 LEU 24 -12.335 4.512 -0.005
177 3HD2 LEU 24 3HD2 LEU 24 -13.016 3.793 -1.483
178 H THR 25 H THR 25 -8.732 2.386 -0.408
179 HA THR 25 HA THR 25 -6.760 0.375 0.130
180 HB THR 25 HB THR 25 -7.327 2.535 -1.856
181 HG1 THR 25 1HG THR 25 -6.351 0.660 -3.104
182 1HG2 THR 25 1HG2 THR 25 -4.875 2.104 -2.714
183 2HG2 THR 25 2HG2 THR 25 -5.115 3.346 -1.461
184 3HG2 THR 25 3HG2 THR 25 -4.514 1.732 -1.011
185 H SER 26 H SER 26 -5.711 0.437 2.040
186 HA SER 26 HA SER 26 -5.220 2.804 3.403
187 1HB SER 26 1HB SER 26 -4.608 -0.045 3.681
188 2HB SER 26 2HB SER 26 -3.287 0.968 4.287
189 HG SER 26 HG SER 26 -4.520 1.043 6.049
190 H HIS 27 H HIS 27 -4.357 4.041 1.433
191 HA HIS 27 HA HIS 27 -1.907 3.380 0.297
192 1HB HIS 27 1HB HIS 27 -1.933 5.565 -0.637
193 2HB HIS 27 2HB HIS 27 -3.597 4.966 -0.621
194 HD1 HIS 27 1HD HIS 27 -1.761 7.943 0.021
195 HD2 HIS 27 2HD HIS 27 -4.933 6.006 1.966
196 HE1 HIS 27 1HE HIS 27 -2.887 9.706 1.482
197 HE2 HIS 27 2HE HIS 27 -4.834 8.461 2.661
198 H TYR 28 H TYR 28 -0.905 2.629 2.443
199 HA TYR 28 HA TYR 28 0.233 4.915 3.891
200 1HB TYR 28 1HB TYR 28 -0.844 2.253 4.480
201 2HB TYR 28 2HB TYR 28 0.840 2.309 5.011
202 HD1 TYR 28 1HD TYR 28 1.247 3.008 7.184
203 HD2 TYR 28 2HD TYR 28 -2.278 4.399 5.199
204 HE1 TYR 28 1HE TYR 28 0.517 4.203 9.305
205 HE2 TYR 28 2HE TYR 28 -2.997 5.590 7.326
206 HH TYR 28 HH TYR 28 -2.482 5.152 9.894
207 H CYS 29 H CYS 29 1.037 3.608 1.162
208 HA CYS 29 HA CYS 29 3.847 3.619 1.794
209 1HB CYS 29 1HB CYS 29 2.722 1.251 0.307
210 2HB CYS 29 2HB CYS 29 4.388 1.516 0.829
211 H THR 30 H THR 30 4.949 3.047 -0.625
212 HA THR 30 HA THR 30 3.324 4.393 -2.659
213 HB THR 30 HB THR 30 4.683 6.154 -1.559
214 HG1 THR 30 1HG THR 30 4.472 6.161 -3.907
215 1HG2 THR 30 1HG2 THR 30 7.163 6.049 -1.694
216 2HG2 THR 30 2HG2 THR 30 6.554 4.706 -0.696
217 3HG2 THR 30 3HG2 THR 30 7.066 4.406 -2.375
218 H GLY 31 H GLY 31 6.068 2.313 -1.723
219 1HA GLY 31 1HA GLY 31 5.965 0.257 -3.219
220 2HA GLY 31 2HA GLY 31 6.245 1.396 -4.523
221 H LYS 32 H LYS 32 7.750 -0.718 -2.372
222 HA LYS 32 HA LYS 32 9.850 -1.120 -1.822
223 1HB LYS 32 1HB LYS 32 10.653 -1.201 -3.929
224 2HB LYS 32 2HB LYS 32 10.115 0.436 -4.340
225 1HG LYS 32 1HG LYS 32 12.285 0.102 -2.284
226 2HG LYS 32 2HG LYS 32 12.709 -0.149 -3.986
227 1HD LYS 32 1HD LYS 32 11.161 2.200 -3.969
228 2HD LYS 32 2HD LYS 32 12.187 2.346 -2.531
229 1HE LYS 32 1HE LYS 32 13.612 1.352 -4.925
230 2HE LYS 32 2HE LYS 32 12.945 2.978 -5.133
231 1HZ LYS 32 1HZ LYS 32 14.857 2.063 -3.066
232 2HZ LYS 32 2HZ LYS 32 15.071 3.250 -4.161
233 3HZ LYS 32 3HZ LYS 32 13.996 3.456 -2.933
234 H SER 33 H SER 33 10.504 -0.496 0.159
235 HA SER 33 HA SER 33 11.749 0.837 1.488
236 1HB SER 33 1HB SER 33 12.101 2.413 -0.540
237 2HB SER 33 2HB SER 33 10.731 3.338 0.100
238 HG SER 33 HG SER 33 12.518 4.280 1.028
239 H CYS 34 H CYS 34 8.931 -0.132 1.507
240 HA CYS 34 HA CYS 34 7.967 1.694 3.558
241 1HB CYS 34 1HB CYS 34 6.036 0.506 1.595
242 2HB CYS 34 2HB CYS 34 5.785 1.827 2.741
243 H ASP 35 H ASP 35 6.074 0.479 4.798
244 HA ASP 35 HA ASP 35 6.076 -2.331 4.565
245 1HB ASP 35 1HB ASP 35 8.219 -2.110 5.725
246 2HB ASP 35 2HB ASP 35 7.501 -1.038 6.937
247 HD2 ASP 35 HD ASP 35 6.723 -3.090 9.038
248 H CYS 36 H CYS 36 4.246 0.024 4.645
249 HA CYS 36 HA CYS 36 2.938 -0.318 7.226
250 1HB CYS 36 1HB CYS 36 2.676 1.752 5.055
251 2HB CYS 36 2HB CYS 36 1.528 1.625 6.389
252 HA PRO 37 HA PRO 37 -0.327 -2.517 5.355
253 1HB PRO 37 1HB PRO 37 -2.569 -1.612 6.625
254 2HB PRO 37 2HB PRO 37 -1.461 -2.778 7.341
255 1HG PRO 37 1HG PRO 37 -1.791 0.104 7.878
256 2HG PRO 37 2HG PRO 37 -1.027 -1.152 8.919
257 1HD PRO 37 1HD PRO 37 0.248 0.867 7.338
258 2HD PRO 37 2HD PRO 37 1.044 -0.444 8.217
259 H LEU 38 H LEU 38 -1.886 -2.674 3.716
260 HA LEU 38 HA LEU 38 -2.821 -0.098 2.742
261 1HB LEU 38 1HB LEU 38 -1.214 -2.033 1.081
262 2HB LEU 38 2HB LEU 38 -2.090 -0.627 0.450
263 HG LEU 38 HG LEU 38 -0.298 0.167 2.575
264 1HD1 LEU 38 1HD1 LEU 38 1.682 -0.381 0.733
265 2HD1 LEU 38 2HD1 LEU 38 1.411 -1.234 2.272
266 3HD1 LEU 38 3HD1 LEU 38 0.730 -1.885 0.762
267 1HD2 LEU 38 1HD2 LEU 38 0.298 1.862 1.102
268 2HD2 LEU 38 2HD2 LEU 38 0.006 0.858 -0.339
269 3HD2 LEU 38 3HD2 LEU 38 -1.367 1.471 0.612
270 H TYR 39 H TYR 39 -4.157 -2.184 4.191
271 HA TYR 39 HA TYR 39 -6.238 -2.721 2.294
272 1HB TYR 39 1HB TYR 39 -4.206 -4.558 2.412
273 2HB TYR 39 2HB TYR 39 -5.131 -5.107 3.813
274 HD1 TYR 39 1HD TYR 39 -6.018 -7.164 3.106
275 HD2 TYR 39 2HD TYR 39 -6.399 -3.738 0.572
276 HE1 TYR 39 1HE TYR 39 -7.551 -8.472 1.555
277 HE2 TYR 39 2HE TYR 39 -7.928 -5.057 -0.970
278 HH TYR 39 HH TYR 39 -8.485 -7.214 -1.535
279 HA PRO 40 HA PRO 40 -8.480 -2.516 5.987
280 1HB PRO 40 1HB PRO 40 -10.856 -3.628 5.228
281 2HB PRO 40 2HB PRO 40 -10.414 -1.961 4.870
282 1HG PRO 40 1HG PRO 40 -10.438 -4.333 3.117
283 2HG PRO 40 2HG PRO 40 -10.461 -2.592 2.653
284 1HD PRO 40 1HD PRO 40 -8.277 -4.440 2.528
285 2HD PRO 40 2HD PRO 40 -8.207 -2.702 2.212
286 H GLY 41 H GLY 41 -9.549 -3.668 7.772
287 1HA GLY 41 1HA GLY 41 -10.158 -5.921 8.508
288 2HA GLY 41 2HA GLY 41 -8.718 -6.508 7.700
Start of MODEL 12
1 H CYS 1 H CYS 1 -2.386 -3.321 5.351
2 HA CYS 1 HA CYS 1 -0.219 -3.385 4.084
3 1HB CYS 1 1HB CYS 1 0.794 -4.731 6.009
4 2HB CYS 1 2HB CYS 1 -0.004 -6.135 5.296
5 H THR 2 H THR 2 -0.168 -6.400 3.218
6 HA THR 2 HA THR 2 -2.791 -7.123 2.511
7 HB THR 2 HB THR 2 -1.256 -5.301 0.649
8 HG1 THR 2 1HG THR 2 -3.648 -4.842 0.294
9 1HG2 THR 2 1HG2 THR 2 -2.371 -6.165 -1.304
10 2HG2 THR 2 2HG2 THR 2 -1.636 -7.591 -0.532
11 3HG2 THR 2 3HG2 THR 2 -3.375 -7.268 -0.331
12 H THR 3 H THR 3 0.723 -7.245 2.050
13 HA THR 3 HA THR 3 0.509 -10.130 1.853
14 HB THR 3 HB THR 3 1.508 -8.304 -0.369
15 HG1 THR 3 1HG THR 3 -0.360 -9.245 -1.086
16 1HG2 THR 3 1HG2 THR 3 3.246 -10.163 0.348
17 2HG2 THR 3 2HG2 THR 3 2.028 -11.299 -0.281
18 3HG2 THR 3 3HG2 THR 3 2.748 -10.079 -1.360
19 H GLY 4 H GLY 4 3.262 -8.031 0.928
20 1HA GLY 4 1HA GLY 4 4.732 -9.158 3.208
21 2HA GLY 4 2HA GLY 4 5.414 -8.442 1.761
22 HA PRO 5 HA PRO 5 5.750 -5.076 4.641
23 1HB PRO 5 1HB PRO 5 7.964 -3.940 3.512
24 2HB PRO 5 2HB PRO 5 8.048 -5.171 4.770
25 1HG PRO 5 1HG PRO 5 8.501 -5.395 1.864
26 2HG PRO 5 2HG PRO 5 9.048 -6.502 3.176
27 1HD PRO 5 1HD PRO 5 6.913 -6.876 1.305
28 2HD PRO 5 2HD PRO 5 7.308 -7.919 2.676
29 H CYS 6 H CYS 6 4.349 -5.328 1.880
30 HA CYS 6 HA CYS 6 3.326 -3.980 0.473
31 1HB CYS 6 1HB CYS 6 1.904 -2.561 1.442
32 2HB CYS 6 2HB CYS 6 2.553 -3.247 2.933
33 H CYS 7 H CYS 7 4.650 -3.381 -1.230
34 HA CYS 7 HA CYS 7 5.446 -1.090 -1.959
35 1HB CYS 7 1HB CYS 7 7.116 -1.690 0.408
36 2HB CYS 7 2HB CYS 7 7.956 -0.996 -0.981
37 H ARG 8 H ARG 8 5.047 -3.680 -2.961
38 HA ARG 8 HA ARG 8 6.485 -4.016 -5.010
39 1HB ARG 8 1HB ARG 8 8.663 -3.855 -4.116
40 2HB ARG 8 2HB ARG 8 8.271 -4.843 -2.698
41 1HG ARG 8 1HG ARG 8 9.705 -6.036 -4.356
42 2HG ARG 8 2HG ARG 8 8.157 -6.859 -4.096
43 1HD ARG 8 1HD ARG 8 8.162 -6.874 -6.398
44 2HD ARG 8 2HD ARG 8 7.453 -5.266 -6.177
45 HE ARG 8 HE ARG 8 10.272 -4.960 -6.151
46 1HH1 ARG 8 2HH2 ARG 8 7.758 -5.961 -8.441
47 2HH1 ARG 8 1HH2 ARG 8 8.647 -5.440 -9.834
48 1HH2 ARG 8 2HH1 ARG 8 11.422 -4.286 -7.963
49 2HH2 ARG 8 1HH1 ARG 8 10.744 -4.481 -9.566
50 H GLN 9 H GLN 9 4.896 -5.323 -2.293
51 HA GLN 9 HA GLN 9 3.772 -7.383 -3.772
52 1HB GLN 9 1HB GLN 9 6.119 -8.097 -2.060
53 2HB GLN 9 2HB GLN 9 4.731 -9.199 -2.021
54 1HG GLN 9 1HG GLN 9 5.077 -8.629 -4.743
55 2HG GLN 9 2HG GLN 9 6.733 -8.757 -4.133
56 1HE2 GLN 9 1HE2 GLN 9 7.583 -10.688 -3.880
57 2HE2 GLN 9 2HE2 GLN 9 6.742 -12.203 -3.891
58 H CYS 10 H CYS 10 2.443 -5.465 -2.568
59 HA CYS 10 HA CYS 10 0.723 -6.660 -0.851
60 1HB CYS 10 1HB CYS 10 2.004 -6.936 0.979
61 2HB CYS 10 2HB CYS 10 3.096 -5.608 0.576
62 H LYS 11 H LYS 11 2.605 -3.693 -1.625
63 HA LYS 11 HA LYS 11 0.276 -2.032 -1.177
64 1HB LYS 11 1HB LYS 11 1.712 -0.336 -0.972
65 2HB LYS 11 2HB LYS 11 2.933 -1.605 -0.787
66 1HG LYS 11 1HG LYS 11 2.181 -0.102 -3.325
67 2HG LYS 11 2HG LYS 11 3.720 -0.007 -2.451
68 1HD LYS 11 1HD LYS 11 4.507 -1.914 -3.410
69 2HD LYS 11 2HD LYS 11 2.957 -2.759 -3.248
70 1HE LYS 11 1HE LYS 11 2.108 -1.380 -5.199
71 2HE LYS 11 2HE LYS 11 3.747 -0.748 -5.407
72 1HZ LYS 11 1HZ LYS 11 3.142 -3.651 -5.424
73 2HZ LYS 11 2HZ LYS 11 3.166 -2.760 -6.787
74 3HZ LYS 11 3HZ LYS 11 4.526 -2.882 -5.871
75 H LEU 12 H LEU 12 0.672 -4.240 -3.373
76 HA LEU 12 HA LEU 12 0.978 -3.360 -5.850
77 1HB LEU 12 1HB LEU 12 -0.774 -4.912 -6.544
78 2HB LEU 12 2HB LEU 12 0.340 -5.606 -5.353
79 HG LEU 12 HG LEU 12 -1.564 -4.843 -3.668
80 1HD1 LEU 12 1HD1 LEU 12 -2.764 -4.300 -6.200
81 2HD1 LEU 12 2HD1 LEU 12 -3.631 -5.657 -5.443
82 3HD1 LEU 12 3HD1 LEU 12 -3.452 -4.117 -4.569
83 1HD2 LEU 12 1HD2 LEU 12 -2.691 -7.193 -4.484
84 2HD2 LEU 12 2HD2 LEU 12 -1.068 -7.303 -5.206
85 3HD2 LEU 12 3HD2 LEU 12 -1.248 -7.052 -3.453
86 H LYS 13 H LYS 13 -1.678 -2.445 -3.644
87 HA LYS 13 HA LYS 13 -3.467 -1.345 -5.354
88 1HB LYS 13 1HB LYS 13 -3.271 0.464 -3.218
89 2HB LYS 13 2HB LYS 13 -4.366 -0.923 -3.366
90 1HG LYS 13 1HG LYS 13 -3.314 -1.800 -1.575
91 2HG LYS 13 2HG LYS 13 -1.898 -2.051 -2.610
92 1HD LYS 13 1HD LYS 13 -2.509 0.268 -0.753
93 2HD LYS 13 2HD LYS 13 -1.103 -0.808 -0.724
94 1HE LYS 13 1HE LYS 13 -0.017 0.766 -1.928
95 2HE LYS 13 2HE LYS 13 -1.056 0.343 -3.297
96 1HZ LYS 13 1HZ LYS 13 -2.682 1.992 -2.180
97 2HZ LYS 13 2HZ LYS 13 -1.385 2.548 -1.367
98 3HZ LYS 13 3HZ LYS 13 -1.386 2.569 -3.010
99 HA PRO 14 HA PRO 14 -1.766 2.246 -7.068
100 1HB PRO 14 1HB PRO 14 -3.563 4.259 -6.648
101 2HB PRO 14 2HB PRO 14 -3.771 3.024 -7.888
102 1HG PRO 14 1HG PRO 14 -5.078 3.312 -5.257
103 2HG PRO 14 2HG PRO 14 -5.626 2.361 -6.686
104 1HD PRO 14 1HD PRO 14 -4.437 1.406 -4.262
105 2HD PRO 14 2HD PRO 14 -4.811 0.450 -5.701
106 H ALA 15 H ALA 15 0.153 2.998 -6.441
107 HA ALA 15 HA ALA 15 0.935 3.598 -3.986
108 1HB ALA 15 1HB ALA 15 1.647 4.507 -6.700
109 2HB ALA 15 2HB ALA 15 2.146 5.632 -5.413
110 3HB ALA 15 3HB ALA 15 2.690 3.938 -5.375
111 H GLY 16 H GLY 16 0.702 5.178 -2.417
112 1HA GLY 16 1HA GLY 16 -1.081 7.437 -3.104
113 2HA GLY 16 2HA GLY 16 -1.268 6.497 -1.638
114 H THR 17 H THR 17 0.407 6.578 0.035
115 HA THR 17 HA THR 17 2.593 8.410 -0.296
116 HB THR 17 HB THR 17 0.458 9.138 1.756
117 HG1 THR 17 1HG THR 17 -0.538 10.233 0.074
118 1HG2 THR 17 1HG2 THR 17 3.075 10.170 0.977
119 2HG2 THR 17 2HG2 THR 17 1.818 11.378 0.618
120 3HG2 THR 17 3HG2 THR 17 1.997 10.745 2.272
121 H THR 18 H THR 18 2.391 8.822 2.773
122 HA THR 18 HA THR 18 3.267 6.094 3.466
123 HB THR 18 HB THR 18 4.611 8.739 3.613
124 HG1 THR 18 1HG THR 18 5.203 5.880 3.883
125 1HG2 THR 18 1HG2 THR 18 5.815 8.163 5.724
126 2HG2 THR 18 2HG2 THR 18 4.090 8.462 6.048
127 3HG2 THR 18 3HG2 THR 18 4.707 6.793 5.979
128 H CYS 19 H CYS 19 2.160 5.123 5.041
129 HA CYS 19 HA CYS 19 0.415 4.915 6.430
130 1HB CYS 19 1HB CYS 19 2.599 6.404 7.735
131 2HB CYS 19 2HB CYS 19 1.062 6.399 8.605
132 H TRP 20 H TRP 20 -1.136 6.065 4.958
133 HA TRP 20 HA TRP 20 -2.053 8.542 6.229
134 1HB TRP 20 1HB TRP 20 -0.735 8.620 3.875
135 2HB TRP 20 2HB TRP 20 -2.383 8.367 3.297
136 HD1 TRP 20 HD TRP 20 -0.239 10.976 5.157
137 HE1 TRP 20 1HE TRP 20 -1.424 13.333 5.200
138 HE3 TRP 20 3HE TRP 20 -4.654 9.376 3.208
139 HZ2 TRP 20 2HZ TRP 20 -4.019 14.243 4.430
140 HZ3 TRP 20 3HZ TRP 20 -6.461 11.062 2.885
141 HH2 TRP 20 HH TRP 20 -6.197 13.422 3.462
142 H LYS 21 H LYS 21 -3.068 6.568 3.357
143 HA LYS 21 HA LYS 21 -4.740 5.046 3.229
144 1HB LYS 21 1HB LYS 21 -5.896 4.268 5.005
145 2HB LYS 21 2HB LYS 21 -4.571 5.044 5.891
146 1HG LYS 21 1HG LYS 21 -6.257 7.155 5.646
147 2HG LYS 21 2HG LYS 21 -7.448 5.845 5.632
148 1HD LYS 21 1HD LYS 21 -5.761 5.097 7.697
149 2HD LYS 21 2HD LYS 21 -5.762 6.863 7.846
150 1HE LYS 21 1HE LYS 21 -8.454 5.875 7.345
151 2HE LYS 21 2HE LYS 21 -7.756 5.044 8.744
152 1HZ LYS 21 1HZ LYS 21 -8.895 7.454 8.887
153 2HZ LYS 21 2HZ LYS 21 -7.733 6.980 9.923
154 3HZ LYS 21 3HZ LYS 21 -7.332 7.883 8.610
155 H THR 22 H THR 22 -6.291 5.482 1.748
156 HA THR 22 HA THR 22 -8.408 7.189 2.051
157 HB THR 22 HB THR 22 -6.721 9.017 2.267
158 HG1 THR 22 1HG THR 22 -8.659 9.587 1.174
159 1HG2 THR 22 1HG2 THR 22 -4.804 8.609 0.997
160 2HG2 THR 22 2HG2 THR 22 -5.710 7.751 -0.272
161 3HG2 THR 22 3HG2 THR 22 -5.733 9.530 -0.211
162 H SER 23 H SER 23 -8.851 8.181 -0.503
163 HA SER 23 HA SER 23 -9.671 7.483 -2.393
164 1HB SER 23 1HB SER 23 -6.864 6.826 -2.392
165 2HB SER 23 2HB SER 23 -7.728 5.617 -3.358
166 HG SER 23 HG SER 23 -8.296 8.404 -3.718
167 H LEU 24 H LEU 24 -10.021 5.747 0.143
168 HA LEU 24 HA LEU 24 -11.297 3.990 0.614
169 1HB LEU 24 1HB LEU 24 -12.179 4.525 -1.805
170 2HB LEU 24 2HB LEU 24 -11.388 2.988 -2.193
171 HG LEU 24 HG LEU 24 -13.646 3.487 -0.241
172 1HD1 LEU 24 1HD1 LEU 24 -13.438 1.972 -2.852
173 2HD1 LEU 24 2HD1 LEU 24 -14.802 1.804 -1.722
174 3HD1 LEU 24 3HD1 LEU 24 -14.457 3.381 -2.473
175 1HD2 LEU 24 1HD2 LEU 24 -13.599 1.052 0.207
176 2HD2 LEU 24 2HD2 LEU 24 -12.067 0.940 -0.692
177 3HD2 LEU 24 3HD2 LEU 24 -12.153 1.902 0.803
178 H THR 25 H THR 25 -8.212 4.074 -0.603
179 HA THR 25 HA THR 25 -7.786 1.254 0.131
180 HB THR 25 HB THR 25 -6.287 2.831 -2.023
181 HG1 THR 25 1HG THR 25 -8.536 2.426 -2.590
182 1HG2 THR 25 1HG2 THR 25 -5.868 0.254 -0.748
183 2HG2 THR 25 2HG2 THR 25 -6.384 -0.013 -2.432
184 3HG2 THR 25 3HG2 THR 25 -4.949 0.982 -2.087
185 H SER 26 H SER 26 -6.823 1.194 2.060
186 HA SER 26 HA SER 26 -5.667 3.314 3.285
187 1HB SER 26 1HB SER 26 -5.421 0.332 3.580
188 2HB SER 26 2HB SER 26 -4.346 1.362 4.540
189 HG SER 26 HG SER 26 -6.805 0.665 5.166
190 H HIS 27 H HIS 27 -4.381 4.369 1.551
191 HA HIS 27 HA HIS 27 -2.382 3.352 0.108
192 1HB HIS 27 1HB HIS 27 -2.531 5.997 1.556
193 2HB HIS 27 2HB HIS 27 -1.266 5.618 0.381
194 HD1 HIS 27 1HD HIS 27 -4.046 3.963 -1.011
195 HD2 HIS 27 2HD HIS 27 -3.008 8.010 -0.637
196 HE1 HIS 27 1HE HIS 27 -5.402 5.213 -2.773
197 HE2 HIS 27 2HE HIS 27 -4.724 7.702 -2.505
198 H TYR 28 H TYR 28 -1.658 4.983 3.276
199 HA TYR 28 HA TYR 28 0.267 4.769 4.471
200 1HB TYR 28 1HB TYR 28 -1.588 2.414 4.514
201 2HB TYR 28 2HB TYR 28 -0.006 2.071 5.222
202 HD1 TYR 28 1HD TYR 28 0.335 2.542 7.478
203 HD2 TYR 28 2HD TYR 28 -2.774 4.600 5.380
204 HE1 TYR 28 1HE TYR 28 -0.429 3.619 9.651
205 HE2 TYR 28 2HE TYR 28 -3.527 5.671 7.560
206 HH TYR 28 HH TYR 28 -2.295 6.249 9.798
207 H CYS 29 H CYS 29 0.894 4.343 1.660
208 HA CYS 29 HA CYS 29 3.415 3.360 1.846
209 1HB CYS 29 1HB CYS 29 1.854 1.195 2.198
210 2HB CYS 29 2HB CYS 29 2.000 1.172 0.438
211 H THR 30 H THR 30 3.809 2.237 -0.731
212 HA THR 30 HA THR 30 2.228 3.641 -2.663
213 HB THR 30 HB THR 30 4.855 4.727 -1.651
214 HG1 THR 30 1HG THR 30 2.453 5.726 -3.015
215 1HG2 THR 30 1HG2 THR 30 5.411 5.754 -3.751
216 2HG2 THR 30 2HG2 THR 30 5.143 4.042 -4.156
217 3HG2 THR 30 3HG2 THR 30 3.875 5.245 -4.493
218 H GLY 31 H GLY 31 5.644 2.448 -2.352
219 1HA GLY 31 1HA GLY 31 5.315 -0.017 -3.503
220 2HA GLY 31 2HA GLY 31 5.464 1.081 -4.860
221 H LYS 32 H LYS 32 7.194 -0.881 -2.746
222 HA LYS 32 HA LYS 32 9.306 -0.981 -2.045
223 1HB LYS 32 1HB LYS 32 10.950 -0.417 -3.962
224 2HB LYS 32 2HB LYS 32 9.781 -1.731 -4.183
225 1HG LYS 32 1HG LYS 32 9.662 -0.472 -6.188
226 2HG LYS 32 2HG LYS 32 8.249 0.065 -5.264
227 1HD LYS 32 1HD LYS 32 9.060 2.140 -5.764
228 2HD LYS 32 2HD LYS 32 10.117 1.851 -4.370
229 1HE LYS 32 1HE LYS 32 11.779 0.818 -6.030
230 2HE LYS 32 2HE LYS 32 10.763 1.465 -7.326
231 1HZ LYS 32 1HZ LYS 32 12.689 2.905 -6.466
232 2HZ LYS 32 2HZ LYS 32 11.251 3.649 -6.649
233 3HZ LYS 32 3HZ LYS 32 11.731 3.164 -5.153
234 H SER 33 H SER 33 7.809 1.596 -1.507
235 HA SER 33 HA SER 33 10.136 3.019 -0.645
236 1HB SER 33 1HB SER 33 9.114 3.801 -3.057
237 2HB SER 33 2HB SER 33 8.168 4.826 -1.962
238 HG SER 33 HG SER 33 10.974 4.651 -1.519
239 H CYS 34 H CYS 34 8.494 1.626 0.990
240 HA CYS 34 HA CYS 34 7.354 3.668 2.587
241 1HB CYS 34 1HB CYS 34 5.077 2.976 2.627
242 2HB CYS 34 2HB CYS 34 5.520 3.378 0.966
243 H ASP 35 H ASP 35 5.483 1.407 3.707
244 HA ASP 35 HA ASP 35 6.582 -0.876 4.295
245 1HB ASP 35 1HB ASP 35 8.230 1.259 5.489
246 2HB ASP 35 2HB ASP 35 7.706 0.058 6.680
247 HD2 ASP 35 HD ASP 35 10.504 0.443 5.473
248 H CYS 36 H CYS 36 4.088 0.550 4.354
249 HA CYS 36 HA CYS 36 3.355 0.185 7.166
250 1HB CYS 36 1HB CYS 36 3.099 2.558 5.527
251 2HB CYS 36 2HB CYS 36 1.521 2.006 6.099
252 HA PRO 37 HA PRO 37 0.218 -2.323 5.483
253 1HB PRO 37 1HB PRO 37 -1.853 -2.017 7.238
254 2HB PRO 37 2HB PRO 37 -0.465 -3.056 7.556
255 1HG PRO 37 1HG PRO 37 -1.117 -0.382 8.618
256 2HG PRO 37 2HG PRO 37 0.012 -1.612 9.292
257 1HD PRO 37 1HD PRO 37 0.643 0.801 7.885
258 2HD PRO 37 2HD PRO 37 1.780 -0.456 8.388
259 H LEU 38 H LEU 38 -1.486 -2.502 4.036
260 HA LEU 38 HA LEU 38 -2.797 0.085 3.572
261 1HB LEU 38 1HB LEU 38 -2.624 -1.430 1.169
262 2HB LEU 38 2HB LEU 38 -2.008 0.194 1.523
263 HG LEU 38 HG LEU 38 -0.199 -1.643 2.693
264 1HD1 LEU 38 1HD1 LEU 38 -0.832 -3.498 1.455
265 2HD1 LEU 38 2HD1 LEU 38 -1.209 -2.536 0.006
266 3HD1 LEU 38 3HD1 LEU 38 0.486 -2.808 0.480
267 1HD2 LEU 38 1HD2 LEU 38 1.382 -0.687 1.083
268 2HD2 LEU 38 2HD2 LEU 38 0.029 0.015 0.166
269 3HD2 LEU 38 3HD2 LEU 38 0.360 0.567 1.826
270 H TYR 39 H TYR 39 -4.215 -1.188 5.255
271 HA TYR 39 HA TYR 39 -6.364 -2.336 3.705
272 1HB TYR 39 1HB TYR 39 -4.379 -3.940 4.928
273 2HB TYR 39 2HB TYR 39 -5.653 -3.896 6.152
274 HD1 TYR 39 1HD TYR 39 -6.968 -5.798 6.116
275 HD2 TYR 39 2HD TYR 39 -5.570 -4.198 2.401
276 HE1 TYR 39 1HE TYR 39 -8.211 -7.621 4.853
277 HE2 TYR 39 2HE TYR 39 -6.818 -6.027 1.152
278 HH TYR 39 HH TYR 39 -8.404 -7.575 1.346
279 HA PRO 40 HA PRO 40 -8.208 0.055 6.883
280 1HB PRO 40 1HB PRO 40 -10.699 0.198 5.772
281 2HB PRO 40 2HB PRO 40 -9.404 1.327 5.383
282 1HG PRO 40 1HG PRO 40 -10.461 -0.951 3.835
283 2HG PRO 40 2HG PRO 40 -9.506 0.458 3.250
284 1HD PRO 40 1HD PRO 40 -8.629 -2.234 3.675
285 2HD PRO 40 2HD PRO 40 -7.614 -0.850 3.250
286 H GLY 41 H GLY 41 -9.798 -2.776 5.533
287 1HA GLY 41 1HA GLY 41 -10.987 -4.406 6.525
288 2HA GLY 41 2HA GLY 41 -9.905 -4.198 7.889
Start of MODEL 13
1 H CYS 1 H CYS 1 -2.287 -3.039 5.912
2 HA CYS 1 HA CYS 1 -0.548 -3.385 4.495
3 1HB CYS 1 1HB CYS 1 0.628 -4.619 6.449
4 2HB CYS 1 2HB CYS 1 0.063 -6.089 5.649
5 H THR 2 H THR 2 -0.053 -6.042 3.277
6 HA THR 2 HA THR 2 -2.650 -7.176 2.749
7 HB THR 2 HB THR 2 -1.245 -5.265 0.871
8 HG1 THR 2 1HG THR 2 -3.206 -4.488 1.620
9 1HG2 THR 2 1HG2 THR 2 -2.374 -6.240 -1.060
10 2HG2 THR 2 2HG2 THR 2 -1.399 -7.536 -0.324
11 3HG2 THR 2 3HG2 THR 2 -3.156 -7.474 -0.043
12 H THR 3 H THR 3 0.663 -7.338 3.189
13 HA THR 3 HA THR 3 0.717 -10.107 2.686
14 HB THR 3 HB THR 3 1.731 -8.227 0.536
15 HG1 THR 3 1HG THR 3 0.585 -9.826 -0.647
16 1HG2 THR 3 1HG2 THR 3 3.125 -10.093 -0.356
17 2HG2 THR 3 2HG2 THR 3 3.754 -9.549 1.217
18 3HG2 THR 3 3HG2 THR 3 2.796 -11.044 1.111
19 H GLY 4 H GLY 4 3.330 -7.684 2.130
20 1HA GLY 4 1HA GLY 4 4.407 -8.389 4.785
21 2HA GLY 4 2HA GLY 4 5.402 -8.526 3.350
22 HA PRO 5 HA PRO 5 6.356 -4.330 4.039
23 1HB PRO 5 1HB PRO 5 7.970 -3.927 1.872
24 2HB PRO 5 2HB PRO 5 8.539 -4.645 3.379
25 1HG PRO 5 1HG PRO 5 7.890 -5.915 0.797
26 2HG PRO 5 2HG PRO 5 8.904 -6.555 2.138
27 1HD PRO 5 1HD PRO 5 6.234 -7.297 1.413
28 2HD PRO 5 2HD PRO 5 7.131 -7.842 2.838
29 H CYS 6 H CYS 6 4.350 -5.513 1.734
30 HA CYS 6 HA CYS 6 2.783 -4.587 0.511
31 1HB CYS 6 1HB CYS 6 1.771 -2.634 1.139
32 2HB CYS 6 2HB CYS 6 2.588 -3.121 2.627
33 H CYS 7 H CYS 7 5.582 -2.286 0.849
34 HA CYS 7 HA CYS 7 5.434 -1.109 -1.601
35 1HB CYS 7 1HB CYS 7 7.409 -1.431 0.481
36 2HB CYS 7 2HB CYS 7 8.175 -1.442 -1.109
37 H ARG 8 H ARG 8 4.577 -2.968 -2.933
38 HA ARG 8 HA ARG 8 5.346 -3.932 -4.882
39 1HB ARG 8 1HB ARG 8 7.738 -3.727 -4.468
40 2HB ARG 8 2HB ARG 8 7.668 -4.908 -3.148
41 1HG ARG 8 1HG ARG 8 8.555 -5.992 -5.135
42 2HG ARG 8 2HG ARG 8 6.938 -6.646 -4.825
43 1HD ARG 8 1HD ARG 8 6.324 -6.037 -6.907
44 2HD ARG 8 2HD ARG 8 6.615 -4.339 -6.498
45 HE ARG 8 HE ARG 8 9.146 -5.370 -7.023
46 1HH1 ARG 8 2HH2 ARG 8 6.111 -5.211 -8.844
47 2HH1 ARG 8 1HH2 ARG 8 6.895 -5.171 -10.389
48 1HH2 ARG 8 2HH1 ARG 8 10.161 -5.317 -9.028
49 2HH2 ARG 8 1HH1 ARG 8 9.214 -5.232 -10.499
50 H GLN 9 H GLN 9 4.775 -5.000 -1.647
51 HA GLN 9 HA GLN 9 3.399 -7.302 -2.685
52 1HB GLN 9 1HB GLN 9 5.793 -7.433 -0.900
53 2HB GLN 9 2HB GLN 9 4.457 -8.535 -0.523
54 1HG GLN 9 1HG GLN 9 4.564 -8.989 -3.153
55 2HG GLN 9 2HG GLN 9 6.229 -8.418 -2.962
56 1HE2 GLN 9 1HE2 GLN 9 7.714 -9.656 -1.961
57 2HE2 GLN 9 2HE2 GLN 9 7.447 -11.267 -1.386
58 H CYS 10 H CYS 10 1.676 -5.660 -2.127
59 HA CYS 10 HA CYS 10 -0.033 -6.094 -0.393
60 1HB CYS 10 1HB CYS 10 0.885 -6.549 1.583
61 2HB CYS 10 2HB CYS 10 2.355 -5.629 1.249
62 H LYS 11 H LYS 11 2.108 -3.807 -1.792
63 HA LYS 11 HA LYS 11 0.280 -1.597 -1.172
64 1HB LYS 11 1HB LYS 11 2.022 -0.139 -1.295
65 2HB LYS 11 2HB LYS 11 2.876 -1.569 -0.690
66 1HG LYS 11 1HG LYS 11 4.270 -1.210 -2.445
67 2HG LYS 11 2HG LYS 11 2.997 -1.962 -3.423
68 1HD LYS 11 1HD LYS 11 2.025 0.504 -3.476
69 2HD LYS 11 2HD LYS 11 3.689 0.963 -3.084
70 1HE LYS 11 1HE LYS 11 3.556 1.003 -5.466
71 2HE LYS 11 2HE LYS 11 4.395 -0.509 -5.086
72 1HZ LYS 11 1HZ LYS 11 1.538 -0.801 -5.190
73 2HZ LYS 11 2HZ LYS 11 2.149 -0.291 -6.610
74 3HZ LYS 11 3HZ LYS 11 2.733 -1.664 -5.917
75 H LEU 12 H LEU 12 -0.068 -3.904 -3.131
76 HA LEU 12 HA LEU 12 0.413 -3.415 -5.692
77 1HB LEU 12 1HB LEU 12 -1.903 -4.289 -6.150
78 2HB LEU 12 2HB LEU 12 -0.840 -5.295 -5.150
79 HG LEU 12 HG LEU 12 -2.111 -4.050 -3.182
80 1HD1 LEU 12 1HD1 LEU 12 -4.207 -4.016 -5.367
81 2HD1 LEU 12 2HD1 LEU 12 -4.413 -3.543 -3.663
82 3HD1 LEU 12 3HD1 LEU 12 -3.373 -2.576 -4.737
83 1HD2 LEU 12 1HD2 LEU 12 -3.501 -5.954 -2.932
84 2HD2 LEU 12 2HD2 LEU 12 -3.504 -6.274 -4.684
85 3HD2 LEU 12 3HD2 LEU 12 -2.014 -6.512 -3.737
86 H LYS 13 H LYS 13 -1.547 -1.400 -3.545
87 HA LYS 13 HA LYS 13 -3.092 -0.002 -5.274
88 1HB LYS 13 1HB LYS 13 -1.518 1.228 -3.007
89 2HB LYS 13 2HB LYS 13 -3.074 1.773 -3.659
90 1HG LYS 13 1HG LYS 13 -3.818 0.570 -1.834
91 2HG LYS 13 2HG LYS 13 -3.792 -0.739 -3.029
92 1HD LYS 13 1HD LYS 13 -1.169 -0.624 -1.998
93 2HD LYS 13 2HD LYS 13 -2.215 -0.408 -0.583
94 1HE LYS 13 1HE LYS 13 -3.170 -2.510 -2.413
95 2HE LYS 13 2HE LYS 13 -1.548 -2.845 -1.787
96 1HZ LYS 13 1HZ LYS 13 -3.911 -2.189 -0.109
97 2HZ LYS 13 2HZ LYS 13 -3.308 -3.688 -0.314
98 3HZ LYS 13 3HZ LYS 13 -2.391 -2.534 0.416
99 HA PRO 14 HA PRO 14 -0.469 2.216 -7.883
100 1HB PRO 14 1HB PRO 14 -1.955 4.435 -8.456
101 2HB PRO 14 2HB PRO 14 -2.219 2.874 -9.227
102 1HG PRO 14 1HG PRO 14 -3.750 4.214 -7.092
103 2HG PRO 14 2HG PRO 14 -4.279 2.888 -8.190
104 1HD PRO 14 1HD PRO 14 -3.539 2.726 -5.428
105 2HD PRO 14 2HD PRO 14 -3.897 1.370 -6.505
106 H ALA 15 H ALA 15 -0.031 2.545 -5.024
107 HA ALA 15 HA ALA 15 1.531 3.718 -3.919
108 1HB ALA 15 1HB ALA 15 1.566 6.114 -5.662
109 2HB ALA 15 2HB ALA 15 2.913 5.139 -5.029
110 3HB ALA 15 3HB ALA 15 2.022 4.595 -6.470
111 H GLY 16 H GLY 16 1.436 5.439 -2.322
112 1HA GLY 16 1HA GLY 16 -0.400 7.525 -2.323
113 2HA GLY 16 2HA GLY 16 -1.212 6.144 -1.613
114 H THR 17 H THR 17 1.556 8.388 -1.318
115 HA THR 17 HA THR 17 2.990 8.778 0.361
116 HB THR 17 HB THR 17 0.484 8.369 2.066
117 HG1 THR 17 1HG THR 17 0.380 10.783 1.282
118 1HG2 THR 17 1HG2 THR 17 3.049 9.931 2.285
119 2HG2 THR 17 2HG2 THR 17 1.558 10.758 2.795
120 3HG2 THR 17 3HG2 THR 17 2.042 9.233 3.575
121 H THR 18 H THR 18 3.367 8.010 2.946
122 HA THR 18 HA THR 18 3.819 5.116 2.629
123 HB THR 18 HB THR 18 5.793 6.830 2.704
124 HG1 THR 18 1HG THR 18 5.410 4.718 4.708
125 1HG2 THR 18 1HG2 THR 18 5.915 6.627 5.613
126 2HG2 THR 18 2HG2 THR 18 6.097 8.076 4.595
127 3HG2 THR 18 3HG2 THR 18 4.479 7.565 5.134
128 H CYS 19 H CYS 19 1.569 7.041 3.897
129 HA CYS 19 HA CYS 19 0.607 5.195 5.658
130 1HB CYS 19 1HB CYS 19 2.600 6.989 6.896
131 2HB CYS 19 2HB CYS 19 1.079 6.812 7.777
132 H TRP 20 H TRP 20 -1.083 6.086 4.175
133 HA TRP 20 HA TRP 20 -2.108 8.660 5.165
134 1HB TRP 20 1HB TRP 20 -1.303 8.056 2.597
135 2HB TRP 20 2HB TRP 20 -3.052 7.832 2.531
136 HD1 TRP 20 HD TRP 20 -1.470 10.322 1.107
137 HE1 TRP 20 1HE TRP 20 -2.144 12.824 1.610
138 HE3 TRP 20 3HE TRP 20 -3.776 9.362 5.536
139 HZ2 TRP 20 2HZ TRP 20 -3.535 14.092 3.755
140 HZ3 TRP 20 3HZ TRP 20 -4.766 11.287 6.771
141 HH2 TRP 20 HH TRP 20 -4.673 13.588 5.949
142 H LYS 21 H LYS 21 -3.262 5.775 3.264
143 HA LYS 21 HA LYS 21 -4.861 4.294 3.716
144 1HB LYS 21 1HB LYS 21 -4.844 3.732 5.852
145 2HB LYS 21 2HB LYS 21 -4.328 5.352 6.352
146 1HG LYS 21 1HG LYS 21 -7.177 5.068 5.507
147 2HG LYS 21 2HG LYS 21 -6.739 4.253 7.018
148 1HD LYS 21 1HD LYS 21 -5.541 6.622 7.471
149 2HD LYS 21 2HD LYS 21 -6.794 7.185 6.353
150 1HE LYS 21 1HE LYS 21 -8.464 6.839 7.871
151 2HE LYS 21 2HE LYS 21 -7.762 5.325 8.464
152 1HZ LYS 21 1HZ LYS 21 -6.503 6.466 10.004
153 2HZ LYS 21 2HZ LYS 21 -6.392 7.832 9.124
154 3HZ LYS 21 3HZ LYS 21 -7.800 7.471 9.892
155 H THR 22 H THR 22 -6.724 4.368 2.579
156 HA THR 22 HA THR 22 -8.010 6.947 2.273
157 HB THR 22 HB THR 22 -9.146 5.802 0.415
158 HG1 THR 22 1HG THR 22 -9.095 3.513 0.399
159 1HG2 THR 22 1HG2 THR 22 -7.190 4.690 -0.776
160 2HG2 THR 22 2HG2 THR 22 -6.813 6.319 -0.166
161 3HG2 THR 22 3HG2 THR 22 -6.240 4.884 0.717
162 H SER 23 H SER 23 -10.338 4.589 1.801
163 HA SER 23 HA SER 23 -11.232 4.689 4.547
164 1HB SER 23 1HB SER 23 -12.347 6.276 2.378
165 2HB SER 23 2HB SER 23 -13.570 5.165 3.021
166 HG SER 23 HG SER 23 -13.551 6.203 4.939
167 H LEU 24 H LEU 24 -10.249 2.766 2.260
168 HA LEU 24 HA LEU 24 -11.982 0.636 2.979
169 1HB LEU 24 1HB LEU 24 -13.519 1.330 1.436
170 2HB LEU 24 2HB LEU 24 -12.298 1.944 0.309
171 HG LEU 24 HG LEU 24 -11.855 -0.826 0.471
172 1HD1 LEU 24 1HD1 LEU 24 -13.860 -1.949 0.295
173 2HD1 LEU 24 2HD1 LEU 24 -14.241 -0.729 1.532
174 3HD1 LEU 24 3HD1 LEU 24 -14.770 -0.486 -0.150
175 1HD2 LEU 24 1HD2 LEU 24 -12.853 1.125 -1.542
176 2HD2 LEU 24 2HD2 LEU 24 -11.452 0.028 -1.593
177 3HD2 LEU 24 3HD2 LEU 24 -13.089 -0.604 -1.889
178 H THR 25 H THR 25 -9.991 1.445 0.049
179 HA THR 25 HA THR 25 -8.624 -0.979 0.047
180 HB THR 25 HB THR 25 -8.483 1.697 -1.256
181 HG1 THR 25 1HG THR 25 -9.427 -0.252 -2.182
182 1HG2 THR 25 1HG2 THR 25 -6.270 1.019 -2.354
183 2HG2 THR 25 2HG2 THR 25 -6.110 1.597 -0.678
184 3HG2 THR 25 3HG2 THR 25 -6.051 -0.148 -1.027
185 H SER 26 H SER 26 -7.612 2.221 1.413
186 HA SER 26 HA SER 26 -6.415 2.594 3.223
187 1HB SER 26 1HB SER 26 -5.689 -0.358 3.338
188 2HB SER 26 2HB SER 26 -5.477 0.834 4.633
189 HG SER 26 HG SER 26 -8.075 0.307 3.517
190 H HIS 27 H HIS 27 -4.963 3.837 1.951
191 HA HIS 27 HA HIS 27 -3.025 2.667 0.304
192 1HB HIS 27 1HB HIS 27 -3.400 5.413 1.482
193 2HB HIS 27 2HB HIS 27 -2.003 5.022 0.475
194 HD1 HIS 27 1HD HIS 27 -3.943 3.075 -1.394
195 HD2 HIS 27 2HD HIS 27 -4.359 7.162 -0.544
196 HE1 HIS 27 1HE HIS 27 -5.345 4.059 -3.284
197 HE2 HIS 27 2HE HIS 27 -5.571 6.580 -2.715
198 H TYR 28 H TYR 28 -1.470 4.961 2.335
199 HA TYR 28 HA TYR 28 0.154 4.827 3.840
200 1HB TYR 28 1HB TYR 28 -1.699 2.572 4.369
201 2HB TYR 28 2HB TYR 28 -0.058 2.176 4.887
202 HD1 TYR 28 1HD TYR 28 0.563 2.744 7.053
203 HD2 TYR 28 2HD TYR 28 -2.557 4.968 5.149
204 HE1 TYR 28 1HE TYR 28 0.177 4.054 9.197
205 HE2 TYR 28 2HE TYR 28 -2.932 6.270 7.299
206 HH TYR 28 HH TYR 28 -2.398 6.494 9.380
207 H CYS 29 H CYS 29 0.898 4.313 1.232
208 HA CYS 29 HA CYS 29 3.316 3.025 1.568
209 1HB CYS 29 1HB CYS 29 1.553 1.063 1.560
210 2HB CYS 29 2HB CYS 29 1.646 1.280 -0.191
211 H THR 30 H THR 30 4.398 2.746 -0.713
212 HA THR 30 HA THR 30 3.066 4.459 -2.692
213 HB THR 30 HB THR 30 5.896 4.725 -1.556
214 HG1 THR 30 1HG THR 30 3.529 6.438 -1.868
215 1HG2 THR 30 1HG2 THR 30 5.804 5.105 -4.079
216 2HG2 THR 30 2HG2 THR 30 4.556 6.339 -3.785
217 3HG2 THR 30 3HG2 THR 30 6.202 6.566 -3.145
218 H GLY 31 H GLY 31 6.009 2.406 -2.128
219 1HA GLY 31 1HA GLY 31 5.539 0.307 -3.681
220 2HA GLY 31 2HA GLY 31 5.873 1.521 -4.900
221 H LYS 32 H LYS 32 7.252 -0.802 -2.827
222 HA LYS 32 HA LYS 32 9.376 -1.478 -2.706
223 1HB LYS 32 1HB LYS 32 10.081 -0.713 -4.774
224 2HB LYS 32 2HB LYS 32 9.857 0.994 -4.354
225 1HG LYS 32 1HG LYS 32 11.827 -0.634 -2.768
226 2HG LYS 32 2HG LYS 32 12.289 -0.141 -4.407
227 1HD LYS 32 1HD LYS 32 11.273 2.205 -3.411
228 2HD LYS 32 2HD LYS 32 11.950 1.490 -1.937
229 1HE LYS 32 1HE LYS 32 13.947 1.033 -3.813
230 2HE LYS 32 2HE LYS 32 13.319 2.612 -4.313
231 1HZ LYS 32 1HZ LYS 32 13.535 2.729 -1.566
232 2HZ LYS 32 2HZ LYS 32 14.896 1.966 -2.031
233 3HZ LYS 32 3HZ LYS 32 14.514 3.426 -2.686
234 H SER 33 H SER 33 9.597 2.127 -2.289
235 HA SER 33 HA SER 33 11.076 1.840 0.059
236 1HB SER 33 1HB SER 33 11.306 3.844 -1.233
237 2HB SER 33 2HB SER 33 9.566 4.180 -1.168
238 HG SER 33 HG SER 33 9.934 4.314 1.257
239 H CYS 34 H CYS 34 8.279 4.011 0.249
240 HA CYS 34 HA CYS 34 7.034 4.245 2.146
241 1HB CYS 34 1HB CYS 34 5.021 2.879 1.905
242 2HB CYS 34 2HB CYS 34 5.559 3.577 0.375
243 H ASP 35 H ASP 35 5.654 1.348 2.818
244 HA ASP 35 HA ASP 35 6.751 -0.524 3.869
245 1HB ASP 35 1HB ASP 35 8.877 0.560 4.353
246 2HB ASP 35 2HB ASP 35 8.090 1.747 5.404
247 HD2 ASP 35 HD ASP 35 9.292 -1.743 6.771
248 H CYS 36 H CYS 36 4.200 0.571 3.878
249 HA CYS 36 HA CYS 36 3.540 0.480 6.716
250 1HB CYS 36 1HB CYS 36 3.215 2.769 4.970
251 2HB CYS 36 2HB CYS 36 1.661 2.224 5.606
252 HA PRO 37 HA PRO 37 0.431 -2.166 5.198
253 1HB PRO 37 1HB PRO 37 -1.577 -1.874 7.027
254 2HB PRO 37 2HB PRO 37 -0.150 -2.870 7.311
255 1HG PRO 37 1HG PRO 37 -0.829 -0.189 8.341
256 2HG PRO 37 2HG PRO 37 0.355 -1.377 8.996
257 1HD PRO 37 1HD PRO 37 0.867 1.021 7.515
258 2HD PRO 37 2HD PRO 37 2.057 -0.195 7.997
259 H LEU 38 H LEU 38 -1.306 -2.414 3.809
260 HA LEU 38 HA LEU 38 -2.731 0.114 3.366
261 1HB LEU 38 1HB LEU 38 -1.804 -1.800 1.234
262 2HB LEU 38 2HB LEU 38 -2.660 -0.267 0.991
263 HG LEU 38 HG LEU 38 -0.383 0.443 2.429
264 1HD1 LEU 38 1HD1 LEU 38 0.132 -2.031 0.965
265 2HD1 LEU 38 2HD1 LEU 38 1.206 -0.699 0.476
266 3HD1 LEU 38 3HD1 LEU 38 1.117 -1.188 2.184
267 1HD2 LEU 38 1HD2 LEU 38 -1.675 1.265 0.193
268 2HD2 LEU 38 2HD2 LEU 38 -0.094 1.884 0.727
269 3HD2 LEU 38 3HD2 LEU 38 -0.179 0.610 -0.513
270 H TYR 39 H TYR 39 -3.763 -1.638 5.172
271 HA TYR 39 HA TYR 39 -6.275 -2.144 4.291
272 1HB TYR 39 1HB TYR 39 -4.396 -3.901 3.087
273 2HB TYR 39 2HB TYR 39 -5.062 -4.864 4.410
274 HD1 TYR 39 1HD TYR 39 -7.576 -5.226 4.499
275 HD2 TYR 39 2HD TYR 39 -5.607 -3.553 1.089
276 HE1 TYR 39 1HE TYR 39 -9.596 -5.775 3.054
277 HE2 TYR 39 2HE TYR 39 -7.633 -4.107 -0.343
278 HH TYR 39 HH TYR 39 -10.055 -4.446 0.021
279 HA PRO 40 HA PRO 40 -6.378 -3.033 8.533
280 1HB PRO 40 1HB PRO 40 -9.050 -3.524 8.816
281 2HB PRO 40 2HB PRO 40 -8.366 -1.900 8.788
282 1HG PRO 40 1HG PRO 40 -9.823 -3.380 6.694
283 2HG PRO 40 2HG PRO 40 -9.563 -1.605 6.839
284 1HD PRO 40 1HD PRO 40 -8.273 -3.457 5.078
285 2HD PRO 40 2HD PRO 40 -7.868 -1.749 5.294
286 H GLY 41 H GLY 41 -6.618 -4.680 10.154
287 1HA GLY 41 1HA GLY 41 -5.952 -7.216 9.110
288 2HA GLY 41 2HA GLY 41 -6.333 -6.824 10.774
Start of MODEL 14
1 H CYS 1 H CYS 1 -2.946 -3.410 5.813
2 HA CYS 1 HA CYS 1 -1.067 -3.539 4.557
3 1HB CYS 1 1HB CYS 1 -0.219 -5.184 6.516
4 2HB CYS 1 2HB CYS 1 -0.366 -6.344 5.192
5 H THR 2 H THR 2 -0.394 -6.250 3.280
6 HA THR 2 HA THR 2 -2.850 -7.285 2.266
7 HB THR 2 HB THR 2 -1.351 -5.117 0.797
8 HG1 THR 2 1HG THR 2 -3.547 -4.581 0.477
9 1HG2 THR 2 1HG2 THR 2 -3.004 -7.215 -0.674
10 2HG2 THR 2 2HG2 THR 2 -2.000 -5.921 -1.369
11 3HG2 THR 2 3HG2 THR 2 -1.230 -7.328 -0.598
12 H THR 3 H THR 3 0.609 -7.126 2.608
13 HA THR 3 HA THR 3 0.757 -9.929 1.919
14 HB THR 3 HB THR 3 2.574 -7.949 0.469
15 HG1 THR 3 1HG THR 3 0.005 -9.210 -0.165
16 1HG2 THR 3 1HG2 THR 3 1.975 -10.909 0.355
17 2HG2 THR 3 2HG2 THR 3 2.316 -10.067 -1.176
18 3HG2 THR 3 3HG2 THR 3 3.527 -10.068 0.129
19 H GLY 4 H GLY 4 3.356 -7.447 2.039
20 1HA GLY 4 1HA GLY 4 4.002 -8.269 4.772
21 2HA GLY 4 2HA GLY 4 5.182 -8.610 3.520
22 HA PRO 5 HA PRO 5 6.571 -4.519 3.910
23 1HB PRO 5 1HB PRO 5 7.926 -4.199 1.560
24 2HB PRO 5 2HB PRO 5 8.601 -5.037 2.954
25 1HG PRO 5 1HG PRO 5 7.485 -6.118 0.448
26 2HG PRO 5 2HG PRO 5 8.586 -6.920 1.624
27 1HD PRO 5 1HD PRO 5 5.779 -7.342 1.241
28 2HD PRO 5 2HD PRO 5 6.786 -8.038 2.519
29 H CYS 6 H CYS 6 4.458 -5.414 1.409
30 HA CYS 6 HA CYS 6 2.810 -4.282 0.481
31 1HB CYS 6 1HB CYS 6 1.905 -2.454 1.432
32 2HB CYS 6 2HB CYS 6 2.948 -2.961 2.763
33 H CYS 7 H CYS 7 5.724 -2.131 0.885
34 HA CYS 7 HA CYS 7 5.500 -0.806 -1.507
35 1HB CYS 7 1HB CYS 7 7.361 -1.000 0.598
36 2HB CYS 7 2HB CYS 7 8.271 -1.277 -0.891
37 H ARG 8 H ARG 8 4.652 -2.655 -2.881
38 HA ARG 8 HA ARG 8 5.643 -3.430 -4.910
39 1HB ARG 8 1HB ARG 8 7.950 -3.610 -4.169
40 2HB ARG 8 2HB ARG 8 7.529 -4.830 -2.955
41 1HG ARG 8 1HG ARG 8 8.540 -5.930 -4.876
42 2HG ARG 8 2HG ARG 8 6.820 -6.365 -4.826
43 1HD ARG 8 1HD ARG 8 7.631 -3.948 -6.421
44 2HD ARG 8 2HD ARG 8 8.019 -5.539 -7.092
45 HE ARG 8 HE ARG 8 5.261 -5.329 -6.148
46 1HH1 ARG 8 2HH2 ARG 8 7.406 -4.694 -8.896
47 2HH1 ARG 8 1HH2 ARG 8 6.127 -4.733 -10.063
48 1HH2 ARG 8 2HH1 ARG 8 3.602 -5.378 -7.667
49 2HH2 ARG 8 1HH1 ARG 8 3.947 -5.123 -9.364
50 H GLN 9 H GLN 9 4.457 -4.616 -1.890
51 HA GLN 9 HA GLN 9 3.141 -6.778 -3.318
52 1HB GLN 9 1HB GLN 9 4.424 -6.967 -0.566
53 2HB GLN 9 2HB GLN 9 3.361 -8.208 -1.251
54 1HG GLN 9 1HG GLN 9 5.774 -7.250 -2.800
55 2HG GLN 9 2HG GLN 9 5.986 -8.429 -1.498
56 1HE2 GLN 9 1HE2 GLN 9 6.720 -9.877 -3.123
57 2HE2 GLN 9 2HE2 GLN 9 5.609 -10.759 -4.117
58 H CYS 10 H CYS 10 2.966 -6.132 0.196
59 HA CYS 10 HA CYS 10 0.295 -6.110 0.405
60 1HB CYS 10 1HB CYS 10 1.278 -6.087 2.433
61 2HB CYS 10 2HB CYS 10 2.494 -4.891 1.975
62 H LYS 11 H LYS 11 2.362 -3.725 -1.112
63 HA LYS 11 HA LYS 11 0.198 -1.760 -1.121
64 1HB LYS 11 1HB LYS 11 2.618 -1.228 -0.437
65 2HB LYS 11 2HB LYS 11 2.993 -1.318 -2.168
66 1HG LYS 11 1HG LYS 11 0.677 0.246 -2.064
67 2HG LYS 11 2HG LYS 11 1.591 0.779 -0.641
68 1HD LYS 11 1HD LYS 11 2.991 1.951 -1.959
69 2HD LYS 11 2HD LYS 11 3.408 0.492 -2.876
70 1HE LYS 11 1HE LYS 11 2.400 2.449 -4.202
71 2HE LYS 11 2HE LYS 11 1.641 0.868 -4.454
72 1HZ LYS 11 1HZ LYS 11 0.575 2.662 -2.380
73 2HZ LYS 11 2HZ LYS 11 0.178 2.943 -3.934
74 3HZ LYS 11 3HZ LYS 11 -0.167 1.484 -3.256
75 H LEU 12 H LEU 12 -0.381 -4.088 -2.535
76 HA LEU 12 HA LEU 12 0.456 -4.128 -5.172
77 1HB LEU 12 1HB LEU 12 -1.134 -5.708 -5.497
78 2HB LEU 12 2HB LEU 12 -0.921 -5.794 -3.739
79 HG LEU 12 HG LEU 12 -2.963 -3.993 -3.948
80 1HD1 LEU 12 1HD1 LEU 12 -4.495 -5.476 -5.605
81 2HD1 LEU 12 2HD1 LEU 12 -3.638 -3.996 -6.098
82 3HD1 LEU 12 3HD1 LEU 12 -2.926 -5.592 -6.439
83 1HD2 LEU 12 1HD2 LEU 12 -2.595 -6.729 -3.137
84 2HD2 LEU 12 2HD2 LEU 12 -3.706 -5.495 -2.496
85 3HD2 LEU 12 3HD2 LEU 12 -4.208 -6.522 -3.860
86 H LYS 13 H LYS 13 -1.639 -1.904 -3.460
87 HA LYS 13 HA LYS 13 -3.092 -1.011 -5.715
88 1HB LYS 13 1HB LYS 13 -3.789 0.804 -4.269
89 2HB LYS 13 2HB LYS 13 -3.882 -0.741 -3.408
90 1HG LYS 13 1HG LYS 13 -1.379 0.934 -3.224
91 2HG LYS 13 2HG LYS 13 -2.789 1.380 -2.248
92 1HD LYS 13 1HD LYS 13 -1.039 -1.064 -2.109
93 2HD LYS 13 2HD LYS 13 -1.655 -0.058 -0.789
94 1HE LYS 13 1HE LYS 13 -3.155 -2.132 -2.432
95 2HE LYS 13 2HE LYS 13 -2.843 -2.160 -0.690
96 1HZ LYS 13 1HZ LYS 13 -5.039 -1.391 -0.902
97 2HZ LYS 13 2HZ LYS 13 -4.213 -0.004 -0.683
98 3HZ LYS 13 3HZ LYS 13 -4.670 -0.451 -2.200
99 HA PRO 14 HA PRO 14 -0.302 1.757 -7.500
100 1HB PRO 14 1HB PRO 14 -1.855 3.871 -8.261
101 2HB PRO 14 2HB PRO 14 -1.778 2.357 -9.162
102 1HG PRO 14 1HG PRO 14 -3.869 3.382 -7.350
103 2HG PRO 14 2HG PRO 14 -4.003 2.105 -8.611
104 1HD PRO 14 1HD PRO 14 -3.867 1.793 -5.767
105 2HD PRO 14 2HD PRO 14 -3.839 0.499 -6.973
106 H ALA 15 H ALA 15 1.172 3.436 -7.231
107 HA ALA 15 HA ALA 15 1.993 4.230 -4.966
108 1HB ALA 15 1HB ALA 15 2.832 5.221 -7.015
109 2HB ALA 15 2HB ALA 15 1.333 6.159 -7.227
110 3HB ALA 15 3HB ALA 15 2.435 6.533 -5.879
111 H GLY 16 H GLY 16 0.929 4.465 -3.055
112 1HA GLY 16 1HA GLY 16 -1.596 5.950 -3.022
113 2HA GLY 16 2HA GLY 16 -0.955 4.915 -1.761
114 H THR 17 H THR 17 0.174 5.822 -0.061
115 HA THR 17 HA THR 17 1.543 8.326 -0.388
116 HB THR 17 HB THR 17 -0.850 8.234 1.513
117 HG1 THR 17 1HG THR 17 -0.516 9.457 -1.133
118 1HG2 THR 17 1HG2 THR 17 0.275 10.155 2.175
119 2HG2 THR 17 2HG2 THR 17 1.200 10.249 0.658
120 3HG2 THR 17 3HG2 THR 17 -0.480 10.832 0.712
121 H THR 18 H THR 18 2.094 9.087 2.099
122 HA THR 18 HA THR 18 3.504 6.761 3.118
123 HB THR 18 HB THR 18 3.695 9.758 3.264
124 HG1 THR 18 1HG THR 18 5.613 9.066 2.377
125 1HG2 THR 18 1HG2 THR 18 4.323 7.886 5.540
126 2HG2 THR 18 2HG2 THR 18 5.569 9.081 5.105
127 3HG2 THR 18 3HG2 THR 18 3.942 9.625 5.584
128 H CYS 19 H CYS 19 2.467 5.413 4.450
129 HA CYS 19 HA CYS 19 0.782 4.783 5.820
130 1HB CYS 19 1HB CYS 19 2.748 6.432 7.359
131 2HB CYS 19 2HB CYS 19 1.366 5.719 8.194
132 H TRP 20 H TRP 20 -0.932 6.037 4.593
133 HA TRP 20 HA TRP 20 -1.936 8.239 6.263
134 1HB TRP 20 1HB TRP 20 -0.991 8.648 3.809
135 2HB TRP 20 2HB TRP 20 -2.625 8.142 3.373
136 HD1 TRP 20 HD TRP 20 -4.442 10.037 3.500
137 HE1 TRP 20 1HE TRP 20 -4.639 12.506 4.409
138 HE3 TRP 20 3HE TRP 20 0.055 10.080 5.876
139 HZ2 TRP 20 2HZ TRP 20 -2.931 14.162 5.986
140 HZ3 TRP 20 3HZ TRP 20 0.713 12.162 7.077
141 HH2 TRP 20 HH TRP 20 -0.697 14.157 7.156
142 H LYS 21 H LYS 21 -2.888 5.875 3.657
143 HA LYS 21 HA LYS 21 -4.486 4.326 3.649
144 1HB LYS 21 1HB LYS 21 -5.066 3.357 5.560
145 2HB LYS 21 2HB LYS 21 -4.037 4.558 6.360
146 1HG LYS 21 1HG LYS 21 -6.185 4.604 7.447
147 2HG LYS 21 2HG LYS 21 -6.079 6.080 6.473
148 1HD LYS 21 1HD LYS 21 -7.939 5.488 5.353
149 2HD LYS 21 2HD LYS 21 -7.182 3.971 4.837
150 1HE LYS 21 1HE LYS 21 -8.803 4.512 7.352
151 2HE LYS 21 2HE LYS 21 -9.180 3.370 6.052
152 1HZ LYS 21 1HZ LYS 21 -7.565 2.961 8.350
153 2HZ LYS 21 2HZ LYS 21 -8.077 1.856 7.268
154 3HZ LYS 21 3HZ LYS 21 -6.697 2.703 6.977
155 H THR 22 H THR 22 -6.104 4.716 2.246
156 HA THR 22 HA THR 22 -7.456 7.259 2.347
157 HB THR 22 HB THR 22 -8.466 6.344 0.210
158 HG1 THR 22 1HG THR 22 -6.628 4.160 0.436
159 1HG2 THR 22 1HG2 THR 22 -6.447 6.307 -1.092
160 2HG2 THR 22 2HG2 THR 22 -6.055 7.352 0.294
161 3HG2 THR 22 3HG2 THR 22 -5.494 5.663 0.266
162 H SER 23 H SER 23 -8.777 3.894 2.053
163 HA SER 23 HA SER 23 -10.327 4.121 4.341
164 1HB SER 23 1HB SER 23 -11.507 5.208 1.838
165 2HB SER 23 2HB SER 23 -12.554 4.101 2.744
166 HG SER 23 HG SER 23 -11.194 6.353 3.944
167 H LEU 24 H LEU 24 -9.976 2.859 0.991
168 HA LEU 24 HA LEU 24 -10.707 0.212 2.039
169 1HB LEU 24 1HB LEU 24 -11.897 -0.298 0.189
170 2HB LEU 24 2HB LEU 24 -12.267 1.428 0.348
171 HG LEU 24 HG LEU 24 -10.026 0.502 -1.431
172 1HD1 LEU 24 1HD1 LEU 24 -12.388 -0.669 -1.806
173 2HD1 LEU 24 2HD1 LEU 24 -12.725 0.866 -2.641
174 3HD1 LEU 24 3HD1 LEU 24 -11.355 -0.146 -3.158
175 1HD2 LEU 24 1HD2 LEU 24 -11.735 2.705 -2.306
176 2HD2 LEU 24 2HD2 LEU 24 -10.980 2.994 -0.719
177 3HD2 LEU 24 3HD2 LEU 24 -9.965 2.618 -2.132
178 H THR 25 H THR 25 -8.629 2.183 -0.131
179 HA THR 25 HA THR 25 -6.966 -0.102 -0.738
180 HB THR 25 HB THR 25 -7.082 2.846 -1.482
181 HG1 THR 25 1HG THR 25 -7.964 1.786 -3.215
182 1HG2 THR 25 1HG2 THR 25 -5.013 0.949 -2.634
183 2HG2 THR 25 2HG2 THR 25 -5.036 2.730 -2.660
184 3HG2 THR 25 3HG2 THR 25 -4.618 1.867 -1.161
185 H SER 26 H SER 26 -7.015 2.647 1.519
186 HA SER 26 HA SER 26 -5.727 3.192 3.177
187 1HB SER 26 1HB SER 26 -5.373 0.222 3.049
188 2HB SER 26 2HB SER 26 -4.273 1.118 4.115
189 HG SER 26 HG SER 26 -7.115 0.798 4.252
190 H HIS 27 H HIS 27 -4.532 4.498 1.472
191 HA HIS 27 HA HIS 27 -2.096 3.436 0.467
192 1HB HIS 27 1HB HIS 27 -1.737 5.744 -0.342
193 2HB HIS 27 2HB HIS 27 -3.294 5.061 -0.827
194 HD1 HIS 27 1HD HIS 27 -4.141 5.805 2.430
195 HD2 HIS 27 2HD HIS 27 -3.159 8.272 -0.817
196 HE1 HIS 27 1HE HIS 27 -5.144 8.094 2.943
197 HE2 HIS 27 2HE HIS 27 -4.511 9.578 0.911
198 H TYR 28 H TYR 28 -0.753 2.756 2.153
199 HA TYR 28 HA TYR 28 0.077 4.898 3.995
200 1HB TYR 28 1HB TYR 28 -0.926 2.187 4.304
201 2HB TYR 28 2HB TYR 28 0.768 2.175 4.803
202 HD1 TYR 28 1HD TYR 28 -2.133 4.531 5.241
203 HD2 TYR 28 2HD TYR 28 1.022 2.315 7.097
204 HE1 TYR 28 1HE TYR 28 -2.804 5.461 7.510
205 HE2 TYR 28 2HE TYR 28 0.341 3.252 9.359
206 HH TYR 28 HH TYR 28 -2.559 5.226 9.692
207 H CYS 29 H CYS 29 0.990 3.601 1.177
208 HA CYS 29 HA CYS 29 3.790 3.856 1.869
209 1HB CYS 29 1HB CYS 29 3.130 1.560 0.103
210 2HB CYS 29 2HB CYS 29 4.515 1.813 1.170
211 H THR 30 H THR 30 4.856 3.222 -0.658
212 HA THR 30 HA THR 30 3.242 4.751 -2.569
213 HB THR 30 HB THR 30 6.055 5.354 -1.559
214 HG1 THR 30 1HG THR 30 4.427 6.604 -0.584
215 1HG2 THR 30 1HG2 THR 30 6.291 5.479 -3.988
216 2HG2 THR 30 2HG2 THR 30 4.687 6.236 -4.150
217 3HG2 THR 30 3HG2 THR 30 6.026 7.139 -3.400
218 H GLY 31 H GLY 31 5.223 2.070 -1.747
219 1HA GLY 31 1HA GLY 31 5.321 0.196 -3.143
220 2HA GLY 31 2HA GLY 31 5.167 1.221 -4.556
221 H LYS 32 H LYS 32 7.331 -0.611 -2.728
222 HA LYS 32 HA LYS 32 9.500 -0.989 -3.061
223 1HB LYS 32 1HB LYS 32 10.503 -0.321 -4.941
224 2HB LYS 32 2HB LYS 32 8.914 0.341 -5.362
225 1HG LYS 32 1HG LYS 32 10.527 2.084 -5.722
226 2HG LYS 32 2HG LYS 32 9.650 2.516 -4.242
227 1HD LYS 32 1HD LYS 32 11.692 2.733 -3.295
228 2HD LYS 32 2HD LYS 32 11.760 0.961 -3.288
229 1HE LYS 32 1HE LYS 32 12.564 1.447 -5.840
230 2HE LYS 32 2HE LYS 32 13.139 2.934 -5.072
231 1HZ LYS 32 1HZ LYS 32 13.747 0.563 -3.560
232 2HZ LYS 32 2HZ LYS 32 14.436 0.544 -5.034
233 3HZ LYS 32 3HZ LYS 32 14.704 1.817 -4.026
234 H SER 33 H SER 33 10.373 -0.756 -1.065
235 HA SER 33 HA SER 33 11.623 0.189 0.470
236 1HB SER 33 1HB SER 33 12.082 1.953 -1.539
237 2HB SER 33 2HB SER 33 11.268 3.031 -0.391
238 HG SER 33 HG SER 33 12.866 2.154 1.228
239 H CYS 34 H CYS 34 9.118 -0.478 1.109
240 HA CYS 34 HA CYS 34 8.341 1.644 2.912
241 1HB CYS 34 1HB CYS 34 6.187 0.355 1.270
242 2HB CYS 34 2HB CYS 34 6.104 1.806 2.273
243 H ASP 35 H ASP 35 6.355 0.610 4.308
244 HA ASP 35 HA ASP 35 6.330 -2.194 4.429
245 1HB ASP 35 1HB ASP 35 8.581 -1.547 5.500
246 2HB ASP 35 2HB ASP 35 7.641 -0.808 6.805
247 HD2 ASP 35 HD ASP 35 7.641 -2.462 8.574
248 H CYS 36 H CYS 36 4.341 -0.207 4.179
249 HA CYS 36 HA CYS 36 3.161 -0.158 6.862
250 1HB CYS 36 1HB CYS 36 3.218 1.866 4.681
251 2HB CYS 36 2HB CYS 36 1.762 1.759 5.673
252 HA PRO 37 HA PRO 37 -0.008 -2.539 5.052
253 1HB PRO 37 1HB PRO 37 -2.065 -2.082 6.791
254 2HB PRO 37 2HB PRO 37 -0.771 -3.234 7.111
255 1HG PRO 37 1HG PRO 37 -1.212 -0.524 8.194
256 2HG PRO 37 2HG PRO 37 -0.197 -1.851 8.867
257 1HD PRO 37 1HD PRO 37 0.648 0.515 7.493
258 2HD PRO 37 2HD PRO 37 1.672 -0.837 7.992
259 H LEU 38 H LEU 38 -1.683 -2.557 3.569
260 HA LEU 38 HA LEU 38 -2.920 0.072 3.215
261 1HB LEU 38 1HB LEU 38 -1.827 -1.594 0.959
262 2HB LEU 38 2HB LEU 38 -2.572 0.011 0.851
263 HG LEU 38 HG LEU 38 -0.433 0.373 2.592
264 1HD1 LEU 38 1HD1 LEU 38 1.336 -0.585 0.734
265 2HD1 LEU 38 2HD1 LEU 38 0.949 -1.362 2.289
266 3HD1 LEU 38 3HD1 LEU 38 0.126 -1.889 0.802
267 1HD2 LEU 38 1HD2 LEU 38 0.396 1.835 0.967
268 2HD2 LEU 38 2HD2 LEU 38 -0.240 0.855 -0.376
269 3HD2 LEU 38 3HD2 LEU 38 -1.356 1.780 0.657
270 H TYR 39 H TYR 39 -4.445 -1.399 4.606
271 HA TYR 39 HA TYR 39 -6.283 -2.632 2.695
272 1HB TYR 39 1HB TYR 39 -4.577 -3.921 4.637
273 2HB TYR 39 2HB TYR 39 -6.210 -3.973 5.310
274 HD1 TYR 39 1HD TYR 39 -6.921 -6.186 5.083
275 HD2 TYR 39 2HD TYR 39 -5.045 -4.253 1.759
276 HE1 TYR 39 1HE TYR 39 -7.441 -8.194 3.612
277 HE2 TYR 39 2HE TYR 39 -5.572 -6.267 0.300
278 HH TYR 39 HH TYR 39 -7.537 -8.922 1.532
279 HA PRO 40 HA PRO 40 -9.283 -0.632 5.084
280 1HB PRO 40 1HB PRO 40 -11.457 -2.270 4.865
281 2HB PRO 40 2HB PRO 40 -10.963 -1.150 3.597
282 1HG PRO 40 1HG PRO 40 -10.631 -4.075 3.778
283 2HG PRO 40 2HG PRO 40 -10.569 -3.027 2.315
284 1HD PRO 40 1HD PRO 40 -8.394 -4.246 3.722
285 2HD PRO 40 2HD PRO 40 -8.272 -3.095 2.387
286 H GLY 41 H GLY 41 -9.551 -4.080 5.831
287 1HA GLY 41 1HA GLY 41 -8.936 -4.913 7.952
288 2HA GLY 41 2HA GLY 41 -9.275 -3.351 8.670
Start of MODEL 15
1 H CYS 1 H CYS 1 -1.260 -3.589 6.307
2 HA CYS 1 HA CYS 1 -0.417 -3.849 4.259
3 1HB CYS 1 1HB CYS 1 1.816 -3.544 4.635
4 2HB CYS 1 2HB CYS 1 1.941 -4.896 5.765
5 H THR 2 H THR 2 -1.004 -5.461 2.727
6 HA THR 2 HA THR 2 -2.352 -7.726 3.794
7 HB THR 2 HB THR 2 -1.619 -7.148 0.885
8 HG1 THR 2 1HG THR 2 -2.598 -5.234 1.537
9 1HG2 THR 2 1HG2 THR 2 -2.909 -9.261 1.363
10 2HG2 THR 2 2HG2 THR 2 -4.127 -8.289 2.226
11 3HG2 THR 2 3HG2 THR 2 -3.889 -8.067 0.476
12 H THR 3 H THR 3 0.363 -7.598 1.389
13 HA THR 3 HA THR 3 1.016 -10.321 1.923
14 HB THR 3 HB THR 3 2.581 -8.136 0.454
15 HG1 THR 3 1HG THR 3 0.457 -10.039 -0.235
16 1HG2 THR 3 1HG2 THR 3 3.494 -9.975 -0.850
17 2HG2 THR 3 2HG2 THR 3 3.731 -10.404 0.860
18 3HG2 THR 3 3HG2 THR 3 2.404 -11.145 -0.067
19 H GLY 4 H GLY 4 3.647 -7.963 1.898
20 1HA GLY 4 1HA GLY 4 4.225 -8.682 4.708
21 2HA GLY 4 2HA GLY 4 5.446 -8.720 3.453
22 HA PRO 5 HA PRO 5 6.157 -4.532 4.378
23 1HB PRO 5 1HB PRO 5 7.846 -3.903 2.325
24 2HB PRO 5 2HB PRO 5 8.379 -4.712 3.797
25 1HG PRO 5 1HG PRO 5 7.894 -5.805 1.100
26 2HG PRO 5 2HG PRO 5 8.875 -6.507 2.435
27 1HD PRO 5 1HD PRO 5 6.273 -7.293 1.535
28 2HD PRO 5 2HD PRO 5 7.128 -7.909 2.955
29 H CYS 6 H CYS 6 4.237 -5.602 1.984
30 HA CYS 6 HA CYS 6 2.644 -4.630 0.827
31 1HB CYS 6 1HB CYS 6 1.729 -2.583 1.416
32 2HB CYS 6 2HB CYS 6 2.409 -3.214 2.919
33 H CYS 7 H CYS 7 5.426 -2.296 1.147
34 HA CYS 7 HA CYS 7 5.248 -1.253 -1.394
35 1HB CYS 7 1HB CYS 7 7.292 -1.389 0.725
36 2HB CYS 7 2HB CYS 7 7.913 -1.100 -0.902
37 H ARG 8 H ARG 8 4.947 -2.748 -3.081
38 HA ARG 8 HA ARG 8 6.068 -3.802 -4.760
39 1HB ARG 8 1HB ARG 8 8.258 -3.747 -3.489
40 2HB ARG 8 2HB ARG 8 7.755 -5.215 -2.635
41 1HG ARG 8 1HG ARG 8 9.172 -5.869 -4.479
42 2HG ARG 8 2HG ARG 8 7.516 -6.346 -4.894
43 1HD ARG 8 1HD ARG 8 7.913 -5.257 -6.851
44 2HD ARG 8 2HD ARG 8 7.649 -3.774 -5.921
45 HE ARG 8 HE ARG 8 10.316 -4.305 -5.489
46 1HH1 ARG 8 2HH2 ARG 8 8.373 -4.063 -8.442
47 2HH1 ARG 8 1HH2 ARG 8 9.696 -3.519 -9.416
48 1HH2 ARG 8 2HH1 ARG 8 12.034 -3.598 -6.759
49 2HH2 ARG 8 1HH1 ARG 8 11.794 -3.252 -8.459
50 H GLN 9 H GLN 9 4.101 -4.544 -2.281
51 HA GLN 9 HA GLN 9 3.339 -7.027 -3.499
52 1HB GLN 9 1HB GLN 9 3.938 -6.851 -0.521
53 2HB GLN 9 2HB GLN 9 3.231 -8.254 -1.344
54 1HG GLN 9 1HG GLN 9 5.290 -8.410 -2.756
55 2HG GLN 9 2HG GLN 9 5.996 -7.060 -1.854
56 1HE2 GLN 9 1HE2 GLN 9 7.210 -9.527 -2.041
57 2HE2 GLN 9 2HE2 GLN 9 7.227 -10.313 -0.497
58 H CYS 10 H CYS 10 2.550 -5.644 -0.251
59 HA CYS 10 HA CYS 10 -0.210 -5.741 -0.817
60 1HB CYS 10 1HB CYS 10 0.626 -3.999 1.386
61 2HB CYS 10 2HB CYS 10 -0.492 -5.367 1.371
62 H LYS 11 H LYS 11 2.378 -3.501 -1.473
63 HA LYS 11 HA LYS 11 0.643 -1.198 -1.613
64 1HB LYS 11 1HB LYS 11 2.520 -0.006 -1.527
65 2HB LYS 11 2HB LYS 11 3.310 -1.529 -1.079
66 1HG LYS 11 1HG LYS 11 4.642 -0.999 -2.866
67 2HG LYS 11 2HG LYS 11 3.346 -1.783 -3.786
68 1HD LYS 11 1HD LYS 11 2.296 0.661 -3.742
69 2HD LYS 11 2HD LYS 11 3.976 1.155 -3.469
70 1HE LYS 11 1HE LYS 11 4.685 0.088 -5.529
71 2HE LYS 11 2HE LYS 11 3.099 -0.666 -5.757
72 1HZ LYS 11 1HZ LYS 11 3.605 2.263 -5.770
73 2HZ LYS 11 2HZ LYS 11 3.374 1.357 -7.104
74 3HZ LYS 11 3HZ LYS 11 2.163 1.506 -6.003
75 H LEU 12 H LEU 12 0.078 -3.653 -3.253
76 HA LEU 12 HA LEU 12 0.810 -2.998 -5.926
77 1HB LEU 12 1HB LEU 12 -0.398 -4.885 -6.548
78 2HB LEU 12 2HB LEU 12 0.363 -5.288 -5.001
79 HG LEU 12 HG LEU 12 -2.311 -4.223 -4.621
80 1HD1 LEU 12 1HD1 LEU 12 -2.482 -6.872 -5.958
81 2HD1 LEU 12 2HD1 LEU 12 -3.654 -5.533 -5.890
82 3HD1 LEU 12 3HD1 LEU 12 -2.269 -5.448 -7.004
83 1HD2 LEU 12 1HD2 LEU 12 -0.995 -6.869 -3.953
84 2HD2 LEU 12 2HD2 LEU 12 -1.131 -5.438 -2.904
85 3HD2 LEU 12 3HD2 LEU 12 -2.591 -6.343 -3.368
86 H LYS 13 H LYS 13 -1.009 -1.280 -3.842
87 HA LYS 13 HA LYS 13 -3.394 -0.902 -5.327
88 1HB LYS 13 1HB LYS 13 -2.403 1.215 -3.499
89 2HB LYS 13 2HB LYS 13 -4.010 0.480 -3.626
90 1HG LYS 13 1HG LYS 13 -3.490 -0.759 -1.817
91 2HG LYS 13 2HG LYS 13 -2.295 -1.618 -2.805
92 1HD LYS 13 1HD LYS 13 -1.929 0.595 -0.813
93 2HD LYS 13 2HD LYS 13 -0.922 -0.836 -1.095
94 1HE LYS 13 1HE LYS 13 0.488 0.638 -2.105
95 2HE LYS 13 2HE LYS 13 -0.622 0.521 -3.479
96 1HZ LYS 13 1HZ LYS 13 -0.812 2.741 -3.168
97 2HZ LYS 13 2HZ LYS 13 -1.786 2.396 -1.910
98 3HZ LYS 13 3HZ LYS 13 -0.185 2.663 -1.650
99 HA PRO 14 HA PRO 14 -2.253 2.367 -7.962
100 1HB PRO 14 1HB PRO 14 -3.656 4.620 -7.314
101 2HB PRO 14 2HB PRO 14 -4.358 3.267 -8.197
102 1HG PRO 14 1HG PRO 14 -4.667 4.053 -5.371
103 2HG PRO 14 2HG PRO 14 -5.734 2.995 -6.364
104 1HD PRO 14 1HD PRO 14 -3.858 2.231 -4.339
105 2HD PRO 14 2HD PRO 14 -4.765 1.145 -5.401
106 H ALA 15 H ALA 15 -1.038 2.362 -5.043
107 HA ALA 15 HA ALA 15 0.800 3.282 -4.205
108 1HB ALA 15 1HB ALA 15 1.438 3.384 -6.719
109 2HB ALA 15 2HB ALA 15 1.038 5.116 -6.603
110 3HB ALA 15 3HB ALA 15 2.329 4.431 -5.587
111 H GLY 16 H GLY 16 0.707 4.645 -2.489
112 1HA GLY 16 1HA GLY 16 -0.583 7.265 -2.877
113 2HA GLY 16 2HA GLY 16 -1.132 6.198 -1.599
114 H THR 17 H THR 17 -0.488 7.745 0.035
115 HA THR 17 HA THR 17 2.277 8.531 0.180
116 HB THR 17 HB THR 17 0.334 8.848 2.464
117 HG1 THR 17 1HG THR 17 0.227 10.009 -0.232
118 1HG2 THR 17 1HG2 THR 17 1.218 11.339 1.496
119 2HG2 THR 17 2HG2 THR 17 1.911 10.461 2.879
120 3HG2 THR 17 3HG2 THR 17 2.624 10.273 1.259
121 H THR 18 H THR 18 3.795 7.965 1.800
122 HA THR 18 HA THR 18 4.091 5.295 2.268
123 HB THR 18 HB THR 18 5.637 7.448 2.613
124 HG1 THR 18 1HG THR 18 5.543 5.021 4.260
125 1HG2 THR 18 1HG2 THR 18 6.058 7.802 5.055
126 2HG2 THR 18 2HG2 THR 18 4.425 8.346 4.605
127 3HG2 THR 18 3HG2 THR 18 4.646 6.789 5.437
128 H CYS 19 H CYS 19 1.884 7.495 3.850
129 HA CYS 19 HA CYS 19 0.748 5.301 5.252
130 1HB CYS 19 1HB CYS 19 2.359 7.333 6.744
131 2HB CYS 19 2HB CYS 19 0.907 6.656 7.488
132 H TRP 20 H TRP 20 -0.667 6.370 3.436
133 HA TRP 20 HA TRP 20 -1.900 8.851 4.343
134 1HB TRP 20 1HB TRP 20 -1.185 7.908 1.857
135 2HB TRP 20 2HB TRP 20 -2.928 7.631 1.895
136 HD1 TRP 20 HD TRP 20 -3.907 9.647 0.535
137 HE1 TRP 20 1HE TRP 20 -3.749 12.281 0.533
138 HE3 TRP 20 3HE TRP 20 -0.231 9.952 4.034
139 HZ2 TRP 20 2HZ TRP 20 -2.139 14.155 1.963
140 HZ3 TRP 20 3HZ TRP 20 0.577 12.222 4.674
141 HH2 TRP 20 HH TRP 20 -0.315 14.277 3.700
142 H LYS 21 H LYS 21 -3.184 5.813 2.817
143 HA LYS 21 HA LYS 21 -4.832 4.458 3.397
144 1HB LYS 21 1HB LYS 21 -4.253 3.844 5.467
145 2HB LYS 21 2HB LYS 21 -3.979 5.506 6.020
146 1HG LYS 21 1HG LYS 21 -5.862 4.624 7.245
147 2HG LYS 21 2HG LYS 21 -6.505 5.798 6.084
148 1HD LYS 21 1HD LYS 21 -7.273 4.060 4.623
149 2HD LYS 21 2HD LYS 21 -6.354 2.815 5.487
150 1HE LYS 21 1HE LYS 21 -8.328 4.384 7.095
151 2HE LYS 21 2HE LYS 21 -9.010 3.275 5.895
152 1HZ LYS 21 1HZ LYS 21 -8.697 1.787 7.568
153 2HZ LYS 21 2HZ LYS 21 -7.148 1.738 7.066
154 3HZ LYS 21 3HZ LYS 21 -7.571 2.724 8.313
155 H THR 22 H THR 22 -6.773 4.747 2.455
156 HA THR 22 HA THR 22 -8.112 7.320 2.918
157 HB THR 22 HB THR 22 -9.158 6.886 0.747
158 HG1 THR 22 1HG THR 22 -7.673 4.376 0.784
159 1HG2 THR 22 1HG2 THR 22 -6.674 7.548 0.678
160 2HG2 THR 22 2HG2 THR 22 -6.303 5.814 0.518
161 3HG2 THR 22 3HG2 THR 22 -7.246 6.642 -0.744
162 H SER 23 H SER 23 -10.574 5.845 1.709
163 HA SER 23 HA SER 23 -11.399 4.774 4.293
164 1HB SER 23 1HB SER 23 -12.571 6.742 2.522
165 2HB SER 23 2HB SER 23 -13.696 5.388 2.722
166 HG SER 23 HG SER 23 -13.134 7.411 4.450
167 H LEU 24 H LEU 24 -10.188 3.650 1.548
168 HA LEU 24 HA LEU 24 -12.129 1.453 1.384
169 1HB LEU 24 1HB LEU 24 -11.559 1.258 -1.001
170 2HB LEU 24 2HB LEU 24 -12.438 2.740 -0.584
171 HG LEU 24 HG LEU 24 -9.546 3.118 -0.553
172 1HD1 LEU 24 1HD1 LEU 24 -9.499 1.381 -2.233
173 2HD1 LEU 24 2HD1 LEU 24 -10.808 2.177 -3.142
174 3HD1 LEU 24 3HD1 LEU 24 -9.216 2.964 -2.999
175 1HD2 LEU 24 1HD2 LEU 24 -11.994 4.488 -1.436
176 2HD2 LEU 24 2HD2 LEU 24 -10.495 5.138 -0.728
177 3HD2 LEU 24 3HD2 LEU 24 -10.574 4.780 -2.469
178 H THR 25 H THR 25 -8.736 2.611 1.132
179 HA THR 25 HA THR 25 -7.860 0.052 2.172
180 HB THR 25 HB THR 25 -7.539 0.935 -0.667
181 HG1 THR 25 1HG THR 25 -7.100 -1.539 0.851
182 1HG2 THR 25 1HG2 THR 25 -5.202 1.220 -0.118
183 2HG2 THR 25 2HG2 THR 25 -5.239 -0.138 1.034
184 3HG2 THR 25 3HG2 THR 25 -5.344 -0.452 -0.715
185 H SER 26 H SER 26 -5.624 0.103 2.940
186 HA SER 26 HA SER 26 -5.087 2.730 3.950
187 1HB SER 26 1HB SER 26 -4.593 0.002 4.764
188 2HB SER 26 2HB SER 26 -3.061 0.894 4.772
189 HG SER 26 HG SER 26 -3.839 1.398 6.748
190 H HIS 27 H HIS 27 -4.515 3.617 1.755
191 HA HIS 27 HA HIS 27 -2.589 2.700 0.106
192 1HB HIS 27 1HB HIS 27 -3.102 5.574 0.897
193 2HB HIS 27 2HB HIS 27 -2.238 5.053 -0.554
194 HD1 HIS 27 1HD HIS 27 -4.086 6.305 -1.984
195 HD2 HIS 27 2HD HIS 27 -5.482 3.069 0.291
196 HE1 HIS 27 1HE HIS 27 -6.408 5.748 -2.883
197 HE2 HIS 27 2HE HIS 27 -7.225 3.750 -1.445
198 H TYR 28 H TYR 28 -2.211 3.649 3.409
199 HA TYR 28 HA TYR 28 0.105 4.801 3.800
200 1HB TYR 28 1HB TYR 28 -1.358 2.436 4.879
201 2HB TYR 28 2HB TYR 28 0.356 2.413 5.303
202 HD1 TYR 28 1HD TYR 28 -2.277 5.093 5.099
203 HD2 TYR 28 2HD TYR 28 0.707 3.146 7.470
204 HE1 TYR 28 1HE TYR 28 -2.738 6.700 7.015
205 HE2 TYR 28 2HE TYR 28 0.236 4.760 9.376
206 HH TYR 28 HH TYR 28 -1.612 7.581 8.934
207 H CYS 29 H CYS 29 1.530 4.700 1.970
208 HA CYS 29 HA CYS 29 3.707 3.227 2.152
209 1HB CYS 29 1HB CYS 29 1.593 1.456 1.351
210 2HB CYS 29 2HB CYS 29 2.801 1.557 0.066
211 H THR 30 H THR 30 4.521 2.674 -0.450
212 HA THR 30 HA THR 30 3.479 4.737 -2.200
213 HB THR 30 HB THR 30 5.026 6.160 -1.121
214 HG1 THR 30 1HG THR 30 6.721 4.609 -2.934
215 1HG2 THR 30 1HG2 THR 30 6.390 3.604 -0.469
216 2HG2 THR 30 2HG2 THR 30 7.511 4.895 -0.965
217 3HG2 THR 30 3HG2 THR 30 6.414 5.151 0.414
218 H GLY 31 H GLY 31 6.342 2.544 -1.771
219 1HA GLY 31 1HA GLY 31 5.741 0.565 -3.472
220 2HA GLY 31 2HA GLY 31 6.204 1.840 -4.583
221 H LYS 32 H LYS 32 7.351 -0.761 -2.757
222 HA LYS 32 HA LYS 32 9.348 -1.354 -1.935
223 1HB LYS 32 1HB LYS 32 11.183 -0.934 -3.733
224 2HB LYS 32 2HB LYS 32 9.815 -2.001 -4.097
225 1HG LYS 32 1HG LYS 32 10.017 -0.586 -5.992
226 2HG LYS 32 2HG LYS 32 8.665 0.104 -5.077
227 1HD LYS 32 1HD LYS 32 9.801 2.059 -5.271
228 2HD LYS 32 2HD LYS 32 10.841 1.427 -3.983
229 1HE LYS 32 1HE LYS 32 12.542 0.841 -5.472
230 2HE LYS 32 2HE LYS 32 11.440 0.671 -6.846
231 1HZ LYS 32 1HZ LYS 32 11.153 3.230 -6.463
232 2HZ LYS 32 2HZ LYS 32 12.595 3.124 -5.711
233 3HZ LYS 32 3HZ LYS 32 12.452 2.632 -7.274
234 H SER 33 H SER 33 8.403 1.339 -1.078
235 HA SER 33 HA SER 33 10.897 2.161 0.001
236 1HB SER 33 1HB SER 33 10.484 3.334 -2.346
237 2HB SER 33 2HB SER 33 9.414 4.382 -1.399
238 HG SER 33 HG SER 33 11.734 4.108 -0.030
239 H CYS 34 H CYS 34 8.736 1.032 1.283
240 HA CYS 34 HA CYS 34 7.920 3.199 2.976
241 1HB CYS 34 1HB CYS 34 5.562 2.823 2.847
242 2HB CYS 34 2HB CYS 34 6.178 3.260 1.252
243 H ASP 35 H ASP 35 5.751 1.443 4.137
244 HA ASP 35 HA ASP 35 6.534 -1.089 4.636
245 1HB ASP 35 1HB ASP 35 8.468 0.561 5.722
246 2HB ASP 35 2HB ASP 35 7.399 0.316 7.110
247 HD2 ASP 35 HD ASP 35 9.183 -2.486 5.063
248 H CYS 36 H CYS 36 4.211 0.681 4.413
249 HA CYS 36 HA CYS 36 3.098 0.472 7.116
250 1HB CYS 36 1HB CYS 36 2.591 2.396 4.872
251 2HB CYS 36 2HB CYS 36 1.356 2.108 6.101
252 HA PRO 37 HA PRO 37 0.102 -2.247 5.484
253 1HB PRO 37 1HB PRO 37 -2.260 -1.486 6.627
254 2HB PRO 37 2HB PRO 37 -1.036 -2.424 7.479
255 1HG PRO 37 1HG PRO 37 -1.718 0.439 7.690
256 2HG PRO 37 2HG PRO 37 -0.834 -0.595 8.869
257 1HD PRO 37 1HD PRO 37 0.226 1.379 7.086
258 2HD PRO 37 2HD PRO 37 1.153 0.276 8.113
259 H LEU 38 H LEU 38 -1.607 -2.750 3.989
260 HA LEU 38 HA LEU 38 -2.706 -0.415 2.672
261 1HB LEU 38 1HB LEU 38 -0.942 -2.402 1.252
262 2HB LEU 38 2HB LEU 38 -1.947 -1.179 0.455
263 HG LEU 38 HG LEU 38 0.200 -0.450 2.447
264 1HD1 LEU 38 1HD1 LEU 38 1.874 -0.745 1.001
265 2HD1 LEU 38 2HD1 LEU 38 0.757 -1.818 0.123
266 3HD1 LEU 38 3HD1 LEU 38 0.928 -0.115 -0.368
267 1HD2 LEU 38 1HD2 LEU 38 -0.139 1.459 0.370
268 2HD2 LEU 38 2HD2 LEU 38 -1.756 1.010 0.964
269 3HD2 LEU 38 3HD2 LEU 38 -0.526 1.614 2.101
270 H TYR 39 H TYR 39 -4.126 -2.040 4.305
271 HA TYR 39 HA TYR 39 -5.796 -3.447 2.382
272 1HB TYR 39 1HB TYR 39 -5.602 -5.511 3.566
273 2HB TYR 39 2HB TYR 39 -3.951 -4.897 3.691
274 HD1 TYR 39 1HD TYR 39 -3.573 -3.309 5.837
275 HD2 TYR 39 2HD TYR 39 -6.599 -6.315 5.485
276 HE1 TYR 39 1HE TYR 39 -3.737 -3.454 8.370
277 HE2 TYR 39 2HE TYR 39 -6.752 -6.449 8.019
278 HH TYR 39 HH TYR 39 -6.225 -5.396 9.909
279 HA PRO 40 HA PRO 40 -8.902 -1.801 4.901
280 1HB PRO 40 1HB PRO 40 -11.003 -3.459 4.355
281 2HB PRO 40 2HB PRO 40 -10.508 -2.148 3.287
282 1HG PRO 40 1HG PRO 40 -10.069 -5.055 3.048
283 2HG PRO 40 2HG PRO 40 -9.997 -3.799 1.759
284 1HD PRO 40 1HD PRO 40 -7.826 -5.142 3.057
285 2HD PRO 40 2HD PRO 40 -7.704 -3.801 1.912
286 H GLY 41 H GLY 41 -10.723 -2.362 6.565
287 1HA GLY 41 1HA GLY 41 -9.500 -3.347 8.808
288 2HA GLY 41 2HA GLY 41 -11.232 -3.311 8.543
Start of MODEL 16
1 H CYS 1 H CYS 1 -2.587 -3.408 5.699
2 HA CYS 1 HA CYS 1 -0.742 -3.625 4.322
3 1HB CYS 1 1HB CYS 1 0.252 -5.130 6.362
4 2HB CYS 1 2HB CYS 1 0.004 -6.360 5.119
5 H THR 2 H THR 2 -0.488 -5.205 2.371
6 HA THR 2 HA THR 2 -2.995 -6.720 2.045
7 HB THR 2 HB THR 2 -1.437 -5.049 0.002
8 HG1 THR 2 1HG THR 2 -3.654 -3.911 0.269
9 1HG2 THR 2 1HG2 THR 2 -3.522 -5.357 -1.367
10 2HG2 THR 2 2HG2 THR 2 -2.689 -6.905 -1.087
11 3HG2 THR 2 3HG2 THR 2 -4.137 -6.491 -0.140
12 H THR 3 H THR 3 0.381 -6.873 2.321
13 HA THR 3 HA THR 3 0.337 -9.623 1.484
14 HB THR 3 HB THR 3 2.212 -7.680 0.046
15 HG1 THR 3 1HG THR 3 -0.184 -9.087 -0.882
16 1HG2 THR 3 1HG2 THR 3 1.560 -10.636 -0.112
17 2HG2 THR 3 2HG2 THR 3 1.965 -9.766 -1.612
18 3HG2 THR 3 3HG2 THR 3 3.139 -9.826 -0.274
19 H GLY 4 H GLY 4 3.353 -7.844 1.339
20 1HA GLY 4 1HA GLY 4 4.101 -9.074 3.903
21 2HA GLY 4 2HA GLY 4 5.185 -8.557 2.626
22 HA PRO 5 HA PRO 5 5.615 -4.997 5.140
23 1HB PRO 5 1HB PRO 5 7.665 -3.842 3.753
24 2HB PRO 5 2HB PRO 5 7.912 -5.063 5.000
25 1HG PRO 5 1HG PRO 5 8.028 -5.304 2.063
26 2HG PRO 5 2HG PRO 5 8.736 -6.395 3.308
27 1HD PRO 5 1HD PRO 5 6.401 -6.806 1.701
28 2HD PRO 5 2HD PRO 5 6.966 -7.835 3.023
29 H CYS 6 H CYS 6 4.937 -5.052 1.780
30 HA CYS 6 HA CYS 6 3.391 -3.797 0.751
31 1HB CYS 6 1HB CYS 6 2.058 -2.395 1.828
32 2HB CYS 6 2HB CYS 6 2.912 -2.918 3.283
33 H CYS 7 H CYS 7 4.454 -3.149 -1.093
34 HA CYS 7 HA CYS 7 5.312 -0.965 -1.934
35 1HB CYS 7 1HB CYS 7 7.141 -1.534 0.322
36 2HB CYS 7 2HB CYS 7 7.890 -0.900 -1.147
37 H ARG 8 H ARG 8 4.752 -3.370 -3.035
38 HA ARG 8 HA ARG 8 6.168 -3.796 -5.081
39 1HB ARG 8 1HB ARG 8 8.330 -3.884 -4.067
40 2HB ARG 8 2HB ARG 8 7.791 -5.003 -2.802
41 1HG ARG 8 1HG ARG 8 9.136 -6.180 -4.488
42 2HG ARG 8 2HG ARG 8 7.466 -6.770 -4.534
43 1HD ARG 8 1HD ARG 8 7.680 -4.518 -6.313
44 2HD ARG 8 2HD ARG 8 9.023 -5.615 -6.667
45 HE ARG 8 HE ARG 8 6.255 -6.057 -7.289
46 1HH1 ARG 8 2HH2 ARG 8 9.100 -7.810 -6.112
47 2HH1 ARG 8 1HH2 ARG 8 8.563 -9.340 -6.723
48 1HH2 ARG 8 2HH1 ARG 8 5.562 -8.045 -8.082
49 2HH2 ARG 8 1HH1 ARG 8 6.540 -9.480 -7.852
50 H GLN 9 H GLN 9 4.493 -5.070 -2.363
51 HA GLN 9 HA GLN 9 3.316 -7.070 -4.019
52 1HB GLN 9 1HB GLN 9 5.189 -7.764 -1.792
53 2HB GLN 9 2HB GLN 9 3.721 -8.746 -1.942
54 1HG GLN 9 1HG GLN 9 4.563 -8.612 -4.558
55 2HG GLN 9 2HG GLN 9 6.115 -8.593 -3.706
56 1HE2 GLN 9 1HE2 GLN 9 4.730 -10.613 -5.400
57 2HE2 GLN 9 2HE2 GLN 9 4.686 -12.077 -4.476
58 H CYS 10 H CYS 10 3.689 -5.531 -0.786
59 HA CYS 10 HA CYS 10 0.890 -6.110 -0.239
60 1HB CYS 10 1HB CYS 10 1.967 -6.632 1.673
61 2HB CYS 10 2HB CYS 10 3.271 -5.472 1.411
62 H LYS 11 H LYS 11 2.147 -4.110 -2.269
63 HA LYS 11 HA LYS 11 0.653 -1.787 -1.285
64 1HB LYS 11 1HB LYS 11 2.303 -0.283 -1.899
65 2HB LYS 11 2HB LYS 11 3.217 -1.585 -1.122
66 1HG LYS 11 1HG LYS 11 4.482 -1.463 -3.017
67 2HG LYS 11 2HG LYS 11 3.199 -2.466 -3.717
68 1HD LYS 11 1HD LYS 11 2.053 -0.408 -4.511
69 2HD LYS 11 2HD LYS 11 3.351 0.585 -3.822
70 1HE LYS 11 1HE LYS 11 3.911 0.370 -6.117
71 2HE LYS 11 2HE LYS 11 4.953 -0.815 -5.315
72 1HZ LYS 11 1HZ LYS 11 3.626 -1.571 -7.358
73 2HZ LYS 11 2HZ LYS 11 3.582 -2.558 -6.063
74 3HZ LYS 11 3HZ LYS 11 2.320 -1.546 -6.360
75 H LEU 12 H LEU 12 0.775 -4.302 -3.416
76 HA LEU 12 HA LEU 12 0.630 -3.704 -5.917
77 1HB LEU 12 1HB LEU 12 -1.138 -5.212 -6.238
78 2HB LEU 12 2HB LEU 12 -0.223 -5.768 -4.826
79 HG LEU 12 HG LEU 12 -2.096 -4.417 -3.525
80 1HD1 LEU 12 1HD1 LEU 12 -3.186 -4.705 -6.279
81 2HD1 LEU 12 2HD1 LEU 12 -4.288 -5.045 -4.922
82 3HD1 LEU 12 3HD1 LEU 12 -3.487 -3.460 -5.043
83 1HD2 LEU 12 1HD2 LEU 12 -1.540 -6.875 -3.439
84 2HD2 LEU 12 2HD2 LEU 12 -3.244 -6.458 -3.133
85 3HD2 LEU 12 3HD2 LEU 12 -2.759 -7.118 -4.714
86 H LYS 13 H LYS 13 -1.752 -2.424 -3.536
87 HA LYS 13 HA LYS 13 -3.485 -1.190 -5.241
88 1HB LYS 13 1HB LYS 13 -4.313 -0.207 -3.394
89 2HB LYS 13 2HB LYS 13 -3.246 -1.359 -2.574
90 1HG LYS 13 1HG LYS 13 -2.179 1.339 -3.401
91 2HG LYS 13 2HG LYS 13 -3.184 1.221 -1.946
92 1HD LYS 13 1HD LYS 13 -1.468 0.364 -0.764
93 2HD LYS 13 2HD LYS 13 -1.176 -0.896 -1.977
94 1HE LYS 13 1HE LYS 13 0.807 0.559 -1.663
95 2HE LYS 13 2HE LYS 13 0.175 0.700 -3.311
96 1HZ LYS 13 1HZ LYS 13 0.694 2.815 -1.823
97 2HZ LYS 13 2HZ LYS 13 -0.527 2.833 -2.900
98 3HZ LYS 13 3HZ LYS 13 -0.845 2.528 -1.317
99 HA PRO 14 HA PRO 14 -1.482 2.251 -6.931
100 1HB PRO 14 1HB PRO 14 -3.137 4.390 -6.542
101 2HB PRO 14 2HB PRO 14 -3.412 3.172 -7.785
102 1HG PRO 14 1HG PRO 14 -4.741 3.553 -5.180
103 2HG PRO 14 2HG PRO 14 -5.329 2.645 -6.618
104 1HD PRO 14 1HD PRO 14 -4.256 1.606 -4.174
105 2HD PRO 14 2HD PRO 14 -4.672 0.680 -5.622
106 H ALA 15 H ALA 15 -0.046 4.018 -6.750
107 HA ALA 15 HA ALA 15 1.285 4.126 -4.376
108 1HB ALA 15 1HB ALA 15 0.957 6.265 -6.520
109 2HB ALA 15 2HB ALA 15 2.220 6.269 -5.264
110 3HB ALA 15 3HB ALA 15 2.179 4.972 -6.481
111 H GLY 16 H GLY 16 1.239 5.417 -2.506
112 1HA GLY 16 1HA GLY 16 -0.668 7.550 -2.229
113 2HA GLY 16 2HA GLY 16 -1.155 6.089 -1.396
114 H THR 17 H THR 17 1.747 8.228 -1.843
115 HA THR 17 HA THR 17 3.543 8.448 -0.456
116 HB THR 17 HB THR 17 1.267 9.266 1.418
117 HG1 THR 17 1HG THR 17 2.466 10.413 -1.003
118 1HG2 THR 17 1HG2 THR 17 2.891 10.471 2.480
119 2HG2 THR 17 2HG2 THR 17 4.110 9.684 1.448
120 3HG2 THR 17 3HG2 THR 17 3.366 11.219 0.936
121 H THR 18 H THR 18 2.761 8.369 2.638
122 HA THR 18 HA THR 18 2.885 5.471 2.970
123 HB THR 18 HB THR 18 5.036 7.498 3.688
124 HG1 THR 18 1HG THR 18 5.306 6.175 1.798
125 1HG2 THR 18 1HG2 THR 18 4.088 5.288 5.372
126 2HG2 THR 18 2HG2 THR 18 5.733 4.971 4.773
127 3HG2 THR 18 3HG2 THR 18 5.392 6.455 5.694
128 H CYS 19 H CYS 19 2.019 4.711 4.891
129 HA CYS 19 HA CYS 19 0.441 4.805 6.449
130 1HB CYS 19 1HB CYS 19 2.302 6.910 7.559
131 2HB CYS 19 2HB CYS 19 1.102 5.998 8.480
132 H TRP 20 H TRP 20 -1.018 5.817 4.688
133 HA TRP 20 HA TRP 20 -1.842 8.489 5.597
134 1HB TRP 20 1HB TRP 20 -0.656 8.146 3.247
135 2HB TRP 20 2HB TRP 20 -2.291 7.683 2.766
136 HD1 TRP 20 HD TRP 20 -4.182 9.675 2.892
137 HE1 TRP 20 1HE TRP 20 -4.069 12.312 2.845
138 HE3 TRP 20 3HE TRP 20 0.767 10.005 4.008
139 HZ2 TRP 20 2HZ TRP 20 -1.968 14.196 3.271
140 HZ3 TRP 20 3HZ TRP 20 1.771 12.280 4.175
141 HH2 TRP 20 HH TRP 20 0.488 14.331 3.827
142 H LYS 21 H LYS 21 -3.088 5.994 3.268
143 HA LYS 21 HA LYS 21 -4.816 4.561 3.553
144 1HB LYS 21 1HB LYS 21 -4.495 4.867 6.066
145 2HB LYS 21 2HB LYS 21 -5.780 6.086 5.976
146 1HG LYS 21 1HG LYS 21 -7.284 4.415 6.099
147 2HG LYS 21 2HG LYS 21 -6.732 3.841 4.515
148 1HD LYS 21 1HD LYS 21 -5.512 2.130 5.422
149 2HD LYS 21 2HD LYS 21 -5.009 3.081 6.832
150 1HE LYS 21 1HE LYS 21 -7.687 2.841 7.320
151 2HE LYS 21 2HE LYS 21 -7.400 1.327 6.447
152 1HZ LYS 21 1HZ LYS 21 -6.256 2.217 9.006
153 2HZ LYS 21 2HZ LYS 21 -6.880 0.762 8.621
154 3HZ LYS 21 3HZ LYS 21 -5.405 1.195 8.037
155 H THR 22 H THR 22 -6.496 4.716 2.149
156 HA THR 22 HA THR 22 -7.399 7.408 1.496
157 HB THR 22 HB THR 22 -8.371 6.161 -0.494
158 HG1 THR 22 1HG THR 22 -8.360 4.162 1.087
159 1HG2 THR 22 1HG2 THR 22 -6.084 6.944 -0.834
160 2HG2 THR 22 2HG2 THR 22 -5.435 5.652 0.205
161 3HG2 THR 22 3HG2 THR 22 -6.140 5.250 -1.379
162 H SER 23 H SER 23 -8.245 5.094 3.730
163 HA SER 23 HA SER 23 -9.997 5.256 5.100
164 1HB SER 23 1HB SER 23 -10.629 7.445 3.897
165 2HB SER 23 2HB SER 23 -11.725 6.461 2.909
166 HG SER 23 HG SER 23 -13.073 6.920 4.536
167 H LEU 24 H LEU 24 -10.191 4.261 1.697
168 HA LEU 24 HA LEU 24 -12.056 2.131 2.471
169 1HB LEU 24 1HB LEU 24 -12.908 3.603 0.769
170 2HB LEU 24 2HB LEU 24 -11.465 3.347 -0.231
171 HG LEU 24 HG LEU 24 -13.019 0.928 0.528
172 1HD1 LEU 24 1HD1 LEU 24 -14.478 1.522 -1.604
173 2HD1 LEU 24 2HD1 LEU 24 -14.967 2.009 0.036
174 3HD1 LEU 24 3HD1 LEU 24 -14.180 3.185 -1.044
175 1HD2 LEU 24 1HD2 LEU 24 -11.473 1.918 -1.856
176 2HD2 LEU 24 2HD2 LEU 24 -11.212 0.469 -0.857
177 3HD2 LEU 24 3HD2 LEU 24 -12.580 0.533 -1.993
178 H THR 25 H THR 25 -9.337 2.697 0.118
179 HA THR 25 HA THR 25 -8.632 -0.075 0.198
180 HB THR 25 HB THR 25 -7.814 2.446 -1.212
181 HG1 THR 25 1HG THR 25 -8.458 1.051 -2.844
182 1HG2 THR 25 1HG2 THR 25 -5.982 0.039 -0.774
183 2HG2 THR 25 2HG2 THR 25 -5.867 1.067 -2.223
184 3HG2 THR 25 3HG2 THR 25 -5.569 1.763 -0.611
185 H SER 26 H SER 26 -6.459 2.739 0.850
186 HA SER 26 HA SER 26 -5.676 2.963 3.103
187 1HB SER 26 1HB SER 26 -5.299 -0.037 2.803
188 2HB SER 26 2HB SER 26 -4.538 0.902 4.100
189 HG SER 26 HG SER 26 -6.410 0.264 5.047
190 H HIS 27 H HIS 27 -4.463 4.236 1.419
191 HA HIS 27 HA HIS 27 -2.520 3.280 -0.203
192 1HB HIS 27 1HB HIS 27 -2.842 5.858 1.301
193 2HB HIS 27 2HB HIS 27 -1.409 5.587 0.304
194 HD1 HIS 27 1HD HIS 27 -3.294 7.843 -0.488
195 HD2 HIS 27 2HD HIS 27 -3.706 3.914 -1.898
196 HE1 HIS 27 1HE HIS 27 -4.620 7.999 -2.662
197 HE2 HIS 27 2HE HIS 27 -4.850 5.552 -3.489
198 H TYR 28 H TYR 28 -1.698 4.835 2.976
199 HA TYR 28 HA TYR 28 0.255 4.594 4.112
200 1HB TYR 28 1HB TYR 28 -1.571 2.216 4.137
201 2HB TYR 28 2HB TYR 28 0.035 1.875 4.790
202 HD1 TYR 28 1HD TYR 28 0.202 2.026 7.090
203 HD2 TYR 28 2HD TYR 28 -2.527 4.619 5.059
204 HE1 TYR 28 1HE TYR 28 -0.512 3.029 9.315
205 HE2 TYR 28 2HE TYR 28 -3.231 5.613 7.290
206 HH TYR 28 HH TYR 28 -1.524 4.834 10.231
207 H CYS 29 H CYS 29 1.107 4.551 1.509
208 HA CYS 29 HA CYS 29 3.521 3.533 1.504
209 1HB CYS 29 1HB CYS 29 1.664 1.290 1.313
210 2HB CYS 29 2HB CYS 29 2.840 1.320 -0.004
211 H THR 30 H THR 30 4.074 2.641 -1.038
212 HA THR 30 HA THR 30 2.329 3.934 -2.942
213 HB THR 30 HB THR 30 3.493 5.924 -2.370
214 HG1 THR 30 1HG THR 30 3.788 5.022 -4.663
215 1HG2 THR 30 1HG2 THR 30 5.218 4.716 -0.876
216 2HG2 THR 30 2HG2 THR 30 6.128 4.373 -2.367
217 3HG2 THR 30 3HG2 THR 30 5.862 6.057 -1.853
218 H GLY 31 H GLY 31 5.405 2.241 -2.185
219 1HA GLY 31 1HA GLY 31 5.273 0.037 -3.538
220 2HA GLY 31 2HA GLY 31 5.408 1.126 -4.904
221 H LYS 32 H LYS 32 7.175 -0.844 -2.874
222 HA LYS 32 HA LYS 32 9.285 -0.871 -2.114
223 1HB LYS 32 1HB LYS 32 10.924 -0.532 -4.009
224 2HB LYS 32 2HB LYS 32 9.620 -1.698 -4.297
225 1HG LYS 32 1HG LYS 32 9.390 1.210 -5.129
226 2HG LYS 32 2HG LYS 32 10.162 0.011 -6.182
227 1HD LYS 32 1HD LYS 32 7.622 -0.985 -5.159
228 2HD LYS 32 2HD LYS 32 7.392 0.581 -5.956
229 1HE LYS 32 1HE LYS 32 8.092 -0.229 -8.027
230 2HE LYS 32 2HE LYS 32 9.098 -1.503 -7.320
231 1HZ LYS 32 1HZ LYS 32 7.137 -2.498 -8.252
232 2HZ LYS 32 2HZ LYS 32 6.968 -2.592 -6.636
233 3HZ LYS 32 3HZ LYS 32 6.166 -1.425 -7.473
234 H SER 33 H SER 33 8.830 0.903 -0.543
235 HA SER 33 HA SER 33 10.782 2.555 -0.143
236 1HB SER 33 1HB SER 33 9.135 3.670 -2.362
237 2HB SER 33 2HB SER 33 9.619 4.824 -1.106
238 HG SER 33 HG SER 33 11.829 4.245 -1.490
239 H CYS 34 H CYS 34 8.589 1.173 1.132
240 HA CYS 34 HA CYS 34 7.696 3.322 2.835
241 1HB CYS 34 1HB CYS 34 5.412 2.973 2.682
242 2HB CYS 34 2HB CYS 34 5.958 3.020 1.002
243 H ASP 35 H ASP 35 5.734 1.511 4.164
244 HA ASP 35 HA ASP 35 6.663 -0.972 4.683
245 1HB ASP 35 1HB ASP 35 8.570 0.798 5.610
246 2HB ASP 35 2HB ASP 35 7.588 0.556 7.064
247 HD2 ASP 35 HD ASP 35 9.829 -2.002 7.597
248 H CYS 36 H CYS 36 4.218 0.553 4.518
249 HA CYS 36 HA CYS 36 3.232 0.233 7.258
250 1HB CYS 36 1HB CYS 36 3.278 2.605 5.692
251 2HB CYS 36 2HB CYS 36 1.594 2.090 5.836
252 HA PRO 37 HA PRO 37 0.287 -2.324 5.320
253 1HB PRO 37 1HB PRO 37 -1.814 -2.198 7.060
254 2HB PRO 37 2HB PRO 37 -0.399 -3.211 7.330
255 1HG PRO 37 1HG PRO 37 -1.147 -0.634 8.554
256 2HG PRO 37 2HG PRO 37 0.009 -1.872 9.163
257 1HD PRO 37 1HD PRO 37 0.583 0.647 7.928
258 2HD PRO 37 2HD PRO 37 1.753 -0.606 8.364
259 H LEU 38 H LEU 38 -1.128 -2.336 3.653
260 HA LEU 38 HA LEU 38 -2.735 0.117 3.482
261 1HB LEU 38 1HB LEU 38 -2.423 -0.210 0.962
262 2HB LEU 38 2HB LEU 38 -1.126 0.544 1.905
263 HG LEU 38 HG LEU 38 -0.469 -2.152 1.917
264 1HD1 LEU 38 1HD1 LEU 38 -0.511 -2.258 -0.821
265 2HD1 LEU 38 2HD1 LEU 38 -1.622 -3.124 0.265
266 3HD1 LEU 38 3HD1 LEU 38 -2.107 -1.567 -0.447
267 1HD2 LEU 38 1HD2 LEU 38 1.156 -0.418 1.722
268 2HD2 LEU 38 2HD2 LEU 38 1.299 -1.452 0.281
269 3HD2 LEU 38 3HD2 LEU 38 0.483 0.126 0.167
270 H TYR 39 H TYR 39 -4.219 -1.442 4.712
271 HA TYR 39 HA TYR 39 -6.053 -2.525 2.818
272 1HB TYR 39 1HB TYR 39 -4.247 -4.316 3.108
273 2HB TYR 39 2HB TYR 39 -4.575 -4.316 4.845
274 HD1 TYR 39 1HD TYR 39 -6.001 -5.123 1.511
275 HD2 TYR 39 2HD TYR 39 -6.402 -5.560 5.747
276 HE1 TYR 39 1HE TYR 39 -7.792 -6.895 1.166
277 HE2 TYR 39 2HE TYR 39 -8.191 -7.330 5.387
278 HH TYR 39 HH TYR 39 -9.842 -7.878 3.578
279 HA PRO 40 HA PRO 40 -8.613 -1.580 6.180
280 1HB PRO 40 1HB PRO 40 -10.938 -2.770 5.378
281 2HB PRO 40 2HB PRO 40 -10.409 -1.194 4.791
282 1HG PRO 40 1HG PRO 40 -10.337 -3.831 3.469
283 2HG PRO 40 2HG PRO 40 -10.257 -2.196 2.720
284 1HD PRO 40 1HD PRO 40 -8.133 -4.071 3.134
285 2HD PRO 40 2HD PRO 40 -7.975 -2.414 2.538
286 H GLY 41 H GLY 41 -7.811 -2.446 8.032
287 1HA GLY 41 1HA GLY 41 -8.778 -5.196 8.543
288 2HA GLY 41 2HA GLY 41 -7.193 -4.626 9.026
Start of MODEL 17
1 H CYS 1 H CYS 1 -3.770 -3.368 2.076
2 HA CYS 1 HA CYS 1 -2.050 -5.387 1.124
3 1HB CYS 1 1HB CYS 1 -0.888 -3.496 1.030
4 2HB CYS 1 2HB CYS 1 -1.810 -2.727 2.325
5 H THR 2 H THR 2 -0.286 -6.337 2.698
6 HA THR 2 HA THR 2 -0.307 -6.636 5.303
7 HB THR 2 HB THR 2 -2.635 -7.007 5.618
8 HG1 THR 2 1HG THR 2 -1.623 -8.741 6.675
9 1HG2 THR 2 1HG2 THR 2 -2.504 -8.086 2.915
10 2HG2 THR 2 2HG2 THR 2 -3.247 -9.289 3.996
11 3HG2 THR 2 3HG2 THR 2 -3.948 -7.657 3.864
12 H THR 3 H THR 3 0.107 -7.818 2.154
13 HA THR 3 HA THR 3 1.056 -10.407 2.666
14 HB THR 3 HB THR 3 1.963 -10.187 0.392
15 HG1 THR 3 1HG THR 3 2.353 -8.063 -0.391
16 1HG2 THR 3 1HG2 THR 3 -0.345 -8.230 0.288
17 2HG2 THR 3 2HG2 THR 3 0.018 -9.595 -0.798
18 3HG2 THR 3 3HG2 THR 3 -0.667 -9.900 0.816
19 H GLY 4 H GLY 4 3.505 -8.373 1.240
20 1HA GLY 4 1HA GLY 4 5.314 -9.142 3.407
21 2HA GLY 4 2HA GLY 4 5.749 -8.575 1.807
22 HA PRO 5 HA PRO 5 6.318 -4.950 4.367
23 1HB PRO 5 1HB PRO 5 8.551 -4.028 3.092
24 2HB PRO 5 2HB PRO 5 8.613 -5.099 4.491
25 1HG PRO 5 1HG PRO 5 9.028 -5.685 1.628
26 2HG PRO 5 2HG PRO 5 9.556 -6.644 3.060
27 1HD PRO 5 1HD PRO 5 7.389 -7.173 1.263
28 2HD PRO 5 2HD PRO 5 7.768 -8.056 2.748
29 H CYS 6 H CYS 6 4.255 -5.044 2.631
30 HA CYS 6 HA CYS 6 3.477 -3.970 0.721
31 1HB CYS 6 1HB CYS 6 2.082 -2.491 1.640
32 2HB CYS 6 2HB CYS 6 2.764 -3.103 3.151
33 H CYS 7 H CYS 7 4.767 -3.481 -1.045
34 HA CYS 7 HA CYS 7 5.567 -1.097 -1.758
35 1HB CYS 7 1HB CYS 7 7.272 -1.872 0.435
36 2HB CYS 7 2HB CYS 7 8.228 -1.627 -1.029
37 H ARG 8 H ARG 8 4.733 -3.505 -2.894
38 HA ARG 8 HA ARG 8 5.858 -3.813 -5.138
39 1HB ARG 8 1HB ARG 8 8.132 -4.000 -4.473
40 2HB ARG 8 2HB ARG 8 7.758 -5.132 -3.160
41 1HG ARG 8 1HG ARG 8 8.823 -6.291 -5.055
42 2HG ARG 8 2HG ARG 8 7.161 -6.867 -4.839
43 1HD ARG 8 1HD ARG 8 6.477 -6.006 -6.845
44 2HD ARG 8 2HD ARG 8 7.458 -4.542 -6.678
45 HE ARG 8 HE ARG 8 8.972 -7.022 -7.169
46 1HH1 ARG 8 2HH2 ARG 8 7.426 -4.188 -8.629
47 2HH1 ARG 8 1HH2 ARG 8 8.345 -4.287 -10.093
48 1HH2 ARG 8 2HH1 ARG 8 10.164 -7.147 -9.073
49 2HH2 ARG 8 1HH1 ARG 8 9.913 -5.979 -10.353
50 H GLN 9 H GLN 9 4.399 -5.140 -2.372
51 HA GLN 9 HA GLN 9 3.233 -7.219 -3.992
52 1HB GLN 9 1HB GLN 9 4.864 -7.688 -1.508
53 2HB GLN 9 2HB GLN 9 3.471 -8.738 -1.818
54 1HG GLN 9 1HG GLN 9 4.818 -8.554 -4.289
55 2HG GLN 9 2HG GLN 9 6.110 -8.710 -3.089
56 1HE2 GLN 9 1HE2 GLN 9 3.620 -10.232 -4.839
57 2HE2 GLN 9 2HE2 GLN 9 3.707 -11.818 -4.144
58 H CYS 10 H CYS 10 3.339 -6.240 -0.482
59 HA CYS 10 HA CYS 10 0.618 -6.601 -0.094
60 1HB CYS 10 1HB CYS 10 1.631 -6.543 1.899
61 2HB CYS 10 2HB CYS 10 2.861 -5.386 1.382
62 H LYS 11 H LYS 11 2.615 -3.767 -1.086
63 HA LYS 11 HA LYS 11 0.291 -2.059 -1.164
64 1HB LYS 11 1HB LYS 11 2.483 -1.245 -0.391
65 2HB LYS 11 2HB LYS 11 3.158 -1.530 -2.006
66 1HG LYS 11 1HG LYS 11 0.693 -0.013 -2.213
67 2HG LYS 11 2HG LYS 11 1.781 0.784 -1.062
68 1HD LYS 11 1HD LYS 11 3.569 0.828 -2.728
69 2HD LYS 11 2HD LYS 11 2.591 -0.114 -3.865
70 1HE LYS 11 1HE LYS 11 2.547 2.770 -3.254
71 2HE LYS 11 2HE LYS 11 1.967 1.922 -4.696
72 1HZ LYS 11 1HZ LYS 11 0.519 2.294 -2.136
73 2HZ LYS 11 2HZ LYS 11 0.080 2.848 -3.603
74 3HZ LYS 11 3HZ LYS 11 0.057 1.231 -3.303
75 H LEU 12 H LEU 12 -0.524 -4.035 -2.679
76 HA LEU 12 HA LEU 12 0.397 -3.927 -5.359
77 1HB LEU 12 1HB LEU 12 -1.120 -5.566 -5.785
78 2HB LEU 12 2HB LEU 12 -0.788 -5.816 -4.061
79 HG LEU 12 HG LEU 12 -2.991 -4.072 -4.174
80 1HD1 LEU 12 1HD1 LEU 12 -3.794 -6.416 -5.834
81 2HD1 LEU 12 2HD1 LEU 12 -4.486 -4.778 -5.739
82 3HD1 LEU 12 3HD1 LEU 12 -2.978 -5.056 -6.643
83 1HD2 LEU 12 1HD2 LEU 12 -2.576 -6.963 -3.466
84 2HD2 LEU 12 2HD2 LEU 12 -2.891 -5.567 -2.408
85 3HD2 LEU 12 3HD2 LEU 12 -4.201 -6.239 -3.408
86 H LYS 13 H LYS 13 -1.283 -1.696 -3.473
87 HA LYS 13 HA LYS 13 -3.040 -0.809 -5.593
88 1HB LYS 13 1HB LYS 13 -3.863 0.767 -3.998
89 2HB LYS 13 2HB LYS 13 -3.742 -0.814 -3.206
90 1HG LYS 13 1HG LYS 13 -1.364 1.000 -3.035
91 2HG LYS 13 2HG LYS 13 -2.791 1.463 -2.089
92 1HD LYS 13 1HD LYS 13 -0.937 -0.857 -1.778
93 2HD LYS 13 2HD LYS 13 -1.780 0.082 -0.535
94 1HE LYS 13 1HE LYS 13 -2.970 -2.063 -2.343
95 2HE LYS 13 2HE LYS 13 -2.690 -2.198 -0.601
96 1HZ LYS 13 1HZ LYS 13 -4.316 0.062 -1.385
97 2HZ LYS 13 2HZ LYS 13 -5.005 -1.378 -1.706
98 3HZ LYS 13 3HZ LYS 13 -4.507 -1.037 -0.178
99 HA PRO 14 HA PRO 14 -0.416 2.257 -7.127
100 1HB PRO 14 1HB PRO 14 -2.063 4.383 -7.614
101 2HB PRO 14 2HB PRO 14 -1.961 2.979 -8.674
102 1HG PRO 14 1HG PRO 14 -4.030 3.722 -6.706
103 2HG PRO 14 2HG PRO 14 -4.159 2.585 -8.097
104 1HD PRO 14 1HD PRO 14 -3.928 1.972 -5.310
105 2HD PRO 14 2HD PRO 14 -3.891 0.819 -6.650
106 H ALA 15 H ALA 15 1.215 3.459 -6.371
107 HA ALA 15 HA ALA 15 1.403 4.198 -3.809
108 1HB ALA 15 1HB ALA 15 3.269 5.444 -4.459
109 2HB ALA 15 2HB ALA 15 3.048 4.363 -5.856
110 3HB ALA 15 3HB ALA 15 2.480 6.047 -5.936
111 H GLY 16 H GLY 16 -0.221 5.151 -2.641
112 1HA GLY 16 1HA GLY 16 -1.558 7.501 -3.794
113 2HA GLY 16 2HA GLY 16 -2.114 6.527 -2.448
114 H THR 17 H THR 17 -0.299 6.417 -0.551
115 HA THR 17 HA THR 17 1.240 8.802 -0.243
116 HB THR 17 HB THR 17 -1.310 8.475 1.425
117 HG1 THR 17 1HG THR 17 -1.791 10.473 0.139
118 1HG2 THR 17 1HG2 THR 17 0.649 10.817 1.206
119 2HG2 THR 17 2HG2 THR 17 -0.757 10.697 2.291
120 3HG2 THR 17 3HG2 THR 17 0.662 9.655 2.554
121 H THR 18 H THR 18 2.458 8.819 1.789
122 HA THR 18 HA THR 18 3.075 6.095 2.540
123 HB THR 18 HB THR 18 4.293 8.849 2.818
124 HG1 THR 18 1HG THR 18 5.696 7.739 1.487
125 1HG2 THR 18 1HG2 THR 18 5.340 6.396 4.307
126 2HG2 THR 18 2HG2 THR 18 5.973 8.057 4.368
127 3HG2 THR 18 3HG2 THR 18 4.409 7.673 5.124
128 H CYS 19 H CYS 19 1.919 5.054 4.033
129 HA CYS 19 HA CYS 19 0.615 4.704 5.775
130 1HB CYS 19 1HB CYS 19 2.271 6.714 7.275
131 2HB CYS 19 2HB CYS 19 1.508 5.244 7.883
132 H TRP 20 H TRP 20 -0.933 6.108 4.250
133 HA TRP 20 HA TRP 20 -1.831 8.421 5.833
134 1HB TRP 20 1HB TRP 20 -0.889 8.620 3.359
135 2HB TRP 20 2HB TRP 20 -2.545 8.162 2.954
136 HD1 TRP 20 HD TRP 20 -3.889 10.334 2.445
137 HE1 TRP 20 1HE TRP 20 -4.109 12.797 3.371
138 HE3 TRP 20 3HE TRP 20 -0.303 9.873 6.021
139 HZ2 TRP 20 2HZ TRP 20 -2.791 14.242 5.446
140 HZ3 TRP 20 3HZ TRP 20 0.169 11.858 7.455
141 HH2 TRP 20 HH TRP 20 -1.007 13.987 7.212
142 H LYS 21 H LYS 21 -2.945 5.929 3.418
143 HA LYS 21 HA LYS 21 -4.658 4.519 3.485
144 1HB LYS 21 1HB LYS 21 -4.775 3.635 5.509
145 2HB LYS 21 2HB LYS 21 -4.321 5.155 6.298
146 1HG LYS 21 1HG LYS 21 -6.522 4.551 7.077
147 2HG LYS 21 2HG LYS 21 -6.724 5.928 5.980
148 1HD LYS 21 1HD LYS 21 -7.642 4.595 4.281
149 2HD LYS 21 2HD LYS 21 -6.917 3.104 4.904
150 1HE LYS 21 1HE LYS 21 -9.461 3.434 5.231
151 2HE LYS 21 2HE LYS 21 -8.530 2.927 6.651
152 1HZ LYS 21 1HZ LYS 21 -9.018 5.792 6.125
153 2HZ LYS 21 2HZ LYS 21 -10.152 4.900 6.881
154 3HZ LYS 21 3HZ LYS 21 -8.646 5.025 7.531
155 H THR 22 H THR 22 -6.325 4.953 2.152
156 HA THR 22 HA THR 22 -7.459 7.578 2.109
157 HB THR 22 HB THR 22 -8.631 6.683 0.141
158 HG1 THR 22 1HG THR 22 -8.419 4.455 1.745
159 1HG2 THR 22 1HG2 THR 22 -5.766 5.816 0.562
160 2HG2 THR 22 2HG2 THR 22 -6.639 5.157 -0.841
161 3HG2 THR 22 3HG2 THR 22 -6.437 6.916 -0.664
162 H SER 23 H SER 23 -10.092 5.868 1.333
163 HA SER 23 HA SER 23 -11.018 5.626 4.072
164 1HB SER 23 1HB SER 23 -11.650 7.809 2.416
165 2HB SER 23 2HB SER 23 -13.085 6.770 2.345
166 HG SER 23 HG SER 23 -13.590 7.565 4.259
167 H LEU 24 H LEU 24 -10.254 3.827 1.693
168 HA LEU 24 HA LEU 24 -12.401 2.010 1.996
169 1HB LEU 24 1HB LEU 24 -13.378 1.987 -0.081
170 2HB LEU 24 2HB LEU 24 -13.274 3.712 0.313
171 HG LEU 24 HG LEU 24 -11.032 2.567 -1.264
172 1HD1 LEU 24 1HD1 LEU 24 -13.823 2.296 -2.114
173 2HD1 LEU 24 2HD1 LEU 24 -12.805 3.185 -3.274
174 3HD1 LEU 24 3HD1 LEU 24 -12.342 1.546 -2.757
175 1HD2 LEU 24 1HD2 LEU 24 -10.903 4.876 -0.822
176 2HD2 LEU 24 2HD2 LEU 24 -11.428 4.746 -2.519
177 3HD2 LEU 24 3HD2 LEU 24 -12.611 5.140 -1.248
178 H THR 25 H THR 25 -9.497 3.107 0.185
179 HA THR 25 HA THR 25 -8.729 0.324 -0.241
180 HB THR 25 HB THR 25 -8.121 3.008 -1.410
181 HG1 THR 25 1HG THR 25 -9.342 1.142 -2.353
182 1HG2 THR 25 1HG2 THR 25 -6.010 0.910 -0.867
183 2HG2 THR 25 2HG2 THR 25 -6.030 1.693 -2.466
184 3HG2 THR 25 3HG2 THR 25 -5.830 2.676 -0.995
185 H SER 26 H SER 26 -7.100 3.319 1.015
186 HA SER 26 HA SER 26 -6.138 3.465 3.056
187 1HB SER 26 1HB SER 26 -5.602 0.476 3.019
188 2HB SER 26 2HB SER 26 -5.476 1.573 4.406
189 HG SER 26 HG SER 26 -7.485 0.938 4.800
190 H HIS 27 H HIS 27 -4.732 4.577 1.429
191 HA HIS 27 HA HIS 27 -2.531 3.030 0.405
192 1HB HIS 27 1HB HIS 27 -1.851 5.253 -0.555
193 2HB HIS 27 2HB HIS 27 -3.409 4.620 -1.099
194 HD1 HIS 27 1HD HIS 27 -3.891 5.929 2.232
195 HD2 HIS 27 2HD HIS 27 -3.619 7.598 -1.607
196 HE1 HIS 27 1HE HIS 27 -4.928 8.255 2.389
197 HE2 HIS 27 2HE HIS 27 -4.738 9.240 -0.004
198 H TYR 28 H TYR 28 -1.339 2.336 2.216
199 HA TYR 28 HA TYR 28 -0.151 4.528 3.782
200 1HB TYR 28 1HB TYR 28 -1.623 2.122 4.435
201 2HB TYR 28 2HB TYR 28 0.049 1.832 4.925
202 HD1 TYR 28 1HD TYR 28 -2.404 4.680 5.114
203 HD2 TYR 28 2HD TYR 28 0.475 2.261 7.155
204 HE1 TYR 28 1HE TYR 28 -2.813 5.987 7.256
205 HE2 TYR 28 2HE TYR 28 0.056 3.577 9.290
206 HH TYR 28 HH TYR 28 -0.828 6.113 9.697
207 H CYS 29 H CYS 29 1.056 4.070 1.374
208 HA CYS 29 HA CYS 29 3.615 3.257 2.175
209 1HB CYS 29 1HB CYS 29 1.983 1.120 1.366
210 2HB CYS 29 2HB CYS 29 3.068 1.438 0.009
211 H THR 30 H THR 30 4.337 2.443 -0.652
212 HA THR 30 HA THR 30 3.377 4.519 -2.366
213 HB THR 30 HB THR 30 5.043 5.641 -0.702
214 HG1 THR 30 1HG THR 30 5.656 5.487 -3.569
215 1HG2 THR 30 1HG2 THR 30 7.405 5.364 -1.200
216 2HG2 THR 30 2HG2 THR 30 6.767 3.730 -0.896
217 3HG2 THR 30 3HG2 THR 30 7.049 4.280 -2.566
218 H GLY 31 H GLY 31 5.761 1.959 -1.602
219 1HA GLY 31 1HA GLY 31 5.568 0.103 -3.261
220 2HA GLY 31 2HA GLY 31 5.835 1.322 -4.491
221 H LYS 32 H LYS 32 7.348 -1.039 -2.650
222 HA LYS 32 HA LYS 32 9.465 -1.625 -2.410
223 1HB LYS 32 1HB LYS 32 9.490 -0.032 -4.705
224 2HB LYS 32 2HB LYS 32 10.856 0.546 -3.737
225 1HG LYS 32 1HG LYS 32 10.364 -2.139 -4.978
226 2HG LYS 32 2HG LYS 32 11.875 -1.220 -4.857
227 1HD LYS 32 1HD LYS 32 11.472 -1.702 -2.235
228 2HD LYS 32 2HD LYS 32 10.595 -3.096 -2.889
229 1HE LYS 32 1HE LYS 32 13.369 -2.418 -3.891
230 2HE LYS 32 2HE LYS 32 13.174 -3.301 -2.369
231 1HZ LYS 32 1HZ LYS 32 11.543 -4.654 -4.031
232 2HZ LYS 32 2HZ LYS 32 12.707 -4.206 -5.079
233 3HZ LYS 32 3HZ LYS 32 13.111 -5.037 -3.719
234 H SER 33 H SER 33 9.367 2.012 -2.308
235 HA SER 33 HA SER 33 10.976 1.880 0.075
236 1HB SER 33 1HB SER 33 10.683 4.483 -0.176
237 2HB SER 33 2HB SER 33 11.742 3.612 -1.298
238 HG SER 33 HG SER 33 10.488 4.814 -2.651
239 H CYS 34 H CYS 34 9.212 0.788 1.341
240 HA CYS 34 HA CYS 34 7.913 2.549 3.000
241 1HB CYS 34 1HB CYS 34 5.666 2.570 2.409
242 2HB CYS 34 2HB CYS 34 6.530 2.965 0.921
243 H ASP 35 H ASP 35 6.086 1.178 4.293
244 HA ASP 35 HA ASP 35 6.210 -1.594 4.058
245 1HB ASP 35 1HB ASP 35 7.433 -2.086 6.177
246 2HB ASP 35 2HB ASP 35 8.485 -1.367 4.947
247 HD2 ASP 35 HD ASP 35 9.868 -0.688 6.506
248 H CYS 36 H CYS 36 4.299 0.620 4.390
249 HA CYS 36 HA CYS 36 3.359 0.207 7.122
250 1HB CYS 36 1HB CYS 36 3.381 2.459 5.313
251 2HB CYS 36 2HB CYS 36 1.743 2.123 5.878
252 HA PRO 37 HA PRO 37 0.072 -2.171 5.534
253 1HB PRO 37 1HB PRO 37 -1.856 -1.806 7.434
254 2HB PRO 37 2HB PRO 37 -0.509 -2.928 7.630
255 1HG PRO 37 1HG PRO 37 -0.938 -0.255 8.804
256 2HG PRO 37 2HG PRO 37 0.161 -1.565 9.366
257 1HD PRO 37 1HD PRO 37 0.832 0.852 7.985
258 2HD PRO 37 2HD PRO 37 1.929 -0.480 8.374
259 H LEU 38 H LEU 38 -1.124 -1.928 3.764
260 HA LEU 38 HA LEU 38 -2.447 0.665 3.552
261 1HB LEU 38 1HB LEU 38 -2.005 -1.420 1.426
262 2HB LEU 38 2HB LEU 38 -2.522 0.259 1.199
263 HG LEU 38 HG LEU 38 -0.051 0.367 2.558
264 1HD1 LEU 38 1HD1 LEU 38 1.316 -0.841 0.682
265 2HD1 LEU 38 2HD1 LEU 38 0.704 -1.756 2.082
266 3HD1 LEU 38 3HD1 LEU 38 -0.152 -1.835 0.524
267 1HD2 LEU 38 1HD2 LEU 38 -1.296 1.627 0.471
268 2HD2 LEU 38 2HD2 LEU 38 0.386 1.901 0.986
269 3HD2 LEU 38 3HD2 LEU 38 0.036 0.781 -0.351
270 H TYR 39 H TYR 39 -3.714 -0.768 5.446
271 HA TYR 39 HA TYR 39 -6.300 -0.861 4.709
272 1HB TYR 39 1HB TYR 39 -4.730 -3.061 3.607
273 2HB TYR 39 2HB TYR 39 -5.843 -3.738 4.800
274 HD1 TYR 39 1HD TYR 39 -8.348 -2.669 4.553
275 HD2 TYR 39 2HD TYR 39 -5.454 -3.046 1.423
276 HE1 TYR 39 1HE TYR 39 -10.205 -2.611 2.819
277 HE2 TYR 39 2HE TYR 39 -7.323 -2.986 -0.301
278 HH TYR 39 HH TYR 39 -10.700 -3.003 0.700
279 HA PRO 40 HA PRO 40 -5.605 -3.439 8.607
280 1HB PRO 40 1HB PRO 40 -3.116 -4.390 9.215
281 2HB PRO 40 2HB PRO 40 -4.338 -5.349 8.383
282 1HG PRO 40 1HG PRO 40 -1.942 -3.997 7.319
283 2HG PRO 40 2HG PRO 40 -2.890 -5.341 6.588
284 1HD PRO 40 1HD PRO 40 -2.877 -2.570 5.864
285 2HD PRO 40 2HD PRO 40 -3.947 -3.823 5.221
286 H GLY 41 H GLY 41 -5.161 -2.914 10.830
287 1HA GLY 41 1HA GLY 41 -4.091 -0.200 10.953
288 2HA GLY 41 2HA GLY 41 -5.022 -1.038 12.178
Start of MODEL 18
1 H CYS 1 H CYS 1 -4.262 -3.410 2.254
2 HA CYS 1 HA CYS 1 -2.717 -5.364 0.742
3 1HB CYS 1 1HB CYS 1 -1.357 -3.636 0.544
4 2HB CYS 1 2HB CYS 1 -2.195 -2.711 1.793
5 H THR 2 H THR 2 -1.413 -6.941 1.872
6 HA THR 2 HA THR 2 -1.213 -7.050 4.670
7 HB THR 2 HB THR 2 -3.578 -7.523 4.755
8 HG1 THR 2 1HG THR 2 -3.397 -9.789 5.427
9 1HG2 THR 2 1HG2 THR 2 -3.221 -8.533 2.116
10 2HG2 THR 2 2HG2 THR 2 -3.656 -9.943 3.111
11 3HG2 THR 2 3HG2 THR 2 -4.732 -8.527 3.056
12 H THR 3 H THR 3 0.300 -7.328 2.110
13 HA THR 3 HA THR 3 1.033 -10.142 2.134
14 HB THR 3 HB THR 3 1.969 -7.736 0.483
15 HG1 THR 3 1HG THR 3 0.081 -8.263 -0.539
16 1HG2 THR 3 1HG2 THR 3 2.294 -10.747 0.008
17 2HG2 THR 3 2HG2 THR 3 2.816 -9.449 -1.093
18 3HG2 THR 3 3HG2 THR 3 3.616 -9.653 0.484
19 H GLY 4 H GLY 4 3.452 -7.607 1.671
20 1HA GLY 4 1HA GLY 4 4.709 -8.446 4.214
21 2HA GLY 4 2HA GLY 4 5.604 -8.309 2.713
22 HA PRO 5 HA PRO 5 6.244 -4.204 4.121
23 1HB PRO 5 1HB PRO 5 8.156 -3.519 2.294
24 2HB PRO 5 2HB PRO 5 8.520 -4.345 3.807
25 1HG PRO 5 1HG PRO 5 8.377 -5.401 1.056
26 2HG PRO 5 2HG PRO 5 9.204 -6.111 2.491
27 1HD PRO 5 1HD PRO 5 6.740 -6.917 1.275
28 2HD PRO 5 2HD PRO 5 7.429 -7.545 2.777
29 H CYS 6 H CYS 6 4.359 -5.193 1.828
30 HA CYS 6 HA CYS 6 2.872 -4.194 0.558
31 1HB CYS 6 1HB CYS 6 2.136 -2.053 0.967
32 2HB CYS 6 2HB CYS 6 2.845 -2.535 2.510
33 H CYS 7 H CYS 7 5.877 -2.134 0.657
34 HA CYS 7 HA CYS 7 5.833 -1.258 -1.917
35 1HB CYS 7 1HB CYS 7 7.977 -1.771 0.076
36 2HB CYS 7 2HB CYS 7 8.470 -1.466 -1.591
37 H ARG 8 H ARG 8 4.982 -2.959 -3.291
38 HA ARG 8 HA ARG 8 5.498 -4.320 -4.969
39 1HB ARG 8 1HB ARG 8 7.936 -4.023 -4.692
40 2HB ARG 8 2HB ARG 8 7.948 -5.176 -3.346
41 1HG ARG 8 1HG ARG 8 8.700 -6.209 -5.474
42 2HG ARG 8 2HG ARG 8 7.226 -6.982 -4.867
43 1HD ARG 8 1HD ARG 8 6.096 -6.422 -6.745
44 2HD ARG 8 2HD ARG 8 6.567 -4.722 -6.599
45 HE ARG 8 HE ARG 8 8.866 -5.862 -7.539
46 1HH1 ARG 8 2HH2 ARG 8 5.506 -6.149 -8.626
47 2HH1 ARG 8 1HH2 ARG 8 5.935 -6.437 -10.280
48 1HH2 ARG 8 2HH1 ARG 8 9.419 -6.235 -9.687
49 2HH2 ARG 8 1HH1 ARG 8 8.173 -6.487 -10.891
50 H GLN 9 H GLN 9 4.920 -4.881 -1.691
51 HA GLN 9 HA GLN 9 3.656 -7.371 -2.313
52 1HB GLN 9 1HB GLN 9 6.089 -7.175 -0.596
53 2HB GLN 9 2HB GLN 9 4.784 -8.210 0.009
54 1HG GLN 9 1HG GLN 9 4.812 -9.118 -2.496
55 2HG GLN 9 2HG GLN 9 6.465 -8.488 -2.484
56 1HE2 GLN 9 1HE2 GLN 9 7.916 -9.226 -0.835
57 2HE2 GLN 9 2HE2 GLN 9 7.757 -10.811 -0.155
58 H CYS 10 H CYS 10 1.810 -5.901 -1.965
59 HA CYS 10 HA CYS 10 0.246 -6.115 -0.035
60 1HB CYS 10 1HB CYS 10 2.405 -5.699 1.452
61 2HB CYS 10 2HB CYS 10 1.870 -4.021 1.328
62 H LYS 11 H LYS 11 2.300 -3.222 -0.871
63 HA LYS 11 HA LYS 11 0.039 -1.532 -1.153
64 1HB LYS 11 1HB LYS 11 1.545 0.147 -1.486
65 2HB LYS 11 2HB LYS 11 2.556 -1.008 -0.601
66 1HG LYS 11 1HG LYS 11 4.002 -0.815 -2.329
67 2HG LYS 11 2HG LYS 11 2.864 -1.809 -3.257
68 1HD LYS 11 1HD LYS 11 1.671 0.505 -3.707
69 2HD LYS 11 2HD LYS 11 3.242 1.195 -3.267
70 1HE LYS 11 1HE LYS 11 3.264 0.918 -5.647
71 2HE LYS 11 2HE LYS 11 4.276 -0.385 -5.006
72 1HZ LYS 11 1HZ LYS 11 2.900 -1.591 -6.361
73 2HZ LYS 11 2HZ LYS 11 1.920 -1.600 -5.061
74 3HZ LYS 11 3HZ LYS 11 1.679 -0.495 -6.255
75 H LEU 12 H LEU 12 -0.137 -4.051 -2.663
76 HA LEU 12 HA LEU 12 0.481 -3.842 -5.315
77 1HB LEU 12 1HB LEU 12 -1.131 -5.489 -5.700
78 2HB LEU 12 2HB LEU 12 -0.469 -5.795 -4.085
79 HG LEU 12 HG LEU 12 -2.607 -4.369 -3.369
80 1HD1 LEU 12 1HD1 LEU 12 -3.893 -3.848 -5.120
81 2HD1 LEU 12 2HD1 LEU 12 -3.083 -5.021 -6.186
82 3HD1 LEU 12 3HD1 LEU 12 -4.386 -5.557 -5.099
83 1HD2 LEU 12 1HD2 LEU 12 -1.837 -6.966 -3.151
84 2HD2 LEU 12 2HD2 LEU 12 -3.349 -6.298 -2.488
85 3HD2 LEU 12 3HD2 LEU 12 -3.361 -7.139 -4.056
86 H LYS 13 H LYS 13 -1.663 -1.863 -3.435
87 HA LYS 13 HA LYS 13 -3.341 -1.095 -5.614
88 1HB LYS 13 1HB LYS 13 -4.343 0.397 -4.080
89 2HB LYS 13 2HB LYS 13 -3.989 -1.089 -3.181
90 1HG LYS 13 1HG LYS 13 -2.039 1.231 -3.231
91 2HG LYS 13 2HG LYS 13 -3.392 1.212 -2.087
92 1HD LYS 13 1HD LYS 13 -1.021 -0.656 -2.291
93 2HD LYS 13 2HD LYS 13 -1.614 0.224 -0.870
94 1HE LYS 13 1HE LYS 13 -2.872 -2.193 -2.231
95 2HE LYS 13 2HE LYS 13 -2.186 -2.128 -0.602
96 1HZ LYS 13 1HZ LYS 13 -4.245 -0.175 -0.999
97 2HZ LYS 13 2HZ LYS 13 -4.806 -1.682 -1.254
98 3HZ LYS 13 3HZ LYS 13 -4.064 -1.321 0.167
99 HA PRO 14 HA PRO 14 -1.092 2.276 -7.139
100 1HB PRO 14 1HB PRO 14 -2.759 4.440 -7.138
101 2HB PRO 14 2HB PRO 14 -2.849 3.153 -8.339
102 1HG PRO 14 1HG PRO 14 -4.570 3.690 -6.003
103 2HG PRO 14 2HG PRO 14 -4.934 2.702 -7.464
104 1HD PRO 14 1HD PRO 14 -4.276 1.802 -4.826
105 2HD PRO 14 2HD PRO 14 -4.470 0.795 -6.266
106 H ALA 15 H ALA 15 -0.688 1.777 -4.337
107 HA ALA 15 HA ALA 15 -0.027 2.838 -2.459
108 1HB ALA 15 1HB ALA 15 1.832 4.592 -3.881
109 2HB ALA 15 2HB ALA 15 2.165 3.170 -2.864
110 3HB ALA 15 3HB ALA 15 1.785 2.959 -4.590
111 H GLY 16 H GLY 16 1.197 5.545 -2.323
112 1HA GLY 16 1HA GLY 16 -0.338 7.618 -3.220
113 2HA GLY 16 2HA GLY 16 -1.218 7.014 -1.831
114 H THR 17 H THR 17 0.220 6.576 0.217
115 HA THR 17 HA THR 17 2.263 8.691 0.384
116 HB THR 17 HB THR 17 0.433 7.920 2.685
117 HG1 THR 17 1HG THR 17 0.066 9.794 0.453
118 1HG2 THR 17 1HG2 THR 17 0.865 10.739 2.362
119 2HG2 THR 17 2HG2 THR 17 1.513 9.688 3.647
120 3HG2 THR 17 3HG2 THR 17 2.448 9.950 2.156
121 H THR 18 H THR 18 2.330 7.670 3.363
122 HA THR 18 HA THR 18 3.844 5.211 2.814
123 HB THR 18 HB THR 18 5.130 7.577 3.097
124 HG1 THR 18 1HG THR 18 6.454 5.786 2.964
125 1HG2 THR 18 1HG2 THR 18 5.249 6.508 5.927
126 2HG2 THR 18 2HG2 THR 18 5.683 8.124 5.320
127 3HG2 THR 18 3HG2 THR 18 3.971 7.677 5.514
128 H CYS 19 H CYS 19 1.214 6.533 4.269
129 HA CYS 19 HA CYS 19 0.662 4.383 5.825
130 1HB CYS 19 1HB CYS 19 2.641 5.958 7.110
131 2HB CYS 19 2HB CYS 19 1.135 6.167 8.008
132 H TRP 20 H TRP 20 -0.579 6.196 4.011
133 HA TRP 20 HA TRP 20 -2.522 7.501 5.793
134 1HB TRP 20 1HB TRP 20 -0.890 8.936 4.318
135 2HB TRP 20 2HB TRP 20 -2.021 8.519 3.029
136 HD1 TRP 20 HD TRP 20 -3.364 9.163 6.578
137 HE1 TRP 20 1HE TRP 20 -4.823 11.361 6.669
138 HE3 TRP 20 3HE TRP 20 -2.257 10.719 1.866
139 HZ2 TRP 20 2HZ TRP 20 -5.338 13.456 4.799
140 HZ3 TRP 20 3HZ TRP 20 -3.280 12.851 1.076
141 HH2 TRP 20 HH TRP 20 -4.773 14.204 2.458
142 H LYS 21 H LYS 21 -4.110 5.907 5.817
143 HA LYS 21 HA LYS 21 -4.720 4.495 3.382
144 1HB LYS 21 1HB LYS 21 -6.432 3.392 4.861
145 2HB LYS 21 2HB LYS 21 -4.742 3.185 5.355
146 1HG LYS 21 1HG LYS 21 -5.053 4.341 7.289
147 2HG LYS 21 2HG LYS 21 -6.050 5.582 6.510
148 1HD LYS 21 1HD LYS 21 -7.129 2.792 6.966
149 2HD LYS 21 2HD LYS 21 -7.140 3.974 8.286
150 1HE LYS 21 1HE LYS 21 -9.033 4.849 7.434
151 2HE LYS 21 2HE LYS 21 -8.151 5.313 5.970
152 1HZ LYS 21 1HZ LYS 21 -8.908 2.520 6.097
153 2HZ LYS 21 2HZ LYS 21 -10.175 3.541 6.020
154 3HZ LYS 21 3HZ LYS 21 -9.002 3.610 4.869
155 H THR 22 H THR 22 -6.287 5.003 1.928
156 HA THR 22 HA THR 22 -8.608 5.755 1.738
157 HB THR 22 HB THR 22 -8.484 6.954 3.968
158 HG1 THR 22 1HG THR 22 -10.202 7.499 2.527
159 1HG2 THR 22 1HG2 THR 22 -7.249 8.878 4.275
160 2HG2 THR 22 2HG2 THR 22 -6.273 8.265 2.918
161 3HG2 THR 22 3HG2 THR 22 -7.569 9.448 2.619
162 H SER 23 H SER 23 -8.478 8.769 1.065
163 HA SER 23 HA SER 23 -8.121 9.949 -0.721
164 1HB SER 23 1HB SER 23 -5.505 8.690 -0.174
165 2HB SER 23 2HB SER 23 -5.680 9.264 -1.842
166 HG SER 23 HG SER 23 -5.777 10.738 0.623
167 H LEU 24 H LEU 24 -9.173 7.026 -0.875
168 HA LEU 24 HA LEU 24 -10.340 6.473 -2.904
169 1HB LEU 24 1HB LEU 24 -8.985 7.899 -4.321
170 2HB LEU 24 2HB LEU 24 -7.608 6.794 -4.156
171 HG LEU 24 HG LEU 24 -9.015 5.027 -5.260
172 1HD1 LEU 24 1HD1 LEU 24 -10.940 5.999 -6.666
173 2HD1 LEU 24 2HD1 LEU 24 -11.233 5.674 -4.941
174 3HD1 LEU 24 3HD1 LEU 24 -10.932 7.338 -5.495
175 1HD2 LEU 24 1HD2 LEU 24 -8.536 5.752 -7.460
176 2HD2 LEU 24 2HD2 LEU 24 -8.669 7.469 -7.008
177 3HD2 LEU 24 3HD2 LEU 24 -7.302 6.495 -6.413
178 H THR 25 H THR 25 -7.821 5.506 -0.879
179 HA THR 25 HA THR 25 -8.558 2.999 -0.428
180 HB THR 25 HB THR 25 -7.290 3.201 -3.131
181 HG1 THR 25 1HG THR 25 -8.843 1.221 -1.617
182 1HG2 THR 25 1HG2 THR 25 -6.392 0.869 -2.940
183 2HG2 THR 25 2HG2 THR 25 -5.479 1.995 -1.908
184 3HG2 THR 25 3HG2 THR 25 -6.690 0.909 -1.186
185 H SER 26 H SER 26 -7.080 1.796 0.878
186 HA SER 26 HA SER 26 -5.549 3.219 2.493
187 1HB SER 26 1HB SER 26 -4.648 0.457 1.629
188 2HB SER 26 2HB SER 26 -4.571 1.173 3.249
189 HG SER 26 HG SER 26 -7.068 1.235 2.943
190 H HIS 27 H HIS 27 -4.038 4.750 1.883
191 HA HIS 27 HA HIS 27 -2.084 3.921 -0.129
192 1HB HIS 27 1HB HIS 27 -3.245 6.569 0.665
193 2HB HIS 27 2HB HIS 27 -1.653 6.504 -0.100
194 HD1 HIS 27 1HD HIS 27 -3.784 3.837 -1.404
195 HD2 HIS 27 2HD HIS 27 -3.207 7.913 -2.211
196 HE1 HIS 27 1HE HIS 27 -4.784 4.257 -3.713
197 HE2 HIS 27 2HE HIS 27 -4.403 6.783 -4.165
198 H TYR 28 H TYR 28 -1.876 2.878 2.514
199 HA TYR 28 HA TYR 28 -0.079 4.531 4.012
200 1HB TYR 28 1HB TYR 28 -1.624 2.034 4.153
201 2HB TYR 28 2HB TYR 28 0.021 1.735 4.723
202 HD1 TYR 28 1HD TYR 28 -2.535 4.468 5.123
203 HD2 TYR 28 2HD TYR 28 0.234 1.817 7.023
204 HE1 TYR 28 1HE TYR 28 -3.156 5.433 7.392
205 HE2 TYR 28 2HE TYR 28 -0.396 2.791 9.284
206 HH TYR 28 HH TYR 28 -2.715 5.468 9.511
207 H CYS 29 H CYS 29 0.757 4.007 1.228
208 HA CYS 29 HA CYS 29 3.421 3.308 1.781
209 1HB CYS 29 1HB CYS 29 2.184 1.046 1.709
210 2HB CYS 29 2HB CYS 29 2.105 1.307 -0.036
211 H THR 30 H THR 30 4.576 3.050 -0.577
212 HA THR 30 HA THR 30 3.148 4.823 -2.445
213 HB THR 30 HB THR 30 5.754 5.554 -2.792
214 HG1 THR 30 1HG THR 30 6.860 5.073 -0.914
215 1HG2 THR 30 1HG2 THR 30 4.841 7.528 -2.096
216 2HG2 THR 30 2HG2 THR 30 3.476 6.652 -1.362
217 3HG2 THR 30 3HG2 THR 30 4.953 6.955 -0.414
218 H GLY 31 H GLY 31 5.449 2.160 -1.867
219 1HA GLY 31 1HA GLY 31 5.220 0.296 -3.406
220 2HA GLY 31 2HA GLY 31 5.142 1.448 -4.723
221 H LYS 32 H LYS 32 7.190 -0.570 -2.866
222 HA LYS 32 HA LYS 32 9.340 -1.062 -3.239
223 1HB LYS 32 1HB LYS 32 9.759 1.496 -4.769
224 2HB LYS 32 2HB LYS 32 10.672 -0.019 -4.875
225 1HG LYS 32 1HG LYS 32 7.940 0.663 -5.964
226 2HG LYS 32 2HG LYS 32 9.305 -0.100 -6.796
227 1HD LYS 32 1HD LYS 32 8.845 -1.971 -4.896
228 2HD LYS 32 2HD LYS 32 7.206 -1.306 -5.026
229 1HE LYS 32 1HE LYS 32 7.016 -2.803 -6.739
230 2HE LYS 32 2HE LYS 32 7.866 -1.567 -7.680
231 1HZ LYS 32 1HZ LYS 32 9.871 -2.948 -6.463
232 2HZ LYS 32 2HZ LYS 32 8.809 -4.136 -6.797
233 3HZ LYS 32 3HZ LYS 32 9.336 -3.153 -8.005
234 H SER 33 H SER 33 8.816 2.500 -2.760
235 HA SER 33 HA SER 33 10.720 2.287 -0.564
236 1HB SER 33 1HB SER 33 10.059 4.426 -2.543
237 2HB SER 33 2HB SER 33 10.486 4.966 -0.908
238 HG SER 33 HG SER 33 12.172 2.994 -2.008
239 H CYS 34 H CYS 34 9.107 1.478 0.946
240 HA CYS 34 HA CYS 34 7.711 3.556 2.252
241 1HB CYS 34 1HB CYS 34 5.453 2.739 2.033
242 2HB CYS 34 2HB CYS 34 6.099 3.223 0.463
243 H ASP 35 H ASP 35 5.750 1.524 3.395
244 HA ASP 35 HA ASP 35 6.633 -0.791 4.191
245 1HB ASP 35 1HB ASP 35 8.374 1.306 5.350
246 2HB ASP 35 2HB ASP 35 7.732 0.179 6.555
247 HD2 ASP 35 HD ASP 35 8.039 -2.110 5.828
248 H CYS 36 H CYS 36 4.171 -0.191 4.184
249 HA CYS 36 HA CYS 36 3.312 -0.045 6.891
250 1HB CYS 36 1HB CYS 36 3.343 2.383 5.320
251 2HB CYS 36 2HB CYS 36 1.696 1.952 5.784
252 HA PRO 37 HA PRO 37 0.214 -2.364 4.887
253 1HB PRO 37 1HB PRO 37 -1.721 -2.425 6.814
254 2HB PRO 37 2HB PRO 37 -0.313 -3.484 6.827
255 1HG PRO 37 1HG PRO 37 -0.887 -1.070 8.420
256 2HG PRO 37 2HG PRO 37 0.290 -2.389 8.766
257 1HD PRO 37 1HD PRO 37 0.813 0.257 7.800
258 2HD PRO 37 2HD PRO 37 1.987 -1.056 7.971
259 H LEU 38 H LEU 38 -1.400 -2.185 3.406
260 HA LEU 38 HA LEU 38 -2.807 0.389 3.587
261 1HB LEU 38 1HB LEU 38 -2.335 -1.039 1.008
262 2HB LEU 38 2HB LEU 38 -2.658 0.679 1.305
263 HG LEU 38 HG LEU 38 -0.257 0.374 2.555
264 1HD1 LEU 38 1HD1 LEU 38 0.591 -1.634 2.030
265 2HD1 LEU 38 2HD1 LEU 38 -0.525 -1.865 0.664
266 3HD1 LEU 38 3HD1 LEU 38 0.948 -0.889 0.453
267 1HD2 LEU 38 1HD2 LEU 38 -1.278 1.786 0.416
268 2HD2 LEU 38 2HD2 LEU 38 0.353 1.958 1.108
269 3HD2 LEU 38 3HD2 LEU 38 0.091 0.901 -0.300
270 H TYR 39 H TYR 39 -4.203 -1.055 5.063
271 HA TYR 39 HA TYR 39 -6.422 -1.942 3.466
272 1HB TYR 39 1HB TYR 39 -5.531 -4.109 3.503
273 2HB TYR 39 2HB TYR 39 -4.405 -3.714 4.808
274 HD1 TYR 39 1HD TYR 39 -8.040 -4.380 4.176
275 HD2 TYR 39 2HD TYR 39 -4.780 -4.595 6.939
276 HE1 TYR 39 1HE TYR 39 -9.502 -5.666 5.812
277 HE2 TYR 39 2HE TYR 39 -6.252 -5.879 8.565
278 HH TYR 39 HH TYR 39 -9.622 -6.649 7.724
279 HA PRO 40 HA PRO 40 -8.229 -0.336 7.085
280 1HB PRO 40 1HB PRO 40 -10.846 -0.621 6.364
281 2HB PRO 40 2HB PRO 40 -9.857 0.752 5.874
282 1HG PRO 40 1HG PRO 40 -10.714 -1.613 4.334
283 2HG PRO 40 2HG PRO 40 -10.134 -0.024 3.720
284 1HD PRO 40 1HD PRO 40 -8.728 -2.515 3.813
285 2HD PRO 40 2HD PRO 40 -8.062 -0.945 3.348
286 H GLY 41 H GLY 41 -7.669 -1.605 8.788
287 1HA GLY 41 1HA GLY 41 -8.571 -4.278 8.981
288 2HA GLY 41 2HA GLY 41 -7.864 -3.302 10.253
Start of MODEL 19
1 H CYS 1 H CYS 1 -2.230 -3.756 6.034
2 HA CYS 1 HA CYS 1 -0.120 -3.805 4.584
3 1HB CYS 1 1HB CYS 1 1.043 -4.810 6.687
4 2HB CYS 1 2HB CYS 1 0.385 -6.342 6.101
5 H THR 2 H THR 2 0.173 -6.482 3.584
6 HA THR 2 HA THR 2 -2.357 -7.789 3.499
7 HB THR 2 HB THR 2 -3.283 -6.817 1.639
8 HG1 THR 2 1HG THR 2 -1.971 -7.671 0.045
9 1HG2 THR 2 1HG2 THR 2 -2.636 -4.662 2.574
10 2HG2 THR 2 2HG2 THR 2 -0.945 -4.892 2.069
11 3HG2 THR 2 3HG2 THR 2 -2.210 -4.619 0.846
12 H THR 3 H THR 3 0.986 -7.572 3.180
13 HA THR 3 HA THR 3 1.138 -10.358 2.521
14 HB THR 3 HB THR 3 2.299 -8.257 0.615
15 HG1 THR 3 1HG THR 3 0.352 -8.665 -0.350
16 1HG2 THR 3 1HG2 THR 3 3.666 -10.410 0.874
17 2HG2 THR 3 2HG2 THR 3 2.213 -11.306 0.372
18 3HG2 THR 3 3HG2 THR 3 2.985 -10.163 -0.752
19 H GLY 4 H GLY 4 3.703 -7.977 1.859
20 1HA GLY 4 1HA GLY 4 4.980 -8.805 4.399
21 2HA GLY 4 2HA GLY 4 5.847 -8.704 2.880
22 HA PRO 5 HA PRO 5 6.635 -4.582 4.088
23 1HB PRO 5 1HB PRO 5 8.203 -3.865 1.969
24 2HB PRO 5 2HB PRO 5 8.824 -4.714 3.382
25 1HG PRO 5 1HG PRO 5 8.207 -5.728 0.682
26 2HG PRO 5 2HG PRO 5 9.268 -6.458 1.940
27 1HD PRO 5 1HD PRO 5 6.629 -7.251 1.156
28 2HD PRO 5 2HD PRO 5 7.569 -7.899 2.507
29 H CYS 6 H CYS 6 4.534 -5.594 1.873
30 HA CYS 6 HA CYS 6 2.860 -4.599 0.853
31 1HB CYS 6 1HB CYS 6 1.970 -2.661 1.624
32 2HB CYS 6 2HB CYS 6 3.010 -3.096 2.984
33 H CYS 7 H CYS 7 5.684 -2.294 0.906
34 HA CYS 7 HA CYS 7 5.339 -1.191 -1.550
35 1HB CYS 7 1HB CYS 7 7.511 -1.497 0.349
36 2HB CYS 7 2HB CYS 7 8.101 -1.462 -1.316
37 H ARG 8 H ARG 8 4.902 -2.330 -3.420
38 HA ARG 8 HA ARG 8 5.216 -3.635 -5.119
39 1HB ARG 8 1HB ARG 8 7.548 -3.200 -5.264
40 2HB ARG 8 2HB ARG 8 7.911 -4.107 -3.786
41 1HG ARG 8 1HG ARG 8 7.916 -6.125 -4.874
42 2HG ARG 8 2HG ARG 8 6.626 -5.658 -5.996
43 1HD ARG 8 1HD ARG 8 8.142 -5.129 -7.583
44 2HD ARG 8 2HD ARG 8 9.001 -4.042 -6.480
45 HE ARG 8 HE ARG 8 9.710 -6.656 -5.713
46 1HH1 ARG 8 2HH2 ARG 8 10.030 -4.662 -8.626
47 2HH1 ARG 8 1HH2 ARG 8 11.478 -5.451 -9.156
48 1HH2 ARG 8 2HH1 ARG 8 11.589 -7.678 -6.407
49 2HH2 ARG 8 1HH1 ARG 8 12.374 -7.178 -7.890
50 H GLN 9 H GLN 9 3.964 -4.508 -2.541
51 HA GLN 9 HA GLN 9 3.772 -7.268 -3.215
52 1HB GLN 9 1HB GLN 9 5.095 -6.355 -0.661
53 2HB GLN 9 2HB GLN 9 4.166 -7.863 -0.674
54 1HG GLN 9 1HG GLN 9 6.544 -7.149 -2.441
55 2HG GLN 9 2HG GLN 9 6.528 -8.346 -1.137
56 1HE2 GLN 9 1HE2 GLN 9 5.203 -10.218 -1.366
57 2HE2 GLN 9 2HE2 GLN 9 4.827 -10.866 -2.926
58 H CYS 10 H CYS 10 3.167 -5.744 -0.006
59 HA CYS 10 HA CYS 10 0.345 -6.260 -0.415
60 1HB CYS 10 1HB CYS 10 0.162 -6.509 1.791
61 2HB CYS 10 2HB CYS 10 1.908 -6.757 1.710
62 H LYS 11 H LYS 11 1.642 -4.145 -1.971
63 HA LYS 11 HA LYS 11 0.060 -1.910 -0.987
64 1HB LYS 11 1HB LYS 11 1.737 -0.487 -0.641
65 2HB LYS 11 2HB LYS 11 2.743 -1.935 -0.467
66 1HG LYS 11 1HG LYS 11 3.977 -1.168 -2.189
67 2HG LYS 11 2HG LYS 11 2.593 -1.476 -3.253
68 1HD LYS 11 1HD LYS 11 3.330 1.102 -1.821
69 2HD LYS 11 2HD LYS 11 3.230 0.833 -3.570
70 1HE LYS 11 1HE LYS 11 0.950 1.065 -3.600
71 2HE LYS 11 2HE LYS 11 0.734 0.261 -2.036
72 1HZ LYS 11 1HZ LYS 11 0.550 2.932 -2.437
73 2HZ LYS 11 2HZ LYS 11 0.823 2.250 -0.984
74 3HZ LYS 11 3HZ LYS 11 2.092 2.763 -1.893
75 H LEU 12 H LEU 12 -0.238 -4.001 -3.080
76 HA LEU 12 HA LEU 12 0.487 -3.261 -5.582
77 1HB LEU 12 1HB LEU 12 -1.339 -4.516 -6.374
78 2HB LEU 12 2HB LEU 12 -0.752 -5.295 -4.894
79 HG LEU 12 HG LEU 12 -2.911 -3.410 -4.368
80 1HD1 LEU 12 1HD1 LEU 12 -3.833 -5.797 -5.932
81 2HD1 LEU 12 2HD1 LEU 12 -4.672 -4.267 -5.581
82 3HD1 LEU 12 3HD1 LEU 12 -3.360 -4.306 -6.783
83 1HD2 LEU 12 1HD2 LEU 12 -2.570 -4.846 -2.630
84 2HD2 LEU 12 2HD2 LEU 12 -3.857 -5.729 -3.487
85 3HD2 LEU 12 3HD2 LEU 12 -2.157 -6.216 -3.689
86 H LYS 13 H LYS 13 -1.493 -1.488 -3.345
87 HA LYS 13 HA LYS 13 -3.275 -0.133 -4.813
88 1HB LYS 13 1HB LYS 13 -1.383 1.078 -2.786
89 2HB LYS 13 2HB LYS 13 -2.952 1.741 -3.276
90 1HG LYS 13 1HG LYS 13 -3.564 0.588 -1.361
91 2HG LYS 13 2HG LYS 13 -3.815 -0.686 -2.567
92 1HD LYS 13 1HD LYS 13 -1.058 -0.746 -1.778
93 2HD LYS 13 2HD LYS 13 -2.028 -0.668 -0.298
94 1HE LYS 13 1HE LYS 13 -2.783 -2.582 -2.513
95 2HE LYS 13 2HE LYS 13 -1.478 -3.012 -1.397
96 1HZ LYS 13 1HZ LYS 13 -4.323 -2.510 -0.760
97 2HZ LYS 13 2HZ LYS 13 -3.439 -3.834 -0.416
98 3HZ LYS 13 3HZ LYS 13 -3.139 -2.427 0.381
99 HA PRO 14 HA PRO 14 -1.229 2.220 -7.796
100 1HB PRO 14 1HB PRO 14 -2.704 4.515 -7.932
101 2HB PRO 14 2HB PRO 14 -3.202 3.004 -8.689
102 1HG PRO 14 1HG PRO 14 -4.158 4.290 -6.213
103 2HG PRO 14 2HG PRO 14 -4.977 3.040 -7.217
104 1HD PRO 14 1HD PRO 14 -3.652 2.715 -4.700
105 2HD PRO 14 2HD PRO 14 -4.302 1.427 -5.723
106 H ALA 15 H ALA 15 -0.108 2.365 -5.139
107 HA ALA 15 HA ALA 15 1.420 3.527 -4.042
108 1HB ALA 15 1HB ALA 15 2.948 4.922 -5.349
109 2HB ALA 15 2HB ALA 15 2.520 3.465 -6.277
110 3HB ALA 15 3HB ALA 15 1.760 5.024 -6.673
111 H GLY 16 H GLY 16 0.659 4.756 -2.393
112 1HA GLY 16 1HA GLY 16 -0.928 7.142 -3.062
113 2HA GLY 16 2HA GLY 16 -0.920 6.282 -1.536
114 H THR 17 H THR 17 0.857 6.558 -0.035
115 HA THR 17 HA THR 17 2.993 8.351 -0.714
116 HB THR 17 HB THR 17 0.702 9.215 1.123
117 HG1 THR 17 1HG THR 17 0.290 10.313 -0.751
118 1HG2 THR 17 1HG2 THR 17 2.756 11.220 0.604
119 2HG2 THR 17 2HG2 THR 17 2.120 10.667 2.172
120 3HG2 THR 17 3HG2 THR 17 3.484 9.811 1.414
121 H THR 18 H THR 18 2.040 8.549 2.579
122 HA THR 18 HA THR 18 3.423 6.091 3.300
123 HB THR 18 HB THR 18 4.467 8.912 3.686
124 HG1 THR 18 1HG THR 18 5.636 6.244 3.351
125 1HG2 THR 18 1HG2 THR 18 4.927 8.460 5.893
126 2HG2 THR 18 2HG2 THR 18 4.432 6.759 5.725
127 3HG2 THR 18 3HG2 THR 18 6.078 7.258 5.263
128 H CYS 19 H CYS 19 1.928 5.117 4.523
129 HA CYS 19 HA CYS 19 0.221 4.887 5.919
130 1HB CYS 19 1HB CYS 19 2.143 6.544 7.545
131 2HB CYS 19 2HB CYS 19 0.698 5.798 8.235
132 H TRP 20 H TRP 20 -1.439 6.019 4.722
133 HA TRP 20 HA TRP 20 -2.205 8.531 5.993
134 1HB TRP 20 1HB TRP 20 -0.870 8.839 3.784
135 2HB TRP 20 2HB TRP 20 -2.365 8.315 3.006
136 HD1 TRP 20 HD TRP 20 -1.436 11.007 5.706
137 HE1 TRP 20 1HE TRP 20 -2.800 13.227 5.290
138 HE3 TRP 20 3HE TRP 20 -4.043 9.277 1.699
139 HZ2 TRP 20 2HZ TRP 20 -4.772 13.994 3.374
140 HZ3 TRP 20 3HZ TRP 20 -5.669 10.824 0.613
141 HH2 TRP 20 HH TRP 20 -6.051 13.111 1.390
142 H LYS 21 H LYS 21 -2.973 5.939 3.566
143 HA LYS 21 HA LYS 21 -4.765 4.663 3.324
144 1HB LYS 21 1HB LYS 21 -5.097 3.972 5.439
145 2HB LYS 21 2HB LYS 21 -5.125 5.611 6.112
146 1HG LYS 21 1HG LYS 21 -7.342 4.713 6.341
147 2HG LYS 21 2HG LYS 21 -7.419 5.896 5.022
148 1HD LYS 21 1HD LYS 21 -7.141 4.004 3.392
149 2HD LYS 21 2HD LYS 21 -7.211 2.861 4.745
150 1HE LYS 21 1HE LYS 21 -9.392 4.870 4.037
151 2HE LYS 21 2HE LYS 21 -9.419 3.163 3.566
152 1HZ LYS 21 1HZ LYS 21 -10.668 3.467 5.597
153 2HZ LYS 21 2HZ LYS 21 -9.323 2.632 5.980
154 3HZ LYS 21 3HZ LYS 21 -9.400 4.243 6.300
155 H THR 22 H THR 22 -6.412 4.937 1.885
156 HA THR 22 HA THR 22 -8.387 6.885 2.076
157 HB THR 22 HB THR 22 -6.588 8.531 1.714
158 HG1 THR 22 1HG THR 22 -7.494 9.292 -0.386
159 1HG2 THR 22 1HG2 THR 22 -5.839 6.599 -0.490
160 2HG2 THR 22 2HG2 THR 22 -5.621 8.340 -0.790
161 3HG2 THR 22 3HG2 THR 22 -4.778 7.558 0.569
162 H SER 23 H SER 23 -9.268 7.292 -0.407
163 HA SER 23 HA SER 23 -10.406 6.284 -1.963
164 1HB SER 23 1HB SER 23 -7.645 5.677 -2.392
165 2HB SER 23 2HB SER 23 -8.575 4.248 -2.874
166 HG SER 23 HG SER 23 -8.234 5.883 -4.585
167 H LEU 24 H LEU 24 -10.427 5.093 0.822
168 HA LEU 24 HA LEU 24 -11.513 3.442 1.823
169 1HB LEU 24 1HB LEU 24 -13.180 3.405 0.203
170 2HB LEU 24 2HB LEU 24 -12.126 2.669 -1.016
171 HG LEU 24 HG LEU 24 -12.633 1.072 1.434
172 1HD1 LEU 24 1HD1 LEU 24 -14.818 1.169 -0.631
173 2HD1 LEU 24 2HD1 LEU 24 -14.841 0.484 1.010
174 3HD1 LEU 24 3HD1 LEU 24 -14.838 2.249 0.782
175 1HD2 LEU 24 1HD2 LEU 24 -11.529 -0.282 0.024
176 2HD2 LEU 24 2HD2 LEU 24 -13.126 -0.522 -0.722
177 3HD2 LEU 24 3HD2 LEU 24 -11.989 0.661 -1.412
178 H THR 25 H THR 25 -8.627 3.347 0.345
179 HA THR 25 HA THR 25 -8.076 0.643 1.364
180 HB THR 25 HB THR 25 -7.598 1.847 -1.346
181 HG1 THR 25 1HG THR 25 -8.719 -0.050 -1.540
182 1HG2 THR 25 1HG2 THR 25 -5.518 0.351 0.259
183 2HG2 THR 25 2HG2 THR 25 -5.752 -0.110 -1.443
184 3HG2 THR 25 3HG2 THR 25 -5.289 1.558 -1.029
185 H SER 26 H SER 26 -6.445 0.500 2.793
186 HA SER 26 HA SER 26 -5.384 2.823 3.837
187 1HB SER 26 1HB SER 26 -4.889 -0.110 4.131
188 2HB SER 26 2HB SER 26 -3.624 0.969 4.742
189 HG SER 26 HG SER 26 -4.987 0.739 6.468
190 H HIS 27 H HIS 27 -4.680 3.823 1.691
191 HA HIS 27 HA HIS 27 -2.768 2.883 0.046
192 1HB HIS 27 1HB HIS 27 -2.878 4.920 -0.824
193 2HB HIS 27 2HB HIS 27 -4.057 5.283 0.442
194 HD1 HIS 27 1HD HIS 27 -1.534 5.196 2.644
195 HD2 HIS 27 2HD HIS 27 -2.052 7.657 -0.714
196 HE1 HIS 27 1HE HIS 27 -0.112 7.275 3.054
197 HE2 HIS 27 2HE HIS 27 -0.467 8.760 0.957
198 H TYR 28 H TYR 28 -2.436 3.730 3.426
199 HA TYR 28 HA TYR 28 -0.102 4.564 4.048
200 1HB TYR 28 1HB TYR 28 -1.644 2.073 4.723
201 2HB TYR 28 2HB TYR 28 0.031 2.057 5.287
202 HD1 TYR 28 1HD TYR 28 -2.819 4.513 5.202
203 HD2 TYR 28 2HD TYR 28 0.311 2.703 7.488
204 HE1 TYR 28 1HE TYR 28 -3.501 5.883 7.233
205 HE2 TYR 28 2HE TYR 28 -0.380 4.079 9.511
206 HH TYR 28 HH TYR 28 -2.998 6.461 9.262
207 H CYS 29 H CYS 29 1.160 4.553 1.987
208 HA CYS 29 HA CYS 29 3.409 3.199 2.063
209 1HB CYS 29 1HB CYS 29 1.502 1.222 1.709
210 2HB CYS 29 2HB CYS 29 2.168 1.449 0.089
211 H THR 30 H THR 30 3.960 2.507 -0.646
212 HA THR 30 HA THR 30 2.750 4.490 -2.355
213 HB THR 30 HB THR 30 4.661 5.549 -0.826
214 HG1 THR 30 1HG THR 30 4.057 6.876 -2.508
215 1HG2 THR 30 1HG2 THR 30 6.862 5.453 -2.001
216 2HG2 THR 30 2HG2 THR 30 6.418 3.847 -1.376
217 3HG2 THR 30 3HG2 THR 30 6.217 4.216 -3.105
218 H GLY 31 H GLY 31 5.548 2.234 -1.903
219 1HA GLY 31 1HA GLY 31 5.125 0.217 -3.429
220 2HA GLY 31 2HA GLY 31 5.195 1.411 -4.710
221 H LYS 32 H LYS 32 7.014 -0.776 -2.861
222 HA LYS 32 HA LYS 32 9.169 -1.285 -2.902
223 1HB LYS 32 1HB LYS 32 9.587 -0.865 -5.100
224 2HB LYS 32 2HB LYS 32 9.127 0.843 -4.998
225 1HG LYS 32 1HG LYS 32 11.545 -0.148 -3.490
226 2HG LYS 32 2HG LYS 32 11.680 0.144 -5.233
227 1HD LYS 32 1HD LYS 32 10.399 2.428 -4.401
228 2HD LYS 32 2HD LYS 32 11.396 2.071 -2.980
229 1HE LYS 32 1HE LYS 32 13.013 3.190 -4.135
230 2HE LYS 32 2HE LYS 32 13.207 1.668 -5.017
231 1HZ LYS 32 1HZ LYS 32 12.389 4.127 -6.044
232 2HZ LYS 32 2HZ LYS 32 12.489 2.717 -6.852
233 3HZ LYS 32 3HZ LYS 32 11.088 3.124 -6.095
234 H SER 33 H SER 33 8.735 2.317 -2.764
235 HA SER 33 HA SER 33 10.625 2.314 -0.565
236 1HB SER 33 1HB SER 33 10.850 4.671 -0.925
237 2HB SER 33 2HB SER 33 10.869 3.917 -2.528
238 HG SER 33 HG SER 33 8.701 4.572 -2.845
239 H CYS 34 H CYS 34 8.955 1.229 0.844
240 HA CYS 34 HA CYS 34 7.633 3.148 2.408
241 1HB CYS 34 1HB CYS 34 5.352 2.611 2.079
242 2HB CYS 34 2HB CYS 34 6.032 3.065 0.514
243 H ASP 35 H ASP 35 5.732 1.386 3.649
244 HA ASP 35 HA ASP 35 6.454 -1.181 3.995
245 1HB ASP 35 1HB ASP 35 8.674 -0.489 4.713
246 2HB ASP 35 2HB ASP 35 7.997 0.675 5.863
247 HD2 ASP 35 HD ASP 35 8.851 -1.934 8.032
248 H CYS 36 H CYS 36 4.141 0.490 4.048
249 HA CYS 36 HA CYS 36 3.361 0.355 6.870
250 1HB CYS 36 1HB CYS 36 2.550 2.247 4.680
251 2HB CYS 36 2HB CYS 36 1.550 2.014 6.116
252 HA PRO 37 HA PRO 37 0.309 -2.471 5.576
253 1HB PRO 37 1HB PRO 37 -1.723 -2.028 7.348
254 2HB PRO 37 2HB PRO 37 -0.288 -2.973 7.742
255 1HG PRO 37 1HG PRO 37 -1.009 -0.215 8.503
256 2HG PRO 37 2HG PRO 37 0.181 -1.320 9.280
257 1HD PRO 37 1HD PRO 37 0.684 0.929 7.580
258 2HD PRO 37 2HD PRO 37 1.881 -0.221 8.190
259 H LEU 38 H LEU 38 -1.388 -2.868 4.182
260 HA LEU 38 HA LEU 38 -2.983 -0.486 3.597
261 1HB LEU 38 1HB LEU 38 -1.691 -2.189 1.475
262 2HB LEU 38 2HB LEU 38 -2.673 -0.733 1.239
263 HG LEU 38 HG LEU 38 -0.620 0.171 2.841
264 1HD1 LEU 38 1HD1 LEU 38 1.430 -0.718 2.228
265 2HD1 LEU 38 2HD1 LEU 38 0.409 -2.167 2.390
266 3HD1 LEU 38 3HD1 LEU 38 0.774 -1.511 0.777
267 1HD2 LEU 38 1HD2 LEU 38 -0.102 1.540 1.074
268 2HD2 LEU 38 2HD2 LEU 38 -0.291 0.246 -0.133
269 3HD2 LEU 38 3HD2 LEU 38 -1.728 0.991 0.604
270 H TYR 39 H TYR 39 -4.165 -2.118 5.207
271 HA TYR 39 HA TYR 39 -5.639 -4.024 3.517
272 1HB TYR 39 1HB TYR 39 -4.134 -4.317 5.897
273 2HB TYR 39 2HB TYR 39 -5.792 -4.207 6.493
274 HD1 TYR 39 1HD TYR 39 -4.628 -5.761 3.306
275 HD2 TYR 39 2HD TYR 39 -6.178 -6.414 7.239
276 HE1 TYR 39 1HE TYR 39 -4.971 -8.222 2.769
277 HE2 TYR 39 2HE TYR 39 -6.517 -8.873 6.688
278 HH TYR 39 HH TYR 39 -6.911 -10.178 4.446
279 HA PRO 40 HA PRO 40 -9.166 -1.683 4.440
280 1HB PRO 40 1HB PRO 40 -11.115 -3.483 3.794
281 2HB PRO 40 2HB PRO 40 -10.274 -2.504 2.595
282 1HG PRO 40 1HG PRO 40 -9.940 -5.352 3.287
283 2HG PRO 40 2HG PRO 40 -9.446 -4.497 1.783
284 1HD PRO 40 1HD PRO 40 -7.799 -5.373 3.954
285 2HD PRO 40 2HD PRO 40 -7.288 -4.396 2.571
286 H GLY 41 H GLY 41 -10.258 -1.027 6.200
287 1HA GLY 41 1HA GLY 41 -11.742 -2.541 7.875
288 2HA GLY 41 2HA GLY 41 -10.115 -2.809 8.470
Start of MODEL 20
1 H CYS 1 H CYS 1 -1.975 -3.138 2.803
2 HA CYS 1 HA CYS 1 -3.614 -4.397 2.020
3 1HB CYS 1 1HB CYS 1 -3.400 -5.753 0.231
4 2HB CYS 1 2HB CYS 1 -1.882 -4.861 0.094
5 H THR 2 H THR 2 -0.712 -6.180 3.235
6 HA THR 2 HA THR 2 -1.572 -7.006 5.600
7 HB THR 2 HB THR 2 -3.628 -7.969 4.833
8 HG1 THR 2 1HG THR 2 -1.623 -10.102 4.679
9 1HG2 THR 2 1HG2 THR 2 -1.909 -9.054 2.565
10 2HG2 THR 2 2HG2 THR 2 -3.426 -9.867 3.018
11 3HG2 THR 2 3HG2 THR 2 -3.454 -8.176 2.459
12 H THR 3 H THR 3 -0.029 -7.894 2.544
13 HA THR 3 HA THR 3 1.538 -10.004 3.355
14 HB THR 3 HB THR 3 2.571 -7.764 1.577
15 HG1 THR 3 1HG THR 3 1.029 -8.747 0.000
16 1HG2 THR 3 1HG2 THR 3 3.994 -9.644 1.371
17 2HG2 THR 3 2HG2 THR 3 2.671 -10.796 1.666
18 3HG2 THR 3 3HG2 THR 3 2.794 -9.965 0.096
19 H GLY 4 H GLY 4 4.074 -8.126 2.669
20 1HA GLY 4 1HA GLY 4 4.762 -7.851 5.515
21 2HA GLY 4 2HA GLY 4 5.880 -8.003 4.173
22 HA PRO 5 HA PRO 5 6.110 -3.650 4.434
23 1HB PRO 5 1HB PRO 5 7.994 -3.261 2.495
24 2HB PRO 5 2HB PRO 5 8.395 -3.676 4.160
25 1HG PRO 5 1HG PRO 5 8.386 -5.358 1.736
26 2HG PRO 5 2HG PRO 5 9.239 -5.641 3.296
27 1HD PRO 5 1HD PRO 5 6.869 -6.907 2.307
28 2HD PRO 5 2HD PRO 5 7.578 -7.105 3.915
29 H CYS 6 H CYS 6 4.153 -5.146 2.683
30 HA CYS 6 HA CYS 6 2.744 -4.694 1.057
31 1HB CYS 6 1HB CYS 6 1.990 -2.343 0.823
32 2HB CYS 6 2HB CYS 6 1.966 -2.965 2.475
33 H CYS 7 H CYS 7 5.331 -2.130 0.865
34 HA CYS 7 HA CYS 7 5.342 -1.594 -1.736
35 1HB CYS 7 1HB CYS 7 7.457 -1.767 0.320
36 2HB CYS 7 2HB CYS 7 8.017 -1.717 -1.354
37 H ARG 8 H ARG 8 5.046 -3.030 -3.418
38 HA ARG 8 HA ARG 8 5.798 -4.493 -4.901
39 1HB ARG 8 1HB ARG 8 7.522 -5.775 -2.735
40 2HB ARG 8 2HB ARG 8 7.630 -6.078 -4.476
41 1HG ARG 8 1HG ARG 8 8.060 -3.345 -3.212
42 2HG ARG 8 2HG ARG 8 9.385 -4.482 -3.516
43 1HD ARG 8 1HD ARG 8 7.494 -3.760 -5.757
44 2HD ARG 8 2HD ARG 8 8.766 -2.616 -5.309
45 HE ARG 8 HE ARG 8 10.409 -4.173 -6.058
46 1HH1 ARG 8 2HH2 ARG 8 7.150 -5.550 -6.282
47 2HH1 ARG 8 1HH2 ARG 8 7.644 -6.872 -7.286
48 1HH2 ARG 8 2HH1 ARG 8 11.045 -5.892 -7.363
49 2HH2 ARG 8 1HH1 ARG 8 9.871 -7.073 -7.907
50 H GLN 9 H GLN 9 4.476 -5.031 -1.772
51 HA GLN 9 HA GLN 9 3.029 -7.295 -2.804
52 1HB GLN 9 1HB GLN 9 5.109 -7.505 -0.763
53 2HB GLN 9 2HB GLN 9 3.546 -8.073 -0.150
54 1HG GLN 9 1HG GLN 9 4.933 -8.987 -2.708
55 2HG GLN 9 2HG GLN 9 4.813 -9.920 -1.209
56 1HE2 GLN 9 1HE2 GLN 9 3.959 -11.068 -3.454
57 2HE2 GLN 9 2HE2 GLN 9 2.232 -11.171 -3.529
58 H CYS 10 H CYS 10 1.532 -5.324 -2.847
59 HA CYS 10 HA CYS 10 -0.556 -5.369 -1.434
60 1HB CYS 10 1HB CYS 10 1.495 -4.274 0.472
61 2HB CYS 10 2HB CYS 10 -0.221 -3.887 0.635
62 H LYS 11 H LYS 11 2.095 -2.866 -1.378
63 HA LYS 11 HA LYS 11 0.538 -0.669 -1.870
64 1HB LYS 11 1HB LYS 11 2.536 0.439 -2.493
65 2HB LYS 11 2HB LYS 11 2.971 -0.742 -1.245
66 1HG LYS 11 1HG LYS 11 4.643 -0.965 -2.913
67 2HG LYS 11 2HG LYS 11 3.553 -2.332 -3.206
68 1HD LYS 11 1HD LYS 11 2.520 -0.129 -4.684
69 2HD LYS 11 2HD LYS 11 4.270 -0.139 -4.973
70 1HE LYS 11 1HE LYS 11 4.211 -2.362 -5.834
71 2HE LYS 11 2HE LYS 11 2.596 -2.674 -5.179
72 1HZ LYS 11 1HZ LYS 11 2.523 -2.206 -7.566
73 2HZ LYS 11 2HZ LYS 11 1.732 -1.029 -6.765
74 3HZ LYS 11 3HZ LYS 11 3.259 -0.759 -7.310
75 H LEU 12 H LEU 12 0.642 -3.418 -3.755
76 HA LEU 12 HA LEU 12 0.951 -2.812 -6.320
77 1HB LEU 12 1HB LEU 12 -0.482 -4.525 -6.841
78 2HB LEU 12 2HB LEU 12 0.052 -4.921 -5.199
79 HG LEU 12 HG LEU 12 -2.209 -3.591 -4.613
80 1HD1 LEU 12 1HD1 LEU 12 -3.587 -4.967 -6.690
81 2HD1 LEU 12 2HD1 LEU 12 -3.566 -3.224 -6.327
82 3HD1 LEU 12 3HD1 LEU 12 -2.363 -3.916 -7.441
83 1HD2 LEU 12 1HD2 LEU 12 -2.143 -6.503 -5.443
84 2HD2 LEU 12 2HD2 LEU 12 -1.562 -5.862 -3.887
85 3HD2 LEU 12 3HD2 LEU 12 -3.285 -5.736 -4.317
86 H LYS 13 H LYS 13 -1.361 -1.325 -4.131
87 HA LYS 13 HA LYS 13 -3.259 -0.409 -5.894
88 1HB LYS 13 1HB LYS 13 -3.301 1.580 -4.197
89 2HB LYS 13 2HB LYS 13 -3.789 -0.046 -3.688
90 1HG LYS 13 1HG LYS 13 -0.888 0.514 -3.441
91 2HG LYS 13 2HG LYS 13 -1.909 1.524 -2.403
92 1HD LYS 13 1HD LYS 13 -1.055 -1.092 -1.886
93 2HD LYS 13 2HD LYS 13 -2.328 -0.223 -1.012
94 1HE LYS 13 1HE LYS 13 -2.988 -1.631 -3.600
95 2HE LYS 13 2HE LYS 13 -2.822 -2.590 -2.120
96 1HZ LYS 13 1HZ LYS 13 -5.123 -1.712 -2.620
97 2HZ LYS 13 2HZ LYS 13 -4.582 -1.357 -1.126
98 3HZ LYS 13 3HZ LYS 13 -4.529 -0.212 -2.305
99 HA PRO 14 HA PRO 14 -1.408 2.742 -8.204
100 1HB PRO 14 1HB PRO 14 -3.165 4.832 -8.153
101 2HB PRO 14 2HB PRO 14 -3.388 3.410 -9.167
102 1HG PRO 14 1HG PRO 14 -4.712 4.164 -6.641
103 2HG PRO 14 2HG PRO 14 -5.267 2.997 -7.895
104 1HD PRO 14 1HD PRO 14 -4.122 2.444 -5.328
105 2HD PRO 14 2HD PRO 14 -4.503 1.265 -6.590
106 H ALA 15 H ALA 15 -0.226 2.568 -5.731
107 HA ALA 15 HA ALA 15 1.072 3.710 -4.349
108 1HB ALA 15 1HB ALA 15 2.506 4.710 -5.768
109 2HB ALA 15 2HB ALA 15 1.207 5.067 -6.930
110 3HB ALA 15 3HB ALA 15 1.530 6.188 -5.587
111 H GLY 16 H GLY 16 1.020 5.263 -2.626
112 1HA GLY 16 1HA GLY 16 -1.241 7.130 -2.623
113 2HA GLY 16 2HA GLY 16 -1.190 5.888 -1.388
114 H THR 17 H THR 17 0.664 5.815 0.118
115 HA THR 17 HA THR 17 2.520 8.008 0.087
116 HB THR 17 HB THR 17 0.611 7.876 2.452
117 HG1 THR 17 1HG THR 17 -0.787 8.403 0.753
118 1HG2 THR 17 1HG2 THR 17 1.521 9.932 3.024
119 2HG2 THR 17 2HG2 THR 17 2.907 9.334 2.080
120 3HG2 THR 17 3HG2 THR 17 1.718 10.421 1.324
121 H THR 18 H THR 18 2.704 7.685 3.135
122 HA THR 18 HA THR 18 3.898 4.992 3.107
123 HB THR 18 HB THR 18 5.440 7.155 2.901
124 HG1 THR 18 1HG THR 18 5.624 5.039 4.930
125 1HG2 THR 18 1HG2 THR 18 5.440 6.943 5.905
126 2HG2 THR 18 2HG2 THR 18 5.912 8.313 4.872
127 3HG2 THR 18 3HG2 THR 18 4.191 7.978 5.174
128 H CYS 19 H CYS 19 1.355 6.677 4.212
129 HA CYS 19 HA CYS 19 0.619 4.970 6.134
130 1HB CYS 19 1HB CYS 19 2.753 6.591 7.156
131 2HB CYS 19 2HB CYS 19 1.269 6.943 8.047
132 H TRP 20 H TRP 20 -0.868 6.090 4.315
133 HA TRP 20 HA TRP 20 -2.126 8.452 5.528
134 1HB TRP 20 1HB TRP 20 -1.094 8.604 3.210
135 2HB TRP 20 2HB TRP 20 -2.409 7.562 2.665
136 HD1 TRP 20 HD TRP 20 -4.635 8.813 2.039
137 HE1 TRP 20 1HE TRP 20 -5.642 11.243 2.249
138 HE3 TRP 20 3HE TRP 20 -0.915 10.669 4.966
139 HZ2 TRP 20 2HZ TRP 20 -4.788 13.615 3.586
140 HZ3 TRP 20 3HZ TRP 20 -1.078 13.051 5.680
141 HH2 TRP 20 HH TRP 20 -2.930 14.511 5.036
142 H LYS 21 H LYS 21 -3.083 5.763 3.270
143 HA LYS 21 HA LYS 21 -4.685 4.239 3.408
144 1HB LYS 21 1HB LYS 21 -4.440 3.348 5.441
145 2HB LYS 21 2HB LYS 21 -4.309 4.920 6.248
146 1HG LYS 21 1HG LYS 21 -6.976 4.093 5.130
147 2HG LYS 21 2HG LYS 21 -6.425 3.314 6.624
148 1HD LYS 21 1HD LYS 21 -5.892 6.061 6.980
149 2HD LYS 21 2HD LYS 21 -7.485 6.013 6.204
150 1HE LYS 21 1HE LYS 21 -8.468 5.207 8.080
151 2HE LYS 21 2HE LYS 21 -7.211 3.983 8.319
152 1HZ LYS 21 1HZ LYS 21 -7.526 6.439 9.668
153 2HZ LYS 21 2HZ LYS 21 -6.421 5.278 9.955
154 3HZ LYS 21 3HZ LYS 21 -6.102 6.448 8.846
155 H THR 22 H THR 22 -6.476 4.570 2.215
156 HA THR 22 HA THR 22 -7.833 7.101 2.407
157 HB THR 22 HB THR 22 -9.003 6.245 0.411
158 HG1 THR 22 1HG THR 22 -8.775 3.969 -0.036
159 1HG2 THR 22 1HG2 THR 22 -6.056 5.439 0.548
160 2HG2 THR 22 2HG2 THR 22 -7.018 5.309 -0.944
161 3HG2 THR 22 3HG2 THR 22 -6.744 6.902 -0.198
162 H SER 23 H SER 23 -10.016 4.571 1.670
163 HA SER 23 HA SER 23 -10.923 4.371 4.393
164 1HB SER 23 1HB SER 23 -12.283 5.955 2.268
165 2HB SER 23 2HB SER 23 -13.334 4.905 3.236
166 HG SER 23 HG SER 23 -11.422 6.674 4.466
167 H LEU 24 H LEU 24 -9.850 2.752 1.945
168 HA LEU 24 HA LEU 24 -11.555 0.508 2.373
169 1HB LEU 24 1HB LEU 24 -11.765 0.373 -0.278
170 2HB LEU 24 2HB LEU 24 -13.021 1.047 0.776
171 HG LEU 24 HG LEU 24 -11.051 3.034 -0.089
172 1HD1 LEU 24 1HD1 LEU 24 -11.769 3.164 -2.422
173 2HD1 LEU 24 2HD1 LEU 24 -10.952 1.621 -2.081
174 3HD1 LEU 24 3HD1 LEU 24 -12.726 1.677 -2.220
175 1HD2 LEU 24 1HD2 LEU 24 -12.809 4.236 0.546
176 2HD2 LEU 24 2HD2 LEU 24 -13.601 3.747 -0.971
177 3HD2 LEU 24 3HD2 LEU 24 -13.880 2.814 0.519
178 H THR 25 H THR 25 -9.406 1.644 -0.328
179 HA THR 25 HA THR 25 -7.958 -0.757 -0.398
180 HB THR 25 HB THR 25 -7.861 1.986 -1.591
181 HG1 THR 25 1HG THR 25 -8.701 0.367 -2.901
182 1HG2 THR 25 1HG2 THR 25 -5.559 2.111 -1.497
183 2HG2 THR 25 2HG2 THR 25 -5.404 0.418 -0.966
184 3HG2 THR 25 3HG2 THR 25 -5.614 0.795 -2.693
185 H SER 26 H SER 26 -7.267 2.404 1.207
186 HA SER 26 HA SER 26 -6.027 2.861 2.937
187 1HB SER 26 1HB SER 26 -6.370 -0.038 3.234
188 2HB SER 26 2HB SER 26 -4.846 0.530 3.942
189 HG SER 26 HG SER 26 -5.978 1.887 5.330
190 H HIS 27 H HIS 27 -4.487 3.950 1.593
191 HA HIS 27 HA HIS 27 -2.522 2.662 0.127
192 1HB HIS 27 1HB HIS 27 -2.632 5.426 1.343
193 2HB HIS 27 2HB HIS 27 -1.367 4.900 0.225
194 HD1 HIS 27 1HD HIS 27 -3.377 3.273 -1.689
195 HD2 HIS 27 2HD HIS 27 -3.815 7.241 -0.401
196 HE1 HIS 27 1HE HIS 27 -4.876 4.421 -3.405
197 HE2 HIS 27 2HE HIS 27 -5.111 6.864 -2.566
198 H TYR 28 H TYR 28 -1.107 4.861 2.452
199 HA TYR 28 HA TYR 28 0.407 4.603 4.050
200 1HB TYR 28 1HB TYR 28 -1.444 2.290 4.222
201 2HB TYR 28 2HB TYR 28 0.158 1.868 4.837
202 HD1 TYR 28 1HD TYR 28 0.311 1.992 7.139
203 HD2 TYR 28 2HD TYR 28 -2.124 4.850 5.087
204 HE1 TYR 28 1HE TYR 28 -0.269 3.099 9.353
205 HE2 TYR 28 2HE TYR 28 -2.695 5.947 7.308
206 HH TYR 28 HH TYR 28 -2.351 5.979 9.439
207 H CYS 29 H CYS 29 1.054 3.995 1.245
208 HA CYS 29 HA CYS 29 3.621 3.105 1.556
209 1HB CYS 29 1HB CYS 29 2.488 0.931 2.117
210 2HB CYS 29 2HB CYS 29 1.929 0.865 0.443
211 H THR 30 H THR 30 4.567 2.534 -0.762
212 HA THR 30 HA THR 30 2.891 3.787 -2.827
213 HB THR 30 HB THR 30 4.305 5.595 -2.520
214 HG1 THR 30 1HG THR 30 4.993 4.516 -4.535
215 1HG2 THR 30 1HG2 THR 30 5.515 5.099 -0.546
216 2HG2 THR 30 2HG2 THR 30 6.113 3.552 -1.190
217 3HG2 THR 30 3HG2 THR 30 6.807 5.086 -1.769
218 H GLY 31 H GLY 31 6.243 2.435 -2.734
219 1HA GLY 31 1HA GLY 31 5.607 -0.048 -3.860
220 2HA GLY 31 2HA GLY 31 5.922 1.069 -5.174
221 H LYS 32 H LYS 32 7.333 -1.059 -2.907
222 HA LYS 32 HA LYS 32 9.422 -1.631 -2.481
223 1HB LYS 32 1HB LYS 32 9.497 -0.830 -5.082
224 2HB LYS 32 2HB LYS 32 10.754 0.199 -4.373
225 1HG LYS 32 1HG LYS 32 10.650 -2.762 -4.719
226 2HG LYS 32 2HG LYS 32 12.047 -1.673 -4.773
227 1HD LYS 32 1HD LYS 32 11.460 -1.433 -2.161
228 2HD LYS 32 2HD LYS 32 10.754 -3.038 -2.423
229 1HE LYS 32 1HE LYS 32 12.880 -3.896 -3.233
230 2HE LYS 32 2HE LYS 32 13.602 -2.281 -3.224
231 1HZ LYS 32 1HZ LYS 32 13.745 -2.314 -0.928
232 2HZ LYS 32 2HZ LYS 32 12.503 -3.345 -0.716
233 3HZ LYS 32 3HZ LYS 32 13.943 -3.909 -1.276
234 H SER 33 H SER 33 9.516 -0.871 -0.370
235 HA SER 33 HA SER 33 11.164 0.374 0.838
236 1HB SER 33 1HB SER 33 10.040 2.630 -0.852
237 2HB SER 33 2HB SER 33 10.986 2.933 0.617
238 HG SER 33 HG SER 33 12.079 2.809 -1.637
239 H CYS 34 H CYS 34 8.617 2.844 0.414
240 HA CYS 34 HA CYS 34 7.317 3.649 2.076
241 1HB CYS 34 1HB CYS 34 5.260 2.343 2.240
242 2HB CYS 34 2HB CYS 34 5.835 2.495 0.577
243 H ASP 35 H ASP 35 5.730 1.511 3.767
244 HA ASP 35 HA ASP 35 7.035 -0.068 5.318
245 1HB ASP 35 1HB ASP 35 8.095 2.673 5.781
246 2HB ASP 35 2HB ASP 35 7.691 1.782 7.255
247 HD2 ASP 35 HD ASP 35 9.043 -0.840 5.628
248 H CYS 36 H CYS 36 4.431 0.184 4.867
249 HA CYS 36 HA CYS 36 3.294 0.578 7.420
250 1HB CYS 36 1HB CYS 36 3.363 2.873 5.747
251 2HB CYS 36 2HB CYS 36 1.691 2.310 5.814
252 HA PRO 37 HA PRO 37 0.619 -2.215 5.411
253 1HB PRO 37 1HB PRO 37 -1.482 -2.276 7.156
254 2HB PRO 37 2HB PRO 37 0.006 -3.186 7.407
255 1HG PRO 37 1HG PRO 37 -0.930 -0.692 8.675
256 2HG PRO 37 2HG PRO 37 0.317 -1.851 9.262
257 1HD PRO 37 1HD PRO 37 0.701 0.724 8.070
258 2HD PRO 37 2HD PRO 37 1.961 -0.446 8.483
259 H LEU 38 H LEU 38 -0.903 -2.371 3.820
260 HA LEU 38 HA LEU 38 -2.330 0.159 3.434
261 1HB LEU 38 1HB LEU 38 -2.168 -1.850 1.275
262 2HB LEU 38 2HB LEU 38 -2.092 -0.082 1.203
263 HG LEU 38 HG LEU 38 0.122 -2.019 1.910
264 1HD1 LEU 38 1HD1 LEU 38 -0.262 -0.060 -0.368
265 2HD1 LEU 38 2HD1 LEU 38 1.249 -0.941 -0.032
266 3HD1 LEU 38 3HD1 LEU 38 -0.228 -1.837 -0.458
267 1HD2 LEU 38 1HD2 LEU 38 -0.081 0.231 3.276
268 2HD2 LEU 38 2HD2 LEU 38 1.488 -0.346 2.665
269 3HD2 LEU 38 3HD2 LEU 38 0.607 0.930 1.790
270 H TYR 39 H TYR 39 -3.377 -1.417 5.440
271 HA TYR 39 HA TYR 39 -5.961 -1.973 4.366
272 1HB TYR 39 1HB TYR 39 -4.096 -4.021 4.219
273 2HB TYR 39 2HB TYR 39 -4.709 -4.286 5.855
274 HD1 TYR 39 1HD TYR 39 -6.220 -6.038 5.912
275 HD2 TYR 39 2HD TYR 39 -6.300 -3.366 2.572
276 HE1 TYR 39 1HE TYR 39 -8.204 -7.297 4.941
277 HE2 TYR 39 2HE TYR 39 -8.282 -4.635 1.613
278 HH TYR 39 HH TYR 39 -9.210 -6.901 1.764
279 HA PRO 40 HA PRO 40 -6.876 -1.007 8.484
280 1HB PRO 40 1HB PRO 40 -9.478 -1.823 8.637
281 2HB PRO 40 2HB PRO 40 -8.989 -0.288 7.921
282 1HG PRO 40 1HG PRO 40 -9.826 -2.803 6.626
283 2HG PRO 40 2HG PRO 40 -9.800 -1.141 5.937
284 1HD PRO 40 1HD PRO 40 -7.984 -3.301 5.447
285 2HD PRO 40 2HD PRO 40 -7.825 -1.638 4.869
286 H GLY 41 H GLY 41 -5.174 -2.898 8.732
287 1HA GLY 41 1HA GLY 41 -5.906 -4.259 11.036
288 2HA GLY 41 2HA GLY 41 -6.233 -5.346 9.701
Start of MODEL 21
1 H CYS 1 H CYS 1 -4.150 -3.477 2.760
2 HA CYS 1 HA CYS 1 -2.852 -5.149 0.740
3 1HB CYS 1 1HB CYS 1 -1.115 -3.815 0.617
4 2HB CYS 1 2HB CYS 1 -1.892 -2.668 1.710
5 H THR 2 H THR 2 -1.420 -6.829 1.754
6 HA THR 2 HA THR 2 -1.320 -7.208 4.533
7 HB THR 2 HB THR 2 -3.669 -7.675 4.549
8 HG1 THR 2 1HG THR 2 -2.340 -9.409 5.453
9 1HG2 THR 2 1HG2 THR 2 -3.900 -7.867 2.000
10 2HG2 THR 2 2HG2 THR 2 -3.251 -9.518 2.142
11 3HG2 THR 2 3HG2 THR 2 -4.797 -9.099 2.918
12 H THR 3 H THR 3 0.814 -7.237 3.195
13 HA THR 3 HA THR 3 1.396 -10.076 2.735
14 HB THR 3 HB THR 3 2.001 -7.692 0.921
15 HG1 THR 3 1HG THR 3 0.747 -10.340 0.798
16 1HG2 THR 3 1HG2 THR 3 3.351 -9.207 -0.449
17 2HG2 THR 3 2HG2 THR 3 4.041 -9.212 1.192
18 3HG2 THR 3 3HG2 THR 3 3.021 -10.566 0.652
19 H GLY 4 H GLY 4 3.672 -7.441 2.123
20 1HA GLY 4 1HA GLY 4 4.953 -8.018 4.723
21 2HA GLY 4 2HA GLY 4 5.858 -8.025 3.222
22 HA PRO 5 HA PRO 5 6.413 -3.775 4.109
23 1HB PRO 5 1HB PRO 5 8.180 -3.226 2.101
24 2HB PRO 5 2HB PRO 5 8.668 -3.888 3.658
25 1HG PRO 5 1HG PRO 5 8.384 -5.216 1.040
26 2HG PRO 5 2HG PRO 5 9.323 -5.757 2.478
27 1HD PRO 5 1HD PRO 5 6.814 -6.745 1.514
28 2HD PRO 5 2HD PRO 5 7.619 -7.201 3.021
29 H CYS 6 H CYS 6 4.503 -5.079 1.939
30 HA CYS 6 HA CYS 6 2.965 -4.295 0.585
31 1HB CYS 6 1HB CYS 6 2.013 -2.182 0.908
32 2HB CYS 6 2HB CYS 6 2.587 -2.706 2.494
33 H CYS 7 H CYS 7 5.721 -1.916 0.732
34 HA CYS 7 HA CYS 7 5.602 -0.987 -1.814
35 1HB CYS 7 1HB CYS 7 7.634 -1.201 0.270
36 2HB CYS 7 2HB CYS 7 8.320 -1.177 -1.356
37 H ARG 8 H ARG 8 4.840 -2.808 -3.145
38 HA ARG 8 HA ARG 8 5.554 -4.008 -4.919
39 1HB ARG 8 1HB ARG 8 7.894 -5.017 -3.241
40 2HB ARG 8 2HB ARG 8 7.673 -5.236 -4.987
41 1HG ARG 8 1HG ARG 8 7.565 -2.414 -4.152
42 2HG ARG 8 2HG ARG 8 9.110 -3.181 -3.746
43 1HD ARG 8 1HD ARG 8 7.857 -3.464 -6.498
44 2HD ARG 8 2HD ARG 8 8.870 -2.069 -6.095
45 HE ARG 8 HE ARG 8 10.196 -4.524 -5.361
46 1HH1 ARG 8 2HH2 ARG 8 9.365 -2.573 -8.201
47 2HH1 ARG 8 1HH2 ARG 8 10.691 -3.163 -9.147
48 1HH2 ARG 8 2HH1 ARG 8 11.916 -5.285 -6.594
49 2HH2 ARG 8 1HH1 ARG 8 12.153 -4.714 -8.233
50 H GLN 9 H GLN 9 5.041 -4.778 -1.610
51 HA GLN 9 HA GLN 9 3.823 -7.263 -2.407
52 1HB GLN 9 1HB GLN 9 6.246 -7.064 -0.740
53 2HB GLN 9 2HB GLN 9 4.953 -8.007 0.021
54 1HG GLN 9 1HG GLN 9 4.960 -9.617 -1.673
55 2HG GLN 9 2HG GLN 9 5.632 -8.510 -2.880
56 1HE2 GLN 9 1HE2 GLN 9 7.616 -8.933 -3.436
57 2HE2 GLN 9 2HE2 GLN 9 8.864 -9.628 -2.456
58 H CYS 10 H CYS 10 1.945 -5.774 -2.090
59 HA CYS 10 HA CYS 10 0.290 -6.153 -0.244
60 1HB CYS 10 1HB CYS 10 2.284 -5.837 1.399
61 2HB CYS 10 2HB CYS 10 1.909 -4.118 1.251
62 H LYS 11 H LYS 11 2.295 -3.177 -0.874
63 HA LYS 11 HA LYS 11 0.019 -1.520 -1.157
64 1HB LYS 11 1HB LYS 11 1.503 0.186 -1.366
65 2HB LYS 11 2HB LYS 11 2.547 -1.002 -0.567
66 1HG LYS 11 1HG LYS 11 3.961 -0.601 -2.299
67 2HG LYS 11 2HG LYS 11 2.886 -1.657 -3.233
68 1HD LYS 11 1HD LYS 11 1.541 0.673 -3.498
69 2HD LYS 11 2HD LYS 11 3.172 1.331 -3.278
70 1HE LYS 11 1HE LYS 11 2.121 -0.500 -5.450
71 2HE LYS 11 2HE LYS 11 2.978 1.038 -5.630
72 1HZ LYS 11 1HZ LYS 11 4.217 -1.433 -4.542
73 2HZ LYS 11 2HZ LYS 11 4.380 -0.943 -6.087
74 3HZ LYS 11 3HZ LYS 11 4.951 0.001 -4.869
75 H LEU 12 H LEU 12 -0.289 -3.903 -2.719
76 HA LEU 12 HA LEU 12 0.433 -3.747 -5.342
77 1HB LEU 12 1HB LEU 12 -1.033 -5.404 -5.680
78 2HB LEU 12 2HB LEU 12 -0.978 -5.459 -3.909
79 HG LEU 12 HG LEU 12 -3.038 -3.770 -4.219
80 1HD1 LEU 12 1HD1 LEU 12 -3.669 -3.571 -6.345
81 2HD1 LEU 12 2HD1 LEU 12 -2.629 -4.918 -6.866
82 3HD1 LEU 12 3HD1 LEU 12 -4.258 -5.246 -6.226
83 1HD2 LEU 12 1HD2 LEU 12 -4.307 -6.226 -4.476
84 2HD2 LEU 12 2HD2 LEU 12 -2.725 -6.629 -3.768
85 3HD2 LEU 12 3HD2 LEU 12 -3.786 -5.448 -2.962
86 H LYS 13 H LYS 13 -1.426 -1.482 -3.549
87 HA LYS 13 HA LYS 13 -3.213 -0.594 -5.488
88 1HB LYS 13 1HB LYS 13 -1.866 1.117 -3.399
89 2HB LYS 13 2HB LYS 13 -3.473 1.332 -4.116
90 1HG LYS 13 1HG LYS 13 -4.124 0.287 -2.182
91 2HG LYS 13 2HG LYS 13 -3.769 -1.175 -3.117
92 1HD LYS 13 1HD LYS 13 -1.300 -0.695 -2.151
93 2HD LYS 13 2HD LYS 13 -2.232 0.094 -0.867
94 1HE LYS 13 1HE LYS 13 -1.701 -2.354 -0.464
95 2HE LYS 13 2HE LYS 13 -3.424 -1.960 -0.379
96 1HZ LYS 13 1HZ LYS 13 -2.075 -3.689 -2.209
97 2HZ LYS 13 2HZ LYS 13 -3.673 -3.560 -1.925
98 3HZ LYS 13 3HZ LYS 13 -2.950 -2.533 -2.985
99 HA PRO 14 HA PRO 14 -0.737 1.558 -8.288
100 1HB PRO 14 1HB PRO 14 -2.365 3.597 -9.099
101 2HB PRO 14 2HB PRO 14 -2.510 1.949 -9.704
102 1HG PRO 14 1HG PRO 14 -4.156 3.396 -7.730
103 2HG PRO 14 2HG PRO 14 -4.579 1.929 -8.684
104 1HD PRO 14 1HD PRO 14 -3.865 2.108 -5.915
105 2HD PRO 14 2HD PRO 14 -4.116 0.626 -6.848
106 H ALA 15 H ALA 15 0.161 2.048 -5.792
107 HA ALA 15 HA ALA 15 1.511 3.477 -4.764
108 1HB ALA 15 1HB ALA 15 2.615 5.096 -5.989
109 2HB ALA 15 2HB ALA 15 1.923 4.136 -7.319
110 3HB ALA 15 3HB ALA 15 1.131 5.644 -6.806
111 H GLY 16 H GLY 16 0.813 4.377 -2.897
112 1HA GLY 16 1HA GLY 16 -1.543 6.158 -3.052
113 2HA GLY 16 2HA GLY 16 -1.180 5.084 -1.716
114 H THR 17 H THR 17 0.227 5.734 -0.072
115 HA THR 17 HA THR 17 1.853 8.106 -0.512
116 HB THR 17 HB THR 17 -0.293 7.930 1.670
117 HG1 THR 17 1HG THR 17 -1.488 8.893 0.076
118 1HG2 THR 17 1HG2 THR 17 0.611 9.849 2.534
119 2HG2 THR 17 2HG2 THR 17 2.060 9.496 1.563
120 3HG2 THR 17 3HG2 THR 17 0.790 10.561 0.912
121 H THR 18 H THR 18 1.340 7.688 2.774
122 HA THR 18 HA THR 18 2.994 5.395 3.183
123 HB THR 18 HB THR 18 4.152 8.215 3.350
124 HG1 THR 18 1HG THR 18 4.587 7.096 1.399
125 1HG2 THR 18 1HG2 THR 18 5.752 7.546 4.866
126 2HG2 THR 18 2HG2 THR 18 4.566 6.308 5.340
127 3HG2 THR 18 3HG2 THR 18 5.844 5.911 4.167
128 H CYS 19 H CYS 19 2.110 4.479 4.916
129 HA CYS 19 HA CYS 19 0.789 4.317 6.700
130 1HB CYS 19 1HB CYS 19 2.761 6.318 7.805
131 2HB CYS 19 2HB CYS 19 1.799 5.164 8.731
132 H TRP 20 H TRP 20 -0.747 5.735 5.114
133 HA TRP 20 HA TRP 20 -1.616 8.024 6.739
134 1HB TRP 20 1HB TRP 20 -0.443 8.365 4.354
135 2HB TRP 20 2HB TRP 20 -2.104 8.105 3.815
136 HD1 TRP 20 HD TRP 20 -3.761 10.159 4.120
137 HE1 TRP 20 1HE TRP 20 -3.625 12.628 5.043
138 HE3 TRP 20 3HE TRP 20 0.828 9.668 6.254
139 HZ2 TRP 20 2HZ TRP 20 -1.657 14.065 6.527
140 HZ3 TRP 20 3HZ TRP 20 1.786 11.653 7.420
141 HH2 TRP 20 HH TRP 20 0.620 13.795 7.577
142 H LYS 21 H LYS 21 -2.754 6.185 3.813
143 HA LYS 21 HA LYS 21 -4.459 4.724 3.646
144 1HB LYS 21 1HB LYS 21 -5.488 3.791 5.422
145 2HB LYS 21 2HB LYS 21 -4.132 4.527 6.293
146 1HG LYS 21 1HG LYS 21 -5.850 6.616 6.307
147 2HG LYS 21 2HG LYS 21 -7.031 5.297 6.235
148 1HD LYS 21 1HD LYS 21 -5.209 4.423 8.153
149 2HD LYS 21 2HD LYS 21 -5.290 6.166 8.459
150 1HE LYS 21 1HE LYS 21 -7.358 5.979 9.360
151 2HE LYS 21 2HE LYS 21 -7.956 5.042 7.982
152 1HZ LYS 21 1HZ LYS 21 -6.594 4.031 10.406
153 2HZ LYS 21 2HZ LYS 21 -8.059 3.605 9.836
154 3HZ LYS 21 3HZ LYS 21 -6.703 3.153 9.021
155 H THR 22 H THR 22 -6.009 5.333 2.237
156 HA THR 22 HA THR 22 -6.975 8.039 2.334
157 HB THR 22 HB THR 22 -8.024 7.353 0.174
158 HG1 THR 22 1HG THR 22 -7.709 5.034 -0.354
159 1HG2 THR 22 1HG2 THR 22 -6.050 7.004 -1.049
160 2HG2 THR 22 2HG2 THR 22 -5.362 7.608 0.478
161 3HG2 THR 22 3HG2 THR 22 -5.397 5.859 0.148
162 H SER 23 H SER 23 -9.510 8.177 1.661
163 HA SER 23 HA SER 23 -10.777 7.163 4.033
164 1HB SER 23 1HB SER 23 -10.930 9.560 2.773
165 2HB SER 23 2HB SER 23 -12.332 8.759 2.038
166 HG SER 23 HG SER 23 -11.834 8.967 4.886
167 H LEU 24 H LEU 24 -10.028 5.619 1.365
168 HA LEU 24 HA LEU 24 -12.650 4.328 1.150
169 1HB LEU 24 1HB LEU 24 -11.062 4.242 -1.285
170 2HB LEU 24 2HB LEU 24 -12.790 4.559 -1.053
171 HG LEU 24 HG LEU 24 -11.770 6.446 -2.126
172 1HD1 LEU 24 1HD1 LEU 24 -13.226 6.597 0.253
173 2HD1 LEU 24 2HD1 LEU 24 -11.931 7.804 0.430
174 3HD1 LEU 24 3HD1 LEU 24 -13.025 7.872 -0.973
175 1HD2 LEU 24 1HD2 LEU 24 -9.476 5.787 -0.811
176 2HD2 LEU 24 2HD2 LEU 24 -9.750 7.314 -1.683
177 3HD2 LEU 24 3HD2 LEU 24 -9.988 7.239 0.080
178 H THR 25 H THR 25 -9.379 3.774 -0.307
179 HA THR 25 HA THR 25 -9.495 1.055 0.754
180 HB THR 25 HB THR 25 -7.981 2.514 -1.444
181 HG1 THR 25 1HG THR 25 -9.061 0.749 -2.576
182 1HG2 THR 25 1HG2 THR 25 -6.971 0.282 0.161
183 2HG2 THR 25 2HG2 THR 25 -7.325 -0.254 -1.499
184 3HG2 THR 25 3HG2 THR 25 -6.201 1.097 -1.220
185 H SER 26 H SER 26 -6.392 2.557 0.110
186 HA SER 26 HA SER 26 -5.813 3.556 2.580
187 1HB SER 26 1HB SER 26 -6.097 0.753 2.732
188 2HB SER 26 2HB SER 26 -4.348 1.036 2.744
189 HG SER 26 HG SER 26 -4.487 1.911 4.706
190 H HIS 27 H HIS 27 -4.149 4.881 1.962
191 HA HIS 27 HA HIS 27 -2.358 3.872 -0.108
192 1HB HIS 27 1HB HIS 27 -3.224 6.608 0.769
193 2HB HIS 27 2HB HIS 27 -1.703 6.404 -0.109
194 HD1 HIS 27 1HD HIS 27 -3.607 8.053 -1.609
195 HD2 HIS 27 2HD HIS 27 -3.815 3.866 -1.749
196 HE1 HIS 27 1HE HIS 27 -4.877 7.471 -3.745
197 HE2 HIS 27 2HE HIS 27 -4.980 4.880 -3.783
198 H TYR 28 H TYR 28 -2.213 2.961 2.690
199 HA TYR 28 HA TYR 28 -0.176 4.383 4.038
200 1HB TYR 28 1HB TYR 28 -1.942 2.117 4.302
201 2HB TYR 28 2HB TYR 28 -0.311 1.486 4.547
202 HD1 TYR 28 1HD TYR 28 0.355 1.348 6.756
203 HD2 TYR 28 2HD TYR 28 -2.283 4.511 5.601
204 HE1 TYR 28 1HE TYR 28 0.294 2.183 9.157
205 HE2 TYR 28 2HE TYR 28 -2.336 5.336 8.006
206 HH TYR 28 HH TYR 28 -0.160 4.606 10.208
207 H CYS 29 H CYS 29 0.712 4.174 1.379
208 HA CYS 29 HA CYS 29 3.273 3.289 1.706
209 1HB CYS 29 1HB CYS 29 2.215 1.032 1.861
210 2HB CYS 29 2HB CYS 29 1.694 1.210 0.182
211 H THR 30 H THR 30 4.403 3.170 -0.569
212 HA THR 30 HA THR 30 2.827 4.753 -2.491
213 HB THR 30 HB THR 30 4.392 6.272 -1.449
214 HG1 THR 30 1HG THR 30 5.748 5.046 -3.738
215 1HG2 THR 30 1HG2 THR 30 6.455 4.053 -1.894
216 2HG2 THR 30 2HG2 THR 30 6.870 5.723 -1.440
217 3HG2 THR 30 3HG2 THR 30 5.928 4.704 -0.324
218 H GLY 31 H GLY 31 5.497 2.393 -1.972
219 1HA GLY 31 1HA GLY 31 5.179 0.410 -3.465
220 2HA GLY 31 2HA GLY 31 5.134 1.559 -4.786
221 H LYS 32 H LYS 32 7.142 -0.394 -2.791
222 HA LYS 32 HA LYS 32 9.311 -0.854 -2.982
223 1HB LYS 32 1HB LYS 32 9.069 -0.139 -5.372
224 2HB LYS 32 2HB LYS 32 9.620 1.477 -4.891
225 1HG LYS 32 1HG LYS 32 11.443 -0.022 -5.772
226 2HG LYS 32 2HG LYS 32 11.755 0.582 -4.136
227 1HD LYS 32 1HD LYS 32 11.151 -1.519 -3.153
228 2HD LYS 32 2HD LYS 32 10.443 -2.115 -4.665
229 1HE LYS 32 1HE LYS 32 12.516 -3.190 -4.660
230 2HE LYS 32 2HE LYS 32 12.896 -1.743 -5.608
231 1HZ LYS 32 1HZ LYS 32 14.541 -1.605 -4.048
232 2HZ LYS 32 2HZ LYS 32 13.403 -0.869 -3.147
233 3HZ LYS 32 3HZ LYS 32 13.692 -2.473 -2.939
234 H SER 33 H SER 33 10.106 -0.516 -0.968
235 HA SER 33 HA SER 33 11.410 0.522 0.489
236 1HB SER 33 1HB SER 33 11.964 2.168 -1.473
237 2HB SER 33 2HB SER 33 10.840 3.267 -0.655
238 HG SER 33 HG SER 33 12.263 2.672 1.329
239 H CYS 34 H CYS 34 8.916 -0.249 1.128
240 HA CYS 34 HA CYS 34 7.952 1.982 2.747
241 1HB CYS 34 1HB CYS 34 6.123 0.054 1.318
242 2HB CYS 34 2HB CYS 34 5.654 1.430 2.320
243 H ASP 35 H ASP 35 5.932 0.553 4.118
244 HA ASP 35 HA ASP 35 6.499 -2.012 4.811
245 1HB ASP 35 1HB ASP 35 8.670 -1.284 5.637
246 2HB ASP 35 2HB ASP 35 7.937 0.038 6.555
247 HD2 ASP 35 HD ASP 35 9.370 -2.288 8.261
248 H CYS 36 H CYS 36 4.257 -0.268 4.434
249 HA CYS 36 HA CYS 36 3.126 -0.304 7.130
250 1HB CYS 36 1HB CYS 36 3.608 1.999 5.540
251 2HB CYS 36 2HB CYS 36 1.860 1.745 5.597
252 HA PRO 37 HA PRO 37 0.071 -2.568 4.987
253 1HB PRO 37 1HB PRO 37 -1.900 -2.598 6.879
254 2HB PRO 37 2HB PRO 37 -0.528 -3.703 6.899
255 1HG PRO 37 1HG PRO 37 -1.050 -1.300 8.526
256 2HG PRO 37 2HG PRO 37 0.075 -2.663 8.866
257 1HD PRO 37 1HD PRO 37 0.705 -0.021 7.960
258 2HD PRO 37 2HD PRO 37 1.830 -1.376 8.126
259 H LEU 38 H LEU 38 -1.471 -2.286 3.458
260 HA LEU 38 HA LEU 38 -2.701 0.374 3.589
261 1HB LEU 38 1HB LEU 38 -2.307 -1.366 1.167
262 2HB LEU 38 2HB LEU 38 -2.822 0.329 1.210
263 HG LEU 38 HG LEU 38 -0.374 0.407 2.472
264 1HD1 LEU 38 1HD1 LEU 38 0.546 -1.629 2.073
265 2HD1 LEU 38 2HD1 LEU 38 -0.421 -1.909 0.604
266 3HD1 LEU 38 3HD1 LEU 38 0.996 -0.834 0.545
267 1HD2 LEU 38 1HD2 LEU 38 0.029 1.939 0.900
268 2HD2 LEU 38 2HD2 LEU 38 -0.166 0.766 -0.424
269 3HD2 LEU 38 3HD2 LEU 38 -1.595 1.554 0.283
270 H TYR 39 H TYR 39 -3.981 -1.170 5.285
271 HA TYR 39 HA TYR 39 -6.389 -1.927 3.808
272 1HB TYR 39 1HB TYR 39 -6.430 -4.049 4.957
273 2HB TYR 39 2HB TYR 39 -4.733 -3.874 4.499
274 HD1 TYR 39 1HD TYR 39 -3.089 -4.141 6.132
275 HD2 TYR 39 2HD TYR 39 -7.075 -3.158 7.339
276 HE1 TYR 39 1HE TYR 39 -2.426 -4.412 8.571
277 HE2 TYR 39 2HE TYR 39 -6.398 -3.433 9.773
278 HH TYR 39 HH TYR 39 -3.038 -4.198 10.635
279 HA PRO 40 HA PRO 40 -8.183 0.334 7.046
280 1HB PRO 40 1HB PRO 40 -10.811 -0.263 6.597
281 2HB PRO 40 2HB PRO 40 -9.940 0.982 5.705
282 1HG PRO 40 1HG PRO 40 -10.714 -1.746 4.890
283 2HG PRO 40 2HG PRO 40 -10.273 -0.344 3.848
284 1HD PRO 40 1HD PRO 40 -8.700 -2.649 4.488
285 2HD PRO 40 2HD PRO 40 -8.165 -1.224 3.591
286 H GLY 41 H GLY 41 -8.459 0.141 9.197
287 1HA GLY 41 1HA GLY 41 -8.319 -2.467 10.279
288 2HA GLY 41 2HA GLY 41 -8.595 -0.971 11.149
Start of MODEL 22
1 H CYS 1 H CYS 1 -2.904 -3.572 3.811
2 HA CYS 1 HA CYS 1 -2.085 -4.659 2.739
3 1HB CYS 1 1HB CYS 1 -1.261 -5.071 1.959
4 2HB CYS 1 2HB CYS 1 -1.123 -4.942 3.018
5 H THR 2 H THR 2 -0.836 -6.389 2.830
6 HA THR 2 HA THR 2 -1.678 -6.909 4.031
7 HB THR 2 HB THR 2 -2.380 -6.624 3.350
8 HG1 THR 2 1HG THR 2 -2.672 -7.343 3.522
9 1HG2 THR 2 1HG2 THR 2 -2.797 -7.608 2.131
10 2HG2 THR 2 2HG2 THR 2 -2.610 -7.841 2.144
11 3HG2 THR 2 3HG2 THR 2 -3.076 -7.757 2.203
12 H THR 3 H THR 3 0.450 -7.440 2.556
13 HA THR 3 HA THR 3 1.056 -10.063 2.656
14 HB THR 3 HB THR 3 2.167 -8.100 0.788
15 HG1 THR 3 1HG THR 3 0.402 -9.310 0.252
16 1HG2 THR 3 1HG2 THR 3 2.876 -10.120 0.581
17 2HG2 THR 3 2HG2 THR 3 2.770 -10.294 0.397
18 3HG2 THR 3 3HG2 THR 3 2.898 -10.206 0.383
19 H GLY 4 H GLY 4 3.554 -7.763 2.061
20 1HA GLY 4 1HA GLY 4 4.651 -8.361 4.635
21 2HA GLY 4 2HA GLY 4 5.590 -8.324 3.226
22 HA PRO 5 HA PRO 5 6.233 -4.267 4.325
23 1HB PRO 5 1HB PRO 5 8.064 -3.676 2.437
24 2HB PRO 5 2HB PRO 5 8.467 -4.450 3.943
25 1HG PRO 5 1HG PRO 5 8.234 -5.582 1.292
26 2HG PRO 5 2HG PRO 5 9.096 -6.236 2.712
27 1HD PRO 5 1HD PRO 5 6.619 -7.046 1.625
28 2HD PRO 5 2HD PRO 5 7.359 -7.601 3.111
29 H CYS 6 H CYS 6 4.402 -5.239 2.121
30 HA CYS 6 HA CYS 6 2.982 -4.364 0.746
31 1HB CYS 6 1HB CYS 6 1.935 -2.433 1.242
32 2HB CYS 6 2HB CYS 6 2.570 -2.971 2.773
33 H CYS 7 H CYS 7 5.233 -2.337 0.386
34 HA CYS 7 HA CYS 7 5.380 -1.112 -1.685
35 1HB CYS 7 1HB CYS 7 7.307 -1.413 0.442
36 2HB CYS 7 2HB CYS 7 8.065 -1.362 -1.128
37 H ARG 8 H ARG 8 4.817 -2.943 -3.091
38 HA ARG 8 HA ARG 8 5.708 -3.905 -4.930
39 1HB ARG 8 1HB ARG 8 7.921 -3.745 -3.966
40 2HB ARG 8 2HB ARG 8 7.697 -5.028 -3.494
41 1HG ARG 8 1HG ARG 8 8.948 -5.120 -4.215
42 2HG ARG 8 2HG ARG 8 7.720 -5.812 -4.245
43 1HD ARG 8 1HD ARG 8 6.998 -5.074 -6.233
44 2HD ARG 8 2HD ARG 8 8.181 -4.563 -6.092
45 HE ARG 8 HE ARG 8 8.550 -5.604 -5.988
46 1HH1 ARG 8 2HH2 ARG 8 8.092 -5.001 -7.658
47 2HH1 ARG 8 1HH2 ARG 8 8.453 -5.365 -8.678
48 1HH2 ARG 8 2HH1 ARG 8 9.455 -6.575 -7.292
49 2HH2 ARG 8 1HH1 ARG 8 8.911 -5.885 -8.762
50 H GLN 9 H GLN 9 4.552 -4.866 -1.984
51 HA GLN 9 HA GLN 9 3.478 -7.188 -3.124
52 1HB GLN 9 1HB GLN 9 5.001 -7.004 -0.699
53 2HB GLN 9 2HB GLN 9 3.744 -8.171 -0.838
54 1HG GLN 9 1HG GLN 9 4.971 -8.314 -3.145
55 2HG GLN 9 2HG GLN 9 5.991 -8.301 -2.054
56 1HE2 GLN 9 1HE2 GLN 9 5.910 -10.049 -2.413
57 2HE2 GLN 9 2HE2 GLN 9 5.663 -11.037 -2.041
58 H CYS 10 H CYS 10 2.613 -5.775 -0.748
59 HA CYS 10 HA CYS 10 0.238 -6.095 -0.462
60 1HB CYS 10 1HB CYS 10 1.615 -6.382 1.290
61 2HB CYS 10 2HB CYS 10 1.378 -5.145 1.375
62 H LYS 11 H LYS 11 2.116 -3.659 -1.553
63 HA LYS 11 HA LYS 11 0.205 -1.651 -1.341
64 1HB LYS 11 1HB LYS 11 1.808 -0.190 -1.200
65 2HB LYS 11 2HB LYS 11 2.803 -1.492 -0.895
66 1HG LYS 11 1HG LYS 11 3.937 -0.638 -2.245
67 2HG LYS 11 2HG LYS 11 2.999 -1.400 -2.946
68 1HD LYS 11 1HD LYS 11 1.847 0.283 -3.299
69 2HD LYS 11 2HD LYS 11 3.165 0.303 -3.442
70 1HE LYS 11 1HE LYS 11 3.317 0.804 -4.982
71 2HE LYS 11 2HE LYS 11 3.048 -0.389 -4.909
72 1HZ LYS 11 1HZ LYS 11 2.280 -0.317 -5.452
73 2HZ LYS 11 2HZ LYS 11 2.242 -0.076 -5.245
74 3HZ LYS 11 3HZ LYS 11 2.968 0.314 -5.918
75 H LEU 12 H LEU 12 -0.145 -3.838 -3.102
76 HA LEU 12 HA LEU 12 0.610 -3.451 -5.642
77 1HB LEU 12 1HB LEU 12 -1.079 -4.883 -6.276
78 2HB LEU 12 2HB LEU 12 -0.480 -5.403 -4.737
79 HG LEU 12 HG LEU 12 -2.536 -3.948 -4.019
80 1HD1 LEU 12 1HD1 LEU 12 -3.608 -4.433 -6.059
81 2HD1 LEU 12 2HD1 LEU 12 -3.646 -4.513 -5.965
82 3HD1 LEU 12 3HD1 LEU 12 -3.564 -4.402 -5.928
83 1HD2 LEU 12 1HD2 LEU 12 -2.549 -6.254 -3.598
84 2HD2 LEU 12 2HD2 LEU 12 -3.020 -6.149 -3.764
85 3HD2 LEU 12 3HD2 LEU 12 -2.693 -6.368 -4.081
86 H LYS 13 H LYS 13 -1.424 -1.557 -3.686
87 HA LYS 13 HA LYS 13 -3.163 -0.539 -5.524
88 1HB LYS 13 1HB LYS 13 -2.578 1.482 -3.827
89 2HB LYS 13 2HB LYS 13 -3.555 0.409 -3.578
90 1HG LYS 13 1HG LYS 13 -2.331 1.207 -2.351
91 2HG LYS 13 2HG LYS 13 -2.823 0.162 -2.656
92 1HD LYS 13 1HD LYS 13 -0.841 -0.375 -2.002
93 2HD LYS 13 2HD LYS 13 -1.784 -0.219 -0.940
94 1HE LYS 13 1HE LYS 13 -2.244 -1.250 -2.966
95 2HE LYS 13 2HE LYS 13 -1.930 -1.610 -1.729
96 1HZ LYS 13 1HZ LYS 13 -3.496 -0.444 -1.650
97 2HZ LYS 13 2HZ LYS 13 -3.613 -0.836 -1.527
98 3HZ LYS 13 3HZ LYS 13 -3.035 -0.415 -0.612
99 HA PRO 14 HA PRO 14 -0.875 2.199 -7.812
100 1HB PRO 14 1HB PRO 14 -2.446 4.370 -8.099
101 2HB PRO 14 2HB PRO 14 -2.661 2.890 -8.997
102 1HG PRO 14 1HG PRO 14 -4.155 3.913 -6.734
103 2HG PRO 14 2HG PRO 14 -4.639 2.688 -7.933
104 1HD PRO 14 1HD PRO 14 -3.823 2.283 -5.270
105 2HD PRO 14 2HD PRO 14 -4.144 1.042 -6.467
106 H ALA 15 H ALA 15 0.088 2.690 -5.732
107 HA ALA 15 HA ALA 15 1.284 3.713 -4.188
108 1HB ALA 15 1HB ALA 15 2.293 5.032 -5.907
109 2HB ALA 15 2HB ALA 15 2.108 4.945 -6.075
110 3HB ALA 15 3HB ALA 15 2.067 5.159 -5.957
111 H GLY 16 H GLY 16 0.788 5.014 -2.608
112 1HA GLY 16 1HA GLY 16 -1.064 7.109 -3.011
113 2HA GLY 16 2HA GLY 16 -1.303 6.006 -1.810
114 H THR 17 H THR 17 0.283 6.738 -0.327
115 HA THR 17 HA THR 17 2.180 8.389 -0.082
116 HB THR 17 HB THR 17 -0.191 8.566 1.676
117 HG1 THR 17 1HG THR 17 -0.355 9.818 -0.132
118 1HG2 THR 17 1HG2 THR 17 1.493 10.296 1.953
119 2HG2 THR 17 2HG2 THR 17 1.405 10.261 2.049
120 3HG2 THR 17 3HG2 THR 17 1.498 10.157 2.003
121 H THR 18 H THR 18 2.630 8.256 2.458
122 HA THR 18 HA THR 18 3.302 5.647 3.008
123 HB THR 18 HB THR 18 4.674 8.110 3.223
124 HG1 THR 18 1HG THR 18 5.551 6.266 2.993
125 1HG2 THR 18 1HG2 THR 18 4.990 7.338 5.423
126 2HG2 THR 18 2HG2 THR 18 5.033 7.115 5.206
127 3HG2 THR 18 3HG2 THR 18 5.162 7.292 5.254
128 H CYS 19 H CYS 19 1.990 5.325 4.563
129 HA CYS 19 HA CYS 19 0.584 4.694 6.131
130 1HB CYS 19 1HB CYS 19 2.461 6.626 7.424
131 2HB CYS 19 2HB CYS 19 1.251 5.794 8.242
132 H TRP 20 H TRP 20 -0.873 5.957 4.509
133 HA TRP 20 HA TRP 20 -1.922 8.281 5.849
134 1HB TRP 20 1HB TRP 20 -0.720 8.492 3.637
135 2HB TRP 20 2HB TRP 20 -2.223 7.988 3.077
136 HD1 TRP 20 HD TRP 20 -2.748 9.928 3.315
137 HE1 TRP 20 1HE TRP 20 -3.518 12.223 3.613
138 HE3 TRP 20 3HE TRP 20 -1.782 9.696 4.692
139 HZ2 TRP 20 2HZ TRP 20 -3.634 13.652 4.374
140 HZ3 TRP 20 3HZ TRP 20 -2.251 11.582 5.196
141 HH2 TRP 20 HH TRP 20 -3.145 13.511 5.055
142 H LYS 21 H LYS 21 -3.046 5.928 3.631
143 HA LYS 21 HA LYS 21 -4.651 4.645 3.453
144 1HB LYS 21 1HB LYS 21 -4.747 3.681 5.226
145 2HB LYS 21 2HB LYS 21 -4.610 5.000 5.912
146 1HG LYS 21 1HG LYS 21 -6.121 5.879 5.762
147 2HG LYS 21 2HG LYS 21 -6.337 4.784 5.755
148 1HD LYS 21 1HD LYS 21 -5.810 4.159 6.691
149 2HD LYS 21 2HD LYS 21 -6.385 4.875 6.070
150 1HE LYS 21 1HE LYS 21 -8.244 5.324 6.474
151 2HE LYS 21 2HE LYS 21 -7.783 4.018 6.622
152 1HZ LYS 21 1HZ LYS 21 -7.606 4.474 7.630
153 2HZ LYS 21 2HZ LYS 21 -7.611 4.326 7.701
154 3HZ LYS 21 3HZ LYS 21 -6.615 4.779 7.659
155 H THR 22 H THR 22 -6.311 4.820 2.215
156 HA THR 22 HA THR 22 -7.636 7.088 2.261
157 HB THR 22 HB THR 22 -8.277 6.745 0.781
158 HG1 THR 22 1HG THR 22 -8.064 5.072 0.837
159 1HG2 THR 22 1HG2 THR 22 -6.117 6.210 0.348
160 2HG2 THR 22 2HG2 THR 22 -6.068 6.383 0.182
161 3HG2 THR 22 3HG2 THR 22 -6.040 6.435 0.406
162 H SER 23 H SER 23 -9.416 5.897 1.865
163 HA SER 23 HA SER 23 -10.572 5.511 3.370
164 1HB SER 23 1HB SER 23 -10.676 7.234 1.815
165 2HB SER 23 2HB SER 23 -11.919 6.225 1.969
166 HG SER 23 HG SER 23 -11.518 7.270 3.498
167 H LEU 24 H LEU 24 -9.946 4.260 1.269
168 HA LEU 24 HA LEU 24 -11.797 2.554 1.265
169 1HB LEU 24 1HB LEU 24 -12.687 3.040 -0.250
170 2HB LEU 24 2HB LEU 24 -11.650 3.548 -0.667
171 HG LEU 24 HG LEU 24 -11.208 2.795 -0.967
172 1HD1 LEU 24 1HD1 LEU 24 -12.384 2.638 -1.982
173 2HD1 LEU 24 2HD1 LEU 24 -12.562 2.733 -1.701
174 3HD1 LEU 24 3HD1 LEU 24 -12.592 2.978 -2.228
175 1HD2 LEU 24 1HD2 LEU 24 -11.556 3.503 -1.578
176 2HD2 LEU 24 2HD2 LEU 24 -11.495 3.906 -1.883
177 3HD2 LEU 24 3HD2 LEU 24 -11.537 3.584 -1.691
178 H THR 25 H THR 25 -9.036 2.985 -0.076
179 HA THR 25 HA THR 25 -8.425 0.346 0.057
180 HB THR 25 HB THR 25 -7.650 2.392 -1.704
181 HG1 THR 25 1HG THR 25 -8.672 0.722 -2.465
182 1HG2 THR 25 1HG2 THR 25 -5.988 0.652 -1.322
183 2HG2 THR 25 2HG2 THR 25 -6.015 0.815 -1.905
184 3HG2 THR 25 3HG2 THR 25 -5.644 1.153 -1.492
185 H SER 26 H SER 26 -6.758 2.078 1.198
186 HA SER 26 HA SER 26 -5.763 2.984 2.973
187 1HB SER 26 1HB SER 26 -5.643 0.052 2.838
188 2HB SER 26 2HB SER 26 -4.719 0.792 3.768
189 HG SER 26 HG SER 26 -6.018 0.945 4.534
190 H HIS 27 H HIS 27 -4.375 4.180 1.711
191 HA HIS 27 HA HIS 27 -2.400 3.070 0.094
192 1HB HIS 27 1HB HIS 27 -2.783 5.824 1.014
193 2HB HIS 27 2HB HIS 27 -1.974 5.300 -0.143
194 HD1 HIS 27 1HD HIS 27 -3.640 5.439 -0.719
195 HD2 HIS 27 2HD HIS 27 -3.651 5.703 -1.102
196 HE1 HIS 27 1HE HIS 27 -4.873 6.022 -2.114
197 HE2 HIS 27 2HE HIS 27 -4.399 6.538 -2.646
198 H TYR 28 H TYR 28 -1.567 3.689 2.672
199 HA TYR 28 HA TYR 28 0.081 4.560 4.029
200 1HB TYR 28 1HB TYR 28 -1.465 2.106 4.305
201 2HB TYR 28 2HB TYR 28 0.187 1.861 4.848
202 HD1 TYR 28 1HD TYR 28 -1.165 3.457 6.011
203 HD2 TYR 28 2HD TYR 28 -0.743 3.133 6.266
204 HE1 TYR 28 1HE TYR 28 -1.741 4.506 8.211
205 HE2 TYR 28 2HE TYR 28 -1.320 4.184 8.466
206 HH TYR 28 HH TYR 28 -1.970 5.247 9.820
207 H CYS 29 H CYS 29 1.030 4.166 1.452
208 HA CYS 29 HA CYS 29 3.552 3.418 1.821
209 1HB CYS 29 1HB CYS 29 1.821 1.333 1.345
210 2HB CYS 29 2HB CYS 29 2.911 1.458 0.520
211 H THR 30 H THR 30 4.265 2.716 -0.753
212 HA THR 30 HA THR 30 2.868 4.336 -2.585
213 HB THR 30 HB THR 30 4.910 5.416 -1.704
214 HG1 THR 30 1HG THR 30 4.602 5.872 -2.594
215 1HG2 THR 30 1HG2 THR 30 5.922 5.357 -2.385
216 2HG2 THR 30 2HG2 THR 30 5.685 5.075 -2.420
217 3HG2 THR 30 3HG2 THR 30 5.854 5.411 -2.412
218 H GLY 31 H GLY 31 5.510 2.180 -2.038
219 1HA GLY 31 1HA GLY 31 5.274 0.112 -3.425
220 2HA GLY 31 2HA GLY 31 5.339 1.222 -4.754
221 H LYS 32 H LYS 32 7.161 -0.783 -2.779
222 HA LYS 32 HA LYS 32 9.281 -1.161 -2.794
223 1HB LYS 32 1HB LYS 32 9.183 -0.642 -4.927
224 2HB LYS 32 2HB LYS 32 9.834 0.243 -4.454
225 1HG LYS 32 1HG LYS 32 10.740 -1.050 -4.679
226 2HG LYS 32 2HG LYS 32 10.591 -0.025 -4.908
227 1HD LYS 32 1HD LYS 32 10.186 1.203 -4.508
228 2HD LYS 32 2HD LYS 32 10.203 0.135 -3.965
229 1HE LYS 32 1HE LYS 32 11.546 -1.011 -5.368
230 2HE LYS 32 2HE LYS 32 11.665 0.131 -5.599
231 1HZ LYS 32 1HZ LYS 32 11.894 0.113 -5.169
232 2HZ LYS 32 2HZ LYS 32 11.924 0.239 -5.175
233 3HZ LYS 32 3HZ LYS 32 11.902 0.367 -4.195
234 H SER 33 H SER 33 9.625 0.850 -1.491
235 HA SER 33 HA SER 33 11.080 1.244 0.069
236 1HB SER 33 1HB SER 33 11.063 2.717 -2.011
237 2HB SER 33 2HB SER 33 10.620 3.509 -0.905
238 HG SER 33 HG SER 33 11.984 3.510 -0.564
239 H CYS 34 H CYS 34 8.797 0.824 0.897
240 HA CYS 34 HA CYS 34 7.872 2.789 2.547
241 1HB CYS 34 1HB CYS 34 5.628 1.536 2.319
242 2HB CYS 34 2HB CYS 34 5.974 2.509 1.348
243 H ASP 35 H ASP 35 5.989 1.236 3.943
244 HA ASP 35 HA ASP 35 6.645 -1.216 4.562
245 1HB ASP 35 1HB ASP 35 8.663 0.152 5.223
246 2HB ASP 35 2HB ASP 35 7.929 0.240 6.421
247 HD2 ASP 35 HD ASP 35 8.969 -1.355 7.222
248 H CYS 36 H CYS 36 4.377 0.225 4.390
249 HA CYS 36 HA CYS 36 3.333 0.210 7.068
250 1HB CYS 36 1HB CYS 36 3.323 2.401 5.159
251 2HB CYS 36 2HB CYS 36 1.757 2.060 5.819
252 HA PRO 37 HA PRO 37 0.339 -2.326 5.220
253 1HB PRO 37 1HB PRO 37 -1.643 -2.195 7.024
254 2HB PRO 37 2HB PRO 37 -0.236 -3.207 7.201
255 1HG PRO 37 1HG PRO 37 -0.869 -0.670 8.477
256 2HG PRO 37 2HG PRO 37 0.299 -1.910 8.990
257 1HD PRO 37 1HD PRO 37 0.827 0.585 7.796
258 2HD PRO 37 2HD PRO 37 1.998 -0.670 8.151
259 H LEU 38 H LEU 38 -1.211 -2.321 3.695
260 HA LEU 38 HA LEU 38 -2.614 0.178 3.514
261 1HB LEU 38 1HB LEU 38 -2.159 -1.543 1.198
262 2HB LEU 38 2HB LEU 38 -2.295 0.115 1.294
263 HG LEU 38 HG LEU 38 -0.272 -0.451 2.349
264 1HD1 LEU 38 1HD1 LEU 38 0.324 -1.350 1.052
265 2HD1 LEU 38 2HD1 LEU 38 0.117 -1.608 0.790
266 3HD1 LEU 38 3HD1 LEU 38 0.344 -1.451 0.494
267 1HD2 LEU 38 1HD2 LEU 38 0.006 0.916 0.914
268 2HD2 LEU 38 2HD2 LEU 38 -0.098 0.667 0.746
269 3HD2 LEU 38 3HD2 LEU 38 -0.222 0.851 0.783
270 H TYR 39 H TYR 39 -3.892 -1.313 5.148
271 HA TYR 39 HA TYR 39 -6.076 -2.249 3.877
272 1HB TYR 39 1HB TYR 39 -4.554 -3.913 3.773
273 2HB TYR 39 2HB TYR 39 -4.935 -3.971 5.165
274 HD1 TYR 39 1HD TYR 39 -6.100 -4.286 4.993
275 HD2 TYR 39 2HD TYR 39 -6.182 -4.600 4.058
276 HE1 TYR 39 1HE TYR 39 -7.484 -5.410 4.872
277 HE2 TYR 39 2HE TYR 39 -7.565 -5.722 3.941
278 HH TYR 39 HH TYR 39 -8.562 -6.469 4.273
279 HA PRO 40 HA PRO 40 -7.554 -1.367 7.018
280 1HB PRO 40 1HB PRO 40 -9.734 -2.195 6.842
281 2HB PRO 40 2HB PRO 40 -8.958 -0.966 6.182
282 1HG PRO 40 1HG PRO 40 -9.493 -3.172 5.110
283 2HG PRO 40 2HG PRO 40 -9.137 -1.733 4.496
284 1HD PRO 40 1HD PRO 40 -7.700 -3.539 4.479
285 2HD PRO 40 2HD PRO 40 -7.398 -2.043 3.964
286 H GLY 41 H GLY 41 -7.836 -2.754 8.250
287 1HA GLY 41 1HA GLY 41 -8.441 -4.011 9.222
288 2HA GLY 41 2HA GLY 41 -8.140 -4.219 9.199