NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
496387 |
2l30   |
17157 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H1 MET 1 2.495 2.756 18.845
2 H2 MET 1 H2 MET 1 1.838 1.471 18.049
3 H3 MET 1 H3 MET 1 2.896 1.224 19.269
4 HA MET 1 HA MET 1 1.364 2.128 20.881
5 HB2 MET 1 2HB MET 1 -0.534 2.347 18.493
6 HB3 MET 1 3HB MET 1 -0.981 2.580 20.180
7 HG2 MET 1 2HG MET 1 0.917 4.319 18.578
8 HG3 MET 1 3HG MET 1 -0.707 4.715 19.123
9 HE1 MET 1 1HE MET 1 0.058 7.005 20.140
10 HE2 MET 1 2HE MET 1 1.456 7.188 21.221
11 HE3 MET 1 3HE MET 1 1.699 6.673 19.538
12 H ALA 2 H ALA 2 -0.833 0.857 21.507
13 HA ALA 2 HA ALA 2 -0.239 -1.946 21.429
14 HB1 ALA 2 1HB ALA 2 -2.809 -0.482 22.163
15 HB2 ALA 2 2HB ALA 2 -2.431 -2.178 22.529
16 HB3 ALA 2 3HB ALA 2 -1.472 -0.881 23.268
17 H GLU 3 H GLU 3 -0.731 -3.469 20.012
18 HA GLU 3 HA GLU 3 -1.265 -4.471 18.085
19 HB2 GLU 3 2HB GLU 3 -4.043 -3.349 18.605
20 HB3 GLU 3 3HB GLU 3 -3.648 -4.804 17.700
21 HG2 GLU 3 2HG GLU 3 -3.278 -4.389 20.692
22 HG3 GLU 3 3HG GLU 3 -4.505 -5.362 19.904
23 H SER 4 H SER 4 -0.218 -1.832 17.628
24 HA SER 4 HA SER 4 -1.241 -0.486 15.415
25 HB2 SER 4 2HB SER 4 1.546 -1.187 16.343
26 HB3 SER 4 3HB SER 4 1.297 -0.171 14.902
27 HG SER 4 HG SER 4 0.123 1.292 16.169
28 H SER 5 H SER 5 0.278 -3.681 15.367
29 HA SER 5 HA SER 5 0.111 -3.744 12.381
30 HB2 SER 5 2HB SER 5 1.862 -5.478 14.137
31 HB3 SER 5 3HB SER 5 1.870 -5.361 12.363
32 HG SER 5 HG SER 5 3.549 -4.128 13.328
33 H ASP 6 H ASP 6 -2.027 -4.427 14.489
34 HA ASP 6 HA ASP 6 -2.596 -7.166 13.653
35 HB2 ASP 6 2HB ASP 6 -3.010 -6.381 15.977
36 HB3 ASP 6 3HB ASP 6 -4.281 -5.317 15.364
37 H LYS 7 H LYS 7 -2.349 -5.570 11.498
38 HA LYS 7 HA LYS 7 -5.046 -5.501 10.199
39 HB2 LYS 7 2HB LYS 7 -2.638 -3.724 9.592
40 HB3 LYS 7 3HB LYS 7 -4.178 -3.748 8.749
41 HG2 LYS 7 2HG LYS 7 -4.639 -1.990 10.072
42 HG3 LYS 7 3HG LYS 7 -5.167 -3.253 11.186
43 HD2 LYS 7 2HD LYS 7 -2.837 -3.180 12.214
44 HD3 LYS 7 3HD LYS 7 -2.463 -1.825 11.172
45 HE2 LYS 7 2HE LYS 7 -4.742 -1.910 13.215
46 HE3 LYS 7 3HE LYS 7 -3.137 -1.251 13.542
47 HZ1 LYS 7 3HZ LYS 7 -4.671 0.506 12.928
48 HZ2 LYS 7 1HZ LYS 7 -3.491 0.399 11.802
49 HZ3 LYS 7 2HZ LYS 7 -4.997 -0.190 11.487
50 H LEU 8 H LEU 8 -4.580 -5.584 7.757
51 HA LEU 8 HA LEU 8 -2.615 -7.790 7.110
52 HB2 LEU 8 2HB LEU 8 -5.051 -6.787 5.569
53 HB3 LEU 8 3HB LEU 8 -4.077 -8.200 5.178
54 HG LEU 8 HG LEU 8 -5.860 -7.954 7.646
55 HD11 LEU 8 1HD1 LEU 8 -7.098 -7.856 5.537
56 HD12 LEU 8 2HD1 LEU 8 -6.305 -9.349 4.987
57 HD13 LEU 8 3HD1 LEU 8 -7.399 -9.385 6.395
58 HD21 LEU 8 3HD2 LEU 8 -4.422 -10.336 6.399
59 HD22 LEU 8 1HD2 LEU 8 -4.010 -9.555 7.943
60 HD23 LEU 8 2HD2 LEU 8 -5.556 -10.404 7.770
61 H TYR 9 H TYR 9 -3.466 -4.405 6.546
62 HA TYR 9 HA TYR 9 -1.601 -4.369 4.216
63 HB2 TYR 9 2HB TYR 9 -4.356 -3.128 4.252
64 HB3 TYR 9 3HB TYR 9 -3.239 -3.208 2.890
65 HD1 TYR 9 HD1 TYR 9 -2.484 -6.051 2.819
66 HD2 TYR 9 HD2 TYR 9 -6.297 -4.220 3.580
67 HE1 TYR 9 HE1 TYR 9 -3.606 -8.159 2.173
68 HE2 TYR 9 HE2 TYR 9 -7.438 -6.331 2.919
69 HH TYR 9 HH TYR 9 -5.572 -9.251 1.939
70 H ARG 10 H ARG 10 -0.708 -2.372 3.738
71 HA ARG 10 HA ARG 10 -1.142 -0.107 5.584
72 HB2 ARG 10 2HB ARG 10 0.687 -1.047 6.666
73 HB3 ARG 10 3HB ARG 10 1.342 -1.728 5.203
74 HG2 ARG 10 2HG ARG 10 2.877 -0.079 5.942
75 HG3 ARG 10 3HG ARG 10 2.134 0.529 4.481
76 HD2 ARG 10 2HD ARG 10 2.232 2.392 5.942
77 HD3 ARG 10 3HD ARG 10 0.554 1.872 5.974
78 HE ARG 10 HE ARG 10 0.776 1.126 8.205
79 HH11 ARG 10 1HH2 ARG 10 3.831 2.729 7.295
80 HH12 ARG 10 2HH2 ARG 10 4.442 2.459 8.892
81 HH21 ARG 10 1HH1 ARG 10 1.516 1.176 10.115
82 HH22 ARG 10 2HH1 ARG 10 3.163 1.675 10.496
83 H VAL 11 H VAL 11 -0.897 1.896 4.607
84 HA VAL 11 HA VAL 11 0.341 2.120 1.914
85 HB VAL 11 HB VAL 11 -2.182 1.830 1.749
86 HG11 VAL 11 1HG1 VAL 11 -2.301 4.730 2.686
87 HG12 VAL 11 2HG1 VAL 11 -3.647 3.696 2.188
88 HG13 VAL 11 3HG1 VAL 11 -2.761 3.375 3.696
89 HG21 VAL 11 3HG2 VAL 11 -1.061 4.474 0.686
90 HG22 VAL 11 1HG2 VAL 11 -0.744 2.911 -0.049
91 HG23 VAL 11 2HG2 VAL 11 -2.399 3.532 -0.011
92 H GLU 12 H GLU 12 1.412 4.086 1.581
93 HA GLU 12 HA GLU 12 1.043 6.410 3.214
94 HB2 GLU 12 2HB GLU 12 3.214 6.400 4.385
95 HB3 GLU 12 3HB GLU 12 2.165 5.125 4.976
96 HG2 GLU 12 2HG GLU 12 3.395 3.436 3.734
97 HG3 GLU 12 3HG GLU 12 4.396 4.670 2.952
98 H TYR 13 H TYR 13 2.609 8.087 2.743
99 HA TYR 13 HA TYR 13 3.792 7.927 0.072
100 HB2 TYR 13 2HB TYR 13 4.029 10.099 2.168
101 HB3 TYR 13 3HB TYR 13 4.420 10.229 0.457
102 HD1 TYR 13 HD1 TYR 13 2.249 9.214 -1.053
103 HD2 TYR 13 HD2 TYR 13 2.042 11.151 2.788
104 HE1 TYR 13 HE1 TYR 13 0.020 10.160 -1.652
105 HE2 TYR 13 HE2 TYR 13 -0.201 12.071 2.207
106 HH TYR 13 HH TYR 13 -1.655 11.588 -1.035
107 H ALA 14 H ALA 14 5.943 7.803 -0.419
108 HA ALA 14 HA ALA 14 7.705 6.589 1.571
109 HB1 ALA 14 1HB ALA 14 8.031 7.210 -1.386
110 HB2 ALA 14 2HB ALA 14 9.152 6.227 -0.414
111 HB3 ALA 14 3HB ALA 14 7.483 5.679 -0.695
112 H LYS 15 H LYS 15 8.862 7.802 2.936
113 HA LYS 15 HA LYS 15 9.585 10.593 2.455
114 HB2 LYS 15 2HB LYS 15 10.240 8.600 4.670
115 HB3 LYS 15 3HB LYS 15 10.978 10.184 4.592
116 HG2 LYS 15 2HG LYS 15 9.185 10.360 6.108
117 HG3 LYS 15 3HG LYS 15 8.792 11.295 4.674
118 HD2 LYS 15 2HD LYS 15 6.824 10.168 5.529
119 HD3 LYS 15 3HD LYS 15 7.223 9.539 3.935
120 HE2 LYS 15 2HE LYS 15 8.339 7.565 5.046
121 HE3 LYS 15 3HE LYS 15 7.872 8.211 6.621
122 HZ1 LYS 15 3HZ LYS 15 5.918 7.571 4.481
123 HZ2 LYS 15 1HZ LYS 15 6.317 6.489 5.616
124 HZ3 LYS 15 2HZ LYS 15 5.575 7.897 6.058
125 H SER 16 H SER 16 11.243 7.554 1.996
126 HA SER 16 HA SER 16 13.329 8.732 0.436
127 HB2 SER 16 2HB SER 16 14.107 9.046 2.906
128 HB3 SER 16 3HB SER 16 14.415 7.298 2.857
129 HG SER 16 HG SER 16 16.251 8.418 2.136
130 H GLY 17 H GLY 17 14.857 7.018 -0.360
131 HA2 GLY 17 2HA GLY 17 13.278 4.848 -1.428
132 HA3 GLY 17 3HA GLY 17 14.953 5.239 -1.807
133 H ARG 18 H ARG 18 13.860 4.486 1.472
134 HA ARG 18 HA ARG 18 15.923 2.394 1.705
135 HB2 ARG 18 2HB ARG 18 13.930 3.491 3.737
136 HB3 ARG 18 3HB ARG 18 15.259 2.396 4.105
137 HG2 ARG 18 2HG ARG 18 15.556 5.246 3.060
138 HG3 ARG 18 3HG ARG 18 15.786 4.707 4.723
139 HD2 ARG 18 2HD ARG 18 17.656 3.206 3.929
140 HD3 ARG 18 3HD ARG 18 17.453 3.875 2.311
141 HE ARG 18 HE ARG 18 18.447 5.867 2.951
142 HH11 ARG 18 1HH2 ARG 18 17.997 3.964 5.865
143 HH12 ARG 18 2HH2 ARG 18 19.018 5.014 6.809
144 HH21 ARG 18 1HH1 ARG 18 19.730 7.154 4.217
145 HH22 ARG 18 2HH1 ARG 18 19.967 6.769 5.896
146 H ALA 19 H ALA 19 12.571 2.335 1.001
147 HA ALA 19 HA ALA 19 12.302 -0.514 1.797
148 HB1 ALA 19 1HB ALA 19 10.225 1.404 0.691
149 HB2 ALA 19 2HB ALA 19 9.945 -0.245 1.289
150 HB3 ALA 19 3HB ALA 19 10.474 1.017 2.413
151 H SER 20 H SER 20 11.756 -2.135 0.334
152 HA SER 20 HA SER 20 12.329 -1.622 -2.541
153 HB2 SER 20 2HB SER 20 13.470 -3.878 -0.867
154 HB3 SER 20 3HB SER 20 13.582 -3.762 -2.632
155 HG SER 20 HG SER 20 14.858 -1.972 -2.458
156 H CYS 21 HN CYS 21 11.313 -2.984 -4.022
157 HA CYS 21 HA CYS 21 8.650 -3.652 -3.122
158 HB2 CYS 21 2HB CYS 21 9.197 -2.430 -5.198
159 HB3 CYS 21 3HB CYS 21 9.931 -3.903 -5.857
160 H LYS 22 H LYS 22 8.235 -5.468 -2.121
161 HA LYS 22 HA LYS 22 9.668 -7.970 -2.471
162 HB2 LYS 22 2HB LYS 22 6.998 -7.307 -1.129
163 HB3 LYS 22 3HB LYS 22 7.801 -8.858 -0.990
164 HG2 LYS 22 2HG LYS 22 8.872 -6.187 0.024
165 HG3 LYS 22 3HG LYS 22 8.161 -7.463 0.996
166 HD2 LYS 22 2HD LYS 22 10.762 -7.645 -0.554
167 HD3 LYS 22 3HD LYS 22 10.574 -7.436 1.200
168 HE2 LYS 22 2HE LYS 22 9.392 -9.625 1.336
169 HE3 LYS 22 3HE LYS 22 9.644 -9.864 -0.398
170 HZ1 LYS 22 3HZ LYS 22 11.355 -10.990 0.901
171 HZ2 LYS 22 1HZ LYS 22 12.049 -9.815 0.008
172 HZ3 LYS 22 2HZ LYS 22 11.818 -9.597 1.612
173 H LYS 23 H LYS 23 7.377 -6.547 -4.442
174 HA LYS 23 HA LYS 23 6.322 -9.166 -5.419
175 HB2 LYS 23 2HB LYS 23 4.598 -7.641 -4.695
176 HB3 LYS 23 3HB LYS 23 5.228 -6.366 -5.731
177 HG2 LYS 23 2HG LYS 23 3.222 -7.421 -6.693
178 HG3 LYS 23 3HG LYS 23 4.618 -7.586 -7.749
179 HD2 LYS 23 2HD LYS 23 4.908 -9.961 -6.958
180 HD3 LYS 23 3HD LYS 23 3.478 -9.767 -5.938
181 HE2 LYS 23 2HE LYS 23 2.131 -9.275 -7.965
182 HE3 LYS 23 3HE LYS 23 3.572 -9.446 -8.972
183 HZ1 LYS 23 3HZ LYS 23 3.708 -11.773 -8.284
184 HZ2 LYS 23 1HZ LYS 23 2.396 -11.624 -7.319
185 HZ3 LYS 23 2HZ LYS 23 2.240 -11.486 -8.935
186 H CYS 24 HN CYS 24 7.676 -6.119 -6.861
187 HA CYS 24 HA CYS 24 8.317 -7.788 -9.244
188 HB2 CYS 24 2HB CYS 24 8.204 -6.018 -10.662
189 HB3 CYS 24 3HB CYS 24 6.767 -5.934 -9.656
190 H SER 25 H SER 25 9.896 -6.976 -6.581
191 HA SER 25 HA SER 25 12.012 -7.134 -5.913
192 HB2 SER 25 2HB SER 25 12.565 -8.433 -8.587
193 HB3 SER 25 3HB SER 25 13.568 -8.536 -7.131
194 HG SER 25 HG SER 25 12.170 -10.344 -7.349
195 H GLU 26 H GLU 26 11.287 -4.688 -7.560
196 HA GLU 26 HA GLU 26 14.051 -3.595 -7.949
197 HB2 GLU 26 2HB GLU 26 11.363 -2.383 -8.683
198 HB3 GLU 26 3HB GLU 26 12.942 -1.678 -9.009
199 HG2 GLU 26 2HG GLU 26 11.784 -4.202 -10.239
200 HG3 GLU 26 3HG GLU 26 12.052 -2.657 -11.027
201 H SER 27 H SER 27 13.439 -0.896 -7.281
202 HA SER 27 HA SER 27 12.745 -1.047 -4.398
203 HB2 SER 27 2HB SER 27 15.077 0.457 -5.562
204 HB3 SER 27 3HB SER 27 14.428 0.676 -3.917
205 HG SER 27 HG SER 27 16.211 -0.852 -4.103
206 H ILE 28 H ILE 28 12.060 0.946 -3.398
207 HA ILE 28 HA ILE 28 9.976 1.947 -5.204
208 HB ILE 28 HB ILE 28 10.123 2.024 -2.182
209 HG12 ILE 28 2HG1 ILE 28 8.653 0.068 -4.020
210 HG13 ILE 28 3HG1 ILE 28 10.109 -0.305 -3.098
211 HG21 ILE 28 1HG2 ILE 28 7.716 2.495 -2.299
212 HG22 ILE 28 2HG2 ILE 28 8.573 3.741 -3.183
213 HG23 ILE 28 3HG2 ILE 28 7.743 2.444 -4.069
214 HD11 ILE 28 3HD1 ILE 28 8.851 0.251 -0.983
215 HD12 ILE 28 1HD1 ILE 28 7.367 0.261 -1.966
216 HD13 ILE 28 2HD1 ILE 28 8.355 -1.207 -1.853
217 HA PRO 29 HA PRO 29 11.980 5.981 -5.295
218 HB2 PRO 29 2HB PRO 29 9.966 7.471 -6.465
219 HB3 PRO 29 3HB PRO 29 11.084 6.401 -7.345
220 HG2 PRO 29 2HG PRO 29 8.281 5.802 -6.387
221 HG3 PRO 29 3HG PRO 29 9.032 5.429 -7.973
222 HD2 PRO 29 2HD PRO 29 8.794 3.575 -6.006
223 HD3 PRO 29 3HD PRO 29 10.216 3.603 -7.095
224 H LYS 30 H LYS 30 11.901 7.982 -4.301
225 HA LYS 30 HA LYS 30 10.045 8.202 -1.975
226 HB2 LYS 30 2HB LYS 30 11.562 9.719 -0.987
227 HB3 LYS 30 3HB LYS 30 12.439 8.289 -1.551
228 HG2 LYS 30 2HG LYS 30 13.116 9.610 -3.596
229 HG3 LYS 30 3HG LYS 30 12.421 11.047 -2.825
230 HD2 LYS 30 2HD LYS 30 14.632 9.315 -1.627
231 HD3 LYS 30 3HD LYS 30 14.928 10.771 -2.577
232 HE2 LYS 30 2HE LYS 30 13.861 12.195 -0.963
233 HE3 LYS 30 3HE LYS 30 13.203 10.825 -0.072
234 HZ1 LYS 30 3HZ LYS 30 15.170 11.722 1.020
235 HZ2 LYS 30 1HZ LYS 30 15.464 10.186 0.554
236 HZ3 LYS 30 2HZ LYS 30 16.101 11.440 -0.291
237 H ASP 31 H ASP 31 9.141 10.263 -1.413
238 HA ASP 31 HA ASP 31 7.441 11.651 -1.839
239 HB2 ASP 31 2HB ASP 31 9.317 13.133 -2.491
240 HB3 ASP 31 3HB ASP 31 9.074 12.680 -4.176
241 H SER 32 H SER 32 7.006 9.133 -2.610
242 HA SER 32 HA SER 32 5.001 9.345 -4.779
243 HB2 SER 32 2HB SER 32 7.163 8.382 -5.715
244 HB3 SER 32 3HB SER 32 6.949 7.022 -4.593
245 HG SER 32 HG SER 32 5.779 6.269 -6.203
246 H LEU 33 H LEU 33 3.777 7.055 -4.733
247 HA LEU 33 HA LEU 33 2.885 6.716 -1.912
248 HB2 LEU 33 2HB LEU 33 1.262 7.662 -3.574
249 HB3 LEU 33 3HB LEU 33 1.431 6.191 -4.532
250 HG LEU 33 HG LEU 33 0.552 4.883 -2.553
251 HD11 LEU 33 1HD1 LEU 33 0.984 6.511 -0.736
252 HD12 LEU 33 2HD1 LEU 33 -0.121 7.669 -1.501
253 HD13 LEU 33 3HD1 LEU 33 -0.738 6.145 -0.848
254 HD21 LEU 33 3HD2 LEU 33 -0.885 5.553 -4.456
255 HD22 LEU 33 1HD2 LEU 33 -1.785 5.514 -2.931
256 HD23 LEU 33 2HD2 LEU 33 -1.271 7.075 -3.618
257 H ARG 34 H ARG 34 2.872 4.729 -0.957
258 HA ARG 34 HA ARG 34 3.504 2.300 -2.534
259 HB2 ARG 34 2HB ARG 34 5.297 1.639 -1.068
260 HB3 ARG 34 3HB ARG 34 5.655 3.191 -1.824
261 HG2 ARG 34 2HG ARG 34 5.146 4.379 0.266
262 HG3 ARG 34 3HG ARG 34 4.671 2.853 1.046
263 HD2 ARG 34 2HD ARG 34 6.966 1.975 0.713
264 HD3 ARG 34 3HD ARG 34 7.423 3.481 -0.093
265 HE ARG 34 HE ARG 34 6.376 3.705 2.674
266 HH11 ARG 34 1HH2 ARG 34 9.298 3.657 0.731
267 HH12 ARG 34 2HH2 ARG 34 10.261 4.311 2.024
268 HH21 ARG 34 1HH1 ARG 34 7.600 4.503 4.230
269 HH22 ARG 34 2HH1 ARG 34 9.342 4.638 4.035
270 H MET 35 H MET 35 3.188 0.355 -1.414
271 HA MET 35 HA MET 35 1.337 0.401 0.884
272 HB2 MET 35 2HB MET 35 0.877 -1.042 -1.753
273 HB3 MET 35 3HB MET 35 0.087 -1.507 -0.234
274 HG2 MET 35 2HG MET 35 -0.859 0.745 -0.012
275 HG3 MET 35 3HG MET 35 -0.142 1.196 -1.564
276 HE1 MET 35 3HE MET 35 -3.380 -0.042 0.178
277 HE2 MET 35 1HE MET 35 -3.921 -1.388 -0.852
278 HE3 MET 35 2HE MET 35 -2.434 -1.539 0.128
279 H ALA 36 H ALA 36 1.144 -1.660 1.938
280 HA ALA 36 HA ALA 36 3.310 -3.580 1.508
281 HB1 ALA 36 1HB ALA 36 4.481 -2.058 2.901
282 HB2 ALA 36 2HB ALA 36 3.116 -1.827 3.974
283 HB3 ALA 36 3HB ALA 36 3.991 -3.383 3.963
284 H ILE 37 H ILE 37 3.113 -5.492 2.895
285 HA ILE 37 HA ILE 37 0.324 -5.953 3.853
286 HB ILE 37 HB ILE 37 1.834 -7.334 1.817
287 HG12 ILE 37 2HG1 ILE 37 -0.941 -7.869 2.977
288 HG13 ILE 37 3HG1 ILE 37 -0.560 -6.582 1.827
289 HG21 ILE 37 1HG2 ILE 37 0.900 -9.196 4.024
290 HG22 ILE 37 2HG2 ILE 37 1.597 -9.618 2.412
291 HG23 ILE 37 3HG2 ILE 37 2.611 -8.846 3.609
292 HD11 ILE 37 3HD1 ILE 37 -1.405 -8.343 0.512
293 HD12 ILE 37 1HD1 ILE 37 0.368 -8.404 0.296
294 HD13 ILE 37 2HD1 ILE 37 -0.437 -9.569 1.369
295 H MET 38 H MET 38 -0.005 -7.028 5.715
296 HA MET 38 HA MET 38 2.296 -7.072 7.571
297 HB2 MET 38 2HB MET 38 -0.667 -7.399 8.076
298 HB3 MET 38 3HB MET 38 0.550 -7.165 9.324
299 HG2 MET 38 2HG MET 38 0.076 -5.032 7.220
300 HG3 MET 38 3HG MET 38 -1.015 -5.219 8.574
301 HE1 MET 38 3HE MET 38 2.992 -5.722 8.974
302 HE2 MET 38 1HE MET 38 2.582 -4.800 7.510
303 HE3 MET 38 2HE MET 38 3.401 -3.996 8.884
304 H VAL 39 H VAL 39 3.433 -8.872 7.506
305 HA VAL 39 HA VAL 39 1.960 -11.485 7.753
306 HB VAL 39 HB VAL 39 3.046 -11.304 5.601
307 HG11 VAL 39 1HG1 VAL 39 5.689 -11.104 7.103
308 HG12 VAL 39 2HG1 VAL 39 5.462 -11.311 5.355
309 HG13 VAL 39 3HG1 VAL 39 4.937 -9.815 6.139
310 HG21 VAL 39 3HG2 VAL 39 4.183 -13.401 5.560
311 HG22 VAL 39 1HG2 VAL 39 4.497 -13.348 7.299
312 HG23 VAL 39 2HG2 VAL 39 2.829 -13.514 6.692
313 H GLN 40 H GLN 40 2.631 -12.985 9.214
314 HA GLN 40 HA GLN 40 4.090 -12.085 11.559
315 HB2 GLN 40 2HB GLN 40 3.826 -14.501 12.242
316 HB3 GLN 40 3HB GLN 40 2.346 -13.575 11.987
317 HG2 GLN 40 2HG GLN 40 1.984 -14.625 9.799
318 HG3 GLN 40 3HG GLN 40 3.512 -15.491 9.919
319 HE21 GLN 40 2HE2 GLN 40 1.610 -17.195 9.420
320 HE22 GLN 40 1HE2 GLN 40 1.021 -18.000 10.868
321 H SER 41 H SER 41 6.218 -12.126 11.929
322 HA SER 41 HA SER 41 7.931 -12.926 9.727
323 HB2 SER 41 2HB SER 41 8.200 -10.783 10.802
324 HB3 SER 41 3HB SER 41 8.599 -11.575 12.333
325 HG SER 41 HG SER 41 10.339 -10.890 10.630
326 HA PRO 42 HA PRO 42 9.658 -16.568 11.626
327 HB2 PRO 42 2HB PRO 42 11.717 -16.243 9.455
328 HB3 PRO 42 3HB PRO 42 10.812 -17.708 9.934
329 HG2 PRO 42 2HG PRO 42 10.137 -16.328 7.688
330 HG3 PRO 42 3HG PRO 42 8.864 -16.984 8.772
331 HD2 PRO 42 2HD PRO 42 9.948 -14.147 8.666
332 HD3 PRO 42 3HD PRO 42 8.252 -14.719 8.726
333 H MET 43 H MET 43 11.139 -13.472 11.152
334 HA MET 43 HA MET 43 13.574 -14.157 12.751
335 HB2 MET 43 2HB MET 43 13.047 -12.017 10.686
336 HB3 MET 43 3HB MET 43 14.505 -12.080 11.668
337 HG2 MET 43 2HG MET 43 15.390 -13.876 10.597
338 HG3 MET 43 3HG MET 43 13.838 -14.632 10.274
339 HE1 MET 43 3HE MET 43 12.395 -14.363 8.258
340 HE2 MET 43 1HE MET 43 12.071 -12.712 8.814
341 HE3 MET 43 2HE MET 43 12.489 -13.007 7.108
342 H PHE 44 H PHE 44 10.715 -12.165 12.783
343 HA PHE 44 HA PHE 44 11.669 -10.668 15.190
344 HB2 PHE 44 2HB PHE 44 11.492 -9.198 13.271
345 HB3 PHE 44 3HB PHE 44 9.867 -9.762 12.924
346 HD1 PHE 44 HD1 PHE 44 11.906 -7.956 15.500
347 HD2 PHE 44 HD2 PHE 44 7.967 -8.737 13.922
348 HE1 PHE 44 HE1 PHE 44 10.959 -6.195 16.978
349 HE2 PHE 44 HE2 PHE 44 7.028 -6.969 15.391
350 HZ PHE 44 HZ PHE 44 8.521 -5.702 16.926
351 H ASP 45 H ASP 45 10.073 -10.109 16.747
352 HA ASP 45 HA ASP 45 8.328 -12.414 17.293
353 HB2 ASP 45 2HB ASP 45 10.045 -11.659 18.906
354 HB3 ASP 45 3HB ASP 45 9.198 -10.122 19.082
355 H GLY 46 H GLY 46 7.072 -11.244 15.304
356 HA2 GLY 46 2HA GLY 46 4.492 -10.592 16.055
357 HA3 GLY 46 3HA GLY 46 5.343 -9.045 16.017
358 H LYS 47 H LYS 47 3.956 -8.407 14.371
359 HA LYS 47 HA LYS 47 4.060 -9.716 11.716
360 HB2 LYS 47 2HB LYS 47 2.322 -7.531 12.901
361 HB3 LYS 47 3HB LYS 47 2.146 -8.133 11.264
362 HG2 LYS 47 2HG LYS 47 2.039 -10.128 13.555
363 HG3 LYS 47 3HG LYS 47 0.696 -9.015 13.385
364 HD2 LYS 47 2HD LYS 47 1.672 -10.989 11.297
365 HD3 LYS 47 3HD LYS 47 0.240 -11.162 12.301
366 HE2 LYS 47 2HE LYS 47 0.703 -9.079 10.134
367 HE3 LYS 47 3HE LYS 47 -0.348 -10.487 10.020
368 HZ1 LYS 47 3HZ LYS 47 -1.656 -8.520 10.526
369 HZ2 LYS 47 1HZ LYS 47 -1.705 -9.513 11.827
370 HZ3 LYS 47 2HZ LYS 47 -0.763 -8.161 11.840
371 H VAL 48 H VAL 48 4.951 -8.777 9.956
372 HA VAL 48 HA VAL 48 6.279 -6.126 10.259
373 HB VAL 48 HB VAL 48 8.187 -6.972 8.981
374 HG11 VAL 48 1HG1 VAL 48 7.656 -8.615 11.495
375 HG12 VAL 48 2HG1 VAL 48 9.238 -8.229 10.793
376 HG13 VAL 48 3HG1 VAL 48 8.232 -6.938 11.465
377 HG21 VAL 48 3HG2 VAL 48 8.595 -9.376 8.708
378 HG22 VAL 48 1HG2 VAL 48 6.952 -9.734 9.275
379 HG23 VAL 48 2HG2 VAL 48 7.202 -8.850 7.758
380 HA PRO 49 HA PRO 49 4.390 -5.283 6.361
381 HB2 PRO 49 2HB PRO 49 5.633 -2.971 5.592
382 HB3 PRO 49 3HB PRO 49 4.549 -3.060 7.011
383 HG2 PRO 49 2HG PRO 49 7.579 -3.196 6.951
384 HG3 PRO 49 3HG PRO 49 6.535 -2.220 8.029
385 HD2 PRO 49 2HD PRO 49 7.608 -4.639 8.766
386 HD3 PRO 49 3HD PRO 49 6.018 -4.072 9.357
387 H HIS 50 H HIS 50 4.590 -6.225 4.352
388 HA HIS 50 HA HIS 50 7.292 -6.392 3.069
389 HB2 HIS 50 2HB HIS 50 4.663 -7.842 2.689
390 HB3 HIS 50 3HB HIS 50 5.856 -7.789 1.399
391 HD2 HIS 50 HD2 HIS 50 6.975 -8.071 5.061
392 HE1 HIS 50 HE1 HIS 50 7.813 -11.825 3.222
393 HE2 HIS 50 HE2 HIS 50 8.179 -10.414 5.309
394 H TRP 51 H TRP 51 7.779 -4.419 2.244
395 HA TRP 51 HA TRP 51 5.762 -2.645 1.243
396 HB2 TRP 51 2HB TRP 51 8.803 -2.610 1.071
397 HB3 TRP 51 3HB TRP 51 7.746 -1.280 0.606
398 HD1 TRP 51 HD1 TRP 51 9.449 -2.709 3.601
399 HE1 TRP 51 HE1 TRP 51 8.751 -1.445 5.724
400 HE3 TRP 51 HE3 TRP 51 5.603 0.047 1.655
401 HZ2 TRP 51 HZ2 TRP 51 6.610 0.333 6.529
402 HZ3 TRP 51 HZ3 TRP 51 4.193 1.448 3.133
403 HH2 TRP 51 HH2 TRP 51 4.680 1.575 5.572
404 H TYR 52 H TYR 52 5.288 -1.980 -0.804
405 HA TYR 52 HA TYR 52 6.916 -2.570 -3.107
406 HB2 TYR 52 2HB TYR 52 4.945 -3.768 -4.293
407 HB3 TYR 52 3HB TYR 52 6.033 -4.672 -3.280
408 HD1 TYR 52 HD1 TYR 52 2.865 -2.703 -2.813
409 HD2 TYR 52 HD2 TYR 52 5.065 -6.310 -1.935
410 HE1 TYR 52 HE1 TYR 52 1.003 -3.523 -1.439
411 HE2 TYR 52 HE2 TYR 52 3.124 -7.168 -0.575
412 HH TYR 52 HH TYR 52 0.115 -5.257 -0.252
413 H HIS 53 H HIS 53 5.943 -1.683 -5.091
414 HA HIS 53 HA HIS 53 5.110 1.019 -4.824
415 HB2 HIS 53 2HB HIS 53 4.629 -0.816 -7.208
416 HB3 HIS 53 3HB HIS 53 4.678 0.927 -7.231
417 HD2 HIS 53 HD2 HIS 53 7.072 2.137 -6.745
418 HE1 HIS 53 HE1 HIS 53 9.482 -1.165 -7.938
419 HE2 HIS 53 HE2 HIS 53 9.489 1.314 -7.441
420 H PHE 54 H PHE 54 3.028 2.080 -5.341
421 HA PHE 54 HA PHE 54 0.792 0.990 -4.034
422 HB2 PHE 54 2HB PHE 54 0.847 3.322 -4.396
423 HB3 PHE 54 3HB PHE 54 1.055 3.146 -6.135
424 HD1 PHE 54 HD2 PHE 54 -1.458 2.211 -3.443
425 HD2 PHE 54 HD1 PHE 54 -0.809 3.475 -7.520
426 HE1 PHE 54 HE2 PHE 54 -3.905 2.200 -3.846
427 HE2 PHE 54 HE1 PHE 54 -3.271 3.525 -7.879
428 HZ PHE 54 HZ PHE 54 -4.805 2.833 -6.064
429 H SER 55 H SER 55 1.606 0.706 -7.546
430 HA SER 55 HA SER 55 -0.901 -0.572 -8.251
431 HB2 SER 55 2HB SER 55 0.217 -0.980 -10.411
432 HB3 SER 55 3HB SER 55 0.262 0.715 -9.898
433 HG SER 55 HG SER 55 2.290 0.103 -10.634
434 H CYS 56 HN CYS 56 2.244 -1.672 -7.112
435 HA CYS 56 HA CYS 56 2.010 -4.358 -7.945
436 HB2 CYS 56 2HB CYS 56 3.749 -2.958 -5.920
437 HB3 CYS 56 3HB CYS 56 3.892 -4.684 -6.270
438 H PHE 57 H PHE 57 0.732 -2.778 -5.024
439 HA PHE 57 HA PHE 57 0.055 -5.067 -3.470
440 HB2 PHE 57 2HB PHE 57 -0.429 -2.658 -2.856
441 HB3 PHE 57 3HB PHE 57 -1.712 -2.636 -4.039
442 HD1 PHE 57 HD2 PHE 57 -3.703 -4.275 -3.760
443 HD2 PHE 57 HD1 PHE 57 -0.873 -3.472 -0.611
444 HE1 PHE 57 HE2 PHE 57 -5.236 -5.275 -2.108
445 HE2 PHE 57 HE1 PHE 57 -2.396 -4.468 1.022
446 HZ PHE 57 HZ PHE 57 -4.597 -5.367 0.293
447 H TRP 58 H TRP 58 -1.716 -3.583 -6.182
448 HA TRP 58 HA TRP 58 -3.773 -5.580 -6.240
449 HB2 TRP 58 2HB TRP 58 -3.083 -3.581 -8.375
450 HB3 TRP 58 3HB TRP 58 -4.639 -4.316 -8.035
451 HD1 TRP 58 HD1 TRP 58 -2.517 -1.404 -7.259
452 HE1 TRP 58 HE1 TRP 58 -3.335 0.028 -5.316
453 HE3 TRP 58 HE3 TRP 58 -6.304 -4.436 -5.575
454 HZ2 TRP 58 HZ2 TRP 58 -5.445 -0.092 -3.290
455 HZ3 TRP 58 HZ3 TRP 58 -7.669 -3.743 -3.636
456 HH2 TRP 58 HH2 TRP 58 -7.222 -1.565 -2.500
457 H LYS 59 H LYS 59 -0.583 -5.621 -7.491
458 HA LYS 59 HA LYS 59 -1.054 -7.787 -9.453
459 HB2 LYS 59 2HB LYS 59 1.540 -6.679 -8.353
460 HB3 LYS 59 3HB LYS 59 1.390 -7.872 -9.644
461 HG2 LYS 59 2HG LYS 59 0.319 -6.289 -11.125
462 HG3 LYS 59 3HG LYS 59 0.143 -5.118 -9.822
463 HD2 LYS 59 2HD LYS 59 2.806 -5.323 -9.682
464 HD3 LYS 59 3HD LYS 59 2.634 -5.868 -11.358
465 HE2 LYS 59 2HE LYS 59 1.586 -3.844 -12.021
466 HE3 LYS 59 3HE LYS 59 1.141 -3.433 -10.360
467 HZ1 LYS 59 3HZ LYS 59 3.905 -3.370 -11.420
468 HZ2 LYS 59 1HZ LYS 59 2.959 -2.065 -11.103
469 HZ3 LYS 59 2HZ LYS 59 3.483 -3.031 -9.872
470 H VAL 60 H VAL 60 -0.013 -7.432 -6.049
471 HA VAL 60 HA VAL 60 0.326 -10.292 -5.568
472 HB VAL 60 HB VAL 60 -0.435 -8.090 -3.600
473 HG11 VAL 60 1HG1 VAL 60 0.569 -10.921 -3.113
474 HG12 VAL 60 2HG1 VAL 60 0.428 -9.652 -1.876
475 HG13 VAL 60 3HG1 VAL 60 -1.021 -10.263 -2.666
476 HG21 VAL 60 3HG2 VAL 60 2.279 -9.378 -4.075
477 HG22 VAL 60 1HG2 VAL 60 1.826 -7.757 -4.651
478 HG23 VAL 60 2HG2 VAL 60 1.890 -8.090 -2.923
479 H GLY 61 H GLY 61 -2.433 -8.078 -5.671
480 HA2 GLY 61 2HA GLY 61 -4.466 -8.621 -6.630
481 HA3 GLY 61 3HA GLY 61 -4.030 -10.328 -6.605
482 H HIS 62 H HIS 62 -3.883 -8.671 -3.549
483 HA HIS 62 HA HIS 62 -6.113 -10.198 -2.425
484 HB2 HIS 62 2HB HIS 62 -4.265 -8.043 -1.347
485 HB3 HIS 62 3HB HIS 62 -5.659 -8.615 -0.448
486 HD2 HIS 62 HD2 HIS 62 -3.306 -11.034 -2.417
487 HE1 HIS 62 HE1 HIS 62 -2.819 -11.840 1.739
488 HE2 HIS 62 HE2 HIS 62 -2.188 -12.584 -0.614
489 H SER 63 H SER 63 -8.128 -9.481 -1.821
490 HA SER 63 HA SER 63 -9.132 -6.915 -2.918
491 HB2 SER 63 2HB SER 63 -11.321 -7.681 -2.263
492 HB3 SER 63 3HB SER 63 -10.510 -8.950 -3.193
493 HG SER 63 HG SER 63 -11.472 -9.881 -1.409
494 H ILE 64 H ILE 64 -10.264 -5.434 -1.646
495 HA ILE 64 HA ILE 64 -9.697 -5.404 1.268
496 HB ILE 64 HB ILE 64 -9.323 -2.980 -0.494
497 HG12 ILE 64 2HG1 ILE 64 -7.136 -4.797 0.553
498 HG13 ILE 64 3HG1 ILE 64 -7.499 -4.373 -1.123
499 HG21 ILE 64 1HG2 ILE 64 -10.003 -2.627 1.911
500 HG22 ILE 64 2HG2 ILE 64 -8.566 -3.538 2.419
501 HG23 ILE 64 3HG2 ILE 64 -8.384 -1.993 1.575
502 HD11 ILE 64 3HD1 ILE 64 -7.039 -1.896 -0.316
503 HD12 ILE 64 1HD1 ILE 64 -6.153 -2.727 0.988
504 HD13 ILE 64 2HD1 ILE 64 -5.703 -2.974 -0.703
505 H ARG 65 H ARG 65 -11.477 -4.927 2.361
506 HA ARG 65 HA ARG 65 -13.955 -4.195 0.816
507 HB2 ARG 65 2HB ARG 65 -15.089 -5.905 2.370
508 HB3 ARG 65 3HB ARG 65 -14.222 -6.470 0.960
509 HG2 ARG 65 2HG ARG 65 -12.811 -6.391 3.634
510 HG3 ARG 65 3HG ARG 65 -13.944 -7.679 3.293
511 HD2 ARG 65 2HD ARG 65 -12.585 -8.729 1.802
512 HD3 ARG 65 3HD ARG 65 -11.963 -7.229 1.112
513 HE ARG 65 HE ARG 65 -10.842 -7.241 3.632
514 HH11 ARG 65 1HH2 ARG 65 -10.462 -9.384 0.829
515 HH12 ARG 65 2HH2 ARG 65 -8.942 -9.934 1.454
516 HH21 ARG 65 1HH1 ARG 65 -9.007 -7.864 4.173
517 HH22 ARG 65 2HH1 ARG 65 -8.004 -8.887 3.146
518 H HIS 66 H HIS 66 -12.146 -3.629 3.677
519 HA HIS 66 HA HIS 66 -13.901 -1.316 4.131
520 HB2 HIS 66 2HB HIS 66 -13.841 -1.522 6.575
521 HB3 HIS 66 3HB HIS 66 -14.892 -2.637 5.734
522 HD2 HIS 66 HD2 HIS 66 -12.946 -5.103 5.234
523 HE1 HIS 66 HE1 HIS 66 -12.685 -5.245 9.455
524 HE2 HIS 66 HE2 HIS 66 -12.342 -6.562 7.318
525 HA PRO 67 HA PRO 67 -9.434 -0.958 3.445
526 HB2 PRO 67 2HB PRO 67 -9.411 1.423 1.950
527 HB3 PRO 67 3HB PRO 67 -9.689 -0.200 1.266
528 HG2 PRO 67 2HG PRO 67 -11.757 1.804 2.175
529 HG3 PRO 67 3HG PRO 67 -11.705 0.885 0.628
530 HD2 PRO 67 2HD PRO 67 -13.256 0.057 2.637
531 HD3 PRO 67 3HD PRO 67 -12.265 -1.151 1.758
532 H ASP 68 H ASP 68 -11.366 1.791 4.684
533 HA ASP 68 HA ASP 68 -9.019 3.090 5.799
534 HB2 ASP 68 2HB ASP 68 -10.683 4.569 6.922
535 HB3 ASP 68 3HB ASP 68 -10.810 4.489 5.171
536 H VAL 69 H VAL 69 -10.618 0.307 6.710
537 HA VAL 69 HA VAL 69 -9.705 0.475 9.532
538 HB VAL 69 HB VAL 69 -11.281 -1.770 8.248
539 HG11 VAL 69 1HG1 VAL 69 -10.880 -0.963 11.156
540 HG12 VAL 69 2HG1 VAL 69 -11.895 -2.303 10.574
541 HG13 VAL 69 3HG1 VAL 69 -10.148 -2.367 10.342
542 HG21 VAL 69 3HG2 VAL 69 -13.302 -0.828 9.342
543 HG22 VAL 69 1HG2 VAL 69 -12.379 0.641 9.748
544 HG23 VAL 69 2HG2 VAL 69 -12.692 0.202 8.050
545 H GLU 70 H GLU 70 -9.429 -1.491 6.560
546 HA GLU 70 HA GLU 70 -7.467 -3.312 7.761
547 HB2 GLU 70 2HB GLU 70 -8.451 -3.048 4.876
548 HB3 GLU 70 3HB GLU 70 -7.514 -4.395 5.532
549 HG2 GLU 70 2HG GLU 70 -9.365 -4.993 7.032
550 HG3 GLU 70 3HG GLU 70 -10.332 -3.663 6.395
551 H VAL 71 H VAL 71 -7.257 -0.580 5.554
552 HA VAL 71 HA VAL 71 -4.329 -0.982 5.075
553 HB VAL 71 HB VAL 71 -6.066 1.195 3.941
554 HG11 VAL 71 1HG1 VAL 71 -4.185 1.334 2.442
555 HG12 VAL 71 2HG1 VAL 71 -3.581 1.446 4.121
556 HG13 VAL 71 3HG1 VAL 71 -3.384 -0.064 3.210
557 HG21 VAL 71 3HG2 VAL 71 -5.302 -1.549 2.829
558 HG22 VAL 71 1HG2 VAL 71 -6.949 -0.973 3.138
559 HG23 VAL 71 2HG2 VAL 71 -5.985 -0.213 1.864
560 H ASP 72 H ASP 72 -3.440 -0.699 6.938
561 HA ASP 72 HA ASP 72 -3.781 1.516 8.731
562 HB2 ASP 72 2HB ASP 72 -2.782 -0.704 9.207
563 HB3 ASP 72 3HB ASP 72 -1.414 -0.313 8.161
564 H GLY 73 H GLY 73 -2.672 3.480 8.814
565 HA2 GLY 73 2HA GLY 73 -1.216 5.206 8.200
566 HA3 GLY 73 3HA GLY 73 -0.580 4.211 6.892
567 H PHE 74 H PHE 74 -3.677 3.903 6.169
568 HA PHE 74 HA PHE 74 -4.007 5.764 4.078
569 HB2 PHE 74 2HB PHE 74 -5.317 3.700 4.459
570 HB3 PHE 74 3HB PHE 74 -6.012 4.386 5.924
571 HD1 PHE 74 HD2 PHE 74 -6.054 4.459 2.225
572 HD2 PHE 74 HD1 PHE 74 -7.844 5.983 5.844
573 HE1 PHE 74 HE2 PHE 74 -7.996 5.305 0.922
574 HE2 PHE 74 HE1 PHE 74 -9.775 6.836 4.523
575 HZ PHE 74 HZ PHE 74 -9.833 6.515 2.069
576 H SER 75 H SER 75 -4.714 6.202 7.534
577 HA SER 75 HA SER 75 -6.171 8.631 7.419
578 HB2 SER 75 2HB SER 75 -4.232 7.660 9.549
579 HB3 SER 75 3HB SER 75 -5.504 8.883 9.763
580 HG SER 75 HG SER 75 -6.188 6.811 10.472
581 H GLU 76 H GLU 76 -2.764 8.119 6.796
582 HA GLU 76 HA GLU 76 -2.017 10.934 7.297
583 HB2 GLU 76 2HB GLU 76 -0.372 8.639 6.188
584 HB3 GLU 76 3HB GLU 76 0.228 10.211 6.695
585 HG2 GLU 76 2HG GLU 76 -1.055 8.119 8.505
586 HG3 GLU 76 3HG GLU 76 0.660 8.482 8.388
587 H LEU 77 H LEU 77 -3.204 9.050 4.647
588 HA LEU 77 HA LEU 77 -1.974 10.517 2.466
589 HB2 LEU 77 2HB LEU 77 -4.306 8.606 2.701
590 HB3 LEU 77 3HB LEU 77 -4.029 9.503 1.226
591 HG LEU 77 HG LEU 77 -1.923 8.467 0.826
592 HD11 LEU 77 1HD1 LEU 77 -2.205 7.032 3.476
593 HD12 LEU 77 2HD1 LEU 77 -1.027 6.643 2.201
594 HD13 LEU 77 3HD1 LEU 77 -0.951 8.204 3.019
595 HD21 LEU 77 3HD2 LEU 77 -3.988 6.408 1.699
596 HD22 LEU 77 1HD2 LEU 77 -4.011 7.303 0.168
597 HD23 LEU 77 2HD2 LEU 77 -2.700 6.168 0.500
598 H ARG 78 H ARG 78 -2.857 12.085 1.150
599 HA ARG 78 HA ARG 78 -4.963 13.827 2.302
600 HB2 ARG 78 2HB ARG 78 -3.258 14.099 -0.223
601 HB3 ARG 78 3HB ARG 78 -4.443 15.286 0.318
602 HG2 ARG 78 2HG ARG 78 -1.887 14.483 1.769
603 HG3 ARG 78 3HG ARG 78 -2.256 16.030 1.000
604 HD2 ARG 78 2HD ARG 78 -4.172 16.310 2.629
605 HD3 ARG 78 3HD ARG 78 -3.638 14.865 3.469
606 HE ARG 78 HE ARG 78 -2.367 17.510 3.514
607 HH11 ARG 78 1HH2 ARG 78 -1.814 14.112 4.290
608 HH12 ARG 78 2HH2 ARG 78 -0.509 14.496 5.364
609 HH21 ARG 78 1HH1 ARG 78 -0.697 17.896 4.911
610 HH22 ARG 78 2HH1 ARG 78 0.100 16.574 5.710
611 H TRP 79 H TRP 79 -6.647 14.664 0.948
612 HA TRP 79 HA TRP 79 -8.379 12.566 0.845
613 HB2 TRP 79 2HB TRP 79 -9.713 14.305 1.128
614 HB3 TRP 79 3HB TRP 79 -8.532 15.418 0.479
615 HD1 TRP 79 HD1 TRP 79 -11.778 13.731 -0.380
616 HE1 TRP 79 HE1 TRP 79 -12.664 14.617 -2.626
617 HE3 TRP 79 HE3 TRP 79 -7.628 16.291 -1.925
618 HZ2 TRP 79 HZ2 TRP 79 -11.679 16.220 -4.826
619 HZ3 TRP 79 HZ3 TRP 79 -7.616 17.486 -4.095
620 HH2 TRP 79 HH2 TRP 79 -9.635 17.462 -5.557
621 H ASP 80 H ASP 80 -6.815 14.051 -2.003
622 HA ASP 80 HA ASP 80 -8.237 12.646 -4.006
623 HB2 ASP 80 2HB ASP 80 -6.835 14.667 -4.350
624 HB3 ASP 80 3HB ASP 80 -5.387 13.711 -4.041
625 H ASP 81 H ASP 81 -5.673 11.505 -1.931
626 HA ASP 81 HA ASP 81 -5.017 9.172 -3.647
627 HB2 ASP 81 2HB ASP 81 -3.762 10.253 -1.104
628 HB3 ASP 81 3HB ASP 81 -3.377 8.674 -1.789
629 H GLN 82 H GLN 82 -6.478 10.048 -0.482
630 HA GLN 82 HA GLN 82 -7.226 7.418 0.324
631 HB2 GLN 82 2HB GLN 82 -8.472 10.163 0.766
632 HB3 GLN 82 3HB GLN 82 -9.154 8.697 1.466
633 HG2 GLN 82 2HG GLN 82 -6.989 8.214 2.583
634 HG3 GLN 82 3HG GLN 82 -6.336 9.730 1.953
635 HE21 GLN 82 2HE2 GLN 82 -6.488 9.103 4.742
636 HE22 GLN 82 1HE2 GLN 82 -7.602 10.273 5.457
637 H GLN 83 H GLN 83 -9.009 9.802 -1.700
638 HA GLN 83 HA GLN 83 -11.246 8.136 -2.308
639 HB2 GLN 83 2HB GLN 83 -9.927 10.443 -3.799
640 HB3 GLN 83 3HB GLN 83 -11.441 9.707 -4.315
641 HG2 GLN 83 2HG GLN 83 -11.060 10.962 -1.563
642 HG3 GLN 83 3HG GLN 83 -11.667 11.829 -2.964
643 HE21 GLN 83 2HE2 GLN 83 -12.512 9.607 -0.391
644 HE22 GLN 83 1HE2 GLN 83 -14.183 9.395 -0.892
645 H LYS 84 H LYS 84 -7.998 8.239 -3.826
646 HA LYS 84 HA LYS 84 -8.797 6.662 -6.148
647 HB2 LYS 84 2HB LYS 84 -7.230 8.426 -6.419
648 HB3 LYS 84 3HB LYS 84 -6.241 7.883 -5.074
649 HG2 LYS 84 2HG LYS 84 -6.576 6.093 -7.475
650 HG3 LYS 84 3HG LYS 84 -5.526 7.500 -7.586
651 HD2 LYS 84 2HD LYS 84 -5.281 5.267 -5.549
652 HD3 LYS 84 3HD LYS 84 -4.261 5.506 -6.973
653 HE2 LYS 84 2HE LYS 84 -4.412 7.235 -4.475
654 HE3 LYS 84 3HE LYS 84 -3.103 6.161 -4.936
655 HZ1 LYS 84 3HZ LYS 84 -2.714 8.560 -5.418
656 HZ2 LYS 84 1HZ LYS 84 -2.549 7.608 -6.757
657 HZ3 LYS 84 2HZ LYS 84 -3.885 8.534 -6.544
658 H VAL 85 H VAL 85 -7.085 6.130 -3.053
659 HA VAL 85 HA VAL 85 -6.505 3.319 -3.572
660 HB VAL 85 HB VAL 85 -6.747 4.935 -1.000
661 HG11 VAL 85 1HG1 VAL 85 -5.835 2.042 -1.313
662 HG12 VAL 85 2HG1 VAL 85 -5.575 3.038 0.134
663 HG13 VAL 85 3HG1 VAL 85 -7.217 2.626 -0.356
664 HG21 VAL 85 3HG2 VAL 85 -4.780 5.396 -2.556
665 HG22 VAL 85 1HG2 VAL 85 -4.350 4.858 -0.929
666 HG23 VAL 85 2HG2 VAL 85 -4.267 3.725 -2.284
667 H LYS 86 H LYS 86 -9.253 4.938 -1.843
668 HA LYS 86 HA LYS 86 -10.668 2.450 -1.429
669 HB2 LYS 86 2HB LYS 86 -11.682 5.328 -1.456
670 HB3 LYS 86 3HB LYS 86 -12.653 3.908 -1.035
671 HG2 LYS 86 2HG LYS 86 -10.857 3.340 0.705
672 HG3 LYS 86 3HG LYS 86 -10.155 4.904 0.385
673 HD2 LYS 86 2HD LYS 86 -11.505 4.922 2.415
674 HD3 LYS 86 3HD LYS 86 -12.177 6.038 1.209
675 HE2 LYS 86 2HE LYS 86 -13.954 4.533 0.689
676 HE3 LYS 86 3HE LYS 86 -13.163 3.192 1.534
677 HZ1 LYS 86 3HZ LYS 86 -13.608 4.229 3.636
678 HZ2 LYS 86 1HZ LYS 86 -14.170 5.609 2.932
679 HZ3 LYS 86 2HZ LYS 86 -15.010 4.214 2.814
680 H LYS 87 H LYS 87 -10.899 4.851 -4.104
681 HA LYS 87 HA LYS 87 -12.900 3.415 -5.581
682 HB2 LYS 87 2HB LYS 87 -12.309 5.715 -6.045
683 HB3 LYS 87 3HB LYS 87 -10.705 5.224 -6.635
684 HG2 LYS 87 2HG LYS 87 -11.682 4.036 -8.506
685 HG3 LYS 87 3HG LYS 87 -13.317 4.171 -7.817
686 HD2 LYS 87 2HD LYS 87 -13.251 6.598 -8.045
687 HD3 LYS 87 3HD LYS 87 -11.598 6.520 -8.701
688 HE2 LYS 87 2HE LYS 87 -12.429 5.154 -10.610
689 HE3 LYS 87 3HE LYS 87 -14.070 5.228 -9.953
690 HZ1 LYS 87 3HZ LYS 87 -14.008 7.649 -10.252
691 HZ2 LYS 87 1HZ LYS 87 -12.492 7.580 -10.862
692 HZ3 LYS 87 2HZ LYS 87 -13.734 6.904 -11.676
693 H THR 88 H THR 88 -9.315 3.081 -5.659
694 HA THR 88 HA THR 88 -9.242 1.080 -7.654
695 HB THR 88 HB THR 88 -7.275 1.564 -5.403
696 HG1 THR 88 1HG THR 88 -7.489 3.338 -6.696
697 HG21 THR 88 1HG2 THR 88 -6.997 0.142 -8.081
698 HG22 THR 88 2HG2 THR 88 -5.668 0.538 -6.964
699 HG23 THR 88 3HG2 THR 88 -6.902 -0.628 -6.478
700 H ALA 89 H ALA 89 -9.768 0.774 -4.127
701 HA ALA 89 HA ALA 89 -9.629 -2.111 -4.074
702 HB1 ALA 89 1HB ALA 89 -9.220 -0.722 -2.102
703 HB2 ALA 89 2HB ALA 89 -10.876 -0.080 -2.174
704 HB3 ALA 89 3HB ALA 89 -10.613 -1.799 -1.837
705 H GLU 90 H GLU 90 -12.281 0.291 -4.480
706 HA GLU 90 HA GLU 90 -14.361 -1.690 -4.703
707 HB2 GLU 90 2HB GLU 90 -14.213 1.198 -5.659
708 HB3 GLU 90 3HB GLU 90 -15.652 0.185 -5.808
709 HG2 GLU 90 2HG GLU 90 -15.660 -0.156 -3.341
710 HG3 GLU 90 3HG GLU 90 -14.298 0.953 -3.197
711 H ALA 91 H ALA 91 -12.223 -0.190 -7.066
712 HA ALA 91 HA ALA 91 -13.444 -1.301 -9.417
713 HB1 ALA 91 1HB ALA 91 -10.716 -0.035 -8.885
714 HB2 ALA 91 2HB ALA 91 -11.423 -0.314 -10.493
715 HB3 ALA 91 3HB ALA 91 -12.192 0.820 -9.363
716 H GLY 92 H GLY 92 -11.551 -2.846 -7.058
717 HA2 GLY 92 2HA GLY 92 -10.734 -5.000 -6.968
718 HA3 GLY 92 3HA GLY 92 -11.226 -5.265 -8.644
719 H GLY 93 H GLY 93 -9.076 -2.566 -7.817
720 HA2 GLY 93 2HA GLY 93 -6.754 -2.601 -7.614
721 HA3 GLY 93 3HA GLY 93 -6.661 -4.116 -8.499
722 H VAL 94 H VAL 94 -5.158 -1.715 -8.796
723 HA VAL 94 HA VAL 94 -5.420 -1.486 -11.744
724 HB VAL 94 HB VAL 94 -6.168 0.644 -10.672
725 HG11 VAL 94 1HG1 VAL 94 -3.227 1.138 -10.057
726 HG12 VAL 94 2HG1 VAL 94 -4.612 2.204 -9.745
727 HG13 VAL 94 3HG1 VAL 94 -4.421 0.699 -8.828
728 HG21 VAL 94 3HG2 VAL 94 -5.376 0.502 -13.000
729 HG22 VAL 94 1HG2 VAL 94 -4.971 2.059 -12.259
730 HG23 VAL 94 2HG2 VAL 94 -3.712 0.824 -12.464
731 H THR 95 H THR 95 -3.656 -1.987 -12.843
732 HA THR 95 HA THR 95 -1.412 -3.071 -11.212
733 HB THR 95 HB THR 95 -1.615 -4.981 -12.890
734 HG1 THR 95 1HG THR 95 -3.599 -5.115 -13.956
735 HG21 THR 95 1HG2 THR 95 -3.522 -6.001 -11.714
736 HG22 THR 95 2HG2 THR 95 -2.536 -5.079 -10.566
737 HG23 THR 95 3HG2 THR 95 -4.069 -4.403 -11.155
738 H GLY 96 H GLY 96 -1.349 -0.610 -13.058
739 HA2 GLY 96 2HA GLY 96 0.274 -1.496 -15.241
740 HA3 GLY 96 3HA GLY 96 0.008 0.193 -14.770
741 H LYS 97 H LYS 97 2.354 -0.077 -15.701
742 HA LYS 97 HA LYS 97 4.437 -1.282 -14.155
743 HB2 LYS 97 2HB LYS 97 4.534 0.916 -16.265
744 HB3 LYS 97 3HB LYS 97 5.947 0.073 -15.621
745 HG2 LYS 97 2HG LYS 97 5.039 -2.097 -16.425
746 HG3 LYS 97 3HG LYS 97 3.649 -1.250 -17.131
747 HD2 LYS 97 2HD LYS 97 5.179 0.060 -18.582
748 HD3 LYS 97 3HD LYS 97 6.571 -0.797 -17.884
749 HE2 LYS 97 2HE LYS 97 5.637 -2.958 -18.682
750 HE3 LYS 97 3HE LYS 97 4.252 -2.106 -19.377
751 HZ1 LYS 97 3HZ LYS 97 5.800 -0.930 -20.852
752 HZ2 LYS 97 1HZ LYS 97 7.080 -1.719 -20.210
753 HZ3 LYS 97 2HZ LYS 97 5.952 -2.541 -21.054
754 H GLY 98 H GLY 98 2.911 1.801 -13.697
755 HA2 GLY 98 2HA GLY 98 3.105 3.286 -11.922
756 HA3 GLY 98 3HA GLY 98 4.301 2.216 -11.200
757 H GLN 99 H GLN 99 5.754 3.733 -10.584
758 HA GLN 99 HA GLN 99 6.515 6.044 -12.123
759 HB2 GLN 99 2HB GLN 99 7.725 4.720 -9.675
760 HB3 GLN 99 3HB GLN 99 8.203 6.308 -10.261
761 HG2 GLN 99 2HG GLN 99 5.374 5.652 -9.314
762 HG3 GLN 99 3HG GLN 99 6.658 6.271 -8.293
763 HE21 GLN 99 2HE2 GLN 99 5.190 8.071 -7.837
764 HE22 GLN 99 1HE2 GLN 99 5.078 9.387 -9.011
765 H ASP 100 H ASP 100 8.573 6.643 -12.891
766 HA ASP 100 HA ASP 100 10.317 4.493 -13.943
767 HB2 ASP 100 2HB ASP 100 9.547 6.420 -15.333
768 HB3 ASP 100 3HB ASP 100 10.437 7.512 -14.272
769 H GLY 101 H GLY 101 10.191 6.467 -11.152
770 HA2 GLY 101 2HA GLY 101 13.058 6.634 -10.564
771 HA3 GLY 101 3HA GLY 101 11.726 7.132 -9.528
772 H ILE 102 H ILE 102 13.697 5.913 -8.306
773 HA ILE 102 HA ILE 102 12.827 3.157 -7.658
774 HB ILE 102 HB ILE 102 14.257 3.183 -9.729
775 HG12 ILE 102 2HG1 ILE 102 15.534 1.624 -7.449
776 HG13 ILE 102 3HG1 ILE 102 13.997 1.193 -8.212
777 HG21 ILE 102 1HG2 ILE 102 16.553 3.902 -7.844
778 HG22 ILE 102 2HG2 ILE 102 16.655 3.586 -9.586
779 HG23 ILE 102 3HG2 ILE 102 15.811 5.019 -9.008
780 HD11 ILE 102 3HD1 ILE 102 16.717 1.290 -9.576
781 HD12 ILE 102 1HD1 ILE 102 15.767 -0.145 -9.165
782 HD13 ILE 102 2HD1 ILE 102 15.171 0.977 -10.404
783 H GLY 103 H GLY 103 14.190 6.052 -6.556
784 HA2 GLY 103 2HA GLY 103 13.807 5.915 -4.034
785 HA3 GLY 103 3HA GLY 103 15.135 4.757 -4.042
786 H SER 104 H SER 104 15.751 7.178 -6.348
787 HA SER 104 HA SER 104 18.035 8.084 -4.745
788 HB2 SER 104 2HB SER 104 17.257 8.593 -7.636
789 HB3 SER 104 3HB SER 104 18.772 9.117 -6.877
790 HG SER 104 HG SER 104 18.993 7.107 -7.979
791 H LYS 105 H LYS 105 18.721 10.284 -4.553
792 HA LYS 105 HA LYS 105 16.695 12.201 -3.809
793 HB2 LYS 105 2HB LYS 105 18.988 12.094 -2.844
794 HB3 LYS 105 3HB LYS 105 19.657 12.615 -4.398
795 HG2 LYS 105 2HG LYS 105 18.453 14.774 -4.207
796 HG3 LYS 105 3HG LYS 105 17.661 14.214 -2.728
797 HD2 LYS 105 2HD LYS 105 19.452 15.710 -2.138
798 HD3 LYS 105 3HD LYS 105 19.879 14.078 -1.601
799 HE2 LYS 105 2HE LYS 105 21.334 13.801 -3.600
800 HE3 LYS 105 3HE LYS 105 20.865 15.408 -4.171
801 HZ1 LYS 105 3HZ LYS 105 22.990 15.470 -2.999
802 HZ2 LYS 105 1HZ LYS 105 21.893 16.344 -2.168
803 HZ3 LYS 105 2HZ LYS 105 22.326 14.859 -1.640
804 H ALA 106 H ALA 106 15.807 13.870 -4.884
805 HA ALA 106 HA ALA 106 14.885 14.975 -6.618
806 HB1 ALA 106 1HB ALA 106 17.784 15.293 -7.464
807 HB2 ALA 106 2HB ALA 106 16.430 16.365 -7.880
808 HB3 ALA 106 3HB ALA 106 16.961 16.230 -6.195
809 H GLU 107 H GLU 107 14.701 12.217 -7.066
810 HA GLU 107 HA GLU 107 15.377 11.660 -9.830
811 HB2 GLU 107 2HB GLU 107 14.535 9.469 -9.429
812 HB3 GLU 107 3HB GLU 107 15.498 9.984 -8.049
813 HG2 GLU 107 2HG GLU 107 13.328 10.579 -6.856
814 HG3 GLU 107 3HG GLU 107 12.454 9.855 -8.208
815 H LYS 108 H LYS 108 12.915 13.512 -8.727
816 HA LYS 108 HA LYS 108 10.939 12.722 -10.832
817 HB2 LYS 108 2HB LYS 108 10.585 14.348 -8.286
818 HB3 LYS 108 3HB LYS 108 9.352 14.121 -9.532
819 HG2 LYS 108 2HG LYS 108 9.366 11.674 -9.145
820 HG3 LYS 108 3HG LYS 108 10.652 11.856 -7.944
821 HD2 LYS 108 2HD LYS 108 8.554 11.599 -6.790
822 HD3 LYS 108 3HD LYS 108 9.161 13.242 -6.535
823 HE2 LYS 108 2HE LYS 108 7.615 14.072 -8.316
824 HE3 LYS 108 3HE LYS 108 7.007 12.424 -8.542
825 HZ1 LYS 108 3HZ LYS 108 5.571 13.707 -7.046
826 HZ2 LYS 108 1HZ LYS 108 6.275 12.480 -6.199
827 HZ3 LYS 108 2HZ LYS 108 6.823 13.986 -6.012
Start of MODEL 2
1 H1 MET 1 H1 MET 1 -1.111 -17.586 15.685
2 H2 MET 1 H2 MET 1 -0.838 -19.175 15.956
3 H3 MET 1 H3 MET 1 -0.524 -18.522 14.483
4 HA MET 1 HA MET 1 0.891 -17.855 16.982
5 HB2 MET 1 2HB MET 1 1.868 -19.438 14.559
6 HB3 MET 1 3HB MET 1 2.892 -18.871 15.878
7 HG2 MET 1 2HG MET 1 0.630 -20.886 16.106
8 HG3 MET 1 3HG MET 1 2.358 -21.201 16.198
9 HE1 MET 1 1HE MET 1 0.274 -22.290 18.322
10 HE2 MET 1 2HE MET 1 2.025 -22.595 18.404
11 HE3 MET 1 3HE MET 1 1.159 -21.995 19.834
12 H ALA 2 H ALA 2 2.684 -16.405 16.751
13 HA ALA 2 HA ALA 2 3.503 -14.377 16.216
14 HB1 ALA 2 1HB ALA 2 3.593 -15.621 13.449
15 HB2 ALA 2 2HB ALA 2 4.601 -14.285 14.045
16 HB3 ALA 2 3HB ALA 2 4.754 -15.895 14.767
17 H GLU 3 H GLU 3 0.886 -13.977 16.583
18 HA GLU 3 HA GLU 3 0.100 -11.975 14.507
19 HB2 GLU 3 2HB GLU 3 -1.508 -13.799 14.743
20 HB3 GLU 3 3HB GLU 3 -1.622 -13.511 16.479
21 HG2 GLU 3 2HG GLU 3 -3.562 -12.609 15.297
22 HG3 GLU 3 3HG GLU 3 -2.663 -11.328 16.098
23 H SER 4 H SER 4 -0.419 -9.940 15.101
24 HA SER 4 HA SER 4 -0.160 -8.954 17.870
25 HB2 SER 4 2HB SER 4 1.702 -7.421 17.296
26 HB3 SER 4 3HB SER 4 2.174 -9.118 17.171
27 HG SER 4 HG SER 4 1.502 -7.337 15.037
28 H SER 5 H SER 5 -1.483 -8.606 14.727
29 HA SER 5 HA SER 5 -1.914 -5.651 15.021
30 HB2 SER 5 2HB SER 5 -0.771 -7.149 12.632
31 HB3 SER 5 3HB SER 5 -1.163 -5.423 12.684
32 HG SER 5 HG SER 5 1.040 -5.742 13.125
33 H ASP 6 H ASP 6 -3.942 -5.086 14.722
34 HA ASP 6 HA ASP 6 -5.916 -6.904 13.652
35 HB2 ASP 6 2HB ASP 6 -6.146 -4.055 14.681
36 HB3 ASP 6 3HB ASP 6 -7.508 -5.114 14.325
37 H LYS 7 H LYS 7 -3.898 -5.579 11.702
38 HA LYS 7 HA LYS 7 -5.760 -4.979 9.554
39 HB2 LYS 7 2HB LYS 7 -3.891 -3.116 8.934
40 HB3 LYS 7 3HB LYS 7 -5.439 -2.799 9.693
41 HG2 LYS 7 2HG LYS 7 -3.844 -1.520 10.850
42 HG3 LYS 7 3HG LYS 7 -4.355 -2.803 11.933
43 HD2 LYS 7 2HD LYS 7 -2.243 -4.082 11.075
44 HD3 LYS 7 3HD LYS 7 -1.731 -2.540 10.407
45 HE2 LYS 7 2HE LYS 7 -2.220 -3.252 13.333
46 HE3 LYS 7 3HE LYS 7 -0.676 -2.871 12.567
47 HZ1 LYS 7 3HZ LYS 7 -1.457 -0.964 13.785
48 HZ2 LYS 7 1HZ LYS 7 -1.553 -0.571 12.202
49 HZ3 LYS 7 2HZ LYS 7 -2.903 -0.958 13.032
50 H LEU 8 H LEU 8 -4.798 -5.289 7.494
51 HA LEU 8 HA LEU 8 -2.591 -7.328 7.520
52 HB2 LEU 8 2HB LEU 8 -4.841 -7.033 5.490
53 HB3 LEU 8 3HB LEU 8 -3.665 -8.324 5.631
54 HG LEU 8 HG LEU 8 -4.804 -8.510 8.093
55 HD11 LEU 8 1HD1 LEU 8 -7.049 -7.595 6.234
56 HD12 LEU 8 2HD1 LEU 8 -7.271 -8.319 7.842
57 HD13 LEU 8 3HD1 LEU 8 -6.502 -6.740 7.682
58 HD21 LEU 8 3HD2 LEU 8 -4.548 -10.359 6.489
59 HD22 LEU 8 1HD2 LEU 8 -6.187 -10.355 7.159
60 HD23 LEU 8 2HD2 LEU 8 -5.897 -9.729 5.518
61 H TYR 9 H TYR 9 -3.363 -4.187 6.579
62 HA TYR 9 HA TYR 9 -1.439 -4.186 4.315
63 HB2 TYR 9 2HB TYR 9 -4.141 -2.832 4.283
64 HB3 TYR 9 3HB TYR 9 -3.016 -2.999 2.945
65 HD1 TYR 9 HD2 TYR 9 -2.360 -5.758 2.742
66 HD2 TYR 9 HD1 TYR 9 -6.102 -4.026 3.926
67 HE1 TYR 9 HE2 TYR 9 -3.535 -7.839 2.020
68 HE2 TYR 9 HE1 TYR 9 -7.294 -6.098 3.209
69 HH TYR 9 HH TYR 9 -7.091 -8.097 2.079
70 H ARG 10 H ARG 10 -0.639 -2.120 3.786
71 HA ARG 10 HA ARG 10 -0.890 0.079 5.759
72 HB2 ARG 10 2HB ARG 10 0.990 -1.177 6.573
73 HB3 ARG 10 3HB ARG 10 1.570 -1.468 4.954
74 HG2 ARG 10 2HG ARG 10 3.104 0.015 5.952
75 HG3 ARG 10 3HG ARG 10 2.222 0.959 4.762
76 HD2 ARG 10 2HD ARG 10 0.712 1.722 6.678
77 HD3 ARG 10 3HD ARG 10 1.829 0.919 7.789
78 HE ARG 10 HE ARG 10 3.367 2.721 6.242
79 HH11 ARG 10 1HH2 ARG 10 0.791 3.025 8.691
80 HH12 ARG 10 2HH2 ARG 10 1.106 4.774 8.758
81 HH21 ARG 10 1HH1 ARG 10 3.768 4.822 6.749
82 HH22 ARG 10 2HH1 ARG 10 2.626 5.693 7.805
83 H VAL 11 H VAL 11 -0.547 2.150 4.814
84 HA VAL 11 HA VAL 11 0.553 2.359 2.066
85 HB VAL 11 HB VAL 11 -1.980 2.143 2.009
86 HG11 VAL 11 1HG1 VAL 11 -1.957 5.031 3.006
87 HG12 VAL 11 2HG1 VAL 11 -3.359 4.055 2.523
88 HG13 VAL 11 3HG1 VAL 11 -2.441 3.651 3.986
89 HG21 VAL 11 3HG2 VAL 11 -0.567 3.161 0.160
90 HG22 VAL 11 1HG2 VAL 11 -2.216 3.793 0.238
91 HG23 VAL 11 2HG2 VAL 11 -0.852 4.746 0.868
92 H GLU 12 H GLU 12 1.545 4.341 1.578
93 HA GLU 12 HA GLU 12 1.332 6.683 3.220
94 HB2 GLU 12 2HB GLU 12 3.626 6.718 4.107
95 HB3 GLU 12 3HB GLU 12 2.730 5.372 4.783
96 HG2 GLU 12 2HG GLU 12 3.852 3.818 3.184
97 HG3 GLU 12 3HG GLU 12 4.747 5.181 2.503
98 H TYR 13 H TYR 13 2.577 8.405 2.477
99 HA TYR 13 HA TYR 13 3.786 8.220 -0.189
100 HB2 TYR 13 2HB TYR 13 3.987 10.432 1.870
101 HB3 TYR 13 3HB TYR 13 4.367 10.537 0.154
102 HD1 TYR 13 HD1 TYR 13 2.200 9.406 -1.297
103 HD2 TYR 13 HD2 TYR 13 1.988 11.447 2.485
104 HE1 TYR 13 HE1 TYR 13 -0.058 10.277 -1.900
105 HE2 TYR 13 HE2 TYR 13 -0.281 12.305 1.900
106 HH TYR 13 HH TYR 13 -1.774 11.638 -1.290
107 H ALA 14 H ALA 14 5.895 7.983 -0.668
108 HA ALA 14 HA ALA 14 7.702 6.965 1.373
109 HB1 ALA 14 1HB ALA 14 8.038 7.493 -1.606
110 HB2 ALA 14 2HB ALA 14 9.164 6.572 -0.586
111 HB3 ALA 14 3HB ALA 14 7.515 5.974 -0.870
112 H LYS 15 H LYS 15 8.559 8.433 2.772
113 HA LYS 15 HA LYS 15 9.453 11.091 1.962
114 HB2 LYS 15 2HB LYS 15 8.476 10.546 4.184
115 HB3 LYS 15 3HB LYS 15 9.856 9.514 4.542
116 HG2 LYS 15 2HG LYS 15 10.041 11.628 5.694
117 HG3 LYS 15 3HG LYS 15 11.358 11.472 4.536
118 HD2 LYS 15 2HD LYS 15 10.168 12.970 2.958
119 HD3 LYS 15 3HD LYS 15 8.807 13.103 4.075
120 HE2 LYS 15 2HE LYS 15 11.677 13.958 4.686
121 HE3 LYS 15 3HE LYS 15 10.428 15.042 4.070
122 HZ1 LYS 15 3HZ LYS 15 9.121 14.589 6.079
123 HZ2 LYS 15 1HZ LYS 15 10.296 13.616 6.673
124 HZ3 LYS 15 2HZ LYS 15 10.578 15.207 6.469
125 H SER 16 H SER 16 10.968 8.000 2.122
126 HA SER 16 HA SER 16 13.443 8.957 0.940
127 HB2 SER 16 2HB SER 16 13.810 9.161 3.454
128 HB3 SER 16 3HB SER 16 13.673 7.396 3.530
129 HG SER 16 HG SER 16 15.550 8.989 2.076
130 H GLY 17 H GLY 17 14.298 7.332 -0.383
131 HA2 GLY 17 2HA GLY 17 12.482 5.158 -0.943
132 HA3 GLY 17 3HA GLY 17 13.884 5.639 -1.892
133 H ARG 18 H ARG 18 13.445 4.425 1.441
134 HA ARG 18 HA ARG 18 15.812 2.675 1.240
135 HB2 ARG 18 2HB ARG 18 13.866 2.987 3.562
136 HB3 ARG 18 3HB ARG 18 15.499 2.331 3.621
137 HG2 ARG 18 2HG ARG 18 14.717 5.230 3.125
138 HG3 ARG 18 3HG ARG 18 15.430 4.558 4.587
139 HD2 ARG 18 2HD ARG 18 17.505 4.025 3.366
140 HD3 ARG 18 3HD ARG 18 16.803 4.649 1.868
141 HE ARG 18 HE ARG 18 16.587 6.864 2.947
142 HH11 ARG 18 1HH2 ARG 18 19.012 4.748 4.367
143 HH12 ARG 18 2HH2 ARG 18 19.866 6.088 5.083
144 HH21 ARG 18 1HH1 ARG 18 17.705 8.476 3.867
145 HH22 ARG 18 2HH1 ARG 18 19.145 8.156 4.795
146 H ALA 19 H ALA 19 12.405 2.205 0.904
147 HA ALA 19 HA ALA 19 12.400 -0.579 1.750
148 HB1 ALA 19 1HB ALA 19 10.509 0.912 2.217
149 HB2 ALA 19 2HB ALA 19 10.243 1.148 0.474
150 HB3 ALA 19 3HB ALA 19 10.011 -0.454 1.207
151 H SER 20 H SER 20 11.868 -2.377 0.481
152 HA SER 20 HA SER 20 12.624 -2.197 -2.416
153 HB2 SER 20 2HB SER 20 13.183 -4.488 -0.521
154 HB3 SER 20 3HB SER 20 13.615 -4.387 -2.239
155 HG SER 20 HG SER 20 15.376 -3.820 -0.868
156 H CYS 21 HN CYS 21 11.331 -3.162 -3.890
157 HA CYS 21 HA CYS 21 8.628 -3.708 -3.041
158 HB2 CYS 21 2HB CYS 21 9.368 -2.407 -5.040
159 HB3 CYS 21 3HB CYS 21 9.899 -3.925 -5.780
160 H LYS 22 H LYS 22 7.452 -5.510 -3.200
161 HA LYS 22 HA LYS 22 8.932 -8.098 -3.028
162 HB2 LYS 22 2HB LYS 22 6.347 -7.125 -1.777
163 HB3 LYS 22 3HB LYS 22 7.018 -8.737 -1.513
164 HG2 LYS 22 2HG LYS 22 8.549 -6.195 -0.915
165 HG3 LYS 22 3HG LYS 22 7.394 -6.875 0.212
166 HD2 LYS 22 2HD LYS 22 8.652 -9.008 0.244
167 HD3 LYS 22 3HD LYS 22 9.821 -8.355 -0.931
168 HE2 LYS 22 2HE LYS 22 9.210 -7.090 1.766
169 HE3 LYS 22 3HE LYS 22 10.478 -8.304 1.553
170 HZ1 LYS 22 3HZ LYS 22 10.414 -5.691 0.109
171 HZ2 LYS 22 1HZ LYS 22 11.375 -6.043 1.393
172 HZ3 LYS 22 2HZ LYS 22 11.577 -6.835 -0.019
173 H LYS 23 H LYS 23 7.204 -6.675 -5.315
174 HA LYS 23 HA LYS 23 6.143 -9.263 -6.424
175 HB2 LYS 23 2HB LYS 23 4.295 -7.834 -5.830
176 HB3 LYS 23 3HB LYS 23 5.011 -6.468 -6.682
177 HG2 LYS 23 2HG LYS 23 3.132 -7.412 -7.887
178 HG3 LYS 23 3HG LYS 23 4.621 -7.518 -8.829
179 HD2 LYS 23 2HD LYS 23 4.822 -9.916 -8.356
180 HD3 LYS 23 3HD LYS 23 3.450 -9.847 -7.239
181 HE2 LYS 23 2HE LYS 23 1.980 -9.122 -9.119
182 HE3 LYS 23 3HE LYS 23 3.351 -9.238 -10.228
183 HZ1 LYS 23 3HZ LYS 23 3.472 -11.619 -9.740
184 HZ2 LYS 23 1HZ LYS 23 2.219 -11.524 -8.695
185 HZ3 LYS 23 2HZ LYS 23 1.980 -11.246 -10.283
186 H CYS 24 HN CYS 24 7.426 -6.049 -7.477
187 HA CYS 24 HA CYS 24 8.358 -7.355 -9.968
188 HB2 CYS 24 2HB CYS 24 8.607 -5.271 -10.925
189 HB3 CYS 24 3HB CYS 24 7.070 -5.227 -10.063
190 H SER 25 H SER 25 9.659 -6.831 -6.943
191 HA SER 25 HA SER 25 11.685 -7.008 -6.008
192 HB2 SER 25 2HB SER 25 12.491 -8.448 -8.542
193 HB3 SER 25 3HB SER 25 13.313 -8.520 -6.974
194 HG SER 25 HG SER 25 11.873 -10.287 -7.290
195 H GLU 26 H GLU 26 11.224 -4.567 -7.605
196 HA GLU 26 HA GLU 26 14.052 -3.609 -7.856
197 HB2 GLU 26 2HB GLU 26 11.452 -2.277 -8.695
198 HB3 GLU 26 3HB GLU 26 13.062 -1.593 -8.873
199 HG2 GLU 26 2HG GLU 26 12.001 -4.063 -10.289
200 HG3 GLU 26 3HG GLU 26 12.285 -2.479 -10.992
201 H SER 27 H SER 27 13.479 -0.894 -7.131
202 HA SER 27 HA SER 27 12.844 -1.173 -4.226
203 HB2 SER 27 2HB SER 27 15.154 0.414 -5.333
204 HB3 SER 27 3HB SER 27 14.639 0.278 -3.630
205 HG SER 27 HG SER 27 16.371 -1.151 -4.145
206 H ILE 28 H ILE 28 11.996 0.576 -3.146
207 HA ILE 28 HA ILE 28 10.135 1.963 -4.945
208 HB ILE 28 HB ILE 28 10.046 1.629 -1.939
209 HG12 ILE 28 2HG1 ILE 28 8.602 -0.064 -4.034
210 HG13 ILE 28 3HG1 ILE 28 10.064 -0.592 -3.202
211 HG21 ILE 28 1HG2 ILE 28 8.628 3.479 -2.832
212 HG22 ILE 28 2HG2 ILE 28 7.887 2.353 -3.985
213 HG23 ILE 28 3HG2 ILE 28 7.649 2.138 -2.247
214 HD11 ILE 28 3HD1 ILE 28 8.221 -1.587 -2.097
215 HD12 ILE 28 1HD1 ILE 28 8.937 -0.386 -1.016
216 HD13 ILE 28 2HD1 ILE 28 7.411 -0.030 -1.857
217 HA PRO 29 HA PRO 29 12.741 5.587 -4.172
218 HB2 PRO 29 2HB PRO 29 11.770 7.311 -6.012
219 HB3 PRO 29 3HB PRO 29 12.621 5.812 -6.503
220 HG2 PRO 29 2HG PRO 29 9.618 6.231 -6.233
221 HG3 PRO 29 3HG PRO 29 10.503 5.615 -7.655
222 HD2 PRO 29 2HD PRO 29 9.381 3.937 -5.822
223 HD3 PRO 29 3HD PRO 29 10.957 3.544 -6.581
224 H LYS 30 H LYS 30 12.610 7.731 -3.272
225 HA LYS 30 HA LYS 30 10.255 8.354 -1.681
226 HB2 LYS 30 2HB LYS 30 11.388 10.335 -0.994
227 HB3 LYS 30 3HB LYS 30 12.509 8.974 -0.974
228 HG2 LYS 30 2HG LYS 30 13.448 9.711 -3.140
229 HG3 LYS 30 3HG LYS 30 12.384 11.121 -3.118
230 HD2 LYS 30 2HD LYS 30 14.510 10.458 -1.036
231 HD3 LYS 30 3HD LYS 30 14.726 11.600 -2.353
232 HE2 LYS 30 2HE LYS 30 12.631 11.889 -0.148
233 HE3 LYS 30 3HE LYS 30 14.228 12.632 -0.115
234 HZ1 LYS 30 3HZ LYS 30 12.116 13.199 -2.144
235 HZ2 LYS 30 1HZ LYS 30 12.613 14.196 -0.957
236 HZ3 LYS 30 2HZ LYS 30 13.632 13.824 -2.175
237 H ASP 31 H ASP 31 9.084 10.360 -1.812
238 HA ASP 31 HA ASP 31 7.432 11.519 -2.804
239 HB2 ASP 31 2HB ASP 31 9.446 12.050 -5.011
240 HB3 ASP 31 3HB ASP 31 7.925 12.904 -4.775
241 H SER 32 H SER 32 7.218 8.822 -3.021
242 HA SER 32 HA SER 32 5.449 8.535 -5.381
243 HB2 SER 32 2HB SER 32 6.075 6.292 -5.760
244 HB3 SER 32 3HB SER 32 7.586 7.202 -5.707
245 HG SER 32 HG SER 32 8.112 6.235 -3.847
246 H LEU 33 H LEU 33 3.891 6.669 -4.958
247 HA LEU 33 HA LEU 33 2.943 6.702 -2.134
248 HB2 LEU 33 2HB LEU 33 1.367 7.577 -3.865
249 HB3 LEU 33 3HB LEU 33 1.487 6.043 -4.727
250 HG LEU 33 HG LEU 33 0.492 4.890 -2.727
251 HD11 LEU 33 1HD1 LEU 33 0.010 7.733 -1.748
252 HD12 LEU 33 2HD1 LEU 33 -0.728 6.266 -1.076
253 HD13 LEU 33 3HD1 LEU 33 1.016 6.508 -0.950
254 HD21 LEU 33 3HD2 LEU 33 -1.178 7.177 -3.854
255 HD22 LEU 33 1HD2 LEU 33 -0.883 5.627 -4.671
256 HD23 LEU 33 2HD2 LEU 33 -1.792 5.661 -3.151
257 H ARG 34 H ARG 34 3.034 4.818 -0.998
258 HA ARG 34 HA ARG 34 3.588 2.260 -2.403
259 HB2 ARG 34 2HB ARG 34 5.459 1.722 -1.040
260 HB3 ARG 34 3HB ARG 34 5.740 3.225 -1.917
261 HG2 ARG 34 2HG ARG 34 5.364 4.526 0.154
262 HG3 ARG 34 3HG ARG 34 5.065 3.016 1.048
263 HD2 ARG 34 2HD ARG 34 7.339 2.218 0.481
264 HD3 ARG 34 3HD ARG 34 7.623 3.688 -0.466
265 HE ARG 34 HE ARG 34 6.965 4.084 2.400
266 HH11 ARG 34 1HH2 ARG 34 9.651 3.941 0.105
267 HH12 ARG 34 2HH2 ARG 34 10.675 4.834 1.210
268 HH21 ARG 34 1HH1 ARG 34 8.276 5.012 3.668
269 HH22 ARG 34 2HH1 ARG 34 9.980 5.278 3.268
270 H MET 35 H MET 35 3.223 0.418 -1.266
271 HA MET 35 HA MET 35 1.454 0.618 1.094
272 HB2 MET 35 2HB MET 35 0.906 -0.932 -1.476
273 HB3 MET 35 3HB MET 35 0.124 -1.321 0.064
274 HG2 MET 35 2HG MET 35 -0.727 0.991 0.216
275 HG3 MET 35 3HG MET 35 -0.028 1.347 -1.367
276 HE1 MET 35 3HE MET 35 -3.835 -1.141 -0.453
277 HE2 MET 35 1HE MET 35 -2.238 -1.778 0.007
278 HE3 MET 35 2HE MET 35 -2.834 -0.255 0.717
279 H ALA 36 H ALA 36 1.263 -1.383 2.293
280 HA ALA 36 HA ALA 36 3.444 -3.304 1.860
281 HB1 ALA 36 1HB ALA 36 3.650 -1.238 3.834
282 HB2 ALA 36 2HB ALA 36 3.472 -2.789 4.679
283 HB3 ALA 36 3HB ALA 36 4.770 -2.566 3.504
284 H ILE 37 H ILE 37 3.237 -5.248 3.281
285 HA ILE 37 HA ILE 37 0.409 -5.754 4.110
286 HB ILE 37 HB ILE 37 2.191 -7.204 2.227
287 HG12 ILE 37 2HG1 ILE 37 -0.818 -7.244 2.669
288 HG13 ILE 37 3HG1 ILE 37 0.015 -5.949 1.802
289 HG21 ILE 37 1HG2 ILE 37 0.462 -8.808 4.142
290 HG22 ILE 37 2HG2 ILE 37 1.255 -9.408 2.654
291 HG23 ILE 37 3HG2 ILE 37 2.243 -8.862 4.002
292 HD11 ILE 37 3HD1 ILE 37 0.854 -7.600 0.148
293 HD12 ILE 37 1HD1 ILE 37 -0.107 -8.859 0.957
294 HD13 ILE 37 2HD1 ILE 37 -0.913 -7.470 0.199
295 H MET 38 H MET 38 0.047 -6.703 5.993
296 HA MET 38 HA MET 38 2.362 -7.098 7.808
297 HB2 MET 38 2HB MET 38 -0.620 -7.241 8.386
298 HB3 MET 38 3HB MET 38 0.662 -7.173 9.581
299 HG2 MET 38 2HG MET 38 0.265 -4.877 7.640
300 HG3 MET 38 3HG MET 38 -0.797 -5.080 9.011
301 HE1 MET 38 3HE MET 38 3.123 -5.956 9.360
302 HE2 MET 38 1HE MET 38 2.871 -4.910 7.943
303 HE3 MET 38 2HE MET 38 3.729 -4.285 9.383
304 H VAL 39 H VAL 39 3.341 -8.969 7.282
305 HA VAL 39 HA VAL 39 1.642 -11.439 7.211
306 HB VAL 39 HB VAL 39 2.955 -11.155 5.225
307 HG11 VAL 39 1HG1 VAL 39 5.368 -11.395 5.194
308 HG12 VAL 39 2HG1 VAL 39 4.911 -9.938 6.086
309 HG13 VAL 39 3HG1 VAL 39 5.441 -11.391 6.965
310 HG21 VAL 39 3HG2 VAL 39 3.910 -13.358 5.096
311 HG22 VAL 39 1HG2 VAL 39 4.004 -13.488 6.859
312 HG23 VAL 39 2HG2 VAL 39 2.420 -13.424 6.046
313 H GLN 40 H GLN 40 1.817 -13.006 8.618
314 HA GLN 40 HA GLN 40 2.992 -12.531 11.210
315 HB2 GLN 40 2HB GLN 40 2.241 -14.970 11.552
316 HB3 GLN 40 3HB GLN 40 1.021 -13.725 11.298
317 HG2 GLN 40 2HG GLN 40 0.614 -14.403 9.033
318 HG3 GLN 40 3HG GLN 40 2.013 -15.481 9.021
319 HE21 GLN 40 2HE2 GLN 40 1.900 -17.491 10.341
320 HE22 GLN 40 1HE2 GLN 40 0.313 -18.127 10.753
321 H SER 41 H SER 41 5.039 -12.776 11.797
322 HA SER 41 HA SER 41 6.889 -13.664 9.824
323 HB2 SER 41 2HB SER 41 7.194 -11.685 11.350
324 HB3 SER 41 3HB SER 41 7.496 -12.843 12.666
325 HG SER 41 HG SER 41 9.045 -12.245 10.417
326 HA PRO 42 HA PRO 42 8.114 -17.545 11.641
327 HB2 PRO 42 2HB PRO 42 10.223 -18.193 10.024
328 HB3 PRO 42 3HB PRO 42 8.523 -18.267 9.469
329 HG2 PRO 42 2HG PRO 42 10.522 -16.029 9.054
330 HG3 PRO 42 3HG PRO 42 9.454 -16.794 7.836
331 HD2 PRO 42 2HD PRO 42 8.818 -14.444 9.142
332 HD3 PRO 42 3HD PRO 42 7.572 -15.606 8.615
333 H MET 43 H MET 43 9.815 -14.554 11.688
334 HA MET 43 HA MET 43 11.844 -15.647 13.593
335 HB2 MET 43 2HB MET 43 13.449 -14.172 12.869
336 HB3 MET 43 3HB MET 43 12.712 -14.883 11.445
337 HG2 MET 43 2HG MET 43 11.241 -12.610 11.610
338 HG3 MET 43 3HG MET 43 12.671 -12.062 12.461
339 HE1 MET 43 3HE MET 43 12.387 -13.453 8.056
340 HE2 MET 43 1HE MET 43 12.263 -14.587 9.422
341 HE3 MET 43 2HE MET 43 11.043 -13.319 9.219
342 H PHE 44 H PHE 44 9.338 -13.263 13.229
343 HA PHE 44 HA PHE 44 10.065 -11.967 15.821
344 HB2 PHE 44 2HB PHE 44 10.172 -10.453 13.939
345 HB3 PHE 44 3HB PHE 44 8.562 -10.907 13.414
346 HD1 PHE 44 HD1 PHE 44 10.326 -9.478 16.428
347 HD2 PHE 44 HD2 PHE 44 6.746 -9.564 14.026
348 HE1 PHE 44 HE1 PHE 44 9.321 -7.705 17.850
349 HE2 PHE 44 HE2 PHE 44 5.748 -7.787 15.442
350 HZ PHE 44 HZ PHE 44 7.032 -6.861 17.362
351 H ASP 45 H ASP 45 8.328 -11.271 17.172
352 HA ASP 45 HA ASP 45 6.432 -13.475 17.629
353 HB2 ASP 45 2HB ASP 45 7.219 -11.096 19.346
354 HB3 ASP 45 3HB ASP 45 6.142 -12.400 19.849
355 H GLY 46 H GLY 46 5.705 -12.022 15.386
356 HA2 GLY 46 2HA GLY 46 3.003 -11.243 15.624
357 HA3 GLY 46 3HA GLY 46 3.986 -9.798 15.877
358 H LYS 47 H LYS 47 2.982 -8.980 13.985
359 HA LYS 47 HA LYS 47 3.741 -10.275 11.429
360 HB2 LYS 47 2HB LYS 47 1.621 -8.146 11.830
361 HB3 LYS 47 3HB LYS 47 1.949 -9.102 10.379
362 HG2 LYS 47 2HG LYS 47 1.566 -11.066 12.330
363 HG3 LYS 47 3HG LYS 47 0.445 -9.815 12.836
364 HD2 LYS 47 2HD LYS 47 0.621 -11.096 10.086
365 HD3 LYS 47 3HD LYS 47 -0.490 -11.612 11.345
366 HE2 LYS 47 2HE LYS 47 -0.504 -8.774 10.250
367 HE3 LYS 47 3HE LYS 47 -1.334 -10.093 9.413
368 HZ1 LYS 47 3HZ LYS 47 -2.682 -10.470 11.382
369 HZ2 LYS 47 1HZ LYS 47 -1.885 -9.431 12.260
370 HZ3 LYS 47 2HZ LYS 47 -2.797 -8.857 11.020
371 H VAL 48 H VAL 48 4.746 -9.283 9.799
372 HA VAL 48 HA VAL 48 6.165 -6.742 10.448
373 HB VAL 48 HB VAL 48 8.158 -7.686 9.340
374 HG11 VAL 48 1HG1 VAL 48 7.153 -9.376 11.673
375 HG12 VAL 48 2HG1 VAL 48 8.842 -9.132 11.194
376 HG13 VAL 48 3HG1 VAL 48 7.892 -7.769 11.809
377 HG21 VAL 48 3HG2 VAL 48 6.677 -10.354 9.393
378 HG22 VAL 48 1HG2 VAL 48 7.095 -9.439 7.932
379 HG23 VAL 48 2HG2 VAL 48 8.377 -10.091 8.960
380 HA PRO 49 HA PRO 49 4.627 -5.382 6.625
381 HB2 PRO 49 2HB PRO 49 6.043 -3.116 6.107
382 HB3 PRO 49 3HB PRO 49 4.964 -3.284 7.523
383 HG2 PRO 49 2HG PRO 49 7.975 -3.666 7.420
384 HG3 PRO 49 3HG PRO 49 7.018 -2.721 8.602
385 HD2 PRO 49 2HD PRO 49 7.857 -5.284 9.096
386 HD3 PRO 49 3HD PRO 49 6.306 -4.649 9.720
387 H HIS 50 H HIS 50 4.725 -6.193 4.635
388 HA HIS 50 HA HIS 50 7.323 -6.363 3.139
389 HB2 HIS 50 2HB HIS 50 4.668 -7.819 2.938
390 HB3 HIS 50 3HB HIS 50 5.760 -7.743 1.564
391 HD2 HIS 50 HD2 HIS 50 6.945 -8.225 5.209
392 HE1 HIS 50 HE1 HIS 50 7.834 -11.822 3.106
393 HE2 HIS 50 HE2 HIS 50 8.166 -10.570 5.298
394 H TRP 51 H TRP 51 7.702 -4.408 2.207
395 HA TRP 51 HA TRP 51 5.535 -2.692 1.350
396 HB2 TRP 51 2HB TRP 51 8.522 -2.417 0.939
397 HB3 TRP 51 3HB TRP 51 7.307 -1.165 0.694
398 HD1 TRP 51 HD1 TRP 51 9.330 -2.855 3.385
399 HE1 TRP 51 HE1 TRP 51 8.951 -1.716 5.648
400 HE3 TRP 51 HE3 TRP 51 5.457 0.270 2.087
401 HZ2 TRP 51 HZ2 TRP 51 7.137 0.198 6.788
402 HZ3 TRP 51 HZ3 TRP 51 4.373 1.683 3.845
403 HH2 TRP 51 HH2 TRP 51 5.237 1.678 6.166
404 H TYR 52 H TYR 52 4.975 -2.047 -0.718
405 HA TYR 52 HA TYR 52 6.506 -2.977 -3.041
406 HB2 TYR 52 2HB TYR 52 3.534 -3.202 -3.301
407 HB3 TYR 52 3HB TYR 52 4.861 -3.934 -4.213
408 HD1 TYR 52 HD1 TYR 52 3.448 -4.263 -0.689
409 HD2 TYR 52 HD2 TYR 52 4.796 -6.141 -4.319
410 HE1 TYR 52 HE1 TYR 52 2.903 -6.503 0.262
411 HE2 TYR 52 HE2 TYR 52 4.207 -8.377 -3.385
412 HH TYR 52 HH TYR 52 2.886 -8.775 -0.089
413 H HIS 53 H HIS 53 5.969 -1.697 -4.970
414 HA HIS 53 HA HIS 53 5.246 1.089 -4.639
415 HB2 HIS 53 2HB HIS 53 4.894 -0.656 -7.114
416 HB3 HIS 53 3HB HIS 53 4.860 1.086 -7.067
417 HD2 HIS 53 HD2 HIS 53 7.214 2.381 -6.478
418 HE1 HIS 53 HE1 HIS 53 9.722 -0.764 -7.886
419 HE2 HIS 53 HE2 HIS 53 9.649 1.681 -7.230
420 H PHE 54 H PHE 54 3.170 2.162 -5.086
421 HA PHE 54 HA PHE 54 0.908 1.028 -3.954
422 HB2 PHE 54 2HB PHE 54 0.944 3.349 -4.292
423 HB3 PHE 54 3HB PHE 54 1.236 3.208 -6.018
424 HD1 PHE 54 HD2 PHE 54 -1.411 2.503 -3.397
425 HD2 PHE 54 HD1 PHE 54 -0.548 3.337 -7.546
426 HE1 PHE 54 HE2 PHE 54 -3.844 2.625 -3.897
427 HE2 PHE 54 HE1 PHE 54 -2.986 3.471 -8.012
428 HZ PHE 54 HZ PHE 54 -4.623 3.020 -6.209
429 H SER 55 H SER 55 1.712 0.909 -7.488
430 HA SER 55 HA SER 55 -0.753 -0.482 -8.175
431 HB2 SER 55 2HB SER 55 0.472 -0.667 -10.421
432 HB3 SER 55 3HB SER 55 0.055 0.940 -9.815
433 HG SER 55 HG SER 55 2.608 -0.300 -9.871
434 H CYS 56 HN CYS 56 2.528 -1.467 -7.284
435 HA CYS 56 HA CYS 56 2.384 -4.097 -8.308
436 HB2 CYS 56 2HB CYS 56 4.026 -2.775 -6.151
437 HB3 CYS 56 3HB CYS 56 4.194 -4.485 -6.515
438 H PHE 57 H PHE 57 1.339 -2.731 -5.191
439 HA PHE 57 HA PHE 57 0.524 -5.059 -3.783
440 HB2 PHE 57 2HB PHE 57 0.538 -2.783 -2.881
441 HB3 PHE 57 3HB PHE 57 -0.825 -2.348 -3.908
442 HD1 PHE 57 HD1 PHE 57 -3.040 -3.621 -3.631
443 HD2 PHE 57 HD2 PHE 57 0.166 -3.822 -0.753
444 HE1 PHE 57 HE1 PHE 57 -4.613 -4.518 -1.956
445 HE2 PHE 57 HE2 PHE 57 -1.452 -4.602 0.962
446 HZ PHE 57 HZ PHE 57 -3.831 -5.004 0.348
447 H TRP 58 H TRP 58 -1.422 -3.091 -6.086
448 HA TRP 58 HA TRP 58 -3.623 -4.950 -6.129
449 HB2 TRP 58 2HB TRP 58 -2.995 -2.703 -8.061
450 HB3 TRP 58 3HB TRP 58 -4.566 -3.444 -7.760
451 HD1 TRP 58 HD1 TRP 58 -2.523 -0.590 -6.766
452 HE1 TRP 58 HE1 TRP 58 -3.360 0.564 -4.657
453 HE3 TRP 58 HE3 TRP 58 -5.951 -4.093 -5.247
454 HZ2 TRP 58 HZ2 TRP 58 -5.383 0.109 -2.629
455 HZ3 TRP 58 HZ3 TRP 58 -7.332 -3.684 -3.239
456 HH2 TRP 58 HH2 TRP 58 -7.075 -1.577 -1.947
457 H LYS 59 H LYS 59 -0.643 -4.989 -7.787
458 HA LYS 59 HA LYS 59 -1.512 -6.775 -9.966
459 HB2 LYS 59 2HB LYS 59 0.046 -4.923 -10.297
460 HB3 LYS 59 3HB LYS 59 1.167 -5.636 -9.123
461 HG2 LYS 59 2HG LYS 59 1.815 -7.337 -10.544
462 HG3 LYS 59 3HG LYS 59 0.381 -7.189 -11.569
463 HD2 LYS 59 2HD LYS 59 2.565 -6.298 -12.577
464 HD3 LYS 59 3HD LYS 59 1.156 -5.253 -12.637
465 HE2 LYS 59 2HE LYS 59 3.020 -3.869 -12.107
466 HE3 LYS 59 3HE LYS 59 1.989 -3.959 -10.685
467 HZ1 LYS 59 3HZ LYS 59 4.561 -5.377 -11.103
468 HZ2 LYS 59 1HZ LYS 59 4.237 -4.216 -9.983
469 HZ3 LYS 59 2HZ LYS 59 3.569 -5.686 -9.830
470 H VAL 60 H VAL 60 -0.192 -7.064 -6.709
471 HA VAL 60 HA VAL 60 -0.025 -10.018 -6.910
472 HB VAL 60 HB VAL 60 -0.448 -8.323 -4.418
473 HG11 VAL 60 1HG1 VAL 60 0.477 -11.205 -4.811
474 HG12 VAL 60 2HG1 VAL 60 0.484 -10.333 -3.267
475 HG13 VAL 60 3HG1 VAL 60 -1.050 -10.681 -4.071
476 HG21 VAL 60 3HG2 VAL 60 1.904 -8.590 -3.954
477 HG22 VAL 60 1HG2 VAL 60 2.159 -9.486 -5.462
478 HG23 VAL 60 2HG2 VAL 60 1.733 -7.758 -5.498
479 H GLY 61 H GLY 61 -2.406 -7.521 -6.044
480 HA2 GLY 61 2HA GLY 61 -4.675 -7.544 -6.561
481 HA3 GLY 61 3HA GLY 61 -4.583 -9.248 -6.994
482 H HIS 62 H HIS 62 -3.583 -7.908 -3.829
483 HA HIS 62 HA HIS 62 -5.393 -9.629 -2.335
484 HB2 HIS 62 2HB HIS 62 -3.603 -7.307 -1.567
485 HB3 HIS 62 3HB HIS 62 -4.713 -8.050 -0.421
486 HD2 HIS 62 HD2 HIS 62 -1.416 -8.720 -2.227
487 HE1 HIS 62 HE1 HIS 62 -2.044 -12.009 0.415
488 HE2 HIS 62 HE2 HIS 62 -0.381 -10.901 -1.158
489 H SER 63 H SER 63 -7.367 -9.262 -1.523
490 HA SER 63 HA SER 63 -8.843 -6.862 -2.451
491 HB2 SER 63 2HB SER 63 -9.834 -9.460 -1.217
492 HB3 SER 63 3HB SER 63 -10.854 -8.137 -1.815
493 HG SER 63 HG SER 63 -10.569 -9.812 -3.378
494 H ILE 64 H ILE 64 -9.837 -5.437 -1.248
495 HA ILE 64 HA ILE 64 -9.521 -5.503 1.720
496 HB ILE 64 HB ILE 64 -9.139 -3.015 0.057
497 HG12 ILE 64 2HG1 ILE 64 -6.957 -4.980 0.773
498 HG13 ILE 64 3HG1 ILE 64 -7.375 -4.312 -0.799
499 HG21 ILE 64 1HG2 ILE 64 -8.284 -3.798 2.878
500 HG22 ILE 64 2HG2 ILE 64 -8.060 -2.208 2.140
501 HG23 ILE 64 3HG2 ILE 64 -9.697 -2.798 2.481
502 HD11 ILE 64 3HD1 ILE 64 -6.723 -2.000 0.206
503 HD12 ILE 64 1HD1 ILE 64 -5.926 -2.959 1.473
504 HD13 ILE 64 2HD1 ILE 64 -5.439 -3.139 -0.211
505 H ARG 65 H ARG 65 -11.304 -4.929 2.802
506 HA ARG 65 HA ARG 65 -13.761 -4.237 1.202
507 HB2 ARG 65 2HB ARG 65 -14.942 -5.798 2.871
508 HB3 ARG 65 3HB ARG 65 -14.081 -6.492 1.515
509 HG2 ARG 65 2HG ARG 65 -12.670 -6.238 4.181
510 HG3 ARG 65 3HG ARG 65 -13.844 -7.513 3.948
511 HD2 ARG 65 2HD ARG 65 -12.544 -8.705 2.523
512 HD3 ARG 65 3HD ARG 65 -11.858 -7.284 1.736
513 HE ARG 65 HE ARG 65 -10.646 -7.099 4.150
514 HH11 ARG 65 1HH2 ARG 65 -10.833 -9.894 2.013
515 HH12 ARG 65 2HH2 ARG 65 -9.301 -10.496 2.584
516 HH21 ARG 65 1HH1 ARG 65 -8.888 -7.883 4.817
517 HH22 ARG 65 2HH1 ARG 65 -8.180 -9.378 4.182
518 H HIS 66 H HIS 66 -11.975 -3.573 4.073
519 HA HIS 66 HA HIS 66 -13.648 -1.173 4.371
520 HB2 HIS 66 2HB HIS 66 -13.662 -1.246 6.812
521 HB3 HIS 66 3HB HIS 66 -14.707 -2.408 6.027
522 HD2 HIS 66 HD2 HIS 66 -12.676 -4.888 5.726
523 HE1 HIS 66 HE1 HIS 66 -12.635 -4.789 9.955
524 HE2 HIS 66 HE2 HIS 66 -12.157 -6.215 7.917
525 HA PRO 67 HA PRO 67 -9.138 -0.923 3.840
526 HB2 PRO 67 2HB PRO 67 -9.039 1.279 2.105
527 HB3 PRO 67 3HB PRO 67 -9.296 -0.405 1.574
528 HG2 PRO 67 2HG PRO 67 -11.397 1.676 2.203
529 HG3 PRO 67 3HG PRO 67 -11.273 0.639 0.737
530 HD2 PRO 67 2HD PRO 67 -12.920 -0.030 2.725
531 HD3 PRO 67 3HD PRO 67 -11.886 -1.302 2.001
532 H ASP 68 H ASP 68 -11.237 1.791 4.798
533 HA ASP 68 HA ASP 68 -9.025 3.337 5.866
534 HB2 ASP 68 2HB ASP 68 -10.837 4.705 6.911
535 HB3 ASP 68 3HB ASP 68 -10.948 4.530 5.166
536 H VAL 69 H VAL 69 -10.438 0.487 6.899
537 HA VAL 69 HA VAL 69 -9.437 0.814 9.681
538 HB VAL 69 HB VAL 69 -11.075 -1.475 8.548
539 HG11 VAL 69 1HG1 VAL 69 -10.455 -0.644 11.412
540 HG12 VAL 69 2HG1 VAL 69 -11.533 -1.972 10.925
541 HG13 VAL 69 3HG1 VAL 69 -9.811 -2.070 10.565
542 HG21 VAL 69 3HG2 VAL 69 -13.005 -0.501 9.781
543 HG22 VAL 69 1HG2 VAL 69 -12.040 0.962 10.096
544 HG23 VAL 69 2HG2 VAL 69 -12.481 0.505 8.433
545 H GLU 70 H GLU 70 -9.217 -1.250 6.774
546 HA GLU 70 HA GLU 70 -7.198 -3.007 8.001
547 HB2 GLU 70 2HB GLU 70 -8.301 -2.904 5.153
548 HB3 GLU 70 3HB GLU 70 -7.323 -4.207 5.837
549 HG2 GLU 70 2HG GLU 70 -9.107 -4.753 7.431
550 HG3 GLU 70 3HG GLU 70 -10.118 -3.471 6.760
551 H VAL 71 H VAL 71 -7.047 -0.300 5.792
552 HA VAL 71 HA VAL 71 -4.160 -0.783 5.175
553 HB VAL 71 HB VAL 71 -5.893 1.436 4.104
554 HG11 VAL 71 1HG1 VAL 71 -3.235 0.188 3.282
555 HG12 VAL 71 2HG1 VAL 71 -4.061 1.576 2.525
556 HG13 VAL 71 3HG1 VAL 71 -3.418 1.707 4.181
557 HG21 VAL 71 3HG2 VAL 71 -6.802 -0.724 3.312
558 HG22 VAL 71 1HG2 VAL 71 -5.900 0.065 2.013
559 HG23 VAL 71 2HG2 VAL 71 -5.168 -1.285 2.917
560 H ASP 72 H ASP 72 -3.226 -0.529 7.067
561 HA ASP 72 HA ASP 72 -3.490 1.633 8.913
562 HB2 ASP 72 2HB ASP 72 -2.372 -0.527 9.277
563 HB3 ASP 72 3HB ASP 72 -1.122 -0.107 8.106
564 H GLY 73 H GLY 73 -2.683 3.717 8.860
565 HA2 GLY 73 2HA GLY 73 -1.451 5.571 8.142
566 HA3 GLY 73 3HA GLY 73 -0.692 4.592 6.888
567 H PHE 74 H PHE 74 -4.002 4.123 6.486
568 HA PHE 74 HA PHE 74 -4.334 5.700 4.161
569 HB2 PHE 74 2HB PHE 74 -5.733 3.800 4.829
570 HB3 PHE 74 3HB PHE 74 -6.365 4.703 6.199
571 HD1 PHE 74 HD1 PHE 74 -6.306 4.441 2.488
572 HD2 PHE 74 HD2 PHE 74 -8.192 6.267 5.912
573 HE1 PHE 74 HE1 PHE 74 -8.192 5.199 1.056
574 HE2 PHE 74 HE2 PHE 74 -10.081 7.007 4.470
575 HZ PHE 74 HZ PHE 74 -10.090 6.452 2.055
576 H SER 75 H SER 75 -4.837 6.597 7.554
577 HA SER 75 HA SER 75 -6.005 9.178 7.116
578 HB2 SER 75 2HB SER 75 -4.400 8.175 9.491
579 HB3 SER 75 3HB SER 75 -5.514 9.556 9.472
580 HG SER 75 HG SER 75 -6.514 7.661 10.298
581 H GLU 76 H GLU 76 -2.738 8.176 6.585
582 HA GLU 76 HA GLU 76 -1.543 10.839 7.068
583 HB2 GLU 76 2HB GLU 76 -0.331 8.331 5.840
584 HB3 GLU 76 3HB GLU 76 0.523 9.800 6.289
585 HG2 GLU 76 2HG GLU 76 0.007 9.449 8.660
586 HG3 GLU 76 3HG GLU 76 -0.960 8.025 8.275
587 H LEU 77 H LEU 77 -3.289 9.346 4.552
588 HA LEU 77 HA LEU 77 -1.962 10.721 2.312
589 HB2 LEU 77 2HB LEU 77 -4.405 8.941 2.466
590 HB3 LEU 77 3HB LEU 77 -3.709 9.566 0.979
591 HG LEU 77 HG LEU 77 -2.335 7.616 2.891
592 HD11 LEU 77 1HD1 LEU 77 -4.258 6.661 1.675
593 HD12 LEU 77 2HD1 LEU 77 -3.646 7.316 0.140
594 HD13 LEU 77 3HD1 LEU 77 -2.751 6.049 0.980
595 HD21 LEU 77 3HD2 LEU 77 -0.685 7.332 1.111
596 HD22 LEU 77 1HD2 LEU 77 -1.454 8.631 0.168
597 HD23 LEU 77 2HD2 LEU 77 -0.665 8.982 1.725
598 H ARG 78 H ARG 78 -3.026 12.101 0.856
599 HA ARG 78 HA ARG 78 -4.995 14.011 1.867
600 HB2 ARG 78 2HB ARG 78 -3.407 13.580 -0.644
601 HB3 ARG 78 3HB ARG 78 -4.959 14.319 -0.890
602 HG2 ARG 78 2HG ARG 78 -3.002 15.383 1.188
603 HG3 ARG 78 3HG ARG 78 -2.945 15.874 -0.507
604 HD2 ARG 78 2HD ARG 78 -5.388 16.200 1.291
605 HD3 ARG 78 3HD ARG 78 -4.211 17.472 0.903
606 HE ARG 78 HE ARG 78 -5.413 16.150 -1.444
607 HH11 ARG 78 1HH2 ARG 78 -5.834 18.939 0.664
608 HH12 ARG 78 2HH2 ARG 78 -6.771 19.768 -0.550
609 HH21 ARG 78 1HH1 ARG 78 -6.539 17.135 -2.797
610 HH22 ARG 78 2HH1 ARG 78 -7.179 18.763 -2.535
611 H TRP 79 H TRP 79 -7.055 14.373 1.056
612 HA TRP 79 HA TRP 79 -8.840 12.232 0.895
613 HB2 TRP 79 2HB TRP 79 -9.870 14.134 1.518
614 HB3 TRP 79 3HB TRP 79 -8.872 15.162 0.515
615 HD1 TRP 79 HD1 TRP 79 -12.251 13.505 0.534
616 HE1 TRP 79 HE1 TRP 79 -13.594 14.303 -1.509
617 HE3 TRP 79 HE3 TRP 79 -8.499 15.857 -2.005
618 HZ2 TRP 79 HZ2 TRP 79 -13.058 15.700 -4.000
619 HZ3 TRP 79 HZ3 TRP 79 -8.902 16.861 -4.223
620 HH2 TRP 79 HH2 TRP 79 -11.185 16.800 -5.239
621 H ASP 80 H ASP 80 -7.178 13.816 -1.835
622 HA ASP 80 HA ASP 80 -8.646 12.377 -3.871
623 HB2 ASP 80 2HB ASP 80 -6.854 13.273 -5.374
624 HB3 ASP 80 3HB ASP 80 -7.887 14.429 -4.548
625 H ASP 81 H ASP 81 -5.892 11.463 -1.981
626 HA ASP 81 HA ASP 81 -5.220 9.193 -3.776
627 HB2 ASP 81 2HB ASP 81 -3.929 10.288 -1.262
628 HB3 ASP 81 3HB ASP 81 -3.550 8.691 -1.912
629 H GLN 82 H GLN 82 -6.605 9.910 -0.530
630 HA GLN 82 HA GLN 82 -7.247 7.304 0.290
631 HB2 GLN 82 2HB GLN 82 -8.605 10.001 0.644
632 HB3 GLN 82 3HB GLN 82 -9.265 8.545 1.378
633 HG2 GLN 82 2HG GLN 82 -7.143 8.140 2.570
634 HG3 GLN 82 3HG GLN 82 -6.455 9.601 1.860
635 HE21 GLN 82 2HE2 GLN 82 -6.554 9.255 4.632
636 HE22 GLN 82 1HE2 GLN 82 -7.691 10.446 5.282
637 H GLN 83 H GLN 83 -9.368 9.519 -1.676
638 HA GLN 83 HA GLN 83 -11.348 7.509 -2.076
639 HB2 GLN 83 2HB GLN 83 -12.380 8.984 -3.607
640 HB3 GLN 83 3HB GLN 83 -11.671 9.966 -2.326
641 HG2 GLN 83 2HG GLN 83 -9.670 10.322 -3.905
642 HG3 GLN 83 3HG GLN 83 -10.639 9.570 -5.176
643 HE21 GLN 83 2HE2 GLN 83 -10.706 12.229 -2.761
644 HE22 GLN 83 1HE2 GLN 83 -11.652 13.318 -3.776
645 H LYS 84 H LYS 84 -8.289 7.955 -3.757
646 HA LYS 84 HA LYS 84 -8.985 6.331 -6.089
647 HB2 LYS 84 2HB LYS 84 -7.553 8.223 -6.354
648 HB3 LYS 84 3HB LYS 84 -6.501 7.725 -5.043
649 HG2 LYS 84 2HG LYS 84 -6.795 5.940 -7.455
650 HG3 LYS 84 3HG LYS 84 -5.827 7.403 -7.579
651 HD2 LYS 84 2HD LYS 84 -5.410 5.200 -5.537
652 HD3 LYS 84 3HD LYS 84 -4.460 5.433 -7.011
653 HE2 LYS 84 2HE LYS 84 -4.582 7.242 -4.565
654 HE3 LYS 84 3HE LYS 84 -3.258 6.181 -5.018
655 HZ1 LYS 84 3HZ LYS 84 -4.144 8.464 -6.699
656 HZ2 LYS 84 1HZ LYS 84 -2.944 8.559 -5.606
657 HZ3 LYS 84 2HZ LYS 84 -2.791 7.560 -6.912
658 H VAL 85 H VAL 85 -7.198 5.972 -3.005
659 HA VAL 85 HA VAL 85 -6.501 3.171 -3.433
660 HB VAL 85 HB VAL 85 -6.883 4.799 -0.884
661 HG11 VAL 85 1HG1 VAL 85 -5.752 1.971 -1.137
662 HG12 VAL 85 2HG1 VAL 85 -5.648 2.992 0.305
663 HG13 VAL 85 3HG1 VAL 85 -7.225 2.445 -0.259
664 HG21 VAL 85 3HG2 VAL 85 -4.897 5.345 -2.410
665 HG22 VAL 85 1HG2 VAL 85 -4.502 4.889 -0.749
666 HG23 VAL 85 2HG2 VAL 85 -4.293 3.718 -2.055
667 H LYS 86 H LYS 86 -9.359 4.729 -1.847
668 HA LYS 86 HA LYS 86 -10.700 2.212 -1.382
669 HB2 LYS 86 2HB LYS 86 -11.830 5.042 -1.527
670 HB3 LYS 86 3HB LYS 86 -12.728 3.598 -1.038
671 HG2 LYS 86 2HG LYS 86 -10.837 3.219 0.699
672 HG3 LYS 86 3HG LYS 86 -10.326 4.845 0.341
673 HD2 LYS 86 2HD LYS 86 -11.655 4.777 2.373
674 HD3 LYS 86 3HD LYS 86 -12.481 5.749 1.137
675 HE2 LYS 86 2HE LYS 86 -14.035 3.982 0.692
676 HE3 LYS 86 3HE LYS 86 -13.065 2.810 1.599
677 HZ1 LYS 86 3HZ LYS 86 -13.660 3.867 3.647
678 HZ2 LYS 86 1HZ LYS 86 -14.387 5.134 2.884
679 HZ3 LYS 86 2HZ LYS 86 -15.045 3.642 2.829
680 H LYS 87 H LYS 87 -10.908 4.462 -4.170
681 HA LYS 87 HA LYS 87 -12.808 2.911 -5.690
682 HB2 LYS 87 2HB LYS 87 -12.110 5.212 -6.236
683 HB3 LYS 87 3HB LYS 87 -10.501 4.655 -6.683
684 HG2 LYS 87 2HG LYS 87 -13.028 3.647 -8.054
685 HG3 LYS 87 3HG LYS 87 -12.260 5.169 -8.498
686 HD2 LYS 87 2HD LYS 87 -10.142 3.946 -9.047
687 HD3 LYS 87 3HD LYS 87 -10.985 2.413 -8.742
688 HE2 LYS 87 2HE LYS 87 -12.734 3.117 -10.421
689 HE3 LYS 87 3HE LYS 87 -11.731 4.516 -10.813
690 HZ1 LYS 87 3HZ LYS 87 -10.901 1.676 -11.128
691 HZ2 LYS 87 1HZ LYS 87 -11.335 2.674 -12.342
692 HZ3 LYS 87 2HZ LYS 87 -9.964 2.957 -11.522
693 H THR 88 H THR 88 -9.238 2.681 -5.532
694 HA THR 88 HA THR 88 -9.096 0.519 -7.357
695 HB THR 88 HB THR 88 -7.031 1.196 -5.255
696 HG1 THR 88 1HG THR 88 -7.464 3.001 -6.499
697 HG21 THR 88 1HG2 THR 88 -6.962 -0.137 -7.996
698 HG22 THR 88 2HG2 THR 88 -5.533 0.312 -7.034
699 HG23 THR 88 3HG2 THR 88 -6.657 -0.934 -6.447
700 H ALA 89 H ALA 89 -9.622 0.487 -3.842
701 HA ALA 89 HA ALA 89 -9.337 -2.367 -3.504
702 HB1 ALA 89 1HB ALA 89 -10.807 -0.246 -1.876
703 HB2 ALA 89 2HB ALA 89 -10.445 -1.898 -1.349
704 HB3 ALA 89 3HB ALA 89 -9.119 -0.752 -1.655
705 H GLU 90 H GLU 90 -12.092 -0.172 -4.210
706 HA GLU 90 HA GLU 90 -14.047 -2.285 -4.343
707 HB2 GLU 90 2HB GLU 90 -13.964 0.538 -5.467
708 HB3 GLU 90 3HB GLU 90 -15.350 -0.520 -5.694
709 HG2 GLU 90 2HG GLU 90 -14.263 0.197 -2.942
710 HG3 GLU 90 3HG GLU 90 -15.486 1.141 -3.781
711 H ALA 91 H ALA 91 -11.848 -0.888 -6.710
712 HA ALA 91 HA ALA 91 -12.874 -2.224 -9.020
713 HB1 ALA 91 1HB ALA 91 -10.104 -1.050 -8.463
714 HB2 ALA 91 2HB ALA 91 -10.828 -1.340 -10.053
715 HB3 ALA 91 3HB ALA 91 -11.520 -0.111 -8.965
716 H GLY 92 H GLY 92 -10.632 -3.265 -6.505
717 HA2 GLY 92 2HA GLY 92 -9.643 -5.294 -6.062
718 HA3 GLY 92 3HA GLY 92 -10.593 -6.028 -7.360
719 H GLY 93 H GLY 93 -8.631 -3.302 -8.209
720 HA2 GLY 93 2HA GLY 93 -6.164 -4.320 -9.035
721 HA3 GLY 93 3HA GLY 93 -7.317 -4.736 -10.308
722 H VAL 94 H VAL 94 -5.047 -2.642 -9.989
723 HA VAL 94 HA VAL 94 -6.451 -0.096 -10.123
724 HB VAL 94 HB VAL 94 -4.381 -0.396 -8.908
725 HG11 VAL 94 1HG1 VAL 94 -2.994 -0.508 -11.623
726 HG12 VAL 94 2HG1 VAL 94 -2.207 -0.408 -10.038
727 HG13 VAL 94 3HG1 VAL 94 -3.119 -1.858 -10.476
728 HG21 VAL 94 3HG2 VAL 94 -5.134 1.843 -9.649
729 HG22 VAL 94 1HG2 VAL 94 -3.372 1.715 -9.497
730 HG23 VAL 94 2HG2 VAL 94 -4.111 1.688 -11.103
731 H THR 95 H THR 95 -6.661 1.346 -11.719
732 HA THR 95 HA THR 95 -6.587 0.258 -14.485
733 HB THR 95 HB THR 95 -8.390 1.971 -14.853
734 HG1 THR 95 1HG THR 95 -8.030 3.397 -13.193
735 HG21 THR 95 1HG2 THR 95 -8.918 0.047 -12.537
736 HG22 THR 95 2HG2 THR 95 -10.122 0.713 -13.672
737 HG23 THR 95 3HG2 THR 95 -8.887 -0.419 -14.252
738 H GLY 96 H GLY 96 -4.973 2.658 -12.705
739 HA2 GLY 96 2HA GLY 96 -4.486 4.337 -15.062
740 HA3 GLY 96 3HA GLY 96 -3.865 4.604 -13.430
741 H LYS 97 H LYS 97 -1.924 5.130 -14.807
742 HA LYS 97 HA LYS 97 -0.435 3.034 -16.151
743 HB2 LYS 97 2HB LYS 97 0.462 5.780 -15.174
744 HB3 LYS 97 3HB LYS 97 1.345 4.756 -16.300
745 HG2 LYS 97 2HG LYS 97 -1.371 6.041 -16.823
746 HG3 LYS 97 3HG LYS 97 0.189 6.565 -17.454
747 HD2 LYS 97 2HD LYS 97 0.422 4.377 -18.653
748 HD3 LYS 97 3HD LYS 97 -1.207 3.928 -18.094
749 HE2 LYS 97 2HE LYS 97 -2.147 5.930 -19.214
750 HE3 LYS 97 3HE LYS 97 -0.532 6.387 -19.769
751 HZ1 LYS 97 3HZ LYS 97 -1.948 3.887 -20.536
752 HZ2 LYS 97 1HZ LYS 97 -1.750 5.193 -21.494
753 HZ3 LYS 97 2HZ LYS 97 -0.454 4.311 -21.047
754 H GLY 98 H GLY 98 -0.625 3.831 -12.818
755 HA2 GLY 98 2HA GLY 98 0.364 2.816 -10.977
756 HA3 GLY 98 3HA GLY 98 1.281 1.763 -12.054
757 H GLN 99 H GLN 99 2.850 2.223 -10.237
758 HA GLN 99 HA GLN 99 4.610 4.529 -10.926
759 HB2 GLN 99 2HB GLN 99 3.809 3.767 -8.088
760 HB3 GLN 99 3HB GLN 99 5.050 4.944 -8.548
761 HG2 GLN 99 2HG GLN 99 3.256 6.240 -9.796
762 HG3 GLN 99 3HG GLN 99 2.058 5.139 -9.110
763 HE21 GLN 99 2HE2 GLN 99 1.241 7.381 -8.366
764 HE22 GLN 99 1HE2 GLN 99 1.868 7.930 -6.818
765 H ASP 100 H ASP 100 6.802 4.261 -10.533
766 HA ASP 100 HA ASP 100 7.891 1.607 -9.842
767 HB2 ASP 100 2HB ASP 100 7.117 1.443 -12.209
768 HB3 ASP 100 3HB ASP 100 8.099 2.850 -12.619
769 H GLY 101 H GLY 101 10.333 1.624 -9.998
770 HA2 GLY 101 2HA GLY 101 11.964 3.792 -10.478
771 HA3 GLY 101 3HA GLY 101 11.481 4.031 -8.806
772 H ILE 102 H ILE 102 13.789 3.906 -8.455
773 HA ILE 102 HA ILE 102 14.699 1.150 -7.887
774 HB ILE 102 HB ILE 102 15.516 1.905 -10.116
775 HG12 ILE 102 2HG1 ILE 102 17.780 1.323 -8.176
776 HG13 ILE 102 3HG1 ILE 102 16.597 0.134 -8.724
777 HG21 ILE 102 1HG2 ILE 102 15.897 4.310 -9.545
778 HG22 ILE 102 2HG2 ILE 102 17.320 3.833 -8.599
779 HG23 ILE 102 3HG2 ILE 102 17.270 3.552 -10.347
780 HD11 ILE 102 3HD1 ILE 102 17.313 0.539 -11.081
781 HD12 ILE 102 1HD1 ILE 102 18.572 1.646 -10.479
782 HD13 ILE 102 2HD1 ILE 102 18.613 -0.068 -10.037
783 H GLY 103 H GLY 103 13.591 3.070 -6.123
784 HA2 GLY 103 2HA GLY 103 13.957 3.646 -3.887
785 HA3 GLY 103 3HA GLY 103 15.534 2.887 -4.004
786 H SER 104 H SER 104 16.264 4.583 -2.614
787 HA SER 104 HA SER 104 16.948 7.139 -4.030
788 HB2 SER 104 2HB SER 104 16.582 6.612 -1.064
789 HB3 SER 104 3HB SER 104 17.314 8.081 -1.729
790 HG SER 104 HG SER 104 15.394 8.484 -2.869
791 H LYS 105 H LYS 105 19.013 8.013 -3.707
792 HA LYS 105 HA LYS 105 21.208 6.124 -2.950
793 HB2 LYS 105 2HB LYS 105 20.677 6.162 -5.432
794 HB3 LYS 105 3HB LYS 105 21.128 7.869 -5.450
795 HG2 LYS 105 2HG LYS 105 23.430 7.242 -4.699
796 HG3 LYS 105 3HG LYS 105 22.924 5.535 -4.668
797 HD2 LYS 105 2HD LYS 105 22.441 5.649 -7.114
798 HD3 LYS 105 3HD LYS 105 22.926 7.347 -7.119
799 HE2 LYS 105 2HE LYS 105 24.755 6.086 -7.979
800 HE3 LYS 105 3HE LYS 105 25.223 6.687 -6.387
801 HZ1 LYS 105 3HZ LYS 105 24.216 3.930 -6.890
802 HZ2 LYS 105 1HZ LYS 105 25.795 4.317 -6.767
803 HZ3 LYS 105 2HZ LYS 105 24.828 4.487 -5.468
804 H ALA 106 H ALA 106 23.040 7.059 -2.080
805 HA ALA 106 HA ALA 106 22.954 10.004 -1.482
806 HB1 ALA 106 1HB ALA 106 23.838 9.444 0.737
807 HB2 ALA 106 2HB ALA 106 22.293 8.615 0.462
808 HB3 ALA 106 3HB ALA 106 23.823 7.714 0.328
809 H GLU 107 H GLU 107 24.809 7.461 -2.797
810 HA GLU 107 HA GLU 107 27.378 8.539 -2.215
811 HB2 GLU 107 2HB GLU 107 26.776 6.641 -4.512
812 HB3 GLU 107 3HB GLU 107 28.276 6.842 -3.619
813 HG2 GLU 107 2HG GLU 107 27.510 4.888 -2.696
814 HG3 GLU 107 3HG GLU 107 26.864 6.041 -1.534
815 H LYS 108 H LYS 108 28.932 9.546 -3.525
816 HA LYS 108 HA LYS 108 28.149 10.752 -6.102
817 HB2 LYS 108 2HB LYS 108 27.383 12.354 -4.349
818 HB3 LYS 108 3HB LYS 108 29.003 12.362 -3.653
819 HG2 LYS 108 2HG LYS 108 28.736 14.364 -4.936
820 HG3 LYS 108 3HG LYS 108 29.897 13.349 -5.757
821 HD2 LYS 108 2HD LYS 108 27.476 12.622 -7.008
822 HD3 LYS 108 3HD LYS 108 27.215 14.311 -6.602
823 HE2 LYS 108 2HE LYS 108 28.173 14.410 -8.747
824 HE3 LYS 108 3HE LYS 108 29.522 14.775 -7.663
825 HZ1 LYS 108 3HZ LYS 108 30.068 12.301 -7.838
826 HZ2 LYS 108 1HZ LYS 108 28.967 12.199 -9.031
827 HZ3 LYS 108 2HZ LYS 108 30.275 13.152 -9.230
Start of MODEL 3
1 H1 MET 1 H1 MET 1 -1.192 4.483 20.205
2 H2 MET 1 H2 MET 1 -1.218 2.910 19.748
3 H3 MET 1 H3 MET 1 0.038 3.875 19.315
4 HA MET 1 HA MET 1 0.718 4.140 21.592
5 HB2 MET 1 2HB MET 1 -1.532 3.897 22.587
6 HB3 MET 1 3HB MET 1 -1.521 2.173 22.226
7 HG2 MET 1 2HG MET 1 -0.938 2.596 24.564
8 HG3 MET 1 3HG MET 1 0.388 1.826 23.709
9 HE1 MET 1 1HE MET 1 0.326 6.206 25.250
10 HE2 MET 1 2HE MET 1 -0.758 5.696 23.940
11 HE3 MET 1 3HE MET 1 -0.926 4.987 25.564
12 H ALA 2 H ALA 2 -0.469 0.859 20.647
13 HA ALA 2 HA ALA 2 2.343 -0.065 20.348
14 HB1 ALA 2 1HB ALA 2 1.904 -1.978 21.831
15 HB2 ALA 2 2HB ALA 2 1.683 -0.454 22.705
16 HB3 ALA 2 3HB ALA 2 0.263 -1.375 22.155
17 H GLU 3 H GLU 3 -0.507 0.226 18.816
18 HA GLU 3 HA GLU 3 -0.940 -2.438 17.802
19 HB2 GLU 3 2HB GLU 3 -2.100 0.170 16.728
20 HB3 GLU 3 3HB GLU 3 -2.737 -1.459 16.544
21 HG2 GLU 3 2HG GLU 3 -4.120 -0.841 18.200
22 HG3 GLU 3 3HG GLU 3 -2.798 -1.339 19.245
23 H SER 4 H SER 4 1.653 -1.801 17.324
24 HA SER 4 HA SER 4 2.516 -0.751 14.923
25 HB2 SER 4 2HB SER 4 3.488 -3.116 16.552
26 HB3 SER 4 3HB SER 4 4.465 -2.307 15.294
27 HG SER 4 HG SER 4 4.910 -1.473 17.390
28 H SER 5 H SER 5 1.180 -4.024 15.408
29 HA SER 5 HA SER 5 1.246 -4.487 12.466
30 HB2 SER 5 2HB SER 5 2.147 -6.678 12.764
31 HB3 SER 5 3HB SER 5 3.228 -5.507 13.505
32 HG SER 5 HG SER 5 1.317 -7.114 14.905
33 H ASP 6 H ASP 6 -0.953 -3.826 14.401
34 HA ASP 6 HA ASP 6 -2.542 -6.256 14.298
35 HB2 ASP 6 2HB ASP 6 -2.368 -4.809 16.331
36 HB3 ASP 6 3HB ASP 6 -3.257 -3.550 15.474
37 H LYS 7 H LYS 7 -2.044 -5.445 11.767
38 HA LYS 7 HA LYS 7 -4.663 -4.972 10.525
39 HB2 LYS 7 2HB LYS 7 -3.628 -3.336 8.950
40 HB3 LYS 7 3HB LYS 7 -3.973 -2.739 10.554
41 HG2 LYS 7 2HG LYS 7 -1.239 -3.858 10.223
42 HG3 LYS 7 3HG LYS 7 -1.584 -2.450 9.211
43 HD2 LYS 7 2HD LYS 7 -2.317 -1.202 11.226
44 HD3 LYS 7 3HD LYS 7 -1.935 -2.594 12.239
45 HE2 LYS 7 2HE LYS 7 0.428 -2.462 11.678
46 HE3 LYS 7 3HE LYS 7 0.115 -1.263 10.419
47 HZ1 LYS 7 3HZ LYS 7 -0.354 -0.779 13.317
48 HZ2 LYS 7 1HZ LYS 7 0.938 -0.238 12.463
49 HZ3 LYS 7 2HZ LYS 7 -0.558 0.314 12.088
50 H LEU 8 H LEU 8 -4.358 -5.260 8.106
51 HA LEU 8 HA LEU 8 -2.412 -7.456 7.470
52 HB2 LEU 8 2HB LEU 8 -4.927 -6.452 6.063
53 HB3 LEU 8 3HB LEU 8 -3.945 -7.809 5.526
54 HG LEU 8 HG LEU 8 -5.513 -7.743 8.148
55 HD11 LEU 8 1HD1 LEU 8 -6.912 -7.655 6.125
56 HD12 LEU 8 2HD1 LEU 8 -6.069 -9.081 5.477
57 HD13 LEU 8 3HD1 LEU 8 -7.060 -9.224 6.955
58 HD21 LEU 8 3HD2 LEU 8 -3.580 -9.252 8.258
59 HD22 LEU 8 1HD2 LEU 8 -5.081 -10.184 8.133
60 HD23 LEU 8 2HD2 LEU 8 -4.037 -9.986 6.703
61 H TYR 9 H TYR 9 -3.190 -4.105 6.797
62 HA TYR 9 HA TYR 9 -1.481 -4.135 4.358
63 HB2 TYR 9 2HB TYR 9 -4.242 -2.916 4.605
64 HB3 TYR 9 3HB TYR 9 -3.225 -2.919 3.167
65 HD1 TYR 9 HD1 TYR 9 -2.400 -5.692 2.876
66 HD2 TYR 9 HD2 TYR 9 -6.180 -4.086 4.137
67 HE1 TYR 9 HE1 TYR 9 -3.521 -7.792 2.149
68 HE2 TYR 9 HE2 TYR 9 -7.309 -6.197 3.448
69 HH TYR 9 HH TYR 9 -5.490 -8.907 1.957
70 H ARG 10 H ARG 10 -0.662 -2.154 3.738
71 HA ARG 10 HA ARG 10 -0.850 0.162 5.588
72 HB2 ARG 10 2HB ARG 10 1.090 -1.033 6.360
73 HB3 ARG 10 3HB ARG 10 1.593 -1.387 4.724
74 HG2 ARG 10 2HG ARG 10 3.136 0.170 5.632
75 HG3 ARG 10 3HG ARG 10 2.228 1.001 4.377
76 HD2 ARG 10 2HD ARG 10 0.757 1.976 6.169
77 HD3 ARG 10 3HD ARG 10 1.761 1.180 7.392
78 HE ARG 10 HE ARG 10 3.410 2.847 5.760
79 HH11 ARG 10 1HH2 ARG 10 0.973 3.227 8.338
80 HH12 ARG 10 2HH2 ARG 10 1.358 4.957 8.418
81 HH21 ARG 10 1HH1 ARG 10 3.927 5.039 6.323
82 HH22 ARG 10 2HH1 ARG 10 2.813 5.838 7.426
83 H VAL 11 H VAL 11 -0.647 2.159 4.531
84 HA VAL 11 HA VAL 11 0.362 2.278 1.745
85 HB VAL 11 HB VAL 11 -2.166 2.073 1.775
86 HG11 VAL 11 1HG1 VAL 11 -2.133 4.983 2.701
87 HG12 VAL 11 2HG1 VAL 11 -3.541 3.975 2.307
88 HG13 VAL 11 3HG1 VAL 11 -2.556 3.628 3.741
89 HG21 VAL 11 3HG2 VAL 11 -1.119 4.694 0.583
90 HG22 VAL 11 1HG2 VAL 11 -0.814 3.119 -0.136
91 HG23 VAL 11 2HG2 VAL 11 -2.476 3.710 -0.004
92 H GLU 12 H GLU 12 1.481 4.181 1.281
93 HA GLU 12 HA GLU 12 1.082 6.579 2.864
94 HB2 GLU 12 2HB GLU 12 3.286 6.791 3.814
95 HB3 GLU 12 3HB GLU 12 2.574 5.311 4.418
96 HG2 GLU 12 2HG GLU 12 3.947 3.953 2.935
97 HG3 GLU 12 3HG GLU 12 4.570 5.384 2.114
98 H TYR 13 H TYR 13 2.153 8.381 2.252
99 HA TYR 13 HA TYR 13 3.669 8.474 -0.263
100 HB2 TYR 13 2HB TYR 13 3.413 10.497 1.986
101 HB3 TYR 13 3HB TYR 13 4.073 10.783 0.380
102 HD1 TYR 13 HD1 TYR 13 1.766 9.122 -1.082
103 HD2 TYR 13 HD2 TYR 13 1.753 12.222 1.918
104 HE1 TYR 13 HE1 TYR 13 -0.381 9.982 -1.981
105 HE2 TYR 13 HE2 TYR 13 -0.448 13.024 1.064
106 HH TYR 13 HH TYR 13 -1.951 11.626 -1.875
107 H ALA 14 H ALA 14 5.643 7.781 -0.376
108 HA ALA 14 HA ALA 14 6.909 6.401 1.682
109 HB1 ALA 14 1HB ALA 14 7.875 7.393 -1.025
110 HB2 ALA 14 2HB ALA 14 8.737 6.186 -0.049
111 HB3 ALA 14 3HB ALA 14 7.104 5.850 -0.669
112 H LYS 15 H LYS 15 8.331 6.850 3.220
113 HA LYS 15 HA LYS 15 9.148 9.611 3.724
114 HB2 LYS 15 2HB LYS 15 9.811 7.096 5.310
115 HB3 LYS 15 3HB LYS 15 9.914 8.762 5.869
116 HG2 LYS 15 2HG LYS 15 7.392 7.203 5.205
117 HG3 LYS 15 3HG LYS 15 7.952 7.708 6.798
118 HD2 LYS 15 2HD LYS 15 7.694 10.101 6.117
119 HD3 LYS 15 3HD LYS 15 7.030 9.581 4.561
120 HE2 LYS 15 2HE LYS 15 5.850 8.915 7.288
121 HE3 LYS 15 3HE LYS 15 5.296 10.209 6.217
122 HZ1 LYS 15 3HZ LYS 15 5.216 7.300 5.583
123 HZ2 LYS 15 1HZ LYS 15 3.934 8.249 5.930
124 HZ3 LYS 15 2HZ LYS 15 4.804 8.490 4.536
125 H SER 16 H SER 16 10.844 6.685 2.769
126 HA SER 16 HA SER 16 13.272 8.160 2.038
127 HB2 SER 16 2HB SER 16 13.552 7.658 4.478
128 HB3 SER 16 3HB SER 16 13.461 5.925 4.091
129 HG SER 16 HG SER 16 15.632 6.877 4.165
130 H GLY 17 H GLY 17 14.725 6.853 0.765
131 HA2 GLY 17 2HA GLY 17 13.289 5.175 -1.098
132 HA3 GLY 17 3HA GLY 17 14.974 5.670 -1.200
133 H ARG 18 H ARG 18 14.247 4.072 1.746
134 HA ARG 18 HA ARG 18 16.130 1.946 1.093
135 HB2 ARG 18 2HB ARG 18 14.508 2.410 3.634
136 HB3 ARG 18 3HB ARG 18 15.901 1.347 3.472
137 HG2 ARG 18 2HG ARG 18 15.925 4.384 3.263
138 HG3 ARG 18 3HG ARG 18 16.513 3.406 4.604
139 HD2 ARG 18 2HD ARG 18 18.221 2.385 3.048
140 HD3 ARG 18 3HD ARG 18 17.657 3.477 1.782
141 HE ARG 18 HE ARG 18 18.667 5.295 2.819
142 HH11 ARG 18 1HH2 ARG 18 18.986 2.554 4.986
143 HH12 ARG 18 2HH2 ARG 18 20.142 3.377 5.995
144 HH21 ARG 18 1HH1 ARG 18 20.143 6.275 4.150
145 HH22 ARG 18 2HH1 ARG 18 20.774 5.426 5.529
146 H ALA 19 H ALA 19 12.661 2.022 1.040
147 HA ALA 19 HA ALA 19 12.291 -0.798 1.595
148 HB1 ALA 19 1HB ALA 19 9.971 -0.407 0.984
149 HB2 ALA 19 2HB ALA 19 10.537 0.896 2.043
150 HB3 ALA 19 3HB ALA 19 10.380 1.170 0.288
151 H SER 20 H SER 20 11.885 -2.470 0.228
152 HA SER 20 HA SER 20 12.527 -2.131 -2.664
153 HB2 SER 20 2HB SER 20 13.389 -4.396 -2.675
154 HB3 SER 20 3HB SER 20 14.289 -3.337 -1.580
155 HG SER 20 HG SER 20 13.910 -5.282 -0.551
156 H CYS 21 HN CYS 21 11.239 -3.070 -4.180
157 HA CYS 21 HA CYS 21 8.497 -3.666 -3.339
158 HB2 CYS 21 2HB CYS 21 9.067 -2.169 -5.232
159 HB3 CYS 21 3HB CYS 21 9.783 -3.552 -6.082
160 H LYS 22 H LYS 22 7.963 -5.613 -2.710
161 HA LYS 22 HA LYS 22 9.604 -7.957 -3.207
162 HB2 LYS 22 2HB LYS 22 6.828 -7.830 -1.980
163 HB3 LYS 22 3HB LYS 22 8.009 -9.109 -1.740
164 HG2 LYS 22 2HG LYS 22 8.444 -6.243 -0.851
165 HG3 LYS 22 3HG LYS 22 7.664 -7.455 0.139
166 HD2 LYS 22 2HD LYS 22 9.634 -8.884 0.087
167 HD3 LYS 22 3HD LYS 22 10.482 -7.763 -1.007
168 HE2 LYS 22 2HE LYS 22 9.394 -6.994 1.719
169 HE3 LYS 22 3HE LYS 22 11.020 -7.656 1.514
170 HZ1 LYS 22 3HZ LYS 22 11.619 -5.770 0.143
171 HZ2 LYS 22 1HZ LYS 22 10.117 -5.176 0.116
172 HZ3 LYS 22 2HZ LYS 22 10.986 -5.189 1.519
173 H LYS 23 H LYS 23 7.385 -6.564 -5.179
174 HA LYS 23 HA LYS 23 6.334 -9.088 -6.391
175 HB2 LYS 23 2HB LYS 23 4.639 -7.534 -5.676
176 HB3 LYS 23 3HB LYS 23 5.453 -6.197 -6.474
177 HG2 LYS 23 2HG LYS 23 3.479 -6.851 -7.688
178 HG3 LYS 23 3HG LYS 23 4.907 -7.072 -8.674
179 HD2 LYS 23 2HD LYS 23 3.355 -8.899 -9.036
180 HD3 LYS 23 3HD LYS 23 4.826 -9.521 -8.293
181 HE2 LYS 23 2HE LYS 23 3.709 -9.600 -6.093
182 HE3 LYS 23 3HE LYS 23 2.243 -8.892 -6.793
183 HZ1 LYS 23 3HZ LYS 23 3.407 -11.490 -7.669
184 HZ2 LYS 23 1HZ LYS 23 2.170 -11.369 -6.621
185 HZ3 LYS 23 2HZ LYS 23 1.977 -10.863 -8.159
186 H CYS 24 HN CYS 24 7.742 -5.950 -7.509
187 HA CYS 24 HA CYS 24 8.491 -7.330 -10.028
188 HB2 CYS 24 2HB CYS 24 8.406 -5.329 -11.159
189 HB3 CYS 24 3HB CYS 24 6.950 -5.397 -10.172
190 H SER 25 H SER 25 9.982 -6.741 -7.203
191 HA SER 25 HA SER 25 12.069 -6.784 -6.445
192 HB2 SER 25 2HB SER 25 12.849 -7.869 -9.161
193 HB3 SER 25 3HB SER 25 13.797 -7.975 -7.669
194 HG SER 25 HG SER 25 12.569 -9.879 -8.061
195 H GLU 26 H GLU 26 11.186 -4.327 -7.921
196 HA GLU 26 HA GLU 26 13.773 -2.911 -8.341
197 HB2 GLU 26 2HB GLU 26 10.863 -2.061 -8.493
198 HB3 GLU 26 3HB GLU 26 12.221 -0.960 -8.725
199 HG2 GLU 26 2HG GLU 26 13.015 -2.322 -10.635
200 HG3 GLU 26 3HG GLU 26 11.621 -3.386 -10.461
201 H SER 27 H SER 27 13.547 -0.572 -7.124
202 HA SER 27 HA SER 27 12.647 -0.981 -4.329
203 HB2 SER 27 2HB SER 27 15.274 0.287 -5.103
204 HB3 SER 27 3HB SER 27 14.517 0.369 -3.493
205 HG SER 27 HG SER 27 16.068 -1.350 -3.727
206 H ILE 28 H ILE 28 12.131 0.911 -3.147
207 HA ILE 28 HA ILE 28 10.387 2.449 -4.980
208 HB ILE 28 HB ILE 28 9.929 1.703 -2.086
209 HG12 ILE 28 2HG1 ILE 28 8.729 0.312 -4.516
210 HG13 ILE 28 3HG1 ILE 28 10.104 -0.330 -3.619
211 HG21 ILE 28 1HG2 ILE 28 7.569 2.271 -2.675
212 HG22 ILE 28 2HG2 ILE 28 8.615 3.673 -2.904
213 HG23 ILE 28 3HG2 ILE 28 8.070 2.732 -4.303
214 HD11 ILE 28 3HD1 ILE 28 8.763 -0.379 -1.535
215 HD12 ILE 28 1HD1 ILE 28 7.327 0.096 -2.476
216 HD13 ILE 28 2HD1 ILE 28 8.150 -1.428 -2.820
217 HA PRO 29 HA PRO 29 12.815 5.974 -3.373
218 HB2 PRO 29 2HB PRO 29 11.921 7.919 -5.062
219 HB3 PRO 29 3HB PRO 29 13.025 6.617 -5.596
220 HG2 PRO 29 2HG PRO 29 9.994 6.681 -5.850
221 HG3 PRO 29 3HG PRO 29 11.200 6.374 -7.141
222 HD2 PRO 29 2HD PRO 29 9.986 4.346 -5.837
223 HD3 PRO 29 3HD PRO 29 11.725 4.233 -6.254
224 H LYS 30 H LYS 30 12.431 7.960 -2.248
225 HA LYS 30 HA LYS 30 9.936 8.102 -0.778
226 HB2 LYS 30 2HB LYS 30 10.859 9.708 0.548
227 HB3 LYS 30 3HB LYS 30 12.197 8.653 0.147
228 HG2 LYS 30 2HG LYS 30 13.136 10.281 -1.376
229 HG3 LYS 30 3HG LYS 30 11.718 11.331 -1.244
230 HD2 LYS 30 2HD LYS 30 13.429 10.571 1.158
231 HD3 LYS 30 3HD LYS 30 13.759 11.997 0.165
232 HE2 LYS 30 2HE LYS 30 11.822 13.119 0.808
233 HE3 LYS 30 3HE LYS 30 10.957 11.638 1.215
234 HZ1 LYS 30 3HZ LYS 30 11.595 12.849 3.207
235 HZ2 LYS 30 1HZ LYS 30 12.320 11.392 3.178
236 HZ3 LYS 30 2HZ LYS 30 13.178 12.763 2.853
237 H ASP 31 H ASP 31 8.704 10.117 -0.507
238 HA ASP 31 HA ASP 31 7.088 11.435 -1.343
239 HB2 ASP 31 2HB ASP 31 9.081 12.915 -1.510
240 HB3 ASP 31 3HB ASP 31 9.218 12.501 -3.217
241 H SER 32 H SER 32 7.066 8.871 -2.346
242 HA SER 32 HA SER 32 5.357 9.194 -4.741
243 HB2 SER 32 2HB SER 32 7.624 8.336 -5.451
244 HB3 SER 32 3HB SER 32 7.347 6.914 -4.422
245 HG SER 32 HG SER 32 6.704 6.631 -6.655
246 H LEU 33 H LEU 33 3.955 7.104 -4.943
247 HA LEU 33 HA LEU 33 2.843 6.658 -2.227
248 HB2 LEU 33 2HB LEU 33 1.388 7.649 -3.991
249 HB3 LEU 33 3HB LEU 33 1.604 6.184 -4.952
250 HG LEU 33 HG LEU 33 0.605 4.876 -3.006
251 HD11 LEU 33 1HD1 LEU 33 0.855 6.542 -1.193
252 HD12 LEU 33 2HD1 LEU 33 -0.221 7.651 -2.061
253 HD13 LEU 33 3HD1 LEU 33 -0.839 6.112 -1.435
254 HD21 LEU 33 3HD2 LEU 33 -1.164 7.027 -4.216
255 HD22 LEU 33 1HD2 LEU 33 -0.681 5.513 -5.033
256 HD23 LEU 33 2HD2 LEU 33 -1.690 5.449 -3.576
257 H ARG 34 H ARG 34 2.905 4.748 -1.236
258 HA ARG 34 HA ARG 34 3.412 2.242 -2.714
259 HB2 ARG 34 2HB ARG 34 5.331 1.614 -1.465
260 HB3 ARG 34 3HB ARG 34 5.620 3.179 -2.219
261 HG2 ARG 34 2HG ARG 34 5.272 4.303 -0.029
262 HG3 ARG 34 3HG ARG 34 4.987 2.722 0.734
263 HD2 ARG 34 2HD ARG 34 7.244 1.966 0.013
264 HD3 ARG 34 3HD ARG 34 7.513 3.539 -0.760
265 HE ARG 34 HE ARG 34 6.900 3.736 2.099
266 HH11 ARG 34 1HH2 ARG 34 9.590 3.486 -0.183
267 HH12 ARG 34 2HH2 ARG 34 10.690 4.157 0.989
268 HH21 ARG 34 1HH1 ARG 34 8.297 4.385 3.454
269 HH22 ARG 34 2HH1 ARG 34 10.040 4.346 3.126
270 H MET 35 H MET 35 3.231 0.357 -1.408
271 HA MET 35 HA MET 35 1.436 0.588 0.933
272 HB2 MET 35 2HB MET 35 0.923 -0.988 -1.621
273 HB3 MET 35 3HB MET 35 0.090 -1.323 -0.091
274 HG2 MET 35 2HG MET 35 -0.756 0.980 -0.040
275 HG3 MET 35 3HG MET 35 0.020 1.309 -1.594
276 HE1 MET 35 3HE MET 35 -3.078 -0.004 0.292
277 HE2 MET 35 1HE MET 35 -3.800 -1.179 -0.828
278 HE3 MET 35 2HE MET 35 -2.251 -1.552 -0.030
279 H ALA 36 H ALA 36 1.217 -1.448 2.112
280 HA ALA 36 HA ALA 36 3.394 -3.358 1.677
281 HB1 ALA 36 1HB ALA 36 3.749 -1.279 3.557
282 HB2 ALA 36 2HB ALA 36 3.424 -2.744 4.509
283 HB3 ALA 36 3HB ALA 36 4.747 -2.726 3.338
284 H ILE 37 H ILE 37 3.222 -5.309 3.062
285 HA ILE 37 HA ILE 37 0.447 -5.803 4.054
286 HB ILE 37 HB ILE 37 2.013 -7.202 1.977
287 HG12 ILE 37 2HG1 ILE 37 -0.936 -7.327 2.727
288 HG13 ILE 37 3HG1 ILE 37 -0.228 -5.966 1.858
289 HG21 ILE 37 1HG2 ILE 37 0.507 -8.908 3.980
290 HG22 ILE 37 2HG2 ILE 37 1.181 -9.425 2.405
291 HG23 ILE 37 3HG2 ILE 37 2.270 -8.913 3.685
292 HD11 ILE 37 3HD1 ILE 37 0.478 -7.455 0.025
293 HD12 ILE 37 1HD1 ILE 37 -0.291 -8.829 0.846
294 HD13 ILE 37 2HD1 ILE 37 -1.278 -7.467 0.273
295 H MET 38 H MET 38 0.174 -6.933 5.876
296 HA MET 38 HA MET 38 2.590 -7.202 7.554
297 HB2 MET 38 2HB MET 38 -0.351 -7.397 8.252
298 HB3 MET 38 3HB MET 38 0.966 -7.247 9.408
299 HG2 MET 38 2HG MET 38 0.529 -5.052 7.365
300 HG3 MET 38 3HG MET 38 -0.553 -5.210 8.716
301 HE1 MET 38 3HE MET 38 3.935 -4.261 8.972
302 HE2 MET 38 1HE MET 38 3.407 -5.957 9.006
303 HE3 MET 38 2HE MET 38 3.034 -4.955 7.589
304 H VAL 39 H VAL 39 3.629 -9.049 7.184
305 HA VAL 39 HA VAL 39 2.059 -11.604 7.378
306 HB VAL 39 HB VAL 39 3.276 -11.475 5.334
307 HG11 VAL 39 1HG1 VAL 39 5.125 -9.980 5.929
308 HG12 VAL 39 2HG1 VAL 39 5.824 -11.235 6.982
309 HG13 VAL 39 3HG1 VAL 39 5.714 -11.496 5.232
310 HG21 VAL 39 3HG2 VAL 39 4.439 -13.574 5.400
311 HG22 VAL 39 1HG2 VAL 39 4.634 -13.487 7.158
312 HG23 VAL 39 2HG2 VAL 39 3.012 -13.674 6.440
313 H GLN 40 H GLN 40 2.428 -13.074 8.914
314 HA GLN 40 HA GLN 40 3.607 -12.198 11.398
315 HB2 GLN 40 2HB GLN 40 3.118 -14.647 12.044
316 HB3 GLN 40 3HB GLN 40 1.778 -13.551 11.724
317 HG2 GLN 40 2HG GLN 40 1.364 -14.501 9.549
318 HG3 GLN 40 3HG GLN 40 2.851 -15.456 9.605
319 HE21 GLN 40 2HE2 GLN 40 -0.400 -15.100 11.143
320 HE22 GLN 40 1HE2 GLN 40 -0.455 -16.767 11.696
321 H SER 41 H SER 41 5.578 -12.382 12.176
322 HA SER 41 HA SER 41 7.638 -13.585 10.437
323 HB2 SER 41 2HB SER 41 7.849 -11.258 10.969
324 HB3 SER 41 3HB SER 41 7.814 -11.615 12.707
325 HG SER 41 HG SER 41 9.948 -11.401 11.373
326 HA PRO 42 HA PRO 42 8.683 -16.627 13.517
327 HB2 PRO 42 2HB PRO 42 11.081 -17.057 11.757
328 HB3 PRO 42 3HB PRO 42 9.956 -18.265 12.440
329 HG2 PRO 42 2HG PRO 42 9.811 -17.542 9.819
330 HG3 PRO 42 3HG PRO 42 8.316 -17.791 10.782
331 HD2 PRO 42 2HD PRO 42 9.701 -15.170 10.124
332 HD3 PRO 42 3HD PRO 42 7.967 -15.603 10.011
333 H MET 43 H MET 43 10.498 -13.843 12.555
334 HA MET 43 HA MET 43 12.587 -14.192 14.657
335 HB2 MET 43 2HB MET 43 12.411 -12.406 12.213
336 HB3 MET 43 3HB MET 43 13.580 -12.157 13.495
337 HG2 MET 43 2HG MET 43 14.664 -13.358 11.771
338 HG3 MET 43 3HG MET 43 14.522 -14.382 13.190
339 HE1 MET 43 3HE MET 43 13.104 -13.576 9.619
340 HE2 MET 43 1HE MET 43 12.011 -14.946 9.321
341 HE3 MET 43 2HE MET 43 11.594 -13.732 10.548
342 H PHE 44 H PHE 44 9.883 -12.080 13.774
343 HA PHE 44 HA PHE 44 10.483 -10.244 16.044
344 HB2 PHE 44 2HB PHE 44 10.431 -9.155 13.902
345 HB3 PHE 44 3HB PHE 44 8.887 -9.881 13.500
346 HD1 PHE 44 HD2 PHE 44 10.462 -7.612 16.063
347 HD2 PHE 44 HD1 PHE 44 6.903 -8.687 13.876
348 HE1 PHE 44 HE2 PHE 44 9.255 -5.686 17.068
349 HE2 PHE 44 HE1 PHE 44 5.704 -6.754 14.872
350 HZ PHE 44 HZ PHE 44 6.876 -5.258 16.478
351 H ASP 45 H ASP 45 8.765 -9.463 17.323
352 HA ASP 45 HA ASP 45 7.017 -11.640 18.232
353 HB2 ASP 45 2HB ASP 45 8.537 -10.419 19.765
354 HB3 ASP 45 3HB ASP 45 7.615 -8.941 19.487
355 H GLY 46 H GLY 46 6.037 -10.963 15.896
356 HA2 GLY 46 2HA GLY 46 3.343 -10.398 15.999
357 HA3 GLY 46 3HA GLY 46 4.084 -8.794 15.920
358 H LYS 47 H LYS 47 3.412 -8.253 13.886
359 HA LYS 47 HA LYS 47 4.366 -9.974 11.630
360 HB2 LYS 47 2HB LYS 47 1.987 -8.135 11.352
361 HB3 LYS 47 3HB LYS 47 2.528 -9.426 10.314
362 HG2 LYS 47 2HG LYS 47 2.131 -10.914 12.521
363 HG3 LYS 47 3HG LYS 47 1.063 -9.580 12.950
364 HD2 LYS 47 2HD LYS 47 1.008 -11.295 10.453
365 HD3 LYS 47 3HD LYS 47 -0.111 -11.427 11.815
366 HE2 LYS 47 2HE LYS 47 0.142 -9.106 9.853
367 HE3 LYS 47 3HE LYS 47 -1.120 -10.328 9.849
368 HZ1 LYS 47 3HZ LYS 47 -1.886 -9.476 12.000
369 HZ2 LYS 47 1HZ LYS 47 -0.703 -8.335 12.042
370 HZ3 LYS 47 2HZ LYS 47 -1.847 -8.257 10.899
371 H VAL 48 H VAL 48 5.065 -9.079 9.750
372 HA VAL 48 HA VAL 48 6.430 -6.441 10.115
373 HB VAL 48 HB VAL 48 8.411 -7.417 9.053
374 HG11 VAL 48 1HG1 VAL 48 8.171 -7.364 11.528
375 HG12 VAL 48 2HG1 VAL 48 7.478 -8.996 11.492
376 HG13 VAL 48 3HG1 VAL 48 9.155 -8.728 10.978
377 HG21 VAL 48 3HG2 VAL 48 8.658 -9.859 8.831
378 HG22 VAL 48 1HG2 VAL 48 6.951 -10.091 9.253
379 HG23 VAL 48 2HG2 VAL 48 7.391 -9.259 7.752
380 HA PRO 49 HA PRO 49 4.724 -5.436 6.281
381 HB2 PRO 49 2HB PRO 49 6.041 -3.162 5.552
382 HB3 PRO 49 3HB PRO 49 5.019 -3.262 7.017
383 HG2 PRO 49 2HG PRO 49 8.034 -3.556 6.825
384 HG3 PRO 49 3HG PRO 49 7.090 -2.558 7.974
385 HD2 PRO 49 2HD PRO 49 8.033 -5.053 8.612
386 HD3 PRO 49 3HD PRO 49 6.484 -4.423 9.249
387 H HIS 50 H HIS 50 4.766 -6.326 4.315
388 HA HIS 50 HA HIS 50 7.313 -6.484 2.742
389 HB2 HIS 50 2HB HIS 50 4.625 -7.885 2.590
390 HB3 HIS 50 3HB HIS 50 5.666 -7.781 1.179
391 HD2 HIS 50 HD2 HIS 50 7.038 -8.326 4.732
392 HE1 HIS 50 HE1 HIS 50 7.811 -11.901 2.540
393 HE2 HIS 50 HE2 HIS 50 8.269 -10.672 4.722
394 H TRP 51 H TRP 51 7.701 -4.506 1.866
395 HA TRP 51 HA TRP 51 5.529 -2.745 1.102
396 HB2 TRP 51 2HB TRP 51 8.523 -2.504 0.690
397 HB3 TRP 51 3HB TRP 51 7.335 -1.250 0.360
398 HD1 TRP 51 HD1 TRP 51 9.285 -2.816 3.166
399 HE1 TRP 51 HE1 TRP 51 8.903 -1.532 5.351
400 HE3 TRP 51 HE3 TRP 51 5.436 0.237 1.660
401 HZ2 TRP 51 HZ2 TRP 51 7.116 0.477 6.351
402 HZ3 TRP 51 HZ3 TRP 51 4.348 1.765 3.321
403 HH2 TRP 51 HH2 TRP 51 5.240 1.937 5.630
404 H TYR 52 H TYR 52 4.942 -2.099 -0.937
405 HA TYR 52 HA TYR 52 6.425 -2.965 -3.290
406 HB2 TYR 52 2HB TYR 52 3.566 -3.470 -3.720
407 HB3 TYR 52 3HB TYR 52 5.010 -4.331 -4.249
408 HD1 TYR 52 HD2 TYR 52 2.916 -3.949 -1.116
409 HD2 TYR 52 HD1 TYR 52 5.312 -6.491 -3.631
410 HE1 TYR 52 HE2 TYR 52 2.226 -5.954 0.223
411 HE2 TYR 52 HE1 TYR 52 4.611 -8.477 -2.303
412 HH TYR 52 HH TYR 52 3.428 -9.239 -0.526
413 H HIS 53 H HIS 53 5.714 -1.767 -5.219
414 HA HIS 53 HA HIS 53 4.950 0.991 -4.814
415 HB2 HIS 53 2HB HIS 53 4.582 -0.719 -7.309
416 HB3 HIS 53 3HB HIS 53 4.488 1.020 -7.238
417 HD2 HIS 53 HD2 HIS 53 6.804 2.389 -6.590
418 HE1 HIS 53 HE1 HIS 53 9.369 -0.561 -8.262
419 HE2 HIS 53 HE2 HIS 53 9.209 1.848 -7.502
420 H PHE 54 H PHE 54 2.881 2.054 -5.370
421 HA PHE 54 HA PHE 54 0.611 0.980 -4.159
422 HB2 PHE 54 2HB PHE 54 0.624 3.282 -4.594
423 HB3 PHE 54 3HB PHE 54 0.956 3.074 -6.307
424 HD1 PHE 54 HD2 PHE 54 -1.742 2.406 -3.731
425 HD2 PHE 54 HD1 PHE 54 -0.787 3.053 -7.893
426 HE1 PHE 54 HE2 PHE 54 -4.154 2.341 -4.307
427 HE2 PHE 54 HE1 PHE 54 -3.207 3.009 -8.448
428 HZ PHE 54 HZ PHE 54 -4.885 2.637 -6.660
429 H SER 55 H SER 55 1.494 0.693 -7.659
430 HA SER 55 HA SER 55 -0.981 -0.658 -8.384
431 HB2 SER 55 2HB SER 55 0.142 -0.889 -10.571
432 HB3 SER 55 3HB SER 55 0.121 0.779 -9.974
433 HG SER 55 HG SER 55 2.193 0.247 -10.751
434 H CYS 56 HN CYS 56 2.331 -1.634 -7.566
435 HA CYS 56 HA CYS 56 2.157 -4.326 -8.309
436 HB2 CYS 56 2HB CYS 56 3.866 -2.860 -6.290
437 HB3 CYS 56 3HB CYS 56 4.097 -4.555 -6.691
438 H PHE 57 H PHE 57 1.187 -2.778 -5.255
439 HA PHE 57 HA PHE 57 0.619 -5.022 -3.629
440 HB2 PHE 57 2HB PHE 57 0.458 -2.718 -2.890
441 HB3 PHE 57 3HB PHE 57 -0.919 -2.426 -3.951
442 HD1 PHE 57 HD1 PHE 57 -3.086 -3.727 -3.577
443 HD2 PHE 57 HD2 PHE 57 0.124 -3.667 -0.695
444 HE1 PHE 57 HE1 PHE 57 -4.604 -4.665 -1.877
445 HE2 PHE 57 HE2 PHE 57 -1.465 -4.415 1.058
446 HZ PHE 57 HZ PHE 57 -3.810 -4.995 0.455
447 H TRP 58 H TRP 58 -1.463 -3.497 -6.152
448 HA TRP 58 HA TRP 58 -3.552 -5.458 -5.848
449 HB2 TRP 58 2HB TRP 58 -3.080 -3.550 -8.132
450 HB3 TRP 58 3HB TRP 58 -4.583 -4.347 -7.709
451 HD1 TRP 58 HD1 TRP 58 -2.666 -1.278 -7.189
452 HE1 TRP 58 HE1 TRP 58 -3.497 0.195 -5.286
453 HE3 TRP 58 HE3 TRP 58 -6.150 -4.471 -5.141
454 HZ2 TRP 58 HZ2 TRP 58 -5.465 0.037 -3.145
455 HZ3 TRP 58 HZ3 TRP 58 -7.489 -3.752 -3.222
456 HH2 TRP 58 HH2 TRP 58 -7.146 -1.506 -2.209
457 H LYS 59 H LYS 59 -0.565 -5.536 -7.661
458 HA LYS 59 HA LYS 59 -1.282 -7.793 -9.384
459 HB2 LYS 59 2HB LYS 59 1.454 -6.946 -8.462
460 HB3 LYS 59 3HB LYS 59 1.095 -8.098 -9.738
461 HG2 LYS 59 2HG LYS 59 0.132 -6.378 -11.140
462 HG3 LYS 59 3HG LYS 59 0.227 -5.203 -9.820
463 HD2 LYS 59 2HD LYS 59 2.799 -5.685 -9.836
464 HD3 LYS 59 3HD LYS 59 2.508 -6.384 -11.441
465 HE2 LYS 59 2HE LYS 59 1.638 -4.338 -12.283
466 HE3 LYS 59 3HE LYS 59 1.362 -3.696 -10.655
467 HZ1 LYS 59 3HZ LYS 59 3.318 -2.710 -11.764
468 HZ2 LYS 59 1HZ LYS 59 3.719 -3.435 -10.337
469 HZ3 LYS 59 2HZ LYS 59 4.070 -4.161 -11.770
470 H VAL 60 H VAL 60 -0.333 -7.432 -5.986
471 HA VAL 60 HA VAL 60 0.254 -10.262 -5.563
472 HB VAL 60 HB VAL 60 -0.785 -8.371 -3.434
473 HG11 VAL 60 1HG1 VAL 60 -0.622 -10.738 -2.733
474 HG12 VAL 60 2HG1 VAL 60 1.060 -10.796 -3.294
475 HG13 VAL 60 3HG1 VAL 60 0.600 -9.759 -1.929
476 HG21 VAL 60 3HG2 VAL 60 1.169 -7.275 -4.499
477 HG22 VAL 60 1HG2 VAL 60 1.534 -7.834 -2.884
478 HG23 VAL 60 2HG2 VAL 60 2.122 -8.759 -4.282
479 H GLY 61 H GLY 61 -2.690 -8.471 -6.015
480 HA2 GLY 61 2HA GLY 61 -4.681 -9.398 -6.718
481 HA3 GLY 61 3HA GLY 61 -4.172 -10.988 -6.158
482 H HIS 62 H HIS 62 -3.963 -8.512 -3.730
483 HA HIS 62 HA HIS 62 -6.240 -9.617 -2.228
484 HB2 HIS 62 2HB HIS 62 -4.311 -7.339 -1.661
485 HB3 HIS 62 3HB HIS 62 -5.650 -7.774 -0.606
486 HD2 HIS 62 HD2 HIS 62 -2.278 -9.169 -1.865
487 HE1 HIS 62 HE1 HIS 62 -3.325 -11.381 1.622
488 HE2 HIS 62 HE2 HIS 62 -1.513 -10.989 -0.119
489 H SER 63 H SER 63 -8.272 -8.936 -2.339
490 HA SER 63 HA SER 63 -8.935 -6.186 -3.338
491 HB2 SER 63 2HB SER 63 -10.707 -8.628 -2.937
492 HB3 SER 63 3HB SER 63 -11.273 -7.013 -3.405
493 HG SER 63 HG SER 63 -10.910 -8.462 -5.201
494 H ILE 64 H ILE 64 -9.415 -4.686 -1.848
495 HA ILE 64 HA ILE 64 -9.280 -5.538 0.995
496 HB ILE 64 HB ILE 64 -8.895 -2.819 -0.278
497 HG12 ILE 64 2HG1 ILE 64 -6.812 -4.820 0.685
498 HG13 ILE 64 3HG1 ILE 64 -7.096 -4.303 -0.976
499 HG21 ILE 64 1HG2 ILE 64 -8.267 -3.744 2.564
500 HG22 ILE 64 2HG2 ILE 64 -8.007 -2.127 1.888
501 HG23 ILE 64 3HG2 ILE 64 -9.652 -2.719 2.102
502 HD11 ILE 64 3HD1 ILE 64 -5.297 -2.956 -0.407
503 HD12 ILE 64 1HD1 ILE 64 -6.631 -1.876 -0.038
504 HD13 ILE 64 2HD1 ILE 64 -5.817 -2.776 1.268
505 H ARG 65 H ARG 65 -11.122 -5.682 2.068
506 HA ARG 65 HA ARG 65 -13.579 -4.801 0.748
507 HB2 ARG 65 2HB ARG 65 -14.627 -6.118 2.761
508 HB3 ARG 65 3HB ARG 65 -13.912 -6.957 1.401
509 HG2 ARG 65 2HG ARG 65 -12.213 -6.412 3.845
510 HG3 ARG 65 3HG ARG 65 -13.423 -7.692 3.895
511 HD2 ARG 65 2HD ARG 65 -12.437 -8.917 2.116
512 HD3 ARG 65 3HD ARG 65 -11.409 -7.578 1.630
513 HE ARG 65 HE ARG 65 -11.089 -8.912 4.296
514 HH11 ARG 65 1HH2 ARG 65 -9.535 -8.100 1.203
515 HH12 ARG 65 2HH2 ARG 65 -7.956 -8.368 1.905
516 HH21 ARG 65 1HH1 ARG 65 -8.996 -9.343 4.963
517 HH22 ARG 65 2HH1 ARG 65 -7.680 -9.076 3.845
518 H HIS 66 H HIS 66 -11.753 -3.652 3.357
519 HA HIS 66 HA HIS 66 -13.538 -1.359 3.739
520 HB2 HIS 66 2HB HIS 66 -13.451 -1.605 6.253
521 HB3 HIS 66 3HB HIS 66 -14.588 -2.583 5.361
522 HD2 HIS 66 HD2 HIS 66 -11.072 -4.104 5.460
523 HE1 HIS 66 HE1 HIS 66 -13.384 -6.138 8.403
524 HE2 HIS 66 HE2 HIS 66 -11.183 -6.131 7.130
525 HA PRO 67 HA PRO 67 -9.040 -0.839 3.467
526 HB2 PRO 67 2HB PRO 67 -8.920 1.483 1.925
527 HB3 PRO 67 3HB PRO 67 -9.136 -0.159 1.252
528 HG2 PRO 67 2HG PRO 67 -11.285 1.865 1.933
529 HG3 PRO 67 3HG PRO 67 -11.094 0.922 0.418
530 HD2 PRO 67 2HD PRO 67 -12.807 0.125 2.330
531 HD3 PRO 67 3HD PRO 67 -11.789 -1.087 1.491
532 H ASP 68 H ASP 68 -11.292 1.708 4.500
533 HA ASP 68 HA ASP 68 -9.268 3.294 5.804
534 HB2 ASP 68 2HB ASP 68 -11.429 4.209 5.089
535 HB3 ASP 68 3HB ASP 68 -12.292 3.082 6.133
536 H VAL 69 H VAL 69 -10.612 0.249 6.581
537 HA VAL 69 HA VAL 69 -10.211 0.502 9.509
538 HB VAL 69 HB VAL 69 -11.437 -1.777 7.912
539 HG11 VAL 69 1HG1 VAL 69 -11.439 -1.202 10.900
540 HG12 VAL 69 2HG1 VAL 69 -12.367 -2.484 10.089
541 HG13 VAL 69 3HG1 VAL 69 -10.606 -2.543 10.080
542 HG21 VAL 69 3HG2 VAL 69 -12.786 0.475 9.466
543 HG22 VAL 69 1HG2 VAL 69 -12.845 0.232 7.706
544 HG23 VAL 69 2HG2 VAL 69 -13.610 -0.943 8.776
545 H GLU 70 H GLU 70 -9.050 -1.283 6.657
546 HA GLU 70 HA GLU 70 -7.027 -2.670 8.379
547 HB2 GLU 70 2HB GLU 70 -8.403 -3.431 5.795
548 HB3 GLU 70 3HB GLU 70 -6.916 -4.225 6.295
549 HG2 GLU 70 2HG GLU 70 -9.448 -4.109 7.967
550 HG3 GLU 70 3HG GLU 70 -8.944 -5.469 6.960
551 H VAL 71 H VAL 71 -7.096 -0.389 5.714
552 HA VAL 71 HA VAL 71 -4.178 -0.736 5.200
553 HB VAL 71 HB VAL 71 -5.973 1.367 4.029
554 HG11 VAL 71 1HG1 VAL 71 -3.279 0.153 3.274
555 HG12 VAL 71 2HG1 VAL 71 -4.152 1.473 2.446
556 HG13 VAL 71 3HG1 VAL 71 -3.502 1.713 4.089
557 HG21 VAL 71 3HG2 VAL 71 -5.138 -1.398 3.022
558 HG22 VAL 71 1HG2 VAL 71 -6.791 -0.891 3.380
559 HG23 VAL 71 2HG2 VAL 71 -5.927 -0.143 2.028
560 H ASP 72 H ASP 72 -3.158 -0.341 7.020
561 HA ASP 72 HA ASP 72 -3.436 1.953 8.726
562 HB2 ASP 72 2HB ASP 72 -2.261 -0.129 9.272
563 HB3 ASP 72 3HB ASP 72 -1.050 0.190 8.031
564 H GLY 73 H GLY 73 -2.501 3.989 8.598
565 HA2 GLY 73 2HA GLY 73 -1.255 5.774 7.765
566 HA3 GLY 73 3HA GLY 73 -0.567 4.723 6.528
567 H PHE 74 H PHE 74 -3.885 4.331 6.265
568 HA PHE 74 HA PHE 74 -4.272 5.897 3.920
569 HB2 PHE 74 2HB PHE 74 -5.605 3.942 4.603
570 HB3 PHE 74 3HB PHE 74 -6.252 4.834 5.975
571 HD1 PHE 74 HD2 PHE 74 -6.186 4.608 2.254
572 HD2 PHE 74 HD1 PHE 74 -8.129 6.325 5.704
573 HE1 PHE 74 HE2 PHE 74 -8.048 5.423 0.816
574 HE2 PHE 74 HE1 PHE 74 -9.985 7.127 4.256
575 HZ PHE 74 HZ PHE 74 -9.907 6.718 1.813
576 H SER 75 H SER 75 -4.484 6.800 7.312
577 HA SER 75 HA SER 75 -5.743 9.379 7.032
578 HB2 SER 75 2HB SER 75 -4.658 9.706 9.307
579 HB3 SER 75 3HB SER 75 -5.770 8.329 9.161
580 HG SER 75 HG SER 75 -3.790 7.778 10.226
581 H GLU 76 H GLU 76 -2.479 8.290 6.324
582 HA GLU 76 HA GLU 76 -1.265 10.945 6.661
583 HB2 GLU 76 2HB GLU 76 -0.140 8.411 5.399
584 HB3 GLU 76 3HB GLU 76 0.759 9.876 5.771
585 HG2 GLU 76 2HG GLU 76 0.404 9.576 8.166
586 HG3 GLU 76 3HG GLU 76 -0.642 8.182 7.880
587 H LEU 77 H LEU 77 -3.012 9.322 4.196
588 HA LEU 77 HA LEU 77 -1.872 10.675 1.873
589 HB2 LEU 77 2HB LEU 77 -4.481 9.166 2.238
590 HB3 LEU 77 3HB LEU 77 -3.788 9.655 0.697
591 HG LEU 77 HG LEU 77 -2.655 7.587 2.628
592 HD11 LEU 77 1HD1 LEU 77 -3.929 7.367 -0.135
593 HD12 LEU 77 2HD1 LEU 77 -3.236 6.026 0.788
594 HD13 LEU 77 3HD1 LEU 77 -4.665 6.871 1.403
595 HD21 LEU 77 3HD2 LEU 77 -0.806 8.726 1.446
596 HD22 LEU 77 1HD2 LEU 77 -1.022 7.075 0.864
597 HD23 LEU 77 2HD2 LEU 77 -1.626 8.438 -0.106
598 H ARG 78 H ARG 78 -2.940 12.201 0.545
599 HA ARG 78 HA ARG 78 -4.874 14.030 1.863
600 HB2 ARG 78 2HB ARG 78 -3.372 14.101 -0.789
601 HB3 ARG 78 3HB ARG 78 -4.710 15.191 -0.484
602 HG2 ARG 78 2HG ARG 78 -2.261 15.012 1.322
603 HG3 ARG 78 3HG ARG 78 -2.463 16.171 0.001
604 HD2 ARG 78 2HD ARG 78 -4.559 17.025 1.097
605 HD3 ARG 78 3HD ARG 78 -4.291 15.923 2.435
606 HE ARG 78 HE ARG 78 -2.556 17.233 3.253
607 HH11 ARG 78 1HH2 ARG 78 -3.467 18.563 0.134
608 HH12 ARG 78 2HH2 ARG 78 -2.545 20.019 0.393
609 HH21 ARG 78 1HH1 ARG 78 -1.408 19.108 3.504
610 HH22 ARG 78 2HH1 ARG 78 -1.412 20.310 2.249
611 H TRP 79 H TRP 79 -6.778 14.711 0.712
612 HA TRP 79 HA TRP 79 -8.602 12.665 0.620
613 HB2 TRP 79 2HB TRP 79 -9.733 14.559 0.938
614 HB3 TRP 79 3HB TRP 79 -8.594 15.527 0.024
615 HD1 TRP 79 HD1 TRP 79 -11.868 13.618 -0.429
616 HE1 TRP 79 HE1 TRP 79 -12.908 14.243 -2.697
617 HE3 TRP 79 HE3 TRP 79 -8.001 16.334 -2.346
618 HZ2 TRP 79 HZ2 TRP 79 -12.160 15.782 -5.039
619 HZ3 TRP 79 HZ3 TRP 79 -8.156 17.346 -4.613
620 HH2 TRP 79 HH2 TRP 79 -10.232 17.081 -5.966
621 H ASP 80 H ASP 80 -6.864 13.970 -2.217
622 HA ASP 80 HA ASP 80 -8.466 12.597 -4.136
623 HB2 ASP 80 2HB ASP 80 -7.089 14.620 -4.588
624 HB3 ASP 80 3HB ASP 80 -5.637 13.619 -4.474
625 H ASP 81 H ASP 81 -5.678 11.474 -2.269
626 HA ASP 81 HA ASP 81 -5.487 9.040 -3.918
627 HB2 ASP 81 2HB ASP 81 -3.767 9.958 -1.629
628 HB3 ASP 81 3HB ASP 81 -3.676 8.369 -2.417
629 H GLN 82 H GLN 82 -6.695 10.177 -0.749
630 HA GLN 82 HA GLN 82 -7.473 7.624 0.246
631 HB2 GLN 82 2HB GLN 82 -8.661 10.403 0.551
632 HB3 GLN 82 3HB GLN 82 -9.391 8.988 1.316
633 HG2 GLN 82 2HG GLN 82 -7.265 8.459 2.440
634 HG3 GLN 82 3HG GLN 82 -6.515 9.886 1.712
635 HE21 GLN 82 2HE2 GLN 82 -6.550 9.496 4.489
636 HE22 GLN 82 1HE2 GLN 82 -7.578 10.756 5.187
637 H GLN 83 H GLN 83 -9.321 9.864 -1.943
638 HA GLN 83 HA GLN 83 -11.410 7.941 -2.293
639 HB2 GLN 83 2HB GLN 83 -12.325 9.341 -3.959
640 HB3 GLN 83 3HB GLN 83 -11.720 10.339 -2.636
641 HG2 GLN 83 2HG GLN 83 -9.689 10.831 -4.016
642 HG3 GLN 83 3HG GLN 83 -10.396 9.942 -5.361
643 HE21 GLN 83 2HE2 GLN 83 -9.751 12.548 -5.975
644 HE22 GLN 83 1HE2 GLN 83 -11.208 13.522 -5.943
645 H LYS 84 H LYS 84 -8.280 8.184 -4.055
646 HA LYS 84 HA LYS 84 -9.230 6.403 -6.154
647 HB2 LYS 84 2HB LYS 84 -7.277 6.759 -7.230
648 HB3 LYS 84 3HB LYS 84 -7.514 8.288 -6.385
649 HG2 LYS 84 2HG LYS 84 -5.347 8.076 -6.015
650 HG3 LYS 84 3HG LYS 84 -5.876 7.119 -4.625
651 HD2 LYS 84 2HD LYS 84 -5.513 5.060 -5.785
652 HD3 LYS 84 3HD LYS 84 -5.189 5.889 -7.313
653 HE2 LYS 84 2HE LYS 84 -3.479 6.049 -4.793
654 HE3 LYS 84 3HE LYS 84 -3.119 5.093 -6.231
655 HZ1 LYS 84 3HZ LYS 84 -3.106 8.042 -5.977
656 HZ2 LYS 84 1HZ LYS 84 -1.898 7.076 -6.468
657 HZ3 LYS 84 2HZ LYS 84 -3.172 7.314 -7.461
658 H VAL 85 H VAL 85 -7.384 6.114 -3.145
659 HA VAL 85 HA VAL 85 -6.780 3.300 -3.575
660 HB VAL 85 HB VAL 85 -6.810 5.062 -1.099
661 HG11 VAL 85 1HG1 VAL 85 -7.211 2.817 -0.225
662 HG12 VAL 85 2HG1 VAL 85 -5.900 2.152 -1.238
663 HG13 VAL 85 3HG1 VAL 85 -5.541 3.280 0.083
664 HG21 VAL 85 3HG2 VAL 85 -4.411 5.002 -1.323
665 HG22 VAL 85 1HG2 VAL 85 -4.490 3.752 -2.576
666 HG23 VAL 85 2HG2 VAL 85 -5.058 5.394 -2.926
667 H LYS 86 H LYS 86 -9.475 5.014 -1.891
668 HA LYS 86 HA LYS 86 -10.961 2.633 -1.238
669 HB2 LYS 86 2HB LYS 86 -11.854 5.498 -1.758
670 HB3 LYS 86 3HB LYS 86 -12.948 4.200 -1.265
671 HG2 LYS 86 2HG LYS 86 -11.606 3.834 0.799
672 HG3 LYS 86 3HG LYS 86 -10.516 5.125 0.326
673 HD2 LYS 86 2HD LYS 86 -12.023 6.054 1.927
674 HD3 LYS 86 3HD LYS 86 -12.504 6.714 0.355
675 HE2 LYS 86 2HE LYS 86 -14.296 4.943 0.246
676 HE3 LYS 86 3HE LYS 86 -13.767 4.362 1.834
677 HZ1 LYS 86 3HZ LYS 86 -15.667 5.869 2.026
678 HZ2 LYS 86 1HZ LYS 86 -14.371 6.535 2.758
679 HZ3 LYS 86 2HZ LYS 86 -14.854 7.079 1.293
680 H LYS 87 H LYS 87 -11.152 4.711 -4.200
681 HA LYS 87 HA LYS 87 -13.097 3.016 -5.497
682 HB2 LYS 87 2HB LYS 87 -11.294 5.239 -6.395
683 HB3 LYS 87 3HB LYS 87 -11.766 4.088 -7.622
684 HG2 LYS 87 2HG LYS 87 -13.329 5.894 -7.654
685 HG3 LYS 87 3HG LYS 87 -14.134 4.408 -7.153
686 HD2 LYS 87 2HD LYS 87 -14.035 5.199 -4.765
687 HD3 LYS 87 3HD LYS 87 -13.298 6.713 -5.341
688 HE2 LYS 87 2HE LYS 87 -15.277 7.134 -6.773
689 HE3 LYS 87 3HE LYS 87 -16.014 5.631 -6.207
690 HZ1 LYS 87 3HZ LYS 87 -16.854 7.548 -4.979
691 HZ2 LYS 87 1HZ LYS 87 -16.043 6.570 -3.955
692 HZ3 LYS 87 2HZ LYS 87 -15.358 7.962 -4.480
693 H THR 88 H THR 88 -9.514 2.870 -5.626
694 HA THR 88 HA THR 88 -9.433 0.709 -7.466
695 HB THR 88 HB THR 88 -7.351 1.454 -5.392
696 HG1 THR 88 1HG THR 88 -7.748 3.157 -6.726
697 HG21 THR 88 1HG2 THR 88 -7.246 -0.118 -7.994
698 HG22 THR 88 2HG2 THR 88 -5.815 0.452 -7.109
699 HG23 THR 88 3HG2 THR 88 -6.896 -0.739 -6.368
700 H ALA 89 H ALA 89 -9.767 0.692 -3.902
701 HA ALA 89 HA ALA 89 -9.463 -2.165 -3.599
702 HB1 ALA 89 1HB ALA 89 -10.763 -0.009 -1.879
703 HB2 ALA 89 2HB ALA 89 -10.432 -1.671 -1.374
704 HB3 ALA 89 3HB ALA 89 -9.086 -0.589 -1.771
705 H GLU 90 H GLU 90 -12.260 0.057 -4.030
706 HA GLU 90 HA GLU 90 -14.257 -2.002 -3.979
707 HB2 GLU 90 2HB GLU 90 -14.200 0.817 -5.112
708 HB3 GLU 90 3HB GLU 90 -15.635 -0.194 -5.216
709 HG2 GLU 90 2HG GLU 90 -14.288 0.437 -2.560
710 HG3 GLU 90 3HG GLU 90 -15.518 1.466 -3.286
711 H ALA 91 H ALA 91 -12.287 -0.681 -6.575
712 HA ALA 91 HA ALA 91 -13.553 -2.080 -8.745
713 HB1 ALA 91 1HB ALA 91 -10.848 -0.693 -8.438
714 HB2 ALA 91 2HB ALA 91 -11.573 -1.195 -9.984
715 HB3 ALA 91 3HB ALA 91 -12.353 0.052 -8.990
716 H GLY 92 H GLY 92 -11.650 -3.357 -6.252
717 HA2 GLY 92 2HA GLY 92 -10.685 -5.421 -5.949
718 HA3 GLY 92 3HA GLY 92 -11.256 -5.917 -7.548
719 H GLY 93 H GLY 93 -9.198 -3.080 -7.111
720 HA2 GLY 93 2HA GLY 93 -6.899 -2.879 -7.148
721 HA3 GLY 93 3HA GLY 93 -6.713 -4.529 -7.729
722 H VAL 94 H VAL 94 -5.572 -1.955 -8.555
723 HA VAL 94 HA VAL 94 -5.957 -2.255 -11.495
724 HB VAL 94 HB VAL 94 -5.684 0.393 -10.021
725 HG11 VAL 94 1HG1 VAL 94 -4.227 0.480 -11.997
726 HG12 VAL 94 2HG1 VAL 94 -5.504 -0.226 -13.007
727 HG13 VAL 94 3HG1 VAL 94 -5.694 1.405 -12.320
728 HG21 VAL 94 3HG2 VAL 94 -7.803 -0.677 -11.943
729 HG22 VAL 94 1HG2 VAL 94 -8.010 -0.468 -10.194
730 HG23 VAL 94 2HG2 VAL 94 -7.774 0.949 -11.221
731 H THR 95 H THR 95 -4.143 -2.449 -12.619
732 HA THR 95 HA THR 95 -1.541 -2.375 -11.160
733 HB THR 95 HB THR 95 -0.880 -4.300 -12.483
734 HG1 THR 95 1HG THR 95 -2.442 -5.335 -13.775
735 HG21 THR 95 1HG2 THR 95 -3.636 -4.791 -11.254
736 HG22 THR 95 2HG2 THR 95 -2.323 -5.973 -11.454
737 HG23 THR 95 3HG2 THR 95 -2.139 -4.620 -10.317
738 H GLY 96 H GLY 96 0.394 -2.115 -12.524
739 HA2 GLY 96 2HA GLY 96 0.205 -0.820 -15.109
740 HA3 GLY 96 3HA GLY 96 0.456 0.329 -13.794
741 H LYS 97 H LYS 97 2.322 0.071 -15.804
742 HA LYS 97 HA LYS 97 4.396 -1.886 -15.257
743 HB2 LYS 97 2HB LYS 97 4.332 0.540 -17.100
744 HB3 LYS 97 3HB LYS 97 5.630 -0.658 -17.059
745 HG2 LYS 97 2HG LYS 97 4.009 -2.452 -17.644
746 HG3 LYS 97 3HG LYS 97 2.716 -1.243 -17.751
747 HD2 LYS 97 2HD LYS 97 3.956 -0.068 -19.552
748 HD3 LYS 97 3HD LYS 97 5.247 -1.288 -19.454
749 HE2 LYS 97 2HE LYS 97 3.603 -3.066 -20.021
750 HE3 LYS 97 3HE LYS 97 2.320 -1.855 -20.117
751 HZ1 LYS 97 3HZ LYS 97 3.214 -2.371 -22.314
752 HZ2 LYS 97 1HZ LYS 97 3.533 -0.811 -21.959
753 HZ3 LYS 97 2HZ LYS 97 4.720 -1.932 -21.870
754 H GLY 98 H GLY 98 6.639 -1.417 -14.918
755 HA2 GLY 98 2HA GLY 98 7.208 0.191 -12.583
756 HA3 GLY 98 3HA GLY 98 8.370 -0.693 -13.566
757 H GLN 99 H GLN 99 9.326 1.542 -12.637
758 HA GLN 99 HA GLN 99 9.372 3.493 -14.869
759 HB2 GLN 99 2HB GLN 99 7.596 4.168 -13.241
760 HB3 GLN 99 3HB GLN 99 8.806 4.225 -11.963
761 HG2 GLN 99 2HG GLN 99 8.218 6.459 -12.825
762 HG3 GLN 99 3HG GLN 99 9.924 6.116 -13.046
763 HE21 GLN 99 2HE2 GLN 99 6.795 6.479 -14.760
764 HE22 GLN 99 1HE2 GLN 99 7.531 6.625 -16.350
765 H ASP 100 H ASP 100 11.191 4.917 -14.870
766 HA ASP 100 HA ASP 100 13.653 3.629 -14.263
767 HB2 ASP 100 2HB ASP 100 13.186 5.185 -16.146
768 HB3 ASP 100 3HB ASP 100 13.078 6.524 -15.004
769 H GLY 101 H GLY 101 11.788 5.851 -12.304
770 HA2 GLY 101 2HA GLY 101 13.896 6.625 -10.444
771 HA3 GLY 101 3HA GLY 101 12.153 6.793 -10.209
772 H ILE 102 H ILE 102 14.890 4.641 -9.966
773 HA ILE 102 HA ILE 102 13.375 2.606 -8.450
774 HB ILE 102 HB ILE 102 14.619 2.076 -10.539
775 HG12 ILE 102 2HG1 ILE 102 15.725 0.467 -8.215
776 HG13 ILE 102 3HG1 ILE 102 14.035 0.403 -8.728
777 HG21 ILE 102 1HG2 ILE 102 17.056 1.889 -10.539
778 HG22 ILE 102 2HG2 ILE 102 16.594 3.546 -10.164
779 HG23 ILE 102 3HG2 ILE 102 17.139 2.463 -8.864
780 HD11 ILE 102 3HD1 ILE 102 16.445 -0.322 -10.443
781 HD12 ILE 102 1HD1 ILE 102 15.280 -1.437 -9.714
782 HD13 ILE 102 2HD1 ILE 102 14.751 -0.325 -10.992
783 H GLY 103 H GLY 103 14.904 5.268 -7.468
784 HA2 GLY 103 2HA GLY 103 14.883 4.519 -4.781
785 HA3 GLY 103 3HA GLY 103 16.559 4.335 -5.309
786 H SER 104 H SER 104 16.233 6.054 -3.348
787 HA SER 104 HA SER 104 16.798 8.710 -4.486
788 HB2 SER 104 2HB SER 104 15.129 9.828 -3.027
789 HB3 SER 104 3HB SER 104 14.375 8.793 -4.245
790 HG SER 104 HG SER 104 14.830 8.132 -1.507
791 H LYS 105 H LYS 105 17.766 10.165 -3.004
792 HA LYS 105 HA LYS 105 18.463 9.217 -0.280
793 HB2 LYS 105 2HB LYS 105 20.332 8.554 -1.790
794 HB3 LYS 105 3HB LYS 105 20.523 10.244 -2.279
795 HG2 LYS 105 2HG LYS 105 21.106 10.862 0.053
796 HG3 LYS 105 3HG LYS 105 20.780 9.207 0.584
797 HD2 LYS 105 2HD LYS 105 23.163 9.525 0.412
798 HD3 LYS 105 3HD LYS 105 22.648 8.386 -0.840
799 HE2 LYS 105 2HE LYS 105 22.708 10.211 -2.528
800 HE3 LYS 105 3HE LYS 105 23.164 11.369 -1.270
801 HZ1 LYS 105 3HZ LYS 105 25.106 10.575 -2.493
802 HZ2 LYS 105 1HZ LYS 105 25.217 10.096 -0.939
803 HZ3 LYS 105 2HZ LYS 105 24.795 9.023 -2.098
804 H ALA 106 H ALA 106 18.439 10.815 1.223
805 HA ALA 106 HA ALA 106 18.686 13.616 0.654
806 HB1 ALA 106 1HB ALA 106 15.970 12.482 1.497
807 HB2 ALA 106 2HB ALA 106 16.402 14.205 1.448
808 HB3 ALA 106 3HB ALA 106 16.327 13.274 -0.056
809 H GLU 107 H GLU 107 18.941 14.754 2.550
810 HA GLU 107 HA GLU 107 19.871 13.327 4.908
811 HB2 GLU 107 2HB GLU 107 19.417 16.298 4.415
812 HB3 GLU 107 3HB GLU 107 20.246 15.627 5.815
813 HG2 GLU 107 2HG GLU 107 21.175 15.366 2.921
814 HG3 GLU 107 3HG GLU 107 21.809 16.488 4.115
815 H LYS 108 H LYS 108 16.771 14.480 4.019
816 HA LYS 108 HA LYS 108 15.609 13.879 6.683
817 HB2 LYS 108 2HB LYS 108 15.009 16.361 5.011
818 HB3 LYS 108 3HB LYS 108 14.052 15.833 6.387
819 HG2 LYS 108 2HG LYS 108 16.975 16.696 6.528
820 HG3 LYS 108 3HG LYS 108 15.581 17.699 6.919
821 HD2 LYS 108 2HD LYS 108 14.938 16.153 8.744
822 HD3 LYS 108 3HD LYS 108 16.347 15.134 8.384
823 HE2 LYS 108 2HE LYS 108 17.853 17.058 8.820
824 HE3 LYS 108 3HE LYS 108 16.453 18.069 9.202
825 HZ1 LYS 108 3HZ LYS 108 17.254 15.630 10.700
826 HZ2 LYS 108 1HZ LYS 108 17.465 17.163 11.214
827 HZ3 LYS 108 2HZ LYS 108 15.958 16.561 11.055
Start of MODEL 4
1 H1 MET 1 H1 MET 1 -7.746 -7.002 17.316
2 H2 MET 1 H2 MET 1 -6.733 -8.283 17.501
3 H3 MET 1 H3 MET 1 -6.291 -7.005 16.561
4 HA MET 1 HA MET 1 -6.170 -5.538 18.393
5 HB2 MET 1 2HB MET 1 -7.965 -6.537 19.743
6 HB3 MET 1 3HB MET 1 -6.959 -7.950 20.083
7 HG2 MET 1 2HG MET 1 -6.981 -6.342 21.948
8 HG3 MET 1 3HG MET 1 -5.358 -6.574 21.307
9 HE1 MET 1 1HE MET 1 -4.433 -4.479 22.567
10 HE2 MET 1 2HE MET 1 -5.205 -2.877 22.533
11 HE3 MET 1 3HE MET 1 -6.041 -4.248 23.296
12 H ALA 2 H ALA 2 -4.079 -5.123 18.465
13 HA ALA 2 HA ALA 2 -2.159 -6.960 19.622
14 HB1 ALA 2 1HB ALA 2 -0.619 -6.988 17.694
15 HB2 ALA 2 2HB ALA 2 -2.156 -7.742 17.252
16 HB3 ALA 2 3HB ALA 2 -1.789 -6.093 16.710
17 H GLU 3 H GLU 3 0.042 -5.843 19.752
18 HA GLU 3 HA GLU 3 -0.259 -3.232 20.900
19 HB2 GLU 3 2HB GLU 3 1.379 -4.992 21.565
20 HB3 GLU 3 3HB GLU 3 2.277 -4.691 20.072
21 HG2 GLU 3 2HG GLU 3 2.752 -2.387 20.788
22 HG3 GLU 3 3HG GLU 3 1.713 -2.582 22.203
23 H SER 4 H SER 4 0.835 -4.187 17.678
24 HA SER 4 HA SER 4 0.677 -1.386 16.750
25 HB2 SER 4 2HB SER 4 3.017 -1.234 16.131
26 HB3 SER 4 3HB SER 4 2.859 -1.583 17.870
27 HG SER 4 HG SER 4 4.464 -2.894 16.881
28 H SER 5 H SER 5 1.465 -4.763 15.910
29 HA SER 5 HA SER 5 1.068 -4.290 13.059
30 HB2 SER 5 2HB SER 5 1.684 -6.603 12.763
31 HB3 SER 5 3HB SER 5 2.848 -5.779 13.802
32 HG SER 5 HG SER 5 2.198 -6.949 15.499
33 H ASP 6 H ASP 6 -1.209 -3.592 14.461
34 HA ASP 6 HA ASP 6 -3.034 -5.814 14.275
35 HB2 ASP 6 2HB ASP 6 -2.883 -4.164 16.215
36 HB3 ASP 6 3HB ASP 6 -3.688 -2.992 15.183
37 H LYS 7 H LYS 7 -2.271 -5.295 11.755
38 HA LYS 7 HA LYS 7 -4.721 -4.639 10.311
39 HB2 LYS 7 2HB LYS 7 -3.552 -3.210 8.708
40 HB3 LYS 7 3HB LYS 7 -3.663 -2.469 10.288
41 HG2 LYS 7 2HG LYS 7 -1.185 -4.075 9.691
42 HG3 LYS 7 3HG LYS 7 -1.391 -2.549 8.828
43 HD2 LYS 7 2HD LYS 7 -1.660 -1.338 10.934
44 HD3 LYS 7 3HD LYS 7 -1.482 -2.822 11.857
45 HE2 LYS 7 2HE LYS 7 0.782 -3.097 11.261
46 HE3 LYS 7 3HE LYS 7 0.655 -1.989 9.882
47 HZ1 LYS 7 3HZ LYS 7 0.401 -0.151 11.413
48 HZ2 LYS 7 1HZ LYS 7 0.517 -1.163 12.732
49 HZ3 LYS 7 2HZ LYS 7 1.797 -0.936 11.742
50 H LEU 8 H LEU 8 -4.415 -5.237 8.031
51 HA LEU 8 HA LEU 8 -2.383 -7.388 7.599
52 HB2 LEU 8 2HB LEU 8 -3.872 -8.395 6.010
53 HB3 LEU 8 3HB LEU 8 -4.545 -8.401 7.628
54 HG LEU 8 HG LEU 8 -5.361 -6.314 5.571
55 HD11 LEU 8 1HD1 LEU 8 -6.669 -9.014 6.132
56 HD12 LEU 8 2HD1 LEU 8 -7.245 -7.757 5.009
57 HD13 LEU 8 3HD1 LEU 8 -5.737 -8.612 4.672
58 HD21 LEU 8 3HD2 LEU 8 -6.691 -7.365 8.097
59 HD22 LEU 8 1HD2 LEU 8 -6.185 -5.693 7.754
60 HD23 LEU 8 2HD2 LEU 8 -7.531 -6.389 6.875
61 H TYR 9 H TYR 9 -3.381 -4.238 6.666
62 HA TYR 9 HA TYR 9 -1.605 -4.279 4.307
63 HB2 TYR 9 2HB TYR 9 -4.311 -2.934 4.340
64 HB3 TYR 9 3HB TYR 9 -3.197 -3.038 2.988
65 HD1 TYR 9 HD2 TYR 9 -2.568 -5.944 2.910
66 HD2 TYR 9 HD1 TYR 9 -6.289 -3.903 3.600
67 HE1 TYR 9 HE2 TYR 9 -3.808 -7.916 2.018
68 HE2 TYR 9 HE1 TYR 9 -7.534 -5.871 2.716
69 HH TYR 9 HH TYR 9 -7.361 -7.872 1.623
70 H ARG 10 H ARG 10 -0.749 -2.222 3.803
71 HA ARG 10 HA ARG 10 -1.288 0.071 5.583
72 HB2 ARG 10 2HB ARG 10 0.497 -0.603 6.822
73 HB3 ARG 10 3HB ARG 10 1.166 -1.579 5.548
74 HG2 ARG 10 2HG ARG 10 2.788 0.059 6.027
75 HG3 ARG 10 3HG ARG 10 2.110 0.457 4.459
76 HD2 ARG 10 2HD ARG 10 2.420 2.484 5.617
77 HD3 ARG 10 3HD ARG 10 0.687 2.193 5.576
78 HE ARG 10 HE ARG 10 1.246 1.227 8.026
79 HH11 ARG 10 1HH2 ARG 10 2.094 4.265 6.498
80 HH12 ARG 10 2HH2 ARG 10 1.795 5.194 7.944
81 HH21 ARG 10 1HH1 ARG 10 0.827 2.481 9.815
82 HH22 ARG 10 2HH1 ARG 10 1.250 4.186 9.791
83 H VAL 11 H VAL 11 -0.976 2.055 4.597
84 HA VAL 11 HA VAL 11 0.347 2.178 1.951
85 HB VAL 11 HB VAL 11 -2.144 1.998 1.690
86 HG11 VAL 11 1HG1 VAL 11 -2.203 4.908 2.600
87 HG12 VAL 11 2HG1 VAL 11 -3.565 3.918 2.049
88 HG13 VAL 11 3HG1 VAL 11 -2.756 3.573 3.592
89 HG21 VAL 11 3HG2 VAL 11 -0.597 3.020 -0.061
90 HG22 VAL 11 1HG2 VAL 11 -2.249 3.655 -0.112
91 HG23 VAL 11 2HG2 VAL 11 -0.937 4.604 0.619
92 H GLU 12 H GLU 12 1.474 4.125 1.580
93 HA GLU 12 HA GLU 12 0.970 6.427 3.301
94 HB2 GLU 12 2HB GLU 12 3.122 6.664 4.271
95 HB3 GLU 12 3HB GLU 12 2.549 5.058 4.714
96 HG2 GLU 12 2HG GLU 12 4.012 4.004 3.115
97 HG3 GLU 12 3HG GLU 12 4.467 5.537 2.391
98 H TYR 13 H TYR 13 2.081 8.314 2.772
99 HA TYR 13 HA TYR 13 3.375 8.546 0.135
100 HB2 TYR 13 2HB TYR 13 3.122 10.460 2.480
101 HB3 TYR 13 3HB TYR 13 3.890 10.829 0.944
102 HD1 TYR 13 HD1 TYR 13 1.365 9.039 -0.432
103 HD2 TYR 13 HD2 TYR 13 1.829 12.560 2.031
104 HE1 TYR 13 HE1 TYR 13 -0.635 10.044 -1.483
105 HE2 TYR 13 HE2 TYR 13 -0.239 13.521 1.024
106 HH TYR 13 HH TYR 13 -1.875 11.962 -1.740
107 H ALA 14 H ALA 14 5.395 8.004 -0.182
108 HA ALA 14 HA ALA 14 6.798 6.515 1.729
109 HB1 ALA 14 1HB ALA 14 7.685 7.629 -0.959
110 HB2 ALA 14 2HB ALA 14 8.479 6.308 -0.092
111 HB3 ALA 14 3HB ALA 14 6.818 6.113 -0.691
112 H LYS 15 H LYS 15 8.182 6.993 3.286
113 HA LYS 15 HA LYS 15 9.079 9.723 3.753
114 HB2 LYS 15 2HB LYS 15 9.798 7.198 5.298
115 HB3 LYS 15 3HB LYS 15 9.920 8.862 5.860
116 HG2 LYS 15 2HG LYS 15 7.380 7.298 5.294
117 HG3 LYS 15 3HG LYS 15 8.002 7.801 6.864
118 HD2 LYS 15 2HD LYS 15 7.708 10.196 6.188
119 HD3 LYS 15 3HD LYS 15 6.968 9.665 4.669
120 HE2 LYS 15 2HE LYS 15 5.937 9.026 7.464
121 HE3 LYS 15 3HE LYS 15 5.311 10.289 6.395
122 HZ1 LYS 15 3HZ LYS 15 3.952 8.324 6.205
123 HZ2 LYS 15 1HZ LYS 15 4.775 8.511 4.778
124 HZ3 LYS 15 2HZ LYS 15 5.220 7.360 5.849
125 H SER 16 H SER 16 10.719 6.779 2.743
126 HA SER 16 HA SER 16 13.214 8.115 2.019
127 HB2 SER 16 2HB SER 16 13.396 7.876 4.507
128 HB3 SER 16 3HB SER 16 13.247 6.118 4.317
129 HG SER 16 HG SER 16 15.453 7.028 4.386
130 H GLY 17 H GLY 17 14.705 6.615 0.984
131 HA2 GLY 17 2HA GLY 17 13.367 4.680 -0.703
132 HA3 GLY 17 3HA GLY 17 15.064 5.145 -0.762
133 H ARG 18 H ARG 18 13.683 3.868 2.218
134 HA ARG 18 HA ARG 18 15.633 1.665 2.252
135 HB2 ARG 18 2HB ARG 18 13.480 2.482 4.254
136 HB3 ARG 18 3HB ARG 18 14.732 1.279 4.543
137 HG2 ARG 18 2HG ARG 18 15.218 4.249 4.059
138 HG3 ARG 18 3HG ARG 18 15.251 3.418 5.615
139 HD2 ARG 18 2HD ARG 18 17.133 1.996 4.790
140 HD3 ARG 18 3HD ARG 18 17.150 2.937 3.281
141 HE ARG 18 HE ARG 18 17.334 4.784 5.404
142 HH11 ARG 18 1HH2 ARG 18 19.357 2.239 4.099
143 HH12 ARG 18 2HH2 ARG 18 20.825 2.999 4.649
144 HH21 ARG 18 1HH1 ARG 18 19.243 5.698 6.079
145 HH22 ARG 18 2HH1 ARG 18 20.755 4.907 5.738
146 H ALA 19 H ALA 19 12.304 1.893 1.362
147 HA ALA 19 HA ALA 19 11.720 -0.950 1.820
148 HB1 ALA 19 1HB ALA 19 9.507 -0.343 0.967
149 HB2 ALA 19 2HB ALA 19 10.005 0.773 2.252
150 HB3 ALA 19 3HB ALA 19 10.082 1.270 0.540
151 H SER 20 H SER 20 11.378 -2.513 0.211
152 HA SER 20 HA SER 20 12.116 -1.805 -2.578
153 HB2 SER 20 2HB SER 20 13.157 -3.983 -2.862
154 HB3 SER 20 3HB SER 20 14.000 -3.001 -1.659
155 HG SER 20 HG SER 20 13.832 -5.001 -0.800
156 H CYS 21 HN CYS 21 11.038 -3.063 -4.191
157 HA CYS 21 HA CYS 21 8.266 -3.627 -3.374
158 HB2 CYS 21 2HB CYS 21 8.865 -2.134 -5.264
159 HB3 CYS 21 3HB CYS 21 9.572 -3.530 -6.103
160 H LYS 22 H LYS 22 7.857 -5.631 -2.622
161 HA LYS 22 HA LYS 22 9.599 -7.849 -3.295
162 HB2 LYS 22 2HB LYS 22 7.059 -8.503 -1.906
163 HB3 LYS 22 3HB LYS 22 8.685 -9.049 -1.602
164 HG2 LYS 22 2HG LYS 22 7.448 -6.401 -0.818
165 HG3 LYS 22 3HG LYS 22 7.770 -7.734 0.257
166 HD2 LYS 22 2HD LYS 22 9.909 -6.081 -1.123
167 HD3 LYS 22 3HD LYS 22 9.365 -5.902 0.550
168 HE2 LYS 22 2HE LYS 22 10.139 -8.232 1.014
169 HE3 LYS 22 3HE LYS 22 10.710 -8.352 -0.660
170 HZ1 LYS 22 3HZ LYS 22 11.710 -6.459 1.400
171 HZ2 LYS 22 1HZ LYS 22 12.548 -7.683 0.718
172 HZ3 LYS 22 2HZ LYS 22 12.134 -6.363 -0.168
173 H LYS 23 H LYS 23 7.308 -6.608 -5.212
174 HA LYS 23 HA LYS 23 6.408 -9.219 -6.354
175 HB2 LYS 23 2HB LYS 23 4.605 -7.823 -5.499
176 HB3 LYS 23 3HB LYS 23 5.128 -6.471 -6.502
177 HG2 LYS 23 2HG LYS 23 3.166 -7.591 -7.412
178 HG3 LYS 23 3HG LYS 23 4.525 -7.695 -8.534
179 HD2 LYS 23 2HD LYS 23 4.922 -10.041 -7.893
180 HD3 LYS 23 3HD LYS 23 3.666 -9.937 -6.639
181 HE2 LYS 23 2HE LYS 23 1.966 -9.489 -8.370
182 HE3 LYS 23 3HE LYS 23 3.210 -9.526 -9.629
183 HZ1 LYS 23 3HZ LYS 23 2.484 -11.838 -7.901
184 HZ2 LYS 23 1HZ LYS 23 2.028 -11.650 -9.454
185 HZ3 LYS 23 2HZ LYS 23 3.603 -11.863 -9.092
186 H CYS 24 HN CYS 24 7.397 -5.921 -7.529
187 HA CYS 24 HA CYS 24 8.200 -7.249 -10.055
188 HB2 CYS 24 2HB CYS 24 8.103 -5.273 -11.172
189 HB3 CYS 24 3HB CYS 24 6.675 -5.294 -10.145
190 H SER 25 H SER 25 9.710 -6.644 -7.213
191 HA SER 25 HA SER 25 11.798 -6.815 -6.479
192 HB2 SER 25 2HB SER 25 12.516 -7.933 -9.198
193 HB3 SER 25 3HB SER 25 13.461 -8.078 -7.710
194 HG SER 25 HG SER 25 10.851 -9.118 -8.190
195 H GLU 26 H GLU 26 11.033 -4.293 -7.903
196 HA GLU 26 HA GLU 26 13.761 -3.090 -8.180
197 HB2 GLU 26 2HB GLU 26 11.027 -1.936 -8.831
198 HB3 GLU 26 3HB GLU 26 12.577 -1.099 -8.993
199 HG2 GLU 26 2HG GLU 26 13.330 -2.947 -10.556
200 HG3 GLU 26 3HG GLU 26 11.683 -3.585 -10.505
201 H SER 27 H SER 27 13.344 -0.557 -7.240
202 HA SER 27 HA SER 27 12.752 -0.928 -4.332
203 HB2 SER 27 2HB SER 27 15.148 -0.882 -4.768
204 HB3 SER 27 3HB SER 27 14.950 0.738 -5.511
205 HG SER 27 HG SER 27 15.592 0.777 -3.286
206 H ILE 28 H ILE 28 12.063 0.896 -3.173
207 HA ILE 28 HA ILE 28 10.232 2.418 -4.942
208 HB ILE 28 HB ILE 28 9.784 1.788 -2.020
209 HG12 ILE 28 2HG1 ILE 28 8.536 0.291 -4.366
210 HG13 ILE 28 3HG1 ILE 28 9.937 -0.321 -3.491
211 HG21 ILE 28 1HG2 ILE 28 7.948 2.735 -4.286
212 HG22 ILE 28 2HG2 ILE 28 7.416 2.344 -2.653
213 HG23 ILE 28 3HG2 ILE 28 8.491 3.716 -2.916
214 HD11 ILE 28 3HD1 ILE 28 8.684 -0.308 -1.372
215 HD12 ILE 28 1HD1 ILE 28 7.215 0.179 -2.250
216 HD13 ILE 28 2HD1 ILE 28 7.988 -1.374 -2.599
217 HA PRO 29 HA PRO 29 12.644 5.936 -3.435
218 HB2 PRO 29 2HB PRO 29 11.719 7.890 -5.096
219 HB3 PRO 29 3HB PRO 29 12.771 6.562 -5.671
220 HG2 PRO 29 2HG PRO 29 9.743 6.731 -5.820
221 HG3 PRO 29 3HG PRO 29 10.893 6.327 -7.135
222 HD2 PRO 29 2HD PRO 29 9.597 4.413 -5.684
223 HD3 PRO 29 3HD PRO 29 11.272 4.173 -6.267
224 H LYS 30 H LYS 30 12.347 7.909 -2.287
225 HA LYS 30 HA LYS 30 9.955 8.165 -0.690
226 HB2 LYS 30 2HB LYS 30 10.951 10.085 0.318
227 HB3 LYS 30 3HB LYS 30 12.066 8.719 0.229
228 HG2 LYS 30 2HG LYS 30 13.127 9.728 -1.773
229 HG3 LYS 30 3HG LYS 30 12.059 11.142 -1.619
230 HD2 LYS 30 2HD LYS 30 13.064 11.771 0.498
231 HD3 LYS 30 3HD LYS 30 13.853 10.188 0.651
232 HE2 LYS 30 2HE LYS 30 15.592 11.538 -0.082
233 HE3 LYS 30 3HE LYS 30 15.034 10.648 -1.513
234 HZ1 LYS 30 3HZ LYS 30 13.822 12.660 -2.198
235 HZ2 LYS 30 1HZ LYS 30 14.314 13.467 -0.862
236 HZ3 LYS 30 2HZ LYS 30 15.399 13.023 -1.994
237 H ASP 31 H ASP 31 8.658 10.127 -0.518
238 HA ASP 31 HA ASP 31 6.987 11.354 -1.372
239 HB2 ASP 31 2HB ASP 31 8.914 12.899 -1.639
240 HB3 ASP 31 3HB ASP 31 9.041 12.418 -3.330
241 H SER 32 H SER 32 6.921 8.777 -2.218
242 HA SER 32 HA SER 32 5.338 8.949 -4.726
243 HB2 SER 32 2HB SER 32 5.962 6.722 -5.326
244 HB3 SER 32 3HB SER 32 7.462 7.627 -5.078
245 HG SER 32 HG SER 32 7.909 6.437 -3.354
246 H LEU 33 H LEU 33 3.693 7.041 -4.704
247 HA LEU 33 HA LEU 33 2.525 6.764 -1.973
248 HB2 LEU 33 2HB LEU 33 1.045 7.762 -3.711
249 HB3 LEU 33 3HB LEU 33 1.279 6.330 -4.714
250 HG LEU 33 HG LEU 33 0.248 4.947 -2.846
251 HD11 LEU 33 1HD1 LEU 33 -0.503 7.692 -1.759
252 HD12 LEU 33 2HD1 LEU 33 -1.188 6.146 -1.226
253 HD13 LEU 33 3HD1 LEU 33 0.521 6.487 -0.947
254 HD21 LEU 33 3HD2 LEU 33 -1.484 7.163 -4.000
255 HD22 LEU 33 1HD2 LEU 33 -1.024 5.665 -4.842
256 HD23 LEU 33 2HD2 LEU 33 -2.048 5.584 -3.398
257 H ARG 34 H ARG 34 2.746 4.827 -0.977
258 HA ARG 34 HA ARG 34 3.221 2.371 -2.584
259 HB2 ARG 34 2HB ARG 34 5.187 1.751 -1.360
260 HB3 ARG 34 3HB ARG 34 5.417 3.299 -2.172
261 HG2 ARG 34 2HG ARG 34 5.127 4.487 -0.005
262 HG3 ARG 34 3HG ARG 34 4.885 2.928 0.808
263 HD2 ARG 34 2HD ARG 34 7.132 2.180 0.004
264 HD3 ARG 34 3HD ARG 34 7.359 3.770 -0.749
265 HE ARG 34 HE ARG 34 6.804 3.908 2.129
266 HH11 ARG 34 1HH2 ARG 34 9.444 3.661 -0.206
267 HH12 ARG 34 2HH2 ARG 34 10.589 4.248 0.975
268 HH21 ARG 34 1HH1 ARG 34 8.257 4.513 3.481
269 HH22 ARG 34 2HH1 ARG 34 9.988 4.466 3.095
270 H MET 35 H MET 35 2.961 0.419 -1.492
271 HA MET 35 HA MET 35 1.201 0.517 0.897
272 HB2 MET 35 2HB MET 35 0.739 -0.956 -1.725
273 HB3 MET 35 3HB MET 35 -0.060 -1.423 -0.212
274 HG2 MET 35 2HG MET 35 -0.989 0.854 -0.011
275 HG3 MET 35 3HG MET 35 -0.269 1.272 -1.571
276 HE1 MET 35 3HE MET 35 -3.186 -0.263 0.380
277 HE2 MET 35 1HE MET 35 -4.035 -1.295 -0.792
278 HE3 MET 35 2HE MET 35 -2.454 -1.801 -0.141
279 H ALA 36 H ALA 36 1.026 -1.493 2.051
280 HA ALA 36 HA ALA 36 3.219 -3.389 1.617
281 HB1 ALA 36 1HB ALA 36 4.090 -3.167 3.891
282 HB2 ALA 36 2HB ALA 36 4.164 -1.619 3.033
283 HB3 ALA 36 3HB ALA 36 2.903 -1.885 4.231
284 H ILE 37 H ILE 37 3.084 -5.298 3.074
285 HA ILE 37 HA ILE 37 0.303 -5.853 4.033
286 HB ILE 37 HB ILE 37 2.006 -7.263 2.058
287 HG12 ILE 37 2HG1 ILE 37 -0.972 -7.406 2.682
288 HG13 ILE 37 3HG1 ILE 37 -0.235 -6.099 1.755
289 HG21 ILE 37 1HG2 ILE 37 0.473 -8.926 4.086
290 HG22 ILE 37 2HG2 ILE 37 1.215 -9.500 2.560
291 HG23 ILE 37 3HG2 ILE 37 2.241 -8.899 3.851
292 HD11 ILE 37 3HD1 ILE 37 -0.297 -9.027 0.951
293 HD12 ILE 37 1HD1 ILE 37 -1.171 -7.675 0.202
294 HD13 ILE 37 2HD1 ILE 37 0.599 -7.759 0.085
295 H MET 38 H MET 38 0.054 -6.836 5.918
296 HA MET 38 HA MET 38 2.451 -7.118 7.615
297 HB2 MET 38 2HB MET 38 0.135 -5.916 8.196
298 HB3 MET 38 3HB MET 38 -0.373 -7.565 8.544
299 HG2 MET 38 2HG MET 38 0.318 -6.925 10.604
300 HG3 MET 38 3HG MET 38 1.830 -7.615 10.015
301 HE1 MET 38 3HE MET 38 3.954 -4.404 9.236
302 HE2 MET 38 1HE MET 38 3.807 -6.175 9.122
303 HE3 MET 38 2HE MET 38 2.859 -5.130 8.032
304 H VAL 39 H VAL 39 3.507 -8.950 7.681
305 HA VAL 39 HA VAL 39 1.931 -11.482 7.904
306 HB VAL 39 HB VAL 39 2.706 -11.299 5.608
307 HG11 VAL 39 1HG1 VAL 39 5.047 -11.440 4.996
308 HG12 VAL 39 2HG1 VAL 39 4.762 -9.958 5.917
309 HG13 VAL 39 3HG1 VAL 39 5.549 -11.347 6.695
310 HG21 VAL 39 3HG2 VAL 39 3.685 -13.468 5.362
311 HG22 VAL 39 1HG2 VAL 39 4.234 -13.488 7.044
312 HG23 VAL 39 2HG2 VAL 39 2.492 -13.523 6.666
313 H GLN 40 H GLN 40 2.681 -13.032 9.215
314 HA GLN 40 HA GLN 40 4.516 -12.290 11.341
315 HB2 GLN 40 2HB GLN 40 4.086 -14.766 11.988
316 HB3 GLN 40 3HB GLN 40 2.813 -13.566 12.171
317 HG2 GLN 40 2HG GLN 40 1.654 -14.302 10.196
318 HG3 GLN 40 3HG GLN 40 2.991 -15.361 9.720
319 HE21 GLN 40 2HE2 GLN 40 3.410 -17.316 11.106
320 HE22 GLN 40 1HE2 GLN 40 2.075 -17.958 12.051
321 H SER 41 H SER 41 6.616 -12.663 11.546
322 HA SER 41 HA SER 41 8.009 -13.634 9.191
323 HB2 SER 41 2HB SER 41 9.996 -12.572 10.494
324 HB3 SER 41 3HB SER 41 8.737 -11.534 9.822
325 HG SER 41 HG SER 41 8.891 -12.447 12.516
326 HA PRO 42 HA PRO 42 9.814 -17.131 11.276
327 HB2 PRO 42 2HB PRO 42 11.398 -18.111 9.284
328 HB3 PRO 42 3HB PRO 42 9.610 -18.221 9.235
329 HG2 PRO 42 2HG PRO 42 11.389 -16.161 7.899
330 HG3 PRO 42 3HG PRO 42 10.036 -17.087 7.178
331 HD2 PRO 42 2HD PRO 42 9.743 -14.524 8.170
332 HD3 PRO 42 3HD PRO 42 8.424 -15.724 8.218
333 H MET 43 H MET 43 11.565 -14.441 9.878
334 HA MET 43 HA MET 43 14.104 -15.111 11.228
335 HB2 MET 43 2HB MET 43 15.125 -13.440 9.874
336 HB3 MET 43 3HB MET 43 14.143 -14.510 8.896
337 HG2 MET 43 2HG MET 43 12.293 -12.575 9.304
338 HG3 MET 43 3HG MET 43 13.728 -11.607 9.618
339 HE1 MET 43 3HE MET 43 12.975 -14.578 7.136
340 HE2 MET 43 1HE MET 43 11.538 -13.541 7.123
341 HE3 MET 43 2HE MET 43 12.544 -13.681 5.659
342 H PHE 44 H PHE 44 11.374 -13.273 12.002
343 HA PHE 44 HA PHE 44 12.814 -11.651 14.019
344 HB2 PHE 44 2HB PHE 44 12.595 -10.144 12.187
345 HB3 PHE 44 3HB PHE 44 10.927 -10.580 11.909
346 HD1 PHE 44 HD1 PHE 44 13.220 -8.892 14.332
347 HD2 PHE 44 HD2 PHE 44 9.134 -9.474 13.073
348 HE1 PHE 44 HE1 PHE 44 12.483 -7.082 15.868
349 HE2 PHE 44 HE2 PHE 44 8.405 -7.657 14.596
350 HZ PHE 44 HZ PHE 44 10.077 -6.464 16.003
351 H ASP 45 H ASP 45 11.413 -10.810 15.712
352 HA ASP 45 HA ASP 45 9.747 -13.065 16.617
353 HB2 ASP 45 2HB ASP 45 11.746 -12.349 17.880
354 HB3 ASP 45 3HB ASP 45 10.994 -10.782 18.177
355 H GLY 46 H GLY 46 8.201 -11.930 14.893
356 HA2 GLY 46 2HA GLY 46 5.771 -11.267 16.074
357 HA3 GLY 46 3HA GLY 46 6.578 -9.711 15.845
358 H LYS 47 H LYS 47 5.655 -8.771 14.145
359 HA LYS 47 HA LYS 47 5.436 -10.272 11.583
360 HB2 LYS 47 2HB LYS 47 3.396 -8.210 12.473
361 HB3 LYS 47 3HB LYS 47 3.348 -9.253 11.056
362 HG2 LYS 47 2HG LYS 47 3.526 -11.157 13.025
363 HG3 LYS 47 3HG LYS 47 2.733 -9.881 13.936
364 HD2 LYS 47 2HD LYS 47 1.834 -11.180 11.345
365 HD3 LYS 47 3HD LYS 47 1.175 -11.514 12.946
366 HE2 LYS 47 2HE LYS 47 1.024 -8.837 11.502
367 HE3 LYS 47 3HE LYS 47 -0.255 -10.057 11.484
368 HZ1 LYS 47 3HZ LYS 47 0.737 -8.666 13.934
369 HZ2 LYS 47 1HZ LYS 47 -0.641 -8.316 13.169
370 HZ3 LYS 47 2HZ LYS 47 -0.473 -9.782 13.896
371 H VAL 48 H VAL 48 5.610 -9.130 9.702
372 HA VAL 48 HA VAL 48 7.202 -6.611 9.881
373 HB VAL 48 HB VAL 48 8.727 -7.566 8.195
374 HG11 VAL 48 1HG1 VAL 48 8.548 -9.243 10.738
375 HG12 VAL 48 2HG1 VAL 48 9.988 -8.985 9.741
376 HG13 VAL 48 3HG1 VAL 48 9.272 -7.629 10.627
377 HG21 VAL 48 3HG2 VAL 48 7.311 -9.320 7.196
378 HG22 VAL 48 1HG2 VAL 48 8.813 -10.006 7.829
379 HG23 VAL 48 2HG2 VAL 48 7.293 -10.207 8.727
380 HA PRO 49 HA PRO 49 4.669 -5.474 6.413
381 HB2 PRO 49 2HB PRO 49 5.751 -3.081 5.693
382 HB3 PRO 49 3HB PRO 49 4.914 -3.325 7.255
383 HG2 PRO 49 2HG PRO 49 7.897 -3.365 6.705
384 HG3 PRO 49 3HG PRO 49 7.022 -2.532 8.025
385 HD2 PRO 49 2HD PRO 49 8.235 -5.000 8.313
386 HD3 PRO 49 3HD PRO 49 6.790 -4.503 9.244
387 H HIS 50 H HIS 50 4.658 -6.337 4.400
388 HA HIS 50 HA HIS 50 7.150 -6.470 2.747
389 HB2 HIS 50 2HB HIS 50 4.440 -7.831 2.597
390 HB3 HIS 50 3HB HIS 50 5.558 -7.811 1.237
391 HD2 HIS 50 HD2 HIS 50 7.048 -8.168 4.722
392 HE1 HIS 50 HE1 HIS 50 7.270 -12.029 2.924
393 HE2 HIS 50 HE2 HIS 50 8.034 -10.619 4.904
394 H TRP 51 H TRP 51 7.522 -4.495 1.931
395 HA TRP 51 HA TRP 51 5.394 -2.715 1.111
396 HB2 TRP 51 2HB TRP 51 8.412 -2.572 0.869
397 HB3 TRP 51 3HB TRP 51 7.312 -1.299 0.358
398 HD1 TRP 51 HD1 TRP 51 8.974 -2.672 3.428
399 HE1 TRP 51 HE1 TRP 51 8.425 -1.193 5.456
400 HE3 TRP 51 HE3 TRP 51 5.310 0.223 1.338
401 HZ2 TRP 51 HZ2 TRP 51 6.554 0.910 6.116
402 HZ3 TRP 51 HZ3 TRP 51 4.076 1.869 2.719
403 HH2 TRP 51 HH2 TRP 51 4.721 2.259 5.095
404 H TYR 52 H TYR 52 4.811 -2.033 -0.915
405 HA TYR 52 HA TYR 52 6.282 -2.924 -3.296
406 HB2 TYR 52 2HB TYR 52 3.305 -3.282 -3.356
407 HB3 TYR 52 3HB TYR 52 4.577 -3.973 -4.372
408 HD1 TYR 52 HD1 TYR 52 2.891 -4.327 -1.043
409 HD2 TYR 52 HD2 TYR 52 5.443 -6.076 -4.028
410 HE1 TYR 52 HE1 TYR 52 2.598 -6.573 0.023
411 HE2 TYR 52 HE2 TYR 52 5.105 -8.331 -2.997
412 HH TYR 52 HH TYR 52 3.105 -8.807 -0.076
413 H HIS 53 H HIS 53 5.695 -1.630 -5.190
414 HA HIS 53 HA HIS 53 4.953 1.139 -4.772
415 HB2 HIS 53 2HB HIS 53 4.540 -0.517 -7.293
416 HB3 HIS 53 3HB HIS 53 4.528 1.222 -7.185
417 HD2 HIS 53 HD2 HIS 53 6.911 2.457 -6.547
418 HE1 HIS 53 HE1 HIS 53 9.337 -0.630 -8.189
419 HE2 HIS 53 HE2 HIS 53 9.307 1.785 -7.411
420 H PHE 54 H PHE 54 2.869 2.206 -5.268
421 HA PHE 54 HA PHE 54 0.653 1.097 -4.036
422 HB2 PHE 54 2HB PHE 54 0.677 3.433 -4.520
423 HB3 PHE 54 3HB PHE 54 0.804 3.155 -6.256
424 HD1 PHE 54 HD1 PHE 54 -1.493 2.230 -3.404
425 HD2 PHE 54 HD2 PHE 54 -1.152 3.364 -7.551
426 HE1 PHE 54 HE1 PHE 54 -3.953 2.022 -3.671
427 HE2 PHE 54 HE2 PHE 54 -3.627 3.246 -7.776
428 HZ PHE 54 HZ PHE 54 -5.017 2.547 -5.848
429 H SER 55 H SER 55 1.341 0.895 -7.583
430 HA SER 55 HA SER 55 -1.123 -0.468 -8.195
431 HB2 SER 55 2HB SER 55 1.418 -0.289 -9.844
432 HB3 SER 55 3HB SER 55 -0.216 -0.671 -10.425
433 HG SER 55 HG SER 55 0.330 1.552 -10.754
434 H CYS 56 HN CYS 56 2.150 -1.529 -7.344
435 HA CYS 56 HA CYS 56 1.952 -4.142 -8.364
436 HB2 CYS 56 2HB CYS 56 3.755 -2.886 -6.285
437 HB3 CYS 56 3HB CYS 56 3.968 -4.526 -6.895
438 H PHE 57 H PHE 57 1.127 -2.850 -5.167
439 HA PHE 57 HA PHE 57 0.645 -5.142 -3.604
440 HB2 PHE 57 2HB PHE 57 0.437 -2.921 -2.752
441 HB3 PHE 57 3HB PHE 57 -0.876 -2.536 -3.859
442 HD1 PHE 57 HD1 PHE 57 -3.111 -3.681 -3.617
443 HD2 PHE 57 HD2 PHE 57 -0.029 -3.991 -0.620
444 HE1 PHE 57 HE1 PHE 57 -4.784 -4.507 -2.000
445 HE2 PHE 57 HE2 PHE 57 -1.742 -4.691 1.040
446 HZ PHE 57 HZ PHE 57 -4.110 -4.995 0.342
447 H TRP 58 H TRP 58 -1.492 -3.662 -6.074
448 HA TRP 58 HA TRP 58 -3.588 -5.623 -5.735
449 HB2 TRP 58 2HB TRP 58 -3.140 -3.654 -7.981
450 HB3 TRP 58 3HB TRP 58 -4.648 -4.447 -7.554
451 HD1 TRP 58 HD1 TRP 58 -2.477 -1.528 -6.825
452 HE1 TRP 58 HE1 TRP 58 -3.381 -0.017 -4.984
453 HE3 TRP 58 HE3 TRP 58 -6.359 -4.485 -5.190
454 HZ2 TRP 58 HZ2 TRP 58 -5.538 -0.065 -3.041
455 HZ3 TRP 58 HZ3 TRP 58 -7.804 -3.705 -3.362
456 HH2 TRP 58 HH2 TRP 58 -7.381 -1.504 -2.271
457 H LYS 59 H LYS 59 -0.703 -5.514 -7.747
458 HA LYS 59 HA LYS 59 -1.427 -7.683 -9.546
459 HB2 LYS 59 2HB LYS 59 1.343 -6.835 -8.672
460 HB3 LYS 59 3HB LYS 59 0.942 -7.884 -10.025
461 HG2 LYS 59 2HG LYS 59 -0.155 -6.077 -11.218
462 HG3 LYS 59 3HG LYS 59 -0.013 -5.017 -9.810
463 HD2 LYS 59 2HD LYS 59 2.564 -5.418 -10.002
464 HD3 LYS 59 3HD LYS 59 2.204 -5.985 -11.646
465 HE2 LYS 59 2HE LYS 59 1.221 -3.897 -12.254
466 HE3 LYS 59 3HE LYS 59 1.023 -3.412 -10.569
467 HZ1 LYS 59 3HZ LYS 59 2.861 -2.258 -11.652
468 HZ2 LYS 59 1HZ LYS 59 3.413 -3.135 -10.366
469 HZ3 LYS 59 2HZ LYS 59 3.663 -3.664 -11.903
470 H VAL 60 H VAL 60 -0.211 -7.510 -6.203
471 HA VAL 60 HA VAL 60 0.393 -10.355 -5.999
472 HB VAL 60 HB VAL 60 -0.412 -8.626 -3.651
473 HG11 VAL 60 1HG1 VAL 60 1.542 -10.957 -3.925
474 HG12 VAL 60 2HG1 VAL 60 1.211 -10.049 -2.435
475 HG13 VAL 60 3HG1 VAL 60 -0.053 -11.037 -3.153
476 HG21 VAL 60 3HG2 VAL 60 1.997 -8.094 -3.362
477 HG22 VAL 60 1HG2 VAL 60 2.328 -8.774 -4.971
478 HG23 VAL 60 2HG2 VAL 60 1.308 -7.331 -4.771
479 H GLY 61 H GLY 61 -2.598 -8.664 -6.234
480 HA2 GLY 61 2HA GLY 61 -4.650 -9.607 -6.650
481 HA3 GLY 61 3HA GLY 61 -4.043 -11.190 -6.172
482 H HIS 62 H HIS 62 -3.628 -8.661 -3.819
483 HA HIS 62 HA HIS 62 -5.638 -9.849 -2.024
484 HB2 HIS 62 2HB HIS 62 -3.575 -7.654 -1.691
485 HB3 HIS 62 3HB HIS 62 -4.807 -7.993 -0.480
486 HD2 HIS 62 HD2 HIS 62 -1.719 -9.632 -2.109
487 HE1 HIS 62 HE1 HIS 62 -2.709 -12.004 1.291
488 HE2 HIS 62 HE2 HIS 62 -1.001 -11.646 -0.565
489 H SER 63 H SER 63 -7.366 -8.783 -1.094
490 HA SER 63 HA SER 63 -8.541 -6.493 -2.620
491 HB2 SER 63 2HB SER 63 -9.931 -9.078 -1.812
492 HB3 SER 63 3HB SER 63 -10.733 -7.645 -2.483
493 HG SER 63 HG SER 63 -10.241 -9.234 -4.087
494 H ILE 64 H ILE 64 -10.046 -5.224 -1.536
495 HA ILE 64 HA ILE 64 -9.838 -5.266 1.438
496 HB ILE 64 HB ILE 64 -9.380 -2.753 -0.174
497 HG12 ILE 64 2HG1 ILE 64 -7.216 -4.763 0.504
498 HG13 ILE 64 3HG1 ILE 64 -7.643 -4.103 -1.065
499 HG21 ILE 64 1HG2 ILE 64 -8.534 -3.627 2.618
500 HG22 ILE 64 2HG2 ILE 64 -8.275 -2.029 1.908
501 HG23 ILE 64 3HG2 ILE 64 -9.921 -2.583 2.238
502 HD11 ILE 64 3HD1 ILE 64 -5.697 -2.952 -0.510
503 HD12 ILE 64 1HD1 ILE 64 -6.966 -1.795 -0.090
504 HD13 ILE 64 2HD1 ILE 64 -6.161 -2.753 1.179
505 H ARG 65 H ARG 65 -11.603 -4.500 2.482
506 HA ARG 65 HA ARG 65 -13.983 -3.705 0.821
507 HB2 ARG 65 2HB ARG 65 -15.303 -5.176 2.485
508 HB3 ARG 65 3HB ARG 65 -14.488 -5.924 1.131
509 HG2 ARG 65 2HG ARG 65 -13.069 -5.784 3.801
510 HG3 ARG 65 3HG ARG 65 -14.336 -6.967 3.566
511 HD2 ARG 65 2HD ARG 65 -13.127 -8.254 2.156
512 HD3 ARG 65 3HD ARG 65 -12.372 -6.889 1.333
513 HE ARG 65 HE ARG 65 -11.086 -6.761 3.718
514 HH11 ARG 65 1HH2 ARG 65 -11.517 -9.530 1.575
515 HH12 ARG 65 2HH2 ARG 65 -10.010 -10.231 2.099
516 HH21 ARG 65 1HH1 ARG 65 -9.345 -7.656 4.310
517 HH22 ARG 65 2HH1 ARG 65 -8.761 -9.188 3.644
518 H HIS 66 H HIS 66 -12.249 -3.209 3.777
519 HA HIS 66 HA HIS 66 -13.783 -0.713 4.085
520 HB2 HIS 66 2HB HIS 66 -13.833 -0.829 6.520
521 HB3 HIS 66 3HB HIS 66 -14.921 -1.931 5.708
522 HD2 HIS 66 HD2 HIS 66 -12.985 -4.491 5.394
523 HE1 HIS 66 HE1 HIS 66 -13.015 -4.459 9.622
524 HE2 HIS 66 HE2 HIS 66 -12.559 -5.872 7.571
525 HA PRO 67 HA PRO 67 -9.266 -0.730 3.584
526 HB2 PRO 67 2HB PRO 67 -9.007 1.485 1.888
527 HB3 PRO 67 3HB PRO 67 -9.384 -0.166 1.327
528 HG2 PRO 67 2HG PRO 67 -11.331 2.049 1.987
529 HG3 PRO 67 3HG PRO 67 -11.276 1.028 0.503
530 HD2 PRO 67 2HD PRO 67 -12.974 0.441 2.477
531 HD3 PRO 67 3HD PRO 67 -12.029 -0.885 1.729
532 H ASP 68 H ASP 68 -11.181 2.129 4.538
533 HA ASP 68 HA ASP 68 -8.878 3.493 5.652
534 HB2 ASP 68 2HB ASP 68 -10.591 4.996 6.669
535 HB3 ASP 68 3HB ASP 68 -10.691 4.829 4.923
536 H VAL 69 H VAL 69 -10.515 0.752 6.654
537 HA VAL 69 HA VAL 69 -9.573 1.014 9.461
538 HB VAL 69 HB VAL 69 -11.295 -1.190 8.290
539 HG11 VAL 69 1HG1 VAL 69 -11.870 -1.625 10.651
540 HG12 VAL 69 2HG1 VAL 69 -10.141 -1.811 10.364
541 HG13 VAL 69 3HG1 VAL 69 -10.749 -0.342 11.164
542 HG21 VAL 69 3HG2 VAL 69 -12.192 1.319 9.766
543 HG22 VAL 69 1HG2 VAL 69 -12.592 0.861 8.091
544 HG23 VAL 69 2HG2 VAL 69 -13.219 -0.096 9.430
545 H GLU 70 H GLU 70 -9.384 -1.066 6.559
546 HA GLU 70 HA GLU 70 -7.503 -2.935 7.825
547 HB2 GLU 70 2HB GLU 70 -8.455 -2.683 4.926
548 HB3 GLU 70 3HB GLU 70 -7.547 -4.043 5.588
549 HG2 GLU 70 2HG GLU 70 -9.418 -4.603 7.084
550 HG3 GLU 70 3HG GLU 70 -10.349 -3.250 6.449
551 H VAL 71 H VAL 71 -7.149 -0.251 5.606
552 HA VAL 71 HA VAL 71 -4.228 -0.752 5.129
553 HB VAL 71 HB VAL 71 -5.953 1.374 3.878
554 HG11 VAL 71 1HG1 VAL 71 -3.302 0.053 3.181
555 HG12 VAL 71 2HG1 VAL 71 -4.103 1.424 2.361
556 HG13 VAL 71 3HG1 VAL 71 -3.474 1.609 4.023
557 HG21 VAL 71 3HG2 VAL 71 -6.861 -0.829 3.215
558 HG22 VAL 71 1HG2 VAL 71 -5.916 -0.142 1.887
559 HG23 VAL 71 2HG2 VAL 71 -5.224 -1.431 2.908
560 H ASP 72 H ASP 72 -3.387 -0.388 7.056
561 HA ASP 72 HA ASP 72 -3.835 1.956 8.673
562 HB2 ASP 72 2HB ASP 72 -2.953 -0.109 9.523
563 HB3 ASP 72 3HB ASP 72 -1.572 -0.050 8.422
564 H GLY 73 H GLY 73 -2.876 3.937 8.616
565 HA2 GLY 73 2HA GLY 73 -1.358 5.637 8.006
566 HA3 GLY 73 3HA GLY 73 -0.629 4.567 6.811
567 H PHE 74 H PHE 74 -3.825 4.279 6.110
568 HA PHE 74 HA PHE 74 -3.986 5.982 3.828
569 HB2 PHE 74 2HB PHE 74 -5.381 4.001 4.268
570 HB3 PHE 74 3HB PHE 74 -6.081 4.758 5.687
571 HD1 PHE 74 HD2 PHE 74 -6.104 4.618 2.002
572 HD2 PHE 74 HD1 PHE 74 -7.837 6.454 5.500
573 HE1 PHE 74 HE2 PHE 74 -8.042 5.395 0.649
574 HE2 PHE 74 HE1 PHE 74 -9.763 7.233 4.132
575 HZ PHE 74 HZ PHE 74 -9.865 6.695 1.715
576 H SER 75 H SER 75 -4.499 6.757 7.229
577 HA SER 75 HA SER 75 -5.815 9.299 6.928
578 HB2 SER 75 2HB SER 75 -4.812 9.669 9.231
579 HB3 SER 75 3HB SER 75 -5.847 8.237 9.053
580 HG SER 75 HG SER 75 -3.872 7.784 10.172
581 H GLU 76 H GLU 76 -2.447 8.336 6.452
582 HA GLU 76 HA GLU 76 -1.344 11.019 6.771
583 HB2 GLU 76 2HB GLU 76 -0.114 8.543 5.493
584 HB3 GLU 76 3HB GLU 76 0.730 10.012 5.963
585 HG2 GLU 76 2HG GLU 76 0.261 9.602 8.330
586 HG3 GLU 76 3HG GLU 76 -0.719 8.187 7.933
587 H LEU 77 H LEU 77 -2.803 9.248 4.173
588 HA LEU 77 HA LEU 77 -1.738 10.734 1.912
589 HB2 LEU 77 2HB LEU 77 -4.157 8.952 2.358
590 HB3 LEU 77 3HB LEU 77 -3.866 9.747 0.830
591 HG LEU 77 HG LEU 77 -1.975 8.470 0.330
592 HD11 LEU 77 1HD1 LEU 77 -2.015 7.262 3.102
593 HD12 LEU 77 2HD1 LEU 77 -0.994 6.739 1.739
594 HD13 LEU 77 3HD1 LEU 77 -0.769 8.343 2.430
595 HD21 LEU 77 3HD2 LEU 77 -4.145 7.400 -0.014
596 HD22 LEU 77 1HD2 LEU 77 -2.907 6.194 0.367
597 HD23 LEU 77 2HD2 LEU 77 -4.071 6.687 1.610
598 H ARG 78 H ARG 78 -3.078 12.146 0.551
599 HA ARG 78 HA ARG 78 -5.234 13.664 1.974
600 HB2 ARG 78 2HB ARG 78 -3.386 14.508 -0.297
601 HB3 ARG 78 3HB ARG 78 -4.841 15.394 0.119
602 HG2 ARG 78 2HG ARG 78 -2.431 14.974 1.934
603 HG3 ARG 78 3HG ARG 78 -2.948 16.458 1.138
604 HD2 ARG 78 2HD ARG 78 -3.809 16.855 3.219
605 HD3 ARG 78 3HD ARG 78 -5.213 16.051 2.473
606 HE ARG 78 HE ARG 78 -3.938 13.929 3.564
607 HH11 ARG 78 1HH2 ARG 78 -4.748 16.959 5.133
608 HH12 ARG 78 2HH2 ARG 78 -4.941 16.180 6.680
609 HH21 ARG 78 1HH1 ARG 78 -4.235 13.019 5.471
610 HH22 ARG 78 2HH1 ARG 78 -4.624 13.979 6.871
611 H TRP 79 H TRP 79 -6.865 14.565 0.570
612 HA TRP 79 HA TRP 79 -8.564 12.497 0.286
613 HB2 TRP 79 2HB TRP 79 -9.859 14.271 0.507
614 HB3 TRP 79 3HB TRP 79 -8.654 15.354 -0.150
615 HD1 TRP 79 HD1 TRP 79 -11.826 13.527 -1.116
616 HE1 TRP 79 HE1 TRP 79 -12.602 14.295 -3.442
617 HE3 TRP 79 HE3 TRP 79 -7.704 16.215 -2.483
618 HZ2 TRP 79 HZ2 TRP 79 -11.592 15.962 -5.590
619 HZ3 TRP 79 HZ3 TRP 79 -7.616 17.378 -4.669
620 HH2 TRP 79 HH2 TRP 79 -9.554 17.261 -6.236
621 H ASP 80 H ASP 80 -6.727 13.877 -2.455
622 HA ASP 80 HA ASP 80 -8.218 12.484 -4.448
623 HB2 ASP 80 2HB ASP 80 -6.901 14.561 -4.839
624 HB3 ASP 80 3HB ASP 80 -5.420 13.608 -4.701
625 H ASP 81 H ASP 81 -5.505 11.441 -2.481
626 HA ASP 81 HA ASP 81 -4.993 9.057 -4.167
627 HB2 ASP 81 2HB ASP 81 -3.643 10.115 -1.662
628 HB3 ASP 81 3HB ASP 81 -3.291 8.546 -2.391
629 H GLN 82 H GLN 82 -6.364 10.034 -0.993
630 HA GLN 82 HA GLN 82 -7.160 7.478 -0.084
631 HB2 GLN 82 2HB GLN 82 -8.371 10.248 0.209
632 HB3 GLN 82 3HB GLN 82 -9.063 8.839 1.008
633 HG2 GLN 82 2HG GLN 82 -6.957 8.400 2.179
634 HG3 GLN 82 3HG GLN 82 -6.187 9.763 1.366
635 HE21 GLN 82 2HE2 GLN 82 -6.296 9.523 4.195
636 HE22 GLN 82 1HE2 GLN 82 -7.282 10.870 4.772
637 H GLN 83 H GLN 83 -9.088 9.766 -2.165
638 HA GLN 83 HA GLN 83 -11.200 7.892 -2.515
639 HB2 GLN 83 2HB GLN 83 -12.134 9.361 -4.087
640 HB3 GLN 83 3HB GLN 83 -11.375 10.351 -2.843
641 HG2 GLN 83 2HG GLN 83 -9.416 10.670 -4.403
642 HG3 GLN 83 3HG GLN 83 -10.296 9.803 -5.652
643 HE21 GLN 83 2HE2 GLN 83 -9.478 12.435 -6.257
644 HE22 GLN 83 1HE2 GLN 83 -10.911 13.443 -6.220
645 H LYS 84 H LYS 84 -8.110 8.056 -4.197
646 HA LYS 84 HA LYS 84 -8.958 6.399 -6.459
647 HB2 LYS 84 2HB LYS 84 -7.482 8.224 -6.849
648 HB3 LYS 84 3HB LYS 84 -6.411 7.767 -5.538
649 HG2 LYS 84 2HG LYS 84 -6.780 5.914 -7.893
650 HG3 LYS 84 3HG LYS 84 -5.767 7.344 -8.050
651 HD2 LYS 84 2HD LYS 84 -5.399 5.127 -6.015
652 HD3 LYS 84 3HD LYS 84 -4.431 5.388 -7.469
653 HE2 LYS 84 2HE LYS 84 -4.551 7.124 -4.973
654 HE3 LYS 84 3HE LYS 84 -3.232 6.073 -5.465
655 HZ1 LYS 84 3HZ LYS 84 -4.104 8.440 -7.040
656 HZ2 LYS 84 1HZ LYS 84 -2.871 8.459 -5.980
657 HZ3 LYS 84 2HZ LYS 84 -2.780 7.517 -7.328
658 H VAL 85 H VAL 85 -7.097 6.047 -3.407
659 HA VAL 85 HA VAL 85 -6.541 3.206 -3.781
660 HB VAL 85 HB VAL 85 -6.836 4.902 -1.263
661 HG11 VAL 85 1HG1 VAL 85 -5.634 3.071 -0.059
662 HG12 VAL 85 2HG1 VAL 85 -7.242 2.580 -0.588
663 HG13 VAL 85 3HG1 VAL 85 -5.806 2.034 -1.486
664 HG21 VAL 85 3HG2 VAL 85 -4.258 3.734 -2.355
665 HG22 VAL 85 1HG2 VAL 85 -4.829 5.333 -2.838
666 HG23 VAL 85 2HG2 VAL 85 -4.480 4.989 -1.138
667 H LYS 86 H LYS 86 -9.286 4.936 -2.177
668 HA LYS 86 HA LYS 86 -10.746 2.493 -1.674
669 HB2 LYS 86 2HB LYS 86 -11.740 5.371 -1.845
670 HB3 LYS 86 3HB LYS 86 -12.700 3.976 -1.329
671 HG2 LYS 86 2HG LYS 86 -10.805 3.532 0.394
672 HG3 LYS 86 3HG LYS 86 -10.229 5.131 0.014
673 HD2 LYS 86 2HD LYS 86 -11.531 5.165 2.053
674 HD3 LYS 86 3HD LYS 86 -12.360 6.122 0.807
675 HE2 LYS 86 2HE LYS 86 -13.958 4.370 0.437
676 HE3 LYS 86 3HE LYS 86 -12.990 3.208 1.360
677 HZ1 LYS 86 3HZ LYS 86 -14.244 5.592 2.605
678 HZ2 LYS 86 1HZ LYS 86 -14.933 4.112 2.601
679 HZ3 LYS 86 2HZ LYS 86 -13.528 4.328 3.387
680 H LYS 87 H LYS 87 -10.862 4.724 -4.488
681 HA LYS 87 HA LYS 87 -12.817 3.275 -5.975
682 HB2 LYS 87 2HB LYS 87 -11.966 5.506 -6.631
683 HB3 LYS 87 3HB LYS 87 -10.378 4.812 -6.961
684 HG2 LYS 87 2HG LYS 87 -11.507 5.202 -9.031
685 HG3 LYS 87 3HG LYS 87 -11.369 3.459 -8.810
686 HD2 LYS 87 2HD LYS 87 -13.734 3.371 -8.043
687 HD3 LYS 87 3HD LYS 87 -13.839 5.141 -8.200
688 HE2 LYS 87 2HE LYS 87 -13.343 4.937 -10.633
689 HE3 LYS 87 3HE LYS 87 -13.242 3.179 -10.466
690 HZ1 LYS 87 3HZ LYS 87 -15.679 4.802 -9.943
691 HZ2 LYS 87 1HZ LYS 87 -15.432 3.872 -11.259
692 HZ3 LYS 87 2HZ LYS 87 -15.588 3.176 -9.792
693 H THR 88 H THR 88 -9.261 2.792 -5.875
694 HA THR 88 HA THR 88 -9.243 0.604 -7.669
695 HB THR 88 HB THR 88 -7.175 1.203 -5.544
696 HG1 THR 88 1HG THR 88 -7.480 2.981 -6.855
697 HG21 THR 88 1HG2 THR 88 -7.081 -0.265 -8.223
698 HG22 THR 88 2HG2 THR 88 -5.658 0.171 -7.249
699 HG23 THR 88 3HG2 THR 88 -6.839 -0.984 -6.616
700 H ALA 89 H ALA 89 -9.766 0.663 -4.138
701 HA ALA 89 HA ALA 89 -9.671 -2.205 -3.778
702 HB1 ALA 89 1HB ALA 89 -10.703 -1.652 -1.617
703 HB2 ALA 89 2HB ALA 89 -9.326 -0.576 -1.950
704 HB3 ALA 89 3HB ALA 89 -10.990 0.012 -2.148
705 H GLU 90 H GLU 90 -12.286 0.183 -4.426
706 HA GLU 90 HA GLU 90 -14.399 -1.762 -4.462
707 HB2 GLU 90 2HB GLU 90 -14.126 1.043 -5.599
708 HB3 GLU 90 3HB GLU 90 -15.604 0.108 -5.786
709 HG2 GLU 90 2HG GLU 90 -14.383 0.692 -3.060
710 HG3 GLU 90 3HG GLU 90 -15.534 1.758 -3.856
711 H ALA 91 H ALA 91 -12.215 -0.579 -6.941
712 HA ALA 91 HA ALA 91 -13.421 -1.940 -9.174
713 HB1 ALA 91 1HB ALA 91 -10.669 -0.695 -8.725
714 HB2 ALA 91 2HB ALA 91 -11.346 -1.154 -10.305
715 HB3 ALA 91 3HB ALA 91 -12.100 0.138 -9.346
716 H GLY 92 H GLY 92 -11.720 -3.261 -6.557
717 HA2 GLY 92 2HA GLY 92 -10.885 -5.362 -6.161
718 HA3 GLY 92 3HA GLY 92 -11.415 -5.865 -7.773
719 H GLY 93 H GLY 93 -9.202 -3.161 -7.288
720 HA2 GLY 93 2HA GLY 93 -6.883 -3.097 -7.253
721 HA3 GLY 93 3HA GLY 93 -6.783 -4.771 -7.777
722 H VAL 94 H VAL 94 -5.539 -2.170 -8.661
723 HA VAL 94 HA VAL 94 -6.190 -2.062 -11.534
724 HB VAL 94 HB VAL 94 -5.452 -0.011 -10.470
725 HG11 VAL 94 1HG1 VAL 94 -2.749 -1.352 -10.033
726 HG12 VAL 94 2HG1 VAL 94 -3.134 0.360 -9.770
727 HG13 VAL 94 3HG1 VAL 94 -3.897 -0.873 -8.764
728 HG21 VAL 94 3HG2 VAL 94 -4.966 -0.395 -12.893
729 HG22 VAL 94 1HG2 VAL 94 -3.823 0.701 -12.101
730 HG23 VAL 94 2HG2 VAL 94 -3.337 -0.961 -12.470
731 H THR 95 H THR 95 -4.990 -2.922 -13.170
732 HA THR 95 HA THR 95 -2.536 -4.458 -12.554
733 HB THR 95 HB THR 95 -3.182 -6.282 -14.041
734 HG1 THR 95 1HG THR 95 -5.342 -6.468 -14.691
735 HG21 THR 95 1HG2 THR 95 -3.657 -6.463 -11.582
736 HG22 THR 95 2HG2 THR 95 -5.303 -5.880 -11.873
737 HG23 THR 95 3HG2 THR 95 -4.766 -7.424 -12.577
738 H GLY 96 H GLY 96 -1.079 -4.602 -14.365
739 HA2 GLY 96 2HA GLY 96 -0.212 -3.985 -16.430
740 HA3 GLY 96 3HA GLY 96 -1.743 -3.182 -16.810
741 H LYS 97 H LYS 97 -0.544 -1.939 -13.890
742 HA LYS 97 HA LYS 97 0.804 0.362 -15.261
743 HB2 LYS 97 2HB LYS 97 -1.326 0.548 -13.090
744 HB3 LYS 97 3HB LYS 97 -0.387 1.900 -13.737
745 HG2 LYS 97 2HG LYS 97 -1.284 1.320 -16.045
746 HG3 LYS 97 3HG LYS 97 -2.388 0.179 -15.255
747 HD2 LYS 97 2HD LYS 97 -3.338 2.064 -13.917
748 HD3 LYS 97 3HD LYS 97 -2.248 3.187 -14.759
749 HE2 LYS 97 2HE LYS 97 -3.257 2.515 -16.935
750 HE3 LYS 97 3HE LYS 97 -4.350 1.413 -16.089
751 HZ1 LYS 97 3HZ LYS 97 -5.425 3.538 -16.561
752 HZ2 LYS 97 1HZ LYS 97 -5.305 3.347 -14.946
753 HZ3 LYS 97 2HZ LYS 97 -4.293 4.364 -15.730
754 H GLY 98 H GLY 98 1.991 1.799 -13.813
755 HA2 GLY 98 2HA GLY 98 3.125 0.752 -11.330
756 HA3 GLY 98 3HA GLY 98 4.204 0.610 -12.720
757 H GLN 99 H GLN 99 5.568 2.017 -11.379
758 HA GLN 99 HA GLN 99 4.917 4.931 -11.610
759 HB2 GLN 99 2HB GLN 99 6.221 3.447 -9.297
760 HB3 GLN 99 3HB GLN 99 6.190 5.209 -9.468
761 HG2 GLN 99 2HG GLN 99 3.722 5.206 -9.437
762 HG3 GLN 99 3HG GLN 99 3.703 3.447 -9.288
763 HE21 GLN 99 2HE2 GLN 99 2.310 4.644 -7.378
764 HE22 GLN 99 1HE2 GLN 99 3.220 4.605 -5.859
765 H ASP 100 H ASP 100 6.657 6.350 -11.890
766 HA ASP 100 HA ASP 100 8.947 5.234 -13.374
767 HB2 ASP 100 2HB ASP 100 7.613 7.083 -14.311
768 HB3 ASP 100 3HB ASP 100 8.030 8.094 -12.924
769 H GLY 101 H GLY 101 11.127 5.737 -12.937
770 HA2 GLY 101 2HA GLY 101 13.005 6.223 -11.662
771 HA3 GLY 101 3HA GLY 101 11.996 6.990 -10.442
772 H ILE 102 H ILE 102 13.941 5.718 -9.377
773 HA ILE 102 HA ILE 102 12.863 3.249 -8.179
774 HB ILE 102 HB ILE 102 14.148 2.519 -10.142
775 HG12 ILE 102 2HG1 ILE 102 15.536 1.757 -7.546
776 HG13 ILE 102 3HG1 ILE 102 13.958 1.157 -8.073
777 HG21 ILE 102 1HG2 ILE 102 16.621 3.712 -8.812
778 HG22 ILE 102 2HG2 ILE 102 16.563 2.789 -10.324
779 HG23 ILE 102 3HG2 ILE 102 15.812 4.377 -10.245
780 HD11 ILE 102 3HD1 ILE 102 15.630 -0.501 -8.573
781 HD12 ILE 102 1HD1 ILE 102 15.040 0.178 -10.103
782 HD13 ILE 102 2HD1 ILE 102 16.624 0.668 -9.453
783 H GLY 103 H GLY 103 13.516 2.865 -6.113
784 HA2 GLY 103 2HA GLY 103 14.429 5.127 -4.581
785 HA3 GLY 103 3HA GLY 103 14.011 3.526 -3.966
786 H SER 104 H SER 104 16.353 2.724 -6.073
787 HA SER 104 HA SER 104 18.673 3.278 -4.287
788 HB2 SER 104 2HB SER 104 17.814 0.487 -5.146
789 HB3 SER 104 3HB SER 104 19.249 0.899 -4.196
790 HG SER 104 HG SER 104 17.848 1.671 -2.545
791 H LYS 105 H LYS 105 20.682 3.089 -5.228
792 HA LYS 105 HA LYS 105 21.013 2.068 -7.975
793 HB2 LYS 105 2HB LYS 105 20.450 4.564 -8.110
794 HB3 LYS 105 3HB LYS 105 21.959 4.874 -7.244
795 HG2 LYS 105 2HG LYS 105 23.184 3.668 -9.117
796 HG3 LYS 105 3HG LYS 105 21.632 3.516 -9.962
797 HD2 LYS 105 2HD LYS 105 21.453 6.030 -9.952
798 HD3 LYS 105 3HD LYS 105 23.043 6.096 -9.158
799 HE2 LYS 105 2HE LYS 105 23.916 4.697 -11.142
800 HE3 LYS 105 3HE LYS 105 22.376 5.044 -11.942
801 HZ1 LYS 105 3HZ LYS 105 24.053 6.672 -12.565
802 HZ2 LYS 105 1HZ LYS 105 22.931 7.446 -11.659
803 HZ3 LYS 105 2HZ LYS 105 24.382 7.024 -11.002
804 H ALA 106 H ALA 106 23.098 1.344 -8.393
805 HA ALA 106 HA ALA 106 25.004 1.255 -6.092
806 HB1 ALA 106 1HB ALA 106 24.628 -0.656 -8.428
807 HB2 ALA 106 2HB ALA 106 25.826 -0.811 -7.125
808 HB3 ALA 106 3HB ALA 106 24.094 -0.912 -6.751
809 H GLU 107 H GLU 107 26.086 3.176 -6.433
810 HA GLU 107 HA GLU 107 27.479 3.757 -8.962
811 HB2 GLU 107 2HB GLU 107 27.526 5.015 -6.198
812 HB3 GLU 107 3HB GLU 107 28.587 5.550 -7.490
813 HG2 GLU 107 2HG GLU 107 25.540 5.546 -7.650
814 HG3 GLU 107 3HG GLU 107 26.527 6.931 -7.198
815 H LYS 108 H LYS 108 29.739 3.832 -9.228
816 HA LYS 108 HA LYS 108 31.490 2.360 -7.364
817 HB2 LYS 108 2HB LYS 108 30.501 0.630 -8.867
818 HB3 LYS 108 3HB LYS 108 31.078 1.524 -10.269
819 HG2 LYS 108 2HG LYS 108 32.530 -0.351 -9.835
820 HG3 LYS 108 3HG LYS 108 33.427 1.142 -9.561
821 HD2 LYS 108 2HD LYS 108 33.166 0.873 -7.113
822 HD3 LYS 108 3HD LYS 108 32.168 -0.577 -7.370
823 HE2 LYS 108 2HE LYS 108 34.084 -1.682 -8.501
824 HE3 LYS 108 3HE LYS 108 35.070 -0.235 -8.254
825 HZ1 LYS 108 3HZ LYS 108 34.840 -0.568 -5.850
826 HZ2 LYS 108 1HZ LYS 108 33.926 -1.906 -6.077
827 HZ3 LYS 108 2HZ LYS 108 35.492 -1.897 -6.536
Start of MODEL 5
1 H1 MET 1 H1 MET 1 0.349 -3.441 21.376
2 H2 MET 1 H2 MET 1 1.135 -4.586 22.255
3 H3 MET 1 H3 MET 1 1.794 -3.094 22.054
4 HA MET 1 HA MET 1 -0.662 -3.735 23.541
5 HB2 MET 1 2HB MET 1 1.404 -4.384 24.733
6 HB3 MET 1 3HB MET 1 2.001 -2.727 24.626
7 HG2 MET 1 2HG MET 1 1.024 -3.181 26.816
8 HG3 MET 1 3HG MET 1 0.096 -1.939 25.981
9 HE1 MET 1 1HE MET 1 -1.831 -2.209 27.773
10 HE2 MET 1 2HE MET 1 -2.591 -3.762 28.186
11 HE3 MET 1 3HE MET 1 -0.887 -3.473 28.599
12 H ALA 2 H ALA 2 1.608 -0.904 23.502
13 HA ALA 2 HA ALA 2 -0.665 0.960 23.281
14 HB1 ALA 2 1HB ALA 2 2.355 1.393 23.247
15 HB2 ALA 2 2HB ALA 2 1.113 2.660 23.355
16 HB3 ALA 2 3HB ALA 2 1.298 1.492 24.677
17 H GLU 3 H GLU 3 1.752 -0.525 21.237
18 HA GLU 3 HA GLU 3 0.683 0.686 18.743
19 HB2 GLU 3 2HB GLU 3 2.522 -0.364 17.626
20 HB3 GLU 3 3HB GLU 3 3.131 0.599 18.961
21 HG2 GLU 3 2HG GLU 3 2.796 -2.440 19.040
22 HG3 GLU 3 3HG GLU 3 4.272 -1.616 18.580
23 H SER 4 H SER 4 0.052 -0.790 16.983
24 HA SER 4 HA SER 4 -0.885 -3.479 17.815
25 HB2 SER 4 2HB SER 4 -3.144 -3.059 17.009
26 HB3 SER 4 3HB SER 4 -2.729 -1.955 18.329
27 HG SER 4 HG SER 4 -3.714 -0.778 16.703
28 H SER 5 H SER 5 -1.156 -4.962 16.221
29 HA SER 5 HA SER 5 -0.606 -4.201 13.392
30 HB2 SER 5 2HB SER 5 0.799 -6.157 13.108
31 HB3 SER 5 3HB SER 5 1.461 -5.115 14.369
32 HG SER 5 HG SER 5 0.799 -6.536 15.917
33 H ASP 6 H ASP 6 -3.124 -4.594 14.737
34 HA ASP 6 HA ASP 6 -4.102 -7.107 13.658
35 HB2 ASP 6 2HB ASP 6 -4.701 -6.206 15.928
36 HB3 ASP 6 3HB ASP 6 -5.633 -4.939 15.134
37 H LYS 7 H LYS 7 -3.195 -5.144 11.731
38 HA LYS 7 HA LYS 7 -5.505 -5.102 9.937
39 HB2 LYS 7 2HB LYS 7 -3.954 -2.709 9.417
40 HB3 LYS 7 3HB LYS 7 -5.676 -2.954 9.534
41 HG2 LYS 7 2HG LYS 7 -5.193 -1.293 11.083
42 HG3 LYS 7 3HG LYS 7 -5.457 -2.729 12.075
43 HD2 LYS 7 2HD LYS 7 -2.984 -3.015 12.281
44 HD3 LYS 7 3HD LYS 7 -2.739 -1.664 11.188
45 HE2 LYS 7 2HE LYS 7 -4.171 -0.283 12.873
46 HE3 LYS 7 3HE LYS 7 -3.907 -1.618 14.003
47 HZ1 LYS 7 3HZ LYS 7 -1.486 -1.222 13.733
48 HZ2 LYS 7 1HZ LYS 7 -1.806 0.033 12.695
49 HZ3 LYS 7 2HZ LYS 7 -2.246 0.102 14.281
50 H LEU 8 H LEU 8 -4.994 -5.990 8.192
51 HA LEU 8 HA LEU 8 -2.394 -7.144 7.780
52 HB2 LEU 8 2HB LEU 8 -3.461 -8.490 6.149
53 HB3 LEU 8 3HB LEU 8 -4.418 -8.465 7.617
54 HG LEU 8 HG LEU 8 -5.065 -6.780 5.165
55 HD11 LEU 8 1HD1 LEU 8 -6.181 -9.490 6.004
56 HD12 LEU 8 2HD1 LEU 8 -6.740 -8.512 4.625
57 HD13 LEU 8 3HD1 LEU 8 -5.108 -9.188 4.616
58 HD21 LEU 8 3HD2 LEU 8 -7.405 -6.867 6.129
59 HD22 LEU 8 1HD2 LEU 8 -6.690 -7.481 7.633
60 HD23 LEU 8 2HD2 LEU 8 -6.275 -5.857 7.000
61 H TYR 9 H TYR 9 -3.652 -4.153 6.622
62 HA TYR 9 HA TYR 9 -1.743 -4.224 4.344
63 HB2 TYR 9 2HB TYR 9 -4.470 -2.911 4.329
64 HB3 TYR 9 3HB TYR 9 -3.306 -2.928 3.014
65 HD1 TYR 9 HD2 TYR 9 -2.492 -5.756 2.877
66 HD2 TYR 9 HD1 TYR 9 -6.370 -4.033 3.536
67 HE1 TYR 9 HE2 TYR 9 -3.552 -7.791 1.900
68 HE2 TYR 9 HE1 TYR 9 -7.441 -6.074 2.594
69 HH TYR 9 HH TYR 9 -7.088 -8.041 1.463
70 H ARG 10 H ARG 10 -0.878 -2.233 3.781
71 HA ARG 10 HA ARG 10 -1.063 0.019 5.704
72 HB2 ARG 10 2HB ARG 10 0.802 -1.267 6.498
73 HB3 ARG 10 3HB ARG 10 1.356 -1.583 4.874
74 HG2 ARG 10 2HG ARG 10 2.913 -0.099 5.886
75 HG3 ARG 10 3HG ARG 10 2.066 0.809 4.639
76 HD2 ARG 10 2HD ARG 10 0.546 1.715 6.426
77 HD3 ARG 10 3HD ARG 10 1.510 0.860 7.643
78 HE ARG 10 HE ARG 10 3.214 2.595 6.129
79 HH11 ARG 10 1HH2 ARG 10 0.687 2.882 8.646
80 HH12 ARG 10 2HH2 ARG 10 1.073 4.610 8.781
81 HH21 ARG 10 1HH1 ARG 10 3.698 4.669 6.726
82 HH22 ARG 10 2HH1 ARG 10 2.607 5.511 7.861
83 H VAL 11 H VAL 11 -0.798 2.049 4.710
84 HA VAL 11 HA VAL 11 0.350 2.213 1.977
85 HB VAL 11 HB VAL 11 -2.184 2.065 1.895
86 HG11 VAL 11 1HG1 VAL 11 -2.092 4.960 2.865
87 HG12 VAL 11 2HG1 VAL 11 -3.519 4.013 2.394
88 HG13 VAL 11 3HG1 VAL 11 -2.607 3.607 3.863
89 HG21 VAL 11 3HG2 VAL 11 -0.998 4.644 0.756
90 HG22 VAL 11 1HG2 VAL 11 -0.740 3.051 0.050
91 HG23 VAL 11 2HG2 VAL 11 -2.375 3.718 0.123
92 H GLU 12 H GLU 12 1.441 4.136 1.526
93 HA GLU 12 HA GLU 12 1.165 6.512 3.157
94 HB2 GLU 12 2HB GLU 12 3.433 6.559 4.097
95 HB3 GLU 12 3HB GLU 12 2.576 5.157 4.706
96 HG2 GLU 12 2HG GLU 12 3.762 3.709 3.063
97 HG3 GLU 12 3HG GLU 12 4.609 5.122 2.431
98 H TYR 13 H TYR 13 2.381 8.251 2.566
99 HA TYR 13 HA TYR 13 3.641 8.290 -0.083
100 HB2 TYR 13 2HB TYR 13 3.671 10.335 2.156
101 HB3 TYR 13 3HB TYR 13 4.165 10.595 0.488
102 HD1 TYR 13 HD1 TYR 13 1.867 9.197 -0.950
103 HD2 TYR 13 HD2 TYR 13 1.874 11.791 2.486
104 HE1 TYR 13 HE1 TYR 13 -0.298 10.178 -1.693
105 HE2 TYR 13 HE2 TYR 13 -0.332 12.724 1.785
106 HH TYR 13 HH TYR 13 -1.869 11.810 -1.317
107 H ALA 14 H ALA 14 5.692 7.857 -0.477
108 HA ALA 14 HA ALA 14 7.452 6.845 1.592
109 HB1 ALA 14 1HB ALA 14 7.761 7.310 -1.403
110 HB2 ALA 14 2HB ALA 14 8.932 6.440 -0.390
111 HB3 ALA 14 3HB ALA 14 7.285 5.805 -0.610
112 H LYS 15 H LYS 15 8.526 8.214 2.937
113 HA LYS 15 HA LYS 15 9.462 10.856 2.072
114 HB2 LYS 15 2HB LYS 15 8.589 10.519 4.335
115 HB3 LYS 15 3HB LYS 15 9.807 9.287 4.659
116 HG2 LYS 15 2HG LYS 15 10.444 11.320 5.772
117 HG3 LYS 15 3HG LYS 15 11.597 10.978 4.507
118 HD2 LYS 15 2HD LYS 15 9.934 12.691 3.129
119 HD3 LYS 15 3HD LYS 15 9.599 13.206 4.777
120 HE2 LYS 15 2HE LYS 15 11.389 14.592 4.171
121 HE3 LYS 15 3HE LYS 15 12.188 13.296 5.066
122 HZ1 LYS 15 3HZ LYS 15 12.528 12.240 2.771
123 HZ2 LYS 15 1HZ LYS 15 12.092 13.671 2.128
124 HZ3 LYS 15 2HZ LYS 15 13.428 13.577 3.069
125 H SER 16 H SER 16 10.892 7.689 2.264
126 HA SER 16 HA SER 16 13.310 8.626 0.900
127 HB2 SER 16 2HB SER 16 13.874 8.910 3.303
128 HB3 SER 16 3HB SER 16 13.549 7.186 3.570
129 HG SER 16 HG SER 16 15.802 7.748 3.144
130 H GLY 17 H GLY 17 14.525 6.863 -0.004
131 HA2 GLY 17 2HA GLY 17 12.789 4.772 -1.031
132 HA3 GLY 17 3HA GLY 17 14.435 5.120 -1.548
133 H ARG 18 H ARG 18 13.306 4.294 1.736
134 HA ARG 18 HA ARG 18 15.389 2.236 2.026
135 HB2 ARG 18 2HB ARG 18 13.217 3.141 3.964
136 HB3 ARG 18 3HB ARG 18 14.595 2.125 4.360
137 HG2 ARG 18 2HG ARG 18 14.663 5.051 3.534
138 HG3 ARG 18 3HG ARG 18 14.990 4.396 5.131
139 HD2 ARG 18 2HD ARG 18 16.683 3.967 2.634
140 HD3 ARG 18 3HD ARG 18 17.049 5.057 3.974
141 HE ARG 18 HE ARG 18 16.731 2.539 5.150
142 HH11 ARG 18 1HH2 ARG 18 18.965 3.928 2.836
143 HH12 ARG 18 2HH2 ARG 18 20.247 2.834 3.280
144 HH21 ARG 18 1HH1 ARG 18 18.403 1.169 5.660
145 HH22 ARG 18 2HH1 ARG 18 19.931 1.319 4.842
146 H ALA 19 H ALA 19 12.040 2.145 1.198
147 HA ALA 19 HA ALA 19 11.743 -0.715 1.889
148 HB1 ALA 19 1HB ALA 19 9.787 1.264 0.658
149 HB2 ALA 19 2HB ALA 19 9.427 -0.388 1.180
150 HB3 ALA 19 3HB ALA 19 9.888 0.827 2.383
151 H SER 20 H SER 20 11.436 -2.354 0.381
152 HA SER 20 HA SER 20 11.951 -1.739 -2.486
153 HB2 SER 20 2HB SER 20 13.188 -4.057 -0.974
154 HB3 SER 20 3HB SER 20 13.392 -3.680 -2.693
155 HG SER 20 HG SER 20 14.345 -1.651 -2.012
156 H CYS 21 HN CYS 21 11.125 -3.271 -4.014
157 HA CYS 21 HA CYS 21 8.410 -3.873 -3.136
158 HB2 CYS 21 2HB CYS 21 9.015 -2.479 -5.090
159 HB3 CYS 21 3HB CYS 21 9.715 -3.909 -5.868
160 H LYS 22 H LYS 22 7.657 -5.775 -2.626
161 HA LYS 22 HA LYS 22 9.244 -8.209 -2.916
162 HB2 LYS 22 2HB LYS 22 6.450 -7.773 -1.810
163 HB3 LYS 22 3HB LYS 22 7.402 -9.225 -1.571
164 HG2 LYS 22 2HG LYS 22 8.182 -6.437 -0.626
165 HG3 LYS 22 3HG LYS 22 7.326 -7.594 0.363
166 HD2 LYS 22 2HD LYS 22 10.097 -8.019 -0.840
167 HD3 LYS 22 3HD LYS 22 9.781 -7.467 0.813
168 HE2 LYS 22 2HE LYS 22 8.526 -9.573 1.279
169 HE3 LYS 22 3HE LYS 22 8.901 -10.150 -0.349
170 HZ1 LYS 22 3HZ LYS 22 10.475 -11.026 1.272
171 HZ2 LYS 22 1HZ LYS 22 11.269 -10.053 0.231
172 HZ3 LYS 22 2HZ LYS 22 10.922 -9.528 1.741
173 H LYS 23 H LYS 23 7.110 -6.789 -5.033
174 HA LYS 23 HA LYS 23 6.195 -9.391 -6.206
175 HB2 LYS 23 2HB LYS 23 4.412 -7.864 -5.601
176 HB3 LYS 23 3HB LYS 23 5.132 -6.580 -6.568
177 HG2 LYS 23 2HG LYS 23 3.202 -7.579 -7.683
178 HG3 LYS 23 3HG LYS 23 4.669 -7.809 -8.631
179 HD2 LYS 23 2HD LYS 23 4.822 -10.163 -7.857
180 HD3 LYS 23 3HD LYS 23 3.390 -9.930 -6.836
181 HE2 LYS 23 2HE LYS 23 2.035 -9.440 -8.842
182 HE3 LYS 23 3HE LYS 23 3.466 -9.587 -9.869
183 HZ1 LYS 23 3HZ LYS 23 2.323 -11.806 -8.249
184 HZ2 LYS 23 1HZ LYS 23 2.143 -11.631 -9.860
185 HZ3 LYS 23 2HZ LYS 23 3.621 -11.925 -9.235
186 H CYS 24 HN CYS 24 7.586 -6.260 -7.344
187 HA CYS 24 HA CYS 24 8.415 -7.680 -9.817
188 HB2 CYS 24 2HB CYS 24 8.496 -5.674 -10.946
189 HB3 CYS 24 3HB CYS 24 6.983 -5.682 -10.045
190 H SER 25 H SER 25 9.805 -7.067 -6.913
191 HA SER 25 HA SER 25 11.862 -7.184 -6.063
192 HB2 SER 25 2HB SER 25 12.708 -8.383 -8.706
193 HB3 SER 25 3HB SER 25 13.584 -8.478 -7.170
194 HG SER 25 HG SER 25 12.299 -10.343 -7.552
195 H GLU 26 H GLU 26 11.151 -4.727 -7.699
196 HA GLU 26 HA GLU 26 13.850 -3.509 -8.062
197 HB2 GLU 26 2HB GLU 26 11.083 -2.350 -8.496
198 HB3 GLU 26 3HB GLU 26 12.601 -1.572 -8.921
199 HG2 GLU 26 2HG GLU 26 11.585 -4.149 -10.202
200 HG3 GLU 26 3HG GLU 26 11.335 -2.536 -10.835
201 H SER 27 H SER 27 13.454 -0.945 -7.166
202 HA SER 27 HA SER 27 12.733 -1.216 -4.288
203 HB2 SER 27 2HB SER 27 15.235 -1.148 -4.816
204 HB3 SER 27 3HB SER 27 14.939 0.590 -5.152
205 HG SER 27 HG SER 27 15.484 0.226 -2.948
206 H ILE 28 H ILE 28 11.935 0.600 -3.218
207 HA ILE 28 HA ILE 28 10.080 1.830 -5.121
208 HB ILE 28 HB ILE 28 9.871 1.576 -2.109
209 HG12 ILE 28 2HG1 ILE 28 8.465 -0.089 -4.253
210 HG13 ILE 28 3HG1 ILE 28 9.911 -0.629 -3.407
211 HG21 ILE 28 1HG2 ILE 28 7.748 2.314 -4.185
212 HG22 ILE 28 2HG2 ILE 28 7.478 2.068 -2.454
213 HG23 ILE 28 3HG2 ILE 28 8.461 3.424 -2.995
214 HD11 ILE 28 3HD1 ILE 28 8.043 -1.647 -2.345
215 HD12 ILE 28 1HD1 ILE 28 8.724 -0.453 -1.230
216 HD13 ILE 28 2HD1 ILE 28 7.221 -0.100 -2.114
217 HA PRO 29 HA PRO 29 12.256 5.684 -4.503
218 HB2 PRO 29 2HB PRO 29 10.923 7.325 -6.226
219 HB3 PRO 29 3HB PRO 29 11.949 5.971 -6.792
220 HG2 PRO 29 2HG PRO 29 8.938 5.970 -6.400
221 HG3 PRO 29 3HG PRO 29 9.865 5.443 -7.842
222 HD2 PRO 29 2HD PRO 29 9.014 3.676 -5.951
223 HD3 PRO 29 3HD PRO 29 10.598 3.475 -6.768
224 H LYS 30 H LYS 30 12.101 7.683 -3.472
225 HA LYS 30 HA LYS 30 9.819 8.193 -1.735
226 HB2 LYS 30 2HB LYS 30 11.103 9.802 -0.684
227 HB3 LYS 30 3HB LYS 30 12.207 8.488 -1.104
228 HG2 LYS 30 2HG LYS 30 12.853 9.851 -3.163
229 HG3 LYS 30 3HG LYS 30 11.895 11.179 -2.487
230 HD2 LYS 30 2HD LYS 30 13.309 11.185 -0.447
231 HD3 LYS 30 3HD LYS 30 14.260 9.826 -1.103
232 HE2 LYS 30 2HE LYS 30 14.697 11.219 -3.150
233 HE3 LYS 30 3HE LYS 30 13.882 12.571 -2.351
234 HZ1 LYS 30 3HZ LYS 30 16.383 11.242 -1.404
235 HZ2 LYS 30 1HZ LYS 30 16.259 12.763 -2.009
236 HZ3 LYS 30 2HZ LYS 30 15.602 12.399 -0.556
237 H ASP 31 H ASP 31 8.919 10.393 -1.538
238 HA ASP 31 HA ASP 31 7.322 11.772 -2.301
239 HB2 ASP 31 2HB ASP 31 9.321 13.043 -3.035
240 HB3 ASP 31 3HB ASP 31 9.171 12.330 -4.640
241 H SER 32 H SER 32 6.821 9.186 -2.697
242 HA SER 32 HA SER 32 5.030 9.051 -5.038
243 HB2 SER 32 2HB SER 32 7.427 8.101 -5.543
244 HB3 SER 32 3HB SER 32 6.939 6.767 -4.482
245 HG SER 32 HG SER 32 5.742 7.665 -6.905
246 H LEU 33 H LEU 33 3.807 6.819 -4.882
247 HA LEU 33 HA LEU 33 2.799 6.628 -2.078
248 HB2 LEU 33 2HB LEU 33 1.284 7.573 -3.817
249 HB3 LEU 33 3HB LEU 33 1.438 6.079 -4.740
250 HG LEU 33 HG LEU 33 0.401 4.839 -2.809
251 HD11 LEU 33 1HD1 LEU 33 0.835 6.405 -0.958
252 HD12 LEU 33 2HD1 LEU 33 -0.144 7.651 -1.758
253 HD13 LEU 33 3HD1 LEU 33 -0.901 6.164 -1.158
254 HD21 LEU 33 3HD2 LEU 33 -1.877 5.596 -3.279
255 HD22 LEU 33 1HD2 LEU 33 -1.260 7.141 -3.915
256 HD23 LEU 33 2HD2 LEU 33 -0.918 5.618 -4.769
257 H ARG 34 H ARG 34 2.858 4.697 -1.007
258 HA ARG 34 HA ARG 34 3.363 2.183 -2.501
259 HB2 ARG 34 2HB ARG 34 5.248 1.551 -1.187
260 HB3 ARG 34 3HB ARG 34 5.555 3.080 -2.009
261 HG2 ARG 34 2HG ARG 34 5.218 4.313 0.111
262 HG3 ARG 34 3HG ARG 34 4.893 2.780 0.955
263 HD2 ARG 34 2HD ARG 34 7.142 1.953 0.376
264 HD3 ARG 34 3HD ARG 34 7.453 3.422 -0.564
265 HE ARG 34 HE ARG 34 6.834 3.810 2.312
266 HH11 ARG 34 1HH2 ARG 34 9.460 3.688 -0.048
267 HH12 ARG 34 2HH2 ARG 34 10.504 4.594 1.023
268 HH21 ARG 34 1HH1 ARG 34 8.172 4.756 3.546
269 HH22 ARG 34 2HH1 ARG 34 9.870 5.009 3.110
270 H MET 35 H MET 35 3.064 0.288 -1.333
271 HA MET 35 HA MET 35 1.264 0.490 1.003
272 HB2 MET 35 2HB MET 35 0.770 -1.069 -1.565
273 HB3 MET 35 3HB MET 35 -0.052 -1.444 -0.041
274 HG2 MET 35 2HG MET 35 -0.888 0.877 0.074
275 HG3 MET 35 3HG MET 35 -0.140 1.221 -1.488
276 HE1 MET 35 3HE MET 35 -4.005 -1.173 -0.673
277 HE2 MET 35 1HE MET 35 -2.440 -1.850 -0.143
278 HE3 MET 35 2HE MET 35 -3.015 -0.295 0.518
279 H ALA 36 H ALA 36 1.047 -1.519 2.198
280 HA ALA 36 HA ALA 36 3.232 -3.436 1.860
281 HB1 ALA 36 1HB ALA 36 3.353 -2.821 4.638
282 HB2 ALA 36 2HB ALA 36 4.596 -2.590 3.408
283 HB3 ALA 36 3HB ALA 36 3.453 -1.284 3.757
284 H ILE 37 H ILE 37 3.081 -5.282 3.421
285 HA ILE 37 HA ILE 37 0.279 -5.765 4.329
286 HB ILE 37 HB ILE 37 1.928 -7.194 2.350
287 HG12 ILE 37 2HG1 ILE 37 -1.007 -7.387 3.116
288 HG13 ILE 37 3HG1 ILE 37 -0.327 -6.084 2.124
289 HG21 ILE 37 1HG2 ILE 37 0.505 -8.915 4.401
290 HG22 ILE 37 2HG2 ILE 37 1.243 -9.437 2.847
291 HG23 ILE 37 3HG2 ILE 37 2.267 -8.824 4.140
292 HD11 ILE 37 3HD1 ILE 37 -1.387 -7.709 0.723
293 HD12 ILE 37 1HD1 ILE 37 0.363 -7.726 0.435
294 HD13 ILE 37 2HD1 ILE 37 -0.401 -9.022 1.394
295 H MET 38 H MET 38 -0.055 -6.682 6.265
296 HA MET 38 HA MET 38 2.338 -7.010 7.961
297 HB2 MET 38 2HB MET 38 0.153 -5.661 8.526
298 HB3 MET 38 3HB MET 38 -0.525 -7.246 8.890
299 HG2 MET 38 2HG MET 38 0.208 -6.697 10.947
300 HG3 MET 38 3HG MET 38 1.679 -7.476 10.371
301 HE1 MET 38 3HE MET 38 3.736 -6.092 9.407
302 HE2 MET 38 1HE MET 38 2.788 -5.004 8.367
303 HE3 MET 38 2HE MET 38 3.944 -4.328 9.541
304 H VAL 39 H VAL 39 3.346 -8.864 7.981
305 HA VAL 39 HA VAL 39 1.733 -11.365 8.315
306 HB VAL 39 HB VAL 39 2.506 -11.241 6.011
307 HG11 VAL 39 1HG1 VAL 39 5.348 -11.305 7.098
308 HG12 VAL 39 2HG1 VAL 39 4.839 -11.429 5.402
309 HG13 VAL 39 3HG1 VAL 39 4.579 -9.922 6.291
310 HG21 VAL 39 3HG2 VAL 39 3.447 -13.426 5.809
311 HG22 VAL 39 1HG2 VAL 39 4.005 -13.420 7.488
312 HG23 VAL 39 2HG2 VAL 39 2.260 -13.438 7.120
313 H GLN 40 H GLN 40 2.503 -12.921 9.645
314 HA GLN 40 HA GLN 40 4.345 -12.136 11.756
315 HB2 GLN 40 2HB GLN 40 3.922 -14.551 12.492
316 HB3 GLN 40 3HB GLN 40 2.581 -13.409 12.538
317 HG2 GLN 40 2HG GLN 40 1.611 -14.314 10.500
318 HG3 GLN 40 3HG GLN 40 3.007 -15.360 10.237
319 HE21 GLN 40 2HE2 GLN 40 0.910 -16.853 10.132
320 HE22 GLN 40 1HE2 GLN 40 0.525 -17.635 11.659
321 H SER 41 H SER 41 6.461 -12.559 11.988
322 HA SER 41 HA SER 41 7.853 -13.786 9.696
323 HB2 SER 41 2HB SER 41 8.535 -11.584 10.404
324 HB3 SER 41 3HB SER 41 8.892 -12.196 12.032
325 HG SER 41 HG SER 41 10.609 -12.070 10.169
326 HA PRO 42 HA PRO 42 9.091 -17.344 12.072
327 HB2 PRO 42 2HB PRO 42 10.944 -17.772 9.738
328 HB3 PRO 42 3HB PRO 42 9.848 -18.941 10.531
329 HG2 PRO 42 2HG PRO 42 9.200 -17.838 8.131
330 HG3 PRO 42 3HG PRO 42 7.949 -18.052 9.403
331 HD2 PRO 42 2HD PRO 42 9.507 -15.535 8.718
332 HD3 PRO 42 3HD PRO 42 7.750 -15.750 8.993
333 H MET 43 H MET 43 11.028 -14.689 11.006
334 HA MET 43 HA MET 43 13.473 -15.608 12.467
335 HB2 MET 43 2HB MET 43 13.083 -13.713 10.150
336 HB3 MET 43 3HB MET 43 14.610 -13.887 11.005
337 HG2 MET 43 2HG MET 43 15.069 -15.954 10.181
338 HG3 MET 43 3HG MET 43 13.387 -16.454 10.099
339 HE1 MET 43 3HE MET 43 12.014 -15.112 6.821
340 HE2 MET 43 1HE MET 43 11.824 -16.253 8.174
341 HE3 MET 43 2HE MET 43 11.818 -14.508 8.485
342 H PHE 44 H PHE 44 11.055 -13.078 12.427
343 HA PHE 44 HA PHE 44 12.562 -11.479 14.454
344 HB2 PHE 44 2HB PHE 44 12.126 -10.245 12.425
345 HB3 PHE 44 3HB PHE 44 10.428 -10.675 12.459
346 HD1 PHE 44 HD2 PHE 44 13.045 -8.825 14.414
347 HD2 PHE 44 HD1 PHE 44 8.846 -9.297 13.546
348 HE1 PHE 44 HE2 PHE 44 12.532 -6.808 15.774
349 HE2 PHE 44 HE1 PHE 44 8.337 -7.276 14.895
350 HZ PHE 44 HZ PHE 44 10.180 -6.034 16.017
351 H ASP 45 H ASP 45 11.309 -10.495 16.141
352 HA ASP 45 HA ASP 45 9.702 -12.527 17.492
353 HB2 ASP 45 2HB ASP 45 10.838 -9.879 18.452
354 HB3 ASP 45 3HB ASP 45 10.035 -11.071 19.476
355 H GLY 46 H GLY 46 8.237 -11.473 15.362
356 HA2 GLY 46 2HA GLY 46 5.679 -10.963 16.287
357 HA3 GLY 46 3HA GLY 46 6.415 -9.360 16.200
358 H LYS 47 H LYS 47 5.131 -8.606 14.565
359 HA LYS 47 HA LYS 47 5.148 -10.057 11.962
360 HB2 LYS 47 2HB LYS 47 3.114 -7.983 12.829
361 HB3 LYS 47 3HB LYS 47 3.074 -9.045 11.420
362 HG2 LYS 47 2HG LYS 47 3.331 -10.886 13.485
363 HG3 LYS 47 3HG LYS 47 2.404 -9.621 14.277
364 HD2 LYS 47 2HD LYS 47 1.715 -11.111 11.719
365 HD3 LYS 47 3HD LYS 47 1.019 -11.418 13.304
366 HE2 LYS 47 2HE LYS 47 0.710 -8.817 11.736
367 HE3 LYS 47 3HE LYS 47 -0.440 -10.156 11.695
368 HZ1 LYS 47 3HZ LYS 47 0.255 -8.584 14.132
369 HZ2 LYS 47 1HZ LYS 47 -1.116 -8.461 13.285
370 HZ3 LYS 47 2HZ LYS 47 -0.792 -9.854 14.093
371 H VAL 48 H VAL 48 5.474 -9.061 10.064
372 HA VAL 48 HA VAL 48 7.092 -6.558 10.181
373 HB VAL 48 HB VAL 48 8.623 -7.597 8.549
374 HG11 VAL 48 1HG1 VAL 48 9.116 -7.594 10.993
375 HG12 VAL 48 2HG1 VAL 48 8.367 -9.198 11.133
376 HG13 VAL 48 3HG1 VAL 48 9.830 -8.981 10.157
377 HG21 VAL 48 3HG2 VAL 48 8.682 -10.034 8.249
378 HG22 VAL 48 1HG2 VAL 48 7.160 -10.206 9.143
379 HG23 VAL 48 2HG2 VAL 48 7.190 -9.360 7.585
380 HA PRO 49 HA PRO 49 4.605 -5.445 6.680
381 HB2 PRO 49 2HB PRO 49 5.750 -3.110 5.887
382 HB3 PRO 49 3HB PRO 49 4.897 -3.284 7.450
383 HG2 PRO 49 2HG PRO 49 7.883 -3.423 6.932
384 HG3 PRO 49 3HG PRO 49 7.021 -2.518 8.212
385 HD2 PRO 49 2HD PRO 49 8.159 -5.001 8.608
386 HD3 PRO 49 3HD PRO 49 6.705 -4.445 9.490
387 H HIS 50 H HIS 50 4.573 -6.372 4.698
388 HA HIS 50 HA HIS 50 7.057 -6.607 3.038
389 HB2 HIS 50 2HB HIS 50 4.315 -7.908 2.966
390 HB3 HIS 50 3HB HIS 50 5.382 -7.939 1.573
391 HD2 HIS 50 HD2 HIS 50 6.845 -8.329 5.106
392 HE1 HIS 50 HE1 HIS 50 7.027 -12.170 3.271
393 HE2 HIS 50 HE2 HIS 50 7.771 -10.797 5.284
394 H TRP 51 H TRP 51 7.461 -4.639 2.131
395 HA TRP 51 HA TRP 51 5.324 -2.886 1.277
396 HB2 TRP 51 2HB TRP 51 8.313 -2.680 0.838
397 HB3 TRP 51 3HB TRP 51 7.126 -1.415 0.544
398 HD1 TRP 51 HD1 TRP 51 9.138 -3.025 3.278
399 HE1 TRP 51 HE1 TRP 51 8.822 -1.774 5.490
400 HE3 TRP 51 HE3 TRP 51 5.304 0.116 1.904
401 HZ2 TRP 51 HZ2 TRP 51 7.032 0.185 6.589
402 HZ3 TRP 51 HZ3 TRP 51 4.207 1.553 3.648
403 HH2 TRP 51 HH2 TRP 51 5.107 1.623 5.952
404 H TYR 52 H TYR 52 4.785 -2.231 -0.785
405 HA TYR 52 HA TYR 52 6.290 -3.184 -3.092
406 HB2 TYR 52 2HB TYR 52 3.397 -3.560 -3.539
407 HB3 TYR 52 3HB TYR 52 4.816 -4.431 -4.124
408 HD1 TYR 52 HD2 TYR 52 2.888 -4.154 -0.851
409 HD2 TYR 52 HD1 TYR 52 4.904 -6.632 -3.740
410 HE1 TYR 52 HE2 TYR 52 2.171 -6.216 0.387
411 HE2 TYR 52 HE1 TYR 52 4.179 -8.666 -2.514
412 HH TYR 52 HH TYR 52 3.099 -9.495 -0.689
413 H HIS 53 H HIS 53 5.679 -2.003 -5.056
414 HA HIS 53 HA HIS 53 5.036 0.796 -4.787
415 HB2 HIS 53 2HB HIS 53 4.642 -1.057 -7.170
416 HB3 HIS 53 3HB HIS 53 4.528 0.670 -7.231
417 HD2 HIS 53 HD2 HIS 53 6.826 2.105 -6.637
418 HE1 HIS 53 HE1 HIS 53 9.425 -0.916 -8.137
419 HE2 HIS 53 HE2 HIS 53 9.246 1.536 -7.519
420 H PHE 54 H PHE 54 3.019 1.933 -5.393
421 HA PHE 54 HA PHE 54 0.737 0.937 -4.078
422 HB2 PHE 54 2HB PHE 54 0.905 3.265 -4.438
423 HB3 PHE 54 3HB PHE 54 1.077 3.082 -6.181
424 HD1 PHE 54 HD1 PHE 54 -1.414 2.229 -3.439
425 HD2 PHE 54 HD2 PHE 54 -0.804 3.499 -7.521
426 HE1 PHE 54 HE1 PHE 54 -3.864 2.319 -3.783
427 HE2 PHE 54 HE2 PHE 54 -3.272 3.648 -7.822
428 HZ PHE 54 HZ PHE 54 -4.787 3.009 -5.972
429 H SER 55 H SER 55 1.602 0.654 -7.573
430 HA SER 55 HA SER 55 -0.929 -0.592 -8.319
431 HB2 SER 55 2HB SER 55 0.253 -0.927 -10.495
432 HB3 SER 55 3HB SER 55 0.188 0.758 -9.944
433 HG SER 55 HG SER 55 2.287 0.173 -10.684
434 H CYS 56 HN CYS 56 2.408 -1.717 -7.649
435 HA CYS 56 HA CYS 56 2.120 -4.347 -8.399
436 HB2 CYS 56 2HB CYS 56 3.838 -3.057 -6.277
437 HB3 CYS 56 3HB CYS 56 3.960 -4.766 -6.675
438 H PHE 57 H PHE 57 1.147 -2.915 -5.292
439 HA PHE 57 HA PHE 57 0.534 -5.161 -3.714
440 HB2 PHE 57 2HB PHE 57 0.405 -2.892 -2.924
441 HB3 PHE 57 3HB PHE 57 -0.927 -2.527 -4.016
442 HD1 PHE 57 HD1 PHE 57 -3.155 -3.614 -3.703
443 HD2 PHE 57 HD2 PHE 57 0.014 -4.085 -0.826
444 HE1 PHE 57 HE1 PHE 57 -4.798 -4.441 -2.050
445 HE2 PHE 57 HE2 PHE 57 -1.648 -4.848 0.857
446 HZ PHE 57 HZ PHE 57 -4.052 -5.048 0.241
447 H TRP 58 H TRP 58 -1.619 -3.572 -6.126
448 HA TRP 58 HA TRP 58 -3.707 -5.559 -5.861
449 HB2 TRP 58 2HB TRP 58 -3.331 -3.580 -8.122
450 HB3 TRP 58 3HB TRP 58 -4.822 -4.345 -7.569
451 HD1 TRP 58 HD1 TRP 58 -2.544 -1.436 -6.950
452 HE1 TRP 58 HE1 TRP 58 -3.335 0.033 -5.020
453 HE3 TRP 58 HE3 TRP 58 -6.383 -4.372 -5.268
454 HZ2 TRP 58 HZ2 TRP 58 -5.468 -0.017 -3.017
455 HZ3 TRP 58 HZ3 TRP 58 -7.776 -3.627 -3.361
456 HH2 TRP 58 HH2 TRP 58 -7.302 -1.446 -2.236
457 H LYS 59 H LYS 59 -0.926 -5.173 -7.985
458 HA LYS 59 HA LYS 59 -1.525 -7.256 -9.874
459 HB2 LYS 59 2HB LYS 59 0.083 -5.300 -10.057
460 HB3 LYS 59 3HB LYS 59 1.159 -6.190 -8.972
461 HG2 LYS 59 2HG LYS 59 1.502 -7.928 -10.593
462 HG3 LYS 59 3HG LYS 59 0.210 -7.284 -11.626
463 HD2 LYS 59 2HD LYS 59 2.399 -6.647 -12.544
464 HD3 LYS 59 3HD LYS 59 1.502 -5.226 -12.003
465 HE2 LYS 59 2HE LYS 59 2.846 -5.548 -9.753
466 HE3 LYS 59 3HE LYS 59 3.918 -6.561 -10.714
467 HZ1 LYS 59 3HZ LYS 59 4.455 -4.662 -12.054
468 HZ2 LYS 59 1HZ LYS 59 3.217 -3.768 -11.450
469 HZ3 LYS 59 2HZ LYS 59 4.467 -4.124 -10.487
470 H VAL 60 H VAL 60 -0.331 -7.427 -6.529
471 HA VAL 60 HA VAL 60 0.444 -10.246 -6.761
472 HB VAL 60 HB VAL 60 -0.624 -9.082 -4.210
473 HG11 VAL 60 1HG1 VAL 60 1.589 -11.092 -4.837
474 HG12 VAL 60 2HG1 VAL 60 1.155 -10.548 -3.208
475 HG13 VAL 60 3HG1 VAL 60 -0.008 -11.466 -4.150
476 HG21 VAL 60 3HG2 VAL 60 1.713 -8.398 -3.605
477 HG22 VAL 60 1HG2 VAL 60 2.144 -8.547 -5.326
478 HG23 VAL 60 2HG2 VAL 60 0.927 -7.374 -4.773
479 H GLY 61 H GLY 61 -2.624 -8.640 -6.760
480 HA2 GLY 61 2HA GLY 61 -4.671 -9.639 -7.270
481 HA3 GLY 61 3HA GLY 61 -4.095 -11.209 -6.715
482 H HIS 62 H HIS 62 -3.552 -8.533 -4.526
483 HA HIS 62 HA HIS 62 -5.344 -9.654 -2.532
484 HB2 HIS 62 2HB HIS 62 -3.682 -7.125 -2.535
485 HB3 HIS 62 3HB HIS 62 -4.598 -7.726 -1.151
486 HD2 HIS 62 HD2 HIS 62 -1.221 -7.746 -2.352
487 HE1 HIS 62 HE1 HIS 62 -1.476 -11.511 -0.365
488 HE2 HIS 62 HE2 HIS 62 0.118 -9.790 -1.352
489 H SER 63 H SER 63 -7.079 -8.653 -1.493
490 HA SER 63 HA SER 63 -8.532 -6.472 -2.919
491 HB2 SER 63 2HB SER 63 -9.724 -9.132 -2.037
492 HB3 SER 63 3HB SER 63 -10.648 -7.728 -2.601
493 HG SER 63 HG SER 63 -10.250 -9.267 -4.274
494 H ILE 64 H ILE 64 -9.868 -5.230 -1.690
495 HA ILE 64 HA ILE 64 -9.615 -5.419 1.280
496 HB ILE 64 HB ILE 64 -9.279 -2.848 -0.277
497 HG12 ILE 64 2HG1 ILE 64 -7.066 -4.773 0.468
498 HG13 ILE 64 3HG1 ILE 64 -7.446 -4.095 -1.101
499 HG21 ILE 64 1HG2 ILE 64 -8.501 -3.671 2.547
500 HG22 ILE 64 2HG2 ILE 64 -8.284 -2.063 1.843
501 HG23 ILE 64 3HG2 ILE 64 -9.915 -2.686 2.108
502 HD11 ILE 64 3HD1 ILE 64 -6.125 -2.730 1.238
503 HD12 ILE 64 1HD1 ILE 64 -5.552 -2.903 -0.420
504 HD13 ILE 64 2HD1 ILE 64 -6.877 -1.787 -0.069
505 H ARG 65 H ARG 65 -11.469 -4.807 2.393
506 HA ARG 65 HA ARG 65 -13.810 -3.977 0.722
507 HB2 ARG 65 2HB ARG 65 -15.281 -5.538 1.653
508 HB3 ARG 65 3HB ARG 65 -13.931 -6.368 0.916
509 HG2 ARG 65 2HG ARG 65 -14.266 -5.958 3.935
510 HG3 ARG 65 3HG ARG 65 -14.796 -7.363 3.018
511 HD2 ARG 65 2HD ARG 65 -12.278 -7.419 2.192
512 HD3 ARG 65 3HD ARG 65 -11.997 -6.497 3.671
513 HE ARG 65 HE ARG 65 -13.643 -8.906 4.010
514 HH11 ARG 65 1HH2 ARG 65 -10.313 -7.742 4.370
515 HH12 ARG 65 2HH2 ARG 65 -9.801 -9.292 4.967
516 HH21 ARG 65 1HH1 ARG 65 -12.896 -10.746 4.934
517 HH22 ARG 65 2HH1 ARG 65 -11.219 -10.890 5.365
518 H HIS 66 H HIS 66 -12.173 -3.486 3.654
519 HA HIS 66 HA HIS 66 -13.871 -1.134 4.074
520 HB2 HIS 66 2HB HIS 66 -13.918 -1.354 6.500
521 HB3 HIS 66 3HB HIS 66 -14.936 -2.487 5.640
522 HD2 HIS 66 HD2 HIS 66 -12.786 -4.913 5.251
523 HE1 HIS 66 HE1 HIS 66 -12.959 -5.032 9.485
524 HE2 HIS 66 HE2 HIS 66 -12.333 -6.334 7.399
525 HA PRO 67 HA PRO 67 -9.357 -0.888 3.583
526 HB2 PRO 67 2HB PRO 67 -9.230 1.407 1.973
527 HB3 PRO 67 3HB PRO 67 -9.498 -0.243 1.350
528 HG2 PRO 67 2HG PRO 67 -11.585 1.818 2.079
529 HG3 PRO 67 3HG PRO 67 -11.462 0.855 0.562
530 HD2 PRO 67 2HD PRO 67 -13.124 0.099 2.505
531 HD3 PRO 67 3HD PRO 67 -12.093 -1.142 1.722
532 H ASP 68 H ASP 68 -11.418 1.838 4.627
533 HA ASP 68 HA ASP 68 -9.181 3.273 5.790
534 HB2 ASP 68 2HB ASP 68 -10.965 4.672 6.838
535 HB3 ASP 68 3HB ASP 68 -11.038 4.556 5.087
536 H VAL 69 H VAL 69 -10.694 0.434 6.708
537 HA VAL 69 HA VAL 69 -9.822 0.674 9.539
538 HB VAL 69 HB VAL 69 -11.382 -1.601 8.277
539 HG11 VAL 69 1HG1 VAL 69 -11.983 -2.123 10.613
540 HG12 VAL 69 2HG1 VAL 69 -10.237 -2.193 10.367
541 HG13 VAL 69 3HG1 VAL 69 -10.959 -0.784 11.180
542 HG21 VAL 69 3HG2 VAL 69 -13.395 -0.652 9.389
543 HG22 VAL 69 1HG2 VAL 69 -12.467 0.815 9.782
544 HG23 VAL 69 2HG2 VAL 69 -12.795 0.374 8.089
545 H GLU 70 H GLU 70 -9.460 -1.317 6.596
546 HA GLU 70 HA GLU 70 -7.473 -3.097 7.834
547 HB2 GLU 70 2HB GLU 70 -8.398 -2.791 4.932
548 HB3 GLU 70 3HB GLU 70 -7.416 -4.116 5.553
549 HG2 GLU 70 2HG GLU 70 -9.246 -4.934 6.917
550 HG3 GLU 70 3HG GLU 70 -10.256 -3.560 6.464
551 H VAL 71 H VAL 71 -7.268 -0.360 5.625
552 HA VAL 71 HA VAL 71 -4.360 -0.767 5.144
553 HB VAL 71 HB VAL 71 -6.106 1.433 4.055
554 HG11 VAL 71 1HG1 VAL 71 -3.427 0.220 3.256
555 HG12 VAL 71 2HG1 VAL 71 -4.262 1.606 2.504
556 HG13 VAL 71 3HG1 VAL 71 -3.632 1.729 4.166
557 HG21 VAL 71 3HG2 VAL 71 -6.063 0.056 1.963
558 HG22 VAL 71 1HG2 VAL 71 -5.325 -1.280 2.884
559 HG23 VAL 71 2HG2 VAL 71 -6.973 -0.747 3.248
560 H ASP 72 H ASP 72 -3.477 -0.521 7.069
561 HA ASP 72 HA ASP 72 -3.722 1.706 8.859
562 HB2 ASP 72 2HB ASP 72 -2.722 -0.472 9.339
563 HB3 ASP 72 3HB ASP 72 -1.437 -0.182 8.171
564 H GLY 73 H GLY 73 -2.721 3.720 8.819
565 HA2 GLY 73 2HA GLY 73 -1.425 5.501 8.050
566 HA3 GLY 73 3HA GLY 73 -0.732 4.467 6.802
567 H PHE 74 H PHE 74 -4.030 4.102 6.412
568 HA PHE 74 HA PHE 74 -4.345 5.764 4.124
569 HB2 PHE 74 2HB PHE 74 -5.718 3.813 4.688
570 HB3 PHE 74 3HB PHE 74 -6.376 4.640 6.095
571 HD1 PHE 74 HD1 PHE 74 -6.308 4.518 2.382
572 HD2 PHE 74 HD2 PHE 74 -8.209 6.212 5.866
573 HE1 PHE 74 HE1 PHE 74 -8.197 5.316 0.975
574 HE2 PHE 74 HE2 PHE 74 -10.097 6.999 4.447
575 HZ PHE 74 HZ PHE 74 -10.088 6.546 2.012
576 H SER 75 H SER 75 -4.729 6.509 7.556
577 HA SER 75 HA SER 75 -5.942 9.109 7.332
578 HB2 SER 75 2HB SER 75 -4.977 9.321 9.675
579 HB3 SER 75 3HB SER 75 -6.084 7.959 9.405
580 HG SER 75 HG SER 75 -4.162 7.349 10.545
581 H GLU 76 H GLU 76 -2.650 8.040 6.743
582 HA GLU 76 HA GLU 76 -1.472 10.690 7.247
583 HB2 GLU 76 2HB GLU 76 -0.233 8.181 6.042
584 HB3 GLU 76 3HB GLU 76 0.618 9.653 6.489
585 HG2 GLU 76 2HG GLU 76 0.019 9.331 8.858
586 HG3 GLU 76 3HG GLU 76 -0.897 7.877 8.451
587 H LEU 77 H LEU 77 -3.040 9.126 4.627
588 HA LEU 77 HA LEU 77 -1.784 10.599 2.435
589 HB2 LEU 77 2HB LEU 77 -4.377 9.028 2.581
590 HB3 LEU 77 3HB LEU 77 -3.635 9.632 1.108
591 HG LEU 77 HG LEU 77 -2.484 7.477 2.934
592 HD11 LEU 77 1HD1 LEU 77 -4.451 6.762 1.648
593 HD12 LEU 77 2HD1 LEU 77 -3.752 7.423 0.155
594 HD13 LEU 77 3HD1 LEU 77 -2.992 6.040 0.949
595 HD21 LEU 77 3HD2 LEU 77 -0.660 8.742 1.844
596 HD22 LEU 77 1HD2 LEU 77 -0.821 7.119 1.169
597 HD23 LEU 77 2HD2 LEU 77 -1.454 8.516 0.268
598 H ARG 78 H ARG 78 -2.895 12.102 1.062
599 HA ARG 78 HA ARG 78 -4.876 13.877 2.393
600 HB2 ARG 78 2HB ARG 78 -3.357 14.079 -0.248
601 HB3 ARG 78 3HB ARG 78 -4.654 15.181 0.171
602 HG2 ARG 78 2HG ARG 78 -2.126 14.808 1.833
603 HG3 ARG 78 3HG ARG 78 -2.422 16.111 0.676
604 HD2 ARG 78 2HD ARG 78 -4.440 16.797 1.982
605 HD3 ARG 78 3HD ARG 78 -4.080 15.581 3.193
606 HE ARG 78 HE ARG 78 -2.711 18.139 2.773
607 HH11 ARG 78 1HH2 ARG 78 -2.367 15.013 4.334
608 HH12 ARG 78 2HH2 ARG 78 -1.170 15.607 5.450
609 HH21 ARG 78 1HH1 ARG 78 -1.186 18.819 4.229
610 HH22 ARG 78 2HH1 ARG 78 -0.526 17.705 5.390
611 H TRP 79 H TRP 79 -6.720 14.604 1.213
612 HA TRP 79 HA TRP 79 -8.476 12.504 1.143
613 HB2 TRP 79 2HB TRP 79 -9.696 14.306 1.567
614 HB3 TRP 79 3HB TRP 79 -8.596 15.379 0.731
615 HD1 TRP 79 HD1 TRP 79 -11.888 13.578 0.248
616 HE1 TRP 79 HE1 TRP 79 -12.991 14.374 -1.933
617 HE3 TRP 79 HE3 TRP 79 -7.994 16.270 -1.672
618 HZ2 TRP 79 HZ2 TRP 79 -12.246 15.947 -4.252
619 HZ3 TRP 79 HZ3 TRP 79 -8.198 17.404 -3.868
620 HH2 TRP 79 HH2 TRP 79 -10.321 17.253 -5.169
621 H ASP 80 H ASP 80 -6.969 13.985 -1.753
622 HA ASP 80 HA ASP 80 -8.584 12.606 -3.667
623 HB2 ASP 80 2HB ASP 80 -7.281 14.671 -4.096
624 HB3 ASP 80 3HB ASP 80 -5.782 13.760 -3.930
625 H ASP 81 H ASP 81 -5.718 11.552 -1.913
626 HA ASP 81 HA ASP 81 -5.252 9.207 -3.656
627 HB2 ASP 81 2HB ASP 81 -3.833 10.268 -1.193
628 HB3 ASP 81 3HB ASP 81 -3.487 8.697 -1.919
629 H GLN 82 H GLN 82 -6.600 10.063 -0.431
630 HA GLN 82 HA GLN 82 -7.392 7.436 0.331
631 HB2 GLN 82 2HB GLN 82 -8.632 10.172 0.798
632 HB3 GLN 82 3HB GLN 82 -9.308 8.703 1.481
633 HG2 GLN 82 2HG GLN 82 -7.199 8.236 2.657
634 HG3 GLN 82 3HG GLN 82 -6.465 9.680 1.954
635 HE21 GLN 82 2HE2 GLN 82 -6.530 9.346 4.720
636 HE22 GLN 82 1HE2 GLN 82 -7.623 10.567 5.385
637 H GLN 83 H GLN 83 -9.123 9.837 -1.781
638 HA GLN 83 HA GLN 83 -11.354 8.129 -2.304
639 HB2 GLN 83 2HB GLN 83 -10.183 10.201 -4.211
640 HB3 GLN 83 3HB GLN 83 -11.770 9.463 -4.298
641 HG2 GLN 83 2HG GLN 83 -10.836 11.714 -2.621
642 HG3 GLN 83 3HG GLN 83 -12.352 11.472 -3.434
643 HE21 GLN 83 2HE2 GLN 83 -10.663 11.146 -0.428
644 HE22 GLN 83 1HE2 GLN 83 -12.025 10.493 0.498
645 H LYS 84 H LYS 84 -8.137 8.231 -3.870
646 HA LYS 84 HA LYS 84 -8.935 6.554 -6.112
647 HB2 LYS 84 2HB LYS 84 -7.456 8.407 -6.439
648 HB3 LYS 84 3HB LYS 84 -6.394 7.904 -5.137
649 HG2 LYS 84 2HG LYS 84 -6.762 6.103 -7.528
650 HG3 LYS 84 3HG LYS 84 -5.760 7.543 -7.673
651 HD2 LYS 84 2HD LYS 84 -5.375 5.333 -5.633
652 HD3 LYS 84 3HD LYS 84 -4.426 5.562 -7.107
653 HE2 LYS 84 2HE LYS 84 -4.507 7.335 -4.634
654 HE3 LYS 84 3HE LYS 84 -3.199 6.271 -5.125
655 HZ1 LYS 84 3HZ LYS 84 -4.077 8.596 -6.752
656 HZ2 LYS 84 1HZ LYS 84 -2.884 8.667 -5.651
657 HZ3 LYS 84 2HZ LYS 84 -2.723 7.696 -6.979
658 H VAL 85 H VAL 85 -7.140 6.158 -3.027
659 HA VAL 85 HA VAL 85 -6.474 3.360 -3.500
660 HB VAL 85 HB VAL 85 -6.788 4.964 -0.934
661 HG11 VAL 85 1HG1 VAL 85 -7.194 2.624 -0.310
662 HG12 VAL 85 2HG1 VAL 85 -5.764 2.097 -1.230
663 HG13 VAL 85 3HG1 VAL 85 -5.583 3.103 0.218
664 HG21 VAL 85 3HG2 VAL 85 -4.389 4.954 -0.849
665 HG22 VAL 85 1HG2 VAL 85 -4.264 3.807 -2.188
666 HG23 VAL 85 2HG2 VAL 85 -4.812 5.462 -2.488
667 H LYS 86 H LYS 86 -9.327 4.943 -1.914
668 HA LYS 86 HA LYS 86 -10.687 2.419 -1.487
669 HB2 LYS 86 2HB LYS 86 -11.784 5.264 -1.602
670 HB3 LYS 86 3HB LYS 86 -12.718 3.821 -1.175
671 HG2 LYS 86 2HG LYS 86 -10.904 3.362 0.608
672 HG3 LYS 86 3HG LYS 86 -10.319 4.969 0.296
673 HD2 LYS 86 2HD LYS 86 -11.709 4.917 2.288
674 HD3 LYS 86 3HD LYS 86 -12.459 5.946 1.051
675 HE2 LYS 86 2HE LYS 86 -14.076 4.262 0.528
676 HE3 LYS 86 3HE LYS 86 -13.176 3.024 1.422
677 HZ1 LYS 86 3HZ LYS 86 -15.144 3.899 2.637
678 HZ2 LYS 86 1HZ LYS 86 -13.768 4.050 3.488
679 HZ3 LYS 86 2HZ LYS 86 -14.433 5.363 2.745
680 H LYS 87 H LYS 87 -10.860 4.734 -4.228
681 HA LYS 87 HA LYS 87 -12.753 3.183 -5.761
682 HB2 LYS 87 2HB LYS 87 -10.613 5.222 -6.473
683 HB3 LYS 87 3HB LYS 87 -11.503 4.400 -7.742
684 HG2 LYS 87 2HG LYS 87 -12.968 5.800 -5.478
685 HG3 LYS 87 3HG LYS 87 -12.423 6.682 -6.914
686 HD2 LYS 87 2HD LYS 87 -13.711 5.355 -8.388
687 HD3 LYS 87 3HD LYS 87 -14.071 4.138 -7.169
688 HE2 LYS 87 2HE LYS 87 -15.089 7.015 -7.101
689 HE3 LYS 87 3HE LYS 87 -16.001 5.623 -7.696
690 HZ1 LYS 87 3HZ LYS 87 -15.718 4.616 -5.437
691 HZ2 LYS 87 1HZ LYS 87 -15.077 6.021 -4.908
692 HZ3 LYS 87 2HZ LYS 87 -16.623 5.985 -5.433
693 H THR 88 H THR 88 -9.211 3.001 -5.675
694 HA THR 88 HA THR 88 -9.007 0.871 -7.533
695 HB THR 88 HB THR 88 -7.047 1.514 -5.316
696 HG1 THR 88 1HG THR 88 -7.398 3.300 -6.600
697 HG21 THR 88 1HG2 THR 88 -6.804 0.199 -8.042
698 HG22 THR 88 2HG2 THR 88 -5.441 0.590 -6.972
699 HG23 THR 88 3HG2 THR 88 -6.627 -0.644 -6.496
700 H ALA 89 H ALA 89 -9.717 0.790 -4.040
701 HA ALA 89 HA ALA 89 -9.507 -2.084 -3.783
702 HB1 ALA 89 1HB ALA 89 -10.962 -0.018 -2.081
703 HB2 ALA 89 2HB ALA 89 -10.603 -1.687 -1.630
704 HB3 ALA 89 3HB ALA 89 -9.274 -0.527 -1.874
705 H GLU 90 H GLU 90 -12.175 0.205 -4.531
706 HA GLU 90 HA GLU 90 -14.188 -1.832 -4.794
707 HB2 GLU 90 2HB GLU 90 -13.970 0.950 -6.011
708 HB3 GLU 90 3HB GLU 90 -15.370 -0.099 -6.217
709 HG2 GLU 90 2HG GLU 90 -15.715 -0.161 -3.772
710 HG3 GLU 90 3HG GLU 90 -14.353 0.932 -3.540
711 H ALA 91 H ALA 91 -11.869 -0.449 -7.081
712 HA ALA 91 HA ALA 91 -12.843 -1.821 -9.413
713 HB1 ALA 91 1HB ALA 91 -10.231 -0.354 -8.814
714 HB2 ALA 91 2HB ALA 91 -10.843 -0.766 -10.432
715 HB3 ALA 91 3HB ALA 91 -11.721 0.392 -9.406
716 H GLY 92 H GLY 92 -10.570 -2.757 -6.916
717 HA2 GLY 92 2HA GLY 92 -9.455 -4.742 -6.535
718 HA3 GLY 92 3HA GLY 92 -10.117 -5.422 -8.025
719 H GLY 93 H GLY 93 -8.477 -2.364 -8.341
720 HA2 GLY 93 2HA GLY 93 -5.855 -2.654 -8.632
721 HA3 GLY 93 3HA GLY 93 -6.387 -3.594 -10.032
722 H VAL 94 H VAL 94 -4.885 -1.061 -9.770
723 HA VAL 94 HA VAL 94 -6.635 1.067 -10.715
724 HB VAL 94 HB VAL 94 -4.853 1.555 -9.170
725 HG11 VAL 94 1HG1 VAL 94 -2.879 0.966 -11.412
726 HG12 VAL 94 2HG1 VAL 94 -2.505 1.663 -9.823
727 HG13 VAL 94 3HG1 VAL 94 -3.088 -0.002 -9.936
728 HG21 VAL 94 3HG2 VAL 94 -4.357 2.971 -11.812
729 HG22 VAL 94 1HG2 VAL 94 -5.719 3.303 -10.711
730 HG23 VAL 94 2HG2 VAL 94 -4.055 3.588 -10.180
731 H THR 95 H THR 95 -6.793 2.007 -12.691
732 HA THR 95 HA THR 95 -6.115 0.256 -14.971
733 HB THR 95 HB THR 95 -7.851 1.595 -16.136
734 HG1 THR 95 1HG THR 95 -9.030 3.075 -14.900
735 HG21 THR 95 1HG2 THR 95 -8.492 -0.432 -14.815
736 HG22 THR 95 2HG2 THR 95 -8.784 0.603 -13.400
737 HG23 THR 95 3HG2 THR 95 -9.776 0.789 -14.863
738 H GLY 96 H GLY 96 -5.161 3.407 -13.849
739 HA2 GLY 96 2HA GLY 96 -4.103 4.132 -16.485
740 HA3 GLY 96 3HA GLY 96 -4.037 5.120 -15.024
741 H LYS 97 H LYS 97 -1.915 4.710 -16.874
742 HA LYS 97 HA LYS 97 0.112 3.002 -15.534
743 HB2 LYS 97 2HB LYS 97 0.249 4.707 -18.056
744 HB3 LYS 97 3HB LYS 97 1.570 3.719 -17.420
745 HG2 LYS 97 2HG LYS 97 0.175 1.676 -17.657
746 HG3 LYS 97 3HG LYS 97 -1.138 2.655 -18.340
747 HD2 LYS 97 2HD LYS 97 0.351 3.357 -20.200
748 HD3 LYS 97 3HD LYS 97 1.656 2.353 -19.527
749 HE2 LYS 97 2HE LYS 97 0.221 0.337 -19.763
750 HE3 LYS 97 3HE LYS 97 -1.079 1.335 -20.427
751 HZ1 LYS 97 3HZ LYS 97 0.213 0.278 -22.192
752 HZ2 LYS 97 1HZ LYS 97 0.393 1.896 -22.290
753 HZ3 LYS 97 2HZ LYS 97 1.595 0.974 -21.677
754 H GLY 98 H GLY 98 2.088 3.793 -14.740
755 HA2 GLY 98 2HA GLY 98 3.033 6.403 -14.545
756 HA3 GLY 98 3HA GLY 98 1.892 6.245 -13.209
757 H GLN 99 H GLN 99 3.782 6.699 -11.932
758 HA GLN 99 HA GLN 99 5.479 6.248 -10.556
759 HB2 GLN 99 2HB GLN 99 3.531 4.924 -9.696
760 HB3 GLN 99 3HB GLN 99 4.299 3.461 -10.332
761 HG2 GLN 99 2HG GLN 99 6.231 3.793 -8.858
762 HG3 GLN 99 3HG GLN 99 5.687 5.415 -8.448
763 HE21 GLN 99 2HE2 GLN 99 5.634 5.058 -6.235
764 HE22 GLN 99 1HE2 GLN 99 4.441 4.016 -5.489
765 H ASP 100 H ASP 100 6.637 6.405 -12.799
766 HA ASP 100 HA ASP 100 8.398 4.153 -13.425
767 HB2 ASP 100 2HB ASP 100 7.628 5.801 -15.113
768 HB3 ASP 100 3HB ASP 100 8.491 7.076 -14.251
769 H GLY 101 H GLY 101 10.765 4.354 -13.307
770 HA2 GLY 101 2HA GLY 101 12.796 5.023 -12.351
771 HA3 GLY 101 3HA GLY 101 11.960 6.065 -11.211
772 H ILE 102 H ILE 102 13.985 4.766 -10.230
773 HA ILE 102 HA ILE 102 12.923 2.664 -8.446
774 HB ILE 102 HB ILE 102 13.823 1.431 -10.329
775 HG12 ILE 102 2HG1 ILE 102 15.665 1.235 -7.905
776 HG13 ILE 102 3HG1 ILE 102 14.045 0.550 -8.046
777 HG21 ILE 102 1HG2 ILE 102 16.549 2.703 -9.836
778 HG22 ILE 102 2HG2 ILE 102 16.126 1.505 -11.072
779 HG23 ILE 102 3HG2 ILE 102 15.469 3.129 -11.180
780 HD11 ILE 102 3HD1 ILE 102 14.867 -0.853 -9.964
781 HD12 ILE 102 1HD1 ILE 102 16.511 -0.259 -9.628
782 HD13 ILE 102 2HD1 ILE 102 15.645 -1.202 -8.406
783 H GLY 103 H GLY 103 13.707 2.736 -6.425
784 HA2 GLY 103 2HA GLY 103 14.936 3.344 -4.565
785 HA3 GLY 103 3HA GLY 103 16.317 3.512 -5.644
786 H SER 104 H SER 104 16.879 5.202 -3.995
787 HA SER 104 HA SER 104 16.140 7.869 -4.971
788 HB2 SER 104 2HB SER 104 15.546 7.072 -2.088
789 HB3 SER 104 3HB SER 104 15.516 8.726 -2.721
790 HG SER 104 HG SER 104 14.081 7.108 -4.307
791 H LYS 105 H LYS 105 17.489 9.539 -4.264
792 HA LYS 105 HA LYS 105 20.144 8.915 -3.208
793 HB2 LYS 105 2HB LYS 105 19.769 10.705 -4.862
794 HB3 LYS 105 3HB LYS 105 18.710 11.553 -3.726
795 HG2 LYS 105 2HG LYS 105 20.630 11.869 -2.174
796 HG3 LYS 105 3HG LYS 105 21.673 10.960 -3.274
797 HD2 LYS 105 2HD LYS 105 22.038 13.362 -3.468
798 HD3 LYS 105 3HD LYS 105 21.424 12.711 -4.992
799 HE2 LYS 105 2HE LYS 105 19.277 13.677 -4.691
800 HE3 LYS 105 3HE LYS 105 19.516 13.886 -2.948
801 HZ1 LYS 105 3HZ LYS 105 21.072 15.605 -3.330
802 HZ2 LYS 105 1HZ LYS 105 21.051 15.413 -4.970
803 HZ3 LYS 105 2HZ LYS 105 19.732 15.987 -4.184
804 H ALA 106 H ALA 106 20.877 9.136 -1.160
805 HA ALA 106 HA ALA 106 18.936 9.170 1.000
806 HB1 ALA 106 1HB ALA 106 21.953 8.764 1.006
807 HB2 ALA 106 2HB ALA 106 20.841 8.422 2.349
808 HB3 ALA 106 3HB ALA 106 20.720 7.491 0.846
809 H GLU 107 H GLU 107 18.499 11.538 0.266
810 HA GLU 107 HA GLU 107 18.363 13.735 0.792
811 HB2 GLU 107 2HB GLU 107 19.286 12.833 3.530
812 HB3 GLU 107 3HB GLU 107 18.338 14.268 3.163
813 HG2 GLU 107 2HG GLU 107 17.371 11.406 2.741
814 HG3 GLU 107 3HG GLU 107 17.025 12.408 4.136
815 H LYS 108 H LYS 108 21.116 12.905 -0.141
816 HA LYS 108 HA LYS 108 22.967 14.743 1.132
817 HB2 LYS 108 2HB LYS 108 23.695 12.560 0.240
818 HB3 LYS 108 3HB LYS 108 23.207 13.047 -1.383
819 HG2 LYS 108 2HG LYS 108 25.583 13.256 -1.247
820 HG3 LYS 108 3HG LYS 108 24.909 14.866 -1.344
821 HD2 LYS 108 2HD LYS 108 25.115 14.490 1.436
822 HD3 LYS 108 3HD LYS 108 26.452 13.532 0.820
823 HE2 LYS 108 2HE LYS 108 27.424 15.643 1.126
824 HE3 LYS 108 3HE LYS 108 27.069 15.608 -0.604
825 HZ1 LYS 108 3HZ LYS 108 26.284 17.684 0.243
826 HZ2 LYS 108 1HZ LYS 108 24.913 16.801 0.025
827 HZ3 LYS 108 2HZ LYS 108 25.529 17.001 1.516
Start of MODEL 6
1 H1 MET 1 H1 MET 1 -5.926 -2.790 27.120
2 H2 MET 1 H2 MET 1 -4.806 -3.137 28.259
3 H3 MET 1 H3 MET 1 -5.357 -4.314 27.258
4 HA MET 1 HA MET 1 -3.783 -1.966 26.426
5 HB2 MET 1 2HB MET 1 -2.960 -4.903 26.591
6 HB3 MET 1 3HB MET 1 -2.021 -3.634 25.804
7 HG2 MET 1 2HG MET 1 -2.696 -3.780 28.762
8 HG3 MET 1 3HG MET 1 -1.136 -4.077 28.007
9 HE1 MET 1 1HE MET 1 -1.505 -2.171 30.502
10 HE2 MET 1 2HE MET 1 0.057 -2.476 29.708
11 HE3 MET 1 3HE MET 1 -0.463 -0.809 30.036
12 H ALA 2 H ALA 2 -3.170 -1.918 24.188
13 HA ALA 2 HA ALA 2 -4.613 -3.657 22.288
14 HB1 ALA 2 1HB ALA 2 -5.541 -1.708 21.084
15 HB2 ALA 2 2HB ALA 2 -6.182 -1.794 22.734
16 HB3 ALA 2 3HB ALA 2 -4.908 -0.618 22.336
17 H GLU 3 H GLU 3 -3.832 -3.393 20.068
18 HA GLU 3 HA GLU 3 -1.119 -2.176 19.770
19 HB2 GLU 3 2HB GLU 3 -1.870 -5.047 19.079
20 HB3 GLU 3 3HB GLU 3 -0.380 -4.235 18.589
21 HG2 GLU 3 2HG GLU 3 0.227 -3.912 20.984
22 HG3 GLU 3 3HG GLU 3 -1.226 -4.794 21.465
23 H SER 4 H SER 4 -0.672 -1.326 17.833
24 HA SER 4 HA SER 4 -2.801 -0.848 15.945
25 HB2 SER 4 2HB SER 4 0.156 -0.162 15.821
26 HB3 SER 4 3HB SER 4 -1.125 0.542 14.810
27 HG SER 4 HG SER 4 -0.606 1.869 16.622
28 H SER 5 H SER 5 -0.845 -3.510 16.174
29 HA SER 5 HA SER 5 -0.310 -3.934 13.303
30 HB2 SER 5 2HB SER 5 0.453 -5.644 15.693
31 HB3 SER 5 3HB SER 5 1.075 -5.787 14.038
32 HG SER 5 HG SER 5 2.496 -4.608 15.429
33 H ASP 6 H ASP 6 -3.023 -4.431 14.962
34 HA ASP 6 HA ASP 6 -3.597 -7.068 13.898
35 HB2 ASP 6 2HB ASP 6 -4.441 -6.324 16.114
36 HB3 ASP 6 3HB ASP 6 -5.437 -5.106 15.315
37 H LYS 7 H LYS 7 -2.811 -5.787 11.803
38 HA LYS 7 HA LYS 7 -5.136 -5.083 10.097
39 HB2 LYS 7 2HB LYS 7 -2.307 -3.916 10.044
40 HB3 LYS 7 3HB LYS 7 -3.658 -3.410 9.034
41 HG2 LYS 7 2HG LYS 7 -3.472 -3.062 12.061
42 HG3 LYS 7 3HG LYS 7 -3.128 -1.825 10.871
43 HD2 LYS 7 2HD LYS 7 -5.434 -1.813 10.096
44 HD3 LYS 7 3HD LYS 7 -5.842 -3.192 11.139
45 HE2 LYS 7 2HE LYS 7 -5.175 -1.844 13.143
46 HE3 LYS 7 3HE LYS 7 -4.901 -0.456 12.079
47 HZ1 LYS 7 3HZ LYS 7 -7.129 -0.286 12.927
48 HZ2 LYS 7 1HZ LYS 7 -7.281 -0.741 11.350
49 HZ3 LYS 7 2HZ LYS 7 -7.491 -1.834 12.541
50 H LEU 8 H LEU 8 -4.555 -5.363 7.818
51 HA LEU 8 HA LEU 8 -2.610 -7.607 7.308
52 HB2 LEU 8 2HB LEU 8 -5.039 -6.687 5.700
53 HB3 LEU 8 3HB LEU 8 -4.020 -8.067 5.314
54 HG LEU 8 HG LEU 8 -5.803 -7.859 7.789
55 HD11 LEU 8 1HD1 LEU 8 -6.166 -9.313 5.147
56 HD12 LEU 8 2HD1 LEU 8 -7.258 -9.402 6.558
57 HD13 LEU 8 3HD1 LEU 8 -7.041 -7.863 5.692
58 HD21 LEU 8 3HD2 LEU 8 -4.241 -10.192 6.597
59 HD22 LEU 8 1HD2 LEU 8 -3.888 -9.365 8.131
60 HD23 LEU 8 2HD2 LEU 8 -5.386 -10.295 7.956
61 H TYR 9 H TYR 9 -3.364 -4.283 6.691
62 HA TYR 9 HA TYR 9 -1.626 -4.235 4.280
63 HB2 TYR 9 2HB TYR 9 -4.403 -3.055 4.551
64 HB3 TYR 9 3HB TYR 9 -3.363 -2.945 3.131
65 HD1 TYR 9 HD2 TYR 9 -2.457 -5.758 2.805
66 HD2 TYR 9 HD1 TYR 9 -6.314 -4.161 3.831
67 HE1 TYR 9 HE2 TYR 9 -3.542 -7.818 1.911
68 HE2 TYR 9 HE1 TYR 9 -7.406 -6.206 2.928
69 HH TYR 9 HH TYR 9 -7.090 -8.135 1.737
70 H ARG 10 H ARG 10 -0.713 -2.329 3.797
71 HA ARG 10 HA ARG 10 -0.936 -0.024 5.659
72 HB2 ARG 10 2HB ARG 10 0.976 -1.248 6.437
73 HB3 ARG 10 3HB ARG 10 1.492 -1.602 4.808
74 HG2 ARG 10 2HG ARG 10 3.049 -0.070 5.735
75 HG3 ARG 10 3HG ARG 10 2.160 0.784 4.480
76 HD2 ARG 10 2HD ARG 10 0.696 1.776 6.247
77 HD3 ARG 10 3HD ARG 10 1.640 0.932 7.488
78 HE ARG 10 HE ARG 10 3.365 2.581 5.904
79 HH11 ARG 10 1HH2 ARG 10 0.920 2.962 8.471
80 HH12 ARG 10 2HH2 ARG 10 1.336 4.683 8.582
81 HH21 ARG 10 1HH1 ARG 10 3.916 4.743 6.476
82 HH22 ARG 10 2HH1 ARG 10 2.811 5.560 7.574
83 H VAL 11 H VAL 11 -0.800 1.965 4.593
84 HA VAL 11 HA VAL 11 0.340 2.096 1.869
85 HB VAL 11 HB VAL 11 -2.181 1.899 1.756
86 HG11 VAL 11 1HG1 VAL 11 -2.179 4.813 2.654
87 HG12 VAL 11 2HG1 VAL 11 -3.571 3.818 2.189
88 HG13 VAL 11 3HG1 VAL 11 -2.670 3.477 3.683
89 HG21 VAL 11 3HG2 VAL 11 -0.730 2.915 -0.086
90 HG22 VAL 11 1HG2 VAL 11 -2.385 3.539 -0.040
91 HG23 VAL 11 2HG2 VAL 11 -1.039 4.499 0.607
92 H GLU 12 H GLU 12 1.444 4.033 1.441
93 HA GLU 12 HA GLU 12 1.041 6.359 3.149
94 HB2 GLU 12 2HB GLU 12 3.249 6.534 4.059
95 HB3 GLU 12 3HB GLU 12 2.565 5.002 4.573
96 HG2 GLU 12 2HG GLU 12 3.931 3.771 2.978
97 HG3 GLU 12 3HG GLU 12 4.514 5.263 2.244
98 H TYR 13 H TYR 13 2.196 8.204 2.597
99 HA TYR 13 HA TYR 13 3.538 8.365 -0.022
100 HB2 TYR 13 2HB TYR 13 3.363 10.302 2.311
101 HB3 TYR 13 3HB TYR 13 4.130 10.629 0.763
102 HD1 TYR 13 HD1 TYR 13 1.542 8.934 -0.593
103 HD2 TYR 13 HD2 TYR 13 2.134 12.430 1.880
104 HE1 TYR 13 HE1 TYR 13 -0.458 9.989 -1.598
105 HE2 TYR 13 HE2 TYR 13 0.073 13.446 0.912
106 HH TYR 13 HH TYR 13 -1.696 11.907 -1.789
107 H ALA 14 H ALA 14 5.511 7.741 -0.314
108 HA ALA 14 HA ALA 14 6.913 6.261 1.607
109 HB1 ALA 14 1HB ALA 14 7.676 7.329 -1.135
110 HB2 ALA 14 2HB ALA 14 8.581 6.071 -0.272
111 HB3 ALA 14 3HB ALA 14 6.900 5.786 -0.780
112 H LYS 15 H LYS 15 8.349 6.732 3.106
113 HA LYS 15 HA LYS 15 9.180 9.466 3.609
114 HB2 LYS 15 2HB LYS 15 10.010 6.920 5.065
115 HB3 LYS 15 3HB LYS 15 10.099 8.569 5.675
116 HG2 LYS 15 2HG LYS 15 7.580 6.957 5.115
117 HG3 LYS 15 3HG LYS 15 8.229 7.423 6.686
118 HD2 LYS 15 2HD LYS 15 7.869 9.829 6.110
119 HD3 LYS 15 3HD LYS 15 7.120 9.347 4.582
120 HE2 LYS 15 2HE LYS 15 6.126 8.571 7.356
121 HE3 LYS 15 3HE LYS 15 5.485 9.882 6.356
122 HZ1 LYS 15 3HZ LYS 15 4.116 7.964 6.048
123 HZ2 LYS 15 1HZ LYS 15 4.970 8.168 4.646
124 HZ3 LYS 15 2HZ LYS 15 5.374 6.980 5.701
125 H SER 16 H SER 16 10.886 6.636 2.422
126 HA SER 16 HA SER 16 13.212 8.187 1.588
127 HB2 SER 16 2HB SER 16 13.651 7.579 4.031
128 HB3 SER 16 3HB SER 16 13.729 5.882 3.496
129 HG SER 16 HG SER 16 15.778 7.061 3.510
130 H GLY 17 H GLY 17 14.567 6.984 0.153
131 HA2 GLY 17 2HA GLY 17 13.182 5.006 -1.483
132 HA3 GLY 17 3HA GLY 17 14.764 5.721 -1.790
133 H ARG 18 H ARG 18 13.464 3.777 0.909
134 HA ARG 18 HA ARG 18 15.748 1.833 0.656
135 HB2 ARG 18 2HB ARG 18 14.656 3.153 3.178
136 HB3 ARG 18 3HB ARG 18 15.923 1.930 3.141
137 HG2 ARG 18 2HG ARG 18 16.132 4.705 1.892
138 HG3 ARG 18 3HG ARG 18 16.821 4.209 3.436
139 HD2 ARG 18 2HD ARG 18 18.267 2.581 2.333
140 HD3 ARG 18 3HD ARG 18 17.552 2.936 0.764
141 HE ARG 18 HE ARG 18 19.393 4.662 2.324
142 HH11 ARG 18 1HH2 ARG 18 17.534 4.347 -0.659
143 HH12 ARG 18 2HH2 ARG 18 18.458 5.604 -1.441
144 HH21 ARG 18 1HH1 ARG 18 20.486 6.253 1.249
145 HH22 ARG 18 2HH1 ARG 18 20.065 6.653 -0.389
146 H ALA 19 H ALA 19 12.394 1.985 0.773
147 HA ALA 19 HA ALA 19 12.097 -0.779 1.794
148 HB1 ALA 19 1HB ALA 19 10.058 1.045 0.464
149 HB2 ALA 19 2HB ALA 19 9.745 -0.519 1.237
150 HB3 ALA 19 3HB ALA 19 10.281 0.853 2.222
151 H SER 20 H SER 20 11.509 -2.519 0.409
152 HA SER 20 HA SER 20 12.417 -2.223 -2.432
153 HB2 SER 20 2HB SER 20 12.717 -4.625 -0.617
154 HB3 SER 20 3HB SER 20 13.200 -4.511 -2.322
155 HG SER 20 HG SER 20 14.945 -4.137 -0.851
156 H CYS 21 HN CYS 21 11.100 -2.909 -3.990
157 HA CYS 21 HA CYS 21 8.376 -3.710 -3.317
158 HB2 CYS 21 2HB CYS 21 8.957 -2.199 -5.181
159 HB3 CYS 21 3HB CYS 21 9.809 -3.529 -5.984
160 H LYS 22 H LYS 22 7.932 -5.692 -2.645
161 HA LYS 22 HA LYS 22 9.599 -7.999 -3.179
162 HB2 LYS 22 2HB LYS 22 6.739 -7.932 -2.151
163 HB3 LYS 22 3HB LYS 22 7.860 -9.257 -1.941
164 HG2 LYS 22 2HG LYS 22 8.148 -6.472 -0.753
165 HG3 LYS 22 3HG LYS 22 7.483 -7.850 0.087
166 HD2 LYS 22 2HD LYS 22 10.334 -7.623 -0.956
167 HD3 LYS 22 3HD LYS 22 9.815 -7.365 0.724
168 HE2 LYS 22 2HE LYS 22 8.974 -9.707 0.827
169 HE3 LYS 22 3HE LYS 22 9.555 -9.985 -0.820
170 HZ1 LYS 22 3HZ LYS 22 11.281 -9.278 1.495
171 HZ2 LYS 22 1HZ LYS 22 11.164 -10.758 0.820
172 HZ3 LYS 22 2HZ LYS 22 11.818 -9.528 -0.030
173 H LYS 23 H LYS 23 7.368 -6.539 -5.181
174 HA LYS 23 HA LYS 23 6.510 -9.057 -6.537
175 HB2 LYS 23 2HB LYS 23 4.735 -7.579 -5.805
176 HB3 LYS 23 3HB LYS 23 5.448 -6.225 -6.675
177 HG2 LYS 23 2HG LYS 23 3.484 -7.161 -7.811
178 HG3 LYS 23 3HG LYS 23 4.926 -7.247 -8.822
179 HD2 LYS 23 2HD LYS 23 5.161 -9.650 -8.370
180 HD3 LYS 23 3HD LYS 23 3.829 -9.595 -7.203
181 HE2 LYS 23 2HE LYS 23 2.272 -8.924 -8.991
182 HE3 LYS 23 3HE LYS 23 3.600 -8.897 -10.161
183 HZ1 LYS 23 3HZ LYS 23 2.665 -11.325 -8.712
184 HZ2 LYS 23 1HZ LYS 23 2.340 -10.981 -10.274
185 HZ3 LYS 23 2HZ LYS 23 3.874 -11.290 -9.813
186 H CYS 24 HN CYS 24 7.897 -5.856 -7.479
187 HA CYS 24 HA CYS 24 8.844 -7.185 -9.971
188 HB2 CYS 24 2HB CYS 24 8.698 -5.245 -11.162
189 HB3 CYS 24 3HB CYS 24 7.191 -5.369 -10.264
190 H SER 25 H SER 25 10.129 -6.518 -7.078
191 HA SER 25 HA SER 25 12.183 -6.569 -6.235
192 HB2 SER 25 2HB SER 25 13.061 -7.620 -8.931
193 HB3 SER 25 3HB SER 25 13.936 -7.771 -7.398
194 HG SER 25 HG SER 25 12.692 -9.643 -7.885
195 H GLU 26 H GLU 26 11.422 -4.054 -7.740
196 HA GLU 26 HA GLU 26 14.078 -2.714 -7.961
197 HB2 GLU 26 2HB GLU 26 11.224 -1.740 -8.354
198 HB3 GLU 26 3HB GLU 26 12.662 -0.720 -8.478
199 HG2 GLU 26 2HG GLU 26 13.526 -2.166 -10.306
200 HG3 GLU 26 3HG GLU 26 12.039 -3.118 -10.244
201 H SER 27 H SER 27 13.948 -0.419 -6.721
202 HA SER 27 HA SER 27 12.909 -0.914 -3.963
203 HB2 SER 27 2HB SER 27 14.935 1.184 -4.484
204 HB3 SER 27 3HB SER 27 14.463 0.357 -2.978
205 HG SER 27 HG SER 27 15.433 -1.568 -3.939
206 H ILE 28 H ILE 28 11.738 0.685 -2.947
207 HA ILE 28 HA ILE 28 10.060 2.028 -4.931
208 HB ILE 28 HB ILE 28 9.607 1.640 -1.959
209 HG12 ILE 28 2HG1 ILE 28 8.415 -0.032 -4.212
210 HG13 ILE 28 3HG1 ILE 28 9.850 -0.536 -3.322
211 HG21 ILE 28 1HG2 ILE 28 7.784 2.442 -4.294
212 HG22 ILE 28 2HG2 ILE 28 7.208 2.030 -2.689
213 HG23 ILE 28 3HG2 ILE 28 8.222 3.461 -2.919
214 HD11 ILE 28 3HD1 ILE 28 8.615 -0.439 -1.190
215 HD12 ILE 28 1HD1 ILE 28 7.117 -0.093 -2.087
216 HD13 ILE 28 2HD1 ILE 28 7.973 -1.621 -2.339
217 HA PRO 29 HA PRO 29 12.294 5.796 -3.962
218 HB2 PRO 29 2HB PRO 29 11.064 7.576 -5.633
219 HB3 PRO 29 3HB PRO 29 12.121 6.256 -6.228
220 HG2 PRO 29 2HG PRO 29 9.087 6.241 -6.000
221 HG3 PRO 29 3HG PRO 29 10.082 5.829 -7.431
222 HD2 PRO 29 2HD PRO 29 9.154 3.908 -5.767
223 HD3 PRO 29 3HD PRO 29 10.804 3.792 -6.454
224 H LYS 30 H LYS 30 12.082 7.773 -2.842
225 HA LYS 30 HA LYS 30 9.799 8.009 -1.048
226 HB2 LYS 30 2HB LYS 30 10.962 9.731 0.053
227 HB3 LYS 30 3HB LYS 30 12.100 8.441 -0.324
228 HG2 LYS 30 2HG LYS 30 12.952 9.747 -2.256
229 HG3 LYS 30 3HG LYS 30 11.851 11.070 -1.838
230 HD2 LYS 30 2HD LYS 30 14.080 9.983 -0.058
231 HD3 LYS 30 3HD LYS 30 14.167 11.450 -1.041
232 HE2 LYS 30 2HE LYS 30 12.278 12.437 0.242
233 HE3 LYS 30 3HE LYS 30 12.197 10.984 1.247
234 HZ1 LYS 30 3HZ LYS 30 13.490 12.721 2.323
235 HZ2 LYS 30 1HZ LYS 30 14.461 11.451 2.006
236 HZ3 LYS 30 2HZ LYS 30 14.542 12.799 1.080
237 H ASP 31 H ASP 31 8.656 10.031 -0.673
238 HA ASP 31 HA ASP 31 6.986 11.378 -1.350
239 HB2 ASP 31 2HB ASP 31 8.977 12.837 -1.673
240 HB3 ASP 31 3HB ASP 31 8.963 12.437 -3.389
241 H SER 32 H SER 32 6.840 8.831 -2.362
242 HA SER 32 HA SER 32 5.028 9.163 -4.680
243 HB2 SER 32 2HB SER 32 7.368 8.238 -5.338
244 HB3 SER 32 3HB SER 32 6.891 6.780 -4.449
245 HG SER 32 HG SER 32 5.709 7.972 -6.748
246 H LEU 33 H LEU 33 3.681 6.986 -4.845
247 HA LEU 33 HA LEU 33 2.605 6.585 -2.103
248 HB2 LEU 33 2HB LEU 33 1.142 7.588 -3.860
249 HB3 LEU 33 3HB LEU 33 1.317 6.110 -4.809
250 HG LEU 33 HG LEU 33 0.284 4.839 -2.884
251 HD11 LEU 33 1HD1 LEU 33 -1.076 6.108 -1.254
252 HD12 LEU 33 2HD1 LEU 33 0.647 6.393 -1.024
253 HD13 LEU 33 3HD1 LEU 33 -0.353 7.621 -1.832
254 HD21 LEU 33 3HD2 LEU 33 -2.003 5.529 -3.396
255 HD22 LEU 33 1HD2 LEU 33 -1.418 7.093 -4.017
256 HD23 LEU 33 2HD2 LEU 33 -1.021 5.587 -4.870
257 H ARG 34 H ARG 34 2.746 4.671 -1.099
258 HA ARG 34 HA ARG 34 3.269 2.180 -2.615
259 HB2 ARG 34 2HB ARG 34 5.219 1.590 -1.449
260 HB3 ARG 34 3HB ARG 34 5.447 3.195 -2.154
261 HG2 ARG 34 2HG ARG 34 5.155 4.230 0.075
262 HG3 ARG 34 3HG ARG 34 4.916 2.620 0.796
263 HD2 ARG 34 2HD ARG 34 7.155 1.914 0.004
264 HD3 ARG 34 3HD ARG 34 7.382 3.496 -0.764
265 HE ARG 34 HE ARG 34 6.871 3.651 2.119
266 HH11 ARG 34 1HH2 ARG 34 9.478 3.482 -0.260
267 HH12 ARG 34 2HH2 ARG 34 10.607 4.167 0.869
268 HH21 ARG 34 1HH1 ARG 34 8.291 4.305 3.430
269 HH22 ARG 34 2HH1 ARG 34 10.023 4.306 3.054
270 H MET 35 H MET 35 3.103 0.268 -1.411
271 HA MET 35 HA MET 35 1.317 0.429 0.943
272 HB2 MET 35 2HB MET 35 0.877 -1.170 -1.610
273 HB3 MET 35 3HB MET 35 0.037 -1.522 -0.089
274 HG2 MET 35 2HG MET 35 -0.851 0.771 -0.042
275 HG3 MET 35 3HG MET 35 -0.073 1.111 -1.594
276 HE1 MET 35 3HE MET 35 -3.881 -1.388 -0.838
277 HE2 MET 35 1HE MET 35 -2.326 -1.825 -0.086
278 HE3 MET 35 2HE MET 35 -3.106 -0.269 0.310
279 H ALA 36 H ALA 36 1.132 -1.610 2.112
280 HA ALA 36 HA ALA 36 3.334 -3.497 1.719
281 HB1 ALA 36 1HB ALA 36 3.399 -2.918 4.530
282 HB2 ALA 36 2HB ALA 36 4.684 -2.737 3.328
283 HB3 ALA 36 3HB ALA 36 3.581 -1.390 3.643
284 H ILE 37 H ILE 37 3.146 -5.430 3.089
285 HA ILE 37 HA ILE 37 0.362 -5.920 4.044
286 HB ILE 37 HB ILE 37 1.982 -7.319 2.020
287 HG12 ILE 37 2HG1 ILE 37 -0.971 -7.417 2.766
288 HG13 ILE 37 3HG1 ILE 37 -0.241 -6.114 1.821
289 HG21 ILE 37 1HG2 ILE 37 0.482 -9.052 4.006
290 HG22 ILE 37 2HG2 ILE 37 1.214 -9.555 2.452
291 HG23 ILE 37 3HG2 ILE 37 2.248 -9.011 3.764
292 HD11 ILE 37 3HD1 ILE 37 -0.405 -9.024 0.993
293 HD12 ILE 37 1HD1 ILE 37 -1.334 -7.658 0.339
294 HD13 ILE 37 2HD1 ILE 37 0.418 -7.737 0.080
295 H MET 38 H MET 38 0.014 -6.978 5.850
296 HA MET 38 HA MET 38 2.337 -7.136 7.653
297 HB2 MET 38 2HB MET 38 -0.626 -7.279 8.276
298 HB3 MET 38 3HB MET 38 0.657 -7.032 9.453
299 HG2 MET 38 2HG MET 38 0.173 -5.001 7.255
300 HG3 MET 38 3HG MET 38 -0.849 -5.068 8.670
301 HE1 MET 38 3HE MET 38 3.159 -5.727 8.914
302 HE2 MET 38 1HE MET 38 2.736 -4.860 7.420
303 HE3 MET 38 2HE MET 38 3.640 -4.034 8.726
304 H VAL 39 H VAL 39 3.384 -8.978 7.519
305 HA VAL 39 HA VAL 39 1.815 -11.512 7.914
306 HB VAL 39 HB VAL 39 2.946 -11.522 5.804
307 HG11 VAL 39 1HG1 VAL 39 5.567 -11.232 7.328
308 HG12 VAL 39 2HG1 VAL 39 5.375 -11.591 5.601
309 HG13 VAL 39 3HG1 VAL 39 4.850 -10.025 6.235
310 HG21 VAL 39 3HG2 VAL 39 4.350 -13.446 7.673
311 HG22 VAL 39 1HG2 VAL 39 2.689 -13.640 7.056
312 HG23 VAL 39 2HG2 VAL 39 4.060 -13.630 5.938
313 H GLN 40 H GLN 40 2.294 -12.888 9.515
314 HA GLN 40 HA GLN 40 3.804 -11.966 11.829
315 HB2 GLN 40 2HB GLN 40 3.277 -14.304 12.662
316 HB3 GLN 40 3HB GLN 40 1.917 -13.230 12.348
317 HG2 GLN 40 2HG GLN 40 1.407 -14.368 10.240
318 HG3 GLN 40 3HG GLN 40 2.839 -15.381 10.389
319 HE21 GLN 40 2HE2 GLN 40 -0.352 -14.676 11.921
320 HE22 GLN 40 1HE2 GLN 40 -0.473 -16.258 12.679
321 H SER 41 H SER 41 5.947 -12.102 12.105
322 HA SER 41 HA SER 41 7.472 -13.123 9.910
323 HB2 SER 41 2HB SER 41 7.990 -11.028 11.212
324 HB3 SER 41 3HB SER 41 8.597 -12.091 12.501
325 HG SER 41 HG SER 41 9.605 -11.662 9.918
326 HA PRO 42 HA PRO 42 9.048 -16.923 11.630
327 HB2 PRO 42 2HB PRO 42 11.085 -16.531 9.440
328 HB3 PRO 42 3HB PRO 42 10.192 -18.014 9.888
329 HG2 PRO 42 2HG PRO 42 9.451 -16.566 7.715
330 HG3 PRO 42 3HG PRO 42 8.203 -17.228 8.824
331 HD2 PRO 42 2HD PRO 42 9.340 -14.412 8.755
332 HD3 PRO 42 3HD PRO 42 7.635 -14.944 8.863
333 H MET 43 H MET 43 10.632 -13.839 11.355
334 HA MET 43 HA MET 43 12.880 -14.719 13.114
335 HB2 MET 43 2HB MET 43 14.424 -13.483 11.873
336 HB3 MET 43 3HB MET 43 13.481 -14.448 10.750
337 HG2 MET 43 2HG MET 43 12.081 -12.068 10.729
338 HG3 MET 43 3HG MET 43 13.707 -11.500 11.052
339 HE1 MET 43 3HE MET 43 11.215 -13.116 8.560
340 HE2 MET 43 1HE MET 43 12.265 -13.813 7.306
341 HE3 MET 43 2HE MET 43 12.253 -14.501 8.947
342 H PHE 44 H PHE 44 10.227 -12.823 13.274
343 HA PHE 44 HA PHE 44 11.424 -11.035 15.320
344 HB2 PHE 44 2HB PHE 44 11.321 -9.699 13.284
345 HB3 PHE 44 3HB PHE 44 9.642 -10.135 13.028
346 HD1 PHE 44 HD2 PHE 44 11.923 -8.351 15.410
347 HD2 PHE 44 HD1 PHE 44 7.882 -8.861 13.991
348 HE1 PHE 44 HE2 PHE 44 11.193 -6.407 16.777
349 HE2 PHE 44 HE1 PHE 44 7.158 -6.912 15.350
350 HZ PHE 44 HZ PHE 44 8.811 -5.688 16.749
351 H ASP 45 H ASP 45 9.929 -10.254 16.872
352 HA ASP 45 HA ASP 45 8.022 -12.355 17.625
353 HB2 ASP 45 2HB ASP 45 9.137 -9.982 19.159
354 HB3 ASP 45 3HB ASP 45 8.083 -11.225 19.836
355 H GLY 46 H GLY 46 6.883 -11.140 15.503
356 HA2 GLY 46 2HA GLY 46 4.329 -10.320 16.220
357 HA3 GLY 46 3HA GLY 46 5.278 -8.833 16.125
358 H LYS 47 H LYS 47 3.966 -8.159 14.426
359 HA LYS 47 HA LYS 47 3.993 -9.621 11.848
360 HB2 LYS 47 2HB LYS 47 2.413 -7.208 12.804
361 HB3 LYS 47 3HB LYS 47 2.187 -8.005 11.259
362 HG2 LYS 47 2HG LYS 47 1.932 -9.694 13.770
363 HG3 LYS 47 3HG LYS 47 0.678 -8.511 13.464
364 HD2 LYS 47 2HD LYS 47 1.517 -10.710 11.546
365 HD3 LYS 47 3HD LYS 47 0.141 -10.801 12.638
366 HE2 LYS 47 2HE LYS 47 0.477 -8.785 10.383
367 HE3 LYS 47 3HE LYS 47 -0.482 -10.254 10.284
368 HZ1 LYS 47 3HZ LYS 47 -1.868 -8.324 10.790
369 HZ2 LYS 47 1HZ LYS 47 -1.920 -9.384 12.039
370 HZ3 LYS 47 2HZ LYS 47 -1.046 -8.001 12.160
371 H VAL 48 H VAL 48 4.946 -8.832 10.034
372 HA VAL 48 HA VAL 48 6.433 -6.253 10.215
373 HB VAL 48 HB VAL 48 8.293 -7.254 8.993
374 HG11 VAL 48 1HG1 VAL 48 8.347 -7.098 11.467
375 HG12 VAL 48 2HG1 VAL 48 7.677 -8.738 11.583
376 HG13 VAL 48 3HG1 VAL 48 9.277 -8.479 10.866
377 HG21 VAL 48 3HG2 VAL 48 8.583 -9.684 8.836
378 HG22 VAL 48 1HG2 VAL 48 6.936 -9.943 9.449
379 HG23 VAL 48 2HG2 VAL 48 7.194 -9.158 7.879
380 HA PRO 49 HA PRO 49 4.566 -5.474 6.329
381 HB2 PRO 49 2HB PRO 49 5.892 -3.260 5.446
382 HB3 PRO 49 3HB PRO 49 4.867 -3.247 6.909
383 HG2 PRO 49 2HG PRO 49 7.881 -3.556 6.741
384 HG3 PRO 49 3HG PRO 49 6.934 -2.484 7.820
385 HD2 PRO 49 2HD PRO 49 7.891 -4.935 8.612
386 HD3 PRO 49 3HD PRO 49 6.354 -4.257 9.228
387 H HIS 50 H HIS 50 4.629 -6.452 4.398
388 HA HIS 50 HA HIS 50 7.185 -6.674 2.829
389 HB2 HIS 50 2HB HIS 50 4.470 -8.033 2.684
390 HB3 HIS 50 3HB HIS 50 5.566 -8.016 1.312
391 HD2 HIS 50 HD2 HIS 50 6.821 -8.460 4.937
392 HE1 HIS 50 HE1 HIS 50 7.427 -12.177 2.941
393 HE2 HIS 50 HE2 HIS 50 7.906 -10.867 5.071
394 H TRP 51 H TRP 51 7.574 -4.718 1.894
395 HA TRP 51 HA TRP 51 5.393 -2.957 1.151
396 HB2 TRP 51 2HB TRP 51 8.377 -2.680 0.731
397 HB3 TRP 51 3HB TRP 51 7.165 -1.441 0.431
398 HD1 TRP 51 HD1 TRP 51 9.146 -3.031 3.203
399 HE1 TRP 51 HE1 TRP 51 8.821 -1.723 5.382
400 HE3 TRP 51 HE3 TRP 51 5.295 0.057 1.746
401 HZ2 TRP 51 HZ2 TRP 51 7.070 0.308 6.402
402 HZ3 TRP 51 HZ3 TRP 51 4.258 1.602 3.414
403 HH2 TRP 51 HH2 TRP 51 5.196 1.783 5.706
404 H TYR 52 H TYR 52 4.816 -2.269 -0.877
405 HA TYR 52 HA TYR 52 6.319 -3.102 -3.226
406 HB2 TYR 52 2HB TYR 52 3.468 -3.592 -3.717
407 HB3 TYR 52 3HB TYR 52 4.922 -4.442 -4.242
408 HD1 TYR 52 HD2 TYR 52 2.811 -4.115 -1.108
409 HD2 TYR 52 HD1 TYR 52 5.198 -6.621 -3.670
410 HE1 TYR 52 HE2 TYR 52 2.118 -6.140 0.200
411 HE2 TYR 52 HE1 TYR 52 4.505 -8.623 -2.366
412 HH TYR 52 HH TYR 52 3.327 -9.413 -0.595
413 H HIS 53 H HIS 53 5.696 -1.847 -5.116
414 HA HIS 53 HA HIS 53 4.980 0.906 -4.685
415 HB2 HIS 53 2HB HIS 53 4.640 -0.807 -7.177
416 HB3 HIS 53 3HB HIS 53 4.543 0.927 -7.131
417 HD2 HIS 53 HD2 HIS 53 6.805 2.287 -6.371
418 HE1 HIS 53 HE1 HIS 53 9.392 -0.534 -8.224
419 HE2 HIS 53 HE2 HIS 53 9.162 1.871 -7.448
420 H PHE 54 H PHE 54 2.944 2.045 -5.194
421 HA PHE 54 HA PHE 54 0.610 0.885 -4.130
422 HB2 PHE 54 2HB PHE 54 0.728 3.230 -4.303
423 HB3 PHE 54 3HB PHE 54 1.022 3.196 -6.039
424 HD1 PHE 54 HD1 PHE 54 -1.605 2.182 -3.504
425 HD2 PHE 54 HD2 PHE 54 -0.781 3.514 -7.526
426 HE1 PHE 54 HE1 PHE 54 -4.039 2.193 -4.011
427 HE2 PHE 54 HE2 PHE 54 -3.224 3.565 -7.996
428 HZ PHE 54 HZ PHE 54 -4.838 2.839 -6.261
429 H SER 55 H SER 55 1.710 0.956 -7.535
430 HA SER 55 HA SER 55 -0.666 -0.211 -8.728
431 HB2 SER 55 2HB SER 55 0.930 1.169 -9.981
432 HB3 SER 55 3HB SER 55 2.247 0.048 -9.605
433 HG SER 55 HG SER 55 1.485 -0.338 -11.669
434 H CYS 56 HN CYS 56 2.491 -1.497 -7.608
435 HA CYS 56 HA CYS 56 2.133 -4.084 -8.536
436 HB2 CYS 56 2HB CYS 56 3.907 -2.951 -6.367
437 HB3 CYS 56 3HB CYS 56 4.027 -4.605 -6.956
438 H PHE 57 H PHE 57 1.183 -2.755 -5.366
439 HA PHE 57 HA PHE 57 0.542 -5.071 -3.902
440 HB2 PHE 57 2HB PHE 57 0.337 -2.793 -3.069
441 HB3 PHE 57 3HB PHE 57 -1.025 -2.484 -4.139
442 HD1 PHE 57 HD2 PHE 57 -3.182 -3.798 -3.831
443 HD2 PHE 57 HD1 PHE 57 0.022 -3.922 -0.950
444 HE1 PHE 57 HE2 PHE 57 -4.746 -4.706 -2.144
445 HE2 PHE 57 HE1 PHE 57 -1.574 -4.746 0.765
446 HZ PHE 57 HZ PHE 57 -3.950 -5.173 0.165
447 H TRP 58 H TRP 58 -1.532 -3.416 -6.324
448 HA TRP 58 HA TRP 58 -3.563 -5.464 -6.256
449 HB2 TRP 58 2HB TRP 58 -3.191 -3.340 -8.368
450 HB3 TRP 58 3HB TRP 58 -4.664 -4.177 -7.902
451 HD1 TRP 58 HD1 TRP 58 -2.573 -1.212 -7.174
452 HE1 TRP 58 HE1 TRP 58 -3.390 0.150 -5.177
453 HE3 TRP 58 HE3 TRP 58 -6.235 -4.393 -5.461
454 HZ2 TRP 58 HZ2 TRP 58 -5.443 -0.074 -3.116
455 HZ3 TRP 58 HZ3 TRP 58 -7.585 -3.779 -3.498
456 HH2 TRP 58 HH2 TRP 58 -7.191 -1.622 -2.326
457 H LYS 59 H LYS 59 -0.566 -5.267 -8.016
458 HA LYS 59 HA LYS 59 -1.251 -7.263 -10.053
459 HB2 LYS 59 2HB LYS 59 1.481 -6.499 -9.011
460 HB3 LYS 59 3HB LYS 59 1.131 -7.496 -10.420
461 HG2 LYS 59 2HG LYS 59 0.081 -5.627 -11.582
462 HG3 LYS 59 3HG LYS 59 0.238 -4.616 -10.139
463 HD2 LYS 59 2HD LYS 59 2.806 -5.164 -10.310
464 HD3 LYS 59 3HD LYS 59 2.434 -5.612 -11.985
465 HE2 LYS 59 2HE LYS 59 1.622 -3.430 -12.490
466 HE3 LYS 59 3HE LYS 59 1.407 -3.033 -10.783
467 HZ1 LYS 59 3HZ LYS 59 3.403 -1.955 -11.683
468 HZ2 LYS 59 1HZ LYS 59 3.810 -3.007 -10.493
469 HZ3 LYS 59 2HZ LYS 59 4.062 -3.402 -12.067
470 H VAL 60 H VAL 60 -0.075 -7.303 -6.677
471 HA VAL 60 HA VAL 60 0.382 -10.201 -6.625
472 HB VAL 60 HB VAL 60 -0.172 -8.373 -4.261
473 HG11 VAL 60 1HG1 VAL 60 1.076 -10.086 -2.981
474 HG12 VAL 60 2HG1 VAL 60 -0.369 -10.788 -3.714
475 HG13 VAL 60 3HG1 VAL 60 1.218 -11.087 -4.443
476 HG21 VAL 60 3HG2 VAL 60 2.523 -9.251 -5.384
477 HG22 VAL 60 1HG2 VAL 60 1.856 -7.616 -5.543
478 HG23 VAL 60 2HG2 VAL 60 2.237 -8.247 -3.951
479 H GLY 61 H GLY 61 -2.416 -8.110 -6.232
480 HA2 GLY 61 2HA GLY 61 -4.570 -8.721 -6.843
481 HA3 GLY 61 3HA GLY 61 -4.138 -10.425 -6.759
482 H HIS 62 H HIS 62 -3.460 -8.483 -3.929
483 HA HIS 62 HA HIS 62 -5.415 -9.896 -2.290
484 HB2 HIS 62 2HB HIS 62 -3.524 -7.590 -1.736
485 HB3 HIS 62 3HB HIS 62 -4.655 -8.219 -0.540
486 HD2 HIS 62 HD2 HIS 62 -1.351 -9.053 -2.229
487 HE1 HIS 62 HE1 HIS 62 -2.145 -12.279 0.445
488 HE2 HIS 62 HE2 HIS 62 -0.408 -11.244 -1.100
489 H SER 63 H SER 63 -7.159 -8.999 -1.139
490 HA SER 63 HA SER 63 -8.560 -6.770 -2.564
491 HB2 SER 63 2HB SER 63 -9.393 -9.032 -3.180
492 HB3 SER 63 3HB SER 63 -9.810 -9.312 -1.476
493 HG SER 63 HG SER 63 -11.575 -8.492 -2.755
494 H ILE 64 H ILE 64 -9.897 -5.462 -1.421
495 HA ILE 64 HA ILE 64 -9.586 -5.404 1.546
496 HB ILE 64 HB ILE 64 -9.214 -2.961 -0.199
497 HG12 ILE 64 2HG1 ILE 64 -7.024 -4.862 0.664
498 HG13 ILE 64 3HG1 ILE 64 -7.424 -4.310 -0.959
499 HG21 ILE 64 1HG2 ILE 64 -8.379 -3.561 2.664
500 HG22 ILE 64 2HG2 ILE 64 -8.217 -2.014 1.815
501 HG23 ILE 64 3HG2 ILE 64 -9.826 -2.640 2.198
502 HD11 ILE 64 3HD1 ILE 64 -5.501 -3.101 -0.405
503 HD12 ILE 64 1HD1 ILE 64 -6.810 -1.940 -0.142
504 HD13 ILE 64 2HD1 ILE 64 -6.052 -2.772 1.239
505 H ARG 65 H ARG 65 -11.380 -4.749 2.598
506 HA ARG 65 HA ARG 65 -13.814 -4.047 0.967
507 HB2 ARG 65 2HB ARG 65 -15.045 -5.612 2.597
508 HB3 ARG 65 3HB ARG 65 -14.180 -6.301 1.242
509 HG2 ARG 65 2HG ARG 65 -12.793 -6.104 3.924
510 HG3 ARG 65 3HG ARG 65 -13.988 -7.357 3.666
511 HD2 ARG 65 2HD ARG 65 -12.690 -8.558 2.255
512 HD3 ARG 65 3HD ARG 65 -12.000 -7.144 1.460
513 HE ARG 65 HE ARG 65 -10.754 -6.957 3.852
514 HH11 ARG 65 1HH2 ARG 65 -11.028 -9.770 1.746
515 HH12 ARG 65 2HH2 ARG 65 -9.510 -10.407 2.316
516 HH21 ARG 65 1HH1 ARG 65 -8.998 -7.774 4.501
517 HH22 ARG 65 2HH1 ARG 65 -8.342 -9.296 3.881
518 H HIS 66 H HIS 66 -12.061 -3.454 3.883
519 HA HIS 66 HA HIS 66 -13.747 -1.063 4.205
520 HB2 HIS 66 2HB HIS 66 -13.753 -1.175 6.645
521 HB3 HIS 66 3HB HIS 66 -14.811 -2.304 5.829
522 HD2 HIS 66 HD2 HIS 66 -12.763 -4.795 5.505
523 HE1 HIS 66 HE1 HIS 66 -12.876 -4.801 9.734
524 HE2 HIS 66 HE2 HIS 66 -12.325 -6.177 7.680
525 HA PRO 67 HA PRO 67 -9.254 -0.765 3.664
526 HB2 PRO 67 2HB PRO 67 -9.183 1.543 2.060
527 HB3 PRO 67 3HB PRO 67 -9.402 -0.119 1.449
528 HG2 PRO 67 2HG PRO 67 -11.550 1.898 2.140
529 HG3 PRO 67 3HG PRO 67 -11.400 0.900 0.650
530 HD2 PRO 67 2HD PRO 67 -13.039 0.154 2.618
531 HD3 PRO 67 3HD PRO 67 -11.991 -1.081 1.851
532 H ASP 68 H ASP 68 -11.310 1.965 4.742
533 HA ASP 68 HA ASP 68 -9.117 3.479 5.841
534 HB2 ASP 68 2HB ASP 68 -11.294 4.470 5.300
535 HB3 ASP 68 3HB ASP 68 -12.105 3.405 6.445
536 H VAL 69 H VAL 69 -10.603 0.567 6.855
537 HA VAL 69 HA VAL 69 -9.704 0.827 9.666
538 HB VAL 69 HB VAL 69 -11.321 -1.423 8.438
539 HG11 VAL 69 1HG1 VAL 69 -10.967 -0.492 11.318
540 HG12 VAL 69 2HG1 VAL 69 -12.030 -1.809 10.775
541 HG13 VAL 69 3HG1 VAL 69 -10.284 -1.968 10.595
542 HG21 VAL 69 3HG2 VAL 69 -12.359 1.101 9.793
543 HG22 VAL 69 1HG2 VAL 69 -12.649 0.593 8.110
544 HG23 VAL 69 2HG2 VAL 69 -13.334 -0.344 9.435
545 H GLU 70 H GLU 70 -9.298 -1.130 6.735
546 HA GLU 70 HA GLU 70 -7.382 -2.971 8.048
547 HB2 GLU 70 2HB GLU 70 -8.311 -2.798 5.133
548 HB3 GLU 70 3HB GLU 70 -7.387 -4.119 5.849
549 HG2 GLU 70 2HG GLU 70 -9.292 -4.726 7.270
550 HG3 GLU 70 3HG GLU 70 -10.240 -3.402 6.595
551 H VAL 71 H VAL 71 -7.187 -0.352 5.688
552 HA VAL 71 HA VAL 71 -4.285 -0.812 5.201
553 HB VAL 71 HB VAL 71 -6.004 1.339 3.990
554 HG11 VAL 71 1HG1 VAL 71 -3.374 -0.015 3.242
555 HG12 VAL 71 2HG1 VAL 71 -4.172 1.359 2.429
556 HG13 VAL 71 3HG1 VAL 71 -3.509 1.545 4.076
557 HG21 VAL 71 3HG2 VAL 71 -5.334 -1.484 3.031
558 HG22 VAL 71 1HG2 VAL 71 -6.954 -0.846 3.346
559 HG23 VAL 71 2HG2 VAL 71 -6.009 -0.194 1.999
560 H ASP 72 H ASP 72 -3.381 -0.444 7.107
561 HA ASP 72 HA ASP 72 -3.681 1.921 8.722
562 HB2 ASP 72 2HB ASP 72 -2.710 -0.112 9.540
563 HB3 ASP 72 3HB ASP 72 -1.449 -0.096 8.308
564 H GLY 73 H GLY 73 -2.642 3.878 8.616
565 HA2 GLY 73 2HA GLY 73 -1.157 5.542 7.901
566 HA3 GLY 73 3HA GLY 73 -0.509 4.448 6.681
567 H PHE 74 H PHE 74 -3.728 4.243 6.124
568 HA PHE 74 HA PHE 74 -3.955 5.943 3.846
569 HB2 PHE 74 2HB PHE 74 -5.348 3.972 4.390
570 HB3 PHE 74 3HB PHE 74 -5.990 4.777 5.812
571 HD1 PHE 74 HD1 PHE 74 -6.127 4.533 2.139
572 HD2 PHE 74 HD2 PHE 74 -7.723 6.499 5.631
573 HE1 PHE 74 HE1 PHE 74 -8.064 5.339 0.810
574 HE2 PHE 74 HE2 PHE 74 -9.643 7.321 4.294
575 HZ PHE 74 HZ PHE 74 -9.808 6.747 1.879
576 H SER 75 H SER 75 -4.308 6.721 7.270
577 HA SER 75 HA SER 75 -5.559 9.299 7.050
578 HB2 SER 75 2HB SER 75 -4.417 9.611 9.303
579 HB3 SER 75 3HB SER 75 -5.520 8.226 9.166
580 HG SER 75 HG SER 75 -3.507 7.684 10.176
581 H GLU 76 H GLU 76 -2.299 8.256 6.274
582 HA GLU 76 HA GLU 76 -1.094 10.906 6.604
583 HB2 GLU 76 2HB GLU 76 0.041 8.392 5.316
584 HB3 GLU 76 3HB GLU 76 0.937 9.833 5.777
585 HG2 GLU 76 2HG GLU 76 0.520 9.438 8.142
586 HG3 GLU 76 3HG GLU 76 -0.552 8.083 7.786
587 H LEU 77 H LEU 77 -2.903 9.375 4.155
588 HA LEU 77 HA LEU 77 -1.714 10.674 1.803
589 HB2 LEU 77 2HB LEU 77 -4.128 8.916 2.342
590 HB3 LEU 77 3HB LEU 77 -3.889 9.676 0.788
591 HG LEU 77 HG LEU 77 -1.972 8.400 0.290
592 HD11 LEU 77 1HD1 LEU 77 -2.015 7.243 3.083
593 HD12 LEU 77 2HD1 LEU 77 -1.001 6.682 1.733
594 HD13 LEU 77 3HD1 LEU 77 -0.761 8.300 2.390
595 HD21 LEU 77 3HD2 LEU 77 -2.896 6.133 0.351
596 HD22 LEU 77 1HD2 LEU 77 -4.047 6.621 1.611
597 HD23 LEU 77 2HD2 LEU 77 -4.154 7.320 -0.016
598 H ARG 78 H ARG 78 -2.755 12.259 0.501
599 HA ARG 78 HA ARG 78 -4.750 14.024 1.768
600 HB2 ARG 78 2HB ARG 78 -3.397 13.998 -0.969
601 HB3 ARG 78 3HB ARG 78 -4.728 15.076 -0.633
602 HG2 ARG 78 2HG ARG 78 -2.191 15.031 1.052
603 HG3 ARG 78 3HG ARG 78 -2.467 16.106 -0.326
604 HD2 ARG 78 2HD ARG 78 -4.533 16.990 0.800
605 HD3 ARG 78 3HD ARG 78 -4.200 15.972 2.186
606 HE ARG 78 HE ARG 78 -2.479 17.372 2.874
607 HH11 ARG 78 1HH2 ARG 78 -3.449 18.452 -0.324
608 HH12 ARG 78 2HH2 ARG 78 -2.515 19.918 -0.201
609 HH21 ARG 78 1HH1 ARG 78 -1.319 19.255 2.951
610 HH22 ARG 78 2HH1 ARG 78 -1.346 20.354 1.603
611 H TRP 79 H TRP 79 -6.711 14.602 0.707
612 HA TRP 79 HA TRP 79 -8.507 12.527 0.621
613 HB2 TRP 79 2HB TRP 79 -9.602 14.447 0.995
614 HB3 TRP 79 3HB TRP 79 -8.532 15.396 -0.016
615 HD1 TRP 79 HD1 TRP 79 -11.815 13.465 -0.210
616 HE1 TRP 79 HE1 TRP 79 -13.002 14.047 -2.417
617 HE3 TRP 79 HE3 TRP 79 -8.080 16.139 -2.425
618 HZ2 TRP 79 HZ2 TRP 79 -12.368 15.458 -4.875
619 HZ3 TRP 79 HZ3 TRP 79 -8.362 17.070 -4.709
620 HH2 TRP 79 HH2 TRP 79 -10.504 16.740 -5.945
621 H ASP 80 H ASP 80 -6.794 13.880 -2.213
622 HA ASP 80 HA ASP 80 -8.365 12.450 -4.132
623 HB2 ASP 80 2HB ASP 80 -7.097 14.555 -4.572
624 HB3 ASP 80 3HB ASP 80 -5.600 13.620 -4.514
625 H ASP 81 H ASP 81 -5.589 11.426 -2.244
626 HA ASP 81 HA ASP 81 -5.132 9.035 -3.943
627 HB2 ASP 81 2HB ASP 81 -3.679 10.130 -1.519
628 HB3 ASP 81 3HB ASP 81 -3.380 8.529 -2.203
629 H GLN 82 H GLN 82 -6.450 10.045 -0.765
630 HA GLN 82 HA GLN 82 -7.212 7.489 0.192
631 HB2 GLN 82 2HB GLN 82 -8.362 10.282 0.502
632 HB3 GLN 82 3HB GLN 82 -9.122 8.895 1.275
633 HG2 GLN 82 2HG GLN 82 -7.022 8.339 2.424
634 HG3 GLN 82 3HG GLN 82 -6.224 9.724 1.676
635 HE21 GLN 82 2HE2 GLN 82 -6.254 9.469 4.442
636 HE22 GLN 82 1HE2 GLN 82 -7.282 10.749 5.101
637 H GLN 83 H GLN 83 -9.190 9.767 -1.836
638 HA GLN 83 HA GLN 83 -11.321 7.912 -2.147
639 HB2 GLN 83 2HB GLN 83 -12.234 9.403 -3.760
640 HB3 GLN 83 3HB GLN 83 -11.492 10.336 -2.483
641 HG2 GLN 83 2HG GLN 83 -10.818 11.536 -4.320
642 HG3 GLN 83 3HG GLN 83 -9.426 10.503 -4.063
643 HE21 GLN 83 2HE2 GLN 83 -9.192 11.395 -6.490
644 HE22 GLN 83 1HE2 GLN 83 -9.919 10.327 -7.682
645 H LYS 84 H LYS 84 -8.249 8.072 -3.888
646 HA LYS 84 HA LYS 84 -9.110 6.408 -6.123
647 HB2 LYS 84 2HB LYS 84 -7.609 8.248 -6.479
648 HB3 LYS 84 3HB LYS 84 -6.516 7.703 -5.215
649 HG2 LYS 84 2HG LYS 84 -7.026 5.933 -7.602
650 HG3 LYS 84 3HG LYS 84 -5.985 7.340 -7.775
651 HD2 LYS 84 2HD LYS 84 -5.601 5.109 -5.759
652 HD3 LYS 84 3HD LYS 84 -4.705 5.304 -7.269
653 HE2 LYS 84 2HE LYS 84 -4.617 7.073 -4.790
654 HE3 LYS 84 3HE LYS 84 -3.365 5.969 -5.341
655 HZ1 LYS 84 3HZ LYS 84 -2.934 7.384 -7.216
656 HZ2 LYS 84 1HZ LYS 84 -4.237 8.335 -6.914
657 HZ3 LYS 84 2HZ LYS 84 -2.981 8.354 -5.882
658 H VAL 85 H VAL 85 -7.215 6.040 -3.094
659 HA VAL 85 HA VAL 85 -6.629 3.215 -3.536
660 HB VAL 85 HB VAL 85 -6.754 4.918 -1.017
661 HG11 VAL 85 1HG1 VAL 85 -5.878 1.995 -1.215
662 HG12 VAL 85 2HG1 VAL 85 -5.571 3.059 0.167
663 HG13 VAL 85 3HG1 VAL 85 -7.229 2.639 -0.247
664 HG21 VAL 85 3HG2 VAL 85 -4.845 5.266 -2.672
665 HG22 VAL 85 1HG2 VAL 85 -4.362 4.801 -1.037
666 HG23 VAL 85 2HG2 VAL 85 -4.349 3.599 -2.331
667 H LYS 86 H LYS 86 -9.325 4.914 -1.844
668 HA LYS 86 HA LYS 86 -10.822 2.537 -1.233
669 HB2 LYS 86 2HB LYS 86 -11.691 5.424 -1.682
670 HB3 LYS 86 3HB LYS 86 -12.802 4.114 -1.258
671 HG2 LYS 86 2HG LYS 86 -11.312 3.612 0.740
672 HG3 LYS 86 3HG LYS 86 -10.460 5.121 0.415
673 HD2 LYS 86 2HD LYS 86 -12.475 6.416 0.776
674 HD3 LYS 86 3HD LYS 86 -13.479 4.945 0.817
675 HE2 LYS 86 2HE LYS 86 -12.361 4.175 2.848
676 HE3 LYS 86 3HE LYS 86 -11.317 5.597 2.853
677 HZ1 LYS 86 3HZ LYS 86 -13.324 6.982 3.101
678 HZ2 LYS 86 1HZ LYS 86 -14.282 5.659 3.111
679 HZ3 LYS 86 2HZ LYS 86 -13.229 5.914 4.329
680 H LYS 87 H LYS 87 -11.013 4.648 -4.168
681 HA LYS 87 HA LYS 87 -12.983 2.930 -5.428
682 HB2 LYS 87 2HB LYS 87 -11.350 5.284 -6.310
683 HB3 LYS 87 3HB LYS 87 -11.867 4.184 -7.566
684 HG2 LYS 87 2HG LYS 87 -13.499 5.996 -7.247
685 HG3 LYS 87 3HG LYS 87 -14.171 4.383 -7.011
686 HD2 LYS 87 2HD LYS 87 -13.924 4.751 -4.496
687 HD3 LYS 87 3HD LYS 87 -13.532 6.440 -4.851
688 HE2 LYS 87 2HE LYS 87 -15.701 6.884 -5.670
689 HE3 LYS 87 3HE LYS 87 -15.997 5.185 -6.069
690 HZ1 LYS 87 3HZ LYS 87 -15.878 6.239 -3.302
691 HZ2 LYS 87 1HZ LYS 87 -17.239 5.797 -4.098
692 HZ3 LYS 87 2HZ LYS 87 -16.111 4.665 -3.724
693 H THR 88 H THR 88 -9.436 2.836 -5.581
694 HA THR 88 HA THR 88 -9.313 0.731 -7.486
695 HB THR 88 HB THR 88 -7.296 1.362 -5.312
696 HG1 THR 88 1HG THR 88 -7.650 3.136 -6.602
697 HG21 THR 88 1HG2 THR 88 -7.160 -0.073 -7.991
698 HG22 THR 88 2HG2 THR 88 -5.739 0.404 -7.028
699 HG23 THR 88 3HG2 THR 88 -6.884 -0.798 -6.397
700 H ALA 89 H ALA 89 -9.797 0.645 -3.937
701 HA ALA 89 HA ALA 89 -9.583 -2.238 -3.730
702 HB1 ALA 89 1HB ALA 89 -10.558 -1.819 -1.500
703 HB2 ALA 89 2HB ALA 89 -9.145 -0.789 -1.834
704 HB3 ALA 89 3HB ALA 89 -10.787 -0.113 -1.912
705 H GLU 90 H GLU 90 -12.305 0.097 -4.121
706 HA GLU 90 HA GLU 90 -14.365 -1.887 -4.216
707 HB2 GLU 90 2HB GLU 90 -14.209 0.910 -5.410
708 HB3 GLU 90 3HB GLU 90 -15.648 -0.108 -5.499
709 HG2 GLU 90 2HG GLU 90 -15.701 -0.251 -3.019
710 HG3 GLU 90 3HG GLU 90 -14.325 0.843 -2.932
711 H ALA 91 H ALA 91 -12.242 -0.602 -6.723
712 HA ALA 91 HA ALA 91 -13.429 -2.011 -8.938
713 HB1 ALA 91 1HB ALA 91 -10.760 -0.588 -8.519
714 HB2 ALA 91 2HB ALA 91 -11.406 -1.105 -10.097
715 HB3 ALA 91 3HB ALA 91 -12.251 0.131 -9.137
716 H GLY 92 H GLY 92 -11.320 -3.110 -6.434
717 HA2 GLY 92 2HA GLY 92 -10.277 -5.130 -6.079
718 HA3 GLY 92 3HA GLY 92 -10.961 -5.747 -7.586
719 H GLY 93 H GLY 93 -8.916 -2.841 -7.387
720 HA2 GLY 93 2HA GLY 93 -6.554 -2.749 -7.826
721 HA3 GLY 93 3HA GLY 93 -6.671 -4.215 -8.802
722 H VAL 94 H VAL 94 -5.610 -1.571 -9.452
723 HA VAL 94 HA VAL 94 -7.015 -1.271 -12.052
724 HB VAL 94 HB VAL 94 -7.878 0.458 -10.401
725 HG11 VAL 94 1HG1 VAL 94 -5.241 1.887 -10.922
726 HG12 VAL 94 2HG1 VAL 94 -6.609 2.432 -9.937
727 HG13 VAL 94 3HG1 VAL 94 -5.626 1.064 -9.400
728 HG21 VAL 94 3HG2 VAL 94 -6.610 1.508 -12.956
729 HG22 VAL 94 1HG2 VAL 94 -8.166 0.654 -12.834
730 HG23 VAL 94 2HG2 VAL 94 -7.960 2.233 -12.058
731 H THR 95 H THR 95 -4.076 -0.648 -10.203
732 HA THR 95 HA THR 95 -1.908 -0.480 -10.739
733 HB THR 95 HB THR 95 -0.926 -1.736 -12.441
734 HG1 THR 95 1HG THR 95 -3.415 -1.523 -13.722
735 HG21 THR 95 1HG2 THR 95 -3.518 -3.191 -11.776
736 HG22 THR 95 2HG2 THR 95 -1.966 -3.911 -12.259
737 HG23 THR 95 3HG2 THR 95 -2.103 -3.072 -10.703
738 H GLY 96 H GLY 96 -0.244 0.348 -12.437
739 HA2 GLY 96 2HA GLY 96 -1.059 2.494 -14.201
740 HA3 GLY 96 3HA GLY 96 -0.526 3.105 -12.634
741 H LYS 97 H LYS 97 0.957 4.118 -14.343
742 HA LYS 97 HA LYS 97 3.055 2.630 -15.607
743 HB2 LYS 97 2HB LYS 97 2.885 5.578 -14.854
744 HB3 LYS 97 3HB LYS 97 4.133 4.872 -15.888
745 HG2 LYS 97 2HG LYS 97 2.345 4.060 -17.451
746 HG3 LYS 97 3HG LYS 97 1.143 4.934 -16.494
747 HD2 LYS 97 2HD LYS 97 3.529 6.187 -17.926
748 HD3 LYS 97 3HD LYS 97 1.862 6.169 -18.517
749 HE2 LYS 97 2HE LYS 97 1.136 7.450 -16.503
750 HE3 LYS 97 3HE LYS 97 2.814 7.510 -15.944
751 HZ1 LYS 97 3HZ LYS 97 3.375 8.745 -17.971
752 HZ2 LYS 97 1HZ LYS 97 1.825 8.694 -18.485
753 HZ3 LYS 97 2HZ LYS 97 2.212 9.533 -17.141
754 H GLY 98 H GLY 98 5.314 2.689 -15.231
755 HA2 GLY 98 2HA GLY 98 6.012 1.581 -12.746
756 HA3 GLY 98 3HA GLY 98 7.155 2.093 -13.982
757 H GLN 99 H GLN 99 6.656 2.343 -10.874
758 HA GLN 99 HA GLN 99 7.337 5.207 -10.443
759 HB2 GLN 99 2HB GLN 99 6.524 2.931 -8.629
760 HB3 GLN 99 3HB GLN 99 7.017 4.523 -8.023
761 HG2 GLN 99 2HG GLN 99 5.101 5.568 -9.113
762 HG3 GLN 99 3HG GLN 99 4.657 4.047 -9.903
763 HE21 GLN 99 2HE2 GLN 99 5.054 5.532 -6.616
764 HE22 GLN 99 1HE2 GLN 99 3.893 4.449 -5.857
765 H ASP 100 H ASP 100 9.346 4.579 -11.712
766 HA ASP 100 HA ASP 100 11.202 2.660 -11.014
767 HB2 ASP 100 2HB ASP 100 11.192 3.852 -13.126
768 HB3 ASP 100 3HB ASP 100 11.598 5.370 -12.327
769 H GLY 101 H GLY 101 12.815 2.341 -9.602
770 HA2 GLY 101 2HA GLY 101 14.394 4.418 -8.417
771 HA3 GLY 101 3HA GLY 101 13.228 3.809 -7.244
772 H ILE 102 H ILE 102 16.002 3.681 -6.949
773 HA ILE 102 HA ILE 102 16.321 0.846 -6.362
774 HB ILE 102 HB ILE 102 17.256 0.949 -8.612
775 HG12 ILE 102 2HG1 ILE 102 19.525 0.085 -8.220
776 HG13 ILE 102 3HG1 ILE 102 19.475 0.639 -6.549
777 HG21 ILE 102 1HG2 ILE 102 19.280 2.990 -7.604
778 HG22 ILE 102 2HG2 ILE 102 19.218 2.248 -9.211
779 HG23 ILE 102 3HG2 ILE 102 17.926 3.337 -8.703
780 HD11 ILE 102 3HD1 ILE 102 17.656 -0.952 -6.057
781 HD12 ILE 102 1HD1 ILE 102 17.566 -1.408 -7.774
782 HD13 ILE 102 2HD1 ILE 102 19.009 -1.798 -6.817
783 H GLY 103 H GLY 103 17.312 0.580 -4.436
784 HA2 GLY 103 2HA GLY 103 19.277 2.412 -3.308
785 HA3 GLY 103 3HA GLY 103 17.661 2.680 -2.657
786 H SER 104 H SER 104 18.239 -0.641 -3.411
787 HA SER 104 HA SER 104 19.459 -1.318 -0.817
788 HB2 SER 104 2HB SER 104 16.970 -1.143 -0.438
789 HB3 SER 104 3HB SER 104 16.758 -2.455 -1.615
790 HG SER 104 HG SER 104 16.880 -3.178 0.593
791 H LYS 105 H LYS 105 20.069 -3.558 -0.675
792 HA LYS 105 HA LYS 105 20.066 -5.273 -3.042
793 HB2 LYS 105 2HB LYS 105 22.490 -5.437 -3.278
794 HB3 LYS 105 3HB LYS 105 21.942 -3.798 -3.601
795 HG2 LYS 105 2HG LYS 105 22.731 -3.045 -1.398
796 HG3 LYS 105 3HG LYS 105 23.176 -4.706 -0.956
797 HD2 LYS 105 2HD LYS 105 24.824 -4.782 -2.780
798 HD3 LYS 105 3HD LYS 105 24.382 -3.135 -3.277
799 HE2 LYS 105 2HE LYS 105 25.143 -2.222 -1.146
800 HE3 LYS 105 3HE LYS 105 25.417 -3.846 -0.497
801 HZ1 LYS 105 3HZ LYS 105 26.905 -2.710 -2.803
802 HZ2 LYS 105 1HZ LYS 105 27.485 -2.827 -1.278
803 HZ3 LYS 105 2HZ LYS 105 27.156 -4.187 -2.122
804 H ALA 106 H ALA 106 21.246 -7.333 -2.641
805 HA ALA 106 HA ALA 106 21.609 -8.108 0.182
806 HB1 ALA 106 1HB ALA 106 19.271 -8.697 -0.314
807 HB2 ALA 106 2HB ALA 106 19.784 -9.591 -1.764
808 HB3 ALA 106 3HB ALA 106 20.268 -10.156 -0.149
809 H GLU 107 H GLU 107 23.528 -8.964 0.317
810 HA GLU 107 HA GLU 107 24.908 -10.067 -2.097
811 HB2 GLU 107 2HB GLU 107 26.042 -8.750 0.390
812 HB3 GLU 107 3HB GLU 107 26.969 -9.301 -1.013
813 HG2 GLU 107 2HG GLU 107 25.686 -7.723 -2.461
814 HG3 GLU 107 3HG GLU 107 24.874 -7.085 -1.029
815 H LYS 108 H LYS 108 23.479 -11.321 0.594
816 HA LYS 108 HA LYS 108 25.106 -13.785 0.555
817 HB2 LYS 108 2HB LYS 108 26.053 -12.380 2.381
818 HB3 LYS 108 3HB LYS 108 24.450 -12.229 3.097
819 HG2 LYS 108 2HG LYS 108 25.752 -13.855 4.320
820 HG3 LYS 108 3HG LYS 108 24.396 -14.662 3.535
821 HD2 LYS 108 2HD LYS 108 25.938 -15.498 1.748
822 HD3 LYS 108 3HD LYS 108 27.268 -14.605 2.494
823 HE2 LYS 108 2HE LYS 108 27.490 -16.889 3.149
824 HE3 LYS 108 3HE LYS 108 26.991 -15.972 4.572
825 HZ1 LYS 108 3HZ LYS 108 24.720 -16.790 4.215
826 HZ2 LYS 108 1HZ LYS 108 25.170 -17.597 2.867
827 HZ3 LYS 108 2HZ LYS 108 25.741 -18.055 4.324
Start of MODEL 7
1 H1 MET 1 H1 MET 1 -3.487 7.074 17.140
2 H2 MET 1 H2 MET 1 -3.810 8.617 16.681
3 H3 MET 1 H3 MET 1 -2.963 7.621 15.684
4 HA MET 1 HA MET 1 -5.765 7.255 16.495
5 HB2 MET 1 2HB MET 1 -5.220 9.140 14.844
6 HB3 MET 1 3HB MET 1 -4.767 7.898 13.686
7 HG2 MET 1 2HG MET 1 -7.476 8.199 15.054
8 HG3 MET 1 3HG MET 1 -7.089 8.798 13.451
9 HE1 MET 1 1HE MET 1 -5.473 6.355 12.063
10 HE2 MET 1 2HE MET 1 -6.849 5.557 11.279
11 HE3 MET 1 3HE MET 1 -6.755 7.331 11.305
12 H ALA 2 H ALA 2 -6.368 5.184 16.525
13 HA ALA 2 HA ALA 2 -6.322 2.951 16.392
14 HB1 ALA 2 1HB ALA 2 -5.776 3.516 13.461
15 HB2 ALA 2 2HB ALA 2 -6.473 2.030 14.137
16 HB3 ALA 2 3HB ALA 2 -7.361 3.553 14.269
17 H GLU 3 H GLU 3 -3.938 3.735 17.494
18 HA GLU 3 HA GLU 3 -1.590 2.566 16.486
19 HB2 GLU 3 2HB GLU 3 -2.444 2.695 19.411
20 HB3 GLU 3 3HB GLU 3 -0.823 2.397 18.795
21 HG2 GLU 3 2HG GLU 3 -0.621 4.607 19.259
22 HG3 GLU 3 3HG GLU 3 -1.137 4.728 17.582
23 H SER 4 H SER 4 -1.403 0.592 15.679
24 HA SER 4 HA SER 4 -1.708 -1.845 17.201
25 HB2 SER 4 2HB SER 4 -4.058 -1.621 16.746
26 HB3 SER 4 3HB SER 4 -3.767 -1.132 15.075
27 HG SER 4 HG SER 4 -4.440 -3.375 15.437
28 H SER 5 H SER 5 -0.762 -3.593 16.135
29 HA SER 5 HA SER 5 0.200 -3.243 13.334
30 HB2 SER 5 2HB SER 5 1.759 -4.704 15.470
31 HB3 SER 5 3HB SER 5 2.183 -4.491 13.756
32 HG SER 5 HG SER 5 3.271 -2.986 15.148
33 H ASP 6 H ASP 6 -2.266 -4.369 14.347
34 HA ASP 6 HA ASP 6 -1.955 -7.070 13.135
35 HB2 ASP 6 2HB ASP 6 -2.655 -6.892 15.634
36 HB3 ASP 6 3HB ASP 6 -4.219 -6.367 15.010
37 H LYS 7 H LYS 7 -2.418 -4.362 11.921
38 HA LYS 7 HA LYS 7 -4.940 -4.682 10.403
39 HB2 LYS 7 2HB LYS 7 -2.712 -2.680 10.423
40 HB3 LYS 7 3HB LYS 7 -4.010 -2.693 9.222
41 HG2 LYS 7 2HG LYS 7 -5.735 -2.391 10.812
42 HG3 LYS 7 3HG LYS 7 -4.710 -2.792 12.198
43 HD2 LYS 7 2HD LYS 7 -4.232 -0.461 10.388
44 HD3 LYS 7 3HD LYS 7 -5.198 -0.378 11.893
45 HE2 LYS 7 2HE LYS 7 -3.182 -1.367 13.112
46 HE3 LYS 7 3HE LYS 7 -2.239 -1.122 11.650
47 HZ1 LYS 7 3HZ LYS 7 -1.909 0.671 13.170
48 HZ2 LYS 7 1HZ LYS 7 -2.632 1.279 11.856
49 HZ3 LYS 7 2HZ LYS 7 -3.492 1.050 13.259
50 H LEU 8 H LEU 8 -4.892 -5.272 8.243
51 HA LEU 8 HA LEU 8 -2.794 -7.187 7.473
52 HB2 LEU 8 2HB LEU 8 -5.259 -6.065 6.044
53 HB3 LEU 8 3HB LEU 8 -4.303 -7.410 5.438
54 HG LEU 8 HG LEU 8 -5.837 -7.494 8.076
55 HD11 LEU 8 1HD1 LEU 8 -7.320 -7.148 6.140
56 HD12 LEU 8 2HD1 LEU 8 -6.572 -8.523 5.305
57 HD13 LEU 8 3HD1 LEU 8 -7.502 -8.785 6.806
58 HD21 LEU 8 3HD2 LEU 8 -4.561 -9.667 6.362
59 HD22 LEU 8 1HD2 LEU 8 -3.981 -9.104 7.946
60 HD23 LEU 8 2HD2 LEU 8 -5.541 -9.933 7.824
61 H TYR 9 H TYR 9 -3.477 -3.817 6.738
62 HA TYR 9 HA TYR 9 -1.665 -3.946 4.378
63 HB2 TYR 9 2HB TYR 9 -4.371 -2.599 4.506
64 HB3 TYR 9 3HB TYR 9 -3.304 -2.669 3.108
65 HD1 TYR 9 HD2 TYR 9 -2.589 -5.425 2.791
66 HD2 TYR 9 HD1 TYR 9 -6.321 -3.765 4.117
67 HE1 TYR 9 HE2 TYR 9 -3.769 -7.494 2.033
68 HE2 TYR 9 HE1 TYR 9 -7.503 -5.837 3.405
69 HH TYR 9 HH TYR 9 -7.310 -7.874 2.394
70 H ARG 10 H ARG 10 -0.782 -1.979 3.737
71 HA ARG 10 HA ARG 10 -1.046 0.381 5.490
72 HB2 ARG 10 2HB ARG 10 0.900 -0.555 6.420
73 HB3 ARG 10 3HB ARG 10 1.413 -1.229 4.894
74 HG2 ARG 10 2HG ARG 10 2.985 0.443 5.500
75 HG3 ARG 10 3HG ARG 10 2.118 0.985 4.082
76 HD2 ARG 10 2HD ARG 10 2.301 2.906 5.464
77 HD3 ARG 10 3HD ARG 10 0.638 2.362 5.652
78 HE ARG 10 HE ARG 10 1.070 1.672 7.879
79 HH11 ARG 10 1HH2 ARG 10 3.990 3.347 6.684
80 HH12 ARG 10 2HH2 ARG 10 4.733 3.131 8.232
81 HH21 ARG 10 1HH1 ARG 10 1.959 1.804 9.722
82 HH22 ARG 10 2HH1 ARG 10 3.614 2.366 9.951
83 H VAL 11 H VAL 11 -0.911 2.319 4.346
84 HA VAL 11 HA VAL 11 0.212 2.353 1.614
85 HB VAL 11 HB VAL 11 -2.332 2.108 1.518
86 HG11 VAL 11 1HG1 VAL 11 -2.327 5.072 2.241
87 HG12 VAL 11 2HG1 VAL 11 -3.720 4.058 1.840
88 HG13 VAL 11 3HG1 VAL 11 -2.815 3.814 3.353
89 HG21 VAL 11 3HG2 VAL 11 -2.514 3.640 -0.378
90 HG22 VAL 11 1HG2 VAL 11 -1.194 4.656 0.240
91 HG23 VAL 11 2HG2 VAL 11 -0.849 3.045 -0.366
92 H GLU 12 H GLU 12 1.319 4.274 1.155
93 HA GLU 12 HA GLU 12 0.975 6.684 2.726
94 HB2 GLU 12 2HB GLU 12 3.204 6.685 3.783
95 HB3 GLU 12 3HB GLU 12 2.193 5.417 4.443
96 HG2 GLU 12 2HG GLU 12 3.365 3.715 3.124
97 HG3 GLU 12 3HG GLU 12 4.309 4.958 2.289
98 H TYR 13 H TYR 13 2.309 8.379 2.163
99 HA TYR 13 HA TYR 13 3.876 8.248 -0.317
100 HB2 TYR 13 2HB TYR 13 3.846 10.406 1.806
101 HB3 TYR 13 3HB TYR 13 4.353 10.546 0.127
102 HD1 TYR 13 HD1 TYR 13 2.144 9.319 -1.387
103 HD2 TYR 13 HD2 TYR 13 1.951 11.692 2.201
104 HE1 TYR 13 HE1 TYR 13 -0.073 10.204 -2.095
105 HE2 TYR 13 HE2 TYR 13 -0.291 12.541 1.520
106 HH TYR 13 HH TYR 13 -1.771 11.667 -1.627
107 H ALA 14 H ALA 14 5.947 7.553 -0.325
108 HA ALA 14 HA ALA 14 7.057 6.212 1.844
109 HB1 ALA 14 1HB ALA 14 8.334 7.261 -0.709
110 HB2 ALA 14 2HB ALA 14 9.061 6.035 0.335
111 HB3 ALA 14 3HB ALA 14 7.524 5.705 -0.502
112 H LYS 15 H LYS 15 7.932 6.918 3.679
113 HA LYS 15 HA LYS 15 8.847 9.564 4.252
114 HB2 LYS 15 2HB LYS 15 9.327 6.888 5.638
115 HB3 LYS 15 3HB LYS 15 10.029 8.389 6.220
116 HG2 LYS 15 2HG LYS 15 8.096 8.006 7.502
117 HG3 LYS 15 3HG LYS 15 7.768 9.387 6.453
118 HD2 LYS 15 2HD LYS 15 6.402 7.979 4.977
119 HD3 LYS 15 3HD LYS 15 6.830 6.529 5.921
120 HE2 LYS 15 2HE LYS 15 5.731 7.507 7.906
121 HE3 LYS 15 3HE LYS 15 5.360 8.977 6.987
122 HZ1 LYS 15 3HZ LYS 15 3.454 7.444 7.038
123 HZ2 LYS 15 1HZ LYS 15 3.992 7.645 5.513
124 HZ3 LYS 15 2HZ LYS 15 4.349 6.258 6.309
125 H SER 16 H SER 16 10.668 6.659 3.419
126 HA SER 16 HA SER 16 12.807 8.200 2.153
127 HB2 SER 16 2HB SER 16 13.578 8.015 4.511
128 HB3 SER 16 3HB SER 16 13.459 6.248 4.397
129 HG SER 16 HG SER 16 15.588 7.213 3.940
130 H GLY 17 H GLY 17 14.053 6.859 0.695
131 HA2 GLY 17 2HA GLY 17 12.342 4.855 -0.529
132 HA3 GLY 17 3HA GLY 17 13.835 5.521 -1.187
133 H ARG 18 H ARG 18 13.543 3.942 1.985
134 HA ARG 18 HA ARG 18 15.756 2.108 1.411
135 HB2 ARG 18 2HB ARG 18 13.878 2.165 3.818
136 HB3 ARG 18 3HB ARG 18 15.437 1.359 3.717
137 HG2 ARG 18 2HG ARG 18 14.924 4.351 3.816
138 HG3 ARG 18 3HG ARG 18 15.669 3.327 5.044
139 HD2 ARG 18 2HD ARG 18 17.519 2.832 3.349
140 HD3 ARG 18 3HD ARG 18 16.794 4.103 2.341
141 HE ARG 18 HE ARG 18 17.274 5.063 5.015
142 HH11 ARG 18 1HH2 ARG 18 19.017 4.434 2.031
143 HH12 ARG 18 2HH2 ARG 18 20.342 5.475 2.496
144 HH21 ARG 18 1HH1 ARG 18 18.964 6.413 5.500
145 HH22 ARG 18 2HH1 ARG 18 20.288 6.587 4.388
146 H ALA 19 H ALA 19 12.283 1.830 1.310
147 HA ALA 19 HA ALA 19 12.099 -0.982 1.760
148 HB1 ALA 19 1HB ALA 19 10.130 0.923 0.435
149 HB2 ALA 19 2HB ALA 19 9.767 -0.691 1.063
150 HB3 ALA 19 3HB ALA 19 10.251 0.593 2.184
151 H SER 20 H SER 20 11.634 -2.663 0.389
152 HA SER 20 HA SER 20 12.398 -2.358 -2.477
153 HB2 SER 20 2HB SER 20 13.228 -4.633 -2.440
154 HB3 SER 20 3HB SER 20 14.105 -3.577 -1.322
155 HG SER 20 HG SER 20 13.673 -5.497 -0.276
156 H CYS 21 HN CYS 21 11.103 -3.153 -4.008
157 HA CYS 21 HA CYS 21 8.352 -3.771 -3.241
158 HB2 CYS 21 2HB CYS 21 8.941 -2.262 -5.095
159 HB3 CYS 21 3HB CYS 21 9.705 -3.616 -5.948
160 H LYS 22 H LYS 22 7.689 -5.731 -2.746
161 HA LYS 22 HA LYS 22 9.328 -8.089 -3.188
162 HB2 LYS 22 2HB LYS 22 6.494 -7.900 -2.105
163 HB3 LYS 22 3HB LYS 22 7.595 -9.253 -1.868
164 HG2 LYS 22 2HG LYS 22 8.173 -6.463 -0.852
165 HG3 LYS 22 3HG LYS 22 7.258 -7.645 0.063
166 HD2 LYS 22 2HD LYS 22 9.134 -9.193 0.061
167 HD3 LYS 22 3HD LYS 22 10.088 -8.123 -0.999
168 HE2 LYS 22 2HE LYS 22 8.983 -7.307 1.705
169 HE3 LYS 22 3HE LYS 22 10.567 -8.072 1.536
170 HZ1 LYS 22 3HZ LYS 22 9.861 -5.518 0.148
171 HZ2 LYS 22 1HZ LYS 22 10.701 -5.606 1.561
172 HZ3 LYS 22 2HZ LYS 22 11.320 -6.210 0.194
173 H LYS 23 H LYS 23 7.187 -6.641 -5.250
174 HA LYS 23 HA LYS 23 6.311 -9.189 -6.559
175 HB2 LYS 23 2HB LYS 23 4.514 -7.739 -5.817
176 HB3 LYS 23 3HB LYS 23 5.191 -6.381 -6.711
177 HG2 LYS 23 2HG LYS 23 3.238 -7.368 -7.818
178 HG3 LYS 23 3HG LYS 23 4.672 -7.437 -8.842
179 HD2 LYS 23 2HD LYS 23 4.957 -9.831 -8.360
180 HD3 LYS 23 3HD LYS 23 3.629 -9.784 -7.187
181 HE2 LYS 23 2HE LYS 23 2.054 -9.158 -8.991
182 HE3 LYS 23 3HE LYS 23 3.382 -9.150 -10.161
183 HZ1 LYS 23 3HZ LYS 23 2.467 -11.545 -8.649
184 HZ2 LYS 23 1HZ LYS 23 2.145 -11.246 -10.219
185 HZ3 LYS 23 2HZ LYS 23 3.679 -11.531 -9.746
186 H CYS 24 HN CYS 24 7.598 -5.957 -7.544
187 HA CYS 24 HA CYS 24 8.476 -7.240 -10.076
188 HB2 CYS 24 2HB CYS 24 8.464 -5.220 -11.150
189 HB3 CYS 24 3HB CYS 24 6.962 -5.290 -10.233
190 H SER 25 H SER 25 9.843 -6.726 -7.158
191 HA SER 25 HA SER 25 11.900 -6.899 -6.332
192 HB2 SER 25 2HB SER 25 12.691 -7.994 -9.037
193 HB3 SER 25 3HB SER 25 13.571 -8.195 -7.513
194 HG SER 25 HG SER 25 12.220 -9.995 -7.987
195 H GLU 26 H GLU 26 11.263 -4.337 -7.764
196 HA GLU 26 HA GLU 26 14.011 -3.178 -7.982
197 HB2 GLU 26 2HB GLU 26 11.270 -1.938 -8.431
198 HB3 GLU 26 3HB GLU 26 12.804 -1.102 -8.621
199 HG2 GLU 26 2HG GLU 26 11.795 -3.436 -10.293
200 HG3 GLU 26 3HG GLU 26 11.918 -1.754 -10.789
201 H SER 27 H SER 27 13.927 -0.821 -6.823
202 HA SER 27 HA SER 27 12.789 -1.170 -4.087
203 HB2 SER 27 2HB SER 27 15.369 0.269 -4.669
204 HB3 SER 27 3HB SER 27 14.533 0.095 -3.105
205 HG SER 27 HG SER 27 15.461 -2.082 -4.690
206 H ILE 28 H ILE 28 11.952 0.574 -3.050
207 HA ILE 28 HA ILE 28 10.351 2.020 -5.010
208 HB ILE 28 HB ILE 28 9.968 1.588 -2.037
209 HG12 ILE 28 2HG1 ILE 28 8.614 0.128 -4.349
210 HG13 ILE 28 3HG1 ILE 28 9.983 -0.527 -3.455
211 HG21 ILE 28 1HG2 ILE 28 8.053 2.610 -4.206
212 HG22 ILE 28 2HG2 ILE 28 7.601 2.231 -2.542
213 HG23 ILE 28 3HG2 ILE 28 8.698 3.566 -2.860
214 HD11 ILE 28 3HD1 ILE 28 7.250 0.065 -2.284
215 HD12 ILE 28 1HD1 ILE 28 8.012 -1.506 -2.554
216 HD13 ILE 28 2HD1 ILE 28 8.685 -0.407 -1.341
217 HA PRO 29 HA PRO 29 12.617 5.770 -4.132
218 HB2 PRO 29 2HB PRO 29 10.310 7.174 -5.459
219 HB3 PRO 29 3HB PRO 29 12.066 7.352 -5.762
220 HG2 PRO 29 2HG PRO 29 10.536 5.896 -7.454
221 HG3 PRO 29 3HG PRO 29 12.144 5.276 -6.948
222 HD2 PRO 29 2HD PRO 29 9.415 4.538 -5.838
223 HD3 PRO 29 3HD PRO 29 10.771 3.483 -6.337
224 H LYS 30 H LYS 30 12.686 7.590 -2.809
225 HA LYS 30 HA LYS 30 10.833 7.970 -0.617
226 HB2 LYS 30 2HB LYS 30 13.243 8.593 -0.564
227 HB3 LYS 30 3HB LYS 30 12.963 9.790 -1.828
228 HG2 LYS 30 2HG LYS 30 11.481 11.070 -0.305
229 HG3 LYS 30 3HG LYS 30 11.726 9.856 0.963
230 HD2 LYS 30 2HD LYS 30 14.174 10.384 0.967
231 HD3 LYS 30 3HD LYS 30 13.918 11.512 -0.367
232 HE2 LYS 30 2HE LYS 30 14.018 12.934 1.458
233 HE3 LYS 30 3HE LYS 30 12.286 12.774 1.166
234 HZ1 LYS 30 3HZ LYS 30 12.244 11.104 3.000
235 HZ2 LYS 30 1HZ LYS 30 13.844 11.330 3.250
236 HZ3 LYS 30 2HZ LYS 30 12.799 12.550 3.519
237 H ASP 31 H ASP 31 9.237 9.516 -0.344
238 HA ASP 31 HA ASP 31 7.377 10.610 -0.932
239 HB2 ASP 31 2HB ASP 31 9.132 12.371 -0.964
240 HB3 ASP 31 3HB ASP 31 9.221 12.221 -2.718
241 H SER 32 H SER 32 7.514 8.217 -2.287
242 HA SER 32 HA SER 32 5.790 8.790 -4.635
243 HB2 SER 32 2HB SER 32 6.446 6.796 -5.713
244 HB3 SER 32 3HB SER 32 7.937 7.660 -5.322
245 HG SER 32 HG SER 32 8.305 6.219 -3.637
246 H LEU 33 H LEU 33 4.063 7.082 -4.870
247 HA LEU 33 HA LEU 33 2.928 6.609 -2.197
248 HB2 LEU 33 2HB LEU 33 1.560 7.707 -3.985
249 HB3 LEU 33 3HB LEU 33 1.687 6.226 -4.940
250 HG LEU 33 HG LEU 33 0.578 5.003 -3.004
251 HD11 LEU 33 1HD1 LEU 33 -0.089 7.814 -2.062
252 HD12 LEU 33 2HD1 LEU 33 -0.795 6.308 -1.445
253 HD13 LEU 33 3HD1 LEU 33 0.917 6.636 -1.196
254 HD21 LEU 33 3HD2 LEU 33 -1.033 7.237 -4.294
255 HD22 LEU 33 1HD2 LEU 33 -0.649 5.673 -5.050
256 HD23 LEU 33 2HD2 LEU 33 -1.680 5.724 -3.609
257 H ARG 34 H ARG 34 2.973 4.720 -1.216
258 HA ARG 34 HA ARG 34 3.430 2.196 -2.705
259 HB2 ARG 34 2HB ARG 34 5.282 1.551 -1.337
260 HB3 ARG 34 3HB ARG 34 5.628 3.101 -2.102
261 HG2 ARG 34 2HG ARG 34 5.222 4.283 0.017
262 HG3 ARG 34 3HG ARG 34 4.760 2.758 0.802
263 HD2 ARG 34 2HD ARG 34 7.022 1.834 0.325
264 HD3 ARG 34 3HD ARG 34 7.471 3.368 -0.439
265 HE ARG 34 HE ARG 34 6.546 3.617 2.351
266 HH11 ARG 34 1HH2 ARG 34 9.436 3.252 0.382
267 HH12 ARG 34 2HH2 ARG 34 10.429 3.942 1.647
268 HH21 ARG 34 1HH1 ARG 34 7.816 4.266 3.848
269 HH22 ARG 34 2HH1 ARG 34 9.579 4.202 3.690
270 H MET 35 H MET 35 3.172 0.301 -1.407
271 HA MET 35 HA MET 35 1.305 0.572 0.857
272 HB2 MET 35 2HB MET 35 0.875 -1.073 -1.673
273 HB3 MET 35 3HB MET 35 0.010 -1.394 -0.160
274 HG2 MET 35 2HG MET 35 -0.844 0.911 -0.150
275 HG3 MET 35 3HG MET 35 -0.047 1.218 -1.698
276 HE1 MET 35 3HE MET 35 -2.329 -1.648 -0.141
277 HE2 MET 35 1HE MET 35 -3.153 -0.101 0.175
278 HE3 MET 35 2HE MET 35 -3.864 -1.273 -0.956
279 H ALA 36 H ALA 36 1.070 -1.401 2.118
280 HA ALA 36 HA ALA 36 3.226 -3.359 1.792
281 HB1 ALA 36 1HB ALA 36 3.201 -2.608 4.594
282 HB2 ALA 36 2HB ALA 36 4.549 -2.695 3.450
283 HB3 ALA 36 3HB ALA 36 3.589 -1.208 3.569
284 H ILE 37 H ILE 37 3.011 -5.240 3.305
285 HA ILE 37 HA ILE 37 0.205 -5.673 4.220
286 HB ILE 37 HB ILE 37 1.778 -7.100 2.164
287 HG12 ILE 37 2HG1 ILE 37 -1.173 -7.121 2.909
288 HG13 ILE 37 3HG1 ILE 37 -0.399 -5.852 1.950
289 HG21 ILE 37 1HG2 ILE 37 0.240 -8.795 4.153
290 HG22 ILE 37 2HG2 ILE 37 0.937 -9.319 2.586
291 HG23 ILE 37 3HG2 ILE 37 2.004 -8.813 3.884
292 HD11 ILE 37 3HD1 ILE 37 -0.679 -8.763 1.151
293 HD12 ILE 37 1HD1 ILE 37 -1.539 -7.370 0.472
294 HD13 ILE 37 2HD1 ILE 37 0.211 -7.529 0.229
295 H MET 38 H MET 38 -0.116 -6.760 6.133
296 HA MET 38 HA MET 38 2.341 -7.181 7.694
297 HB2 MET 38 2HB MET 38 0.237 -5.941 8.449
298 HB3 MET 38 3HB MET 38 -0.512 -7.537 8.617
299 HG2 MET 38 2HG MET 38 0.214 -7.265 10.744
300 HG3 MET 38 3HG MET 38 1.681 -7.990 10.088
301 HE1 MET 38 3HE MET 38 3.660 -6.308 9.089
302 HE2 MET 38 1HE MET 38 2.515 -5.163 8.353
303 HE3 MET 38 2HE MET 38 3.772 -4.573 9.475
304 H VAL 39 H VAL 39 3.383 -8.964 7.943
305 HA VAL 39 HA VAL 39 1.864 -11.500 8.280
306 HB VAL 39 HB VAL 39 2.613 -11.455 5.953
307 HG11 VAL 39 1HG1 VAL 39 5.467 -11.379 7.013
308 HG12 VAL 39 2HG1 VAL 39 4.951 -11.592 5.328
309 HG13 VAL 39 3HG1 VAL 39 4.643 -10.060 6.155
310 HG21 VAL 39 3HG2 VAL 39 3.606 -13.614 5.819
311 HG22 VAL 39 1HG2 VAL 39 4.192 -13.531 7.484
312 HG23 VAL 39 2HG2 VAL 39 2.442 -13.610 7.151
313 H GLN 40 H GLN 40 2.754 -12.996 9.648
314 HA GLN 40 HA GLN 40 4.670 -12.088 11.654
315 HB2 GLN 40 2HB GLN 40 4.395 -14.522 12.431
316 HB3 GLN 40 3HB GLN 40 3.031 -13.417 12.582
317 HG2 GLN 40 2HG GLN 40 1.916 -14.355 10.646
318 HG3 GLN 40 3HG GLN 40 3.317 -15.352 10.247
319 HE21 GLN 40 2HE2 GLN 40 1.294 -16.930 10.315
320 HE22 GLN 40 1HE2 GLN 40 1.066 -17.728 11.866
321 H SER 41 H SER 41 6.837 -12.362 11.686
322 HA SER 41 HA SER 41 8.000 -13.154 9.176
323 HB2 SER 41 2HB SER 41 8.725 -11.189 10.560
324 HB3 SER 41 3HB SER 41 9.525 -12.352 11.642
325 HG SER 41 HG SER 41 10.686 -11.379 9.686
326 HA PRO 42 HA PRO 42 9.744 -17.095 10.321
327 HB2 PRO 42 2HB PRO 42 11.408 -16.537 7.868
328 HB3 PRO 42 3HB PRO 42 10.571 -18.047 8.336
329 HG2 PRO 42 2HG PRO 42 9.521 -16.423 6.428
330 HG3 PRO 42 3HG PRO 42 8.454 -17.173 7.664
331 HD2 PRO 42 2HD PRO 42 9.601 -14.361 7.643
332 HD3 PRO 42 3HD PRO 42 7.930 -14.902 7.980
333 H MET 43 H MET 43 11.303 -14.002 10.021
334 HA MET 43 HA MET 43 13.812 -15.020 11.279
335 HB2 MET 43 2HB MET 43 15.135 -13.763 9.843
336 HB3 MET 43 3HB MET 43 13.940 -14.584 8.849
337 HG2 MET 43 2HG MET 43 12.706 -12.152 9.312
338 HG3 MET 43 3HG MET 43 14.398 -11.690 9.328
339 HE1 MET 43 3HE MET 43 12.308 -14.386 7.391
340 HE2 MET 43 1HE MET 43 11.334 -12.906 7.294
341 HE3 MET 43 2HE MET 43 12.056 -13.589 5.818
342 H PHE 44 H PHE 44 11.294 -13.154 12.124
343 HA PHE 44 HA PHE 44 12.917 -11.430 13.916
344 HB2 PHE 44 2HB PHE 44 12.391 -10.032 11.983
345 HB3 PHE 44 3HB PHE 44 10.689 -10.440 12.103
346 HD1 PHE 44 HD1 PHE 44 13.477 -8.813 14.022
347 HD2 PHE 44 HD2 PHE 44 9.219 -9.119 13.400
348 HE1 PHE 44 HE1 PHE 44 13.107 -6.916 15.585
349 HE2 PHE 44 HE2 PHE 44 8.854 -7.219 14.957
350 HZ PHE 44 HZ PHE 44 10.797 -6.120 16.056
351 H ASP 45 H ASP 45 11.729 -10.600 15.733
352 HA ASP 45 HA ASP 45 10.065 -12.727 16.875
353 HB2 ASP 45 2HB ASP 45 12.117 -11.871 17.982
354 HB3 ASP 45 3HB ASP 45 11.339 -10.303 18.184
355 H GLY 46 H GLY 46 8.557 -11.539 15.012
356 HA2 GLY 46 2HA GLY 46 6.111 -10.840 16.109
357 HA3 GLY 46 3HA GLY 46 6.966 -9.301 15.946
358 H LYS 47 H LYS 47 5.447 -8.589 14.434
359 HA LYS 47 HA LYS 47 5.363 -10.006 11.814
360 HB2 LYS 47 2HB LYS 47 3.309 -8.012 12.805
361 HB3 LYS 47 3HB LYS 47 3.232 -9.074 11.396
362 HG2 LYS 47 2HG LYS 47 3.671 -10.921 13.404
363 HG3 LYS 47 3HG LYS 47 2.788 -9.693 14.296
364 HD2 LYS 47 2HD LYS 47 1.919 -11.163 11.782
365 HD3 LYS 47 3HD LYS 47 1.366 -11.503 13.415
366 HE2 LYS 47 2HE LYS 47 0.808 -8.967 11.814
367 HE3 LYS 47 3HE LYS 47 -0.300 -10.318 12.067
368 HZ1 LYS 47 3HZ LYS 47 0.326 -9.643 14.599
369 HZ2 LYS 47 1HZ LYS 47 0.338 -8.157 13.878
370 HZ3 LYS 47 2HZ LYS 47 -0.997 -9.116 13.818
371 H VAL 48 H VAL 48 5.548 -8.991 9.917
372 HA VAL 48 HA VAL 48 7.118 -6.460 9.966
373 HB VAL 48 HB VAL 48 8.633 -7.519 8.307
374 HG11 VAL 48 1HG1 VAL 48 8.526 -8.922 11.017
375 HG12 VAL 48 2HG1 VAL 48 9.947 -8.760 9.969
376 HG13 VAL 48 3HG1 VAL 48 9.229 -7.323 10.711
377 HG21 VAL 48 3HG2 VAL 48 7.257 -9.397 7.506
378 HG22 VAL 48 1HG2 VAL 48 8.790 -9.972 8.169
379 HG23 VAL 48 2HG2 VAL 48 7.298 -10.140 9.114
380 HA PRO 49 HA PRO 49 4.525 -5.532 6.511
381 HB2 PRO 49 2HB PRO 49 5.551 -3.150 5.660
382 HB3 PRO 49 3HB PRO 49 4.725 -3.342 7.238
383 HG2 PRO 49 2HG PRO 49 7.707 -3.355 6.672
384 HG3 PRO 49 3HG PRO 49 6.825 -2.461 7.948
385 HD2 PRO 49 2HD PRO 49 8.075 -4.878 8.384
386 HD3 PRO 49 3HD PRO 49 6.597 -4.379 9.263
387 H HIS 50 H HIS 50 4.483 -6.438 4.509
388 HA HIS 50 HA HIS 50 6.960 -6.673 2.860
389 HB2 HIS 50 2HB HIS 50 4.200 -7.926 2.746
390 HB3 HIS 50 3HB HIS 50 5.276 -7.941 1.353
391 HD2 HIS 50 HD2 HIS 50 6.817 -8.345 4.822
392 HE1 HIS 50 HE1 HIS 50 6.995 -12.177 2.965
393 HE2 HIS 50 HE2 HIS 50 7.785 -10.803 4.958
394 H TRP 51 H TRP 51 7.446 -4.755 1.966
395 HA TRP 51 HA TRP 51 5.415 -2.866 1.156
396 HB2 TRP 51 2HB TRP 51 8.429 -2.908 0.803
397 HB3 TRP 51 3HB TRP 51 7.380 -1.572 0.356
398 HD1 TRP 51 HD1 TRP 51 9.160 -3.028 3.307
399 HE1 TRP 51 HE1 TRP 51 8.780 -1.563 5.378
400 HE3 TRP 51 HE3 TRP 51 5.427 -0.028 1.494
401 HZ2 TRP 51 HZ2 TRP 51 7.037 0.598 6.171
402 HZ3 TRP 51 HZ3 TRP 51 4.393 1.699 2.948
403 HH2 TRP 51 HH2 TRP 51 5.204 2.028 5.277
404 H TYR 52 H TYR 52 4.819 -2.232 -0.863
405 HA TYR 52 HA TYR 52 6.281 -3.137 -3.218
406 HB2 TYR 52 2HB TYR 52 3.388 -3.478 -3.650
407 HB3 TYR 52 3HB TYR 52 4.784 -4.382 -4.236
408 HD1 TYR 52 HD2 TYR 52 2.787 -4.019 -1.029
409 HD2 TYR 52 HD1 TYR 52 4.952 -6.589 -3.725
410 HE1 TYR 52 HE2 TYR 52 2.026 -6.036 0.255
411 HE2 TYR 52 HE1 TYR 52 4.205 -8.579 -2.436
412 HH TYR 52 HH TYR 52 3.033 -9.345 -0.640
413 H HIS 53 H HIS 53 5.631 -1.864 -5.136
414 HA HIS 53 HA HIS 53 4.965 0.915 -4.675
415 HB2 HIS 53 2HB HIS 53 4.546 -0.752 -7.190
416 HB3 HIS 53 3HB HIS 53 4.465 0.986 -7.100
417 HD2 HIS 53 HD2 HIS 53 6.762 2.342 -6.473
418 HE1 HIS 53 HE1 HIS 53 9.350 -0.616 -8.107
419 HE2 HIS 53 HE2 HIS 53 9.164 1.805 -7.442
420 H PHE 54 H PHE 54 2.917 2.048 -5.128
421 HA PHE 54 HA PHE 54 0.596 0.920 -4.028
422 HB2 PHE 54 2HB PHE 54 0.654 3.244 -4.281
423 HB3 PHE 54 3HB PHE 54 1.031 3.171 -5.998
424 HD1 PHE 54 HD1 PHE 54 -1.726 2.565 -3.507
425 HD2 PHE 54 HD2 PHE 54 -0.676 3.093 -7.661
426 HE1 PHE 54 HE1 PHE 54 -4.141 2.586 -4.135
427 HE2 PHE 54 HE2 PHE 54 -3.085 3.097 -8.263
428 HZ PHE 54 HZ PHE 54 -4.808 2.774 -6.509
429 H SER 55 H SER 55 1.662 0.847 -7.467
430 HA SER 55 HA SER 55 -0.774 -0.310 -8.515
431 HB2 SER 55 2HB SER 55 0.683 -0.592 -10.541
432 HB3 SER 55 3HB SER 55 0.590 1.069 -9.925
433 HG SER 55 HG SER 55 2.738 0.530 -10.369
434 H CYS 56 HN CYS 56 2.421 -1.550 -7.545
435 HA CYS 56 HA CYS 56 2.105 -4.164 -8.436
436 HB2 CYS 56 2HB CYS 56 3.833 -2.940 -6.279
437 HB3 CYS 56 3HB CYS 56 3.992 -4.613 -6.807
438 H PHE 57 H PHE 57 1.139 -2.782 -5.301
439 HA PHE 57 HA PHE 57 0.385 -5.106 -3.874
440 HB2 PHE 57 2HB PHE 57 0.280 -2.797 -3.034
441 HB3 PHE 57 3HB PHE 57 -1.075 -2.450 -4.102
442 HD1 PHE 57 HD2 PHE 57 -3.251 -3.797 -3.818
443 HD2 PHE 57 HD1 PHE 57 -0.085 -3.790 -0.889
444 HE1 PHE 57 HE2 PHE 57 -4.822 -4.678 -2.127
445 HE2 PHE 57 HE1 PHE 57 -1.701 -4.556 0.831
446 HZ PHE 57 HZ PHE 57 -4.055 -5.056 0.206
447 H TRP 58 H TRP 58 -1.489 -3.323 -6.369
448 HA TRP 58 HA TRP 58 -3.660 -5.232 -6.390
449 HB2 TRP 58 2HB TRP 58 -2.995 -3.091 -8.418
450 HB3 TRP 58 3HB TRP 58 -4.545 -3.867 -8.155
451 HD1 TRP 58 HD1 TRP 58 -2.614 -0.906 -7.272
452 HE1 TRP 58 HE1 TRP 58 -3.485 0.373 -5.254
453 HE3 TRP 58 HE3 TRP 58 -6.111 -4.295 -5.595
454 HZ2 TRP 58 HZ2 TRP 58 -5.493 0.016 -3.185
455 HZ3 TRP 58 HZ3 TRP 58 -7.464 -3.784 -3.609
456 HH2 TRP 58 HH2 TRP 58 -7.169 -1.635 -2.406
457 H LYS 59 H LYS 59 -0.580 -5.229 -7.998
458 HA LYS 59 HA LYS 59 -1.318 -7.198 -10.059
459 HB2 LYS 59 2HB LYS 59 1.410 -6.433 -8.986
460 HB3 LYS 59 3HB LYS 59 1.105 -7.489 -10.365
461 HG2 LYS 59 2HG LYS 59 0.118 -5.696 -11.650
462 HG3 LYS 59 3HG LYS 59 0.110 -4.636 -10.242
463 HD2 LYS 59 2HD LYS 59 2.744 -5.083 -10.255
464 HD3 LYS 59 3HD LYS 59 2.455 -5.475 -11.958
465 HE2 LYS 59 2HE LYS 59 1.588 -3.312 -12.422
466 HE3 LYS 59 3HE LYS 59 1.227 -3.004 -10.719
467 HZ1 LYS 59 3HZ LYS 59 3.979 -3.141 -11.803
468 HZ2 LYS 59 1HZ LYS 59 3.156 -1.759 -11.470
469 HZ3 LYS 59 2HZ LYS 59 3.577 -2.795 -10.254
470 H VAL 60 H VAL 60 -0.169 -7.255 -6.687
471 HA VAL 60 HA VAL 60 -0.025 -10.198 -6.579
472 HB VAL 60 HB VAL 60 -0.289 -8.231 -4.274
473 HG11 VAL 60 1HG1 VAL 60 0.655 -11.134 -4.362
474 HG12 VAL 60 2HG1 VAL 60 0.667 -10.075 -2.935
475 HG13 VAL 60 3HG1 VAL 60 -0.870 -10.568 -3.658
476 HG21 VAL 60 3HG2 VAL 60 2.127 -8.504 -3.988
477 HG22 VAL 60 1HG2 VAL 60 2.211 -9.549 -5.418
478 HG23 VAL 60 2HG2 VAL 60 1.808 -7.827 -5.579
479 H GLY 61 H GLY 61 -2.462 -7.694 -5.921
480 HA2 GLY 61 2HA GLY 61 -4.683 -7.839 -6.539
481 HA3 GLY 61 3HA GLY 61 -4.493 -9.558 -6.863
482 H HIS 62 H HIS 62 -3.768 -8.116 -3.688
483 HA HIS 62 HA HIS 62 -5.715 -9.789 -2.308
484 HB2 HIS 62 2HB HIS 62 -4.004 -7.445 -1.409
485 HB3 HIS 62 3HB HIS 62 -5.127 -8.291 -0.349
486 HD2 HIS 62 HD2 HIS 62 -1.724 -8.719 -2.040
487 HE1 HIS 62 HE1 HIS 62 -2.268 -12.119 0.477
488 HE2 HIS 62 HE2 HIS 62 -0.611 -10.868 -0.993
489 H SER 63 H SER 63 -7.818 -9.429 -1.964
490 HA SER 63 HA SER 63 -9.074 -6.893 -2.796
491 HB2 SER 63 2HB SER 63 -10.283 -9.449 -1.668
492 HB3 SER 63 3HB SER 63 -11.189 -8.052 -2.280
493 HG SER 63 HG SER 63 -10.936 -9.707 -3.868
494 H ILE 64 H ILE 64 -9.372 -5.249 -1.548
495 HA ILE 64 HA ILE 64 -9.166 -5.527 1.408
496 HB ILE 64 HB ILE 64 -9.046 -3.034 -0.295
497 HG12 ILE 64 2HG1 ILE 64 -6.747 -4.735 0.713
498 HG13 ILE 64 3HG1 ILE 64 -7.147 -4.313 -0.951
499 HG21 ILE 64 1HG2 ILE 64 -8.277 -3.553 2.624
500 HG22 ILE 64 2HG2 ILE 64 -8.132 -2.008 1.781
501 HG23 ILE 64 3HG2 ILE 64 -9.731 -2.687 2.077
502 HD11 ILE 64 3HD1 ILE 64 -6.799 -1.841 -0.227
503 HD12 ILE 64 1HD1 ILE 64 -5.962 -2.540 1.182
504 HD13 ILE 64 2HD1 ILE 64 -5.380 -2.868 -0.452
505 H ARG 65 H ARG 65 -11.030 -5.661 2.434
506 HA ARG 65 HA ARG 65 -13.530 -5.037 0.989
507 HB2 ARG 65 2HB ARG 65 -14.546 -6.392 2.939
508 HB3 ARG 65 3HB ARG 65 -13.688 -7.206 1.653
509 HG2 ARG 65 2HG ARG 65 -12.231 -6.515 4.225
510 HG3 ARG 65 3HG ARG 65 -13.334 -7.892 4.150
511 HD2 ARG 65 2HD ARG 65 -12.085 -8.843 2.234
512 HD3 ARG 65 3HD ARG 65 -10.921 -7.520 2.330
513 HE ARG 65 HE ARG 65 -11.237 -8.967 4.841
514 HH11 ARG 65 1HH2 ARG 65 -9.429 -8.978 1.805
515 HH12 ARG 65 2HH2 ARG 65 -8.249 -10.090 2.443
516 HH21 ARG 65 1HH1 ARG 65 -9.653 -10.340 5.561
517 HH22 ARG 65 2HH1 ARG 65 -8.348 -10.795 4.509
518 H HIS 66 H HIS 66 -11.808 -3.760 3.620
519 HA HIS 66 HA HIS 66 -13.671 -1.517 3.792
520 HB2 HIS 66 2HB HIS 66 -13.622 -1.522 6.312
521 HB3 HIS 66 3HB HIS 66 -14.731 -2.593 5.490
522 HD2 HIS 66 HD2 HIS 66 -11.245 -4.114 5.755
523 HE1 HIS 66 HE1 HIS 66 -13.528 -5.755 8.956
524 HE2 HIS 66 HE2 HIS 66 -11.347 -5.926 7.660
525 HA PRO 67 HA PRO 67 -9.199 -0.789 3.503
526 HB2 PRO 67 2HB PRO 67 -9.265 1.504 1.884
527 HB3 PRO 67 3HB PRO 67 -9.318 -0.167 1.261
528 HG2 PRO 67 2HG PRO 67 -11.653 1.663 1.856
529 HG3 PRO 67 3HG PRO 67 -11.358 0.687 0.378
530 HD2 PRO 67 2HD PRO 67 -13.016 -0.179 2.295
531 HD3 PRO 67 3HD PRO 67 -11.875 -1.333 1.538
532 H ASP 68 H ASP 68 -11.624 1.615 4.414
533 HA ASP 68 HA ASP 68 -9.836 3.479 5.641
534 HB2 ASP 68 2HB ASP 68 -12.266 3.736 4.871
535 HB3 ASP 68 3HB ASP 68 -12.754 2.857 6.311
536 H VAL 69 H VAL 69 -10.861 0.342 6.598
537 HA VAL 69 HA VAL 69 -10.320 0.759 9.476
538 HB VAL 69 HB VAL 69 -11.465 -1.671 8.048
539 HG11 VAL 69 1HG1 VAL 69 -12.257 -2.321 10.295
540 HG12 VAL 69 2HG1 VAL 69 -10.498 -2.267 10.211
541 HG13 VAL 69 3HG1 VAL 69 -11.385 -0.941 11.001
542 HG21 VAL 69 3HG2 VAL 69 -13.008 0.227 7.798
543 HG22 VAL 69 1HG2 VAL 69 -13.653 -0.943 8.949
544 HG23 VAL 69 2HG2 VAL 69 -12.906 0.561 9.542
545 H GLU 70 H GLU 70 -9.211 -1.072 6.647
546 HA GLU 70 HA GLU 70 -7.150 -2.441 8.330
547 HB2 GLU 70 2HB GLU 70 -8.507 -3.153 5.718
548 HB3 GLU 70 3HB GLU 70 -7.056 -3.988 6.258
549 HG2 GLU 70 2HG GLU 70 -9.616 -3.793 7.875
550 HG3 GLU 70 3HG GLU 70 -9.149 -5.165 6.864
551 H VAL 71 H VAL 71 -7.229 -0.186 5.630
552 HA VAL 71 HA VAL 71 -4.305 -0.478 5.112
553 HB VAL 71 HB VAL 71 -6.163 1.623 4.031
554 HG11 VAL 71 1HG1 VAL 71 -3.456 0.477 3.203
555 HG12 VAL 71 2HG1 VAL 71 -4.355 1.808 2.429
556 HG13 VAL 71 3HG1 VAL 71 -3.687 2.005 4.073
557 HG21 VAL 71 3HG2 VAL 71 -6.109 0.175 1.978
558 HG22 VAL 71 1HG2 VAL 71 -5.293 -1.097 2.925
559 HG23 VAL 71 2HG2 VAL 71 -6.951 -0.625 3.312
560 H ASP 72 H ASP 72 -3.285 -0.144 6.931
561 HA ASP 72 HA ASP 72 -3.479 2.139 8.657
562 HB2 ASP 72 2HB ASP 72 -2.324 -0.043 9.127
563 HB3 ASP 72 3HB ASP 72 -1.095 0.385 7.932
564 H GLY 73 H GLY 73 -2.352 4.123 8.588
565 HA2 GLY 73 2HA GLY 73 -1.001 5.837 7.785
566 HA3 GLY 73 3HA GLY 73 -0.387 4.759 6.532
567 H PHE 74 H PHE 74 -3.511 4.413 5.938
568 HA PHE 74 HA PHE 74 -3.952 6.209 3.786
569 HB2 PHE 74 2HB PHE 74 -5.177 4.111 4.247
570 HB3 PHE 74 3HB PHE 74 -5.823 4.784 5.736
571 HD1 PHE 74 HD2 PHE 74 -7.656 6.400 5.734
572 HD2 PHE 74 HD1 PHE 74 -6.123 4.718 2.069
573 HE1 PHE 74 HE2 PHE 74 -9.690 7.159 4.539
574 HE2 PHE 74 HE1 PHE 74 -8.176 5.454 0.883
575 HZ PHE 74 HZ PHE 74 -9.948 6.689 2.112
576 H SER 75 H SER 75 -4.289 6.753 7.249
577 HA SER 75 HA SER 75 -5.843 9.162 7.256
578 HB2 SER 75 2HB SER 75 -4.614 9.487 9.466
579 HB3 SER 75 3HB SER 75 -5.550 7.988 9.295
580 HG SER 75 HG SER 75 -3.405 7.674 10.164
581 H GLU 76 H GLU 76 -2.480 8.571 6.370
582 HA GLU 76 HA GLU 76 -1.727 11.409 6.646
583 HB2 GLU 76 2HB GLU 76 -0.110 9.074 5.554
584 HB3 GLU 76 3HB GLU 76 0.483 10.677 5.982
585 HG2 GLU 76 2HG GLU 76 -0.245 10.251 8.366
586 HG3 GLU 76 3HG GLU 76 -0.626 8.586 7.907
587 H LEU 77 H LEU 77 -3.105 9.431 4.194
588 HA LEU 77 HA LEU 77 -2.026 10.769 1.850
589 HB2 LEU 77 2HB LEU 77 -4.291 8.846 2.391
590 HB3 LEU 77 3HB LEU 77 -4.230 9.707 0.868
591 HG LEU 77 HG LEU 77 -2.171 8.731 0.226
592 HD11 LEU 77 1HD1 LEU 77 -2.057 7.356 2.927
593 HD12 LEU 77 2HD1 LEU 77 -1.027 6.982 1.523
594 HD13 LEU 77 3HD1 LEU 77 -0.920 8.566 2.296
595 HD21 LEU 77 3HD2 LEU 77 -2.878 6.396 0.057
596 HD22 LEU 77 1HD2 LEU 77 -4.024 6.625 1.400
597 HD23 LEU 77 2HD2 LEU 77 -4.267 7.472 -0.135
598 H ARG 78 H ARG 78 -2.986 12.276 0.524
599 HA ARG 78 HA ARG 78 -5.017 14.091 1.659
600 HB2 ARG 78 2HB ARG 78 -3.495 13.999 -0.990
601 HB3 ARG 78 3HB ARG 78 -4.798 15.147 -0.714
602 HG2 ARG 78 2HG ARG 78 -2.271 14.963 0.979
603 HG3 ARG 78 3HG ARG 78 -2.592 16.147 -0.295
604 HD2 ARG 78 2HD ARG 78 -4.634 16.899 0.968
605 HD3 ARG 78 3HD ARG 78 -4.196 15.842 2.295
606 HE ARG 78 HE ARG 78 -2.961 18.394 1.579
607 HH11 ARG 78 1HH2 ARG 78 -2.359 15.438 3.379
608 HH12 ARG 78 2HH2 ARG 78 -1.152 16.196 4.379
609 HH21 ARG 78 1HH1 ARG 78 -1.413 19.281 2.890
610 HH22 ARG 78 2HH1 ARG 78 -0.636 18.310 4.105
611 H TRP 79 H TRP 79 -6.897 14.703 0.482
612 HA TRP 79 HA TRP 79 -8.677 12.617 0.470
613 HB2 TRP 79 2HB TRP 79 -9.865 14.480 0.742
614 HB3 TRP 79 3HB TRP 79 -8.741 15.464 -0.168
615 HD1 TRP 79 HD1 TRP 79 -11.985 13.518 -0.612
616 HE1 TRP 79 HE1 TRP 79 -13.022 14.093 -2.893
617 HE3 TRP 79 HE3 TRP 79 -8.130 16.227 -2.570
618 HZ2 TRP 79 HZ2 TRP 79 -12.286 15.608 -5.253
619 HZ3 TRP 79 HZ3 TRP 79 -8.291 17.201 -4.852
620 HH2 TRP 79 HH2 TRP 79 -10.364 16.901 -6.201
621 H ASP 80 H ASP 80 -6.983 13.898 -2.394
622 HA ASP 80 HA ASP 80 -8.508 12.411 -4.289
623 HB2 ASP 80 2HB ASP 80 -7.215 14.480 -4.783
624 HB3 ASP 80 3HB ASP 80 -5.724 13.541 -4.644
625 H ASP 81 H ASP 81 -5.740 11.453 -2.338
626 HA ASP 81 HA ASP 81 -5.229 9.026 -3.953
627 HB2 ASP 81 2HB ASP 81 -3.868 10.189 -1.505
628 HB3 ASP 81 3HB ASP 81 -3.522 8.583 -2.153
629 H GLN 82 H GLN 82 -6.645 10.081 -0.829
630 HA GLN 82 HA GLN 82 -7.366 7.514 0.148
631 HB2 GLN 82 2HB GLN 82 -8.593 10.277 0.450
632 HB3 GLN 82 3HB GLN 82 -9.304 8.860 1.220
633 HG2 GLN 82 2HG GLN 82 -7.185 8.381 2.376
634 HG3 GLN 82 3HG GLN 82 -6.449 9.811 1.648
635 HE21 GLN 82 2HE2 GLN 82 -6.520 9.498 4.434
636 HE22 GLN 82 1HE2 GLN 82 -7.610 10.727 5.082
637 H GLN 83 H GLN 83 -9.334 9.744 -1.945
638 HA GLN 83 HA GLN 83 -11.424 7.819 -2.264
639 HB2 GLN 83 2HB GLN 83 -12.394 9.260 -3.844
640 HB3 GLN 83 3HB GLN 83 -11.660 10.270 -2.599
641 HG2 GLN 83 2HG GLN 83 -9.703 10.627 -4.150
642 HG3 GLN 83 3HG GLN 83 -10.565 9.745 -5.404
643 HE21 GLN 83 2HE2 GLN 83 -9.813 12.353 -6.061
644 HE22 GLN 83 1HE2 GLN 83 -11.240 13.368 -5.980
645 H LYS 84 H LYS 84 -8.331 8.062 -3.944
646 HA LYS 84 HA LYS 84 -9.107 6.387 -6.208
647 HB2 LYS 84 2HB LYS 84 -7.561 8.193 -6.512
648 HB3 LYS 84 3HB LYS 84 -6.543 7.650 -5.185
649 HG2 LYS 84 2HG LYS 84 -6.954 5.841 -7.562
650 HG3 LYS 84 3HG LYS 84 -5.898 7.239 -7.721
651 HD2 LYS 84 2HD LYS 84 -5.613 5.050 -5.641
652 HD3 LYS 84 3HD LYS 84 -4.652 5.209 -7.119
653 HE2 LYS 84 2HE LYS 84 -4.654 7.045 -4.691
654 HE3 LYS 84 3HE LYS 84 -3.388 5.916 -5.152
655 HZ1 LYS 84 3HZ LYS 84 -2.979 8.290 -5.761
656 HZ2 LYS 84 1HZ LYS 84 -2.862 7.261 -7.047
657 HZ3 LYS 84 2HZ LYS 84 -4.179 8.218 -6.852
658 H VAL 85 H VAL 85 -7.337 6.033 -3.101
659 HA VAL 85 HA VAL 85 -6.769 3.201 -3.508
660 HB VAL 85 HB VAL 85 -6.943 4.935 -1.008
661 HG11 VAL 85 1HG1 VAL 85 -5.801 3.079 0.227
662 HG12 VAL 85 2HG1 VAL 85 -7.461 2.687 -0.205
663 HG13 VAL 85 3HG1 VAL 85 -6.111 2.000 -1.145
664 HG21 VAL 85 3HG2 VAL 85 -4.505 3.568 -2.200
665 HG22 VAL 85 1HG2 VAL 85 -4.985 5.221 -2.634
666 HG23 VAL 85 2HG2 VAL 85 -4.566 4.831 -0.961
667 H LYS 86 H LYS 86 -9.464 4.892 -1.806
668 HA LYS 86 HA LYS 86 -10.949 2.517 -1.189
669 HB2 LYS 86 2HB LYS 86 -11.821 5.405 -1.638
670 HB3 LYS 86 3HB LYS 86 -12.933 4.105 -1.184
671 HG2 LYS 86 2HG LYS 86 -11.490 3.608 0.804
672 HG3 LYS 86 3HG LYS 86 -10.518 5.035 0.438
673 HD2 LYS 86 2HD LYS 86 -12.368 6.511 0.840
674 HD3 LYS 86 3HD LYS 86 -13.534 5.164 0.884
675 HE2 LYS 86 2HE LYS 86 -12.688 4.297 2.911
676 HE3 LYS 86 3HE LYS 86 -11.222 5.259 2.832
677 HZ1 LYS 86 3HZ LYS 86 -12.661 6.254 4.422
678 HZ2 LYS 86 1HZ LYS 86 -12.655 7.266 3.142
679 HZ3 LYS 86 2HZ LYS 86 -13.947 6.292 3.394
680 H LYS 87 H LYS 87 -11.146 4.625 -4.098
681 HA LYS 87 HA LYS 87 -13.145 3.042 -5.427
682 HB2 LYS 87 2HB LYS 87 -12.654 5.334 -6.033
683 HB3 LYS 87 3HB LYS 87 -11.049 4.872 -6.641
684 HG2 LYS 87 2HG LYS 87 -12.023 3.554 -8.420
685 HG3 LYS 87 3HG LYS 87 -13.643 3.653 -7.693
686 HD2 LYS 87 2HD LYS 87 -13.703 6.060 -8.053
687 HD3 LYS 87 3HD LYS 87 -12.061 6.030 -8.742
688 HE2 LYS 87 2HE LYS 87 -12.861 4.519 -10.555
689 HE3 LYS 87 3HE LYS 87 -14.490 4.554 -9.868
690 HZ1 LYS 87 3HZ LYS 87 -14.265 6.145 -11.688
691 HZ2 LYS 87 1HZ LYS 87 -14.551 6.954 -10.302
692 HZ3 LYS 87 2HZ LYS 87 -13.044 6.923 -10.937
693 H THR 88 H THR 88 -9.562 2.843 -5.607
694 HA THR 88 HA THR 88 -9.467 0.773 -7.522
695 HB THR 88 HB THR 88 -7.420 1.400 -5.380
696 HG1 THR 88 1HG THR 88 -7.770 3.156 -6.666
697 HG21 THR 88 1HG2 THR 88 -7.281 -0.059 -8.047
698 HG22 THR 88 2HG2 THR 88 -5.871 0.446 -7.081
699 HG23 THR 88 3HG2 THR 88 -6.995 -0.766 -6.444
700 H ALA 89 H ALA 89 -9.848 0.579 -3.974
701 HA ALA 89 HA ALA 89 -9.558 -2.292 -3.810
702 HB1 ALA 89 1HB ALA 89 -10.506 -1.926 -1.560
703 HB2 ALA 89 2HB ALA 89 -9.149 -0.834 -1.912
704 HB3 ALA 89 3HB ALA 89 -10.819 -0.224 -1.966
705 H GLU 90 H GLU 90 -12.340 -0.033 -4.207
706 HA GLU 90 HA GLU 90 -14.331 -2.113 -4.272
707 HB2 GLU 90 2HB GLU 90 -14.354 0.728 -5.369
708 HB3 GLU 90 3HB GLU 90 -15.746 -0.357 -5.412
709 HG2 GLU 90 2HG GLU 90 -15.650 -0.567 -2.930
710 HG3 GLU 90 3HG GLU 90 -14.340 0.611 -2.895
711 H ALA 91 H ALA 91 -12.342 -0.625 -6.772
712 HA ALA 91 HA ALA 91 -13.587 -1.904 -9.025
713 HB1 ALA 91 1HB ALA 91 -10.921 -0.462 -8.655
714 HB2 ALA 91 2HB ALA 91 -11.670 -0.854 -10.221
715 HB3 ALA 91 3HB ALA 91 -12.460 0.284 -9.111
716 H GLY 92 H GLY 92 -11.430 -3.182 -6.696
717 HA2 GLY 92 2HA GLY 92 -10.459 -5.268 -6.538
718 HA3 GLY 92 3HA GLY 92 -11.080 -5.685 -8.137
719 H GLY 93 H GLY 93 -9.034 -2.832 -7.617
720 HA2 GLY 93 2HA GLY 93 -6.677 -2.710 -7.770
721 HA3 GLY 93 3HA GLY 93 -6.622 -4.221 -8.668
722 H VAL 94 H VAL 94 -5.490 -1.563 -9.170
723 HA VAL 94 HA VAL 94 -6.565 -1.030 -11.917
724 HB VAL 94 HB VAL 94 -6.933 0.751 -10.201
725 HG11 VAL 94 1HG1 VAL 94 -5.149 2.182 -9.478
726 HG12 VAL 94 2HG1 VAL 94 -4.682 0.532 -9.045
727 HG13 VAL 94 3HG1 VAL 94 -3.948 1.314 -10.455
728 HG21 VAL 94 3HG2 VAL 94 -6.960 1.233 -12.616
729 HG22 VAL 94 1HG2 VAL 94 -6.385 2.603 -11.651
730 HG23 VAL 94 2HG2 VAL 94 -5.224 1.614 -12.558
731 H THR 95 H THR 95 -3.602 -1.598 -10.120
732 HA THR 95 HA THR 95 -1.459 -1.969 -10.727
733 HB THR 95 HB THR 95 -1.000 -3.451 -12.447
734 HG1 THR 95 1HG THR 95 -3.343 -2.467 -13.663
735 HG21 THR 95 1HG2 THR 95 -3.907 -3.996 -11.721
736 HG22 THR 95 2HG2 THR 95 -2.675 -5.175 -12.221
737 HG23 THR 95 3HG2 THR 95 -2.513 -4.331 -10.670
738 H GLY 96 H GLY 96 -0.436 -1.774 -13.629
739 HA2 GLY 96 2HA GLY 96 0.233 0.048 -15.029
740 HA3 GLY 96 3HA GLY 96 -0.083 1.189 -13.729
741 H LYS 97 H LYS 97 2.201 1.524 -15.015
742 HA LYS 97 HA LYS 97 4.370 0.703 -13.140
743 HB2 LYS 97 2HB LYS 97 4.471 0.405 -16.178
744 HB3 LYS 97 3HB LYS 97 5.860 0.251 -15.100
745 HG2 LYS 97 2HG LYS 97 4.773 -1.685 -13.972
746 HG3 LYS 97 3HG LYS 97 3.420 -1.574 -15.119
747 HD2 LYS 97 2HD LYS 97 4.992 -1.917 -17.010
748 HD3 LYS 97 3HD LYS 97 6.340 -2.059 -15.861
749 HE2 LYS 97 2HE LYS 97 5.237 -4.020 -14.809
750 HE3 LYS 97 3HE LYS 97 3.885 -3.873 -15.941
751 HZ1 LYS 97 3HZ LYS 97 5.452 -4.301 -17.761
752 HZ2 LYS 97 1HZ LYS 97 6.700 -4.436 -16.716
753 HZ3 LYS 97 2HZ LYS 97 5.493 -5.532 -16.693
754 H GLY 98 H GLY 98 6.214 2.035 -13.171
755 HA2 GLY 98 2HA GLY 98 7.114 3.897 -14.884
756 HA3 GLY 98 3HA GLY 98 5.861 4.833 -14.076
757 H GLN 99 H GLN 99 9.099 4.079 -14.026
758 HA GLN 99 HA GLN 99 9.539 5.595 -11.582
759 HB2 GLN 99 2HB GLN 99 9.308 3.398 -10.593
760 HB3 GLN 99 3HB GLN 99 10.425 2.679 -11.758
761 HG2 GLN 99 2HG GLN 99 12.313 3.842 -10.815
762 HG3 GLN 99 3HG GLN 99 11.275 4.871 -9.821
763 HE21 GLN 99 2HE2 GLN 99 13.512 3.129 -8.953
764 HE22 GLN 99 1HE2 GLN 99 12.738 2.124 -7.706
765 H ASP 100 H ASP 100 11.565 6.532 -11.491
766 HA ASP 100 HA ASP 100 13.702 5.644 -13.328
767 HB2 ASP 100 2HB ASP 100 12.737 7.643 -14.392
768 HB3 ASP 100 3HB ASP 100 12.912 8.549 -12.886
769 H GLY 101 H GLY 101 15.733 5.635 -12.360
770 HA2 GLY 101 2HA GLY 101 17.305 5.695 -10.646
771 HA3 GLY 101 3HA GLY 101 16.250 6.736 -9.694
772 H ILE 102 H ILE 102 17.318 5.122 -8.109
773 HA ILE 102 HA ILE 102 15.578 2.738 -7.723
774 HB ILE 102 HB ILE 102 17.793 2.267 -8.755
775 HG12 ILE 102 2HG1 ILE 102 18.403 0.324 -7.489
776 HG13 ILE 102 3HG1 ILE 102 17.556 0.883 -6.056
777 HG21 ILE 102 1HG2 ILE 102 18.964 3.019 -6.041
778 HG22 ILE 102 2HG2 ILE 102 19.836 2.308 -7.412
779 HG23 ILE 102 3HG2 ILE 102 19.164 3.935 -7.552
780 HD11 ILE 102 3HD1 ILE 102 15.391 0.626 -7.194
781 HD12 ILE 102 1HD1 ILE 102 16.219 0.222 -8.718
782 HD13 ILE 102 2HD1 ILE 102 16.325 -0.873 -7.324
783 H GLY 103 H GLY 103 15.484 5.452 -6.512
784 HA2 GLY 103 2HA GLY 103 14.699 6.243 -4.492
785 HA3 GLY 103 3HA GLY 103 14.643 4.565 -3.923
786 H SER 104 H SER 104 15.662 4.469 -2.041
787 HA SER 104 HA SER 104 18.253 5.896 -1.600
788 HB2 SER 104 2HB SER 104 16.191 5.429 0.560
789 HB3 SER 104 3HB SER 104 17.625 6.452 0.619
790 HG SER 104 HG SER 104 16.627 7.833 -0.908
791 H LYS 105 H LYS 105 18.008 3.274 -2.624
792 HA LYS 105 HA LYS 105 17.952 1.134 -0.884
793 HB2 LYS 105 2HB LYS 105 18.024 1.134 -3.389
794 HB3 LYS 105 3HB LYS 105 19.773 1.397 -3.316
795 HG2 LYS 105 2HG LYS 105 20.086 -0.774 -2.218
796 HG3 LYS 105 3HG LYS 105 18.347 -0.958 -2.006
797 HD2 LYS 105 2HD LYS 105 19.024 -2.362 -3.855
798 HD3 LYS 105 3HD LYS 105 18.007 -1.058 -4.439
799 HE2 LYS 105 2HE LYS 105 19.718 -1.290 -6.047
800 HE3 LYS 105 3HE LYS 105 20.106 0.183 -5.155
801 HZ1 LYS 105 3HZ LYS 105 21.362 -2.481 -4.714
802 HZ2 LYS 105 1HZ LYS 105 22.091 -1.201 -5.437
803 HZ3 LYS 105 2HZ LYS 105 21.719 -1.116 -3.868
804 H ALA 106 H ALA 106 19.246 0.110 0.521
805 HA ALA 106 HA ALA 106 20.981 1.783 1.957
806 HB1 ALA 106 1HB ALA 106 20.483 -1.211 2.258
807 HB2 ALA 106 2HB ALA 106 21.148 -0.131 3.502
808 HB3 ALA 106 3HB ALA 106 19.482 0.094 2.942
809 H GLU 107 H GLU 107 21.834 -0.587 -0.437
810 HA GLU 107 HA GLU 107 24.686 0.229 -0.231
811 HB2 GLU 107 2HB GLU 107 23.700 -2.603 -0.791
812 HB3 GLU 107 3HB GLU 107 25.355 -2.031 -1.029
813 HG2 GLU 107 2HG GLU 107 25.502 -1.475 1.401
814 HG3 GLU 107 3HG GLU 107 23.884 -2.144 1.640
815 H LYS 108 H LYS 108 25.750 0.218 -2.354
816 HA LYS 108 HA LYS 108 23.884 1.117 -4.452
817 HB2 LYS 108 2HB LYS 108 26.923 1.136 -4.381
818 HB3 LYS 108 3HB LYS 108 25.910 1.894 -5.604
819 HG2 LYS 108 2HG LYS 108 26.063 2.666 -2.658
820 HG3 LYS 108 3HG LYS 108 26.756 3.543 -4.021
821 HD2 LYS 108 2HD LYS 108 24.449 3.887 -4.943
822 HD3 LYS 108 3HD LYS 108 23.772 3.145 -3.488
823 HE2 LYS 108 2HE LYS 108 25.557 5.618 -3.518
824 HE3 LYS 108 3HE LYS 108 23.794 5.657 -3.488
825 HZ1 LYS 108 3HZ LYS 108 25.499 4.471 -1.365
826 HZ2 LYS 108 1HZ LYS 108 24.679 5.875 -1.259
827 HZ3 LYS 108 2HZ LYS 108 23.861 4.467 -1.359
Start of MODEL 8
1 H1 MET 1 H1 MET 1 11.918 5.745 16.512
2 H2 MET 1 H2 MET 1 11.809 5.160 18.034
3 H3 MET 1 H3 MET 1 11.621 6.765 17.761
4 HA MET 1 HA MET 1 9.490 5.703 18.180
5 HB2 MET 1 2HB MET 1 9.903 6.785 15.357
6 HB3 MET 1 3HB MET 1 8.327 6.384 16.029
7 HG2 MET 1 2HG MET 1 8.590 8.707 16.279
8 HG3 MET 1 3HG MET 1 8.691 7.994 17.883
9 HE1 MET 1 1HE MET 1 9.550 10.307 18.829
10 HE2 MET 1 2HE MET 1 10.923 11.208 18.151
11 HE3 MET 1 3HE MET 1 9.436 11.008 17.198
12 H ALA 2 H ALA 2 7.844 4.229 17.482
13 HA ALA 2 HA ALA 2 8.559 2.104 15.562
14 HB1 ALA 2 1HB ALA 2 7.925 1.562 18.501
15 HB2 ALA 2 2HB ALA 2 8.131 0.333 17.234
16 HB3 ALA 2 3HB ALA 2 9.508 1.336 17.720
17 H GLU 3 H GLU 3 6.712 0.621 15.184
18 HA GLU 3 HA GLU 3 4.009 1.756 15.751
19 HB2 GLU 3 2HB GLU 3 5.044 0.921 13.008
20 HB3 GLU 3 3HB GLU 3 3.360 1.269 13.412
21 HG2 GLU 3 2HG GLU 3 4.049 3.601 14.077
22 HG3 GLU 3 3HG GLU 3 5.677 3.247 13.480
23 H SER 4 H SER 4 2.336 0.311 15.822
24 HA SER 4 HA SER 4 2.962 -2.481 16.391
25 HB2 SER 4 2HB SER 4 0.331 -0.970 16.274
26 HB3 SER 4 3HB SER 4 0.533 -2.638 16.857
27 HG SER 4 HG SER 4 0.561 -1.098 18.572
28 H SER 5 H SER 5 2.062 -4.302 15.361
29 HA SER 5 HA SER 5 1.415 -3.964 12.460
30 HB2 SER 5 2HB SER 5 2.987 -6.237 13.704
31 HB3 SER 5 3HB SER 5 2.702 -5.934 11.980
32 HG SER 5 HG SER 5 4.769 -5.278 12.691
33 H ASP 6 H ASP 6 -0.577 -3.980 14.360
34 HA ASP 6 HA ASP 6 -1.761 -6.612 14.388
35 HB2 ASP 6 2HB ASP 6 -3.442 -5.569 15.832
36 HB3 ASP 6 3HB ASP 6 -1.814 -5.168 16.356
37 H LYS 7 H LYS 7 -1.556 -4.796 11.821
38 HA LYS 7 HA LYS 7 -4.366 -4.921 10.827
39 HB2 LYS 7 2HB LYS 7 -2.083 -3.450 9.540
40 HB3 LYS 7 3HB LYS 7 -3.817 -3.265 9.311
41 HG2 LYS 7 2HG LYS 7 -3.639 -1.489 10.696
42 HG3 LYS 7 3HG LYS 7 -3.650 -2.656 11.994
43 HD2 LYS 7 2HD LYS 7 -1.144 -2.753 11.918
44 HD3 LYS 7 3HD LYS 7 -1.158 -1.572 10.605
45 HE2 LYS 7 2HE LYS 7 -2.486 -0.056 12.262
46 HE3 LYS 7 3HE LYS 7 -1.949 -1.191 13.514
47 HZ1 LYS 7 3HZ LYS 7 0.352 -0.695 12.863
48 HZ2 LYS 7 1HZ LYS 7 -0.158 0.344 11.693
49 HZ3 LYS 7 2HZ LYS 7 -0.426 0.694 13.267
50 H LEU 8 H LEU 8 -4.112 -5.170 8.324
51 HA LEU 8 HA LEU 8 -2.280 -7.445 7.698
52 HB2 LEU 8 2HB LEU 8 -3.913 -8.301 6.143
53 HB3 LEU 8 3HB LEU 8 -4.444 -8.404 7.808
54 HG LEU 8 HG LEU 8 -5.391 -6.149 5.999
55 HD11 LEU 8 1HD1 LEU 8 -6.658 -8.899 6.422
56 HD12 LEU 8 2HD1 LEU 8 -7.349 -7.553 5.489
57 HD13 LEU 8 3HD1 LEU 8 -5.874 -8.350 4.927
58 HD21 LEU 8 3HD2 LEU 8 -7.440 -6.310 7.462
59 HD22 LEU 8 1HD2 LEU 8 -6.550 -7.435 8.505
60 HD23 LEU 8 2HD2 LEU 8 -6.013 -5.752 8.314
61 H TYR 9 H TYR 9 -3.335 -4.227 6.854
62 HA TYR 9 HA TYR 9 -1.629 -4.300 4.430
63 HB2 TYR 9 2HB TYR 9 -4.381 -3.043 4.527
64 HB3 TYR 9 3HB TYR 9 -3.279 -3.044 3.160
65 HD1 TYR 9 HD1 TYR 9 -2.466 -5.932 3.093
66 HD2 TYR 9 HD2 TYR 9 -6.299 -4.072 3.636
67 HE1 TYR 9 HE1 TYR 9 -3.562 -7.970 2.194
68 HE2 TYR 9 HE2 TYR 9 -7.410 -6.102 2.726
69 HH TYR 9 HH TYR 9 -5.526 -8.961 1.629
70 H ARG 10 H ARG 10 -0.856 -2.307 3.787
71 HA ARG 10 HA ARG 10 -1.059 0.020 5.620
72 HB2 ARG 10 2HB ARG 10 0.807 -1.230 6.464
73 HB3 ARG 10 3HB ARG 10 1.381 -1.589 4.855
74 HG2 ARG 10 2HG ARG 10 2.884 -0.070 5.906
75 HG3 ARG 10 3HG ARG 10 2.130 0.746 4.546
76 HD2 ARG 10 2HD ARG 10 0.786 2.108 5.958
77 HD3 ARG 10 3HD ARG 10 0.970 1.026 7.347
78 HE ARG 10 HE ARG 10 3.184 2.764 6.260
79 HH11 ARG 10 1HH2 ARG 10 1.437 1.691 9.223
80 HH12 ARG 10 2HH2 ARG 10 2.564 2.634 10.161
81 HH21 ARG 10 1HH1 ARG 10 4.448 3.736 7.576
82 HH22 ARG 10 2HH1 ARG 10 4.313 3.533 9.346
83 H VAL 11 H VAL 11 -0.805 1.993 4.561
84 HA VAL 11 HA VAL 11 0.331 2.122 1.850
85 HB VAL 11 HB VAL 11 -2.179 1.850 1.698
86 HG11 VAL 11 1HG1 VAL 11 -2.288 4.786 2.525
87 HG12 VAL 11 2HG1 VAL 11 -3.638 3.733 2.071
88 HG13 VAL 11 3HG1 VAL 11 -2.750 3.467 3.588
89 HG21 VAL 11 3HG2 VAL 11 -1.087 4.470 0.551
90 HG22 VAL 11 1HG2 VAL 11 -0.717 2.894 -0.126
91 HG23 VAL 11 2HG2 VAL 11 -2.392 3.472 -0.127
92 H GLU 12 H GLU 12 1.442 4.048 1.465
93 HA GLU 12 HA GLU 12 0.928 6.442 3.017
94 HB2 GLU 12 2HB GLU 12 3.116 6.605 4.119
95 HB3 GLU 12 3HB GLU 12 2.199 5.254 4.755
96 HG2 GLU 12 2HG GLU 12 3.541 3.676 3.408
97 HG3 GLU 12 3HG GLU 12 4.431 5.026 2.689
98 H TYR 13 H TYR 13 2.249 8.229 2.532
99 HA TYR 13 HA TYR 13 3.649 8.245 -0.054
100 HB2 TYR 13 2HB TYR 13 3.459 10.320 2.155
101 HB3 TYR 13 3HB TYR 13 4.170 10.565 0.566
102 HD1 TYR 13 HD1 TYR 13 1.755 8.877 -0.838
103 HD2 TYR 13 HD2 TYR 13 1.994 12.230 1.874
104 HE1 TYR 13 HE1 TYR 13 -0.287 9.851 -1.855
105 HE2 TYR 13 HE2 TYR 13 -0.107 13.154 0.902
106 HH TYR 13 HH TYR 13 -1.673 11.673 -1.956
107 H ALA 14 H ALA 14 5.721 7.773 -0.308
108 HA ALA 14 HA ALA 14 7.115 6.453 1.739
109 HB1 ALA 14 1HB ALA 14 8.063 7.429 -0.985
110 HB2 ALA 14 2HB ALA 14 8.881 6.204 -0.001
111 HB3 ALA 14 3HB ALA 14 7.255 5.890 -0.649
112 H LYS 15 H LYS 15 8.170 7.233 3.418
113 HA LYS 15 HA LYS 15 9.000 9.943 3.771
114 HB2 LYS 15 2HB LYS 15 10.055 7.549 5.332
115 HB3 LYS 15 3HB LYS 15 9.942 9.223 5.864
116 HG2 LYS 15 2HG LYS 15 7.668 7.272 5.390
117 HG3 LYS 15 3HG LYS 15 8.217 7.924 6.931
118 HD2 LYS 15 2HD LYS 15 7.495 10.189 6.274
119 HD3 LYS 15 3HD LYS 15 6.948 9.597 4.699
120 HE2 LYS 15 2HE LYS 15 5.867 8.665 7.383
121 HE3 LYS 15 3HE LYS 15 5.119 9.876 6.332
122 HZ1 LYS 15 3HZ LYS 15 4.094 7.769 5.937
123 HZ2 LYS 15 1HZ LYS 15 4.974 8.151 4.595
124 HZ3 LYS 15 2HZ LYS 15 5.535 7.015 5.614
125 H SER 16 H SER 16 10.812 7.071 2.900
126 HA SER 16 HA SER 16 12.911 8.524 1.535
127 HB2 SER 16 2HB SER 16 13.697 8.620 3.911
128 HB3 SER 16 3HB SER 16 13.677 6.848 3.963
129 HG SER 16 HG SER 16 15.753 7.825 3.419
130 H GLY 17 H GLY 17 14.401 6.980 0.475
131 HA2 GLY 17 2HA GLY 17 12.924 4.807 -0.767
132 HA3 GLY 17 3HA GLY 17 14.540 5.373 -1.191
133 H ARG 18 H ARG 18 13.404 4.166 1.966
134 HA ARG 18 HA ARG 18 15.596 2.157 2.060
135 HB2 ARG 18 2HB ARG 18 13.584 3.007 4.185
136 HB3 ARG 18 3HB ARG 18 14.962 1.945 4.435
137 HG2 ARG 18 2HG ARG 18 15.041 4.907 3.744
138 HG3 ARG 18 3HG ARG 18 15.478 4.160 5.274
139 HD2 ARG 18 2HD ARG 18 16.944 3.876 2.624
140 HD3 ARG 18 3HD ARG 18 17.469 4.813 4.018
141 HE ARG 18 HE ARG 18 17.467 2.559 5.273
142 HH11 ARG 18 1HH2 ARG 18 18.393 2.789 1.895
143 HH12 ARG 18 2HH2 ARG 18 19.366 1.345 1.979
144 HH21 ARG 18 1HH1 ARG 18 18.728 0.744 5.301
145 HH22 ARG 18 2HH1 ARG 18 19.557 0.234 3.861
146 H ALA 19 H ALA 19 12.269 2.139 1.308
147 HA ALA 19 HA ALA 19 11.952 -0.758 1.856
148 HB1 ALA 19 1HB ALA 19 10.108 0.749 2.491
149 HB2 ALA 19 2HB ALA 19 9.978 1.303 0.802
150 HB3 ALA 19 3HB ALA 19 9.623 -0.381 1.215
151 H SER 20 H SER 20 11.564 -2.280 0.228
152 HA SER 20 HA SER 20 11.957 -1.443 -2.593
153 HB2 SER 20 2HB SER 20 13.429 -3.700 -1.201
154 HB3 SER 20 3HB SER 20 13.341 -3.497 -2.962
155 HG SER 20 HG SER 20 15.230 -2.535 -1.971
156 H CYS 21 HN CYS 21 11.097 -2.832 -4.167
157 HA CYS 21 HA CYS 21 8.440 -3.619 -3.280
158 HB2 CYS 21 2HB CYS 21 8.923 -2.141 -5.198
159 HB3 CYS 21 3HB CYS 21 9.718 -3.493 -6.025
160 H LYS 22 H LYS 22 7.928 -5.601 -2.688
161 HA LYS 22 HA LYS 22 9.637 -7.904 -3.139
162 HB2 LYS 22 2HB LYS 22 6.784 -7.809 -2.109
163 HB3 LYS 22 3HB LYS 22 7.900 -9.136 -1.878
164 HG2 LYS 22 2HG LYS 22 8.231 -6.320 -0.763
165 HG3 LYS 22 3HG LYS 22 7.561 -7.663 0.125
166 HD2 LYS 22 2HD LYS 22 10.396 -7.521 -0.981
167 HD3 LYS 22 3HD LYS 22 9.924 -7.183 0.694
168 HE2 LYS 22 2HE LYS 22 9.043 -9.504 0.918
169 HE3 LYS 22 3HE LYS 22 9.574 -9.860 -0.730
170 HZ1 LYS 22 3HZ LYS 22 11.865 -9.414 -0.020
171 HZ2 LYS 22 1HZ LYS 22 11.374 -9.093 1.507
172 HZ3 LYS 22 2HZ LYS 22 11.214 -10.596 0.896
173 H LYS 23 H LYS 23 7.275 -6.552 -5.128
174 HA LYS 23 HA LYS 23 6.484 -9.162 -6.339
175 HB2 LYS 23 2HB LYS 23 4.680 -7.752 -5.508
176 HB3 LYS 23 3HB LYS 23 5.219 -6.419 -6.527
177 HG2 LYS 23 2HG LYS 23 3.247 -7.537 -7.454
178 HG3 LYS 23 3HG LYS 23 4.622 -7.662 -8.550
179 HD2 LYS 23 2HD LYS 23 5.015 -10.007 -7.803
180 HD3 LYS 23 3HD LYS 23 3.661 -9.869 -6.662
181 HE2 LYS 23 2HE LYS 23 2.125 -9.444 -8.545
182 HE3 LYS 23 3HE LYS 23 3.474 -9.511 -9.686
183 HZ1 LYS 23 3HZ LYS 23 3.801 -11.841 -9.080
184 HZ2 LYS 23 1HZ LYS 23 2.581 -11.791 -7.992
185 HZ3 LYS 23 2HZ LYS 23 2.264 -11.625 -9.582
186 H CYS 24 HN CYS 24 7.615 -5.935 -7.490
187 HA CYS 24 HA CYS 24 8.368 -7.262 -10.041
188 HB2 CYS 24 2HB CYS 24 8.234 -5.272 -11.162
189 HB3 CYS 24 3HB CYS 24 6.795 -5.345 -10.152
190 H SER 25 H SER 25 9.856 -6.669 -7.214
191 HA SER 25 HA SER 25 11.955 -6.745 -6.475
192 HB2 SER 25 2HB SER 25 12.661 -7.863 -9.197
193 HB3 SER 25 3HB SER 25 13.619 -8.002 -7.712
194 HG SER 25 HG SER 25 12.315 -9.860 -8.091
195 H GLU 26 H GLU 26 11.152 -4.234 -7.848
196 HA GLU 26 HA GLU 26 13.850 -2.989 -8.230
197 HB2 GLU 26 2HB GLU 26 11.063 -1.897 -8.755
198 HB3 GLU 26 3HB GLU 26 12.571 -0.994 -8.944
199 HG2 GLU 26 2HG GLU 26 13.351 -2.760 -10.571
200 HG3 GLU 26 3HG GLU 26 11.720 -3.439 -10.535
201 H SER 27 H SER 27 13.615 -0.542 -7.198
202 HA SER 27 HA SER 27 12.905 -0.942 -4.326
203 HB2 SER 27 2HB SER 27 15.323 -0.752 -4.804
204 HB3 SER 27 3HB SER 27 14.994 0.925 -5.357
205 HG SER 27 HG SER 27 14.633 -0.224 -2.779
206 H ILE 28 H ILE 28 12.035 0.826 -3.181
207 HA ILE 28 HA ILE 28 10.132 2.148 -4.998
208 HB ILE 28 HB ILE 28 9.970 1.789 -1.995
209 HG12 ILE 28 2HG1 ILE 28 8.501 0.256 -4.197
210 HG13 ILE 28 3HG1 ILE 28 9.908 -0.366 -3.343
211 HG21 ILE 28 1HG2 ILE 28 7.824 2.664 -3.991
212 HG22 ILE 28 2HG2 ILE 28 7.619 2.416 -2.250
213 HG23 ILE 28 3HG2 ILE 28 8.629 3.732 -2.824
214 HD11 ILE 28 3HD1 ILE 28 8.676 -0.185 -1.181
215 HD12 ILE 28 1HD1 ILE 28 7.207 0.217 -2.104
216 HD13 ILE 28 2HD1 ILE 28 8.001 -1.346 -2.336
217 HA PRO 29 HA PRO 29 12.482 5.896 -4.283
218 HB2 PRO 29 2HB PRO 29 11.109 7.671 -5.837
219 HB3 PRO 29 3HB PRO 29 12.132 6.364 -6.508
220 HG2 PRO 29 2HG PRO 29 9.130 6.362 -6.103
221 HG3 PRO 29 3HG PRO 29 10.043 5.886 -7.564
222 HD2 PRO 29 2HD PRO 29 9.145 4.065 -5.736
223 HD3 PRO 29 3HD PRO 29 10.697 3.840 -6.600
224 H LYS 30 H LYS 30 12.353 7.903 -3.280
225 HA LYS 30 HA LYS 30 10.517 8.220 -1.045
226 HB2 LYS 30 2HB LYS 30 12.911 8.827 -0.999
227 HB3 LYS 30 3HB LYS 30 12.652 10.019 -2.275
228 HG2 LYS 30 2HG LYS 30 11.258 11.379 -0.792
229 HG3 LYS 30 3HG LYS 30 11.359 10.146 0.483
230 HD2 LYS 30 2HD LYS 30 13.806 10.473 0.625
231 HD3 LYS 30 3HD LYS 30 13.744 11.622 -0.724
232 HE2 LYS 30 2HE LYS 30 12.329 13.140 0.601
233 HE3 LYS 30 3HE LYS 30 12.341 12.002 1.959
234 HZ1 LYS 30 3HZ LYS 30 14.817 13.185 0.810
235 HZ2 LYS 30 1HZ LYS 30 14.043 13.819 2.120
236 HZ3 LYS 30 2HZ LYS 30 14.713 12.327 2.174
237 H ASP 31 H ASP 31 9.005 9.863 -0.724
238 HA ASP 31 HA ASP 31 7.144 10.990 -1.256
239 HB2 ASP 31 2HB ASP 31 8.921 12.704 -1.522
240 HB3 ASP 31 3HB ASP 31 8.902 12.429 -3.263
241 H SER 32 H SER 32 7.131 8.521 -2.411
242 HA SER 32 HA SER 32 5.280 8.924 -4.696
243 HB2 SER 32 2HB SER 32 5.947 6.918 -5.730
244 HB3 SER 32 3HB SER 32 7.443 7.806 -5.420
245 HG SER 32 HG SER 32 7.943 6.395 -3.789
246 H LEU 33 H LEU 33 3.730 6.943 -4.783
247 HA LEU 33 HA LEU 33 2.715 6.545 -2.030
248 HB2 LEU 33 2HB LEU 33 1.188 7.501 -3.760
249 HB3 LEU 33 3HB LEU 33 1.386 6.027 -4.712
250 HG LEU 33 HG LEU 33 0.419 4.720 -2.780
251 HD11 LEU 33 1HD1 LEU 33 -0.210 7.499 -1.699
252 HD12 LEU 33 2HD1 LEU 33 -0.955 6.001 -1.131
253 HD13 LEU 33 3HD1 LEU 33 0.776 6.252 -0.906
254 HD21 LEU 33 3HD2 LEU 33 -1.355 6.950 -3.831
255 HD22 LEU 33 1HD2 LEU 33 -0.935 5.468 -4.730
256 HD23 LEU 33 2HD2 LEU 33 -1.889 5.356 -3.238
257 H ARG 34 H ARG 34 2.878 4.666 -1.029
258 HA ARG 34 HA ARG 34 3.507 2.168 -2.511
259 HB2 ARG 34 2HB ARG 34 5.324 1.613 -1.057
260 HB3 ARG 34 3HB ARG 34 5.623 3.177 -1.821
261 HG2 ARG 34 2HG ARG 34 5.058 4.348 0.270
262 HG3 ARG 34 3HG ARG 34 4.685 2.798 1.057
263 HD2 ARG 34 2HD ARG 34 7.018 2.050 0.704
264 HD3 ARG 34 3HD ARG 34 7.381 3.574 -0.124
265 HE ARG 34 HE ARG 34 6.353 3.862 2.620
266 HH11 ARG 34 1HH2 ARG 34 9.304 3.589 0.760
267 HH12 ARG 34 2HH2 ARG 34 10.257 4.402 1.965
268 HH21 ARG 34 1HH1 ARG 34 7.566 4.813 4.129
269 HH22 ARG 34 2HH1 ARG 34 9.317 4.788 3.987
270 H MET 35 H MET 35 3.115 0.270 -1.384
271 HA MET 35 HA MET 35 1.256 0.436 0.917
272 HB2 MET 35 2HB MET 35 0.869 -1.101 -1.670
273 HB3 MET 35 3HB MET 35 0.033 -1.546 -0.167
274 HG2 MET 35 2HG MET 35 -0.887 0.742 -0.027
275 HG3 MET 35 3HG MET 35 -0.139 1.128 -1.582
276 HE1 MET 35 3HE MET 35 -3.175 -0.184 0.316
277 HE2 MET 35 1HE MET 35 -3.984 -1.300 -0.802
278 HE3 MET 35 2HE MET 35 -2.443 -1.771 -0.031
279 H ALA 36 H ALA 36 1.066 -1.593 2.104
280 HA ALA 36 HA ALA 36 3.309 -3.447 1.788
281 HB1 ALA 36 1HB ALA 36 3.362 -2.829 4.575
282 HB2 ALA 36 2HB ALA 36 4.630 -2.604 3.368
283 HB3 ALA 36 3HB ALA 36 3.479 -1.299 3.683
284 H ILE 37 H ILE 37 3.151 -5.348 3.219
285 HA ILE 37 HA ILE 37 0.378 -5.881 4.203
286 HB ILE 37 HB ILE 37 1.979 -7.249 2.127
287 HG12 ILE 37 2HG1 ILE 37 -0.953 -7.483 2.899
288 HG13 ILE 37 3HG1 ILE 37 -0.308 -6.099 2.014
289 HG21 ILE 37 1HG2 ILE 37 0.561 -8.989 4.167
290 HG22 ILE 37 2HG2 ILE 37 1.238 -9.496 2.586
291 HG23 ILE 37 3HG2 ILE 37 2.319 -8.931 3.849
292 HD11 ILE 37 3HD1 ILE 37 -0.270 -8.971 1.031
293 HD12 ILE 37 1HD1 ILE 37 -1.321 -7.659 0.462
294 HD13 ILE 37 2HD1 ILE 37 0.427 -7.575 0.184
295 H MET 38 H MET 38 0.152 -6.951 6.057
296 HA MET 38 HA MET 38 2.610 -7.194 7.706
297 HB2 MET 38 2HB MET 38 -0.290 -7.389 8.541
298 HB3 MET 38 3HB MET 38 1.086 -7.211 9.619
299 HG2 MET 38 2HG MET 38 0.464 -5.043 7.589
300 HG3 MET 38 3HG MET 38 -0.493 -5.199 9.040
301 HE1 MET 38 3HE MET 38 3.088 -4.922 7.702
302 HE2 MET 38 1HE MET 38 4.008 -4.214 9.062
303 HE3 MET 38 2HE MET 38 3.484 -5.908 9.130
304 H VAL 39 H VAL 39 3.617 -9.076 7.334
305 HA VAL 39 HA VAL 39 1.997 -11.591 7.612
306 HB VAL 39 HB VAL 39 3.038 -11.471 5.462
307 HG11 VAL 39 1HG1 VAL 39 5.727 -11.435 6.900
308 HG12 VAL 39 2HG1 VAL 39 5.450 -11.607 5.155
309 HG13 VAL 39 3HG1 VAL 39 5.027 -10.091 5.968
310 HG21 VAL 39 3HG2 VAL 39 4.425 -13.595 7.117
311 HG22 VAL 39 1HG2 VAL 39 2.739 -13.672 6.540
312 HG23 VAL 39 2HG2 VAL 39 4.075 -13.622 5.383
313 H GLN 40 H GLN 40 2.562 -13.152 8.994
314 HA GLN 40 HA GLN 40 3.886 -12.368 11.425
315 HB2 GLN 40 2HB GLN 40 3.432 -14.842 11.997
316 HB3 GLN 40 3HB GLN 40 2.110 -13.712 11.799
317 HG2 GLN 40 2HG GLN 40 1.398 -15.707 10.783
318 HG3 GLN 40 3HG GLN 40 1.689 -14.580 9.470
319 HE21 GLN 40 2HE2 GLN 40 3.465 -17.182 11.325
320 HE22 GLN 40 1HE2 GLN 40 4.220 -17.837 9.879
321 H SER 41 H SER 41 5.919 -12.551 12.073
322 HA SER 41 HA SER 41 7.874 -13.543 10.125
323 HB2 SER 41 2HB SER 41 8.077 -11.296 11.089
324 HB3 SER 41 3HB SER 41 8.270 -12.021 12.695
325 HG SER 41 HG SER 41 10.022 -12.013 10.489
326 HA PRO 42 HA PRO 42 9.135 -16.963 12.687
327 HB2 PRO 42 2HB PRO 42 11.420 -17.124 10.740
328 HB3 PRO 42 3HB PRO 42 10.329 -18.426 11.300
329 HG2 PRO 42 2HG PRO 42 10.045 -17.331 8.821
330 HG3 PRO 42 3HG PRO 42 8.605 -17.734 9.816
331 HD2 PRO 42 2HD PRO 42 9.948 -15.029 9.484
332 HD3 PRO 42 3HD PRO 42 8.211 -15.458 9.391
333 H MET 43 H MET 43 10.845 -14.053 12.013
334 HA MET 43 HA MET 43 13.074 -14.680 13.914
335 HB2 MET 43 2HB MET 43 12.904 -12.836 11.529
336 HB3 MET 43 3HB MET 43 14.237 -12.796 12.679
337 HG2 MET 43 2HG MET 43 15.129 -14.785 12.024
338 HG3 MET 43 3HG MET 43 13.583 -15.504 11.598
339 HE1 MET 43 3HE MET 43 12.150 -13.784 9.649
340 HE2 MET 43 1HE MET 43 12.774 -14.344 8.077
341 HE3 MET 43 2HE MET 43 12.457 -15.509 9.387
342 H PHE 44 H PHE 44 10.441 -12.440 13.302
343 HA PHE 44 HA PHE 44 11.284 -10.687 15.567
344 HB2 PHE 44 2HB PHE 44 11.097 -9.515 13.469
345 HB3 PHE 44 3HB PHE 44 9.501 -10.174 13.174
346 HD1 PHE 44 HD2 PHE 44 11.383 -8.027 15.622
347 HD2 PHE 44 HD1 PHE 44 7.577 -8.983 13.829
348 HE1 PHE 44 HE2 PHE 44 10.338 -6.102 16.798
349 HE2 PHE 44 HE1 PHE 44 6.542 -7.050 14.992
350 HZ PHE 44 HZ PHE 44 7.918 -5.614 16.486
351 H ASP 45 H ASP 45 9.657 -9.913 16.991
352 HA ASP 45 HA ASP 45 7.994 -12.120 17.963
353 HB2 ASP 45 2HB ASP 45 9.617 -10.920 19.402
354 HB3 ASP 45 3HB ASP 45 8.661 -9.447 19.237
355 H GLY 46 H GLY 46 6.819 -11.386 15.724
356 HA2 GLY 46 2HA GLY 46 4.140 -10.929 16.047
357 HA3 GLY 46 3HA GLY 46 4.796 -9.287 16.043
358 H LYS 47 H LYS 47 3.971 -8.608 14.119
359 HA LYS 47 HA LYS 47 4.636 -10.166 11.666
360 HB2 LYS 47 2HB LYS 47 2.404 -8.135 11.877
361 HB3 LYS 47 3HB LYS 47 2.727 -9.292 10.591
362 HG2 LYS 47 2HG LYS 47 2.482 -10.994 12.745
363 HG3 LYS 47 3HG LYS 47 1.431 -9.683 13.265
364 HD2 LYS 47 2HD LYS 47 1.278 -11.366 10.753
365 HD3 LYS 47 3HD LYS 47 0.184 -11.434 12.129
366 HE2 LYS 47 2HE LYS 47 0.470 -9.159 10.122
367 HE3 LYS 47 3HE LYS 47 -0.824 -10.347 10.159
368 HZ1 LYS 47 3HZ LYS 47 -1.486 -9.439 12.344
369 HZ2 LYS 47 1HZ LYS 47 -0.315 -8.280 12.250
370 HZ3 LYS 47 2HZ LYS 47 -1.535 -8.288 11.174
371 H VAL 48 H VAL 48 5.243 -9.160 9.802
372 HA VAL 48 HA VAL 48 6.699 -6.577 10.157
373 HB VAL 48 HB VAL 48 8.535 -7.573 8.806
374 HG11 VAL 48 1HG1 VAL 48 8.655 -7.434 11.275
375 HG12 VAL 48 2HG1 VAL 48 7.915 -9.039 11.408
376 HG13 VAL 48 3HG1 VAL 48 9.512 -8.856 10.658
377 HG21 VAL 48 3HG2 VAL 48 7.124 -10.237 9.298
378 HG22 VAL 48 1HG2 VAL 48 7.317 -9.447 7.724
379 HG23 VAL 48 2HG2 VAL 48 8.741 -10.009 8.609
380 HA PRO 49 HA PRO 49 4.737 -5.496 6.400
381 HB2 PRO 49 2HB PRO 49 6.052 -3.240 5.630
382 HB3 PRO 49 3HB PRO 49 5.070 -3.322 7.120
383 HG2 PRO 49 2HG PRO 49 8.078 -3.639 6.852
384 HG3 PRO 49 3HG PRO 49 7.169 -2.635 8.025
385 HD2 PRO 49 2HD PRO 49 8.120 -5.138 8.633
386 HD3 PRO 49 3HD PRO 49 6.596 -4.499 9.320
387 H HIS 50 H HIS 50 4.733 -6.393 4.435
388 HA HIS 50 HA HIS 50 7.250 -6.581 2.810
389 HB2 HIS 50 2HB HIS 50 4.556 -7.978 2.704
390 HB3 HIS 50 3HB HIS 50 5.603 -7.904 1.294
391 HD2 HIS 50 HD2 HIS 50 6.948 -8.413 4.870
392 HE1 HIS 50 HE1 HIS 50 7.633 -12.052 2.760
393 HE2 HIS 50 HE2 HIS 50 8.120 -10.786 4.914
394 H TRP 51 H TRP 51 7.631 -4.671 1.890
395 HA TRP 51 HA TRP 51 5.478 -2.834 1.214
396 HB2 TRP 51 2HB TRP 51 8.478 -2.665 0.798
397 HB3 TRP 51 3HB TRP 51 7.323 -1.370 0.510
398 HD1 TRP 51 HD1 TRP 51 9.267 -3.034 3.260
399 HE1 TRP 51 HE1 TRP 51 8.900 -1.804 5.479
400 HE3 TRP 51 HE3 TRP 51 5.435 0.066 1.843
401 HZ2 TRP 51 HZ2 TRP 51 7.073 0.149 6.553
402 HZ3 TRP 51 HZ3 TRP 51 4.354 1.557 3.524
403 HH2 TRP 51 HH2 TRP 51 5.175 1.605 5.868
404 H TYR 52 H TYR 52 4.869 -2.150 -0.816
405 HA TYR 52 HA TYR 52 6.333 -3.001 -3.198
406 HB2 TYR 52 2HB TYR 52 3.448 -3.445 -3.573
407 HB3 TYR 52 3HB TYR 52 4.866 -4.312 -4.165
408 HD1 TYR 52 HD2 TYR 52 2.800 -3.996 -1.007
409 HD2 TYR 52 HD1 TYR 52 5.221 -6.472 -3.566
410 HE1 TYR 52 HE2 TYR 52 2.148 -6.036 0.316
411 HE2 TYR 52 HE1 TYR 52 4.552 -8.484 -2.262
412 HH TYR 52 HH TYR 52 3.381 -9.288 -0.492
413 H HIS 53 H HIS 53 5.617 -1.783 -5.119
414 HA HIS 53 HA HIS 53 4.889 0.986 -4.678
415 HB2 HIS 53 2HB HIS 53 4.519 -0.677 -7.201
416 HB3 HIS 53 3HB HIS 53 4.462 1.060 -7.100
417 HD2 HIS 53 HD2 HIS 53 6.783 2.375 -6.456
418 HE1 HIS 53 HE1 HIS 53 9.320 -0.616 -8.114
419 HE2 HIS 53 HE2 HIS 53 9.188 1.803 -7.368
420 H PHE 54 H PHE 54 2.827 2.058 -5.288
421 HA PHE 54 HA PHE 54 0.543 1.023 -4.100
422 HB2 PHE 54 2HB PHE 54 0.670 3.332 -4.608
423 HB3 PHE 54 3HB PHE 54 0.894 3.040 -6.326
424 HD1 PHE 54 HD2 PHE 54 -1.685 2.070 -3.704
425 HD2 PHE 54 HD1 PHE 54 -0.929 3.611 -7.663
426 HE1 PHE 54 HE2 PHE 54 -4.127 2.183 -4.137
427 HE2 PHE 54 HE1 PHE 54 -3.377 3.768 -8.059
428 HZ PHE 54 HZ PHE 54 -4.971 3.030 -6.307
429 H SER 55 H SER 55 1.437 0.697 -7.571
430 HA SER 55 HA SER 55 -0.964 -0.696 -8.428
431 HB2 SER 55 2HB SER 55 0.249 0.483 -10.080
432 HB3 SER 55 3HB SER 55 1.801 -0.190 -9.557
433 HG SER 55 HG SER 55 0.971 -1.113 -11.508
434 H CYS 56 HN CYS 56 2.295 -1.694 -7.376
435 HA CYS 56 HA CYS 56 2.113 -4.343 -8.151
436 HB2 CYS 56 2HB CYS 56 3.824 -2.953 -6.095
437 HB3 CYS 56 3HB CYS 56 4.069 -4.625 -6.603
438 H PHE 57 H PHE 57 1.109 -2.907 -5.054
439 HA PHE 57 HA PHE 57 0.558 -5.211 -3.504
440 HB2 PHE 57 2HB PHE 57 0.384 -2.994 -2.640
441 HB3 PHE 57 3HB PHE 57 -0.920 -2.577 -3.749
442 HD1 PHE 57 HD1 PHE 57 -3.177 -3.741 -3.519
443 HD2 PHE 57 HD2 PHE 57 -0.087 -4.065 -0.528
444 HE1 PHE 57 HE1 PHE 57 -4.838 -4.601 -1.910
445 HE2 PHE 57 HE2 PHE 57 -1.794 -4.785 1.125
446 HZ PHE 57 HZ PHE 57 -4.158 -5.106 0.430
447 H TRP 58 H TRP 58 -1.648 -3.589 -5.860
448 HA TRP 58 HA TRP 58 -3.728 -5.565 -5.634
449 HB2 TRP 58 2HB TRP 58 -3.202 -3.674 -7.933
450 HB3 TRP 58 3HB TRP 58 -4.723 -4.425 -7.488
451 HD1 TRP 58 HD1 TRP 58 -2.653 -1.426 -6.964
452 HE1 TRP 58 HE1 TRP 58 -3.503 0.103 -5.104
453 HE3 TRP 58 HE3 TRP 58 -6.364 -4.437 -5.092
454 HZ2 TRP 58 HZ2 TRP 58 -5.598 0.046 -3.060
455 HZ3 TRP 58 HZ3 TRP 58 -7.793 -3.640 -3.249
456 HH2 TRP 58 HH2 TRP 58 -7.376 -1.416 -2.205
457 H LYS 59 H LYS 59 -0.865 -5.275 -7.653
458 HA LYS 59 HA LYS 59 -1.467 -7.390 -9.529
459 HB2 LYS 59 2HB LYS 59 -0.004 -5.373 -9.848
460 HB3 LYS 59 3HB LYS 59 1.181 -6.146 -8.783
461 HG2 LYS 59 2HG LYS 59 1.560 -7.914 -10.336
462 HG3 LYS 59 3HG LYS 59 0.157 -7.452 -11.315
463 HD2 LYS 59 2HD LYS 59 2.355 -6.798 -12.316
464 HD3 LYS 59 3HD LYS 59 1.241 -5.455 -12.104
465 HE2 LYS 59 2HE LYS 59 2.984 -5.854 -9.757
466 HE3 LYS 59 3HE LYS 59 3.923 -5.625 -11.228
467 HZ1 LYS 59 3HZ LYS 59 2.871 -3.522 -11.590
468 HZ2 LYS 59 1HZ LYS 59 1.784 -3.731 -10.392
469 HZ3 LYS 59 2HZ LYS 59 3.366 -3.544 -10.020
470 H VAL 60 H VAL 60 -0.208 -7.451 -6.233
471 HA VAL 60 HA VAL 60 0.681 -10.231 -6.336
472 HB VAL 60 HB VAL 60 -0.525 -8.833 -3.926
473 HG11 VAL 60 1HG1 VAL 60 -0.218 -11.251 -3.579
474 HG12 VAL 60 2HG1 VAL 60 1.457 -11.141 -4.166
475 HG13 VAL 60 3HG1 VAL 60 0.974 -10.361 -2.646
476 HG21 VAL 60 3HG2 VAL 60 1.277 -7.406 -4.596
477 HG22 VAL 60 1HG2 VAL 60 1.847 -8.357 -3.252
478 HG23 VAL 60 2HG2 VAL 60 2.358 -8.786 -4.901
479 H GLY 61 H GLY 61 -2.468 -8.725 -6.408
480 HA2 GLY 61 2HA GLY 61 -4.437 -9.848 -7.050
481 HA3 GLY 61 3HA GLY 61 -3.837 -11.366 -6.386
482 H HIS 62 H HIS 62 -3.361 -8.747 -4.198
483 HA HIS 62 HA HIS 62 -5.468 -9.690 -2.397
484 HB2 HIS 62 2HB HIS 62 -3.305 -7.589 -2.201
485 HB3 HIS 62 3HB HIS 62 -4.637 -7.619 -1.050
486 HD2 HIS 62 HD2 HIS 62 -1.574 -9.702 -2.084
487 HE1 HIS 62 HE1 HIS 62 -3.118 -11.465 1.474
488 HE2 HIS 62 HE2 HIS 62 -1.200 -11.504 -0.198
489 H SER 63 H SER 63 -7.125 -8.480 -1.519
490 HA SER 63 HA SER 63 -8.172 -6.135 -2.966
491 HB2 SER 63 2HB SER 63 -9.085 -8.179 -4.107
492 HB3 SER 63 3HB SER 63 -9.841 -8.645 -2.568
493 HG SER 63 HG SER 63 -11.260 -7.435 -3.933
494 H ILE 64 H ILE 64 -9.942 -5.111 -1.758
495 HA ILE 64 HA ILE 64 -9.648 -5.441 1.208
496 HB ILE 64 HB ILE 64 -9.243 -2.801 -0.232
497 HG12 ILE 64 2HG1 ILE 64 -7.062 -4.770 0.550
498 HG13 ILE 64 3HG1 ILE 64 -7.426 -4.156 -1.055
499 HG21 ILE 64 1HG2 ILE 64 -9.883 -2.725 2.163
500 HG22 ILE 64 2HG2 ILE 64 -8.463 -3.725 2.556
501 HG23 ILE 64 3HG2 ILE 64 -8.255 -2.101 1.883
502 HD11 ILE 64 3HD1 ILE 64 -5.590 -2.888 -0.484
503 HD12 ILE 64 1HD1 ILE 64 -6.909 -1.799 -0.050
504 HD13 ILE 64 2HD1 ILE 64 -6.069 -2.747 1.209
505 H ARG 65 H ARG 65 -11.410 -4.820 2.381
506 HA ARG 65 HA ARG 65 -13.875 -4.096 0.809
507 HB2 ARG 65 2HB ARG 65 -15.078 -5.658 2.448
508 HB3 ARG 65 3HB ARG 65 -14.224 -6.347 1.089
509 HG2 ARG 65 2HG ARG 65 -12.804 -6.145 3.753
510 HG3 ARG 65 3HG ARG 65 -14.019 -7.385 3.527
511 HD2 ARG 65 2HD ARG 65 -12.728 -8.644 2.179
512 HD3 ARG 65 3HD ARG 65 -12.129 -7.259 1.260
513 HE ARG 65 HE ARG 65 -10.820 -7.036 3.708
514 HH11 ARG 65 1HH2 ARG 65 -10.848 -9.488 1.171
515 HH12 ARG 65 2HH2 ARG 65 -9.158 -9.830 1.434
516 HH21 ARG 65 1HH1 ARG 65 -8.866 -7.544 3.991
517 HH22 ARG 65 2HH1 ARG 65 -7.984 -8.609 2.892
518 H HIS 66 H HIS 66 -12.102 -3.478 3.712
519 HA HIS 66 HA HIS 66 -13.823 -1.115 4.074
520 HB2 HIS 66 2HB HIS 66 -13.859 -1.264 6.506
521 HB3 HIS 66 3HB HIS 66 -14.870 -2.422 5.677
522 HD2 HIS 66 HD2 HIS 66 -12.701 -4.826 5.333
523 HE1 HIS 66 HE1 HIS 66 -12.840 -4.875 9.566
524 HE2 HIS 66 HE2 HIS 66 -12.221 -6.209 7.501
525 HA PRO 67 HA PRO 67 -9.334 -0.870 3.521
526 HB2 PRO 67 2HB PRO 67 -9.201 1.399 1.878
527 HB3 PRO 67 3HB PRO 67 -9.501 -0.261 1.294
528 HG2 PRO 67 2HG PRO 67 -11.551 1.846 2.012
529 HG3 PRO 67 3HG PRO 67 -11.466 0.851 0.516
530 HD2 PRO 67 2HD PRO 67 -13.102 0.157 2.506
531 HD3 PRO 67 3HD PRO 67 -12.102 -1.113 1.730
532 H ASP 68 H ASP 68 -11.284 1.947 4.587
533 HA ASP 68 HA ASP 68 -8.934 3.270 5.680
534 HB2 ASP 68 2HB ASP 68 -10.538 4.834 6.696
535 HB3 ASP 68 3HB ASP 68 -10.748 4.634 4.963
536 H VAL 69 H VAL 69 -10.591 0.541 6.675
537 HA VAL 69 HA VAL 69 -9.734 0.806 9.507
538 HB VAL 69 HB VAL 69 -11.336 -1.457 8.282
539 HG11 VAL 69 1HG1 VAL 69 -10.964 -0.537 11.162
540 HG12 VAL 69 2HG1 VAL 69 -12.003 -1.875 10.620
541 HG13 VAL 69 3HG1 VAL 69 -10.254 -1.991 10.422
542 HG21 VAL 69 3HG2 VAL 69 -12.393 1.041 9.669
543 HG22 VAL 69 1HG2 VAL 69 -12.694 0.547 7.986
544 HG23 VAL 69 2HG2 VAL 69 -13.350 -0.416 9.307
545 H GLU 70 H GLU 70 -9.403 -1.271 6.611
546 HA GLU 70 HA GLU 70 -7.437 -3.031 7.913
547 HB2 GLU 70 2HB GLU 70 -8.291 -2.838 4.975
548 HB3 GLU 70 3HB GLU 70 -7.392 -4.169 5.708
549 HG2 GLU 70 2HG GLU 70 -9.339 -4.771 7.076
550 HG3 GLU 70 3HG GLU 70 -10.254 -3.426 6.402
551 H VAL 71 H VAL 71 -7.215 -0.368 5.621
552 HA VAL 71 HA VAL 71 -4.301 -0.810 5.187
553 HB VAL 71 HB VAL 71 -6.001 1.307 3.901
554 HG11 VAL 71 1HG1 VAL 71 -3.341 -0.045 3.271
555 HG12 VAL 71 2HG1 VAL 71 -4.123 1.306 2.403
556 HG13 VAL 71 3HG1 VAL 71 -3.511 1.532 4.069
557 HG21 VAL 71 3HG2 VAL 71 -5.930 -0.267 1.942
558 HG22 VAL 71 1HG2 VAL 71 -5.272 -1.529 3.022
559 HG23 VAL 71 2HG2 VAL 71 -6.910 -0.905 3.272
560 H ASP 72 H ASP 72 -3.339 -0.359 6.971
561 HA ASP 72 HA ASP 72 -3.700 1.977 8.615
562 HB2 ASP 72 2HB ASP 72 -2.768 -0.158 9.295
563 HB3 ASP 72 3HB ASP 72 -1.430 0.008 8.163
564 H GLY 73 H GLY 73 -2.579 3.935 8.586
565 HA2 GLY 73 2HA GLY 73 -1.100 5.600 7.898
566 HA3 GLY 73 3HA GLY 73 -0.419 4.513 6.691
567 H PHE 74 H PHE 74 -3.607 4.274 6.048
568 HA PHE 74 HA PHE 74 -3.895 5.989 3.804
569 HB2 PHE 74 2HB PHE 74 -5.258 4.003 4.337
570 HB3 PHE 74 3HB PHE 74 -5.888 4.780 5.778
571 HD1 PHE 74 HD1 PHE 74 -6.034 4.668 2.083
572 HD2 PHE 74 HD2 PHE 74 -7.705 6.387 5.671
573 HE1 PHE 74 HE1 PHE 74 -8.025 5.431 0.803
574 HE2 PHE 74 HE2 PHE 74 -9.688 7.150 4.376
575 HZ PHE 74 HZ PHE 74 -9.836 6.685 1.948
576 H SER 75 H SER 75 -4.222 6.730 7.228
577 HA SER 75 HA SER 75 -5.569 9.255 7.089
578 HB2 SER 75 2HB SER 75 -4.364 9.591 9.301
579 HB3 SER 75 3HB SER 75 -5.395 8.151 9.185
580 HG SER 75 HG SER 75 -3.319 7.706 10.111
581 H GLU 76 H GLU 76 -2.247 8.379 6.240
582 HA GLU 76 HA GLU 76 -1.243 11.122 6.498
583 HB2 GLU 76 2HB GLU 76 0.069 8.726 5.157
584 HB3 GLU 76 3HB GLU 76 0.830 10.243 5.632
585 HG2 GLU 76 2HG GLU 76 0.141 9.678 8.044
586 HG3 GLU 76 3HG GLU 76 -0.199 8.043 7.464
587 H LEU 77 H LEU 77 -2.931 9.381 4.059
588 HA LEU 77 HA LEU 77 -1.796 10.662 1.706
589 HB2 LEU 77 2HB LEU 77 -4.208 8.920 2.269
590 HB3 LEU 77 3HB LEU 77 -3.986 9.668 0.705
591 HG LEU 77 HG LEU 77 -2.038 8.424 0.219
592 HD11 LEU 77 1HD1 LEU 77 -2.094 7.280 3.023
593 HD12 LEU 77 2HD1 LEU 77 -1.073 6.707 1.684
594 HD13 LEU 77 3HD1 LEU 77 -0.841 8.333 2.327
595 HD21 LEU 77 3HD2 LEU 77 -4.213 7.315 -0.093
596 HD22 LEU 77 1HD2 LEU 77 -2.938 6.144 0.272
597 HD23 LEU 77 2HD2 LEU 77 -4.096 6.616 1.533
598 H ARG 78 H ARG 78 -2.704 12.253 0.390
599 HA ARG 78 HA ARG 78 -4.531 14.245 1.479
600 HB2 ARG 78 2HB ARG 78 -2.639 14.522 -0.285
601 HB3 ARG 78 3HB ARG 78 -3.738 13.735 -1.412
602 HG2 ARG 78 2HG ARG 78 -5.323 15.800 -0.404
603 HG3 ARG 78 3HG ARG 78 -3.718 16.515 -0.333
604 HD2 ARG 78 2HD ARG 78 -4.979 15.176 -2.753
605 HD3 ARG 78 3HD ARG 78 -4.915 16.932 -2.484
606 HE ARG 78 HE ARG 78 -2.260 15.982 -2.332
607 HH11 ARG 78 1HH2 ARG 78 -4.691 16.254 -4.842
608 HH12 ARG 78 2HH2 ARG 78 -3.501 16.290 -6.113
609 HH21 ARG 78 1HH1 ARG 78 -0.800 16.050 -4.001
610 HH22 ARG 78 2HH1 ARG 78 -1.358 16.205 -5.640
611 H TRP 79 H TRP 79 -6.675 14.663 0.613
612 HA TRP 79 HA TRP 79 -8.410 12.507 0.516
613 HB2 TRP 79 2HB TRP 79 -9.825 14.171 0.759
614 HB3 TRP 79 3HB TRP 79 -8.612 15.341 0.307
615 HD1 TRP 79 HD1 TRP 79 -11.807 13.825 -0.860
616 HE1 TRP 79 HE1 TRP 79 -12.514 14.807 -3.126
617 HE3 TRP 79 HE3 TRP 79 -7.453 16.190 -2.102
618 HZ2 TRP 79 HZ2 TRP 79 -11.332 16.426 -5.214
619 HZ3 TRP 79 HZ3 TRP 79 -7.260 17.464 -4.227
620 HH2 TRP 79 HH2 TRP 79 -9.193 17.585 -5.792
621 H ASP 80 H ASP 80 -6.736 13.912 -2.283
622 HA ASP 80 HA ASP 80 -8.307 12.560 -4.221
623 HB2 ASP 80 2HB ASP 80 -6.941 14.598 -4.643
624 HB3 ASP 80 3HB ASP 80 -5.489 13.594 -4.584
625 H ASP 81 H ASP 81 -5.529 11.453 -2.356
626 HA ASP 81 HA ASP 81 -5.167 9.028 -4.028
627 HB2 ASP 81 2HB ASP 81 -3.661 10.141 -1.647
628 HB3 ASP 81 3HB ASP 81 -3.458 8.484 -2.219
629 H GLN 82 H GLN 82 -6.463 10.090 -0.837
630 HA GLN 82 HA GLN 82 -7.240 7.526 0.095
631 HB2 GLN 82 2HB GLN 82 -8.448 10.290 0.460
632 HB3 GLN 82 3HB GLN 82 -9.112 8.863 1.251
633 HG2 GLN 82 2HG GLN 82 -6.933 8.410 2.324
634 HG3 GLN 82 3HG GLN 82 -6.257 9.860 1.575
635 HE21 GLN 82 2HE2 GLN 82 -6.273 9.458 4.382
636 HE22 GLN 82 1HE2 GLN 82 -7.331 10.696 5.070
637 H GLN 83 H GLN 83 -9.202 9.839 -1.906
638 HA GLN 83 HA GLN 83 -11.372 8.033 -2.210
639 HB2 GLN 83 2HB GLN 83 -12.258 9.552 -3.817
640 HB3 GLN 83 3HB GLN 83 -11.495 10.460 -2.535
641 HG2 GLN 83 2HG GLN 83 -10.807 11.661 -4.366
642 HG3 GLN 83 3HG GLN 83 -9.431 10.603 -4.119
643 HE21 GLN 83 2HE2 GLN 83 -9.162 11.492 -6.534
644 HE22 GLN 83 1HE2 GLN 83 -9.918 10.458 -7.736
645 H LYS 84 H LYS 84 -8.331 8.162 -4.004
646 HA LYS 84 HA LYS 84 -9.297 6.471 -6.194
647 HB2 LYS 84 2HB LYS 84 -7.851 8.334 -6.664
648 HB3 LYS 84 3HB LYS 84 -6.661 7.776 -5.492
649 HG2 LYS 84 2HG LYS 84 -7.308 5.814 -7.653
650 HG3 LYS 84 3HG LYS 84 -6.583 7.317 -8.218
651 HD2 LYS 84 2HD LYS 84 -5.410 5.681 -5.943
652 HD3 LYS 84 3HD LYS 84 -4.931 5.488 -7.649
653 HE2 LYS 84 2HE LYS 84 -4.208 7.838 -7.761
654 HE3 LYS 84 3HE LYS 84 -4.806 8.132 -6.133
655 HZ1 LYS 84 3HZ LYS 84 -2.432 6.581 -6.896
656 HZ2 LYS 84 1HZ LYS 84 -2.596 7.814 -5.798
657 HZ3 LYS 84 2HZ LYS 84 -3.162 6.327 -5.444
658 H VAL 85 H VAL 85 -7.257 6.125 -3.259
659 HA VAL 85 HA VAL 85 -6.670 3.309 -3.713
660 HB VAL 85 HB VAL 85 -6.782 4.978 -1.173
661 HG11 VAL 85 1HG1 VAL 85 -5.855 2.078 -1.457
662 HG12 VAL 85 2HG1 VAL 85 -5.553 3.113 -0.052
663 HG13 VAL 85 3HG1 VAL 85 -7.207 2.667 -0.461
664 HG21 VAL 85 3HG2 VAL 85 -4.382 4.898 -1.235
665 HG22 VAL 85 1HG2 VAL 85 -4.375 3.719 -2.550
666 HG23 VAL 85 2HG2 VAL 85 -4.896 5.383 -2.857
667 H LYS 86 H LYS 86 -9.366 4.973 -1.958
668 HA LYS 86 HA LYS 86 -10.758 2.502 -1.390
669 HB2 LYS 86 2HB LYS 86 -11.782 5.373 -1.518
670 HB3 LYS 86 3HB LYS 86 -12.730 3.972 -1.000
671 HG2 LYS 86 2HG LYS 86 -10.844 3.507 0.703
672 HG3 LYS 86 3HG LYS 86 -10.217 5.084 0.303
673 HD2 LYS 86 2HD LYS 86 -11.514 5.148 2.363
674 HD3 LYS 86 3HD LYS 86 -12.281 6.162 1.123
675 HE2 LYS 86 2HE LYS 86 -13.958 4.491 0.706
676 HE3 LYS 86 3HE LYS 86 -13.076 3.284 1.660
677 HZ1 LYS 86 3HZ LYS 86 -13.610 4.425 3.660
678 HZ2 LYS 86 1HZ LYS 86 -14.213 5.742 2.868
679 HZ3 LYS 86 2HZ LYS 86 -15.003 4.313 2.836
680 H LYS 87 H LYS 87 -11.069 4.760 -4.172
681 HA LYS 87 HA LYS 87 -13.097 3.258 -5.545
682 HB2 LYS 87 2HB LYS 87 -12.479 5.536 -6.121
683 HB3 LYS 87 3HB LYS 87 -10.904 4.983 -6.730
684 HG2 LYS 87 2HG LYS 87 -11.949 3.728 -8.511
685 HG3 LYS 87 3HG LYS 87 -13.562 3.917 -7.784
686 HD2 LYS 87 2HD LYS 87 -13.480 6.328 -8.134
687 HD3 LYS 87 3HD LYS 87 -11.846 6.202 -8.831
688 HE2 LYS 87 2HE LYS 87 -12.741 4.751 -10.645
689 HE3 LYS 87 3HE LYS 87 -14.362 4.871 -9.947
690 HZ1 LYS 87 3HZ LYS 87 -14.293 7.273 -10.369
691 HZ2 LYS 87 1HZ LYS 87 -12.795 7.163 -11.015
692 HZ3 LYS 87 2HZ LYS 87 -14.062 6.457 -11.761
693 H THR 88 H THR 88 -9.527 2.921 -5.655
694 HA THR 88 HA THR 88 -9.469 0.782 -7.512
695 HB THR 88 HB THR 88 -7.461 1.476 -5.344
696 HG1 THR 88 1HG THR 88 -7.732 3.147 -6.746
697 HG21 THR 88 1HG2 THR 88 -7.207 -0.148 -7.907
698 HG22 THR 88 2HG2 THR 88 -5.859 0.368 -6.862
699 HG23 THR 88 3HG2 THR 88 -7.054 -0.779 -6.249
700 H ALA 89 H ALA 89 -9.884 0.731 -3.951
701 HA ALA 89 HA ALA 89 -9.707 -2.133 -3.669
702 HB1 ALA 89 1HB ALA 89 -11.016 0.018 -1.949
703 HB2 ALA 89 2HB ALA 89 -10.694 -1.651 -1.464
704 HB3 ALA 89 3HB ALA 89 -9.339 -0.554 -1.821
705 H GLU 90 H GLU 90 -12.411 0.188 -4.171
706 HA GLU 90 HA GLU 90 -14.465 -1.815 -4.221
707 HB2 GLU 90 2HB GLU 90 -14.307 1.028 -5.277
708 HB3 GLU 90 3HB GLU 90 -15.763 0.055 -5.444
709 HG2 GLU 90 2HG GLU 90 -14.467 0.609 -2.744
710 HG3 GLU 90 3HG GLU 90 -15.681 1.653 -3.472
711 H ALA 91 H ALA 91 -12.395 -0.482 -6.736
712 HA ALA 91 HA ALA 91 -13.654 -1.810 -8.964
713 HB1 ALA 91 1HB ALA 91 -10.948 -0.441 -8.609
714 HB2 ALA 91 2HB ALA 91 -11.679 -0.887 -10.167
715 HB3 ALA 91 3HB ALA 91 -12.451 0.333 -9.133
716 H GLY 92 H GLY 92 -11.694 -3.098 -6.503
717 HA2 GLY 92 2HA GLY 92 -10.832 -5.213 -6.227
718 HA3 GLY 92 3HA GLY 92 -11.365 -5.649 -7.853
719 H GLY 93 H GLY 93 -9.221 -2.871 -7.335
720 HA2 GLY 93 2HA GLY 93 -6.888 -2.836 -7.254
721 HA3 GLY 93 3HA GLY 93 -6.798 -4.434 -7.978
722 H VAL 94 H VAL 94 -5.415 -1.983 -8.601
723 HA VAL 94 HA VAL 94 -5.756 -2.154 -11.539
724 HB VAL 94 HB VAL 94 -6.681 0.033 -10.748
725 HG11 VAL 94 1HG1 VAL 94 -4.962 0.511 -8.959
726 HG12 VAL 94 2HG1 VAL 94 -3.790 0.846 -10.242
727 HG13 VAL 94 3HG1 VAL 94 -5.249 1.843 -10.089
728 HG21 VAL 94 3HG2 VAL 94 -5.893 -0.342 -13.057
729 HG22 VAL 94 1HG2 VAL 94 -5.647 1.329 -12.526
730 HG23 VAL 94 2HG2 VAL 94 -4.267 0.218 -12.595
731 H THR 95 H THR 95 -3.929 -2.536 -12.636
732 HA THR 95 HA THR 95 -1.528 -3.142 -10.961
733 HB THR 95 HB THR 95 -1.433 -5.225 -12.329
734 HG1 THR 95 1HG THR 95 -3.282 -5.750 -13.532
735 HG21 THR 95 1HG2 THR 95 -4.158 -4.903 -10.988
736 HG22 THR 95 2HG2 THR 95 -3.200 -6.390 -11.170
737 HG23 THR 95 3HG2 THR 95 -2.640 -5.094 -10.095
738 H GLY 96 H GLY 96 -2.132 -1.096 -13.425
739 HA2 GLY 96 2HA GLY 96 0.585 -1.306 -14.525
740 HA3 GLY 96 3HA GLY 96 -0.706 -1.715 -15.648
741 H LYS 97 H LYS 97 0.483 0.119 -16.728
742 HA LYS 97 HA LYS 97 0.694 2.230 -17.519
743 HB2 LYS 97 2HB LYS 97 -2.123 2.617 -16.459
744 HB3 LYS 97 3HB LYS 97 -1.319 3.598 -17.684
745 HG2 LYS 97 2HG LYS 97 -1.124 1.603 -19.165
746 HG3 LYS 97 3HG LYS 97 -2.021 0.645 -17.969
747 HD2 LYS 97 2HD LYS 97 -3.958 2.179 -18.183
748 HD3 LYS 97 3HD LYS 97 -3.068 3.133 -19.390
749 HE2 LYS 97 2HE LYS 97 -2.896 1.123 -20.845
750 HE3 LYS 97 3HE LYS 97 -3.789 0.177 -19.647
751 HZ1 LYS 97 3HZ LYS 97 -5.692 1.665 -19.988
752 HZ2 LYS 97 1HZ LYS 97 -4.866 2.538 -21.096
753 HZ3 LYS 97 2HZ LYS 97 -5.255 0.985 -21.404
754 H GLY 98 H GLY 98 1.585 1.842 -14.713
755 HA2 GLY 98 2HA GLY 98 1.248 4.401 -13.362
756 HA3 GLY 98 3HA GLY 98 2.335 3.098 -12.892
757 H GLN 99 H GLN 99 3.161 5.671 -12.637
758 HA GLN 99 HA GLN 99 4.810 6.500 -14.928
759 HB2 GLN 99 2HB GLN 99 4.543 7.619 -12.112
760 HB3 GLN 99 3HB GLN 99 5.508 8.340 -13.397
761 HG2 GLN 99 2HG GLN 99 2.476 7.973 -13.455
762 HG3 GLN 99 3HG GLN 99 3.338 9.472 -13.136
763 HE21 GLN 99 2HE2 GLN 99 4.781 10.326 -14.962
764 HE22 GLN 99 1HE2 GLN 99 4.244 9.989 -16.602
765 H ASP 100 H ASP 100 7.093 6.807 -14.838
766 HA ASP 100 HA ASP 100 8.503 4.529 -13.684
767 HB2 ASP 100 2HB ASP 100 8.904 5.266 -15.982
768 HB3 ASP 100 3HB ASP 100 9.437 6.848 -15.407
769 H GLY 101 H GLY 101 10.056 4.484 -12.130
770 HA2 GLY 101 2HA GLY 101 11.671 6.482 -11.126
771 HA3 GLY 101 3HA GLY 101 10.229 6.571 -10.111
772 H ILE 102 H ILE 102 13.100 5.680 -9.591
773 HA ILE 102 HA ILE 102 12.465 3.204 -8.116
774 HB ILE 102 HB ILE 102 13.189 2.422 -10.295
775 HG12 ILE 102 2HG1 ILE 102 15.273 1.872 -8.142
776 HG13 ILE 102 3HG1 ILE 102 13.673 1.134 -8.262
777 HG21 ILE 102 1HG2 ILE 102 15.912 3.704 -9.836
778 HG22 ILE 102 2HG2 ILE 102 15.370 2.776 -11.245
779 HG23 ILE 102 3HG2 ILE 102 14.674 4.359 -10.928
780 HD11 ILE 102 3HD1 ILE 102 15.969 0.785 -10.223
781 HD12 ILE 102 1HD1 ILE 102 15.289 -0.421 -9.122
782 HD13 ILE 102 2HD1 ILE 102 14.317 0.170 -10.486
783 H GLY 103 H GLY 103 13.265 3.189 -6.199
784 HA2 GLY 103 2HA GLY 103 14.601 3.295 -4.385
785 HA3 GLY 103 3HA GLY 103 15.916 3.409 -5.539
786 H SER 104 H SER 104 14.982 6.255 -6.294
787 HA SER 104 HA SER 104 15.811 8.313 -5.862
788 HB2 SER 104 2HB SER 104 14.773 7.788 -3.064
789 HB3 SER 104 3HB SER 104 15.241 9.376 -3.705
790 HG SER 104 HG SER 104 13.653 9.192 -5.288
791 H LYS 105 H LYS 105 17.782 6.480 -5.969
792 HA LYS 105 HA LYS 105 19.586 6.366 -3.796
793 HB2 LYS 105 2HB LYS 105 19.356 4.830 -5.804
794 HB3 LYS 105 3HB LYS 105 20.197 6.038 -6.766
795 HG2 LYS 105 2HG LYS 105 21.657 4.206 -6.117
796 HG3 LYS 105 3HG LYS 105 22.242 5.711 -5.420
797 HD2 LYS 105 2HD LYS 105 21.355 5.089 -3.213
798 HD3 LYS 105 3HD LYS 105 20.550 3.663 -3.908
799 HE2 LYS 105 2HE LYS 105 22.774 2.755 -4.571
800 HE3 LYS 105 3HE LYS 105 23.563 4.157 -3.841
801 HZ1 LYS 105 3HZ LYS 105 21.911 2.165 -2.375
802 HZ2 LYS 105 1HZ LYS 105 23.536 2.266 -2.319
803 HZ3 LYS 105 2HZ LYS 105 22.626 3.463 -1.686
804 H ALA 106 H ALA 106 19.021 9.117 -5.640
805 HA ALA 106 HA ALA 106 21.586 10.413 -5.494
806 HB1 ALA 106 1HB ALA 106 18.753 11.552 -5.433
807 HB2 ALA 106 2HB ALA 106 20.240 12.469 -5.755
808 HB3 ALA 106 3HB ALA 106 19.712 11.217 -6.896
809 H GLU 107 H GLU 107 19.138 9.696 -3.052
810 HA GLU 107 HA GLU 107 20.821 11.045 -0.979
811 HB2 GLU 107 2HB GLU 107 17.968 10.010 -0.848
812 HB3 GLU 107 3HB GLU 107 18.936 10.449 0.567
813 HG2 GLU 107 2HG GLU 107 19.245 12.746 -0.361
814 HG3 GLU 107 3HG GLU 107 18.213 12.320 -1.730
815 H LYS 108 H LYS 108 21.787 9.867 0.606
816 HA LYS 108 HA LYS 108 21.815 6.889 0.453
817 HB2 LYS 108 2HB LYS 108 24.238 8.730 0.260
818 HB3 LYS 108 3HB LYS 108 24.311 6.986 0.526
819 HG2 LYS 108 2HG LYS 108 23.222 6.578 -1.659
820 HG3 LYS 108 3HG LYS 108 23.123 8.328 -1.943
821 HD2 LYS 108 2HD LYS 108 25.583 8.510 -1.876
822 HD3 LYS 108 3HD LYS 108 25.715 6.787 -1.511
823 HE2 LYS 108 2HE LYS 108 26.212 7.149 -3.846
824 HE3 LYS 108 3HE LYS 108 24.727 6.208 -3.694
825 HZ1 LYS 108 3HZ LYS 108 24.786 9.139 -4.191
826 HZ2 LYS 108 1HZ LYS 108 24.587 8.016 -5.358
827 HZ3 LYS 108 2HZ LYS 108 23.447 8.180 -4.203
Start of MODEL 9
1 H1 MET 1 H1 MET 1 7.426 1.945 25.255
2 H2 MET 1 H2 MET 1 6.633 0.644 25.850
3 H3 MET 1 H3 MET 1 6.392 2.120 26.515
4 HA MET 1 HA MET 1 4.521 1.501 25.146
5 HB2 MET 1 2HB MET 1 5.154 3.901 25.392
6 HB3 MET 1 3HB MET 1 6.136 3.786 23.929
7 HG2 MET 1 2HG MET 1 3.942 4.811 23.516
8 HG3 MET 1 3HG MET 1 4.149 3.336 22.582
9 HE1 MET 1 1HE MET 1 0.294 3.393 23.215
10 HE2 MET 1 2HE MET 1 1.357 4.788 22.927
11 HE3 MET 1 3HE MET 1 1.593 3.282 22.008
12 H ALA 2 H ALA 2 3.673 0.809 23.157
13 HA ALA 2 HA ALA 2 5.498 0.119 20.938
14 HB1 ALA 2 1HB ALA 2 3.765 -1.930 22.397
15 HB2 ALA 2 2HB ALA 2 4.707 -2.223 20.919
16 HB3 ALA 2 3HB ALA 2 5.541 -1.854 22.438
17 H GLU 3 H GLU 3 4.253 -0.695 19.034
18 HA GLU 3 HA GLU 3 1.515 0.506 18.823
19 HB2 GLU 3 2HB GLU 3 3.748 0.532 16.760
20 HB3 GLU 3 3HB GLU 3 2.075 1.024 16.464
21 HG2 GLU 3 2HG GLU 3 2.279 2.775 18.225
22 HG3 GLU 3 3HG GLU 3 3.971 2.332 18.465
23 H SER 4 H SER 4 0.023 -0.518 17.461
24 HA SER 4 HA SER 4 0.210 -3.406 17.574
25 HB2 SER 4 2HB SER 4 -1.857 -2.274 18.120
26 HB3 SER 4 3HB SER 4 -1.957 -1.582 16.488
27 HG SER 4 HG SER 4 -3.213 -3.541 16.851
28 H SER 5 H SER 5 0.399 -4.891 16.041
29 HA SER 5 HA SER 5 0.526 -4.121 13.163
30 HB2 SER 5 2HB SER 5 2.038 -5.947 12.740
31 HB3 SER 5 3HB SER 5 2.730 -4.862 13.939
32 HG SER 5 HG SER 5 2.226 -6.319 15.565
33 H ASP 6 H ASP 6 -1.794 -4.810 14.899
34 HA ASP 6 HA ASP 6 -2.689 -7.289 13.701
35 HB2 ASP 6 2HB ASP 6 -3.095 -6.684 16.087
36 HB3 ASP 6 3HB ASP 6 -4.214 -5.430 15.543
37 H LYS 7 H LYS 7 -2.186 -5.666 11.635
38 HA LYS 7 HA LYS 7 -4.851 -5.098 10.401
39 HB2 LYS 7 2HB LYS 7 -2.173 -3.829 9.701
40 HB3 LYS 7 3HB LYS 7 -3.729 -3.529 8.939
41 HG2 LYS 7 2HG LYS 7 -3.890 -1.779 10.327
42 HG3 LYS 7 3HG LYS 7 -4.412 -2.965 11.522
43 HD2 LYS 7 2HD LYS 7 -1.967 -3.176 12.239
44 HD3 LYS 7 3HD LYS 7 -1.600 -1.873 11.096
45 HE2 LYS 7 2HE LYS 7 -3.537 -0.599 12.377
46 HE3 LYS 7 3HE LYS 7 -3.247 -1.798 13.649
47 HZ1 LYS 7 3HZ LYS 7 -1.902 0.184 14.005
48 HZ2 LYS 7 1HZ LYS 7 -0.875 -1.039 13.619
49 HZ3 LYS 7 2HZ LYS 7 -1.280 0.111 12.499
50 H LEU 8 H LEU 8 -4.549 -5.277 7.954
51 HA LEU 8 HA LEU 8 -2.924 -7.694 7.200
52 HB2 LEU 8 2HB LEU 8 -5.354 -6.381 5.898
53 HB3 LEU 8 3HB LEU 8 -4.522 -7.793 5.259
54 HG LEU 8 HG LEU 8 -6.008 -7.737 7.927
55 HD11 LEU 8 1HD1 LEU 8 -6.821 -8.800 5.194
56 HD12 LEU 8 2HD1 LEU 8 -7.752 -8.966 6.707
57 HD13 LEU 8 3HD1 LEU 8 -7.479 -7.359 5.996
58 HD21 LEU 8 3HD2 LEU 8 -4.248 -9.447 7.850
59 HD22 LEU 8 1HD2 LEU 8 -5.849 -10.199 7.741
60 HD23 LEU 8 2HD2 LEU 8 -4.850 -10.022 6.278
61 H TYR 9 H TYR 9 -3.361 -4.271 6.686
62 HA TYR 9 HA TYR 9 -1.628 -4.316 4.268
63 HB2 TYR 9 2HB TYR 9 -4.321 -2.948 4.483
64 HB3 TYR 9 3HB TYR 9 -3.281 -2.997 3.065
65 HD1 TYR 9 HD2 TYR 9 -2.639 -5.771 2.658
66 HD2 TYR 9 HD1 TYR 9 -6.309 -4.052 4.089
67 HE1 TYR 9 HE2 TYR 9 -3.885 -7.768 1.831
68 HE2 TYR 9 HE1 TYR 9 -7.559 -6.053 3.288
69 HH TYR 9 HH TYR 9 -7.438 -8.054 2.161
70 H ARG 10 H ARG 10 -0.793 -2.285 3.684
71 HA ARG 10 HA ARG 10 -0.935 -0.035 5.607
72 HB2 ARG 10 2HB ARG 10 0.958 -1.262 6.408
73 HB3 ARG 10 3HB ARG 10 1.487 -1.632 4.788
74 HG2 ARG 10 2HG ARG 10 3.060 -0.124 5.685
75 HG3 ARG 10 3HG ARG 10 2.166 0.768 4.464
76 HD2 ARG 10 2HD ARG 10 0.734 1.710 6.336
77 HD3 ARG 10 3HD ARG 10 1.792 0.887 7.491
78 HE ARG 10 HE ARG 10 3.353 2.588 5.791
79 HH11 ARG 10 1HH2 ARG 10 1.081 2.903 8.515
80 HH12 ARG 10 2HH2 ARG 10 1.495 4.623 8.644
81 HH21 ARG 10 1HH1 ARG 10 3.971 4.730 6.423
82 HH22 ARG 10 2HH1 ARG 10 2.927 5.518 7.609
83 H VAL 11 H VAL 11 -0.655 1.984 4.611
84 HA VAL 11 HA VAL 11 0.385 2.160 1.839
85 HB VAL 11 HB VAL 11 -2.143 1.964 1.831
86 HG11 VAL 11 1HG1 VAL 11 -2.116 4.845 2.819
87 HG12 VAL 11 2HG1 VAL 11 -3.520 3.857 2.385
88 HG13 VAL 11 3HG1 VAL 11 -2.550 3.477 3.826
89 HG21 VAL 11 3HG2 VAL 11 -1.067 4.609 0.716
90 HG22 VAL 11 1HG2 VAL 11 -0.781 3.053 -0.044
91 HG23 VAL 11 2HG2 VAL 11 -2.435 3.660 0.100
92 H GLU 12 H GLU 12 1.489 4.084 1.412
93 HA GLU 12 HA GLU 12 1.122 6.414 3.103
94 HB2 GLU 12 2HB GLU 12 3.337 6.613 4.002
95 HB3 GLU 12 3HB GLU 12 2.643 5.104 4.562
96 HG2 GLU 12 2HG GLU 12 4.003 3.807 3.044
97 HG3 GLU 12 3HG GLU 12 4.559 5.262 2.204
98 H TYR 13 H TYR 13 2.249 8.255 2.521
99 HA TYR 13 HA TYR 13 3.580 8.405 -0.103
100 HB2 TYR 13 2HB TYR 13 3.456 10.366 2.216
101 HB3 TYR 13 3HB TYR 13 4.090 10.694 0.609
102 HD1 TYR 13 HD1 TYR 13 1.562 9.016 -0.682
103 HD2 TYR 13 HD2 TYR 13 2.021 12.337 2.040
104 HE1 TYR 13 HE1 TYR 13 -0.536 10.009 -1.536
105 HE2 TYR 13 HE2 TYR 13 -0.134 13.289 1.225
106 HH TYR 13 HH TYR 13 -1.858 11.897 -1.570
107 H ALA 14 H ALA 14 5.663 8.020 -0.403
108 HA ALA 14 HA ALA 14 7.233 6.697 1.565
109 HB1 ALA 14 1HB ALA 14 7.862 7.754 -1.222
110 HB2 ALA 14 2HB ALA 14 8.916 6.678 -0.305
111 HB3 ALA 14 3HB ALA 14 7.296 6.126 -0.803
112 H LYS 15 H LYS 15 8.425 7.536 3.140
113 HA LYS 15 HA LYS 15 9.097 10.327 3.407
114 HB2 LYS 15 2HB LYS 15 10.002 7.834 4.911
115 HB3 LYS 15 3HB LYS 15 10.619 9.436 5.285
116 HG2 LYS 15 2HG LYS 15 8.839 8.847 6.814
117 HG3 LYS 15 3HG LYS 15 8.391 10.258 5.845
118 HD2 LYS 15 2HD LYS 15 6.951 8.912 4.440
119 HD3 LYS 15 3HD LYS 15 7.498 7.408 5.228
120 HE2 LYS 15 2HE LYS 15 6.471 8.212 7.346
121 HE3 LYS 15 3HE LYS 15 5.938 9.685 6.508
122 HZ1 LYS 15 3HZ LYS 15 4.701 8.243 4.964
123 HZ2 LYS 15 1HZ LYS 15 5.158 6.906 5.792
124 HZ3 LYS 15 2HZ LYS 15 4.164 8.001 6.505
125 H SER 16 H SER 16 11.044 7.514 2.594
126 HA SER 16 HA SER 16 12.880 8.991 0.868
127 HB2 SER 16 2HB SER 16 13.782 7.735 3.475
128 HB3 SER 16 3HB SER 16 14.871 7.850 2.080
129 HG SER 16 HG SER 16 14.992 9.665 3.525
130 H GLY 17 H GLY 17 14.365 7.424 -0.258
131 HA2 GLY 17 2HA GLY 17 13.026 4.992 -1.141
132 HA3 GLY 17 3HA GLY 17 14.636 5.552 -1.595
133 H ARG 18 H ARG 18 12.833 4.122 1.098
134 HA ARG 18 HA ARG 18 15.227 2.554 1.970
135 HB2 ARG 18 2HB ARG 18 14.784 4.549 3.339
136 HB3 ARG 18 3HB ARG 18 13.137 4.018 3.641
137 HG2 ARG 18 2HG ARG 18 14.703 3.715 5.553
138 HG3 ARG 18 3HG ARG 18 13.871 2.248 5.074
139 HD2 ARG 18 2HD ARG 18 15.986 1.603 3.755
140 HD3 ARG 18 3HD ARG 18 16.761 3.017 4.466
141 HE ARG 18 HE ARG 18 16.967 1.870 6.476
142 HH11 ARG 18 1HH2 ARG 18 14.620 0.086 4.544
143 HH12 ARG 18 2HH2 ARG 18 14.687 -1.294 5.612
144 HH21 ARG 18 1HH1 ARG 18 16.947 0.106 7.795
145 HH22 ARG 18 2HH1 ARG 18 15.951 -1.271 7.415
146 H ALA 19 H ALA 19 12.529 1.960 0.433
147 HA ALA 19 HA ALA 19 12.085 -0.679 1.741
148 HB1 ALA 19 1HB ALA 19 9.935 1.116 0.540
149 HB2 ALA 19 2HB ALA 19 9.702 -0.524 1.176
150 HB3 ALA 19 3HB ALA 19 10.170 0.786 2.273
151 H SER 20 H SER 20 11.601 -2.409 0.321
152 HA SER 20 HA SER 20 12.313 -1.959 -2.532
153 HB2 SER 20 2HB SER 20 13.314 -4.194 -2.541
154 HB3 SER 20 3HB SER 20 14.154 -3.046 -1.488
155 HG SER 20 HG SER 20 13.865 -5.078 -0.467
156 H CYS 21 HN CYS 21 11.183 -3.071 -4.110
157 HA CYS 21 HA CYS 21 8.441 -3.749 -3.332
158 HB2 CYS 21 2HB CYS 21 8.998 -2.276 -5.238
159 HB3 CYS 21 3HB CYS 21 9.797 -3.641 -6.040
160 H LYS 22 H LYS 22 8.043 -5.696 -2.575
161 HA LYS 22 HA LYS 22 9.679 -8.029 -3.068
162 HB2 LYS 22 2HB LYS 22 6.824 -7.945 -2.041
163 HB3 LYS 22 3HB LYS 22 7.974 -9.229 -1.756
164 HG2 LYS 22 2HG LYS 22 8.182 -6.376 -0.706
165 HG3 LYS 22 3HG LYS 22 7.530 -7.719 0.194
166 HD2 LYS 22 2HD LYS 22 10.395 -7.474 -0.803
167 HD3 LYS 22 3HD LYS 22 9.833 -7.166 0.853
168 HE2 LYS 22 2HE LYS 22 9.057 -9.525 1.033
169 HE3 LYS 22 3HE LYS 22 9.679 -9.850 -0.590
170 HZ1 LYS 22 3HZ LYS 22 11.337 -9.001 1.725
171 HZ2 LYS 22 1HZ LYS 22 11.278 -10.509 1.107
172 HZ3 LYS 22 2HZ LYS 22 11.910 -9.293 0.223
173 H LYS 23 H LYS 23 7.358 -6.612 -5.029
174 HA LYS 23 HA LYS 23 6.416 -9.145 -6.274
175 HB2 LYS 23 2HB LYS 23 4.723 -7.570 -5.527
176 HB3 LYS 23 3HB LYS 23 5.457 -6.280 -6.476
177 HG2 LYS 23 2HG LYS 23 3.422 -7.146 -7.517
178 HG3 LYS 23 3HG LYS 23 4.820 -7.381 -8.564
179 HD2 LYS 23 2HD LYS 23 4.919 -9.767 -7.980
180 HD3 LYS 23 3HD LYS 23 3.632 -9.554 -6.772
181 HE2 LYS 23 2HE LYS 23 2.069 -8.864 -8.531
182 HE3 LYS 23 3HE LYS 23 3.337 -8.989 -9.757
183 HZ1 LYS 23 3HZ LYS 23 2.326 -11.282 -8.147
184 HZ2 LYS 23 1HZ LYS 23 1.897 -10.970 -9.686
185 HZ3 LYS 23 2HZ LYS 23 3.442 -11.376 -9.339
186 H CYS 24 HN CYS 24 7.859 -6.024 -7.389
187 HA CYS 24 HA CYS 24 8.646 -7.454 -9.879
188 HB2 CYS 24 2HB CYS 24 8.486 -5.533 -11.115
189 HB3 CYS 24 3HB CYS 24 7.018 -5.614 -10.148
190 H SER 25 H SER 25 10.071 -6.695 -7.076
191 HA SER 25 HA SER 25 12.125 -6.751 -6.296
192 HB2 SER 25 2HB SER 25 13.790 -8.083 -7.291
193 HB3 SER 25 3HB SER 25 12.213 -8.800 -7.625
194 HG SER 25 HG SER 25 12.422 -7.502 -9.698
195 H GLU 26 H GLU 26 11.350 -4.289 -7.891
196 HA GLU 26 HA GLU 26 14.036 -2.984 -8.053
197 HB2 GLU 26 2HB GLU 26 11.273 -1.864 -8.656
198 HB3 GLU 26 3HB GLU 26 12.810 -1.005 -8.810
199 HG2 GLU 26 2HG GLU 26 13.530 -2.851 -10.437
200 HG3 GLU 26 3HG GLU 26 11.833 -3.335 -10.483
201 H SER 27 H SER 27 13.590 -0.533 -6.991
202 HA SER 27 HA SER 27 12.563 -0.984 -4.235
203 HB2 SER 27 2HB SER 27 15.043 0.545 -4.971
204 HB3 SER 27 3HB SER 27 14.262 0.531 -3.366
205 HG SER 27 HG SER 27 15.986 -0.973 -3.545
206 H ILE 28 H ILE 28 11.714 0.781 -3.104
207 HA ILE 28 HA ILE 28 9.936 2.099 -5.037
208 HB ILE 28 HB ILE 28 9.552 1.636 -2.072
209 HG12 ILE 28 2HG1 ILE 28 8.307 -0.031 -4.296
210 HG13 ILE 28 3HG1 ILE 28 9.814 -0.513 -3.525
211 HG21 ILE 28 1HG2 ILE 28 8.090 3.420 -2.999
212 HG22 ILE 28 2HG2 ILE 28 7.658 2.383 -4.368
213 HG23 ILE 28 3HG2 ILE 28 7.131 1.950 -2.748
214 HD11 ILE 28 3HD1 ILE 28 8.018 -1.663 -2.443
215 HD12 ILE 28 1HD1 ILE 28 8.749 -0.521 -1.309
216 HD13 ILE 28 2HD1 ILE 28 7.182 -0.149 -2.063
217 HA PRO 29 HA PRO 29 12.387 5.652 -4.071
218 HB2 PRO 29 2HB PRO 29 11.453 7.485 -5.873
219 HB3 PRO 29 3HB PRO 29 12.373 6.021 -6.340
220 HG2 PRO 29 2HG PRO 29 9.354 6.373 -6.281
221 HG3 PRO 29 3HG PRO 29 10.367 5.761 -7.632
222 HD2 PRO 29 2HD PRO 29 9.131 4.061 -5.920
223 HD3 PRO 29 3HD PRO 29 10.784 3.720 -6.515
224 H LYS 30 H LYS 30 12.451 7.723 -3.268
225 HA LYS 30 HA LYS 30 10.703 8.577 -1.203
226 HB2 LYS 30 2HB LYS 30 13.123 9.121 -1.534
227 HB3 LYS 30 3HB LYS 30 12.706 10.133 -2.913
228 HG2 LYS 30 2HG LYS 30 11.534 11.721 -1.465
229 HG3 LYS 30 3HG LYS 30 11.746 10.653 -0.071
230 HD2 LYS 30 2HD LYS 30 14.276 10.856 -0.414
231 HD3 LYS 30 3HD LYS 30 13.939 12.017 -1.696
232 HE2 LYS 30 2HE LYS 30 14.473 13.330 0.162
233 HE3 LYS 30 3HE LYS 30 12.714 13.434 0.039
234 HZ1 LYS 30 3HZ LYS 30 14.160 11.590 1.894
235 HZ2 LYS 30 1HZ LYS 30 13.513 13.028 2.334
236 HZ3 LYS 30 2HZ LYS 30 12.557 11.800 1.842
237 H ASP 31 H ASP 31 9.161 10.181 -1.048
238 HA ASP 31 HA ASP 31 7.349 11.364 -1.622
239 HB2 ASP 31 2HB ASP 31 9.208 12.946 -2.034
240 HB3 ASP 31 3HB ASP 31 9.159 12.541 -3.749
241 H SER 32 H SER 32 7.031 8.889 -2.509
242 HA SER 32 HA SER 32 5.191 9.191 -4.806
243 HB2 SER 32 2HB SER 32 7.391 8.209 -5.600
244 HB3 SER 32 3HB SER 32 7.080 6.823 -4.534
245 HG SER 32 HG SER 32 6.322 6.548 -6.734
246 H LEU 33 H LEU 33 3.778 7.085 -4.884
247 HA LEU 33 HA LEU 33 2.755 6.685 -2.125
248 HB2 LEU 33 2HB LEU 33 1.235 7.617 -3.866
249 HB3 LEU 33 3HB LEU 33 1.475 6.160 -4.829
250 HG LEU 33 HG LEU 33 0.471 4.818 -2.941
251 HD11 LEU 33 1HD1 LEU 33 0.766 6.378 -1.054
252 HD12 LEU 33 2HD1 LEU 33 -0.275 7.571 -1.857
253 HD13 LEU 33 3HD1 LEU 33 -0.944 6.026 -1.297
254 HD21 LEU 33 3HD2 LEU 33 -1.835 5.456 -3.457
255 HD22 LEU 33 1HD2 LEU 33 -1.285 7.041 -4.055
256 HD23 LEU 33 2HD2 LEU 33 -0.840 5.554 -4.922
257 H ARG 34 H ARG 34 2.853 4.756 -1.118
258 HA ARG 34 HA ARG 34 3.522 2.281 -2.618
259 HB2 ARG 34 2HB ARG 34 5.310 1.679 -1.180
260 HB3 ARG 34 3HB ARG 34 5.653 3.269 -1.879
261 HG2 ARG 34 2HG ARG 34 5.297 4.393 0.182
262 HG3 ARG 34 3HG ARG 34 4.502 2.984 0.899
263 HD2 ARG 34 2HD ARG 34 6.623 3.049 1.895
264 HD3 ARG 34 3HD ARG 34 6.659 1.721 0.760
265 HE ARG 34 HE ARG 34 7.955 3.152 -0.796
266 HH11 ARG 34 1HH2 ARG 34 7.942 4.351 2.544
267 HH12 ARG 34 2HH2 ARG 34 9.635 4.767 2.436
268 HH21 ARG 34 1HH1 ARG 34 10.073 3.978 -0.853
269 HH22 ARG 34 2HH1 ARG 34 10.638 4.842 0.542
270 H MET 35 H MET 35 3.164 0.351 -1.454
271 HA MET 35 HA MET 35 1.328 0.508 0.859
272 HB2 MET 35 2HB MET 35 0.792 -0.929 -1.766
273 HB3 MET 35 3HB MET 35 0.005 -1.394 -0.245
274 HG2 MET 35 2HG MET 35 -0.853 0.898 0.006
275 HG3 MET 35 3HG MET 35 -0.150 1.330 -1.558
276 HE1 MET 35 3HE MET 35 -2.390 -1.717 -0.168
277 HE2 MET 35 1HE MET 35 -3.067 -0.181 0.423
278 HE3 MET 35 2HE MET 35 -3.971 -1.153 -0.759
279 H ALA 36 H ALA 36 1.106 -1.518 2.002
280 HA ALA 36 HA ALA 36 3.240 -3.474 1.550
281 HB1 ALA 36 1HB ALA 36 4.605 -2.736 3.167
282 HB2 ALA 36 2HB ALA 36 3.495 -1.417 3.554
283 HB3 ALA 36 3HB ALA 36 3.331 -2.988 4.363
284 H ILE 37 H ILE 37 3.002 -5.414 2.944
285 HA ILE 37 HA ILE 37 0.187 -5.855 3.859
286 HB ILE 37 HB ILE 37 1.815 -7.301 1.874
287 HG12 ILE 37 2HG1 ILE 37 -1.151 -7.378 2.576
288 HG13 ILE 37 3HG1 ILE 37 -0.400 -6.089 1.633
289 HG21 ILE 37 1HG2 ILE 37 0.261 -8.976 3.871
290 HG22 ILE 37 2HG2 ILE 37 1.011 -9.519 2.335
291 HG23 ILE 37 3HG2 ILE 37 2.034 -8.964 3.651
292 HD11 ILE 37 3HD1 ILE 37 0.313 -7.724 -0.076
293 HD12 ILE 37 1HD1 ILE 37 -0.536 -9.004 0.817
294 HD13 ILE 37 2HD1 ILE 37 -1.448 -7.645 0.123
295 H MET 38 H MET 38 -0.193 -6.997 5.618
296 HA MET 38 HA MET 38 2.066 -7.096 7.498
297 HB2 MET 38 2HB MET 38 -0.288 -5.845 7.699
298 HB3 MET 38 3HB MET 38 -0.858 -7.436 8.161
299 HG2 MET 38 2HG MET 38 -0.388 -6.621 10.215
300 HG3 MET 38 3HG MET 38 1.212 -7.263 9.848
301 HE1 MET 38 3HE MET 38 3.136 -5.819 8.898
302 HE2 MET 38 1HE MET 38 2.162 -4.967 7.676
303 HE3 MET 38 2HE MET 38 3.173 -4.037 8.815
304 H VAL 39 H VAL 39 3.169 -8.932 7.368
305 HA VAL 39 HA VAL 39 1.640 -11.504 7.660
306 HB VAL 39 HB VAL 39 2.745 -11.344 5.506
307 HG11 VAL 39 1HG1 VAL 39 5.382 -11.286 7.024
308 HG12 VAL 39 2HG1 VAL 39 5.151 -11.453 5.274
309 HG13 VAL 39 3HG1 VAL 39 4.694 -9.945 6.080
310 HG21 VAL 39 3HG2 VAL 39 2.416 -13.545 6.587
311 HG22 VAL 39 1HG2 VAL 39 3.798 -13.494 5.483
312 HG23 VAL 39 2HG2 VAL 39 4.078 -13.452 7.230
313 H GLN 40 H GLN 40 2.242 -13.004 9.123
314 HA GLN 40 HA GLN 40 3.564 -12.096 11.522
315 HB2 GLN 40 2HB GLN 40 3.266 -14.526 12.199
316 HB3 GLN 40 3HB GLN 40 1.813 -13.581 11.877
317 HG2 GLN 40 2HG GLN 40 1.522 -14.620 9.685
318 HG3 GLN 40 3HG GLN 40 3.050 -15.484 9.842
319 HE21 GLN 40 2HE2 GLN 40 1.225 -17.218 9.269
320 HE22 GLN 40 1HE2 GLN 40 0.562 -18.025 10.683
321 H SER 41 H SER 41 5.627 -12.225 12.158
322 HA SER 41 HA SER 41 7.581 -13.124 10.170
323 HB2 SER 41 2HB SER 41 7.731 -10.899 11.195
324 HB3 SER 41 3HB SER 41 7.976 -11.663 12.775
325 HG SER 41 HG SER 41 9.685 -11.536 10.539
326 HA PRO 42 HA PRO 42 8.981 -16.590 12.593
327 HB2 PRO 42 2HB PRO 42 11.239 -16.594 10.607
328 HB3 PRO 42 3HB PRO 42 10.213 -17.957 11.143
329 HG2 PRO 42 2HG PRO 42 9.837 -16.797 8.707
330 HG3 PRO 42 3HG PRO 42 8.432 -17.287 9.714
331 HD2 PRO 42 2HD PRO 42 9.664 -14.523 9.442
332 HD3 PRO 42 3HD PRO 42 7.943 -15.016 9.369
333 H MET 43 H MET 43 10.560 -13.589 12.004
334 HA MET 43 HA MET 43 12.841 -14.184 13.850
335 HB2 MET 43 2HB MET 43 12.567 -12.287 11.519
336 HB3 MET 43 3HB MET 43 13.918 -12.233 12.645
337 HG2 MET 43 2HG MET 43 14.864 -14.173 11.921
338 HG3 MET 43 3HG MET 43 13.336 -14.929 11.496
339 HE1 MET 43 3HE MET 43 11.816 -13.210 9.630
340 HE2 MET 43 1HE MET 43 12.433 -13.682 8.027
341 HE3 MET 43 2HE MET 43 12.183 -14.908 9.294
342 H PHE 44 H PHE 44 10.099 -12.055 13.366
343 HA PHE 44 HA PHE 44 10.931 -10.310 15.645
344 HB2 PHE 44 2HB PHE 44 10.782 -9.120 13.551
345 HB3 PHE 44 3HB PHE 44 9.184 -9.764 13.230
346 HD1 PHE 44 HD1 PHE 44 11.060 -7.634 15.694
347 HD2 PHE 44 HD2 PHE 44 7.256 -8.585 13.899
348 HE1 PHE 44 HE1 PHE 44 10.016 -5.712 16.876
349 HE2 PHE 44 HE2 PHE 44 6.219 -6.657 15.069
350 HZ PHE 44 HZ PHE 44 7.596 -5.224 16.567
351 H ASP 45 H ASP 45 9.281 -9.528 17.039
352 HA ASP 45 HA ASP 45 7.611 -11.734 18.004
353 HB2 ASP 45 2HB ASP 45 8.351 -9.064 19.247
354 HB3 ASP 45 3HB ASP 45 7.442 -10.343 20.054
355 H GLY 46 H GLY 46 6.511 -10.783 15.683
356 HA2 GLY 46 2HA GLY 46 3.787 -10.394 16.101
357 HA3 GLY 46 3HA GLY 46 4.467 -8.761 16.038
358 H LYS 47 H LYS 47 3.399 -8.255 14.098
359 HA LYS 47 HA LYS 47 4.173 -9.854 11.704
360 HB2 LYS 47 2HB LYS 47 1.883 -7.898 11.836
361 HB3 LYS 47 3HB LYS 47 2.240 -9.106 10.608
362 HG2 LYS 47 2HG LYS 47 2.022 -10.648 12.938
363 HG3 LYS 47 3HG LYS 47 0.847 -9.370 13.223
364 HD2 LYS 47 2HD LYS 47 1.008 -11.330 10.924
365 HD3 LYS 47 3HD LYS 47 -0.177 -11.335 12.218
366 HE2 LYS 47 2HE LYS 47 0.089 -9.227 10.021
367 HE3 LYS 47 3HE LYS 47 -1.063 -10.557 10.025
368 HZ1 LYS 47 3HZ LYS 47 -2.061 -9.607 12.042
369 HZ2 LYS 47 1HZ LYS 47 -1.003 -8.343 12.017
370 HZ3 LYS 47 2HZ LYS 47 -2.094 -8.523 10.810
371 H VAL 48 H VAL 48 4.825 -8.924 9.839
372 HA VAL 48 HA VAL 48 6.180 -6.283 10.135
373 HB VAL 48 HB VAL 48 8.071 -7.254 8.853
374 HG11 VAL 48 1HG1 VAL 48 7.433 -8.662 11.482
375 HG12 VAL 48 2HG1 VAL 48 9.043 -8.463 10.761
376 HG13 VAL 48 3HG1 VAL 48 8.138 -7.045 11.314
377 HG21 VAL 48 3HG2 VAL 48 6.732 -9.947 9.373
378 HG22 VAL 48 1HG2 VAL 48 6.952 -9.189 7.787
379 HG23 VAL 48 2HG2 VAL 48 8.364 -9.685 8.727
380 HA PRO 49 HA PRO 49 4.289 -5.376 6.286
381 HB2 PRO 49 2HB PRO 49 5.561 -3.084 5.518
382 HB3 PRO 49 3HB PRO 49 4.500 -3.173 6.955
383 HG2 PRO 49 2HG PRO 49 7.527 -3.361 6.849
384 HG3 PRO 49 3HG PRO 49 6.516 -2.372 7.948
385 HD2 PRO 49 2HD PRO 49 7.544 -4.816 8.662
386 HD3 PRO 49 3HD PRO 49 5.963 -4.228 9.259
387 H HIS 50 H HIS 50 4.445 -6.338 4.316
388 HA HIS 50 HA HIS 50 7.087 -6.547 2.904
389 HB2 HIS 50 2HB HIS 50 4.430 -7.998 2.683
390 HB3 HIS 50 3HB HIS 50 5.573 -7.985 1.349
391 HD2 HIS 50 HD2 HIS 50 6.744 -8.233 5.013
392 HE1 HIS 50 HE1 HIS 50 7.540 -12.007 3.198
393 HE2 HIS 50 HE2 HIS 50 7.920 -10.587 5.278
394 H TRP 51 H TRP 51 7.527 -4.714 1.826
395 HA TRP 51 HA TRP 51 5.379 -2.922 1.051
396 HB2 TRP 51 2HB TRP 51 8.375 -2.684 0.693
397 HB3 TRP 51 3HB TRP 51 7.188 -1.418 0.407
398 HD1 TRP 51 HD1 TRP 51 9.115 -3.110 3.156
399 HE1 TRP 51 HE1 TRP 51 8.752 -1.888 5.378
400 HE3 TRP 51 HE3 TRP 51 5.291 0.020 1.753
401 HZ2 TRP 51 HZ2 TRP 51 6.996 0.125 6.436
402 HZ3 TRP 51 HZ3 TRP 51 4.271 1.563 3.433
403 HH2 TRP 51 HH2 TRP 51 5.168 1.658 5.751
404 H TYR 52 H TYR 52 4.847 -2.212 -0.971
405 HA TYR 52 HA TYR 52 6.339 -3.091 -3.315
406 HB2 TYR 52 2HB TYR 52 3.481 -3.559 -3.771
407 HB3 TYR 52 3HB TYR 52 4.922 -4.452 -4.262
408 HD1 TYR 52 HD2 TYR 52 2.617 -4.053 -1.299
409 HD2 TYR 52 HD1 TYR 52 5.383 -6.538 -3.465
410 HE1 TYR 52 HE2 TYR 52 1.918 -6.055 0.065
411 HE2 TYR 52 HE1 TYR 52 4.654 -8.517 -2.139
412 HH TYR 52 HH TYR 52 3.353 -9.289 -0.469
413 H HIS 53 H HIS 53 5.631 -1.916 -5.262
414 HA HIS 53 HA HIS 53 4.955 0.870 -4.897
415 HB2 HIS 53 2HB HIS 53 4.545 -0.879 -7.358
416 HB3 HIS 53 3HB HIS 53 4.456 0.860 -7.322
417 HD2 HIS 53 HD2 HIS 53 6.738 2.249 -6.760
418 HE1 HIS 53 HE1 HIS 53 9.362 -0.764 -8.237
419 HE2 HIS 53 HE2 HIS 53 9.173 1.685 -7.597
420 H PHE 54 H PHE 54 2.927 1.976 -5.477
421 HA PHE 54 HA PHE 54 0.671 1.026 -4.164
422 HB2 PHE 54 2HB PHE 54 0.813 3.328 -4.694
423 HB3 PHE 54 3HB PHE 54 0.969 3.017 -6.419
424 HD1 PHE 54 HD2 PHE 54 -1.496 2.285 -3.623
425 HD2 PHE 54 HD1 PHE 54 -0.913 3.372 -7.760
426 HE1 PHE 54 HE2 PHE 54 -3.955 2.308 -3.974
427 HE2 PHE 54 HE1 PHE 54 -3.378 3.445 -8.074
428 HZ PHE 54 HZ PHE 54 -4.889 2.847 -6.203
429 H SER 55 H SER 55 1.422 0.535 -7.677
430 HA SER 55 HA SER 55 -1.105 -0.828 -8.222
431 HB2 SER 55 2HB SER 55 -0.030 -1.253 -10.433
432 HB3 SER 55 3HB SER 55 -0.141 0.459 -9.980
433 HG SER 55 HG SER 55 1.942 -0.047 -10.787
434 H CYS 56 HN CYS 56 2.319 -1.786 -7.735
435 HA CYS 56 HA CYS 56 2.150 -4.470 -8.288
436 HB2 CYS 56 2HB CYS 56 3.830 -2.970 -6.296
437 HB3 CYS 56 3HB CYS 56 4.056 -4.678 -6.666
438 H PHE 57 H PHE 57 1.213 -2.921 -5.222
439 HA PHE 57 HA PHE 57 0.687 -5.134 -3.549
440 HB2 PHE 57 2HB PHE 57 0.549 -2.878 -2.794
441 HB3 PHE 57 3HB PHE 57 -0.768 -2.504 -3.903
442 HD1 PHE 57 HD2 PHE 57 -3.020 -3.618 -3.601
443 HD2 PHE 57 HD1 PHE 57 0.079 -3.837 -0.615
444 HE1 PHE 57 HE2 PHE 57 -4.681 -4.394 -1.955
445 HE2 PHE 57 HE1 PHE 57 -1.632 -4.430 1.082
446 HZ PHE 57 HZ PHE 57 -4.001 -4.785 0.399
447 H TRP 58 H TRP 58 -1.516 -3.660 -5.998
448 HA TRP 58 HA TRP 58 -3.600 -5.627 -5.564
449 HB2 TRP 58 2HB TRP 58 -3.270 -3.746 -7.896
450 HB3 TRP 58 3HB TRP 58 -4.736 -4.542 -7.341
451 HD1 TRP 58 HD1 TRP 58 -2.588 -1.548 -6.833
452 HE1 TRP 58 HE1 TRP 58 -3.420 -0.013 -4.975
453 HE3 TRP 58 HE3 TRP 58 -6.387 -4.483 -5.028
454 HZ2 TRP 58 HZ2 TRP 58 -5.519 -0.042 -2.946
455 HZ3 TRP 58 HZ3 TRP 58 -7.798 -3.676 -3.177
456 HH2 TRP 58 HH2 TRP 58 -7.345 -1.471 -2.117
457 H LYS 59 H LYS 59 -0.831 -5.381 -7.725
458 HA LYS 59 HA LYS 59 -1.516 -7.592 -9.487
459 HB2 LYS 59 2HB LYS 59 1.139 -6.289 -8.806
460 HB3 LYS 59 3HB LYS 59 0.937 -7.523 -10.039
461 HG2 LYS 59 2HG LYS 59 -0.294 -6.158 -11.462
462 HG3 LYS 59 3HG LYS 59 -0.763 -5.034 -10.184
463 HD2 LYS 59 2HD LYS 59 0.898 -4.151 -11.839
464 HD3 LYS 59 3HD LYS 59 1.281 -3.949 -10.145
465 HE2 LYS 59 2HE LYS 59 2.789 -6.011 -10.341
466 HE3 LYS 59 3HE LYS 59 2.519 -5.926 -12.091
467 HZ1 LYS 59 3HZ LYS 59 3.371 -3.595 -11.952
468 HZ2 LYS 59 1HZ LYS 59 3.761 -3.839 -10.362
469 HZ3 LYS 59 2HZ LYS 59 4.505 -4.705 -11.527
470 H VAL 60 H VAL 60 -0.237 -7.517 -6.189
471 HA VAL 60 HA VAL 60 0.583 -10.317 -6.179
472 HB VAL 60 HB VAL 60 -0.508 -8.764 -3.817
473 HG11 VAL 60 1HG1 VAL 60 -0.264 -11.180 -3.347
474 HG12 VAL 60 2HG1 VAL 60 1.397 -11.145 -3.976
475 HG13 VAL 60 3HG1 VAL 60 0.969 -10.269 -2.492
476 HG21 VAL 60 3HG2 VAL 60 1.882 -8.319 -3.245
477 HG22 VAL 60 1HG2 VAL 60 2.351 -8.902 -4.858
478 HG23 VAL 60 2HG2 VAL 60 1.331 -7.458 -4.655
479 H GLY 61 H GLY 61 -2.543 -8.792 -6.316
480 HA2 GLY 61 2HA GLY 61 -4.473 -9.919 -7.002
481 HA3 GLY 61 3HA GLY 61 -3.878 -11.437 -6.334
482 H HIS 62 H HIS 62 -3.545 -8.892 -4.060
483 HA HIS 62 HA HIS 62 -5.771 -9.888 -2.421
484 HB2 HIS 62 2HB HIS 62 -3.674 -7.741 -1.967
485 HB3 HIS 62 3HB HIS 62 -4.982 -8.077 -0.836
486 HD2 HIS 62 HD2 HIS 62 -1.720 -9.603 -2.150
487 HE1 HIS 62 HE1 HIS 62 -2.976 -12.050 1.103
488 HE2 HIS 62 HE2 HIS 62 -1.094 -11.604 -0.551
489 H SER 63 H SER 63 -7.539 -8.784 -1.736
490 HA SER 63 HA SER 63 -8.261 -6.176 -2.976
491 HB2 SER 63 2HB SER 63 -10.076 -8.612 -2.776
492 HB3 SER 63 3HB SER 63 -10.625 -6.966 -3.132
493 HG SER 63 HG SER 63 -8.792 -8.514 -4.671
494 H ILE 64 H ILE 64 -9.705 -4.912 -1.698
495 HA ILE 64 HA ILE 64 -9.405 -5.504 1.221
496 HB ILE 64 HB ILE 64 -9.095 -2.800 -0.109
497 HG12 ILE 64 2HG1 ILE 64 -6.902 -4.764 0.672
498 HG13 ILE 64 3HG1 ILE 64 -7.276 -4.177 -0.943
499 HG21 ILE 64 1HG2 ILE 64 -8.371 -3.803 2.679
500 HG22 ILE 64 2HG2 ILE 64 -8.094 -2.175 2.051
501 HG23 ILE 64 3HG2 ILE 64 -9.748 -2.750 2.272
502 HD11 ILE 64 3HD1 ILE 64 -6.816 -1.791 0.062
503 HD12 ILE 64 1HD1 ILE 64 -5.932 -2.722 1.301
504 HD13 ILE 64 2HD1 ILE 64 -5.480 -2.841 -0.401
505 H ARG 65 H ARG 65 -11.254 -5.605 2.240
506 HA ARG 65 HA ARG 65 -13.743 -4.788 0.920
507 HB2 ARG 65 2HB ARG 65 -14.788 -5.924 2.979
508 HB3 ARG 65 3HB ARG 65 -14.030 -6.892 1.738
509 HG2 ARG 65 2HG ARG 65 -12.417 -6.096 4.173
510 HG3 ARG 65 3HG ARG 65 -13.630 -7.359 4.320
511 HD2 ARG 65 2HD ARG 65 -11.451 -7.449 2.193
512 HD3 ARG 65 3HD ARG 65 -11.244 -8.143 3.798
513 HE ARG 65 HE ARG 65 -12.894 -9.158 1.588
514 HH11 ARG 65 1HH2 ARG 65 -12.312 -9.494 5.033
515 HH12 ARG 65 2HH2 ARG 65 -13.037 -11.077 5.084
516 HH21 ARG 65 1HH1 ARG 65 -13.806 -11.168 1.736
517 HH22 ARG 65 2HH1 ARG 65 -13.856 -11.991 3.266
518 H HIS 66 H HIS 66 -11.870 -3.579 3.537
519 HA HIS 66 HA HIS 66 -13.554 -1.179 3.749
520 HB2 HIS 66 2HB HIS 66 -13.548 -1.338 6.279
521 HB3 HIS 66 3HB HIS 66 -14.717 -2.265 5.374
522 HD2 HIS 66 HD2 HIS 66 -11.259 -3.926 5.720
523 HE1 HIS 66 HE1 HIS 66 -13.861 -5.845 8.495
524 HE2 HIS 66 HE2 HIS 66 -11.561 -5.919 7.409
525 HA PRO 67 HA PRO 67 -9.046 -0.844 3.588
526 HB2 PRO 67 2HB PRO 67 -8.788 1.455 2.033
527 HB3 PRO 67 3HB PRO 67 -9.081 -0.179 1.366
528 HG2 PRO 67 2HG PRO 67 -11.132 1.942 2.040
529 HG3 PRO 67 3HG PRO 67 -10.973 1.011 0.510
530 HD2 PRO 67 2HD PRO 67 -12.746 0.281 2.384
531 HD3 PRO 67 3HD PRO 67 -11.760 -0.978 1.573
532 H ASP 68 H ASP 68 -11.165 1.847 4.582
533 HA ASP 68 HA ASP 68 -8.999 3.219 5.953
534 HB2 ASP 68 2HB ASP 68 -10.768 4.646 6.888
535 HB3 ASP 68 3HB ASP 68 -10.819 4.521 5.137
536 H VAL 69 H VAL 69 -10.563 0.337 6.649
537 HA VAL 69 HA VAL 69 -10.149 0.536 9.583
538 HB VAL 69 HB VAL 69 -11.437 -1.701 7.979
539 HG11 VAL 69 1HG1 VAL 69 -11.329 -1.196 10.978
540 HG12 VAL 69 2HG1 VAL 69 -12.288 -2.459 10.168
541 HG13 VAL 69 3HG1 VAL 69 -10.528 -2.520 10.097
542 HG21 VAL 69 3HG2 VAL 69 -12.726 0.506 9.640
543 HG22 VAL 69 1HG2 VAL 69 -12.834 0.326 7.876
544 HG23 VAL 69 2HG2 VAL 69 -13.573 -0.887 8.925
545 H GLU 70 H GLU 70 -9.138 -1.342 6.703
546 HA GLU 70 HA GLU 70 -7.110 -2.756 8.387
547 HB2 GLU 70 2HB GLU 70 -8.473 -3.445 5.766
548 HB3 GLU 70 3HB GLU 70 -7.095 -4.356 6.367
549 HG2 GLU 70 2HG GLU 70 -9.704 -3.972 7.880
550 HG3 GLU 70 3HG GLU 70 -9.278 -5.390 6.919
551 H VAL 71 H VAL 71 -7.092 -0.425 5.810
552 HA VAL 71 HA VAL 71 -4.195 -0.872 5.227
553 HB VAL 71 HB VAL 71 -5.919 1.342 4.157
554 HG11 VAL 71 1HG1 VAL 71 -3.297 0.038 3.306
555 HG12 VAL 71 2HG1 VAL 71 -4.120 1.436 2.562
556 HG13 VAL 71 3HG1 VAL 71 -3.433 1.562 4.204
557 HG21 VAL 71 3HG2 VAL 71 -5.205 -1.391 2.989
558 HG22 VAL 71 1HG2 VAL 71 -6.833 -0.866 3.427
559 HG23 VAL 71 2HG2 VAL 71 -5.987 -0.059 2.097
560 H ASP 72 H ASP 72 -3.174 -0.580 7.076
561 HA ASP 72 HA ASP 72 -3.353 1.651 8.863
562 HB2 ASP 72 2HB ASP 72 -2.191 -0.493 9.278
563 HB3 ASP 72 3HB ASP 72 -1.004 -0.106 8.034
564 H GLY 73 H GLY 73 -2.386 3.682 8.781
565 HA2 GLY 73 2HA GLY 73 -1.026 5.424 8.039
566 HA3 GLY 73 3HA GLY 73 -0.411 4.393 6.749
567 H PHE 74 H PHE 74 -3.651 4.168 6.273
568 HA PHE 74 HA PHE 74 -3.910 5.920 4.045
569 HB2 PHE 74 2HB PHE 74 -5.317 3.946 4.598
570 HB3 PHE 74 3HB PHE 74 -5.933 4.764 6.024
571 HD1 PHE 74 HD1 PHE 74 -6.025 4.670 2.306
572 HD2 PHE 74 HD2 PHE 74 -7.760 6.330 5.891
573 HE1 PHE 74 HE1 PHE 74 -8.009 5.428 1.006
574 HE2 PHE 74 HE2 PHE 74 -9.737 7.080 4.582
575 HZ PHE 74 HZ PHE 74 -9.862 6.623 2.151
576 H SER 75 H SER 75 -4.353 6.627 7.497
577 HA SER 75 HA SER 75 -5.518 9.240 7.177
578 HB2 SER 75 2HB SER 75 -3.892 8.065 9.458
579 HB3 SER 75 3HB SER 75 -4.911 9.519 9.541
580 HG SER 75 HG SER 75 -6.010 7.654 10.309
581 H GLU 76 H GLU 76 -2.273 8.181 6.568
582 HA GLU 76 HA GLU 76 -1.008 10.801 7.079
583 HB2 GLU 76 2HB GLU 76 0.126 8.306 5.757
584 HB3 GLU 76 3HB GLU 76 1.020 9.729 6.266
585 HG2 GLU 76 2HG GLU 76 0.547 9.285 8.617
586 HG3 GLU 76 3HG GLU 76 -0.511 7.935 8.199
587 H LEU 77 H LEU 77 -2.663 9.240 4.490
588 HA LEU 77 HA LEU 77 -1.496 10.664 2.230
589 HB2 LEU 77 2HB LEU 77 -3.981 8.981 2.687
590 HB3 LEU 77 3HB LEU 77 -3.714 9.797 1.169
591 HG LEU 77 HG LEU 77 -1.847 8.501 0.605
592 HD11 LEU 77 1HD1 LEU 77 -0.935 6.677 1.938
593 HD12 LEU 77 2HD1 LEU 77 -0.646 8.243 2.696
594 HD13 LEU 77 3HD1 LEU 77 -1.934 7.185 3.320
595 HD21 LEU 77 3HD2 LEU 77 -2.845 6.281 0.503
596 HD22 LEU 77 1HD2 LEU 77 -3.969 6.703 1.814
597 HD23 LEU 77 2HD2 LEU 77 -4.073 7.525 0.244
598 H ARG 78 H ARG 78 -3.052 11.956 0.787
599 HA ARG 78 HA ARG 78 -5.018 13.606 2.321
600 HB2 ARG 78 2HB ARG 78 -3.324 14.453 -0.076
601 HB3 ARG 78 3HB ARG 78 -4.652 15.404 0.578
602 HG2 ARG 78 2HG ARG 78 -2.120 14.635 2.090
603 HG3 ARG 78 3HG ARG 78 -2.482 16.215 1.400
604 HD2 ARG 78 2HD ARG 78 -4.391 16.504 2.909
605 HD3 ARG 78 3HD ARG 78 -4.176 14.902 3.587
606 HE ARG 78 HE ARG 78 -2.573 17.283 4.168
607 HH11 ARG 78 1HH2 ARG 78 -2.674 13.768 4.510
608 HH12 ARG 78 2HH2 ARG 78 -1.327 13.768 5.607
609 HH21 ARG 78 1HH1 ARG 78 -0.957 17.185 5.687
610 HH22 ARG 78 2HH1 ARG 78 -0.470 15.652 6.346
611 H TRP 79 H TRP 79 -6.698 14.540 0.964
612 HA TRP 79 HA TRP 79 -8.381 12.439 0.728
613 HB2 TRP 79 2HB TRP 79 -9.722 14.169 1.025
614 HB3 TRP 79 3HB TRP 79 -8.549 15.300 0.392
615 HD1 TRP 79 HD1 TRP 79 -11.728 13.498 -0.556
616 HE1 TRP 79 HE1 TRP 79 -12.567 14.324 -2.837
617 HE3 TRP 79 HE3 TRP 79 -7.643 16.223 -1.971
618 HZ2 TRP 79 HZ2 TRP 79 -11.616 16.040 -4.971
619 HZ3 TRP 79 HZ3 TRP 79 -7.616 17.436 -4.130
620 HH2 TRP 79 HH2 TRP 79 -9.598 17.355 -5.644
621 H ASP 80 H ASP 80 -6.665 13.889 -2.042
622 HA ASP 80 HA ASP 80 -8.211 12.547 -4.022
623 HB2 ASP 80 2HB ASP 80 -6.893 14.622 -4.402
624 HB3 ASP 80 3HB ASP 80 -5.415 13.658 -4.325
625 H ASP 81 H ASP 81 -5.448 11.452 -2.149
626 HA ASP 81 HA ASP 81 -4.993 9.100 -3.892
627 HB2 ASP 81 2HB ASP 81 -3.554 10.126 -1.428
628 HB3 ASP 81 3HB ASP 81 -3.236 8.558 -2.176
629 H GLN 82 H GLN 82 -6.303 10.022 -0.681
630 HA GLN 82 HA GLN 82 -7.057 7.436 0.204
631 HB2 GLN 82 2HB GLN 82 -8.285 10.189 0.579
632 HB3 GLN 82 3HB GLN 82 -8.930 8.757 1.376
633 HG2 GLN 82 2HG GLN 82 -6.810 8.342 2.508
634 HG3 GLN 82 3HG GLN 82 -6.048 9.688 1.661
635 HE21 GLN 82 2HE2 GLN 82 -6.054 9.505 4.483
636 HE22 GLN 82 1HE2 GLN 82 -7.018 10.863 5.073
637 H GLN 83 H GLN 83 -9.036 9.770 -1.786
638 HA GLN 83 HA GLN 83 -11.140 7.886 -2.154
639 HB2 GLN 83 2HB GLN 83 -12.111 9.391 -3.670
640 HB3 GLN 83 3HB GLN 83 -11.344 10.350 -2.406
641 HG2 GLN 83 2HG GLN 83 -9.410 10.737 -3.980
642 HG3 GLN 83 3HG GLN 83 -10.300 9.901 -5.245
643 HE21 GLN 83 2HE2 GLN 83 -9.520 12.543 -5.801
644 HE22 GLN 83 1HE2 GLN 83 -10.954 13.545 -5.701
645 H LYS 84 H LYS 84 -8.080 8.127 -3.870
646 HA LYS 84 HA LYS 84 -8.911 6.538 -6.175
647 HB2 LYS 84 2HB LYS 84 -7.403 8.365 -6.462
648 HB3 LYS 84 3HB LYS 84 -6.337 7.797 -5.187
649 HG2 LYS 84 2HG LYS 84 -6.798 6.078 -7.623
650 HG3 LYS 84 3HG LYS 84 -5.749 7.486 -7.741
651 HD2 LYS 84 2HD LYS 84 -5.412 5.207 -5.770
652 HD3 LYS 84 3HD LYS 84 -4.483 5.437 -7.256
653 HE2 LYS 84 2HE LYS 84 -4.448 7.162 -4.748
654 HE3 LYS 84 3HE LYS 84 -3.193 6.054 -5.280
655 HZ1 LYS 84 3HZ LYS 84 -2.705 7.486 -7.130
656 HZ2 LYS 84 1HZ LYS 84 -4.005 8.445 -6.848
657 HZ3 LYS 84 2HZ LYS 84 -2.773 8.443 -5.787
658 H VAL 85 H VAL 85 -7.105 6.094 -3.123
659 HA VAL 85 HA VAL 85 -6.536 3.263 -3.534
660 HB VAL 85 HB VAL 85 -6.734 5.008 -1.045
661 HG11 VAL 85 1HG1 VAL 85 -7.287 2.766 -0.246
662 HG12 VAL 85 2HG1 VAL 85 -5.923 2.069 -1.155
663 HG13 VAL 85 3HG1 VAL 85 -5.634 3.156 0.217
664 HG21 VAL 85 3HG2 VAL 85 -4.354 4.884 -0.976
665 HG22 VAL 85 1HG2 VAL 85 -4.294 3.613 -2.206
666 HG23 VAL 85 2HG2 VAL 85 -4.753 5.264 -2.656
667 H LYS 86 H LYS 86 -9.251 4.971 -1.853
668 HA LYS 86 HA LYS 86 -10.717 2.551 -1.322
669 HB2 LYS 86 2HB LYS 86 -11.718 5.421 -1.589
670 HB3 LYS 86 3HB LYS 86 -12.687 4.040 -1.063
671 HG2 LYS 86 2HG LYS 86 -10.760 3.680 0.706
672 HG3 LYS 86 3HG LYS 86 -10.320 5.323 0.330
673 HD2 LYS 86 2HD LYS 86 -11.686 5.288 2.320
674 HD3 LYS 86 3HD LYS 86 -12.596 6.095 1.026
675 HE2 LYS 86 2HE LYS 86 -13.922 4.105 0.655
676 HE3 LYS 86 3HE LYS 86 -12.851 3.143 1.690
677 HZ1 LYS 86 3HZ LYS 86 -13.669 4.201 3.611
678 HZ2 LYS 86 1HZ LYS 86 -14.437 5.401 2.769
679 HZ3 LYS 86 2HZ LYS 86 -14.997 3.865 2.745
680 H LYS 87 H LYS 87 -10.924 4.783 -4.139
681 HA LYS 87 HA LYS 87 -12.864 3.282 -5.602
682 HB2 LYS 87 2HB LYS 87 -12.230 5.476 -6.306
683 HB3 LYS 87 3HB LYS 87 -10.542 5.047 -6.475
684 HG2 LYS 87 2HG LYS 87 -12.714 3.819 -8.215
685 HG3 LYS 87 3HG LYS 87 -11.992 5.376 -8.582
686 HD2 LYS 87 2HD LYS 87 -10.514 2.713 -8.552
687 HD3 LYS 87 3HD LYS 87 -10.988 3.655 -9.947
688 HE2 LYS 87 2HE LYS 87 -9.477 5.454 -9.385
689 HE3 LYS 87 3HE LYS 87 -9.080 4.724 -7.823
690 HZ1 LYS 87 3HZ LYS 87 -8.488 3.375 -10.395
691 HZ2 LYS 87 1HZ LYS 87 -7.408 4.306 -9.600
692 HZ3 LYS 87 2HZ LYS 87 -7.954 2.949 -8.889
693 H THR 88 H THR 88 -9.296 2.870 -5.559
694 HA THR 88 HA THR 88 -9.287 0.704 -7.392
695 HB THR 88 HB THR 88 -7.198 1.361 -5.306
696 HG1 THR 88 1HG THR 88 -7.462 3.097 -6.574
697 HG21 THR 88 1HG2 THR 88 -7.063 -0.106 -7.976
698 HG22 THR 88 2HG2 THR 88 -5.677 0.340 -6.951
699 HG23 THR 88 3HG2 THR 88 -6.844 -0.857 -6.378
700 H ALA 89 H ALA 89 -9.780 0.707 -3.878
701 HA ALA 89 HA ALA 89 -9.633 -2.159 -3.538
702 HB1 ALA 89 1HB ALA 89 -10.960 0.014 -1.865
703 HB2 ALA 89 2HB ALA 89 -10.603 -1.641 -1.355
704 HB3 ALA 89 3HB ALA 89 -9.273 -0.522 -1.720
705 H GLU 90 H GLU 90 -12.287 0.196 -4.175
706 HA GLU 90 HA GLU 90 -14.366 -1.798 -4.236
707 HB2 GLU 90 2HB GLU 90 -14.230 0.989 -5.461
708 HB3 GLU 90 3HB GLU 90 -15.663 -0.038 -5.491
709 HG2 GLU 90 2HG GLU 90 -15.627 -0.119 -2.988
710 HG3 GLU 90 3HG GLU 90 -14.297 1.039 -3.001
711 H ALA 91 H ALA 91 -12.228 -0.489 -6.709
712 HA ALA 91 HA ALA 91 -13.438 -1.784 -8.965
713 HB1 ALA 91 1HB ALA 91 -11.418 -0.898 -10.114
714 HB2 ALA 91 2HB ALA 91 -12.160 0.329 -9.066
715 HB3 ALA 91 3HB ALA 91 -10.695 -0.513 -8.535
716 H GLY 92 H GLY 92 -11.503 -3.121 -6.488
717 HA2 GLY 92 2HA GLY 92 -10.630 -5.238 -6.220
718 HA3 GLY 92 3HA GLY 92 -11.231 -5.684 -7.819
719 H GLY 93 H GLY 93 -9.017 -2.937 -7.296
720 HA2 GLY 93 2HA GLY 93 -6.670 -3.018 -7.305
721 HA3 GLY 93 3HA GLY 93 -6.686 -4.511 -8.236
722 H VAL 94 H VAL 94 -5.197 -2.166 -8.650
723 HA VAL 94 HA VAL 94 -5.842 -1.723 -11.528
724 HB VAL 94 HB VAL 94 -6.087 0.388 -10.212
725 HG11 VAL 94 1HG1 VAL 94 -4.153 0.004 -8.615
726 HG12 VAL 94 2HG1 VAL 94 -3.048 0.342 -9.958
727 HG13 VAL 94 3HG1 VAL 94 -4.175 1.592 -9.400
728 HG21 VAL 94 3HG2 VAL 94 -4.911 1.782 -11.809
729 HG22 VAL 94 1HG2 VAL 94 -3.846 0.447 -12.279
730 HG23 VAL 94 2HG2 VAL 94 -5.587 0.373 -12.642
731 H THR 95 H THR 95 -4.160 -1.986 -12.984
732 HA THR 95 HA THR 95 -1.638 -3.167 -11.898
733 HB THR 95 HB THR 95 -1.682 -4.787 -13.716
734 HG1 THR 95 1HG THR 95 -3.580 -5.004 -14.940
735 HG21 THR 95 1HG2 THR 95 -4.338 -4.859 -12.209
736 HG22 THR 95 2HG2 THR 95 -3.429 -6.236 -12.871
737 HG23 THR 95 3HG2 THR 95 -2.782 -5.319 -11.500
738 H GLY 96 H GLY 96 0.223 -3.091 -13.236
739 HA2 GLY 96 2HA GLY 96 0.527 -1.573 -15.606
740 HA3 GLY 96 3HA GLY 96 0.774 -0.498 -14.225
741 H LYS 97 H LYS 97 2.758 -1.261 -16.185
742 HA LYS 97 HA LYS 97 4.623 -3.116 -14.783
743 HB2 LYS 97 2HB LYS 97 4.725 -1.866 -17.553
744 HB3 LYS 97 3HB LYS 97 5.965 -2.931 -16.871
745 HG2 LYS 97 2HG LYS 97 4.251 -4.724 -16.576
746 HG3 LYS 97 3HG LYS 97 3.051 -3.700 -17.370
747 HD2 LYS 97 2HD LYS 97 5.643 -4.689 -18.640
748 HD3 LYS 97 3HD LYS 97 4.044 -5.408 -18.872
749 HE2 LYS 97 2HE LYS 97 3.214 -3.256 -19.823
750 HE3 LYS 97 3HE LYS 97 4.832 -2.563 -19.644
751 HZ1 LYS 97 3HZ LYS 97 4.165 -4.909 -21.341
752 HZ2 LYS 97 1HZ LYS 97 4.480 -3.407 -21.891
753 HZ3 LYS 97 2HZ LYS 97 5.662 -4.272 -21.173
754 H GLY 98 H GLY 98 6.465 -2.516 -13.813
755 HA2 GLY 98 2HA GLY 98 6.846 0.189 -12.950
756 HA3 GLY 98 3HA GLY 98 7.970 -1.147 -12.706
757 H GLN 99 H GLN 99 7.997 1.824 -13.746
758 HA GLN 99 HA GLN 99 9.552 1.465 -16.268
759 HB2 GLN 99 2HB GLN 99 8.448 3.978 -14.965
760 HB3 GLN 99 3HB GLN 99 9.221 3.873 -16.545
761 HG2 GLN 99 2HG GLN 99 6.554 2.635 -15.737
762 HG3 GLN 99 3HG GLN 99 6.795 4.018 -16.788
763 HE21 GLN 99 2HE2 GLN 99 6.082 0.764 -16.869
764 HE22 GLN 99 1HE2 GLN 99 6.680 0.423 -18.496
765 H ASP 100 H ASP 100 9.908 2.742 -12.973
766 HA ASP 100 HA ASP 100 12.808 2.536 -13.061
767 HB2 ASP 100 2HB ASP 100 12.408 4.734 -14.168
768 HB3 ASP 100 3HB ASP 100 11.452 5.256 -12.783
769 H GLY 101 H GLY 101 13.746 2.699 -10.942
770 HA2 GLY 101 2HA GLY 101 12.263 3.504 -8.612
771 HA3 GLY 101 3HA GLY 101 12.323 1.743 -8.728
772 H ILE 102 H ILE 102 13.506 3.565 -6.745
773 HA ILE 102 HA ILE 102 16.176 2.433 -6.624
774 HB ILE 102 HB ILE 102 16.576 4.463 -7.962
775 HG12 ILE 102 2HG1 ILE 102 18.336 5.532 -6.655
776 HG13 ILE 102 3HG1 ILE 102 17.750 4.794 -5.171
777 HG21 ILE 102 1HG2 ILE 102 15.539 6.067 -5.584
778 HG22 ILE 102 2HG2 ILE 102 16.284 6.715 -7.057
779 HG23 ILE 102 3HG2 ILE 102 14.728 5.888 -7.157
780 HD11 ILE 102 3HD1 ILE 102 19.731 3.636 -6.136
781 HD12 ILE 102 1HD1 ILE 102 18.342 2.547 -6.044
782 HD13 ILE 102 2HD1 ILE 102 18.803 3.270 -7.604
783 H GLY 103 H GLY 103 17.004 2.336 -4.532
784 HA2 GLY 103 2HA GLY 103 16.464 3.706 -2.271
785 HA3 GLY 103 3HA GLY 103 15.072 2.618 -2.335
786 H SER 104 H SER 104 16.988 2.661 -0.286
787 HA SER 104 HA SER 104 18.413 1.443 0.976
788 HB2 SER 104 2HB SER 104 16.990 -0.893 -0.327
789 HB3 SER 104 3HB SER 104 17.877 -0.925 1.209
790 HG SER 104 HG SER 104 15.651 -0.639 1.552
791 H LYS 105 H LYS 105 19.514 2.025 -1.789
792 HA LYS 105 HA LYS 105 21.203 -0.278 -2.386
793 HB2 LYS 105 2HB LYS 105 20.059 1.048 -4.145
794 HB3 LYS 105 3HB LYS 105 21.053 2.444 -3.738
795 HG2 LYS 105 2HG LYS 105 21.905 1.323 -5.727
796 HG3 LYS 105 3HG LYS 105 23.091 1.207 -4.424
797 HD2 LYS 105 2HD LYS 105 22.407 -1.115 -3.969
798 HD3 LYS 105 3HD LYS 105 21.151 -1.017 -5.220
799 HE2 LYS 105 2HE LYS 105 22.823 -0.803 -6.967
800 HE3 LYS 105 3HE LYS 105 24.107 -0.550 -5.772
801 HZ1 LYS 105 3HZ LYS 105 24.185 -2.841 -6.498
802 HZ2 LYS 105 1HZ LYS 105 23.737 -2.779 -4.954
803 HZ3 LYS 105 2HZ LYS 105 22.600 -3.086 -6.111
804 H ALA 106 H ALA 106 22.175 -0.216 -0.252
805 HA ALA 106 HA ALA 106 24.346 1.754 0.131
806 HB1 ALA 106 1HB ALA 106 22.794 1.231 1.978
807 HB2 ALA 106 2HB ALA 106 23.303 -0.473 1.930
808 HB3 ALA 106 3HB ALA 106 24.462 0.792 2.389
809 H GLU 107 H GLU 107 24.115 -1.331 -1.302
810 HA GLU 107 HA GLU 107 27.073 -1.700 -1.203
811 HB2 GLU 107 2HB GLU 107 24.990 -3.889 -0.818
812 HB3 GLU 107 3HB GLU 107 26.713 -4.157 -1.106
813 HG2 GLU 107 2HG GLU 107 27.244 -2.881 0.978
814 HG3 GLU 107 3HG GLU 107 25.514 -2.729 1.305
815 H LYS 108 H LYS 108 27.985 -2.639 -3.040
816 HA LYS 108 HA LYS 108 26.768 -1.840 -5.515
817 HB2 LYS 108 2HB LYS 108 29.310 -3.406 -4.930
818 HB3 LYS 108 3HB LYS 108 28.822 -2.836 -6.530
819 HG2 LYS 108 2HG LYS 108 28.861 -0.488 -5.737
820 HG3 LYS 108 3HG LYS 108 29.304 -1.029 -4.116
821 HD2 LYS 108 2HD LYS 108 31.280 -0.233 -5.228
822 HD3 LYS 108 3HD LYS 108 31.419 -1.983 -5.001
823 HE2 LYS 108 2HE LYS 108 30.747 -2.344 -7.368
824 HE3 LYS 108 3HE LYS 108 30.556 -0.600 -7.586
825 HZ1 LYS 108 3HZ LYS 108 33.114 -1.965 -6.926
826 HZ2 LYS 108 1HZ LYS 108 32.715 -1.367 -8.390
827 HZ3 LYS 108 2HZ LYS 108 32.939 -0.353 -7.133
Start of MODEL 10
1 H1 MET 1 H1 MET 1 -2.265 -2.171 25.700
2 H2 MET 1 H2 MET 1 -1.107 -1.427 26.584
3 H3 MET 1 H3 MET 1 -1.224 -3.058 26.603
4 HA MET 1 HA MET 1 0.637 -2.363 25.247
5 HB2 MET 1 2HB MET 1 -0.464 -4.471 24.677
6 HB3 MET 1 3HB MET 1 -1.663 -3.627 23.697
7 HG2 MET 1 2HG MET 1 0.096 -4.698 22.335
8 HG3 MET 1 3HG MET 1 -0.004 -2.966 22.088
9 HE1 MET 1 1HE MET 1 2.105 -5.977 23.331
10 HE2 MET 1 2HE MET 1 3.470 -5.217 24.177
11 HE3 MET 1 3HE MET 1 1.849 -5.178 24.900
12 H ALA 2 H ALA 2 1.519 -0.812 23.999
13 HA ALA 2 HA ALA 2 -0.230 1.322 22.922
14 HB1 ALA 2 1HB ALA 2 1.601 1.876 24.477
15 HB2 ALA 2 2HB ALA 2 2.782 1.178 23.342
16 HB3 ALA 2 3HB ALA 2 1.848 2.617 22.884
17 H GLU 3 H GLU 3 1.617 -1.349 21.674
18 HA GLU 3 HA GLU 3 1.897 -0.168 18.966
19 HB2 GLU 3 2HB GLU 3 2.911 -2.785 20.135
20 HB3 GLU 3 3HB GLU 3 3.207 -2.207 18.491
21 HG2 GLU 3 2HG GLU 3 4.300 -0.156 19.437
22 HG3 GLU 3 3HG GLU 3 4.120 -0.832 21.055
23 H SER 4 H SER 4 1.392 -1.593 17.073
24 HA SER 4 HA SER 4 -0.992 -3.335 17.414
25 HB2 SER 4 2HB SER 4 -2.073 -1.295 16.993
26 HB3 SER 4 3HB SER 4 -0.872 -0.787 15.796
27 HG SER 4 HG SER 4 -3.062 -1.739 15.125
28 H SER 5 H SER 5 -1.040 -5.006 16.164
29 HA SER 5 HA SER 5 0.449 -5.136 13.581
30 HB2 SER 5 2HB SER 5 0.316 -7.324 15.694
31 HB3 SER 5 3HB SER 5 0.844 -7.569 14.023
32 HG SER 5 HG SER 5 2.049 -5.775 15.866
33 H ASP 6 H ASP 6 -2.335 -4.536 14.518
34 HA ASP 6 HA ASP 6 -3.711 -7.010 14.019
35 HB2 ASP 6 2HB ASP 6 -4.600 -4.383 15.259
36 HB3 ASP 6 3HB ASP 6 -5.588 -5.844 15.207
37 H LYS 7 H LYS 7 -2.852 -5.907 11.643
38 HA LYS 7 HA LYS 7 -5.306 -5.512 10.046
39 HB2 LYS 7 2HB LYS 7 -4.104 -3.792 8.710
40 HB3 LYS 7 3HB LYS 7 -4.561 -3.267 10.317
41 HG2 LYS 7 2HG LYS 7 -1.860 -4.495 10.117
42 HG3 LYS 7 3HG LYS 7 -2.057 -2.989 9.205
43 HD2 LYS 7 2HD LYS 7 -2.745 -1.813 11.205
44 HD3 LYS 7 3HD LYS 7 -2.776 -3.301 12.148
45 HE2 LYS 7 2HE LYS 7 -0.377 -3.586 11.965
46 HE3 LYS 7 3HE LYS 7 -0.256 -2.297 10.760
47 HZ1 LYS 7 3HZ LYS 7 0.379 -1.615 13.056
48 HZ2 LYS 7 1HZ LYS 7 -0.790 -0.682 12.368
49 HZ3 LYS 7 2HZ LYS 7 -1.182 -1.795 13.530
50 H LEU 8 H LEU 8 -4.618 -5.666 7.671
51 HA LEU 8 HA LEU 8 -2.664 -7.910 7.255
52 HB2 LEU 8 2HB LEU 8 -4.993 -6.953 5.530
53 HB3 LEU 8 3HB LEU 8 -3.997 -8.369 5.221
54 HG LEU 8 HG LEU 8 -5.926 -8.064 7.572
55 HD11 LEU 8 1HD1 LEU 8 -7.354 -9.584 6.279
56 HD12 LEU 8 2HD1 LEU 8 -7.040 -8.076 5.392
57 HD13 LEU 8 3HD1 LEU 8 -6.179 -9.561 4.938
58 HD21 LEU 8 3HD2 LEU 8 -4.083 -9.622 8.057
59 HD22 LEU 8 1HD2 LEU 8 -5.600 -10.504 7.810
60 HD23 LEU 8 2HD2 LEU 8 -4.374 -10.469 6.520
61 H TYR 9 H TYR 9 -3.405 -4.574 6.578
62 HA TYR 9 HA TYR 9 -1.520 -4.519 4.287
63 HB2 TYR 9 2HB TYR 9 -4.285 -3.292 4.342
64 HB3 TYR 9 3HB TYR 9 -3.164 -3.305 2.983
65 HD1 TYR 9 HD2 TYR 9 -2.353 -6.127 2.817
66 HD2 TYR 9 HD1 TYR 9 -6.195 -4.401 3.668
67 HE1 TYR 9 HE2 TYR 9 -3.458 -8.225 2.037
68 HE2 TYR 9 HE1 TYR 9 -7.307 -6.491 2.910
69 HH TYR 9 HH TYR 9 -7.012 -8.513 1.889
70 H ARG 10 H ARG 10 -0.686 -2.532 3.804
71 HA ARG 10 HA ARG 10 -0.955 -0.316 5.760
72 HB2 ARG 10 2HB ARG 10 0.815 -1.622 6.665
73 HB3 ARG 10 3HB ARG 10 1.481 -1.974 5.092
74 HG2 ARG 10 2HG ARG 10 2.964 -0.518 6.264
75 HG3 ARG 10 3HG ARG 10 2.311 0.354 4.883
76 HD2 ARG 10 2HD ARG 10 1.002 1.760 6.198
77 HD3 ARG 10 3HD ARG 10 0.954 0.644 7.566
78 HE ARG 10 HE ARG 10 3.423 1.191 7.869
79 HH11 ARG 10 1HH2 ARG 10 1.374 3.664 6.394
80 HH12 ARG 10 2HH2 ARG 10 2.059 4.919 7.402
81 HH21 ARG 10 1HH1 ARG 10 4.391 2.941 8.901
82 HH22 ARG 10 2HH1 ARG 10 3.775 4.543 8.588
83 H VAL 11 H VAL 11 -0.572 1.706 4.861
84 HA VAL 11 HA VAL 11 0.654 1.917 2.156
85 HB VAL 11 HB VAL 11 -1.863 1.858 2.044
86 HG11 VAL 11 1HG1 VAL 11 -1.725 4.657 3.232
87 HG12 VAL 11 2HG1 VAL 11 -3.166 3.792 2.656
88 HG13 VAL 11 3HG1 VAL 11 -2.289 3.237 4.098
89 HG21 VAL 11 3HG2 VAL 11 -0.443 2.945 0.250
90 HG22 VAL 11 1HG2 VAL 11 -2.052 3.654 0.404
91 HG23 VAL 11 2HG2 VAL 11 -0.632 4.487 1.077
92 H GLU 12 H GLU 12 1.785 3.873 1.796
93 HA GLU 12 HA GLU 12 1.355 6.089 3.604
94 HB2 GLU 12 2HB GLU 12 3.508 6.465 4.434
95 HB3 GLU 12 3HB GLU 12 3.115 4.802 4.866
96 HG2 GLU 12 2HG GLU 12 4.601 3.914 3.222
97 HG3 GLU 12 3HG GLU 12 4.833 5.476 2.451
98 H TYR 13 H TYR 13 2.286 8.077 2.892
99 HA TYR 13 HA TYR 13 3.391 8.246 0.153
100 HB2 TYR 13 2HB TYR 13 2.769 10.214 2.349
101 HB3 TYR 13 3HB TYR 13 4.043 10.592 1.206
102 HD1 TYR 13 HD2 TYR 13 0.521 9.197 1.013
103 HD2 TYR 13 HD1 TYR 13 3.468 11.912 -0.592
104 HE1 TYR 13 HE2 TYR 13 -1.140 10.028 -0.661
105 HE2 TYR 13 HE1 TYR 13 1.809 12.736 -2.247
106 HH TYR 13 HH TYR 13 -0.320 12.558 -3.046
107 H ALA 14 H ALA 14 5.442 7.878 -0.263
108 HA ALA 14 HA ALA 14 7.069 6.544 1.611
109 HB1 ALA 14 1HB ALA 14 7.569 7.583 -1.204
110 HB2 ALA 14 2HB ALA 14 8.637 6.455 -0.352
111 HB3 ALA 14 3HB ALA 14 6.969 5.981 -0.748
112 H LYS 15 H LYS 15 8.429 7.263 3.094
113 HA LYS 15 HA LYS 15 9.156 10.059 3.336
114 HB2 LYS 15 2HB LYS 15 10.200 7.697 4.951
115 HB3 LYS 15 3HB LYS 15 10.208 9.395 5.418
116 HG2 LYS 15 2HG LYS 15 7.790 7.583 5.117
117 HG3 LYS 15 3HG LYS 15 8.466 8.229 6.611
118 HD2 LYS 15 2HD LYS 15 7.902 10.543 5.848
119 HD3 LYS 15 3HD LYS 15 7.131 9.872 4.402
120 HE2 LYS 15 2HE LYS 15 6.315 9.277 7.276
121 HE3 LYS 15 3HE LYS 15 5.526 10.433 6.194
122 HZ1 LYS 15 3HZ LYS 15 4.318 8.381 6.130
123 HZ2 LYS 15 1HZ LYS 15 5.083 8.537 4.675
124 HZ3 LYS 15 2HZ LYS 15 5.647 7.483 5.785
125 H SER 16 H SER 16 10.975 7.199 2.401
126 HA SER 16 HA SER 16 13.243 8.723 1.348
127 HB2 SER 16 2HB SER 16 13.673 8.491 3.820
128 HB3 SER 16 3HB SER 16 13.736 6.735 3.593
129 HG SER 16 HG SER 16 15.745 8.170 3.446
130 H GLY 17 H GLY 17 14.577 7.377 -0.011
131 HA2 GLY 17 2HA GLY 17 13.014 5.399 -1.438
132 HA3 GLY 17 3HA GLY 17 14.602 6.018 -1.882
133 H ARG 18 H ARG 18 13.567 4.231 1.039
134 HA ARG 18 HA ARG 18 15.853 2.335 0.633
135 HB2 ARG 18 2HB ARG 18 14.480 2.926 3.264
136 HB3 ARG 18 3HB ARG 18 16.076 2.232 2.992
137 HG2 ARG 18 2HG ARG 18 15.213 5.107 2.536
138 HG3 ARG 18 3HG ARG 18 16.248 4.522 3.826
139 HD2 ARG 18 2HD ARG 18 18.075 4.129 2.369
140 HD3 ARG 18 3HD ARG 18 17.065 4.216 0.914
141 HE ARG 18 HE ARG 18 16.727 6.691 2.105
142 HH11 ARG 18 1HH2 ARG 18 19.510 4.989 0.816
143 HH12 ARG 18 2HH2 ARG 18 20.322 6.469 0.382
144 HH21 ARG 18 1HH1 ARG 18 17.809 8.516 1.549
145 HH22 ARG 18 2HH1 ARG 18 19.374 8.424 0.793
146 H ALA 19 H ALA 19 12.452 2.250 0.638
147 HA ALA 19 HA ALA 19 12.245 -0.539 1.562
148 HB1 ALA 19 1HB ALA 19 10.143 1.304 0.367
149 HB2 ALA 19 2HB ALA 19 9.862 -0.260 1.150
150 HB3 ALA 19 3HB ALA 19 10.469 1.102 2.107
151 H SER 20 H SER 20 11.891 -2.311 0.255
152 HA SER 20 HA SER 20 12.486 -1.959 -2.664
153 HB2 SER 20 2HB SER 20 13.192 -4.289 -0.859
154 HB3 SER 20 3HB SER 20 13.520 -4.163 -2.598
155 HG SER 20 HG SER 20 15.337 -3.563 -1.303
156 H CYS 21 HN CYS 21 11.306 -3.072 -4.165
157 HA CYS 21 HA CYS 21 8.607 -3.750 -3.401
158 HB2 CYS 21 2HB CYS 21 9.305 -2.613 -5.478
159 HB3 CYS 21 3HB CYS 21 10.039 -4.120 -6.046
160 H LYS 22 H LYS 22 7.592 -5.609 -3.263
161 HA LYS 22 HA LYS 22 9.181 -8.126 -3.075
162 HB2 LYS 22 2HB LYS 22 6.542 -7.277 -1.828
163 HB3 LYS 22 3HB LYS 22 7.322 -8.826 -1.518
164 HG2 LYS 22 2HG LYS 22 8.711 -6.180 -0.995
165 HG3 LYS 22 3HG LYS 22 7.560 -6.845 0.140
166 HD2 LYS 22 2HD LYS 22 8.908 -8.905 0.343
167 HD3 LYS 22 3HD LYS 22 10.033 -8.294 -0.906
168 HE2 LYS 22 2HE LYS 22 10.575 -6.362 0.553
169 HE3 LYS 22 3HE LYS 22 9.444 -6.963 1.776
170 HZ1 LYS 22 3HZ LYS 22 10.833 -8.951 2.001
171 HZ2 LYS 22 1HZ LYS 22 11.884 -8.403 0.875
172 HZ3 LYS 22 2HZ LYS 22 11.729 -7.618 2.298
173 H LYS 23 H LYS 23 7.394 -6.776 -5.347
174 HA LYS 23 HA LYS 23 6.356 -9.382 -6.439
175 HB2 LYS 23 2HB LYS 23 4.495 -7.980 -5.816
176 HB3 LYS 23 3HB LYS 23 5.183 -6.600 -6.673
177 HG2 LYS 23 2HG LYS 23 3.291 -7.577 -7.842
178 HG3 LYS 23 3HG LYS 23 4.758 -7.635 -8.819
179 HD2 LYS 23 2HD LYS 23 5.025 -10.031 -8.382
180 HD3 LYS 23 3HD LYS 23 3.696 -10.007 -7.212
181 HE2 LYS 23 2HE LYS 23 2.117 -9.362 -8.996
182 HE3 LYS 23 3HE LYS 23 3.440 -9.323 -10.172
183 HZ1 LYS 23 3HZ LYS 23 3.753 -11.710 -9.808
184 HZ2 LYS 23 1HZ LYS 23 2.548 -11.753 -8.704
185 HZ3 LYS 23 2HZ LYS 23 2.213 -11.424 -10.266
186 H CYS 24 HN CYS 24 7.628 -6.153 -7.468
187 HA CYS 24 HA CYS 24 8.624 -7.510 -9.919
188 HB2 CYS 24 2HB CYS 24 8.280 -5.695 -11.157
189 HB3 CYS 24 3HB CYS 24 6.899 -5.663 -10.092
190 H SER 25 H SER 25 9.799 -6.686 -7.016
191 HA SER 25 HA SER 25 11.821 -6.711 -6.082
192 HB2 SER 25 2HB SER 25 12.736 -7.989 -8.663
193 HB3 SER 25 3HB SER 25 13.548 -8.075 -7.090
194 HG SER 25 HG SER 25 12.225 -9.913 -7.493
195 H GLU 26 H GLU 26 11.263 -4.302 -7.912
196 HA GLU 26 HA GLU 26 14.008 -3.145 -8.080
197 HB2 GLU 26 2HB GLU 26 11.278 -2.044 -8.830
198 HB3 GLU 26 3HB GLU 26 12.797 -1.177 -9.037
199 HG2 GLU 26 2HG GLU 26 12.106 -3.814 -10.390
200 HG3 GLU 26 3HG GLU 26 11.923 -2.224 -11.112
201 H SER 27 H SER 27 13.380 -0.469 -7.301
202 HA SER 27 HA SER 27 12.799 -0.759 -4.388
203 HB2 SER 27 2HB SER 27 15.176 -0.441 -4.944
204 HB3 SER 27 3HB SER 27 14.752 1.162 -5.627
205 HG SER 27 HG SER 27 15.449 1.098 -3.361
206 H ILE 28 H ILE 28 11.996 1.096 -3.336
207 HA ILE 28 HA ILE 28 9.909 2.287 -5.070
208 HB ILE 28 HB ILE 28 9.791 1.717 -2.096
209 HG12 ILE 28 2HG1 ILE 28 8.434 0.031 -4.235
210 HG13 ILE 28 3HG1 ILE 28 10.007 -0.404 -3.579
211 HG21 ILE 28 1HG2 ILE 28 7.655 2.422 -4.175
212 HG22 ILE 28 2HG2 ILE 28 7.331 1.977 -2.506
213 HG23 ILE 28 3HG2 ILE 28 8.211 3.473 -2.868
214 HD11 ILE 28 3HD1 ILE 28 7.470 -0.151 -1.937
215 HD12 ILE 28 1HD1 ILE 28 8.324 -1.630 -2.401
216 HD13 ILE 28 2HD1 ILE 28 9.093 -0.485 -1.298
217 HA PRO 29 HA PRO 29 12.278 5.968 -3.948
218 HB2 PRO 29 2HB PRO 29 11.186 7.795 -5.680
219 HB3 PRO 29 3HB PRO 29 12.308 6.501 -6.186
220 HG2 PRO 29 2HG PRO 29 9.274 6.479 -6.286
221 HG3 PRO 29 3HG PRO 29 10.427 6.048 -7.593
222 HD2 PRO 29 2HD PRO 29 9.274 4.157 -6.024
223 HD3 PRO 29 3HD PRO 29 10.976 3.999 -6.555
224 H LYS 30 H LYS 30 12.027 8.017 -2.967
225 HA LYS 30 HA LYS 30 9.748 8.329 -1.187
226 HB2 LYS 30 2HB LYS 30 10.924 10.198 -0.260
227 HB3 LYS 30 3HB LYS 30 12.013 8.829 -0.478
228 HG2 LYS 30 2HG LYS 30 12.893 9.878 -2.565
229 HG3 LYS 30 3HG LYS 30 11.880 11.292 -2.262
230 HD2 LYS 30 2HD LYS 30 14.098 10.227 -0.462
231 HD3 LYS 30 3HD LYS 30 14.242 11.608 -1.537
232 HE2 LYS 30 2HE LYS 30 12.308 11.459 0.826
233 HE3 LYS 30 3HE LYS 30 13.919 12.167 0.895
234 HZ1 LYS 30 3HZ LYS 30 13.214 13.759 -0.831
235 HZ2 LYS 30 1HZ LYS 30 11.692 13.147 -0.826
236 HZ3 LYS 30 2HZ LYS 30 12.283 13.878 0.503
237 H ASP 31 H ASP 31 8.587 10.349 -0.916
238 HA ASP 31 HA ASP 31 6.911 11.680 -1.639
239 HB2 ASP 31 2HB ASP 31 8.914 12.583 -3.731
240 HB3 ASP 31 3HB ASP 31 7.423 13.417 -3.309
241 H SER 32 H SER 32 6.827 9.037 -2.533
242 HA SER 32 HA SER 32 4.828 9.249 -4.714
243 HB2 SER 32 2HB SER 32 7.029 8.361 -5.610
244 HB3 SER 32 3HB SER 32 6.840 6.976 -4.516
245 HG SER 32 HG SER 32 5.988 6.641 -6.674
246 H LEU 33 H LEU 33 3.631 6.912 -4.684
247 HA LEU 33 HA LEU 33 2.752 6.576 -1.856
248 HB2 LEU 33 2HB LEU 33 1.115 7.450 -3.566
249 HB3 LEU 33 3HB LEU 33 1.286 5.921 -4.432
250 HG LEU 33 HG LEU 33 0.506 4.752 -2.309
251 HD11 LEU 33 1HD1 LEU 33 -0.285 7.598 -1.525
252 HD12 LEU 33 2HD1 LEU 33 -0.812 6.115 -0.703
253 HD13 LEU 33 3HD1 LEU 33 0.888 6.587 -0.669
254 HD21 LEU 33 3HD2 LEU 33 -0.976 5.199 -4.245
255 HD22 LEU 33 1HD2 LEU 33 -1.852 5.243 -2.708
256 HD23 LEU 33 2HD2 LEU 33 -1.424 6.767 -3.523
257 H ARG 34 H ARG 34 2.899 4.629 -0.863
258 HA ARG 34 HA ARG 34 3.618 2.199 -2.419
259 HB2 ARG 34 2HB ARG 34 5.423 1.634 -0.925
260 HB3 ARG 34 3HB ARG 34 5.723 3.188 -1.720
261 HG2 ARG 34 2HG ARG 34 5.355 4.429 0.278
262 HG3 ARG 34 3HG ARG 34 4.606 3.050 1.079
263 HD2 ARG 34 2HD ARG 34 6.745 3.261 2.040
264 HD3 ARG 34 3HD ARG 34 6.787 1.836 1.027
265 HE ARG 34 HE ARG 34 7.961 3.259 -0.706
266 HH11 ARG 34 1HH2 ARG 34 8.260 4.348 2.656
267 HH12 ARG 34 2HH2 ARG 34 9.975 4.611 2.453
268 HH21 ARG 34 1HH1 ARG 34 10.130 3.948 -0.883
269 HH22 ARG 34 2HH1 ARG 34 10.864 4.659 0.515
270 H MET 35 H MET 35 3.153 0.243 -1.424
271 HA MET 35 HA MET 35 1.311 0.318 0.898
272 HB2 MET 35 2HB MET 35 0.778 -0.993 -1.794
273 HB3 MET 35 3HB MET 35 -0.025 -1.503 -0.296
274 HG2 MET 35 2HG MET 35 -0.794 0.826 0.059
275 HG3 MET 35 3HG MET 35 -0.124 1.270 -1.515
276 HE1 MET 35 3HE MET 35 -3.962 -1.134 -0.601
277 HE2 MET 35 1HE MET 35 -2.386 -1.911 -0.310
278 HE3 MET 35 2HE MET 35 -2.820 -0.421 0.568
279 H ALA 36 H ALA 36 1.173 -1.622 2.088
280 HA ALA 36 HA ALA 36 3.333 -3.584 1.649
281 HB1 ALA 36 1HB ALA 36 4.630 -2.503 3.150
282 HB2 ALA 36 2HB ALA 36 3.298 -1.530 3.772
283 HB3 ALA 36 3HB ALA 36 3.556 -3.184 4.367
284 H ILE 37 H ILE 37 3.193 -5.455 3.133
285 HA ILE 37 HA ILE 37 0.394 -6.052 3.999
286 HB ILE 37 HB ILE 37 2.131 -7.402 2.015
287 HG12 ILE 37 2HG1 ILE 37 -0.850 -7.703 2.520
288 HG13 ILE 37 3HG1 ILE 37 -0.191 -6.227 1.821
289 HG21 ILE 37 1HG2 ILE 37 1.313 -9.654 2.426
290 HG22 ILE 37 2HG2 ILE 37 2.334 -9.090 3.746
291 HG23 ILE 37 3HG2 ILE 37 0.565 -9.126 3.964
292 HD11 ILE 37 3HD1 ILE 37 0.807 -7.488 -0.035
293 HD12 ILE 37 1HD1 ILE 37 0.113 -8.992 0.609
294 HD13 ILE 37 2HD1 ILE 37 -0.953 -7.681 0.045
295 H MET 38 H MET 38 0.093 -7.237 5.787
296 HA MET 38 HA MET 38 2.387 -7.193 7.610
297 HB2 MET 38 2HB MET 38 -0.550 -7.747 8.144
298 HB3 MET 38 3HB MET 38 0.665 -7.369 9.365
299 HG2 MET 38 2HG MET 38 0.073 -5.354 7.179
300 HG3 MET 38 3HG MET 38 -1.048 -5.584 8.485
301 HE1 MET 38 3HE MET 38 2.958 -5.777 9.007
302 HE2 MET 38 1HE MET 38 2.525 -4.918 7.508
303 HE3 MET 38 2HE MET 38 3.255 -4.028 8.882
304 H VAL 39 H VAL 39 3.692 -8.845 7.435
305 HA VAL 39 HA VAL 39 2.639 -11.616 7.264
306 HB VAL 39 HB VAL 39 5.573 -10.917 7.417
307 HG11 VAL 39 1HG1 VAL 39 4.035 -13.132 6.023
308 HG12 VAL 39 2HG1 VAL 39 5.801 -12.920 6.035
309 HG13 VAL 39 3HG1 VAL 39 4.959 -13.275 7.543
310 HG21 VAL 39 3HG2 VAL 39 5.579 -10.855 4.908
311 HG22 VAL 39 1HG2 VAL 39 3.813 -10.675 4.957
312 HG23 VAL 39 2HG2 VAL 39 4.878 -9.435 5.688
313 H GLN 40 H GLN 40 2.606 -13.028 8.980
314 HA GLN 40 HA GLN 40 3.298 -12.176 11.660
315 HB2 GLN 40 2HB GLN 40 2.991 -14.677 12.154
316 HB3 GLN 40 3HB GLN 40 1.597 -13.733 11.640
317 HG2 GLN 40 2HG GLN 40 1.650 -14.634 9.412
318 HG3 GLN 40 3HG GLN 40 3.210 -15.420 9.687
319 HE21 GLN 40 2HE2 GLN 40 3.261 -17.286 11.242
320 HE22 GLN 40 1HE2 GLN 40 1.771 -18.184 11.501
321 H SER 41 H SER 41 5.252 -11.976 12.522
322 HA SER 41 HA SER 41 7.433 -12.571 10.783
323 HB2 SER 41 2HB SER 41 7.085 -10.427 12.120
324 HB3 SER 41 3HB SER 41 7.662 -11.343 13.531
325 HG SER 41 HG SER 41 9.034 -10.639 11.182
326 HA PRO 42 HA PRO 42 9.434 -15.722 13.233
327 HB2 PRO 42 2HB PRO 42 11.681 -16.125 11.743
328 HB3 PRO 42 3HB PRO 42 10.066 -16.670 11.195
329 HG2 PRO 42 2HG PRO 42 11.531 -14.126 10.439
330 HG3 PRO 42 3HG PRO 42 10.721 -15.297 9.351
331 HD2 PRO 42 2HD PRO 42 9.517 -12.977 10.268
332 HD3 PRO 42 3HD PRO 42 8.590 -14.456 9.892
333 H MET 43 H MET 43 10.368 -12.447 12.721
334 HA MET 43 HA MET 43 12.628 -12.673 14.663
335 HB2 MET 43 2HB MET 43 13.806 -11.025 13.603
336 HB3 MET 43 3HB MET 43 13.208 -12.115 12.364
337 HG2 MET 43 2HG MET 43 11.260 -10.268 12.223
338 HG3 MET 43 3HG MET 43 12.485 -9.252 12.957
339 HE1 MET 43 3HE MET 43 12.817 -12.217 10.332
340 HE2 MET 43 1HE MET 43 11.302 -11.367 9.992
341 HE3 MET 43 2HE MET 43 12.640 -11.305 8.815
342 H PHE 44 H PHE 44 9.604 -11.070 14.087
343 HA PHE 44 HA PHE 44 10.078 -9.105 16.287
344 HB2 PHE 44 2HB PHE 44 9.849 -8.082 14.107
345 HB3 PHE 44 3HB PHE 44 8.379 -8.984 13.788
346 HD1 PHE 44 HD1 PHE 44 9.736 -6.577 16.367
347 HD2 PHE 44 HD2 PHE 44 6.348 -7.879 14.036
348 HE1 PHE 44 HE1 PHE 44 8.352 -4.761 17.350
349 HE2 PHE 44 HE2 PHE 44 4.972 -6.058 15.013
350 HZ PHE 44 HZ PHE 44 5.971 -4.504 16.681
351 H ASP 45 H ASP 45 8.235 -8.462 17.523
352 HA ASP 45 HA ASP 45 6.809 -10.808 18.584
353 HB2 ASP 45 2HB ASP 45 7.132 -7.981 19.646
354 HB3 ASP 45 3HB ASP 45 6.308 -9.293 20.492
355 H GLY 46 H GLY 46 5.803 -10.213 16.137
356 HA2 GLY 46 2HA GLY 46 3.030 -10.001 16.233
357 HA3 GLY 46 3HA GLY 46 3.607 -8.331 16.130
358 H LYS 47 H LYS 47 3.037 -7.823 14.058
359 HA LYS 47 HA LYS 47 4.046 -9.602 11.886
360 HB2 LYS 47 2HB LYS 47 1.562 -7.883 11.686
361 HB3 LYS 47 3HB LYS 47 2.187 -9.048 10.514
362 HG2 LYS 47 2HG LYS 47 1.973 -10.659 12.733
363 HG3 LYS 47 3HG LYS 47 0.681 -9.520 13.064
364 HD2 LYS 47 2HD LYS 47 1.033 -11.326 10.663
365 HD3 LYS 47 3HD LYS 47 -0.166 -11.490 11.939
366 HE2 LYS 47 2HE LYS 47 -0.014 -9.209 9.923
367 HE3 LYS 47 3HE LYS 47 -1.014 -10.641 9.729
368 HZ1 LYS 47 3HZ LYS 47 -2.263 -9.995 11.706
369 HZ2 LYS 47 1HZ LYS 47 -1.314 -8.679 11.964
370 HZ3 LYS 47 2HZ LYS 47 -2.254 -8.740 10.644
371 H VAL 48 H VAL 48 4.897 -8.820 10.057
372 HA VAL 48 HA VAL 48 6.143 -6.120 10.312
373 HB VAL 48 HB VAL 48 8.002 -7.179 8.923
374 HG11 VAL 48 1HG1 VAL 48 8.215 -6.599 11.325
375 HG12 VAL 48 2HG1 VAL 48 7.495 -8.153 11.777
376 HG13 VAL 48 3HG1 VAL 48 9.078 -8.103 10.972
377 HG21 VAL 48 3HG2 VAL 48 6.839 -9.799 9.911
378 HG22 VAL 48 1HG2 VAL 48 6.880 -9.240 8.224
379 HG23 VAL 48 2HG2 VAL 48 8.389 -9.546 9.088
380 HA PRO 49 HA PRO 49 4.420 -5.219 6.355
381 HB2 PRO 49 2HB PRO 49 5.670 -2.883 5.700
382 HB3 PRO 49 3HB PRO 49 4.509 -3.015 7.054
383 HG2 PRO 49 2HG PRO 49 7.539 -3.102 7.171
384 HG3 PRO 49 3HG PRO 49 6.416 -2.160 8.199
385 HD2 PRO 49 2HD PRO 49 7.473 -4.575 8.971
386 HD3 PRO 49 3HD PRO 49 5.837 -4.043 9.461
387 H HIS 50 H HIS 50 4.750 -6.242 4.472
388 HA HIS 50 HA HIS 50 7.453 -6.195 3.160
389 HB2 HIS 50 2HB HIS 50 5.009 -7.963 2.902
390 HB3 HIS 50 3HB HIS 50 6.117 -7.793 1.550
391 HD2 HIS 50 HD2 HIS 50 7.086 -8.041 5.280
392 HE1 HIS 50 HE1 HIS 50 8.881 -11.355 3.278
393 HE2 HIS 50 HE2 HIS 50 8.711 -10.127 5.508
394 H TRP 51 H TRP 51 7.742 -4.313 2.111
395 HA TRP 51 HA TRP 51 5.465 -2.772 1.169
396 HB2 TRP 51 2HB TRP 51 8.456 -2.311 1.012
397 HB3 TRP 51 3HB TRP 51 7.237 -1.177 0.449
398 HD1 TRP 51 HD1 TRP 51 9.051 -2.200 3.538
399 HE1 TRP 51 HE1 TRP 51 8.309 -0.757 5.524
400 HE3 TRP 51 HE3 TRP 51 4.906 -0.018 1.455
401 HZ2 TRP 51 HZ2 TRP 51 6.220 1.139 6.123
402 HZ3 TRP 51 HZ3 TRP 51 3.535 1.589 2.783
403 HH2 TRP 51 HH2 TRP 51 4.212 2.202 5.084
404 H TYR 52 H TYR 52 4.976 -2.151 -0.886
405 HA TYR 52 HA TYR 52 6.569 -3.050 -3.182
406 HB2 TYR 52 2HB TYR 52 3.602 -3.335 -3.432
407 HB3 TYR 52 3HB TYR 52 4.941 -4.060 -4.333
408 HD1 TYR 52 HD1 TYR 52 3.450 -4.345 -0.841
409 HD2 TYR 52 HD2 TYR 52 5.021 -6.273 -4.351
410 HE1 TYR 52 HE1 TYR 52 2.932 -6.578 0.147
411 HE2 TYR 52 HE2 TYR 52 4.444 -8.502 -3.389
412 HH TYR 52 HH TYR 52 2.976 -8.851 -0.150
413 H HIS 53 H HIS 53 5.900 -1.834 -5.144
414 HA HIS 53 HA HIS 53 5.226 0.959 -4.811
415 HB2 HIS 53 2HB HIS 53 4.823 -0.793 -7.271
416 HB3 HIS 53 3HB HIS 53 4.894 0.953 -7.235
417 HD2 HIS 53 HD2 HIS 53 7.297 2.066 -6.420
418 HE1 HIS 53 HE1 HIS 53 9.703 -1.191 -7.713
419 HE2 HIS 53 HE2 HIS 53 9.749 1.205 -6.929
420 H PHE 54 H PHE 54 3.154 2.041 -5.299
421 HA PHE 54 HA PHE 54 0.909 0.949 -4.068
422 HB2 PHE 54 2HB PHE 54 0.854 3.256 -4.430
423 HB3 PHE 54 3HB PHE 54 1.232 3.112 -6.143
424 HD1 PHE 54 HD2 PHE 54 -1.510 2.259 -3.671
425 HD2 PHE 54 HD1 PHE 54 -0.481 3.195 -7.758
426 HE1 PHE 54 HE2 PHE 54 -3.908 2.176 -4.304
427 HE2 PHE 54 HE1 PHE 54 -2.886 3.137 -8.369
428 HZ PHE 54 HZ PHE 54 -4.596 2.598 -6.653
429 H SER 55 H SER 55 1.722 0.667 -7.587
430 HA SER 55 HA SER 55 -0.810 -0.598 -8.239
431 HB2 SER 55 2HB SER 55 0.186 -0.869 -10.468
432 HB3 SER 55 3HB SER 55 0.280 0.792 -9.861
433 HG SER 55 HG SER 55 2.300 0.515 -10.484
434 H CYS 56 HN CYS 56 2.472 -1.722 -7.483
435 HA CYS 56 HA CYS 56 2.254 -4.353 -8.343
436 HB2 CYS 56 2HB CYS 56 3.921 -3.022 -6.199
437 HB3 CYS 56 3HB CYS 56 4.137 -4.709 -6.671
438 H PHE 57 H PHE 57 1.227 -2.988 -5.234
439 HA PHE 57 HA PHE 57 0.531 -5.301 -3.757
440 HB2 PHE 57 2HB PHE 57 0.399 -2.992 -2.943
441 HB3 PHE 57 3HB PHE 57 -0.964 -2.668 -4.011
442 HD1 PHE 57 HD2 PHE 57 -3.123 -4.043 -3.707
443 HD2 PHE 57 HD1 PHE 57 0.050 -3.969 -0.783
444 HE1 PHE 57 HE2 PHE 57 -4.669 -4.958 -2.013
445 HE2 PHE 57 HE1 PHE 57 -1.547 -4.760 0.945
446 HZ PHE 57 HZ PHE 57 -3.893 -5.308 0.321
447 H TRP 58 H TRP 58 -1.445 -3.558 -6.204
448 HA TRP 58 HA TRP 58 -3.533 -5.560 -6.206
449 HB2 TRP 58 2HB TRP 58 -3.105 -3.396 -8.258
450 HB3 TRP 58 3HB TRP 58 -4.603 -4.189 -7.804
451 HD1 TRP 58 HD1 TRP 58 -2.403 -1.311 -7.031
452 HE1 TRP 58 HE1 TRP 58 -3.222 0.097 -5.080
453 HE3 TRP 58 HE3 TRP 58 -6.147 -4.396 -5.322
454 HZ2 TRP 58 HZ2 TRP 58 -5.356 -0.011 -3.100
455 HZ3 TRP 58 HZ3 TRP 58 -7.534 -3.700 -3.405
456 HH2 TRP 58 HH2 TRP 58 -7.142 -1.496 -2.308
457 H LYS 59 H LYS 59 -0.507 -5.392 -7.891
458 HA LYS 59 HA LYS 59 -1.239 -7.309 -10.004
459 HB2 LYS 59 2HB LYS 59 1.477 -6.454 -8.968
460 HB3 LYS 59 3HB LYS 59 1.210 -7.532 -10.336
461 HG2 LYS 59 2HG LYS 59 0.136 -5.808 -11.634
462 HG3 LYS 59 3HG LYS 59 0.051 -4.739 -10.241
463 HD2 LYS 59 2HD LYS 59 2.763 -5.156 -10.321
464 HD3 LYS 59 3HD LYS 59 2.381 -5.324 -12.041
465 HE2 LYS 59 2HE LYS 59 1.417 -3.130 -12.137
466 HE3 LYS 59 3HE LYS 59 1.226 -3.073 -10.384
467 HZ1 LYS 59 3HZ LYS 59 3.689 -3.028 -10.201
468 HZ2 LYS 59 1HZ LYS 59 3.787 -2.837 -11.849
469 HZ3 LYS 59 2HZ LYS 59 3.050 -1.707 -10.895
470 H VAL 60 H VAL 60 -0.111 -7.474 -6.637
471 HA VAL 60 HA VAL 60 0.020 -10.432 -6.682
472 HB VAL 60 HB VAL 60 -0.272 -8.626 -4.256
473 HG11 VAL 60 1HG1 VAL 60 -0.814 -11.007 -3.818
474 HG12 VAL 60 2HG1 VAL 60 0.713 -11.500 -4.573
475 HG13 VAL 60 3HG1 VAL 60 0.723 -10.562 -3.066
476 HG21 VAL 60 3HG2 VAL 60 2.262 -9.785 -5.483
477 HG22 VAL 60 1HG2 VAL 60 1.822 -8.061 -5.472
478 HG23 VAL 60 2HG2 VAL 60 2.140 -8.896 -3.954
479 H GLY 61 H GLY 61 -2.378 -7.922 -5.920
480 HA2 GLY 61 2HA GLY 61 -4.630 -8.023 -6.476
481 HA3 GLY 61 3HA GLY 61 -4.485 -9.744 -6.820
482 H HIS 62 H HIS 62 -3.563 -8.360 -3.683
483 HA HIS 62 HA HIS 62 -5.402 -10.028 -2.190
484 HB2 HIS 62 2HB HIS 62 -3.599 -7.705 -1.457
485 HB3 HIS 62 3HB HIS 62 -4.713 -8.422 -0.302
486 HD2 HIS 62 HD2 HIS 62 -1.439 -9.166 -2.125
487 HE1 HIS 62 HE1 HIS 62 -2.097 -12.424 0.547
488 HE2 HIS 62 HE2 HIS 62 -0.432 -11.357 -1.052
489 H SER 63 H SER 63 -7.345 -9.616 -1.260
490 HA SER 63 HA SER 63 -8.911 -7.404 -2.407
491 HB2 SER 63 2HB SER 63 -10.837 -8.691 -1.431
492 HB3 SER 63 3HB SER 63 -9.884 -9.551 -2.659
493 HG SER 63 HG SER 63 -10.049 -11.014 -1.070
494 H ILE 64 H ILE 64 -10.124 -5.970 -1.321
495 HA ILE 64 HA ILE 64 -9.766 -5.522 1.571
496 HB ILE 64 HB ILE 64 -9.246 -3.312 -0.421
497 HG12 ILE 64 2HG1 ILE 64 -7.151 -5.145 0.744
498 HG13 ILE 64 3HG1 ILE 64 -7.442 -4.723 -0.941
499 HG21 ILE 64 1HG2 ILE 64 -8.553 -3.620 2.534
500 HG22 ILE 64 2HG2 ILE 64 -8.314 -2.165 1.563
501 HG23 ILE 64 3HG2 ILE 64 -9.955 -2.720 1.915
502 HD11 ILE 64 3HD1 ILE 64 -5.526 -3.495 -0.370
503 HD12 ILE 64 1HD1 ILE 64 -6.815 -2.297 -0.249
504 HD13 ILE 64 2HD1 ILE 64 -6.152 -3.055 1.217
505 H ARG 65 H ARG 65 -11.593 -4.654 2.432
506 HA ARG 65 HA ARG 65 -13.831 -3.848 0.648
507 HB2 ARG 65 2HB ARG 65 -15.423 -5.292 1.562
508 HB3 ARG 65 3HB ARG 65 -14.077 -6.258 1.000
509 HG2 ARG 65 2HG ARG 65 -14.573 -5.517 3.928
510 HG3 ARG 65 3HG ARG 65 -15.140 -7.000 3.179
511 HD2 ARG 65 2HD ARG 65 -12.232 -6.201 3.222
512 HD3 ARG 65 3HD ARG 65 -12.967 -7.183 4.501
513 HE ARG 65 HE ARG 65 -13.594 -8.614 2.288
514 HH11 ARG 65 1HH2 ARG 65 -10.494 -7.352 3.416
515 HH12 ARG 65 2HH2 ARG 65 -9.623 -8.218 2.166
516 HH21 ARG 65 1HH1 ARG 65 -12.365 -9.908 0.964
517 HH22 ARG 65 2HH1 ARG 65 -10.632 -9.752 0.935
518 H HIS 66 H HIS 66 -12.234 -3.395 3.621
519 HA HIS 66 HA HIS 66 -13.778 -0.922 3.960
520 HB2 HIS 66 2HB HIS 66 -13.827 -1.067 6.384
521 HB3 HIS 66 3HB HIS 66 -14.921 -2.154 5.554
522 HD2 HIS 66 HD2 HIS 66 -12.930 -4.723 5.248
523 HE1 HIS 66 HE1 HIS 66 -13.128 -4.705 9.485
524 HE2 HIS 66 HE2 HIS 66 -12.576 -6.108 7.441
525 HA PRO 67 HA PRO 67 -9.274 -0.950 3.401
526 HB2 PRO 67 2HB PRO 67 -9.054 1.363 1.812
527 HB3 PRO 67 3HB PRO 67 -9.402 -0.269 1.182
528 HG2 PRO 67 2HG PRO 67 -11.389 1.874 1.953
529 HG3 PRO 67 3HG PRO 67 -11.327 0.918 0.429
530 HD2 PRO 67 2HD PRO 67 -12.994 0.228 2.381
531 HD3 PRO 67 3HD PRO 67 -12.019 -1.058 1.601
532 H ASP 68 H ASP 68 -11.103 1.931 4.495
533 HA ASP 68 HA ASP 68 -8.721 3.175 5.596
534 HB2 ASP 68 2HB ASP 68 -10.283 4.770 6.621
535 HB3 ASP 68 3HB ASP 68 -10.549 4.560 4.895
536 H VAL 69 H VAL 69 -10.466 0.493 6.574
537 HA VAL 69 HA VAL 69 -9.561 0.683 9.397
538 HB VAL 69 HB VAL 69 -11.301 -1.473 8.165
539 HG11 VAL 69 1HG1 VAL 69 -10.833 -0.619 11.053
540 HG12 VAL 69 2HG1 VAL 69 -11.955 -1.887 10.509
541 HG13 VAL 69 3HG1 VAL 69 -10.219 -2.100 10.281
542 HG21 VAL 69 3HG2 VAL 69 -12.191 1.064 9.597
543 HG22 VAL 69 1HG2 VAL 69 -12.549 0.600 7.915
544 HG23 VAL 69 2HG2 VAL 69 -13.237 -0.334 9.241
545 H GLU 70 H GLU 70 -9.374 -1.359 6.471
546 HA GLU 70 HA GLU 70 -7.532 -3.270 7.721
547 HB2 GLU 70 2HB GLU 70 -8.490 -2.945 4.841
548 HB3 GLU 70 3HB GLU 70 -7.559 -4.319 5.449
549 HG2 GLU 70 2HG GLU 70 -9.366 -5.007 6.904
550 HG3 GLU 70 3HG GLU 70 -10.319 -3.588 6.466
551 H VAL 71 H VAL 71 -7.124 -0.566 5.494
552 HA VAL 71 HA VAL 71 -4.201 -1.089 5.120
553 HB VAL 71 HB VAL 71 -5.867 1.088 3.868
554 HG11 VAL 71 1HG1 VAL 71 -3.145 -0.137 3.276
555 HG12 VAL 71 2HG1 VAL 71 -3.939 1.219 2.425
556 HG13 VAL 71 3HG1 VAL 71 -3.420 1.405 4.117
557 HG21 VAL 71 3HG2 VAL 71 -5.064 -1.676 2.850
558 HG22 VAL 71 1HG2 VAL 71 -6.721 -1.089 3.083
559 HG23 VAL 71 2HG2 VAL 71 -5.706 -0.363 1.829
560 H ASP 72 H ASP 72 -3.262 -0.670 7.018
561 HA ASP 72 HA ASP 72 -3.904 1.700 8.582
562 HB2 ASP 72 2HB ASP 72 -3.130 -0.465 9.485
563 HB3 ASP 72 3HB ASP 72 -1.535 -0.186 8.770
564 H GLY 73 H GLY 73 -2.750 3.612 8.741
565 HA2 GLY 73 2HA GLY 73 -1.182 5.272 8.164
566 HA3 GLY 73 3HA GLY 73 -0.498 4.207 6.939
567 H PHE 74 H PHE 74 -3.728 4.030 6.329
568 HA PHE 74 HA PHE 74 -3.885 5.685 4.023
569 HB2 PHE 74 2HB PHE 74 -5.364 3.794 4.580
570 HB3 PHE 74 3HB PHE 74 -5.974 4.650 5.993
571 HD1 PHE 74 HD1 PHE 74 -5.959 4.566 2.269
572 HD2 PHE 74 HD2 PHE 74 -7.751 6.260 5.812
573 HE1 PHE 74 HE1 PHE 74 -7.846 5.449 0.906
574 HE2 PHE 74 HE2 PHE 74 -9.638 7.124 4.438
575 HZ PHE 74 HZ PHE 74 -9.686 6.707 2.001
576 H SER 75 H SER 75 -4.457 6.482 7.421
577 HA SER 75 HA SER 75 -5.593 9.068 7.135
578 HB2 SER 75 2HB SER 75 -3.760 7.989 9.303
579 HB3 SER 75 3HB SER 75 -4.833 9.399 9.445
580 HG SER 75 HG SER 75 -5.793 7.506 10.315
581 H GLU 76 H GLU 76 -2.328 8.089 6.377
582 HA GLU 76 HA GLU 76 -1.133 10.752 6.756
583 HB2 GLU 76 2HB GLU 76 -0.038 8.301 5.322
584 HB3 GLU 76 3HB GLU 76 0.844 9.752 5.774
585 HG2 GLU 76 2HG GLU 76 0.443 9.245 8.185
586 HG3 GLU 76 3HG GLU 76 -0.381 7.748 7.727
587 H LEU 77 H LEU 77 -3.038 9.286 4.293
588 HA LEU 77 HA LEU 77 -1.638 10.403 2.001
589 HB2 LEU 77 2HB LEU 77 -4.178 8.821 2.414
590 HB3 LEU 77 3HB LEU 77 -3.805 9.508 0.848
591 HG LEU 77 HG LEU 77 -1.914 8.148 0.531
592 HD11 LEU 77 1HD1 LEU 77 -2.156 7.110 3.360
593 HD12 LEU 77 2HD1 LEU 77 -1.042 6.516 2.104
594 HD13 LEU 77 3HD1 LEU 77 -0.853 8.144 2.736
595 HD21 LEU 77 3HD2 LEU 77 -4.112 6.491 1.811
596 HD22 LEU 77 1HD2 LEU 77 -4.099 7.105 0.145
597 HD23 LEU 77 2HD2 LEU 77 -2.900 5.906 0.652
598 H ARG 78 H ARG 78 -2.256 11.948 0.588
599 HA ARG 78 HA ARG 78 -3.911 14.202 1.323
600 HB2 ARG 78 2HB ARG 78 -1.972 14.269 -0.194
601 HB3 ARG 78 3HB ARG 78 -2.789 13.225 -1.341
602 HG2 ARG 78 2HG ARG 78 -4.088 15.849 -0.600
603 HG3 ARG 78 3HG ARG 78 -2.634 15.888 -1.591
604 HD2 ARG 78 2HD ARG 78 -5.151 14.350 -2.291
605 HD3 ARG 78 3HD ARG 78 -4.696 15.910 -2.966
606 HE ARG 78 HE ARG 78 -3.579 13.251 -3.630
607 HH11 ARG 78 1HH2 ARG 78 -2.980 16.700 -4.055
608 HH12 ARG 78 2HH2 ARG 78 -1.954 16.390 -5.430
609 HH21 ARG 78 1HH1 ARG 78 -2.390 12.958 -5.233
610 HH22 ARG 78 2HH1 ARG 78 -1.597 14.272 -6.116
611 H TRP 79 H TRP 79 -6.055 14.668 0.756
612 HA TRP 79 HA TRP 79 -7.732 12.491 1.000
613 HB2 TRP 79 2HB TRP 79 -9.292 13.940 1.452
614 HB3 TRP 79 3HB TRP 79 -8.058 15.163 1.297
615 HD1 TRP 79 HD1 TRP 79 -11.418 14.490 0.305
616 HE1 TRP 79 HE1 TRP 79 -12.193 15.865 -1.730
617 HE3 TRP 79 HE3 TRP 79 -6.863 15.897 -1.476
618 HZ2 TRP 79 HZ2 TRP 79 -10.957 17.382 -3.870
619 HZ3 TRP 79 HZ3 TRP 79 -6.654 17.300 -3.511
620 HH2 TRP 79 HH2 TRP 79 -8.703 18.037 -4.726
621 H ASP 80 H ASP 80 -6.926 14.019 -2.108
622 HA ASP 80 HA ASP 80 -8.807 12.618 -3.661
623 HB2 ASP 80 2HB ASP 80 -7.588 14.631 -4.391
624 HB3 ASP 80 3HB ASP 80 -6.104 13.684 -4.513
625 H ASP 81 H ASP 81 -5.716 11.599 -2.347
626 HA ASP 81 HA ASP 81 -5.538 9.209 -4.030
627 HB2 ASP 81 2HB ASP 81 -3.635 10.476 -2.057
628 HB3 ASP 81 3HB ASP 81 -3.433 8.827 -2.665
629 H GLN 82 H GLN 82 -6.396 10.180 -0.695
630 HA GLN 82 HA GLN 82 -7.085 7.545 0.216
631 HB2 GLN 82 2HB GLN 82 -8.330 10.270 0.738
632 HB3 GLN 82 3HB GLN 82 -8.939 8.799 1.463
633 HG2 GLN 82 2HG GLN 82 -6.703 8.362 2.453
634 HG3 GLN 82 3HG GLN 82 -6.118 9.886 1.764
635 HE21 GLN 82 2HE2 GLN 82 -6.097 9.255 4.571
636 HE22 GLN 82 1HE2 GLN 82 -7.164 10.438 5.340
637 H GLN 83 H GLN 83 -8.923 9.880 -1.891
638 HA GLN 83 HA GLN 83 -11.111 8.068 -2.255
639 HB2 GLN 83 2HB GLN 83 -10.253 10.184 -4.260
640 HB3 GLN 83 3HB GLN 83 -11.795 9.364 -4.153
641 HG2 GLN 83 2HG GLN 83 -10.767 11.647 -2.551
642 HG3 GLN 83 3HG GLN 83 -12.337 11.386 -3.253
643 HE21 GLN 83 2HE2 GLN 83 -10.473 11.175 -0.371
644 HE22 GLN 83 1HE2 GLN 83 -11.734 10.446 0.636
645 H LYS 84 H LYS 84 -8.002 8.276 -4.120
646 HA LYS 84 HA LYS 84 -8.997 6.444 -6.128
647 HB2 LYS 84 2HB LYS 84 -7.039 6.723 -7.257
648 HB3 LYS 84 3HB LYS 84 -7.292 8.285 -6.483
649 HG2 LYS 84 2HG LYS 84 -5.094 8.091 -6.123
650 HG3 LYS 84 3HG LYS 84 -5.626 7.227 -4.676
651 HD2 LYS 84 2HD LYS 84 -5.309 5.086 -5.767
652 HD3 LYS 84 3HD LYS 84 -4.864 5.874 -7.285
653 HE2 LYS 84 2HE LYS 84 -3.344 6.097 -4.646
654 HE3 LYS 84 3HE LYS 84 -2.910 5.032 -5.981
655 HZ1 LYS 84 3HZ LYS 84 -2.835 7.998 -5.976
656 HZ2 LYS 84 1HZ LYS 84 -1.593 6.976 -6.193
657 HZ3 LYS 84 2HZ LYS 84 -2.719 7.118 -7.367
658 H VAL 85 H VAL 85 -7.085 6.140 -3.153
659 HA VAL 85 HA VAL 85 -6.509 3.330 -3.628
660 HB VAL 85 HB VAL 85 -6.469 4.983 -1.084
661 HG11 VAL 85 1HG1 VAL 85 -6.775 2.640 -0.393
662 HG12 VAL 85 2HG1 VAL 85 -5.481 2.116 -1.496
663 HG13 VAL 85 3HG1 VAL 85 -5.108 3.140 -0.098
664 HG21 VAL 85 3HG2 VAL 85 -4.791 5.479 -2.948
665 HG22 VAL 85 1HG2 VAL 85 -4.067 4.964 -1.414
666 HG23 VAL 85 2HG2 VAL 85 -4.199 3.825 -2.766
667 H LYS 86 H LYS 86 -9.185 4.983 -1.851
668 HA LYS 86 HA LYS 86 -10.552 2.501 -1.235
669 HB2 LYS 86 2HB LYS 86 -11.620 5.352 -1.446
670 HB3 LYS 86 3HB LYS 86 -12.549 3.946 -0.905
671 HG2 LYS 86 2HG LYS 86 -10.663 3.571 0.831
672 HG3 LYS 86 3HG LYS 86 -10.084 5.149 0.400
673 HD2 LYS 86 2HD LYS 86 -11.413 5.212 2.448
674 HD3 LYS 86 3HD LYS 86 -12.180 6.191 1.181
675 HE2 LYS 86 2HE LYS 86 -13.830 4.507 0.773
676 HE3 LYS 86 3HE LYS 86 -12.930 3.303 1.713
677 HZ1 LYS 86 3HZ LYS 86 -14.873 4.287 2.900
678 HZ2 LYS 86 1HZ LYS 86 -13.479 4.404 3.724
679 HZ3 LYS 86 2HZ LYS 86 -14.103 5.726 2.955
680 H LYS 87 H LYS 87 -10.879 4.731 -4.025
681 HA LYS 87 HA LYS 87 -12.899 3.199 -5.383
682 HB2 LYS 87 2HB LYS 87 -12.320 5.528 -5.904
683 HB3 LYS 87 3HB LYS 87 -10.755 5.034 -6.547
684 HG2 LYS 87 2HG LYS 87 -13.309 3.857 -7.692
685 HG3 LYS 87 3HG LYS 87 -12.847 5.510 -8.095
686 HD2 LYS 87 2HD LYS 87 -10.679 4.744 -8.987
687 HD3 LYS 87 3HD LYS 87 -11.116 3.058 -8.641
688 HE2 LYS 87 2HE LYS 87 -13.094 3.251 -10.111
689 HE3 LYS 87 3HE LYS 87 -12.700 4.941 -10.439
690 HZ1 LYS 87 3HZ LYS 87 -10.621 4.193 -11.469
691 HZ2 LYS 87 1HZ LYS 87 -10.982 2.626 -11.167
692 HZ3 LYS 87 2HZ LYS 87 -11.894 3.490 -12.207
693 H THR 88 H THR 88 -9.330 2.928 -5.530
694 HA THR 88 HA THR 88 -9.280 0.821 -7.432
695 HB THR 88 HB THR 88 -7.253 1.436 -5.255
696 HG1 THR 88 1HG THR 88 -7.525 3.157 -6.617
697 HG21 THR 88 1HG2 THR 88 -7.076 -0.070 -7.882
698 HG22 THR 88 2HG2 THR 88 -5.688 0.365 -6.851
699 HG23 THR 88 3HG2 THR 88 -6.892 -0.793 -6.269
700 H ALA 89 H ALA 89 -9.710 0.681 -3.877
701 HA ALA 89 HA ALA 89 -9.541 -2.204 -3.718
702 HB1 ALA 89 1HB ALA 89 -10.747 -0.108 -1.860
703 HB2 ALA 89 2HB ALA 89 -10.463 -1.812 -1.457
704 HB3 ALA 89 3HB ALA 89 -9.088 -0.736 -1.803
705 H GLU 90 H GLU 90 -12.217 0.168 -4.080
706 HA GLU 90 HA GLU 90 -14.304 -1.803 -4.195
707 HB2 GLU 90 2HB GLU 90 -14.094 1.049 -5.226
708 HB3 GLU 90 3HB GLU 90 -15.565 0.097 -5.393
709 HG2 GLU 90 2HG GLU 90 -14.252 0.640 -2.698
710 HG3 GLU 90 3HG GLU 90 -15.468 1.686 -3.421
711 H ALA 91 H ALA 91 -12.182 -0.461 -6.662
712 HA ALA 91 HA ALA 91 -13.400 -1.749 -8.928
713 HB1 ALA 91 1HB ALA 91 -11.378 -0.881 -10.071
714 HB2 ALA 91 2HB ALA 91 -12.087 0.357 -9.009
715 HB3 ALA 91 3HB ALA 91 -10.634 -0.517 -8.501
716 H GLY 92 H GLY 92 -11.496 -3.063 -6.409
717 HA2 GLY 92 2HA GLY 92 -10.628 -5.163 -6.080
718 HA3 GLY 92 3HA GLY 92 -11.241 -5.660 -7.660
719 H GLY 93 H GLY 93 -9.065 -2.893 -7.430
720 HA2 GLY 93 2HA GLY 93 -6.616 -3.167 -7.527
721 HA3 GLY 93 3HA GLY 93 -6.845 -4.456 -8.708
722 H VAL 94 H VAL 94 -5.355 -1.999 -8.902
723 HA VAL 94 HA VAL 94 -6.763 -0.155 -10.638
724 HB VAL 94 HB VAL 94 -5.025 0.518 -9.036
725 HG11 VAL 94 1HG1 VAL 94 -3.337 -1.261 -9.434
726 HG12 VAL 94 2HG1 VAL 94 -2.999 -0.569 -11.032
727 HG13 VAL 94 3HG1 VAL 94 -2.662 0.369 -9.564
728 HG21 VAL 94 3HG2 VAL 94 -5.725 2.000 -10.880
729 HG22 VAL 94 1HG2 VAL 94 -4.064 2.271 -10.345
730 HG23 VAL 94 2HG2 VAL 94 -4.359 1.408 -11.858
731 H THR 95 H THR 95 -6.329 0.382 -12.813
732 HA THR 95 HA THR 95 -5.955 -1.924 -14.553
733 HB THR 95 HB THR 95 -6.494 -0.212 -16.344
734 HG1 THR 95 1HG THR 95 -7.190 1.798 -15.610
735 HG21 THR 95 1HG2 THR 95 -8.459 -0.310 -14.002
736 HG22 THR 95 2HG2 THR 95 -8.845 0.063 -15.697
737 HG23 THR 95 3HG2 THR 95 -8.285 -1.558 -15.255
738 H GLY 96 H GLY 96 -3.666 0.157 -13.299
739 HA2 GLY 96 2HA GLY 96 -2.084 0.463 -15.670
740 HA3 GLY 96 3HA GLY 96 -1.534 0.764 -14.012
741 H LYS 97 H LYS 97 -0.070 -0.456 -16.180
742 HA LYS 97 HA LYS 97 0.452 -3.243 -15.202
743 HB2 LYS 97 2HB LYS 97 0.261 -2.291 -18.094
744 HB3 LYS 97 3HB LYS 97 0.780 -3.899 -17.580
745 HG2 LYS 97 2HG LYS 97 -1.444 -4.290 -16.535
746 HG3 LYS 97 3HG LYS 97 -1.981 -2.698 -17.107
747 HD2 LYS 97 2HD LYS 97 -1.560 -3.395 -19.454
748 HD3 LYS 97 3HD LYS 97 -1.079 -5.008 -18.878
749 HE2 LYS 97 2HE LYS 97 -3.321 -5.308 -17.852
750 HE3 LYS 97 3HE LYS 97 -3.796 -3.696 -18.404
751 HZ1 LYS 97 3HZ LYS 97 -3.502 -4.467 -20.700
752 HZ2 LYS 97 1HZ LYS 97 -3.062 -5.957 -20.191
753 HZ3 LYS 97 2HZ LYS 97 -4.579 -5.418 -19.928
754 H GLY 98 H GLY 98 2.539 -4.110 -15.874
755 HA2 GLY 98 2HA GLY 98 4.836 -4.040 -16.203
756 HA3 GLY 98 3HA GLY 98 4.674 -2.395 -16.804
757 H GLN 99 H GLN 99 6.526 -1.700 -15.741
758 HA GLN 99 HA GLN 99 6.484 -1.607 -12.749
759 HB2 GLN 99 2HB GLN 99 8.892 -1.902 -14.583
760 HB3 GLN 99 3HB GLN 99 8.927 -1.753 -12.824
761 HG2 GLN 99 2HG GLN 99 7.632 -3.889 -12.644
762 HG3 GLN 99 3HG GLN 99 7.717 -4.067 -14.401
763 HE21 GLN 99 2HE2 GLN 99 9.603 -4.160 -11.387
764 HE22 GLN 99 1HE2 GLN 99 11.027 -4.876 -12.119
765 H ASP 100 H ASP 100 7.113 0.205 -11.736
766 HA ASP 100 HA ASP 100 8.625 2.309 -13.051
767 HB2 ASP 100 2HB ASP 100 6.307 3.062 -13.506
768 HB3 ASP 100 3HB ASP 100 5.916 2.919 -11.790
769 H GLY 101 H GLY 101 10.019 3.272 -11.531
770 HA2 GLY 101 2HA GLY 101 9.847 3.325 -8.728
771 HA3 GLY 101 3HA GLY 101 10.452 1.720 -9.156
772 H ILE 102 H ILE 102 12.395 2.226 -8.042
773 HA ILE 102 HA ILE 102 14.372 3.697 -9.688
774 HB ILE 102 HB ILE 102 13.396 5.152 -7.872
775 HG12 ILE 102 2HG1 ILE 102 16.400 4.775 -7.642
776 HG13 ILE 102 3HG1 ILE 102 15.595 5.535 -9.022
777 HG21 ILE 102 1HG2 ILE 102 15.065 3.445 -5.972
778 HG22 ILE 102 2HG2 ILE 102 14.103 4.873 -5.562
779 HG23 ILE 102 3HG2 ILE 102 13.293 3.402 -6.080
780 HD11 ILE 102 3HD1 ILE 102 14.622 7.246 -7.480
781 HD12 ILE 102 1HD1 ILE 102 15.558 6.532 -6.143
782 HD13 ILE 102 2HD1 ILE 102 16.396 7.251 -7.525
783 H GLY 103 H GLY 103 16.604 3.212 -9.172
784 HA2 GLY 103 2HA GLY 103 17.065 0.565 -7.837
785 HA3 GLY 103 3HA GLY 103 18.106 1.248 -9.089
786 H SER 104 H SER 104 17.639 0.984 -5.737
787 HA SER 104 HA SER 104 18.739 3.587 -4.980
788 HB2 SER 104 2HB SER 104 18.342 2.736 -2.668
789 HB3 SER 104 3HB SER 104 16.909 2.749 -3.710
790 HG SER 104 HG SER 104 17.391 0.755 -2.409
791 H LYS 105 H LYS 105 20.248 0.670 -5.802
792 HA LYS 105 HA LYS 105 22.377 0.585 -3.869
793 HB2 LYS 105 2HB LYS 105 21.632 -1.304 -5.336
794 HB3 LYS 105 3HB LYS 105 22.351 -0.480 -6.727
795 HG2 LYS 105 2HG LYS 105 24.588 -0.617 -5.638
796 HG3 LYS 105 3HG LYS 105 23.850 -1.398 -4.228
797 HD2 LYS 105 2HD LYS 105 23.111 -3.282 -5.683
798 HD3 LYS 105 3HD LYS 105 23.883 -2.496 -7.078
799 HE2 LYS 105 2HE LYS 105 26.082 -2.606 -5.912
800 HE3 LYS 105 3HE LYS 105 25.308 -3.381 -4.524
801 HZ1 LYS 105 3HZ LYS 105 25.422 -4.531 -7.265
802 HZ2 LYS 105 1HZ LYS 105 26.324 -5.021 -5.997
803 HZ3 LYS 105 2HZ LYS 105 24.709 -5.244 -5.978
804 H ALA 106 H ALA 106 24.288 1.627 -3.736
805 HA ALA 106 HA ALA 106 24.702 4.062 -5.150
806 HB1 ALA 106 1HB ALA 106 25.411 3.627 -2.819
807 HB2 ALA 106 2HB ALA 106 26.617 2.454 -3.403
808 HB3 ALA 106 3HB ALA 106 26.768 4.175 -3.817
809 H GLU 107 H GLU 107 25.698 0.880 -6.062
810 HA GLU 107 HA GLU 107 27.814 1.840 -7.857
811 HB2 GLU 107 2HB GLU 107 26.670 -0.952 -7.457
812 HB3 GLU 107 3HB GLU 107 28.117 -0.559 -8.379
813 HG2 GLU 107 2HG GLU 107 27.754 -0.222 -5.372
814 HG3 GLU 107 3HG GLU 107 28.681 -1.470 -6.184
815 H LYS 108 H LYS 108 24.507 1.865 -8.171
816 HA LYS 108 HA LYS 108 24.204 0.807 -10.854
817 HB2 LYS 108 2HB LYS 108 22.406 0.788 -9.127
818 HB3 LYS 108 3HB LYS 108 22.368 2.546 -9.169
819 HG2 LYS 108 2HG LYS 108 20.512 1.724 -10.378
820 HG3 LYS 108 3HG LYS 108 21.588 2.478 -11.538
821 HD2 LYS 108 2HD LYS 108 21.639 -0.533 -11.066
822 HD3 LYS 108 3HD LYS 108 20.402 0.212 -12.082
823 HE2 LYS 108 2HE LYS 108 22.149 1.219 -13.522
824 HE3 LYS 108 3HE LYS 108 23.400 0.430 -12.564
825 HZ1 LYS 108 3HZ LYS 108 22.448 -1.721 -13.202
826 HZ2 LYS 108 1HZ LYS 108 21.295 -0.989 -14.100
827 HZ3 LYS 108 2HZ LYS 108 22.863 -0.869 -14.529
Start of MODEL 11
1 H1 MET 1 H1 MET 1 13.240 -0.480 15.955
2 H2 MET 1 H2 MET 1 12.587 -1.955 15.645
3 H3 MET 1 H3 MET 1 12.759 -1.443 17.186
4 HA MET 1 HA MET 1 11.159 0.316 16.868
5 HB2 MET 1 2HB MET 1 10.873 -0.888 14.077
6 HB3 MET 1 3HB MET 1 9.757 0.274 14.793
7 HG2 MET 1 2HG MET 1 12.684 0.775 14.148
8 HG3 MET 1 3HG MET 1 11.281 1.390 13.286
9 HE1 MET 1 1HE MET 1 13.645 3.258 14.172
10 HE2 MET 1 2HE MET 1 12.184 3.837 13.339
11 HE3 MET 1 3HE MET 1 12.752 4.656 14.809
12 H ALA 2 H ALA 2 8.965 -0.033 17.402
13 HA ALA 2 HA ALA 2 7.810 -2.724 17.124
14 HB1 ALA 2 1HB ALA 2 7.272 -2.874 19.532
15 HB2 ALA 2 2HB ALA 2 9.025 -2.865 19.269
16 HB3 ALA 2 3HB ALA 2 8.205 -1.395 19.843
17 H GLU 3 H GLU 3 5.590 -2.731 17.090
18 HA GLU 3 HA GLU 3 3.946 -0.441 17.822
19 HB2 GLU 3 2HB GLU 3 3.038 -0.028 15.597
20 HB3 GLU 3 3HB GLU 3 4.760 0.319 15.626
21 HG2 GLU 3 2HG GLU 3 5.228 -1.859 14.512
22 HG3 GLU 3 3HG GLU 3 3.500 -2.224 14.498
23 H SER 4 H SER 4 1.585 -0.900 17.338
24 HA SER 4 HA SER 4 0.865 -3.717 17.741
25 HB2 SER 4 2HB SER 4 -0.487 -1.930 18.744
26 HB3 SER 4 3HB SER 4 -0.888 -1.312 17.126
27 HG SER 4 HG SER 4 -2.487 -2.763 18.007
28 H SER 5 H SER 5 0.779 -5.156 16.156
29 HA SER 5 HA SER 5 0.695 -4.275 13.324
30 HB2 SER 5 2HB SER 5 1.757 -6.356 12.756
31 HB3 SER 5 3HB SER 5 2.691 -5.481 13.964
32 HG SER 5 HG SER 5 1.925 -6.881 15.560
33 H ASP 6 H ASP 6 -1.699 -4.437 14.941
34 HA ASP 6 HA ASP 6 -3.103 -6.718 13.899
35 HB2 ASP 6 2HB ASP 6 -3.323 -5.927 16.243
36 HB3 ASP 6 3HB ASP 6 -4.123 -4.466 15.663
37 H LYS 7 H LYS 7 -2.428 -5.564 11.728
38 HA LYS 7 HA LYS 7 -4.938 -4.854 10.374
39 HB2 LYS 7 2HB LYS 7 -3.748 -3.215 8.947
40 HB3 LYS 7 3HB LYS 7 -4.022 -2.683 10.592
41 HG2 LYS 7 2HG LYS 7 -1.436 -4.082 10.207
42 HG3 LYS 7 3HG LYS 7 -1.604 -2.618 9.229
43 HD2 LYS 7 2HD LYS 7 -2.187 -1.355 11.283
44 HD3 LYS 7 3HD LYS 7 -1.983 -2.826 12.247
45 HE2 LYS 7 2HE LYS 7 0.364 -2.980 11.694
46 HE3 LYS 7 3HE LYS 7 0.215 -1.756 10.425
47 HZ1 LYS 7 3HZ LYS 7 -0.262 -0.103 12.134
48 HZ2 LYS 7 1HZ LYS 7 -0.039 -1.243 13.332
49 HZ3 LYS 7 2HZ LYS 7 1.211 -0.794 12.386
50 H LEU 8 H LEU 8 -4.445 -5.060 7.915
51 HA LEU 8 HA LEU 8 -2.623 -7.404 7.429
52 HB2 LEU 8 2HB LEU 8 -5.088 -6.617 5.834
53 HB3 LEU 8 3HB LEU 8 -4.074 -8.035 5.621
54 HG LEU 8 HG LEU 8 -4.843 -8.359 8.234
55 HD11 LEU 8 1HD1 LEU 8 -7.240 -7.153 6.783
56 HD12 LEU 8 2HD1 LEU 8 -7.271 -7.927 8.381
57 HD13 LEU 8 3HD1 LEU 8 -6.398 -6.407 8.154
58 HD21 LEU 8 3HD2 LEU 8 -6.491 -10.005 7.384
59 HD22 LEU 8 1HD2 LEU 8 -6.393 -9.265 5.768
60 HD23 LEU 8 2HD2 LEU 8 -4.976 -10.077 6.470
61 H TYR 9 H TYR 9 -3.238 -4.084 6.741
62 HA TYR 9 HA TYR 9 -1.488 -4.149 4.341
63 HB2 TYR 9 2HB TYR 9 -4.126 -2.690 4.432
64 HB3 TYR 9 3HB TYR 9 -3.093 -2.955 3.037
65 HD1 TYR 9 HD2 TYR 9 -2.647 -5.708 2.750
66 HD2 TYR 9 HD1 TYR 9 -6.149 -3.803 4.352
67 HE1 TYR 9 HE2 TYR 9 -3.980 -7.756 2.245
68 HE2 TYR 9 HE1 TYR 9 -7.488 -5.845 3.867
69 HH TYR 9 HH TYR 9 -7.472 -7.971 2.994
70 H ARG 10 H ARG 10 -0.666 -2.109 3.741
71 HA ARG 10 HA ARG 10 -0.791 0.142 5.674
72 HB2 ARG 10 2HB ARG 10 1.084 -1.105 6.471
73 HB3 ARG 10 3HB ARG 10 1.599 -1.506 4.852
74 HG2 ARG 10 2HG ARG 10 3.197 -0.015 5.778
75 HG3 ARG 10 3HG ARG 10 2.369 0.834 4.483
76 HD2 ARG 10 2HD ARG 10 0.919 1.958 6.203
77 HD3 ARG 10 3HD ARG 10 1.797 1.093 7.475
78 HE ARG 10 HE ARG 10 3.542 2.699 5.781
79 HH11 ARG 10 1HH2 ARG 10 1.413 2.960 8.611
80 HH12 ARG 10 2HH2 ARG 10 2.156 4.463 9.073
81 HH21 ARG 10 1HH1 ARG 10 4.468 4.522 6.549
82 HH22 ARG 10 2HH1 ARG 10 3.828 5.307 7.979
83 H VAL 11 H VAL 11 -0.459 2.169 4.693
84 HA VAL 11 HA VAL 11 0.570 2.332 1.910
85 HB VAL 11 HB VAL 11 -1.980 2.205 1.974
86 HG11 VAL 11 1HG1 VAL 11 -1.804 5.109 2.899
87 HG12 VAL 11 2HG1 VAL 11 -3.259 4.151 2.549
88 HG13 VAL 11 3HG1 VAL 11 -2.243 3.771 3.954
89 HG21 VAL 11 3HG2 VAL 11 -0.618 3.186 0.043
90 HG22 VAL 11 1HG2 VAL 11 -2.251 3.836 0.199
91 HG23 VAL 11 2HG2 VAL 11 -0.849 4.777 0.757
92 H GLU 12 H GLU 12 1.591 4.308 1.396
93 HA GLU 12 HA GLU 12 1.446 6.630 3.074
94 HB2 GLU 12 2HB GLU 12 3.763 6.703 3.861
95 HB3 GLU 12 3HB GLU 12 2.971 5.296 4.549
96 HG2 GLU 12 2HG GLU 12 4.059 3.833 2.889
97 HG3 GLU 12 3HG GLU 12 4.806 5.241 2.118
98 H TYR 13 H TYR 13 2.445 8.392 2.220
99 HA TYR 13 HA TYR 13 3.795 8.238 -0.394
100 HB2 TYR 13 2HB TYR 13 3.809 10.473 1.653
101 HB3 TYR 13 3HB TYR 13 4.232 10.575 -0.052
102 HD1 TYR 13 HD1 TYR 13 2.102 9.334 -1.523
103 HD2 TYR 13 HD2 TYR 13 1.788 11.457 2.200
104 HE1 TYR 13 HE1 TYR 13 -0.152 10.170 -2.199
105 HE2 TYR 13 HE2 TYR 13 -0.463 12.307 1.535
106 HH TYR 13 HH TYR 13 -1.906 11.541 -1.660
107 H ALA 14 H ALA 14 5.914 7.791 -0.634
108 HA ALA 14 HA ALA 14 7.436 6.672 1.457
109 HB1 ALA 14 1HB ALA 14 8.194 7.650 -1.322
110 HB2 ALA 14 2HB ALA 14 9.216 6.622 -0.307
111 HB3 ALA 14 3HB ALA 14 7.640 6.025 -0.883
112 H LYS 15 H LYS 15 8.054 7.864 3.186
113 HA LYS 15 HA LYS 15 9.041 10.560 3.121
114 HB2 LYS 15 2HB LYS 15 8.030 9.396 5.095
115 HB3 LYS 15 3HB LYS 15 9.445 8.352 5.194
116 HG2 LYS 15 2HG LYS 15 9.574 10.075 6.871
117 HG3 LYS 15 3HG LYS 15 10.871 10.323 5.704
118 HD2 LYS 15 2HD LYS 15 9.595 12.156 4.640
119 HD3 LYS 15 3HD LYS 15 8.218 11.840 5.720
120 HE2 LYS 15 2HE LYS 15 9.670 12.349 7.684
121 HE3 LYS 15 3HE LYS 15 11.017 12.694 6.592
122 HZ1 LYS 15 3HZ LYS 15 9.867 14.728 7.253
123 HZ2 LYS 15 1HZ LYS 15 9.690 14.515 5.646
124 HZ3 LYS 15 2HZ LYS 15 8.447 14.191 6.658
125 H SER 16 H SER 16 10.650 7.461 2.804
126 HA SER 16 HA SER 16 13.074 8.725 1.721
127 HB2 SER 16 2HB SER 16 14.571 7.468 3.222
128 HB3 SER 16 3HB SER 16 13.541 8.587 4.131
129 HG SER 16 HG SER 16 13.523 6.607 5.175
130 H GLY 17 H GLY 17 14.473 7.143 0.639
131 HA2 GLY 17 2HA GLY 17 12.972 5.159 -0.860
132 HA3 GLY 17 3HA GLY 17 14.664 5.602 -1.068
133 H ARG 18 H ARG 18 13.259 4.399 1.973
134 HA ARG 18 HA ARG 18 15.358 2.321 2.089
135 HB2 ARG 18 2HB ARG 18 13.444 3.423 4.184
136 HB3 ARG 18 3HB ARG 18 14.692 2.225 4.513
137 HG2 ARG 18 2HG ARG 18 15.239 5.047 3.500
138 HG3 ARG 18 3HG ARG 18 15.351 4.508 5.175
139 HD2 ARG 18 2HD ARG 18 17.112 2.844 4.477
140 HD3 ARG 18 3HD ARG 18 17.036 3.503 2.844
141 HE ARG 18 HE ARG 18 18.174 5.411 3.504
142 HH11 ARG 18 1HH2 ARG 18 17.428 3.604 6.419
143 HH12 ARG 18 2HH2 ARG 18 18.491 4.578 7.396
144 HH21 ARG 18 1HH1 ARG 18 19.504 6.605 4.813
145 HH22 ARG 18 2HH1 ARG 18 19.629 6.230 6.506
146 H ALA 19 H ALA 19 12.363 2.106 0.846
147 HA ALA 19 HA ALA 19 12.040 -0.741 1.704
148 HB1 ALA 19 1HB ALA 19 9.661 -0.518 1.243
149 HB2 ALA 19 2HB ALA 19 10.160 0.665 2.467
150 HB3 ALA 19 3HB ALA 19 9.874 1.179 0.785
151 H SER 20 H SER 20 11.471 -2.278 0.106
152 HA SER 20 HA SER 20 11.850 -1.477 -2.723
153 HB2 SER 20 2HB SER 20 13.396 -3.664 -1.293
154 HB3 SER 20 3HB SER 20 13.307 -3.493 -3.057
155 HG SER 20 HG SER 20 15.159 -2.462 -2.039
156 H CYS 21 HN CYS 21 11.091 -2.994 -4.279
157 HA CYS 21 HA CYS 21 8.438 -3.813 -3.405
158 HB2 CYS 21 2HB CYS 21 8.919 -2.403 -5.366
159 HB3 CYS 21 3HB CYS 21 9.760 -3.762 -6.131
160 H LYS 22 H LYS 22 7.927 -5.746 -2.769
161 HA LYS 22 HA LYS 22 9.608 -8.097 -3.170
162 HB2 LYS 22 2HB LYS 22 6.764 -7.934 -2.129
163 HB3 LYS 22 3HB LYS 22 7.875 -9.256 -1.856
164 HG2 LYS 22 2HG LYS 22 8.208 -6.404 -0.820
165 HG3 LYS 22 3HG LYS 22 7.523 -7.720 0.099
166 HD2 LYS 22 2HD LYS 22 10.371 -7.611 -0.974
167 HD3 LYS 22 3HD LYS 22 9.871 -7.249 0.692
168 HE2 LYS 22 2HE LYS 22 8.984 -9.566 0.932
169 HE3 LYS 22 3HE LYS 22 9.549 -9.946 -0.700
170 HZ1 LYS 22 3HZ LYS 22 11.157 -10.657 0.968
171 HZ2 LYS 22 1HZ LYS 22 11.825 -9.485 0.050
172 HZ3 LYS 22 2HZ LYS 22 11.304 -9.144 1.562
173 H LYS 23 H LYS 23 7.314 -6.665 -5.171
174 HA LYS 23 HA LYS 23 6.388 -9.246 -6.351
175 HB2 LYS 23 2HB LYS 23 4.656 -7.754 -5.506
176 HB3 LYS 23 3HB LYS 23 5.234 -6.449 -6.539
177 HG2 LYS 23 2HG LYS 23 3.215 -7.490 -7.446
178 HG3 LYS 23 3HG LYS 23 4.576 -7.688 -8.548
179 HD2 LYS 23 2HD LYS 23 4.869 -10.043 -7.769
180 HD3 LYS 23 3HD LYS 23 3.515 -9.830 -6.636
181 HE2 LYS 23 2HE LYS 23 2.014 -9.348 -8.539
182 HE3 LYS 23 3HE LYS 23 3.368 -9.496 -9.667
183 HZ1 LYS 23 3HZ LYS 23 2.047 -11.544 -9.547
184 HZ2 LYS 23 1HZ LYS 23 3.570 -11.832 -9.039
185 HZ3 LYS 23 2HZ LYS 23 2.354 -11.711 -7.955
186 H CYS 24 HN CYS 24 7.674 -6.086 -7.508
187 HA CYS 24 HA CYS 24 8.410 -7.485 -10.033
188 HB2 CYS 24 2HB CYS 24 8.299 -5.542 -11.236
189 HB3 CYS 24 3HB CYS 24 6.832 -5.603 -10.267
190 H SER 25 H SER 25 9.872 -6.843 -7.227
191 HA SER 25 HA SER 25 11.971 -6.931 -6.482
192 HB2 SER 25 2HB SER 25 12.676 -8.060 -9.197
193 HB3 SER 25 3HB SER 25 13.622 -8.210 -7.707
194 HG SER 25 HG SER 25 12.299 -10.051 -8.092
195 H GLU 26 H GLU 26 11.200 -4.423 -7.957
196 HA GLU 26 HA GLU 26 13.921 -3.203 -8.247
197 HB2 GLU 26 2HB GLU 26 11.172 -2.089 -8.913
198 HB3 GLU 26 3HB GLU 26 12.690 -1.222 -9.098
199 HG2 GLU 26 2HG GLU 26 11.823 -3.702 -10.626
200 HG3 GLU 26 3HG GLU 26 11.940 -2.061 -11.243
201 H SER 27 H SER 27 13.495 -0.663 -7.317
202 HA SER 27 HA SER 27 12.810 -1.045 -4.449
203 HB2 SER 27 2HB SER 27 15.217 -0.775 -4.983
204 HB3 SER 27 3HB SER 27 14.840 0.866 -5.562
205 HG SER 27 HG SER 27 14.520 -0.235 -2.950
206 H ILE 28 H ILE 28 12.066 0.906 -3.328
207 HA ILE 28 HA ILE 28 10.074 2.200 -5.116
208 HB ILE 28 HB ILE 28 9.791 1.606 -2.160
209 HG12 ILE 28 2HG1 ILE 28 8.426 0.060 -4.401
210 HG13 ILE 28 3HG1 ILE 28 9.918 -0.501 -3.661
211 HG21 ILE 28 1HG2 ILE 28 7.812 2.486 -4.321
212 HG22 ILE 28 2HG2 ILE 28 7.384 2.038 -2.673
213 HG23 ILE 28 3HG2 ILE 28 8.376 3.477 -2.966
214 HD11 ILE 28 3HD1 ILE 28 7.289 -0.106 -2.196
215 HD12 ILE 28 1HD1 ILE 28 8.100 -1.623 -2.594
216 HD13 ILE 28 2HD1 ILE 28 8.839 -0.516 -1.427
217 HA PRO 29 HA PRO 29 12.705 5.629 -3.909
218 HB2 PRO 29 2HB PRO 29 11.861 7.565 -5.656
219 HB3 PRO 29 3HB PRO 29 12.814 6.140 -6.156
220 HG2 PRO 29 2HG PRO 29 9.800 6.487 -6.256
221 HG3 PRO 29 3HG PRO 29 10.892 5.935 -7.568
222 HD2 PRO 29 2HD PRO 29 9.541 4.166 -6.017
223 HD3 PRO 29 3HD PRO 29 11.230 3.839 -6.522
224 H LYS 30 H LYS 30 12.697 7.654 -2.937
225 HA LYS 30 HA LYS 30 10.680 8.461 -1.090
226 HB2 LYS 30 2HB LYS 30 13.123 9.019 -1.034
227 HB3 LYS 30 3HB LYS 30 12.898 10.057 -2.443
228 HG2 LYS 30 2HG LYS 30 11.352 11.501 -1.085
229 HG3 LYS 30 3HG LYS 30 11.673 10.465 0.320
230 HD2 LYS 30 2HD LYS 30 14.117 11.044 0.132
231 HD3 LYS 30 3HD LYS 30 13.748 12.021 -1.290
232 HE2 LYS 30 2HE LYS 30 13.859 13.643 0.340
233 HE3 LYS 30 3HE LYS 30 12.123 13.345 0.231
234 HZ1 LYS 30 3HZ LYS 30 12.378 11.869 2.217
235 HZ2 LYS 30 1HZ LYS 30 13.964 12.255 2.300
236 HZ3 LYS 30 2HZ LYS 30 12.838 13.408 2.536
237 H ASP 31 H ASP 31 9.165 10.098 -1.144
238 HA ASP 31 HA ASP 31 7.430 11.257 -1.948
239 HB2 ASP 31 2HB ASP 31 9.320 12.832 -2.298
240 HB3 ASP 31 3HB ASP 31 9.385 12.345 -3.991
241 H SER 32 H SER 32 7.394 8.656 -2.807
242 HA SER 32 HA SER 32 5.519 8.899 -5.083
243 HB2 SER 32 2HB SER 32 7.699 7.890 -5.890
244 HB3 SER 32 3HB SER 32 7.411 6.536 -4.777
245 HG SER 32 HG SER 32 6.609 6.174 -6.933
246 H LEU 33 H LEU 33 3.946 7.017 -5.048
247 HA LEU 33 HA LEU 33 3.049 6.657 -2.253
248 HB2 LEU 33 2HB LEU 33 1.517 7.614 -3.968
249 HB3 LEU 33 3HB LEU 33 1.658 6.121 -4.898
250 HG LEU 33 HG LEU 33 0.666 4.879 -2.929
251 HD11 LEU 33 1HD1 LEU 33 1.097 6.517 -1.122
252 HD12 LEU 33 2HD1 LEU 33 0.022 7.679 -1.920
253 HD13 LEU 33 3HD1 LEU 33 -0.623 6.158 -1.278
254 HD21 LEU 33 3HD2 LEU 33 -1.028 7.140 -4.049
255 HD22 LEU 33 1HD2 LEU 33 -0.671 5.613 -4.895
256 HD23 LEU 33 2HD2 LEU 33 -1.624 5.590 -3.396
257 H ARG 34 H ARG 34 3.041 4.753 -1.191
258 HA ARG 34 HA ARG 34 3.593 2.212 -2.627
259 HB2 ARG 34 2HB ARG 34 5.396 1.606 -1.212
260 HB3 ARG 34 3HB ARG 34 5.753 3.180 -1.944
261 HG2 ARG 34 2HG ARG 34 5.454 4.347 0.095
262 HG3 ARG 34 3HG ARG 34 4.629 2.973 0.847
263 HD2 ARG 34 2HD ARG 34 6.753 3.019 1.838
264 HD3 ARG 34 3HD ARG 34 6.748 1.658 0.739
265 HE ARG 34 HE ARG 34 8.088 2.983 -0.851
266 HH11 ARG 34 1HH2 ARG 34 8.101 4.365 2.434
267 HH12 ARG 34 2HH2 ARG 34 9.790 4.786 2.259
268 HH21 ARG 34 1HH1 ARG 34 10.234 3.760 -0.931
269 HH22 ARG 34 2HH1 ARG 34 10.799 4.645 0.455
270 H MET 35 H MET 35 3.218 0.338 -1.402
271 HA MET 35 HA MET 35 1.451 0.582 0.946
272 HB2 MET 35 2HB MET 35 0.802 -0.923 -1.620
273 HB3 MET 35 3HB MET 35 0.030 -1.291 -0.067
274 HG2 MET 35 2HG MET 35 -0.749 1.034 0.101
275 HG3 MET 35 3HG MET 35 -0.055 1.383 -1.486
276 HE1 MET 35 3HE MET 35 -2.343 -1.615 -0.035
277 HE2 MET 35 1HE MET 35 -2.936 -0.060 0.598
278 HE3 MET 35 2HE MET 35 -3.924 -0.984 -0.557
279 H ALA 36 H ALA 36 1.204 -1.450 2.117
280 HA ALA 36 HA ALA 36 3.319 -3.435 1.636
281 HB1 ALA 36 1HB ALA 36 4.692 -2.760 3.257
282 HB2 ALA 36 2HB ALA 36 3.635 -1.383 3.605
283 HB3 ALA 36 3HB ALA 36 3.406 -2.925 4.455
284 H ILE 37 H ILE 37 3.078 -5.390 3.006
285 HA ILE 37 HA ILE 37 0.280 -5.817 3.974
286 HB ILE 37 HB ILE 37 1.849 -7.251 1.918
287 HG12 ILE 37 2HG1 ILE 37 -1.113 -7.248 2.634
288 HG13 ILE 37 3HG1 ILE 37 -0.326 -5.966 1.712
289 HG21 ILE 37 1HG2 ILE 37 0.257 -8.911 3.898
290 HG22 ILE 37 2HG2 ILE 37 0.954 -9.451 2.337
291 HG23 ILE 37 3HG2 ILE 37 2.025 -8.968 3.639
292 HD11 ILE 37 3HD1 ILE 37 -1.436 -7.452 0.174
293 HD12 ILE 37 1HD1 ILE 37 0.319 -7.602 -0.035
294 HD13 ILE 37 2HD1 ILE 37 -0.580 -8.860 0.838
295 H MET 38 H MET 38 -0.033 -6.963 5.773
296 HA MET 38 HA MET 38 2.356 -7.286 7.495
297 HB2 MET 38 2HB MET 38 -0.593 -7.390 8.182
298 HB3 MET 38 3HB MET 38 0.729 -7.268 9.333
299 HG2 MET 38 2HG MET 38 0.382 -5.078 7.271
300 HG3 MET 38 3HG MET 38 -0.744 -5.201 8.586
301 HE1 MET 38 3HE MET 38 3.176 -6.073 8.994
302 HE2 MET 38 1HE MET 38 2.892 -5.051 7.568
303 HE3 MET 38 2HE MET 38 3.771 -4.398 8.985
304 H VAL 39 H VAL 39 3.327 -9.173 7.128
305 HA VAL 39 HA VAL 39 1.661 -11.665 7.299
306 HB VAL 39 HB VAL 39 2.912 -11.581 5.272
307 HG11 VAL 39 1HG1 VAL 39 5.348 -11.702 5.206
308 HG12 VAL 39 2HG1 VAL 39 4.807 -10.159 5.884
309 HG13 VAL 39 3HG1 VAL 39 5.442 -11.433 6.956
310 HG21 VAL 39 3HG2 VAL 39 4.159 -13.647 7.111
311 HG22 VAL 39 1HG2 VAL 39 2.543 -13.768 6.368
312 HG23 VAL 39 2HG2 VAL 39 3.989 -13.723 5.351
313 H GLN 40 H GLN 40 1.968 -13.153 8.836
314 HA GLN 40 HA GLN 40 3.155 -12.316 11.335
315 HB2 GLN 40 2HB GLN 40 2.543 -14.721 11.995
316 HB3 GLN 40 3HB GLN 40 1.251 -13.579 11.628
317 HG2 GLN 40 2HG GLN 40 0.885 -14.542 9.430
318 HG3 GLN 40 3HG GLN 40 2.296 -15.591 9.594
319 HE21 GLN 40 2HE2 GLN 40 0.316 -17.097 8.943
320 HE22 GLN 40 1HE2 GLN 40 -0.488 -17.840 10.320
321 H SER 41 H SER 41 5.129 -12.582 12.113
322 HA SER 41 HA SER 41 7.125 -13.890 10.390
323 HB2 SER 41 2HB SER 41 7.503 -11.608 11.028
324 HB3 SER 41 3HB SER 41 7.419 -12.042 12.748
325 HG SER 41 HG SER 41 9.583 -11.950 11.450
326 HA PRO 42 HA PRO 42 7.861 -17.169 13.315
327 HB2 PRO 42 2HB PRO 42 10.314 -17.603 11.626
328 HB3 PRO 42 3HB PRO 42 9.111 -18.800 12.186
329 HG2 PRO 42 2HG PRO 42 9.096 -17.913 9.615
330 HG3 PRO 42 3HG PRO 42 7.555 -18.142 10.508
331 HD2 PRO 42 2HD PRO 42 9.088 -15.560 10.059
332 HD3 PRO 42 3HD PRO 42 7.340 -15.897 9.867
333 H MET 43 H MET 43 9.858 -14.442 12.612
334 HA MET 43 HA MET 43 11.838 -15.066 14.767
335 HB2 MET 43 2HB MET 43 12.023 -13.378 12.271
336 HB3 MET 43 3HB MET 43 13.254 -13.379 13.528
337 HG2 MET 43 2HG MET 43 14.029 -15.461 13.049
338 HG3 MET 43 3HG MET 43 12.465 -16.087 12.548
339 HE1 MET 43 3HE MET 43 12.009 -15.072 8.914
340 HE2 MET 43 1HE MET 43 11.503 -16.134 10.249
341 HE3 MET 43 2HE MET 43 11.320 -14.378 10.403
342 H PHE 44 H PHE 44 9.386 -12.745 13.846
343 HA PHE 44 HA PHE 44 10.193 -10.888 16.045
344 HB2 PHE 44 2HB PHE 44 10.297 -9.834 13.881
345 HB3 PHE 44 3HB PHE 44 8.687 -10.389 13.466
346 HD1 PHE 44 HD2 PHE 44 10.529 -8.182 15.880
347 HD2 PHE 44 HD1 PHE 44 6.781 -9.077 13.944
348 HE1 PHE 44 HE2 PHE 44 9.540 -6.105 16.822
349 HE2 PHE 44 HE1 PHE 44 5.796 -7.000 14.882
350 HZ PHE 44 HZ PHE 44 7.173 -5.516 16.329
351 H ASP 45 H ASP 45 8.522 -9.919 17.284
352 HA ASP 45 HA ASP 45 6.613 -11.943 18.193
353 HB2 ASP 45 2HB ASP 45 8.202 -10.789 19.710
354 HB3 ASP 45 3HB ASP 45 7.366 -9.266 19.409
355 H GLY 46 H GLY 46 5.707 -11.196 15.815
356 HA2 GLY 46 2HA GLY 46 3.040 -10.554 15.904
357 HA3 GLY 46 3HA GLY 46 3.818 -8.966 15.870
358 H LYS 47 H LYS 47 3.027 -8.442 13.852
359 HA LYS 47 HA LYS 47 3.935 -10.108 11.551
360 HB2 LYS 47 2HB LYS 47 1.657 -8.117 11.474
361 HB3 LYS 47 3HB LYS 47 2.100 -9.346 10.292
362 HG2 LYS 47 2HG LYS 47 1.734 -10.948 12.475
363 HG3 LYS 47 3HG LYS 47 0.661 -9.626 12.921
364 HD2 LYS 47 2HD LYS 47 0.623 -11.321 10.408
365 HD3 LYS 47 3HD LYS 47 -0.515 -11.429 11.751
366 HE2 LYS 47 2HE LYS 47 -0.198 -9.111 9.793
367 HE3 LYS 47 3HE LYS 47 -1.474 -10.320 9.765
368 HZ1 LYS 47 3HZ LYS 47 -1.061 -8.327 11.954
369 HZ2 LYS 47 1HZ LYS 47 -2.205 -8.260 10.812
370 HZ3 LYS 47 2HZ LYS 47 -2.245 -9.471 11.923
371 H VAL 48 H VAL 48 4.742 -9.247 9.731
372 HA VAL 48 HA VAL 48 6.198 -6.667 10.106
373 HB VAL 48 HB VAL 48 8.148 -7.727 9.054
374 HG11 VAL 48 1HG1 VAL 48 8.834 -9.050 10.988
375 HG12 VAL 48 2HG1 VAL 48 7.896 -7.650 11.530
376 HG13 VAL 48 3HG1 VAL 48 7.148 -9.260 11.496
377 HG21 VAL 48 3HG2 VAL 48 6.602 -10.351 9.289
378 HG22 VAL 48 1HG2 VAL 48 7.046 -9.547 7.772
379 HG23 VAL 48 2HG2 VAL 48 8.308 -10.170 8.844
380 HA PRO 49 HA PRO 49 4.559 -5.606 6.251
381 HB2 PRO 49 2HB PRO 49 5.944 -3.374 5.539
382 HB3 PRO 49 3HB PRO 49 4.914 -3.450 6.999
383 HG2 PRO 49 2HG PRO 49 7.920 -3.836 6.821
384 HG3 PRO 49 3HG PRO 49 7.001 -2.810 7.967
385 HD2 PRO 49 2HD PRO 49 7.862 -5.336 8.606
386 HD3 PRO 49 3HD PRO 49 6.331 -4.658 9.234
387 H HIS 50 H HIS 50 4.590 -6.482 4.267
388 HA HIS 50 HA HIS 50 7.148 -6.680 2.710
389 HB2 HIS 50 2HB HIS 50 4.442 -8.048 2.526
390 HB3 HIS 50 3HB HIS 50 5.519 -7.973 1.141
391 HD2 HIS 50 HD2 HIS 50 6.743 -8.550 4.755
392 HE1 HIS 50 HE1 HIS 50 7.510 -12.142 2.591
393 HE2 HIS 50 HE2 HIS 50 7.904 -10.928 4.795
394 H TRP 51 H TRP 51 7.580 -4.789 1.743
395 HA TRP 51 HA TRP 51 5.444 -2.925 1.068
396 HB2 TRP 51 2HB TRP 51 8.445 -2.764 0.682
397 HB3 TRP 51 3HB TRP 51 7.296 -1.462 0.402
398 HD1 TRP 51 HD1 TRP 51 9.175 -3.222 3.148
399 HE1 TRP 51 HE1 TRP 51 8.854 -1.987 5.371
400 HE3 TRP 51 HE3 TRP 51 5.440 0.016 1.749
401 HZ2 TRP 51 HZ2 TRP 51 7.170 0.090 6.429
402 HZ3 TRP 51 HZ3 TRP 51 4.472 1.594 3.431
403 HH2 TRP 51 HH2 TRP 51 5.373 1.663 5.743
404 H TYR 52 H TYR 52 4.861 -2.216 -0.951
405 HA TYR 52 HA TYR 52 6.329 -3.064 -3.327
406 HB2 TYR 52 2HB TYR 52 3.466 -3.523 -3.762
407 HB3 TYR 52 3HB TYR 52 4.900 -4.416 -4.273
408 HD1 TYR 52 HD2 TYR 52 2.662 -4.010 -1.257
409 HD2 TYR 52 HD1 TYR 52 5.301 -6.532 -3.539
410 HE1 TYR 52 HE2 TYR 52 1.964 -6.007 0.107
411 HE2 TYR 52 HE1 TYR 52 4.574 -8.508 -2.206
412 HH TYR 52 HH TYR 52 3.305 -9.269 -0.500
413 H HIS 53 H HIS 53 5.587 -1.897 -5.258
414 HA HIS 53 HA HIS 53 4.934 0.888 -4.881
415 HB2 HIS 53 2HB HIS 53 4.529 -0.832 -7.362
416 HB3 HIS 53 3HB HIS 53 4.535 0.914 -7.307
417 HD2 HIS 53 HD2 HIS 53 6.897 2.130 -6.559
418 HE1 HIS 53 HE1 HIS 53 9.415 -1.028 -7.901
419 HE2 HIS 53 HE2 HIS 53 9.362 1.381 -7.132
420 H PHE 54 H PHE 54 2.911 2.012 -5.407
421 HA PHE 54 HA PHE 54 0.654 1.052 -4.100
422 HB2 PHE 54 2HB PHE 54 0.776 3.346 -4.545
423 HB3 PHE 54 3HB PHE 54 1.027 3.116 -6.266
424 HD1 PHE 54 HD2 PHE 54 -1.643 2.456 -3.627
425 HD2 PHE 54 HD1 PHE 54 -0.747 3.429 -7.743
426 HE1 PHE 54 HE2 PHE 54 -4.063 2.607 -4.133
427 HE2 PHE 54 HE1 PHE 54 -3.176 3.604 -8.216
428 HZ PHE 54 HZ PHE 54 -4.830 3.131 -6.427
429 H SER 55 H SER 55 1.383 0.629 -7.611
430 HA SER 55 HA SER 55 -1.167 -0.680 -8.187
431 HB2 SER 55 2HB SER 55 -0.085 -1.043 -10.412
432 HB3 SER 55 3HB SER 55 -0.199 0.653 -9.898
433 HG SER 55 HG SER 55 1.893 0.107 -10.746
434 H CYS 56 HN CYS 56 2.230 -1.696 -7.662
435 HA CYS 56 HA CYS 56 1.992 -4.363 -8.319
436 HB2 CYS 56 2HB CYS 56 3.744 -2.966 -6.291
437 HB3 CYS 56 3HB CYS 56 3.917 -4.675 -6.690
438 H PHE 57 H PHE 57 1.102 -2.843 -5.223
439 HA PHE 57 HA PHE 57 0.586 -5.035 -3.543
440 HB2 PHE 57 2HB PHE 57 0.398 -2.736 -2.861
441 HB3 PHE 57 3HB PHE 57 -0.979 -2.470 -3.923
442 HD1 PHE 57 HD2 PHE 57 -3.148 -3.723 -3.501
443 HD2 PHE 57 HD1 PHE 57 0.075 -3.657 -0.641
444 HE1 PHE 57 HE2 PHE 57 -4.698 -4.522 -1.756
445 HE2 PHE 57 HE1 PHE 57 -1.528 -4.297 1.147
446 HZ PHE 57 HZ PHE 57 -3.898 -4.805 0.572
447 H TRP 58 H TRP 58 -1.683 -3.614 -5.954
448 HA TRP 58 HA TRP 58 -3.703 -5.642 -5.528
449 HB2 TRP 58 2HB TRP 58 -3.463 -3.729 -7.865
450 HB3 TRP 58 3HB TRP 58 -4.914 -4.511 -7.239
451 HD1 TRP 58 HD1 TRP 58 -2.712 -1.511 -6.800
452 HE1 TRP 58 HE1 TRP 58 -3.472 -0.014 -4.886
453 HE3 TRP 58 HE3 TRP 58 -6.382 -4.516 -4.859
454 HZ2 TRP 58 HZ2 TRP 58 -5.504 -0.062 -2.799
455 HZ3 TRP 58 HZ3 TRP 58 -7.706 -3.756 -2.913
456 HH2 TRP 58 HH2 TRP 58 -7.267 -1.534 -1.881
457 H LYS 59 H LYS 59 -1.015 -5.274 -7.759
458 HA LYS 59 HA LYS 59 -1.610 -7.451 -9.543
459 HB2 LYS 59 2HB LYS 59 -0.072 -5.437 -9.834
460 HB3 LYS 59 3HB LYS 59 1.075 -6.280 -8.785
461 HG2 LYS 59 2HG LYS 59 1.391 -8.036 -10.394
462 HG3 LYS 59 3HG LYS 59 0.034 -7.446 -11.374
463 HD2 LYS 59 2HD LYS 59 2.162 -6.761 -12.401
464 HD3 LYS 59 3HD LYS 59 1.238 -5.361 -11.850
465 HE2 LYS 59 2HE LYS 59 2.700 -5.609 -9.652
466 HE3 LYS 59 3HE LYS 59 3.769 -6.566 -10.667
467 HZ1 LYS 59 3HZ LYS 59 4.202 -4.100 -10.472
468 HZ2 LYS 59 1HZ LYS 59 4.136 -4.645 -12.035
469 HZ3 LYS 59 2HZ LYS 59 2.886 -3.815 -11.366
470 H VAL 60 H VAL 60 -0.279 -7.428 -6.250
471 HA VAL 60 HA VAL 60 0.605 -10.203 -6.312
472 HB VAL 60 HB VAL 60 -0.522 -8.855 -3.845
473 HG11 VAL 60 1HG1 VAL 60 1.686 -10.933 -4.233
474 HG12 VAL 60 2HG1 VAL 60 1.165 -10.249 -2.678
475 HG13 VAL 60 3HG1 VAL 60 0.063 -11.262 -3.593
476 HG21 VAL 60 3HG2 VAL 60 1.083 -7.254 -4.566
477 HG22 VAL 60 1HG2 VAL 60 1.856 -8.193 -3.325
478 HG23 VAL 60 2HG2 VAL 60 2.259 -8.507 -5.027
479 H GLY 61 H GLY 61 -2.560 -8.788 -6.435
480 HA2 GLY 61 2HA GLY 61 -4.534 -9.932 -6.919
481 HA3 GLY 61 3HA GLY 61 -3.862 -11.441 -6.301
482 H HIS 62 H HIS 62 -3.376 -8.830 -4.121
483 HA HIS 62 HA HIS 62 -5.401 -9.836 -2.241
484 HB2 HIS 62 2HB HIS 62 -3.199 -7.767 -2.070
485 HB3 HIS 62 3HB HIS 62 -4.462 -7.862 -0.847
486 HD2 HIS 62 HD2 HIS 62 -1.749 -10.198 -2.397
487 HE1 HIS 62 HE1 HIS 62 -2.635 -11.655 1.508
488 HE2 HIS 62 HE2 HIS 62 -1.142 -11.958 -0.532
489 H SER 63 H SER 63 -7.016 -8.613 -1.273
490 HA SER 63 HA SER 63 -8.014 -6.190 -2.647
491 HB2 SER 63 2HB SER 63 -9.065 -8.180 -3.746
492 HB3 SER 63 3HB SER 63 -9.753 -8.638 -2.173
493 HG SER 63 HG SER 63 -11.192 -7.362 -3.472
494 H ILE 64 H ILE 64 -9.673 -5.084 -1.381
495 HA ILE 64 HA ILE 64 -9.293 -5.435 1.564
496 HB ILE 64 HB ILE 64 -8.945 -2.787 0.124
497 HG12 ILE 64 2HG1 ILE 64 -6.751 -4.704 1.003
498 HG13 ILE 64 3HG1 ILE 64 -7.105 -4.167 -0.636
499 HG21 ILE 64 1HG2 ILE 64 -8.283 -3.684 2.963
500 HG22 ILE 64 2HG2 ILE 64 -7.987 -2.080 2.287
501 HG23 ILE 64 3HG2 ILE 64 -9.644 -2.644 2.483
502 HD11 ILE 64 3HD1 ILE 64 -6.676 -1.751 0.299
503 HD12 ILE 64 1HD1 ILE 64 -5.811 -2.638 1.585
504 HD13 ILE 64 2HD1 ILE 64 -5.322 -2.805 -0.103
505 H ARG 65 H ARG 65 -11.179 -5.395 2.551
506 HA ARG 65 HA ARG 65 -13.607 -4.596 1.081
507 HB2 ARG 65 2HB ARG 65 -14.801 -5.629 3.030
508 HB3 ARG 65 3HB ARG 65 -13.843 -6.703 2.029
509 HG2 ARG 65 2HG ARG 65 -12.599 -5.560 4.534
510 HG3 ARG 65 3HG ARG 65 -13.794 -6.847 4.680
511 HD2 ARG 65 2HD ARG 65 -12.499 -8.361 3.340
512 HD3 ARG 65 3HD ARG 65 -11.345 -7.114 2.888
513 HE ARG 65 HE ARG 65 -10.662 -6.944 5.278
514 HH11 ARG 65 1HH2 ARG 65 -11.993 -10.035 4.242
515 HH12 ARG 65 2HH2 ARG 65 -11.371 -10.848 5.652
516 HH21 ARG 65 1HH1 ARG 65 -10.153 -7.953 7.077
517 HH22 ARG 65 2HH1 ARG 65 -10.279 -9.702 7.216
518 H HIS 66 H HIS 66 -11.721 -3.294 3.634
519 HA HIS 66 HA HIS 66 -13.206 -0.781 3.569
520 HB2 HIS 66 2HB HIS 66 -13.378 -0.706 6.106
521 HB3 HIS 66 3HB HIS 66 -14.584 -1.593 5.202
522 HD2 HIS 66 HD2 HIS 66 -11.361 -3.557 5.869
523 HE1 HIS 66 HE1 HIS 66 -14.237 -4.938 8.691
524 HE2 HIS 66 HE2 HIS 66 -11.917 -5.355 7.694
525 HA PRO 67 HA PRO 67 -8.679 -0.558 3.901
526 HB2 PRO 67 2HB PRO 67 -8.244 1.713 2.352
527 HB3 PRO 67 3HB PRO 67 -8.426 0.066 1.677
528 HG2 PRO 67 2HG PRO 67 -10.539 2.198 1.996
529 HG3 PRO 67 3HG PRO 67 -10.188 1.192 0.549
530 HD2 PRO 67 2HD PRO 67 -12.205 0.567 2.231
531 HD3 PRO 67 3HD PRO 67 -11.174 -0.728 1.547
532 H ASP 68 H ASP 68 -11.044 1.967 4.641
533 HA ASP 68 HA ASP 68 -9.231 3.643 6.098
534 HB2 ASP 68 2HB ASP 68 -11.417 4.405 5.251
535 HB3 ASP 68 3HB ASP 68 -12.248 3.235 6.273
536 H VAL 69 H VAL 69 -10.503 0.538 6.771
537 HA VAL 69 HA VAL 69 -10.047 0.727 9.696
538 HB VAL 69 HB VAL 69 -11.357 -1.470 8.060
539 HG11 VAL 69 1HG1 VAL 69 -11.194 -1.082 11.074
540 HG12 VAL 69 2HG1 VAL 69 -12.184 -2.301 10.238
541 HG13 VAL 69 3HG1 VAL 69 -10.427 -2.381 10.130
542 HG21 VAL 69 3HG2 VAL 69 -12.612 0.673 9.825
543 HG22 VAL 69 1HG2 VAL 69 -12.747 0.564 8.057
544 HG23 VAL 69 2HG2 VAL 69 -13.474 -0.686 9.066
545 H GLU 70 H GLU 70 -8.988 -0.987 6.768
546 HA GLU 70 HA GLU 70 -7.012 -2.547 8.406
547 HB2 GLU 70 2HB GLU 70 -8.403 -3.167 5.780
548 HB3 GLU 70 3HB GLU 70 -7.127 -4.173 6.491
549 HG2 GLU 70 2HG GLU 70 -8.447 -4.525 8.516
550 HG3 GLU 70 3HG GLU 70 -9.751 -3.524 7.877
551 H VAL 71 H VAL 71 -6.957 -0.141 5.933
552 HA VAL 71 HA VAL 71 -4.073 -0.669 5.286
553 HB VAL 71 HB VAL 71 -5.881 1.477 4.198
554 HG11 VAL 71 1HG1 VAL 71 -3.463 2.004 4.291
555 HG12 VAL 71 2HG1 VAL 71 -3.101 0.478 3.461
556 HG13 VAL 71 3HG1 VAL 71 -4.047 1.748 2.633
557 HG21 VAL 71 3HG2 VAL 71 -4.806 -1.102 2.969
558 HG22 VAL 71 1HG2 VAL 71 -6.486 -0.865 3.452
559 HG23 VAL 71 2HG2 VAL 71 -5.801 0.121 2.146
560 H ASP 72 H ASP 72 -2.978 -0.349 7.074
561 HA ASP 72 HA ASP 72 -3.219 1.863 8.897
562 HB2 ASP 72 2HB ASP 72 -2.095 -0.267 9.329
563 HB3 ASP 72 3HB ASP 72 -0.876 0.086 8.105
564 H GLY 73 H GLY 73 -2.208 3.894 8.871
565 HA2 GLY 73 2HA GLY 73 -1.061 5.735 8.053
566 HA3 GLY 73 3HA GLY 73 -0.373 4.737 6.774
567 H PHE 74 H PHE 74 -3.661 4.254 6.476
568 HA PHE 74 HA PHE 74 -4.061 5.836 4.154
569 HB2 PHE 74 2HB PHE 74 -5.325 3.828 4.726
570 HB3 PHE 74 3HB PHE 74 -6.016 4.616 6.139
571 HD1 PHE 74 HD2 PHE 74 -5.992 4.542 2.416
572 HD2 PHE 74 HD1 PHE 74 -7.964 6.023 5.956
573 HE1 PHE 74 HE2 PHE 74 -7.950 5.263 1.045
574 HE2 PHE 74 HE1 PHE 74 -9.910 6.723 4.574
575 HZ PHE 74 HZ PHE 74 -9.873 6.373 2.123
576 H SER 75 H SER 75 -4.481 6.696 7.543
577 HA SER 75 HA SER 75 -5.958 9.136 7.243
578 HB2 SER 75 2HB SER 75 -4.914 9.587 9.524
579 HB3 SER 75 3HB SER 75 -5.893 8.114 9.375
580 HG SER 75 HG SER 75 -3.873 7.760 10.458
581 H GLU 76 H GLU 76 -2.575 8.406 6.601
582 HA GLU 76 HA GLU 76 -1.723 11.214 6.860
583 HB2 GLU 76 2HB GLU 76 -0.228 8.757 5.865
584 HB3 GLU 76 3HB GLU 76 0.480 10.338 6.142
585 HG2 GLU 76 2HG GLU 76 -0.785 8.604 8.312
586 HG3 GLU 76 3HG GLU 76 0.931 8.719 7.967
587 H LEU 77 H LEU 77 -3.171 9.334 4.400
588 HA LEU 77 HA LEU 77 -1.979 10.647 2.088
589 HB2 LEU 77 2HB LEU 77 -4.495 8.990 2.420
590 HB3 LEU 77 3HB LEU 77 -3.874 9.555 0.876
591 HG LEU 77 HG LEU 77 -2.434 7.614 2.745
592 HD11 LEU 77 1HD1 LEU 77 -3.010 5.993 0.929
593 HD12 LEU 77 2HD1 LEU 77 -4.455 6.669 1.700
594 HD13 LEU 77 3HD1 LEU 77 -3.935 7.253 0.104
595 HD21 LEU 77 3HD2 LEU 77 -1.720 8.528 -0.069
596 HD22 LEU 77 1HD2 LEU 77 -0.809 8.891 1.417
597 HD23 LEU 77 2HD2 LEU 77 -0.925 7.230 0.852
598 H ARG 78 H ARG 78 -2.968 12.109 0.666
599 HA ARG 78 HA ARG 78 -4.892 14.029 1.807
600 HB2 ARG 78 2HB ARG 78 -3.483 13.779 -0.890
601 HB3 ARG 78 3HB ARG 78 -4.786 14.931 -0.658
602 HG2 ARG 78 2HG ARG 78 -2.245 14.885 1.026
603 HG3 ARG 78 3HG ARG 78 -2.541 15.936 -0.366
604 HD2 ARG 78 2HD ARG 78 -4.584 16.838 0.787
605 HD3 ARG 78 3HD ARG 78 -4.176 15.916 2.222
606 HE ARG 78 HE ARG 78 -2.890 18.360 1.242
607 HH11 ARG 78 1HH2 ARG 78 -2.397 15.640 3.406
608 HH12 ARG 78 2HH2 ARG 78 -1.208 16.497 4.347
609 HH21 ARG 78 1HH1 ARG 78 -1.369 19.380 2.483
610 HH22 ARG 78 2HH1 ARG 78 -0.645 18.555 3.833
611 H TRP 79 H TRP 79 -6.835 14.618 0.769
612 HA TRP 79 HA TRP 79 -8.630 12.525 0.834
613 HB2 TRP 79 2HB TRP 79 -9.776 14.384 1.243
614 HB3 TRP 79 3HB TRP 79 -8.708 15.390 0.293
615 HD1 TRP 79 HD1 TRP 79 -12.031 13.583 0.061
616 HE1 TRP 79 HE1 TRP 79 -13.253 14.335 -2.075
617 HE3 TRP 79 HE3 TRP 79 -8.232 16.185 -2.147
618 HZ2 TRP 79 HZ2 TRP 79 -12.638 15.871 -4.458
619 HZ3 TRP 79 HZ3 TRP 79 -8.548 17.257 -4.363
620 HH2 TRP 79 HH2 TRP 79 -10.748 17.112 -5.527
621 H ASP 80 H ASP 80 -7.242 13.966 -2.156
622 HA ASP 80 HA ASP 80 -8.794 12.450 -3.986
623 HB2 ASP 80 2HB ASP 80 -7.480 14.505 -4.496
624 HB3 ASP 80 3HB ASP 80 -5.991 13.571 -4.338
625 H ASP 81 H ASP 81 -6.027 11.447 -2.119
626 HA ASP 81 HA ASP 81 -5.496 9.044 -3.786
627 HB2 ASP 81 2HB ASP 81 -4.056 10.293 -1.431
628 HB3 ASP 81 3HB ASP 81 -3.770 8.627 -1.924
629 H GLN 82 H GLN 82 -6.866 10.040 -0.614
630 HA GLN 82 HA GLN 82 -7.552 7.411 0.273
631 HB2 GLN 82 2HB GLN 82 -8.820 10.135 0.742
632 HB3 GLN 82 3HB GLN 82 -9.428 8.657 1.489
633 HG2 GLN 82 2HG GLN 82 -7.246 8.233 2.530
634 HG3 GLN 82 3HG GLN 82 -6.582 9.692 1.789
635 HE21 GLN 82 2HE2 GLN 82 -6.525 9.279 4.584
636 HE22 GLN 82 1HE2 GLN 82 -7.577 10.503 5.306
637 H GLN 83 H GLN 83 -9.454 9.729 -1.771
638 HA GLN 83 HA GLN 83 -11.667 8.010 -2.249
639 HB2 GLN 83 2HB GLN 83 -10.405 10.089 -4.095
640 HB3 GLN 83 3HB GLN 83 -11.962 9.304 -4.367
641 HG2 GLN 83 2HG GLN 83 -12.724 10.237 -2.123
642 HG3 GLN 83 3HG GLN 83 -11.264 11.227 -2.133
643 HE21 GLN 83 2HE2 GLN 83 -10.980 12.291 -4.599
644 HE22 GLN 83 1HE2 GLN 83 -12.445 13.121 -5.084
645 H LYS 84 H LYS 84 -8.467 8.051 -3.863
646 HA LYS 84 HA LYS 84 -9.331 6.249 -5.993
647 HB2 LYS 84 2HB LYS 84 -7.941 8.158 -6.471
648 HB3 LYS 84 3HB LYS 84 -6.748 7.647 -5.282
649 HG2 LYS 84 2HG LYS 84 -7.316 5.618 -7.398
650 HG3 LYS 84 3HG LYS 84 -6.675 7.138 -8.020
651 HD2 LYS 84 2HD LYS 84 -5.410 5.633 -5.708
652 HD3 LYS 84 3HD LYS 84 -4.920 5.418 -7.411
653 HE2 LYS 84 2HE LYS 84 -4.303 7.785 -7.592
654 HE3 LYS 84 3HE LYS 84 -4.943 8.112 -5.985
655 HZ1 LYS 84 3HZ LYS 84 -2.473 6.683 -6.651
656 HZ2 LYS 84 1HZ LYS 84 -2.750 7.911 -5.567
657 HZ3 LYS 84 2HZ LYS 84 -3.226 6.396 -5.218
658 H VAL 85 H VAL 85 -7.389 6.035 -2.985
659 HA VAL 85 HA VAL 85 -6.719 3.223 -3.356
660 HB VAL 85 HB VAL 85 -6.914 4.994 -0.902
661 HG11 VAL 85 1HG1 VAL 85 -6.096 2.050 -0.957
662 HG12 VAL 85 2HG1 VAL 85 -5.793 3.164 0.388
663 HG13 VAL 85 3HG1 VAL 85 -7.451 2.763 -0.044
664 HG21 VAL 85 3HG2 VAL 85 -4.517 3.582 -2.142
665 HG22 VAL 85 1HG2 VAL 85 -4.967 5.263 -2.499
666 HG23 VAL 85 2HG2 VAL 85 -4.508 4.799 -0.856
667 H LYS 86 H LYS 86 -9.509 4.882 -1.746
668 HA LYS 86 HA LYS 86 -10.971 2.485 -1.125
669 HB2 LYS 86 2HB LYS 86 -11.899 5.329 -1.694
670 HB3 LYS 86 3HB LYS 86 -12.976 4.026 -1.185
671 HG2 LYS 86 2HG LYS 86 -11.725 3.747 0.919
672 HG3 LYS 86 3HG LYS 86 -10.567 4.976 0.434
673 HD2 LYS 86 2HD LYS 86 -12.053 6.088 1.902
674 HD3 LYS 86 3HD LYS 86 -12.563 6.607 0.288
675 HE2 LYS 86 2HE LYS 86 -14.332 4.789 0.372
676 HE3 LYS 86 3HE LYS 86 -13.789 4.407 2.016
677 HZ1 LYS 86 3HZ LYS 86 -14.919 7.023 1.160
678 HZ2 LYS 86 1HZ LYS 86 -15.708 5.900 2.039
679 HZ3 LYS 86 2HZ LYS 86 -14.419 6.670 2.676
680 H LYS 87 H LYS 87 -11.116 4.540 -4.082
681 HA LYS 87 HA LYS 87 -13.008 2.882 -5.465
682 HB2 LYS 87 2HB LYS 87 -12.473 5.185 -6.085
683 HB3 LYS 87 3HB LYS 87 -10.869 4.679 -6.653
684 HG2 LYS 87 2HG LYS 87 -11.828 3.326 -8.411
685 HG3 LYS 87 3HG LYS 87 -13.458 3.459 -7.712
686 HD2 LYS 87 2HD LYS 87 -13.493 5.857 -8.144
687 HD3 LYS 87 3HD LYS 87 -11.845 5.789 -8.818
688 HE2 LYS 87 2HE LYS 87 -12.640 4.232 -10.588
689 HE3 LYS 87 3HE LYS 87 -14.273 4.289 -9.914
690 HZ1 LYS 87 3HZ LYS 87 -12.817 6.623 -11.045
691 HZ2 LYS 87 1HZ LYS 87 -14.034 5.823 -11.781
692 HZ3 LYS 87 2HZ LYS 87 -14.328 6.674 -10.422
693 H THR 88 H THR 88 -9.422 2.744 -5.487
694 HA THR 88 HA THR 88 -9.230 0.554 -7.275
695 HB THR 88 HB THR 88 -7.211 1.294 -5.138
696 HG1 THR 88 1HG THR 88 -7.647 3.064 -6.398
697 HG21 THR 88 1HG2 THR 88 -7.016 -0.032 -7.870
698 HG22 THR 88 2HG2 THR 88 -5.631 0.407 -6.852
699 HG23 THR 88 3HG2 THR 88 -6.759 -0.855 -6.320
700 H ALA 89 H ALA 89 -9.794 0.607 -3.766
701 HA ALA 89 HA ALA 89 -9.425 -2.218 -3.333
702 HB1 ALA 89 1HB ALA 89 -10.970 -0.119 -1.755
703 HB2 ALA 89 2HB ALA 89 -10.471 -1.713 -1.185
704 HB3 ALA 89 3HB ALA 89 -9.245 -0.494 -1.566
705 H GLU 90 H GLU 90 -12.224 -0.152 -4.215
706 HA GLU 90 HA GLU 90 -14.077 -2.378 -4.272
707 HB2 GLU 90 2HB GLU 90 -14.236 0.398 -5.509
708 HB3 GLU 90 3HB GLU 90 -15.535 -0.795 -5.565
709 HG2 GLU 90 2HG GLU 90 -15.546 -0.866 -3.060
710 HG3 GLU 90 3HG GLU 90 -14.364 0.443 -3.044
711 H ALA 91 H ALA 91 -12.023 -0.828 -6.699
712 HA ALA 91 HA ALA 91 -13.051 -2.275 -8.967
713 HB1 ALA 91 1HB ALA 91 -10.526 -0.612 -8.551
714 HB2 ALA 91 2HB ALA 91 -11.204 -1.092 -10.122
715 HB3 ALA 91 3HB ALA 91 -12.105 0.007 -9.056
716 H GLY 92 H GLY 92 -10.566 -3.044 -6.628
717 HA2 GLY 92 2HA GLY 92 -9.421 -5.029 -6.299
718 HA3 GLY 92 3HA GLY 92 -10.031 -5.667 -7.827
719 H GLY 93 H GLY 93 -8.560 -2.555 -8.161
720 HA2 GLY 93 2HA GLY 93 -5.971 -2.543 -8.137
721 HA3 GLY 93 3HA GLY 93 -6.127 -3.736 -9.424
722 H VAL 94 H VAL 94 -4.960 -1.050 -9.319
723 HA VAL 94 HA VAL 94 -5.839 -0.174 -11.952
724 HB VAL 94 HB VAL 94 -7.170 1.149 -10.113
725 HG11 VAL 94 1HG1 VAL 94 -4.626 2.826 -10.100
726 HG12 VAL 94 2HG1 VAL 94 -6.155 3.153 -9.269
727 HG13 VAL 94 3HG1 VAL 94 -5.151 1.788 -8.755
728 HG21 VAL 94 3HG2 VAL 94 -7.276 3.103 -11.511
729 HG22 VAL 94 1HG2 VAL 94 -5.751 2.693 -12.313
730 HG23 VAL 94 2HG2 VAL 94 -7.184 1.658 -12.526
731 H THR 95 H THR 95 -4.244 1.406 -12.893
732 HA THR 95 HA THR 95 -1.518 1.102 -11.711
733 HB THR 95 HB THR 95 -0.646 0.853 -14.007
734 HG1 THR 95 1HG THR 95 -2.117 0.294 -15.633
735 HG21 THR 95 1HG2 THR 95 -2.719 -1.267 -13.254
736 HG22 THR 95 2HG2 THR 95 -1.279 -1.497 -14.274
737 HG23 THR 95 3HG2 THR 95 -1.100 -1.130 -12.549
738 H GLY 96 H GLY 96 0.013 2.673 -12.108
739 HA2 GLY 96 2HA GLY 96 -1.072 5.393 -12.243
740 HA3 GLY 96 3HA GLY 96 0.559 4.909 -11.803
741 H LYS 97 H LYS 97 0.598 7.020 -13.156
742 HA LYS 97 HA LYS 97 1.580 6.340 -15.892
743 HB2 LYS 97 2HB LYS 97 -0.123 8.761 -15.150
744 HB3 LYS 97 3HB LYS 97 0.747 8.567 -16.675
745 HG2 LYS 97 2HG LYS 97 -0.561 6.494 -17.153
746 HG3 LYS 97 3HG LYS 97 -1.499 6.768 -15.672
747 HD2 LYS 97 2HD LYS 97 -2.263 8.957 -16.551
748 HD3 LYS 97 3HD LYS 97 -1.327 8.685 -18.038
749 HE2 LYS 97 2HE LYS 97 -2.650 6.625 -18.485
750 HE3 LYS 97 3HE LYS 97 -3.587 6.906 -17.013
751 HZ1 LYS 97 3HZ LYS 97 -4.747 7.748 -18.974
752 HZ2 LYS 97 1HZ LYS 97 -4.373 8.998 -17.994
753 HZ3 LYS 97 2HZ LYS 97 -3.507 8.736 -19.356
754 H GLY 98 H GLY 98 3.166 7.843 -16.712
755 HA2 GLY 98 2HA GLY 98 5.083 9.162 -16.543
756 HA3 GLY 98 3HA GLY 98 4.606 9.652 -14.921
757 H GLN 99 H GLN 99 7.029 9.410 -14.711
758 HA GLN 99 HA GLN 99 8.159 6.717 -14.640
759 HB2 GLN 99 2HB GLN 99 9.296 9.412 -13.818
760 HB3 GLN 99 3HB GLN 99 10.190 7.884 -13.805
761 HG2 GLN 99 2HG GLN 99 9.802 7.629 -16.248
762 HG3 GLN 99 3HG GLN 99 8.953 9.175 -16.279
763 HE21 GLN 99 2HE2 GLN 99 10.907 9.190 -18.022
764 HE22 GLN 99 1HE2 GLN 99 12.341 10.006 -17.408
765 H ASP 100 H ASP 100 8.557 5.425 -12.955
766 HA ASP 100 HA ASP 100 8.539 6.313 -10.182
767 HB2 ASP 100 2HB ASP 100 6.111 5.899 -10.654
768 HB3 ASP 100 3HB ASP 100 6.508 4.248 -11.129
769 H GLY 101 H GLY 101 9.188 4.508 -8.730
770 HA2 GLY 101 2HA GLY 101 10.468 2.635 -8.188
771 HA3 GLY 101 3HA GLY 101 10.530 2.151 -9.872
772 H ILE 102 H ILE 102 12.670 2.043 -8.012
773 HA ILE 102 HA ILE 102 14.702 3.470 -9.567
774 HB ILE 102 HB ILE 102 14.186 4.987 -7.711
775 HG12 ILE 102 2HG1 ILE 102 16.400 5.414 -6.829
776 HG13 ILE 102 3HG1 ILE 102 16.968 3.825 -7.326
777 HG21 ILE 102 1HG2 ILE 102 13.541 3.259 -5.992
778 HG22 ILE 102 2HG2 ILE 102 15.276 2.916 -5.782
779 HG23 ILE 102 3HG2 ILE 102 14.634 4.515 -5.404
780 HD11 ILE 102 3HD1 ILE 102 15.976 6.002 -9.222
781 HD12 ILE 102 1HD1 ILE 102 17.678 5.655 -8.854
782 HD13 ILE 102 2HD1 ILE 102 16.700 4.446 -9.698
783 H GLY 103 H GLY 103 16.867 2.544 -9.352
784 HA2 GLY 103 2HA GLY 103 16.749 -0.366 -9.196
785 HA3 GLY 103 3HA GLY 103 18.137 0.613 -9.652
786 H SER 104 H SER 104 17.897 -1.730 -7.861
787 HA SER 104 HA SER 104 19.794 -0.804 -5.867
788 HB2 SER 104 2HB SER 104 17.582 -0.481 -4.704
789 HB3 SER 104 3HB SER 104 17.292 -2.224 -4.868
790 HG SER 104 HG SER 104 18.259 -1.617 -2.842
791 H LYS 105 H LYS 105 20.821 -2.673 -4.749
792 HA LYS 105 HA LYS 105 20.459 -5.332 -5.957
793 HB2 LYS 105 2HB LYS 105 22.072 -3.929 -7.434
794 HB3 LYS 105 3HB LYS 105 23.195 -3.992 -6.085
795 HG2 LYS 105 2HG LYS 105 23.845 -5.682 -7.606
796 HG3 LYS 105 3HG LYS 105 23.107 -6.543 -6.256
797 HD2 LYS 105 2HD LYS 105 20.973 -6.713 -7.583
798 HD3 LYS 105 3HD LYS 105 21.762 -5.892 -8.927
799 HE2 LYS 105 2HE LYS 105 22.593 -8.576 -7.723
800 HE3 LYS 105 3HE LYS 105 21.631 -8.358 -9.187
801 HZ1 LYS 105 3HZ LYS 105 24.475 -7.583 -8.810
802 HZ2 LYS 105 1HZ LYS 105 23.885 -8.700 -9.830
803 HZ3 LYS 105 2HZ LYS 105 23.585 -7.122 -10.121
804 H ALA 106 H ALA 106 21.147 -7.004 -4.691
805 HA ALA 106 HA ALA 106 21.588 -6.481 -1.885
806 HB1 ALA 106 1HB ALA 106 21.395 -8.919 -1.690
807 HB2 ALA 106 2HB ALA 106 20.130 -8.285 -2.756
808 HB3 ALA 106 3HB ALA 106 21.557 -9.095 -3.450
809 H GLU 107 H GLU 107 23.881 -6.363 -4.260
810 HA GLU 107 HA GLU 107 26.028 -7.711 -2.801
811 HB2 GLU 107 2HB GLU 107 26.014 -5.996 -5.319
812 HB3 GLU 107 3HB GLU 107 27.446 -6.804 -4.668
813 HG2 GLU 107 2HG GLU 107 26.353 -9.006 -4.919
814 HG3 GLU 107 3HG GLU 107 24.912 -8.232 -5.580
815 H LYS 108 H LYS 108 24.561 -4.715 -2.408
816 HA LYS 108 HA LYS 108 26.870 -3.076 -1.736
817 HB2 LYS 108 2HB LYS 108 24.710 -2.191 -2.592
818 HB3 LYS 108 3HB LYS 108 23.920 -2.687 -1.088
819 HG2 LYS 108 2HG LYS 108 25.450 -1.193 0.198
820 HG3 LYS 108 3HG LYS 108 26.225 -0.690 -1.310
821 HD2 LYS 108 2HD LYS 108 23.286 -0.266 -0.598
822 HD3 LYS 108 3HD LYS 108 24.566 0.944 -0.434
823 HE2 LYS 108 2HE LYS 108 25.002 0.806 -2.889
824 HE3 LYS 108 3HE LYS 108 23.671 -0.348 -3.049
825 HZ1 LYS 108 3HZ LYS 108 22.946 1.913 -3.552
826 HZ2 LYS 108 1HZ LYS 108 22.161 1.379 -2.223
827 HZ3 LYS 108 2HZ LYS 108 23.391 2.445 -2.077
Start of MODEL 12
1 H1 MET 1 H1 MET 1 -5.238 -4.648 25.772
2 H2 MET 1 H2 MET 1 -6.454 -4.376 24.712
3 H3 MET 1 H3 MET 1 -5.603 -3.118 25.336
4 HA MET 1 HA MET 1 -4.490 -5.214 23.598
5 HB2 MET 1 2HB MET 1 -4.356 -3.615 21.801
6 HB3 MET 1 3HB MET 1 -6.025 -3.786 22.325
7 HG2 MET 1 2HG MET 1 -5.835 -1.640 23.583
8 HG3 MET 1 3HG MET 1 -4.162 -1.480 23.035
9 HE1 MET 1 1HE MET 1 -4.637 0.947 22.158
10 HE2 MET 1 2HE MET 1 -5.976 1.362 21.066
11 HE3 MET 1 3HE MET 1 -6.320 0.812 22.721
12 H ALA 2 H ALA 2 -2.339 -5.016 23.010
13 HA ALA 2 HA ALA 2 -0.636 -2.968 24.336
14 HB1 ALA 2 1HB ALA 2 0.830 -4.713 25.279
15 HB2 ALA 2 2HB ALA 2 -0.809 -4.855 25.933
16 HB3 ALA 2 3HB ALA 2 -0.257 -5.979 24.670
17 H GLU 3 H GLU 3 -1.383 -4.676 21.557
18 HA GLU 3 HA GLU 3 1.364 -4.603 20.415
19 HB2 GLU 3 2HB GLU 3 0.536 -6.232 18.802
20 HB3 GLU 3 3HB GLU 3 0.456 -6.818 20.453
21 HG2 GLU 3 2HG GLU 3 -1.985 -5.665 19.031
22 HG3 GLU 3 3HG GLU 3 -1.495 -7.339 18.850
23 H SER 4 H SER 4 1.729 -3.912 18.293
24 HA SER 4 HA SER 4 -0.124 -1.791 17.310
25 HB2 SER 4 2HB SER 4 1.928 -0.681 16.510
26 HB3 SER 4 3HB SER 4 1.919 -0.936 18.262
27 HG SER 4 HG SER 4 3.932 -1.529 17.322
28 H SER 5 H SER 5 0.665 -4.849 16.410
29 HA SER 5 HA SER 5 0.787 -4.285 13.486
30 HB2 SER 5 2HB SER 5 1.695 -6.525 13.234
31 HB3 SER 5 3HB SER 5 2.677 -5.561 14.339
32 HG SER 5 HG SER 5 2.021 -6.766 16.017
33 H ASP 6 H ASP 6 -1.680 -4.064 14.958
34 HA ASP 6 HA ASP 6 -3.143 -6.464 14.202
35 HB2 ASP 6 2HB ASP 6 -3.243 -5.442 16.484
36 HB3 ASP 6 3HB ASP 6 -4.109 -4.071 15.793
37 H LYS 7 H LYS 7 -2.353 -4.938 11.955
38 HA LYS 7 HA LYS 7 -4.887 -4.651 10.587
39 HB2 LYS 7 2HB LYS 7 -3.760 -2.447 9.495
40 HB3 LYS 7 3HB LYS 7 -5.033 -2.463 10.697
41 HG2 LYS 7 2HG LYS 7 -3.424 -0.822 11.300
42 HG3 LYS 7 3HG LYS 7 -3.398 -2.107 12.499
43 HD2 LYS 7 2HD LYS 7 -1.322 -3.031 11.446
44 HD3 LYS 7 3HD LYS 7 -1.384 -1.752 10.227
45 HE2 LYS 7 2HE LYS 7 -1.411 -0.093 12.228
46 HE3 LYS 7 3HE LYS 7 -1.011 -1.482 13.243
47 HZ1 LYS 7 3HZ LYS 7 1.007 -0.426 12.644
48 HZ2 LYS 7 1HZ LYS 7 0.977 -1.774 11.725
49 HZ3 LYS 7 2HZ LYS 7 0.610 -0.300 11.061
50 H LEU 8 H LEU 8 -4.768 -5.417 8.602
51 HA LEU 8 HA LEU 8 -2.475 -7.016 7.845
52 HB2 LEU 8 2HB LEU 8 -5.041 -6.206 6.395
53 HB3 LEU 8 3HB LEU 8 -3.969 -7.491 5.862
54 HG LEU 8 HG LEU 8 -5.491 -7.562 8.505
55 HD11 LEU 8 1HD1 LEU 8 -6.962 -7.470 6.526
56 HD12 LEU 8 2HD1 LEU 8 -6.076 -8.830 5.801
57 HD13 LEU 8 3HD1 LEU 8 -7.014 -9.072 7.303
58 HD21 LEU 8 3HD2 LEU 8 -3.482 -8.982 8.483
59 HD22 LEU 8 1HD2 LEU 8 -4.949 -9.973 8.399
60 HD23 LEU 8 2HD2 LEU 8 -3.981 -9.692 6.931
61 H TYR 9 H TYR 9 -3.451 -3.755 6.940
62 HA TYR 9 HA TYR 9 -1.707 -3.897 4.526
63 HB2 TYR 9 2HB TYR 9 -4.477 -2.686 4.730
64 HB3 TYR 9 3HB TYR 9 -3.453 -2.715 3.291
65 HD1 TYR 9 HD1 TYR 9 -2.546 -5.445 3.093
66 HD2 TYR 9 HD2 TYR 9 -6.382 -3.956 4.306
67 HE1 TYR 9 HE1 TYR 9 -3.563 -7.647 2.522
68 HE2 TYR 9 HE2 TYR 9 -7.411 -6.162 3.772
69 HH TYR 9 HH TYR 9 -5.444 -8.906 2.531
70 H ARG 10 H ARG 10 -0.893 -1.919 3.791
71 HA ARG 10 HA ARG 10 -1.035 0.426 5.578
72 HB2 ARG 10 2HB ARG 10 0.872 -0.624 6.473
73 HB3 ARG 10 3HB ARG 10 1.351 -1.269 4.922
74 HG2 ARG 10 2HG ARG 10 2.984 0.335 5.587
75 HG3 ARG 10 3HG ARG 10 2.142 0.934 4.176
76 HD2 ARG 10 2HD ARG 10 2.378 2.813 5.583
77 HD3 ARG 10 3HD ARG 10 0.701 2.331 5.769
78 HE ARG 10 HE ARG 10 1.207 1.384 7.953
79 HH11 ARG 10 1HH2 ARG 10 3.888 3.466 6.783
80 HH12 ARG 10 2HH2 ARG 10 4.460 3.613 8.413
81 HH21 ARG 10 1HH1 ARG 10 1.925 1.841 9.865
82 HH22 ARG 10 2HH1 ARG 10 3.416 2.738 10.114
83 H VAL 11 H VAL 11 -0.800 2.380 4.471
84 HA VAL 11 HA VAL 11 0.202 2.428 1.679
85 HB VAL 11 HB VAL 11 -2.344 2.229 1.748
86 HG11 VAL 11 1HG1 VAL 11 -2.249 5.172 2.568
87 HG12 VAL 11 2HG1 VAL 11 -3.682 4.184 2.219
88 HG13 VAL 11 3HG1 VAL 11 -2.686 3.868 3.656
89 HG21 VAL 11 3HG2 VAL 11 -1.000 3.179 -0.218
90 HG22 VAL 11 1HG2 VAL 11 -2.651 3.801 -0.090
91 HG23 VAL 11 2HG2 VAL 11 -1.273 4.788 0.441
92 H GLU 12 H GLU 12 1.345 4.306 1.190
93 HA GLU 12 HA GLU 12 1.052 6.748 2.734
94 HB2 GLU 12 2HB GLU 12 3.333 6.782 3.709
95 HB3 GLU 12 3HB GLU 12 2.372 5.491 4.400
96 HG2 GLU 12 2HG GLU 12 3.497 3.850 2.873
97 HG3 GLU 12 3HG GLU 12 4.476 5.166 2.214
98 H TYR 13 H TYR 13 2.195 8.473 2.088
99 HA TYR 13 HA TYR 13 3.661 8.471 -0.455
100 HB2 TYR 13 2HB TYR 13 3.520 10.567 1.743
101 HB3 TYR 13 3HB TYR 13 4.072 10.798 0.091
102 HD1 TYR 13 HD1 TYR 13 1.787 9.294 -1.341
103 HD2 TYR 13 HD2 TYR 13 1.759 12.110 1.916
104 HE1 TYR 13 HE1 TYR 13 -0.404 10.178 -2.126
105 HE2 TYR 13 HE2 TYR 13 -0.463 12.955 1.166
106 HH TYR 13 HH TYR 13 -2.016 11.776 -1.841
107 H ALA 14 H ALA 14 5.661 7.700 -0.569
108 HA ALA 14 HA ALA 14 7.090 6.678 1.650
109 HB1 ALA 14 1HB ALA 14 7.892 7.245 -1.235
110 HB2 ALA 14 2HB ALA 14 8.836 6.252 -0.106
111 HB3 ALA 14 3HB ALA 14 7.204 5.748 -0.603
112 H LYS 15 H LYS 15 8.300 7.695 3.126
113 HA LYS 15 HA LYS 15 9.379 10.418 2.628
114 HB2 LYS 15 2HB LYS 15 9.339 8.776 5.191
115 HB3 LYS 15 3HB LYS 15 9.723 10.486 5.047
116 HG2 LYS 15 2HG LYS 15 7.021 9.154 4.607
117 HG3 LYS 15 3HG LYS 15 7.479 10.211 5.925
118 HD2 LYS 15 2HD LYS 15 7.143 11.002 2.999
119 HD3 LYS 15 3HD LYS 15 6.030 11.363 4.303
120 HE2 LYS 15 2HE LYS 15 8.899 12.403 4.129
121 HE3 LYS 15 3HE LYS 15 7.469 13.291 3.603
122 HZ1 LYS 15 3HZ LYS 15 8.097 13.944 5.838
123 HZ2 LYS 15 1HZ LYS 15 6.641 13.216 5.893
124 HZ3 LYS 15 2HZ LYS 15 7.975 12.418 6.399
125 H SER 16 H SER 16 10.607 7.195 2.881
126 HA SER 16 HA SER 16 13.310 8.083 2.182
127 HB2 SER 16 2HB SER 16 13.335 8.085 4.667
128 HB3 SER 16 3HB SER 16 12.831 6.383 4.666
129 HG SER 16 HG SER 16 15.157 6.780 4.829
130 H GLY 17 H GLY 17 14.585 6.393 1.287
131 HA2 GLY 17 2HA GLY 17 12.946 4.606 -0.313
132 HA3 GLY 17 3HA GLY 17 14.661 4.946 -0.509
133 H ARG 18 H ARG 18 13.660 3.809 2.646
134 HA ARG 18 HA ARG 18 15.391 1.508 2.549
135 HB2 ARG 18 2HB ARG 18 13.224 2.247 4.549
136 HB3 ARG 18 3HB ARG 18 14.386 0.931 4.719
137 HG2 ARG 18 2HG ARG 18 16.188 2.847 4.284
138 HG3 ARG 18 3HG ARG 18 14.875 3.908 4.837
139 HD2 ARG 18 2HD ARG 18 14.651 2.453 6.876
140 HD3 ARG 18 3HD ARG 18 16.009 1.478 6.269
141 HE ARG 18 HE ARG 18 16.732 4.275 6.486
142 HH11 ARG 18 1HH2 ARG 18 16.324 1.453 8.607
143 HH12 ARG 18 2HH2 ARG 18 17.525 2.117 9.717
144 HH21 ARG 18 1HH1 ARG 18 18.237 4.879 7.990
145 HH22 ARG 18 2HH1 ARG 18 18.402 3.910 9.467
146 H ALA 19 H ALA 19 11.994 1.773 1.736
147 HA ALA 19 HA ALA 19 11.431 -1.073 2.025
148 HB1 ALA 19 1HB ALA 19 9.827 1.180 0.760
149 HB2 ALA 19 2HB ALA 19 9.244 -0.449 1.102
150 HB3 ALA 19 3HB ALA 19 9.696 0.614 2.449
151 H SER 20 H SER 20 11.207 -2.609 0.447
152 HA SER 20 HA SER 20 11.833 -1.892 -2.370
153 HB2 SER 20 2HB SER 20 12.997 -4.225 -0.824
154 HB3 SER 20 3HB SER 20 13.085 -4.035 -2.587
155 HG SER 20 HG SER 20 14.947 -3.219 -1.435
156 H CYS 21 HN CYS 21 10.933 -3.168 -3.982
157 HA CYS 21 HA CYS 21 8.196 -3.820 -3.234
158 HB2 CYS 21 2HB CYS 21 8.833 -2.344 -5.100
159 HB3 CYS 21 3HB CYS 21 9.602 -3.717 -5.916
160 H LYS 22 H LYS 22 7.562 -5.785 -2.677
161 HA LYS 22 HA LYS 22 9.152 -8.173 -3.155
162 HB2 LYS 22 2HB LYS 22 6.315 -7.939 -2.102
163 HB3 LYS 22 3HB LYS 22 7.358 -9.333 -1.911
164 HG2 LYS 22 2HG LYS 22 7.844 -6.566 -0.740
165 HG3 LYS 22 3HG LYS 22 7.133 -7.904 0.126
166 HD2 LYS 22 2HD LYS 22 9.959 -7.850 -1.025
167 HD3 LYS 22 3HD LYS 22 9.531 -7.533 0.662
168 HE2 LYS 22 2HE LYS 22 8.557 -9.821 0.849
169 HE3 LYS 22 3HE LYS 22 9.039 -10.157 -0.819
170 HZ1 LYS 22 3HZ LYS 22 10.679 -11.002 0.754
171 HZ2 LYS 22 1HZ LYS 22 11.361 -9.825 -0.146
172 HZ3 LYS 22 2HZ LYS 22 10.916 -9.522 1.398
173 H LYS 23 H LYS 23 7.046 -6.629 -5.218
174 HA LYS 23 HA LYS 23 6.115 -9.141 -6.549
175 HB2 LYS 23 2HB LYS 23 4.363 -7.628 -5.829
176 HB3 LYS 23 3HB LYS 23 5.102 -6.296 -6.713
177 HG2 LYS 23 2HG LYS 23 3.137 -7.190 -7.858
178 HG3 LYS 23 3HG LYS 23 4.583 -7.362 -8.850
179 HD2 LYS 23 2HD LYS 23 4.719 -9.762 -8.308
180 HD3 LYS 23 3HD LYS 23 3.360 -9.609 -7.174
181 HE2 LYS 23 2HE LYS 23 1.883 -8.919 -9.011
182 HE3 LYS 23 3HE LYS 23 3.230 -8.979 -10.155
183 HZ1 LYS 23 3HZ LYS 23 3.383 -11.372 -9.774
184 HZ2 LYS 23 1HZ LYS 23 2.174 -11.336 -8.674
185 HZ3 LYS 23 2HZ LYS 23 1.863 -11.000 -10.238
186 H CYS 24 HN CYS 24 7.559 -5.969 -7.494
187 HA CYS 24 HA CYS 24 8.447 -7.292 -10.007
188 HB2 CYS 24 2HB CYS 24 8.502 -5.283 -11.109
189 HB3 CYS 24 3HB CYS 24 6.969 -5.335 -10.248
190 H SER 25 H SER 25 9.764 -6.803 -7.078
191 HA SER 25 HA SER 25 11.806 -6.998 -6.214
192 HB2 SER 25 2HB SER 25 12.656 -8.044 -8.921
193 HB3 SER 25 3HB SER 25 13.504 -8.270 -7.382
194 HG SER 25 HG SER 25 12.168 -10.064 -7.918
195 H GLU 26 H GLU 26 11.201 -4.421 -7.720
196 HA GLU 26 HA GLU 26 13.945 -3.260 -7.882
197 HB2 GLU 26 2HB GLU 26 11.196 -2.071 -8.405
198 HB3 GLU 26 3HB GLU 26 12.711 -1.188 -8.543
199 HG2 GLU 26 2HG GLU 26 11.971 -3.612 -10.238
200 HG3 GLU 26 3HG GLU 26 11.792 -1.935 -10.722
201 H SER 27 H SER 27 13.892 -0.922 -6.744
202 HA SER 27 HA SER 27 12.850 -1.282 -3.969
203 HB2 SER 27 2HB SER 27 15.320 -1.395 -4.196
204 HB3 SER 27 3HB SER 27 15.250 0.337 -4.671
205 HG SER 27 HG SER 27 14.513 -0.902 -2.223
206 H ILE 28 H ILE 28 12.064 0.542 -2.875
207 HA ILE 28 HA ILE 28 10.503 2.016 -4.880
208 HB ILE 28 HB ILE 28 9.866 1.630 -1.944
209 HG12 ILE 28 2HG1 ILE 28 8.735 0.060 -4.307
210 HG13 ILE 28 3HG1 ILE 28 10.007 -0.553 -3.257
211 HG21 ILE 28 1HG2 ILE 28 8.149 2.519 -4.317
212 HG22 ILE 28 2HG2 ILE 28 7.560 2.236 -2.680
213 HG23 ILE 28 3HG2 ILE 28 8.686 3.556 -2.979
214 HD11 ILE 28 3HD1 ILE 28 7.958 -1.503 -2.511
215 HD12 ILE 28 1HD1 ILE 28 8.502 -0.346 -1.286
216 HD13 ILE 28 2HD1 ILE 28 7.170 0.074 -2.391
217 HA PRO 29 HA PRO 29 12.852 5.678 -3.640
218 HB2 PRO 29 2HB PRO 29 11.848 7.507 -5.405
219 HB3 PRO 29 3HB PRO 29 12.961 6.198 -5.890
220 HG2 PRO 29 2HG PRO 29 9.931 6.223 -6.070
221 HG3 PRO 29 3HG PRO 29 11.107 5.794 -7.354
222 HD2 PRO 29 2HD PRO 29 9.893 3.903 -5.824
223 HD3 PRO 29 3HD PRO 29 11.601 3.722 -6.335
224 H LYS 30 H LYS 30 12.521 7.690 -2.595
225 HA LYS 30 HA LYS 30 9.986 8.054 -1.178
226 HB2 LYS 30 2HB LYS 30 11.007 9.881 -0.049
227 HB3 LYS 30 3HB LYS 30 12.054 8.470 -0.012
228 HG2 LYS 30 2HG LYS 30 13.490 9.433 -1.756
229 HG3 LYS 30 3HG LYS 30 12.430 10.847 -1.897
230 HD2 LYS 30 2HD LYS 30 13.810 10.024 0.694
231 HD3 LYS 30 3HD LYS 30 14.535 11.141 -0.466
232 HE2 LYS 30 2HE LYS 30 12.900 12.807 -0.133
233 HE3 LYS 30 3HE LYS 30 11.749 11.685 0.598
234 HZ1 LYS 30 3HZ LYS 30 13.090 11.530 2.541
235 HZ2 LYS 30 1HZ LYS 30 14.304 12.442 1.897
236 HZ3 LYS 30 2HZ LYS 30 12.858 13.119 2.246
237 H ASP 31 H ASP 31 8.907 10.160 -1.129
238 HA ASP 31 HA ASP 31 7.399 11.463 -2.121
239 HB2 ASP 31 2HB ASP 31 9.464 12.823 -2.509
240 HB3 ASP 31 3HB ASP 31 9.511 12.208 -4.160
241 H SER 32 H SER 32 7.152 8.823 -2.714
242 HA SER 32 HA SER 32 5.453 8.946 -5.117
243 HB2 SER 32 2HB SER 32 7.699 7.918 -5.765
244 HB3 SER 32 3HB SER 32 7.298 6.575 -4.675
245 HG SER 32 HG SER 32 6.606 6.133 -6.803
246 H LEU 33 H LEU 33 4.000 6.878 -5.113
247 HA LEU 33 HA LEU 33 2.944 6.640 -2.340
248 HB2 LEU 33 2HB LEU 33 1.493 7.650 -4.092
249 HB3 LEU 33 3HB LEU 33 1.606 6.152 -5.017
250 HG LEU 33 HG LEU 33 0.540 4.954 -3.055
251 HD11 LEU 33 1HD1 LEU 33 -0.058 7.776 -2.090
252 HD12 LEU 33 2HD1 LEU 33 -0.762 6.281 -1.449
253 HD13 LEU 33 3HD1 LEU 33 0.962 6.591 -1.255
254 HD21 LEU 33 3HD2 LEU 33 -1.077 7.238 -4.241
255 HD22 LEU 33 1HD2 LEU 33 -0.728 5.701 -5.066
256 HD23 LEU 33 2HD2 LEU 33 -1.718 5.703 -3.593
257 H ARG 34 H ARG 34 2.910 4.749 -1.281
258 HA ARG 34 HA ARG 34 3.362 2.185 -2.706
259 HB2 ARG 34 2HB ARG 34 5.206 1.540 -1.334
260 HB3 ARG 34 3HB ARG 34 5.574 3.060 -2.149
261 HG2 ARG 34 2HG ARG 34 5.173 4.310 -0.056
262 HG3 ARG 34 3HG ARG 34 4.753 2.798 0.780
263 HD2 ARG 34 2HD ARG 34 7.004 1.893 0.322
264 HD3 ARG 34 3HD ARG 34 7.416 3.361 -0.581
265 HE ARG 34 HE ARG 34 6.613 3.770 2.244
266 HH11 ARG 34 1HH2 ARG 34 9.399 3.479 0.088
267 HH12 ARG 34 2HH2 ARG 34 10.427 4.252 1.276
268 HH21 ARG 34 1HH1 ARG 34 7.938 4.606 3.602
269 HH22 ARG 34 2HH1 ARG 34 9.683 4.699 3.283
270 H MET 35 H MET 35 3.096 0.326 -1.364
271 HA MET 35 HA MET 35 1.303 0.638 0.957
272 HB2 MET 35 2HB MET 35 0.749 -1.019 -1.541
273 HB3 MET 35 3HB MET 35 -0.079 -1.276 0.005
274 HG2 MET 35 2HG MET 35 -0.881 1.040 -0.021
275 HG3 MET 35 3HG MET 35 -0.111 1.302 -1.590
276 HE1 MET 35 3HE MET 35 -2.377 -1.682 -0.116
277 HE2 MET 35 1HE MET 35 -3.064 -0.125 0.428
278 HE3 MET 35 2HE MET 35 -3.955 -1.132 -0.732
279 H ALA 36 H ALA 36 1.054 -1.363 2.206
280 HA ALA 36 HA ALA 36 3.200 -3.336 1.845
281 HB1 ALA 36 1HB ALA 36 3.196 -2.504 4.648
282 HB2 ALA 36 2HB ALA 36 4.540 -2.724 3.523
283 HB3 ALA 36 3HB ALA 36 3.662 -1.183 3.559
284 H ILE 37 H ILE 37 3.013 -5.197 3.371
285 HA ILE 37 HA ILE 37 0.240 -5.607 4.378
286 HB ILE 37 HB ILE 37 1.722 -7.056 2.297
287 HG12 ILE 37 2HG1 ILE 37 -1.167 -7.267 3.217
288 HG13 ILE 37 3HG1 ILE 37 -0.550 -5.918 2.264
289 HG21 ILE 37 1HG2 ILE 37 0.388 -8.772 4.416
290 HG22 ILE 37 2HG2 ILE 37 0.993 -9.302 2.813
291 HG23 ILE 37 3HG2 ILE 37 2.129 -8.736 4.028
292 HD11 ILE 37 3HD1 ILE 37 0.071 -7.456 0.437
293 HD12 ILE 37 1HD1 ILE 37 -0.626 -8.811 1.360
294 HD13 ILE 37 2HD1 ILE 37 -1.660 -7.483 0.807
295 H MET 38 H MET 38 -0.028 -6.575 6.327
296 HA MET 38 HA MET 38 2.436 -7.082 7.868
297 HB2 MET 38 2HB MET 38 0.396 -5.656 8.610
298 HB3 MET 38 3HB MET 38 -0.412 -7.199 8.886
299 HG2 MET 38 2HG MET 38 0.412 -6.876 10.962
300 HG3 MET 38 3HG MET 38 1.826 -7.684 10.290
301 HE1 MET 38 3HE MET 38 3.898 -6.295 9.306
302 HE2 MET 38 1HE MET 38 2.913 -5.110 8.414
303 HE3 MET 38 2HE MET 38 4.171 -4.551 9.548
304 H VAL 39 H VAL 39 3.347 -8.980 7.916
305 HA VAL 39 HA VAL 39 1.612 -11.387 8.281
306 HB VAL 39 HB VAL 39 2.305 -11.308 5.937
307 HG11 VAL 39 1HG1 VAL 39 4.479 -10.152 6.150
308 HG12 VAL 39 2HG1 VAL 39 5.168 -11.595 6.925
309 HG13 VAL 39 3HG1 VAL 39 4.592 -11.670 5.248
310 HG21 VAL 39 3HG2 VAL 39 3.679 -13.597 7.364
311 HG22 VAL 39 1HG2 VAL 39 1.926 -13.479 7.062
312 HG23 VAL 39 2HG2 VAL 39 3.062 -13.558 5.708
313 H GLN 40 H GLN 40 2.366 -12.989 9.570
314 HA GLN 40 HA GLN 40 4.382 -12.335 11.573
315 HB2 GLN 40 2HB GLN 40 3.850 -14.730 12.316
316 HB3 GLN 40 3HB GLN 40 2.601 -13.500 12.475
317 HG2 GLN 40 2HG GLN 40 1.422 -14.303 10.505
318 HG3 GLN 40 3HG GLN 40 2.715 -15.441 10.129
319 HE21 GLN 40 2HE2 GLN 40 0.499 -16.767 10.170
320 HE22 GLN 40 1HE2 GLN 40 0.178 -17.545 11.714
321 H SER 41 H SER 41 6.484 -12.874 11.625
322 HA SER 41 HA SER 41 7.619 -14.122 9.219
323 HB2 SER 41 2HB SER 41 8.524 -12.001 10.070
324 HB3 SER 41 3HB SER 41 8.978 -12.825 11.574
325 HG SER 41 HG SER 41 10.061 -13.054 8.987
326 HA PRO 42 HA PRO 42 8.752 -17.845 11.384
327 HB2 PRO 42 2HB PRO 42 10.330 -18.408 8.889
328 HB3 PRO 42 3HB PRO 42 9.173 -19.466 9.747
329 HG2 PRO 42 2HG PRO 42 8.477 -18.225 7.424
330 HG3 PRO 42 3HG PRO 42 7.307 -18.350 8.781
331 HD2 PRO 42 2HD PRO 42 9.074 -15.989 8.050
332 HD3 PRO 42 3HD PRO 42 7.326 -16.028 8.438
333 H MET 43 H MET 43 10.799 -15.333 10.237
334 HA MET 43 HA MET 43 13.268 -16.502 11.467
335 HB2 MET 43 2HB MET 43 12.865 -14.572 9.181
336 HB3 MET 43 3HB MET 43 14.435 -14.856 9.929
337 HG2 MET 43 2HG MET 43 14.675 -16.963 9.102
338 HG3 MET 43 3HG MET 43 12.957 -17.323 9.122
339 HE1 MET 43 3HE MET 43 11.452 -15.276 7.590
340 HE2 MET 43 1HE MET 43 11.504 -15.896 5.920
341 HE3 MET 43 2HE MET 43 11.309 -17.016 7.290
342 H PHE 44 H PHE 44 11.111 -13.732 11.559
343 HA PHE 44 HA PHE 44 12.872 -12.316 13.508
344 HB2 PHE 44 2HB PHE 44 12.355 -11.017 11.534
345 HB3 PHE 44 3HB PHE 44 10.638 -11.309 11.724
346 HD1 PHE 44 HD2 PHE 44 13.577 -9.670 13.370
347 HD2 PHE 44 HD1 PHE 44 9.280 -9.891 13.062
348 HE1 PHE 44 HE2 PHE 44 13.366 -7.650 14.803
349 HE2 PHE 44 HE1 PHE 44 9.073 -7.867 14.487
350 HZ PHE 44 HZ PHE 44 11.115 -6.749 15.364
351 H ASP 45 H ASP 45 11.877 -11.331 15.337
352 HA ASP 45 HA ASP 45 10.161 -13.250 16.717
353 HB2 ASP 45 2HB ASP 45 12.311 -12.410 17.635
354 HB3 ASP 45 3HB ASP 45 11.611 -10.797 17.764
355 H GLY 46 H GLY 46 8.574 -12.130 14.865
356 HA2 GLY 46 2HA GLY 46 6.212 -11.352 16.008
357 HA3 GLY 46 3HA GLY 46 7.075 -9.819 15.860
358 H LYS 47 H LYS 47 5.681 -8.956 14.385
359 HA LYS 47 HA LYS 47 5.359 -10.328 11.755
360 HB2 LYS 47 2HB LYS 47 3.552 -8.162 12.866
361 HB3 LYS 47 3HB LYS 47 3.310 -9.167 11.437
362 HG2 LYS 47 2HG LYS 47 3.643 -11.092 13.419
363 HG3 LYS 47 3HG LYS 47 2.873 -9.802 14.327
364 HD2 LYS 47 2HD LYS 47 1.857 -11.154 11.803
365 HD3 LYS 47 3HD LYS 47 1.301 -11.488 13.438
366 HE2 LYS 47 2HE LYS 47 0.993 -8.815 11.999
367 HE3 LYS 47 3HE LYS 47 -0.236 -10.083 12.035
368 HZ1 LYS 47 3HZ LYS 47 -0.612 -8.386 13.730
369 HZ2 LYS 47 1HZ LYS 47 -0.345 -9.840 14.455
370 HZ3 LYS 47 2HZ LYS 47 0.811 -8.665 14.439
371 H VAL 48 H VAL 48 5.561 -9.281 9.857
372 HA VAL 48 HA VAL 48 7.335 -6.883 9.897
373 HB VAL 48 HB VAL 48 8.676 -7.972 8.140
374 HG11 VAL 48 1HG1 VAL 48 8.551 -9.579 10.730
375 HG12 VAL 48 2HG1 VAL 48 9.941 -9.429 9.641
376 HG13 VAL 48 3HG1 VAL 48 9.365 -8.013 10.534
377 HG21 VAL 48 3HG2 VAL 48 8.600 -10.411 7.827
378 HG22 VAL 48 1HG2 VAL 48 7.152 -10.521 8.844
379 HG23 VAL 48 2HG2 VAL 48 7.089 -9.668 7.291
380 HA PRO 49 HA PRO 49 4.694 -5.599 6.579
381 HB2 PRO 49 2HB PRO 49 5.861 -3.276 5.792
382 HB3 PRO 49 3HB PRO 49 5.098 -3.475 7.399
383 HG2 PRO 49 2HG PRO 49 8.043 -3.688 6.699
384 HG3 PRO 49 3HG PRO 49 7.287 -2.797 8.053
385 HD2 PRO 49 2HD PRO 49 8.361 -5.328 8.306
386 HD3 PRO 49 3HD PRO 49 6.985 -4.748 9.292
387 H HIS 50 H HIS 50 4.522 -6.450 4.569
388 HA HIS 50 HA HIS 50 6.905 -6.752 2.783
389 HB2 HIS 50 2HB HIS 50 4.100 -7.914 2.793
390 HB3 HIS 50 3HB HIS 50 5.128 -7.976 1.369
391 HD2 HIS 50 HD2 HIS 50 6.585 -8.537 4.897
392 HE1 HIS 50 HE1 HIS 50 6.632 -12.308 2.914
393 HE2 HIS 50 HE2 HIS 50 7.417 -11.043 4.980
394 H TRP 51 H TRP 51 7.365 -4.811 1.892
395 HA TRP 51 HA TRP 51 5.285 -2.937 1.145
396 HB2 TRP 51 2HB TRP 51 8.284 -2.907 0.723
397 HB3 TRP 51 3HB TRP 51 7.185 -1.581 0.367
398 HD1 TRP 51 HD1 TRP 51 8.978 -3.253 3.228
399 HE1 TRP 51 HE1 TRP 51 8.688 -1.870 5.371
400 HE3 TRP 51 HE3 TRP 51 5.459 0.075 1.564
401 HZ2 TRP 51 HZ2 TRP 51 7.049 0.322 6.286
402 HZ3 TRP 51 HZ3 TRP 51 4.518 1.779 3.115
403 HH2 TRP 51 HH2 TRP 51 5.309 1.905 5.469
404 H TYR 52 H TYR 52 4.694 -2.238 -0.876
405 HA TYR 52 HA TYR 52 6.126 -3.146 -3.242
406 HB2 TYR 52 2HB TYR 52 3.243 -3.538 -3.668
407 HB3 TYR 52 3HB TYR 52 4.659 -4.422 -4.239
408 HD1 TYR 52 HD1 TYR 52 2.721 -4.089 -0.980
409 HD2 TYR 52 HD2 TYR 52 4.752 -6.627 -3.806
410 HE1 TYR 52 HE1 TYR 52 1.990 -6.118 0.298
411 HE2 TYR 52 HE2 TYR 52 4.001 -8.635 -2.543
412 HH TYR 52 HH TYR 52 2.039 -8.405 0.424
413 H HIS 53 H HIS 53 5.482 -1.910 -5.167
414 HA HIS 53 HA HIS 53 4.826 0.875 -4.720
415 HB2 HIS 53 2HB HIS 53 4.496 -0.755 -7.270
416 HB3 HIS 53 3HB HIS 53 4.438 0.980 -7.156
417 HD2 HIS 53 HD2 HIS 53 6.724 2.290 -6.421
418 HE1 HIS 53 HE1 HIS 53 9.347 -0.692 -7.962
419 HE2 HIS 53 HE2 HIS 53 9.176 1.725 -7.200
420 H PHE 54 H PHE 54 2.838 2.028 -5.318
421 HA PHE 54 HA PHE 54 0.517 1.039 -4.151
422 HB2 PHE 54 2HB PHE 54 0.747 3.361 -4.555
423 HB3 PHE 54 3HB PHE 54 0.939 3.139 -6.287
424 HD1 PHE 54 HD1 PHE 54 -1.639 2.254 -3.634
425 HD2 PHE 54 HD2 PHE 54 -0.882 3.738 -7.617
426 HE1 PHE 54 HE1 PHE 54 -4.080 2.419 -4.047
427 HE2 PHE 54 HE2 PHE 54 -3.329 3.959 -7.987
428 HZ PHE 54 HZ PHE 54 -4.924 3.244 -6.224
429 H SER 55 H SER 55 1.413 0.726 -7.639
430 HA SER 55 HA SER 55 -1.133 -0.503 -8.378
431 HB2 SER 55 2HB SER 55 0.081 -0.799 -10.570
432 HB3 SER 55 3HB SER 55 -0.090 0.874 -9.999
433 HG SER 55 HG SER 55 2.054 0.417 -10.731
434 H CYS 56 HN CYS 56 2.254 -1.594 -7.935
435 HA CYS 56 HA CYS 56 2.042 -4.246 -8.577
436 HB2 CYS 56 2HB CYS 56 3.656 -2.842 -6.420
437 HB3 CYS 56 3HB CYS 56 3.891 -4.533 -6.833
438 H PHE 57 H PHE 57 1.076 -2.747 -5.478
439 HA PHE 57 HA PHE 57 0.582 -4.948 -3.809
440 HB2 PHE 57 2HB PHE 57 0.407 -2.584 -3.182
441 HB3 PHE 57 3HB PHE 57 -1.071 -2.426 -4.124
442 HD1 PHE 57 HD2 PHE 57 -3.124 -3.799 -3.480
443 HD2 PHE 57 HD1 PHE 57 0.375 -3.543 -0.977
444 HE1 PHE 57 HE2 PHE 57 -4.426 -4.690 -1.577
445 HE2 PHE 57 HE1 PHE 57 -0.962 -4.309 0.958
446 HZ PHE 57 HZ PHE 57 -3.354 -4.951 0.650
447 H TRP 58 H TRP 58 -1.717 -3.466 -6.145
448 HA TRP 58 HA TRP 58 -3.701 -5.554 -5.775
449 HB2 TRP 58 2HB TRP 58 -3.591 -3.531 -8.017
450 HB3 TRP 58 3HB TRP 58 -4.994 -4.348 -7.327
451 HD1 TRP 58 HD1 TRP 58 -2.787 -1.347 -6.939
452 HE1 TRP 58 HE1 TRP 58 -3.472 0.117 -4.969
453 HE3 TRP 58 HE3 TRP 58 -6.370 -4.386 -4.911
454 HZ2 TRP 58 HZ2 TRP 58 -5.479 0.060 -2.848
455 HZ3 TRP 58 HZ3 TRP 58 -7.657 -3.646 -2.933
456 HH2 TRP 58 HH2 TRP 58 -7.232 -1.412 -1.918
457 H LYS 59 H LYS 59 -0.995 -5.058 -7.970
458 HA LYS 59 HA LYS 59 -1.608 -7.058 -9.920
459 HB2 LYS 59 2HB LYS 59 0.187 -5.092 -9.775
460 HB3 LYS 59 3HB LYS 59 1.180 -6.323 -9.005
461 HG2 LYS 59 2HG LYS 59 1.781 -6.214 -11.240
462 HG3 LYS 59 3HG LYS 59 0.923 -7.749 -11.032
463 HD2 LYS 59 2HD LYS 59 -1.020 -6.925 -12.189
464 HD3 LYS 59 3HD LYS 59 -0.471 -5.234 -12.059
465 HE2 LYS 59 2HE LYS 59 1.464 -5.711 -13.474
466 HE3 LYS 59 3HE LYS 59 0.993 -7.411 -13.607
467 HZ1 LYS 59 3HZ LYS 59 -1.049 -6.693 -14.739
468 HZ2 LYS 59 1HZ LYS 59 -0.614 -5.121 -14.622
469 HZ3 LYS 59 2HZ LYS 59 0.256 -6.144 -15.548
470 H VAL 60 H VAL 60 -0.397 -7.329 -6.593
471 HA VAL 60 HA VAL 60 0.365 -10.133 -6.810
472 HB VAL 60 HB VAL 60 -0.742 -8.801 -4.326
473 HG11 VAL 60 1HG1 VAL 60 0.825 -10.413 -3.172
474 HG12 VAL 60 2HG1 VAL 60 -0.489 -11.207 -4.024
475 HG13 VAL 60 3HG1 VAL 60 1.138 -11.167 -4.746
476 HG21 VAL 60 3HG2 VAL 60 1.084 -7.393 -5.040
477 HG22 VAL 60 1HG2 VAL 60 1.608 -8.351 -3.683
478 HG23 VAL 60 2HG2 VAL 60 2.132 -8.803 -5.321
479 H GLY 61 H GLY 61 -2.738 -8.575 -6.863
480 HA2 GLY 61 2HA GLY 61 -4.705 -9.677 -7.554
481 HA3 GLY 61 3HA GLY 61 -4.158 -11.191 -6.839
482 H HIS 62 H HIS 62 -3.710 -8.524 -4.705
483 HA HIS 62 HA HIS 62 -5.705 -9.470 -2.841
484 HB2 HIS 62 2HB HIS 62 -4.012 -6.956 -2.838
485 HB3 HIS 62 3HB HIS 62 -5.021 -7.496 -1.496
486 HD2 HIS 62 HD2 HIS 62 -1.570 -7.586 -2.499
487 HE1 HIS 62 HE1 HIS 62 -1.960 -11.212 -0.291
488 HE2 HIS 62 HE2 HIS 62 -0.302 -9.576 -1.315
489 H SER 63 H SER 63 -7.549 -8.459 -2.061
490 HA SER 63 HA SER 63 -8.552 -5.963 -3.300
491 HB2 SER 63 2HB SER 63 -10.194 -8.516 -3.067
492 HB3 SER 63 3HB SER 63 -10.876 -6.903 -3.334
493 HG SER 63 HG SER 63 -8.993 -8.213 -5.028
494 H ILE 64 H ILE 64 -9.502 -4.628 -1.793
495 HA ILE 64 HA ILE 64 -9.286 -5.555 1.043
496 HB ILE 64 HB ILE 64 -8.806 -2.796 -0.113
497 HG12 ILE 64 2HG1 ILE 64 -6.836 -4.882 0.927
498 HG13 ILE 64 3HG1 ILE 64 -7.001 -4.339 -0.740
499 HG21 ILE 64 1HG2 ILE 64 -8.375 -3.822 2.728
500 HG22 ILE 64 2HG2 ILE 64 -8.030 -2.192 2.120
501 HG23 ILE 64 3HG2 ILE 64 -9.700 -2.748 2.213
502 HD11 ILE 64 3HD1 ILE 64 -6.456 -1.968 0.124
503 HD12 ILE 64 1HD1 ILE 64 -5.905 -2.787 1.608
504 HD13 ILE 64 2HD1 ILE 64 -5.142 -3.148 0.065
505 H ARG 65 H ARG 65 -11.123 -5.706 2.093
506 HA ARG 65 HA ARG 65 -13.595 -4.775 0.798
507 HB2 ARG 65 2HB ARG 65 -14.662 -6.234 2.637
508 HB3 ARG 65 3HB ARG 65 -13.822 -7.001 1.306
509 HG2 ARG 65 2HG ARG 65 -12.297 -6.480 3.862
510 HG3 ARG 65 3HG ARG 65 -13.487 -7.780 3.827
511 HD2 ARG 65 2HD ARG 65 -12.378 -8.975 2.109
512 HD3 ARG 65 3HD ARG 65 -11.356 -7.613 1.675
513 HE ARG 65 HE ARG 65 -11.149 -8.948 4.352
514 HH11 ARG 65 1HH2 ARG 65 -9.417 -8.079 1.353
515 HH12 ARG 65 2HH2 ARG 65 -7.893 -8.279 2.172
516 HH21 ARG 65 1HH1 ARG 65 -9.093 -9.272 5.163
517 HH22 ARG 65 2HH1 ARG 65 -7.717 -8.953 4.131
518 H HIS 66 H HIS 66 -11.778 -3.751 3.478
519 HA HIS 66 HA HIS 66 -13.637 -1.534 3.970
520 HB2 HIS 66 2HB HIS 66 -13.541 -1.831 6.449
521 HB3 HIS 66 3HB HIS 66 -14.600 -2.888 5.550
522 HD2 HIS 66 HD2 HIS 66 -11.101 -4.320 5.456
523 HE1 HIS 66 HE1 HIS 66 -13.086 -6.258 8.689
524 HE2 HIS 66 HE2 HIS 66 -11.031 -6.292 7.192
525 HA PRO 67 HA PRO 67 -9.164 -0.895 3.575
526 HB2 PRO 67 2HB PRO 67 -9.149 1.403 1.995
527 HB3 PRO 67 3HB PRO 67 -9.335 -0.259 1.360
528 HG2 PRO 67 2HG PRO 67 -11.529 1.705 2.087
529 HG3 PRO 67 3HG PRO 67 -11.350 0.769 0.564
530 HD2 PRO 67 2HD PRO 67 -12.983 -0.077 2.511
531 HD3 PRO 67 3HD PRO 67 -11.926 -1.262 1.679
532 H ASP 68 H ASP 68 -11.398 1.726 4.575
533 HA ASP 68 HA ASP 68 -9.238 3.218 5.834
534 HB2 ASP 68 2HB ASP 68 -10.997 4.645 6.747
535 HB3 ASP 68 3HB ASP 68 -11.117 4.429 5.007
536 H VAL 69 H VAL 69 -10.710 0.325 6.687
537 HA VAL 69 HA VAL 69 -10.310 0.661 9.607
538 HB VAL 69 HB VAL 69 -11.406 -1.744 8.102
539 HG11 VAL 69 1HG1 VAL 69 -11.433 -1.031 11.061
540 HG12 VAL 69 2HG1 VAL 69 -12.260 -2.418 10.316
541 HG13 VAL 69 3HG1 VAL 69 -10.499 -2.339 10.298
542 HG21 VAL 69 3HG2 VAL 69 -12.898 0.477 9.562
543 HG22 VAL 69 1HG2 VAL 69 -12.952 0.145 7.816
544 HG23 VAL 69 2HG2 VAL 69 -13.624 -1.027 8.951
545 H GLU 70 H GLU 70 -9.167 -1.271 6.810
546 HA GLU 70 HA GLU 70 -7.071 -2.487 8.547
547 HB2 GLU 70 2HB GLU 70 -8.287 -3.271 5.886
548 HB3 GLU 70 3HB GLU 70 -6.839 -4.047 6.518
549 HG2 GLU 70 2HG GLU 70 -9.512 -3.946 7.955
550 HG3 GLU 70 3HG GLU 70 -8.894 -5.312 7.020
551 H VAL 71 H VAL 71 -7.163 -0.265 5.814
552 HA VAL 71 HA VAL 71 -4.243 -0.465 5.307
553 HB VAL 71 HB VAL 71 -6.153 1.591 4.230
554 HG11 VAL 71 1HG1 VAL 71 -3.416 0.555 3.384
555 HG12 VAL 71 2HG1 VAL 71 -4.377 1.844 2.610
556 HG13 VAL 71 3HG1 VAL 71 -3.712 2.077 4.245
557 HG21 VAL 71 3HG2 VAL 71 -6.854 -0.710 3.521
558 HG22 VAL 71 1HG2 VAL 71 -6.101 0.168 2.182
559 HG23 VAL 71 2HG2 VAL 71 -5.183 -1.071 3.074
560 H ASP 72 H ASP 72 -3.220 -0.082 7.117
561 HA ASP 72 HA ASP 72 -3.410 2.231 8.813
562 HB2 ASP 72 2HB ASP 72 -2.313 0.111 9.359
563 HB3 ASP 72 3HB ASP 72 -1.135 0.354 8.066
564 H GLY 73 H GLY 73 -2.270 4.187 8.704
565 HA2 GLY 73 2HA GLY 73 -1.076 5.957 7.790
566 HA3 GLY 73 3HA GLY 73 -0.468 4.885 6.532
567 H PHE 74 H PHE 74 -3.726 4.488 6.250
568 HA PHE 74 HA PHE 74 -4.178 6.053 3.940
569 HB2 PHE 74 2HB PHE 74 -5.476 4.091 4.630
570 HB3 PHE 74 3HB PHE 74 -6.091 4.951 6.035
571 HD1 PHE 74 HD2 PHE 74 -6.164 4.804 2.305
572 HD2 PHE 74 HD1 PHE 74 -8.037 6.344 5.874
573 HE1 PHE 74 HE2 PHE 74 -8.147 5.504 0.975
574 HE2 PHE 74 HE1 PHE 74 -10.017 7.031 4.531
575 HZ PHE 74 HZ PHE 74 -10.058 6.631 2.088
576 H SER 75 H SER 75 -4.649 6.916 7.348
577 HA SER 75 HA SER 75 -5.943 9.439 6.944
578 HB2 SER 75 2HB SER 75 -4.206 8.524 9.264
579 HB3 SER 75 3HB SER 75 -5.387 9.851 9.281
580 HG SER 75 HG SER 75 -6.260 7.911 10.148
581 H GLU 76 H GLU 76 -2.613 8.571 6.418
582 HA GLU 76 HA GLU 76 -1.596 11.322 6.824
583 HB2 GLU 76 2HB GLU 76 -0.151 8.821 5.892
584 HB3 GLU 76 3HB GLU 76 0.587 10.364 6.290
585 HG2 GLU 76 2HG GLU 76 -0.899 8.545 8.230
586 HG3 GLU 76 3HG GLU 76 0.844 8.737 8.110
587 H LEU 77 H LEU 77 -2.994 9.517 4.291
588 HA LEU 77 HA LEU 77 -1.766 10.830 1.999
589 HB2 LEU 77 2HB LEU 77 -4.426 9.414 2.349
590 HB3 LEU 77 3HB LEU 77 -3.731 9.878 0.803
591 HG LEU 77 HG LEU 77 -2.624 7.773 2.702
592 HD11 LEU 77 1HD1 LEU 77 -3.296 6.265 0.813
593 HD12 LEU 77 2HD1 LEU 77 -4.676 7.102 1.548
594 HD13 LEU 77 3HD1 LEU 77 -4.023 7.648 -0.010
595 HD21 LEU 77 3HD2 LEU 77 -1.653 8.608 -0.064
596 HD22 LEU 77 1HD2 LEU 77 -0.777 8.867 1.463
597 HD23 LEU 77 2HD2 LEU 77 -1.061 7.224 0.882
598 H ARG 78 H ARG 78 -3.356 12.033 0.454
599 HA ARG 78 HA ARG 78 -5.251 13.825 1.924
600 HB2 ARG 78 2HB ARG 78 -3.638 14.443 -0.594
601 HB3 ARG 78 3HB ARG 78 -4.933 15.467 0.022
602 HG2 ARG 78 2HG ARG 78 -2.360 14.785 1.505
603 HG3 ARG 78 3HG ARG 78 -2.724 16.310 0.701
604 HD2 ARG 78 2HD ARG 78 -4.563 16.764 2.248
605 HD3 ARG 78 3HD ARG 78 -4.371 15.211 3.038
606 HE ARG 78 HE ARG 78 -2.691 17.581 3.397
607 HH11 ARG 78 1HH2 ARG 78 -2.866 14.102 3.988
608 HH12 ARG 78 2HH2 ARG 78 -1.476 14.137 5.025
609 HH21 ARG 78 1HH1 ARG 78 -1.025 17.544 4.867
610 HH22 ARG 78 2HH1 ARG 78 -0.553 16.046 5.615
611 H TRP 79 H TRP 79 -6.995 14.665 0.598
612 HA TRP 79 HA TRP 79 -8.669 12.532 0.561
613 HB2 TRP 79 2HB TRP 79 -10.020 14.257 0.849
614 HB3 TRP 79 3HB TRP 79 -8.892 15.373 0.112
615 HD1 TRP 79 HD1 TRP 79 -12.088 13.495 -0.606
616 HE1 TRP 79 HE1 TRP 79 -13.042 14.206 -2.882
617 HE3 TRP 79 HE3 TRP 79 -8.110 16.201 -2.328
618 HZ2 TRP 79 HZ2 TRP 79 -12.211 15.831 -5.134
619 HZ3 TRP 79 HZ3 TRP 79 -8.196 17.312 -4.539
620 HH2 TRP 79 HH2 TRP 79 -10.242 17.138 -5.956
621 H ASP 80 H ASP 80 -7.113 13.886 -2.345
622 HA ASP 80 HA ASP 80 -8.721 12.431 -4.194
623 HB2 ASP 80 2HB ASP 80 -7.461 14.503 -4.731
624 HB3 ASP 80 3HB ASP 80 -5.959 13.575 -4.659
625 H ASP 81 H ASP 81 -5.828 11.504 -2.411
626 HA ASP 81 HA ASP 81 -5.412 9.040 -4.002
627 HB2 ASP 81 2HB ASP 81 -3.954 10.241 -1.628
628 HB3 ASP 81 3HB ASP 81 -3.662 8.606 -2.222
629 H GLN 82 H GLN 82 -6.743 10.129 -0.838
630 HA GLN 82 HA GLN 82 -7.378 7.548 0.170
631 HB2 GLN 82 2HB GLN 82 -8.686 10.269 0.506
632 HB3 GLN 82 3HB GLN 82 -9.280 8.835 1.343
633 HG2 GLN 82 2HG GLN 82 -7.126 8.477 2.415
634 HG3 GLN 82 3HG GLN 82 -6.421 9.837 1.529
635 HE21 GLN 82 2HE2 GLN 82 -6.323 9.681 4.344
636 HE22 GLN 82 1HE2 GLN 82 -7.296 11.023 4.959
637 H GLN 83 H GLN 83 -9.483 9.738 -1.833
638 HA GLN 83 HA GLN 83 -11.560 7.801 -2.033
639 HB2 GLN 83 2HB GLN 83 -12.587 9.208 -3.631
640 HB3 GLN 83 3HB GLN 83 -11.836 10.229 -2.407
641 HG2 GLN 83 2HG GLN 83 -9.914 10.599 -4.008
642 HG3 GLN 83 3HG GLN 83 -10.802 9.706 -5.236
643 HE21 GLN 83 2HE2 GLN 83 -10.093 12.316 -5.927
644 HE22 GLN 83 1HE2 GLN 83 -11.531 13.311 -5.822
645 H LYS 84 H LYS 84 -8.588 8.072 -3.921
646 HA LYS 84 HA LYS 84 -9.528 6.265 -6.038
647 HB2 LYS 84 2HB LYS 84 -8.190 8.186 -6.616
648 HB3 LYS 84 3HB LYS 84 -6.951 7.746 -5.445
649 HG2 LYS 84 2HG LYS 84 -7.500 5.674 -7.527
650 HG3 LYS 84 3HG LYS 84 -6.871 7.197 -8.149
651 HD2 LYS 84 2HD LYS 84 -5.582 5.697 -5.842
652 HD3 LYS 84 3HD LYS 84 -5.104 5.496 -7.547
653 HE2 LYS 84 2HE LYS 84 -4.504 7.872 -7.713
654 HE3 LYS 84 3HE LYS 84 -5.126 8.179 -6.096
655 HZ1 LYS 84 3HZ LYS 84 -2.891 7.990 -5.758
656 HZ2 LYS 84 1HZ LYS 84 -3.389 6.497 -5.341
657 HZ3 LYS 84 2HZ LYS 84 -2.674 6.720 -6.802
658 H VAL 85 H VAL 85 -7.381 6.110 -3.143
659 HA VAL 85 HA VAL 85 -6.661 3.317 -3.524
660 HB VAL 85 HB VAL 85 -6.861 5.058 -1.039
661 HG11 VAL 85 1HG1 VAL 85 -5.856 2.172 -1.170
662 HG12 VAL 85 2HG1 VAL 85 -5.597 3.286 0.183
663 HG13 VAL 85 3HG1 VAL 85 -7.235 2.779 -0.217
664 HG21 VAL 85 3HG2 VAL 85 -4.970 5.407 -2.755
665 HG22 VAL 85 1HG2 VAL 85 -4.477 5.087 -1.088
666 HG23 VAL 85 2HG2 VAL 85 -4.394 3.796 -2.297
667 H LYS 86 H LYS 86 -9.441 4.888 -1.821
668 HA LYS 86 HA LYS 86 -10.731 2.381 -1.203
669 HB2 LYS 86 2HB LYS 86 -11.876 5.197 -1.460
670 HB3 LYS 86 3HB LYS 86 -12.779 3.775 -0.920
671 HG2 LYS 86 2HG LYS 86 -10.911 3.454 0.848
672 HG3 LYS 86 3HG LYS 86 -10.363 5.052 0.423
673 HD2 LYS 86 2HD LYS 86 -11.735 5.091 2.440
674 HD3 LYS 86 3HD LYS 86 -12.518 6.026 1.146
675 HE2 LYS 86 2HE LYS 86 -14.064 4.236 0.708
676 HE3 LYS 86 3HE LYS 86 -13.144 3.116 1.731
677 HZ1 LYS 86 3HZ LYS 86 -14.461 5.525 2.849
678 HZ2 LYS 86 1HZ LYS 86 -15.205 4.071 2.772
679 HZ3 LYS 86 2HZ LYS 86 -13.863 4.217 3.668
680 H LYS 87 H LYS 87 -11.085 4.506 -4.090
681 HA LYS 87 HA LYS 87 -13.006 2.756 -5.351
682 HB2 LYS 87 2HB LYS 87 -11.103 4.885 -6.397
683 HB3 LYS 87 3HB LYS 87 -12.068 3.932 -7.512
684 HG2 LYS 87 2HG LYS 87 -13.348 5.419 -5.188
685 HG3 LYS 87 3HG LYS 87 -13.070 6.185 -6.764
686 HD2 LYS 87 2HD LYS 87 -14.488 4.651 -7.890
687 HD3 LYS 87 3HD LYS 87 -14.503 3.527 -6.531
688 HE2 LYS 87 2HE LYS 87 -15.569 5.519 -5.192
689 HE3 LYS 87 3HE LYS 87 -15.968 6.163 -6.793
690 HZ1 LYS 87 3HZ LYS 87 -16.721 3.481 -5.729
691 HZ2 LYS 87 1HZ LYS 87 -17.749 4.746 -5.896
692 HZ3 LYS 87 2HZ LYS 87 -17.124 4.028 -7.227
693 H THR 88 H THR 88 -9.477 2.757 -5.529
694 HA THR 88 HA THR 88 -9.261 0.549 -7.305
695 HB THR 88 HB THR 88 -7.241 1.327 -5.178
696 HG1 THR 88 1HG THR 88 -7.720 3.092 -6.457
697 HG21 THR 88 1HG2 THR 88 -6.792 -0.822 -6.366
698 HG22 THR 88 2HG2 THR 88 -7.048 0.009 -7.912
699 HG23 THR 88 3HG2 THR 88 -5.666 0.446 -6.887
700 H ALA 89 H ALA 89 -9.796 0.650 -3.794
701 HA ALA 89 HA ALA 89 -9.408 -2.159 -3.305
702 HB1 ALA 89 1HB ALA 89 -10.952 -0.048 -1.749
703 HB2 ALA 89 2HB ALA 89 -10.410 -1.612 -1.152
704 HB3 ALA 89 3HB ALA 89 -9.214 -0.381 -1.589
705 H GLU 90 H GLU 90 -12.249 -0.119 -4.153
706 HA GLU 90 HA GLU 90 -14.103 -2.329 -4.190
707 HB2 GLU 90 2HB GLU 90 -14.203 0.377 -5.582
708 HB3 GLU 90 3HB GLU 90 -15.506 -0.809 -5.624
709 HG2 GLU 90 2HG GLU 90 -15.612 -0.727 -3.118
710 HG3 GLU 90 3HG GLU 90 -14.466 0.612 -3.147
711 H ALA 91 H ALA 91 -12.066 -0.834 -6.680
712 HA ALA 91 HA ALA 91 -13.104 -2.338 -8.889
713 HB1 ALA 91 1HB ALA 91 -10.592 -0.637 -8.545
714 HB2 ALA 91 2HB ALA 91 -11.285 -1.153 -10.098
715 HB3 ALA 91 3HB ALA 91 -12.188 -0.052 -9.038
716 H GLY 92 H GLY 92 -10.550 -3.058 -6.606
717 HA2 GLY 92 2HA GLY 92 -9.331 -5.004 -6.311
718 HA3 GLY 92 3HA GLY 92 -10.005 -5.682 -7.793
719 H GLY 93 H GLY 93 -8.598 -2.524 -8.190
720 HA2 GLY 93 2HA GLY 93 -6.023 -2.507 -8.221
721 HA3 GLY 93 3HA GLY 93 -6.190 -3.661 -9.542
722 H VAL 94 H VAL 94 -4.981 -1.050 -9.371
723 HA VAL 94 HA VAL 94 -5.868 -0.050 -11.960
724 HB VAL 94 HB VAL 94 -7.055 1.310 -10.070
725 HG11 VAL 94 1HG1 VAL 94 -5.870 3.188 -9.153
726 HG12 VAL 94 2HG1 VAL 94 -4.977 1.726 -8.707
727 HG13 VAL 94 3HG1 VAL 94 -4.378 2.770 -10.012
728 HG21 VAL 94 3HG2 VAL 94 -5.522 2.826 -12.214
729 HG22 VAL 94 1HG2 VAL 94 -7.037 1.922 -12.460
730 HG23 VAL 94 2HG2 VAL 94 -7.004 3.326 -11.385
731 H THR 95 H THR 95 -4.181 1.360 -12.947
732 HA THR 95 HA THR 95 -1.454 0.843 -11.844
733 HB THR 95 HB THR 95 -0.685 0.456 -14.156
734 HG1 THR 95 1HG THR 95 -2.254 0.011 -15.724
735 HG21 THR 95 1HG2 THR 95 -1.280 -1.444 -12.640
736 HG22 THR 95 2HG2 THR 95 -2.920 -1.448 -13.314
737 HG23 THR 95 3HG2 THR 95 -1.527 -1.823 -14.354
738 H GLY 96 H GLY 96 0.247 2.207 -12.539
739 HA2 GLY 96 2HA GLY 96 -0.087 4.678 -13.928
740 HA3 GLY 96 3HA GLY 96 -0.255 4.949 -12.189
741 H LYS 97 H LYS 97 1.757 6.227 -13.381
742 HA LYS 97 HA LYS 97 4.248 4.608 -13.325
743 HB2 LYS 97 2HB LYS 97 3.736 7.466 -14.242
744 HB3 LYS 97 3HB LYS 97 5.244 6.581 -14.436
745 HG2 LYS 97 2HG LYS 97 2.588 5.870 -15.757
746 HG3 LYS 97 3HG LYS 97 3.968 6.662 -16.516
747 HD2 LYS 97 2HD LYS 97 5.362 4.627 -16.068
748 HD3 LYS 97 3HD LYS 97 3.917 3.813 -15.421
749 HE2 LYS 97 2HE LYS 97 2.758 4.136 -17.586
750 HE3 LYS 97 3HE LYS 97 4.179 4.963 -18.235
751 HZ1 LYS 97 3HZ LYS 97 5.440 2.898 -17.934
752 HZ2 LYS 97 1HZ LYS 97 4.127 2.130 -17.334
753 HZ3 LYS 97 2HZ LYS 97 4.145 2.627 -18.888
754 H GLY 98 H GLY 98 2.729 6.853 -11.181
755 HA2 GLY 98 2HA GLY 98 3.466 7.900 -9.230
756 HA3 GLY 98 3HA GLY 98 4.828 6.780 -9.209
757 H GLN 99 H GLN 99 6.568 8.045 -8.884
758 HA GLN 99 HA GLN 99 7.261 10.003 -11.023
759 HB2 GLN 99 2HB GLN 99 7.899 10.256 -8.063
760 HB3 GLN 99 3HB GLN 99 8.696 11.182 -9.346
761 HG2 GLN 99 2HG GLN 99 6.384 11.998 -10.060
762 HG3 GLN 99 3HG GLN 99 5.759 11.292 -8.563
763 HE21 GLN 99 2HE2 GLN 99 7.016 12.055 -6.479
764 HE22 GLN 99 1HE2 GLN 99 7.505 13.731 -6.451
765 H ASP 100 H ASP 100 9.391 9.963 -11.745
766 HA ASP 100 HA ASP 100 10.554 7.339 -11.804
767 HB2 ASP 100 2HB ASP 100 10.542 8.854 -13.728
768 HB3 ASP 100 3HB ASP 100 11.568 10.001 -12.863
769 H GLY 101 H GLY 101 12.285 6.456 -10.828
770 HA2 GLY 101 2HA GLY 101 14.561 7.492 -9.716
771 HA3 GLY 101 3HA GLY 101 13.379 7.680 -8.418
772 H ILE 102 H ILE 102 15.160 6.226 -7.504
773 HA ILE 102 HA ILE 102 14.083 3.489 -7.442
774 HB ILE 102 HB ILE 102 16.012 3.502 -9.054
775 HG12 ILE 102 2HG1 ILE 102 17.299 1.601 -8.024
776 HG13 ILE 102 3HG1 ILE 102 16.369 1.815 -6.546
777 HG21 ILE 102 1HG2 ILE 102 17.408 5.235 -7.930
778 HG22 ILE 102 2HG2 ILE 102 17.771 4.072 -6.634
779 HG23 ILE 102 3HG2 ILE 102 18.294 3.751 -8.295
780 HD11 ILE 102 3HD1 ILE 102 15.450 0.017 -7.960
781 HD12 ILE 102 1HD1 ILE 102 14.273 1.337 -7.853
782 HD13 ILE 102 2HD1 ILE 102 15.258 1.147 -9.314
783 H GLY 103 H GLY 103 14.185 2.527 -5.421
784 HA2 GLY 103 2HA GLY 103 14.557 4.207 -3.100
785 HA3 GLY 103 3HA GLY 103 14.265 2.475 -3.089
786 H SER 104 H SER 104 16.115 4.204 -1.530
787 HA SER 104 HA SER 104 18.401 2.406 -1.546
788 HB2 SER 104 2HB SER 104 20.102 4.183 -1.597
789 HB3 SER 104 3HB SER 104 19.216 4.077 -3.125
790 HG SER 104 HG SER 104 19.466 6.247 -2.429
791 H LYS 105 H LYS 105 19.597 2.473 0.411
792 HA LYS 105 HA LYS 105 18.011 3.362 2.723
793 HB2 LYS 105 2HB LYS 105 18.964 1.073 2.520
794 HB3 LYS 105 3HB LYS 105 20.593 1.750 2.626
795 HG2 LYS 105 2HG LYS 105 20.165 2.544 4.904
796 HG3 LYS 105 3HG LYS 105 18.452 2.089 4.778
797 HD2 LYS 105 2HD LYS 105 19.120 -0.290 4.478
798 HD3 LYS 105 3HD LYS 105 20.817 0.153 4.695
799 HE2 LYS 105 2HE LYS 105 18.622 0.678 6.758
800 HE3 LYS 105 3HE LYS 105 19.596 -0.793 6.728
801 HZ1 LYS 105 3HZ LYS 105 21.580 0.565 7.057
802 HZ2 LYS 105 1HZ LYS 105 20.694 1.951 7.106
803 HZ3 LYS 105 2HZ LYS 105 20.496 0.829 8.263
804 H ALA 106 H ALA 106 18.713 4.679 4.385
805 HA ALA 106 HA ALA 106 21.222 6.150 4.239
806 HB1 ALA 106 1HB ALA 106 20.070 8.338 4.462
807 HB2 ALA 106 2HB ALA 106 19.697 7.573 2.905
808 HB3 ALA 106 3HB ALA 106 18.500 7.544 4.220
809 H GLU 107 H GLU 107 21.908 6.600 6.204
810 HA GLU 107 HA GLU 107 22.317 6.383 8.422
811 HB2 GLU 107 2HB GLU 107 19.336 6.733 8.876
812 HB3 GLU 107 3HB GLU 107 20.608 6.847 10.087
813 HG2 GLU 107 2HG GLU 107 21.626 8.748 8.828
814 HG3 GLU 107 3HG GLU 107 20.272 8.701 7.695
815 H LYS 108 H LYS 108 21.559 5.085 10.521
816 HA LYS 108 HA LYS 108 22.127 2.338 9.902
817 HB2 LYS 108 2HB LYS 108 21.343 3.692 12.514
818 HB3 LYS 108 3HB LYS 108 21.879 2.014 12.363
819 HG2 LYS 108 2HG LYS 108 24.040 2.784 11.391
820 HG3 LYS 108 3HG LYS 108 23.531 4.469 11.614
821 HD2 LYS 108 2HD LYS 108 23.346 4.092 14.061
822 HD3 LYS 108 3HD LYS 108 23.859 2.405 13.837
823 HE2 LYS 108 2HE LYS 108 26.003 3.196 12.851
824 HE3 LYS 108 3HE LYS 108 25.493 4.874 13.085
825 HZ1 LYS 108 3HZ LYS 108 25.912 2.899 15.269
826 HZ2 LYS 108 1HZ LYS 108 26.924 4.123 14.897
827 HZ3 LYS 108 2HZ LYS 108 25.439 4.449 15.487
Start of MODEL 13
1 H1 MET 1 H1 MET 1 2.552 2.088 26.516
2 H2 MET 1 H2 MET 1 1.562 3.350 26.210
3 H3 MET 1 H3 MET 1 3.182 3.547 26.104
4 HA MET 1 HA MET 1 2.221 3.413 23.904
5 HB2 MET 1 2HB MET 1 3.895 0.975 24.662
6 HB3 MET 1 3HB MET 1 3.531 1.459 23.009
7 HG2 MET 1 2HG MET 1 5.118 3.057 25.044
8 HG3 MET 1 3HG MET 1 5.746 2.223 23.634
9 HE1 MET 1 1HE MET 1 5.645 3.068 21.189
10 HE2 MET 1 2HE MET 1 3.869 2.964 21.200
11 HE3 MET 1 3HE MET 1 4.668 4.444 20.635
12 H ALA 2 H ALA 2 1.119 2.166 22.287
13 HA ALA 2 HA ALA 2 -0.512 -0.138 23.169
14 HB1 ALA 2 1HB ALA 2 -2.571 0.905 22.292
15 HB2 ALA 2 2HB ALA 2 -1.906 1.851 23.636
16 HB3 ALA 2 3HB ALA 2 -1.683 2.409 21.960
17 H GLU 3 H GLU 3 -1.449 -1.325 21.380
18 HA GLU 3 HA GLU 3 -0.408 -0.834 18.659
19 HB2 GLU 3 2HB GLU 3 1.398 -2.030 19.911
20 HB3 GLU 3 3HB GLU 3 0.274 -3.347 20.253
21 HG2 GLU 3 2HG GLU 3 0.100 -3.861 17.855
22 HG3 GLU 3 3HG GLU 3 1.078 -2.444 17.453
23 H SER 4 H SER 4 -1.516 -1.915 17.041
24 HA SER 4 HA SER 4 -3.668 -3.827 17.732
25 HB2 SER 4 2HB SER 4 -5.235 -2.722 16.214
26 HB3 SER 4 3HB SER 4 -4.780 -1.675 17.569
27 HG SER 4 HG SER 4 -4.704 -0.473 15.682
28 H SER 5 H SER 5 -4.182 -5.302 16.091
29 HA SER 5 HA SER 5 -2.187 -5.535 13.889
30 HB2 SER 5 2HB SER 5 -1.818 -7.884 14.551
31 HB3 SER 5 3HB SER 5 -1.381 -6.759 15.843
32 HG SER 5 HG SER 5 -2.635 -8.517 16.633
33 H ASP 6 H ASP 6 -5.258 -5.070 14.043
34 HA ASP 6 HA ASP 6 -6.045 -7.068 12.063
35 HB2 ASP 6 2HB ASP 6 -8.192 -5.933 12.048
36 HB3 ASP 6 3HB ASP 6 -7.687 -6.248 13.701
37 H LYS 7 H LYS 7 -3.758 -5.129 11.640
38 HA LYS 7 HA LYS 7 -4.623 -3.564 9.263
39 HB2 LYS 7 2HB LYS 7 -2.114 -3.214 10.954
40 HB3 LYS 7 3HB LYS 7 -2.751 -2.131 9.724
41 HG2 LYS 7 2HG LYS 7 -3.881 -2.725 12.484
42 HG3 LYS 7 3HG LYS 7 -3.198 -1.203 11.919
43 HD2 LYS 7 2HD LYS 7 -5.127 -0.839 10.427
44 HD3 LYS 7 3HD LYS 7 -5.784 -2.432 10.843
45 HE2 LYS 7 2HE LYS 7 -5.724 -1.702 13.281
46 HE3 LYS 7 3HE LYS 7 -5.451 -0.052 12.682
47 HZ1 LYS 7 3HZ LYS 7 -7.794 -1.809 12.250
48 HZ2 LYS 7 1HZ LYS 7 -7.796 -0.308 12.902
49 HZ3 LYS 7 2HZ LYS 7 -7.547 -0.519 11.276
50 H LEU 8 H LEU 8 -4.636 -5.898 8.583
51 HA LEU 8 HA LEU 8 -2.293 -7.158 7.676
52 HB2 LEU 8 2HB LEU 8 -3.686 -8.474 6.302
53 HB3 LEU 8 3HB LEU 8 -4.496 -8.245 7.842
54 HG LEU 8 HG LEU 8 -5.154 -6.674 5.311
55 HD11 LEU 8 1HD1 LEU 8 -7.068 -8.174 5.083
56 HD12 LEU 8 2HD1 LEU 8 -5.565 -9.096 5.029
57 HD13 LEU 8 3HD1 LEU 8 -6.551 -9.099 6.513
58 HD21 LEU 8 3HD2 LEU 8 -6.641 -6.937 7.947
59 HD22 LEU 8 1HD2 LEU 8 -6.004 -5.447 7.196
60 HD23 LEU 8 2HD2 LEU 8 -7.354 -6.290 6.457
61 H TYR 9 H TYR 9 -3.706 -4.219 6.493
62 HA TYR 9 HA TYR 9 -1.800 -4.225 4.224
63 HB2 TYR 9 2HB TYR 9 -4.470 -2.820 4.243
64 HB3 TYR 9 3HB TYR 9 -3.360 -2.982 2.889
65 HD1 TYR 9 HD2 TYR 9 -2.763 -5.882 2.856
66 HD2 TYR 9 HD1 TYR 9 -6.473 -3.840 3.632
67 HE1 TYR 9 HE2 TYR 9 -4.021 -7.909 2.154
68 HE2 TYR 9 HE1 TYR 9 -7.737 -5.867 2.926
69 HH TYR 9 HH TYR 9 -7.584 -7.939 1.948
70 H ARG 10 H ARG 10 -0.821 -2.208 3.809
71 HA ARG 10 HA ARG 10 -1.496 0.095 5.492
72 HB2 ARG 10 2HB ARG 10 0.243 -0.297 6.861
73 HB3 ARG 10 3HB ARG 10 0.940 -1.475 5.798
74 HG2 ARG 10 2HG ARG 10 2.626 0.109 6.040
75 HG3 ARG 10 3HG ARG 10 1.959 0.439 4.451
76 HD2 ARG 10 2HD ARG 10 2.314 2.543 5.420
77 HD3 ARG 10 3HD ARG 10 0.577 2.273 5.543
78 HE ARG 10 HE ARG 10 1.092 1.553 7.976
79 HH11 ARG 10 1HH2 ARG 10 2.978 4.233 6.538
80 HH12 ARG 10 2HH2 ARG 10 2.271 5.332 7.721
81 HH21 ARG 10 1HH1 ARG 10 0.780 2.896 9.568
82 HH22 ARG 10 2HH1 ARG 10 1.385 4.562 9.503
83 H VAL 11 H VAL 11 -1.045 2.102 4.516
84 HA VAL 11 HA VAL 11 0.239 2.164 1.845
85 HB VAL 11 HB VAL 11 -2.272 1.962 1.629
86 HG11 VAL 11 1HG1 VAL 11 -2.297 4.903 2.440
87 HG12 VAL 11 2HG1 VAL 11 -3.674 3.908 1.944
88 HG13 VAL 11 3HG1 VAL 11 -2.843 3.617 3.490
89 HG21 VAL 11 3HG2 VAL 11 -2.393 3.561 -0.223
90 HG22 VAL 11 1HG2 VAL 11 -1.082 4.540 0.470
91 HG23 VAL 11 2HG2 VAL 11 -0.735 2.945 -0.172
92 H GLU 12 H GLU 12 1.375 4.073 1.442
93 HA GLU 12 HA GLU 12 0.949 6.441 3.089
94 HB2 GLU 12 2HB GLU 12 3.133 6.540 4.123
95 HB3 GLU 12 3HB GLU 12 2.302 5.070 4.624
96 HG2 GLU 12 2HG GLU 12 3.633 3.763 2.976
97 HG3 GLU 12 3HG GLU 12 4.481 5.234 2.495
98 H TYR 13 H TYR 13 2.223 8.267 2.485
99 HA TYR 13 HA TYR 13 3.392 8.302 -0.211
100 HB2 TYR 13 2HB TYR 13 3.583 10.325 2.043
101 HB3 TYR 13 3HB TYR 13 4.074 10.572 0.375
102 HD1 TYR 13 HD1 TYR 13 1.305 9.028 -0.587
103 HD2 TYR 13 HD2 TYR 13 2.332 12.421 1.879
104 HE1 TYR 13 HE1 TYR 13 -0.887 10.079 -1.107
105 HE2 TYR 13 HE2 TYR 13 0.139 13.463 1.355
106 HH TYR 13 HH TYR 13 -1.777 13.311 0.138
107 H ALA 14 H ALA 14 5.445 7.816 -0.677
108 HA ALA 14 HA ALA 14 7.189 6.673 1.325
109 HB1 ALA 14 1HB ALA 14 7.595 7.306 -1.629
110 HB2 ALA 14 2HB ALA 14 8.660 6.292 -0.632
111 HB3 ALA 14 3HB ALA 14 6.989 5.783 -0.958
112 H LYS 15 H LYS 15 8.174 7.970 2.766
113 HA LYS 15 HA LYS 15 9.127 10.672 2.075
114 HB2 LYS 15 2HB LYS 15 9.373 9.104 4.676
115 HB3 LYS 15 3HB LYS 15 9.687 10.820 4.465
116 HG2 LYS 15 2HG LYS 15 7.002 9.397 4.271
117 HG3 LYS 15 3HG LYS 15 7.532 10.506 5.521
118 HD2 LYS 15 2HD LYS 15 6.943 11.232 2.617
119 HD3 LYS 15 3HD LYS 15 5.926 11.565 4.020
120 HE2 LYS 15 2HE LYS 15 7.738 12.973 5.002
121 HE3 LYS 15 3HE LYS 15 8.732 12.684 3.568
122 HZ1 LYS 15 3HZ LYS 15 7.533 14.787 3.402
123 HZ2 LYS 15 1HZ LYS 15 7.000 13.779 2.235
124 HZ3 LYS 15 2HZ LYS 15 6.089 14.048 3.566
125 H SER 16 H SER 16 10.570 7.533 2.351
126 HA SER 16 HA SER 16 13.218 8.593 1.557
127 HB2 SER 16 2HB SER 16 14.367 7.286 3.279
128 HB3 SER 16 3HB SER 16 13.275 8.465 4.020
129 HG SER 16 HG SER 16 12.991 6.481 5.037
130 H GLY 17 H GLY 17 14.583 7.027 0.573
131 HA2 GLY 17 2HA GLY 17 13.146 5.118 -1.055
132 HA3 GLY 17 3HA GLY 17 14.860 5.516 -1.144
133 H ARG 18 H ARG 18 13.539 4.391 1.906
134 HA ARG 18 HA ARG 18 15.587 2.317 2.038
135 HB2 ARG 18 2HB ARG 18 13.493 3.203 4.036
136 HB3 ARG 18 3HB ARG 18 14.775 2.017 4.323
137 HG2 ARG 18 2HG ARG 18 16.424 3.871 3.495
138 HG3 ARG 18 3HG ARG 18 15.069 4.990 3.765
139 HD2 ARG 18 2HD ARG 18 14.883 4.085 6.096
140 HD3 ARG 18 3HD ARG 18 16.297 3.058 5.749
141 HE ARG 18 HE ARG 18 17.079 5.699 5.176
142 HH11 ARG 18 1HH2 ARG 18 16.115 3.964 8.063
143 HH12 ARG 18 2HH2 ARG 18 17.038 5.008 9.111
144 HH21 ARG 18 1HH1 ARG 18 18.236 6.994 6.570
145 HH22 ARG 18 2HH1 ARG 18 18.207 6.673 8.279
146 H ALA 19 H ALA 19 12.131 2.174 1.395
147 HA ALA 19 HA ALA 19 11.890 -0.632 2.150
148 HB1 ALA 19 1HB ALA 19 9.593 -0.410 1.355
149 HB2 ALA 19 2HB ALA 19 10.014 0.928 2.435
150 HB3 ALA 19 3HB ALA 19 9.954 1.192 0.674
151 H SER 20 H SER 20 11.631 -2.404 0.830
152 HA SER 20 HA SER 20 12.455 -2.137 -2.021
153 HB2 SER 20 2HB SER 20 13.386 -4.372 -1.897
154 HB3 SER 20 3HB SER 20 14.167 -3.254 -0.768
155 HG SER 20 HG SER 20 13.775 -5.161 0.306
156 H CYS 21 HN CYS 21 11.302 -3.135 -3.610
157 HA CYS 21 HA CYS 21 8.528 -3.773 -2.922
158 HB2 CYS 21 2HB CYS 21 9.156 -2.288 -4.797
159 HB3 CYS 21 3HB CYS 21 9.944 -3.663 -5.597
160 H LYS 22 H LYS 22 7.797 -5.708 -2.548
161 HA LYS 22 HA LYS 22 9.501 -8.072 -2.858
162 HB2 LYS 22 2HB LYS 22 6.700 -7.863 -1.721
163 HB3 LYS 22 3HB LYS 22 7.830 -9.181 -1.453
164 HG2 LYS 22 2HG LYS 22 8.324 -6.322 -0.567
165 HG3 LYS 22 3HG LYS 22 7.512 -7.520 0.417
166 HD2 LYS 22 2HD LYS 22 9.499 -8.989 0.315
167 HD3 LYS 22 3HD LYS 22 10.360 -7.791 -0.681
168 HE2 LYS 22 2HE LYS 22 9.182 -7.207 2.057
169 HE3 LYS 22 3HE LYS 22 10.826 -7.825 1.858
170 HZ1 LYS 22 3HZ LYS 22 10.719 -5.355 2.011
171 HZ2 LYS 22 1HZ LYS 22 11.434 -5.847 0.644
172 HZ3 LYS 22 2HZ LYS 22 9.921 -5.288 0.568
173 H LYS 23 H LYS 23 7.422 -6.680 -4.994
174 HA LYS 23 HA LYS 23 6.510 -9.272 -6.198
175 HB2 LYS 23 2HB LYS 23 4.710 -7.795 -5.496
176 HB3 LYS 23 3HB LYS 23 5.389 -6.470 -6.442
177 HG2 LYS 23 2HG LYS 23 3.444 -7.456 -7.529
178 HG3 LYS 23 3HG LYS 23 4.883 -7.650 -8.530
179 HD2 LYS 23 2HD LYS 23 5.080 -10.016 -7.844
180 HD3 LYS 23 3HD LYS 23 3.716 -9.823 -6.724
181 HE2 LYS 23 2HE LYS 23 2.228 -9.285 -8.621
182 HE3 LYS 23 3HE LYS 23 3.592 -9.409 -9.744
183 HZ1 LYS 23 3HZ LYS 23 2.278 -11.460 -9.694
184 HZ2 LYS 23 1HZ LYS 23 3.785 -11.763 -9.148
185 HZ3 LYS 23 2HZ LYS 23 2.538 -11.654 -8.096
186 H CYS 24 HN CYS 24 7.795 -6.074 -7.255
187 HA CYS 24 HA CYS 24 8.683 -7.386 -9.764
188 HB2 CYS 24 2HB CYS 24 8.674 -5.360 -10.845
189 HB3 CYS 24 3HB CYS 24 7.168 -5.430 -9.935
190 H SER 25 H SER 25 10.027 -6.835 -6.841
191 HA SER 25 HA SER 25 12.085 -6.981 -5.996
192 HB2 SER 25 2HB SER 25 12.865 -8.161 -8.667
193 HB3 SER 25 3HB SER 25 13.742 -8.332 -7.137
194 HG SER 25 HG SER 25 12.367 -10.126 -7.562
195 H GLU 26 H GLU 26 11.481 -4.437 -7.328
196 HA GLU 26 HA GLU 26 14.259 -3.331 -7.562
197 HB2 GLU 26 2HB GLU 26 11.579 -2.030 -8.172
198 HB3 GLU 26 3HB GLU 26 13.153 -1.267 -8.346
199 HG2 GLU 26 2HG GLU 26 12.076 -3.608 -9.961
200 HG3 GLU 26 3HG GLU 26 12.318 -1.958 -10.512
201 H SER 27 H SER 27 14.145 -0.919 -6.476
202 HA SER 27 HA SER 27 12.966 -1.238 -3.748
203 HB2 SER 27 2HB SER 27 15.453 0.320 -4.430
204 HB3 SER 27 3HB SER 27 14.650 0.194 -2.841
205 HG SER 27 HG SER 27 16.427 -1.287 -3.109
206 H ILE 28 H ILE 28 11.954 0.516 -2.780
207 HA ILE 28 HA ILE 28 10.391 1.830 -4.855
208 HB ILE 28 HB ILE 28 9.950 1.637 -1.861
209 HG12 ILE 28 2HG1 ILE 28 8.583 0.031 -4.067
210 HG13 ILE 28 3HG1 ILE 28 9.973 -0.573 -3.171
211 HG21 ILE 28 1HG2 ILE 28 8.705 3.546 -2.843
212 HG22 ILE 28 2HG2 ILE 28 8.072 2.493 -4.125
213 HG23 ILE 28 3HG2 ILE 28 7.590 2.243 -2.445
214 HD11 ILE 28 3HD1 ILE 28 8.035 -1.496 -2.162
215 HD12 ILE 28 1HD1 ILE 28 8.731 -0.326 -1.035
216 HD13 ILE 28 2HD1 ILE 28 7.273 0.089 -1.967
217 HA PRO 29 HA PRO 29 12.627 5.688 -4.091
218 HB2 PRO 29 2HB PRO 29 11.414 7.319 -5.915
219 HB3 PRO 29 3HB PRO 29 12.535 6.013 -6.388
220 HG2 PRO 29 2HG PRO 29 9.505 5.927 -6.318
221 HG3 PRO 29 3HG PRO 29 10.604 5.415 -7.640
222 HD2 PRO 29 2HD PRO 29 9.561 3.647 -5.848
223 HD3 PRO 29 3HD PRO 29 11.219 3.451 -6.504
224 H LYS 30 H LYS 30 12.293 7.755 -3.188
225 HA LYS 30 HA LYS 30 9.842 8.176 -1.636
226 HB2 LYS 30 2HB LYS 30 10.907 10.086 -0.685
227 HB3 LYS 30 3HB LYS 30 11.953 8.669 -0.607
228 HG2 LYS 30 2HG LYS 30 13.273 9.489 -2.506
229 HG3 LYS 30 3HG LYS 30 12.186 10.884 -2.685
230 HD2 LYS 30 2HD LYS 30 12.807 11.695 -0.441
231 HD3 LYS 30 3HD LYS 30 13.861 10.274 -0.200
232 HE2 LYS 30 2HE LYS 30 15.169 10.878 -2.173
233 HE3 LYS 30 3HE LYS 30 14.103 12.254 -2.491
234 HZ1 LYS 30 3HZ LYS 30 16.134 12.961 -1.335
235 HZ2 LYS 30 1HZ LYS 30 14.845 13.232 -0.374
236 HZ3 LYS 30 2HZ LYS 30 15.833 11.963 -0.081
237 H ASP 31 H ASP 31 8.800 10.323 -1.644
238 HA ASP 31 HA ASP 31 7.262 11.626 -2.628
239 HB2 ASP 31 2HB ASP 31 9.285 12.915 -3.247
240 HB3 ASP 31 3HB ASP 31 9.300 12.116 -4.818
241 H SER 32 H SER 32 6.808 9.054 -2.895
242 HA SER 32 HA SER 32 5.136 8.816 -5.318
243 HB2 SER 32 2HB SER 32 7.377 7.698 -5.757
244 HB3 SER 32 3HB SER 32 6.991 6.567 -4.446
245 HG SER 32 HG SER 32 6.371 5.841 -6.586
246 H LEU 33 H LEU 33 3.820 6.605 -4.994
247 HA LEU 33 HA LEU 33 2.770 6.580 -2.193
248 HB2 LEU 33 2HB LEU 33 1.238 7.503 -3.939
249 HB3 LEU 33 3HB LEU 33 1.359 5.979 -4.815
250 HG LEU 33 HG LEU 33 0.370 4.818 -2.803
251 HD11 LEU 33 1HD1 LEU 33 -0.908 6.213 -1.190
252 HD12 LEU 33 2HD1 LEU 33 0.824 6.516 -1.049
253 HD13 LEU 33 3HD1 LEU 33 -0.216 7.680 -1.899
254 HD21 LEU 33 3HD2 LEU 33 -1.317 7.058 -3.989
255 HD22 LEU 33 1HD2 LEU 33 -0.983 5.500 -4.780
256 HD23 LEU 33 2HD2 LEU 33 -1.919 5.543 -3.272
257 H ARG 34 H ARG 34 2.813 4.674 -1.095
258 HA ARG 34 HA ARG 34 3.380 2.137 -2.538
259 HB2 ARG 34 2HB ARG 34 5.241 1.570 -1.154
260 HB3 ARG 34 3HB ARG 34 5.547 3.096 -1.978
261 HG2 ARG 34 2HG ARG 34 5.105 4.338 0.118
262 HG3 ARG 34 3HG ARG 34 4.751 2.809 0.958
263 HD2 ARG 34 2HD ARG 34 7.027 1.991 0.493
264 HD3 ARG 34 3HD ARG 34 7.373 3.455 -0.442
265 HE ARG 34 HE ARG 34 6.631 3.832 2.415
266 HH11 ARG 34 1HH2 ARG 34 9.314 3.721 0.139
267 HH12 ARG 34 2HH2 ARG 34 10.340 4.632 1.212
268 HH21 ARG 34 1HH1 ARG 34 7.934 4.785 3.701
269 HH22 ARG 34 2HH1 ARG 34 9.642 5.041 3.315
270 H MET 35 H MET 35 3.103 0.248 -1.308
271 HA MET 35 HA MET 35 1.225 0.447 0.975
272 HB2 MET 35 2HB MET 35 0.826 -1.098 -1.614
273 HB3 MET 35 3HB MET 35 -0.039 -1.505 -0.118
274 HG2 MET 35 2HG MET 35 -0.919 0.795 -0.012
275 HG3 MET 35 3HG MET 35 -0.129 1.164 -1.552
276 HE1 MET 35 3HE MET 35 -2.446 -1.756 -0.090
277 HE2 MET 35 1HE MET 35 -3.230 -0.202 0.283
278 HE3 MET 35 2HE MET 35 -3.981 -1.312 -0.881
279 H ALA 36 H ALA 36 0.966 -1.558 2.165
280 HA ALA 36 HA ALA 36 3.220 -3.435 1.923
281 HB1 ALA 36 1HB ALA 36 3.899 -1.539 3.429
282 HB2 ALA 36 2HB ALA 36 2.641 -2.059 4.553
283 HB3 ALA 36 3HB ALA 36 3.983 -3.153 4.172
284 H ILE 37 H ILE 37 2.995 -5.361 3.369
285 HA ILE 37 HA ILE 37 0.178 -5.917 4.184
286 HB ILE 37 HB ILE 37 1.895 -7.283 2.194
287 HG12 ILE 37 2HG1 ILE 37 -1.102 -7.391 2.732
288 HG13 ILE 37 3HG1 ILE 37 -0.311 -6.085 1.847
289 HG21 ILE 37 1HG2 ILE 37 0.297 -9.010 4.105
290 HG22 ILE 37 2HG2 ILE 37 1.076 -9.526 2.578
291 HG23 ILE 37 3HG2 ILE 37 2.070 -8.987 3.920
292 HD11 ILE 37 3HD1 ILE 37 0.477 -7.689 0.141
293 HD12 ILE 37 1HD1 ILE 37 -0.384 -8.997 0.981
294 HD13 ILE 37 2HD1 ILE 37 -1.290 -7.645 0.277
295 H MET 38 H MET 38 -0.129 -7.035 6.069
296 HA MET 38 HA MET 38 2.276 -7.437 7.728
297 HB2 MET 38 2HB MET 38 -0.040 -6.391 8.435
298 HB3 MET 38 3HB MET 38 -0.530 -8.075 8.620
299 HG2 MET 38 2HG MET 38 0.190 -7.678 10.726
300 HG3 MET 38 3HG MET 38 1.725 -8.205 10.038
301 HE1 MET 38 3HE MET 38 2.585 -5.444 8.345
302 HE2 MET 38 1HE MET 38 3.649 -4.791 9.612
303 HE3 MET 38 2HE MET 38 3.609 -6.543 9.301
304 H VAL 39 H VAL 39 3.407 -9.223 7.729
305 HA VAL 39 HA VAL 39 1.984 -11.845 7.794
306 HB VAL 39 HB VAL 39 2.733 -11.409 5.464
307 HG11 VAL 39 1HG1 VAL 39 4.802 -10.124 5.954
308 HG12 VAL 39 2HG1 VAL 39 5.570 -11.611 6.543
309 HG13 VAL 39 3HG1 VAL 39 5.050 -11.486 4.852
310 HG21 VAL 39 3HG2 VAL 39 4.229 -13.744 6.670
311 HG22 VAL 39 1HG2 VAL 39 2.480 -13.717 6.322
312 HG23 VAL 39 2HG2 VAL 39 3.655 -13.546 5.011
313 H GLN 40 H GLN 40 3.136 -13.547 8.816
314 HA GLN 40 HA GLN 40 4.973 -12.757 10.945
315 HB2 GLN 40 2HB GLN 40 5.056 -15.249 11.342
316 HB3 GLN 40 3HB GLN 40 3.489 -14.459 11.534
317 HG2 GLN 40 2HG GLN 40 2.722 -15.276 9.366
318 HG3 GLN 40 3HG GLN 40 4.306 -15.961 9.010
319 HE21 GLN 40 2HE2 GLN 40 2.579 -17.842 8.676
320 HE22 GLN 40 1HE2 GLN 40 2.379 -18.871 10.086
321 H SER 41 H SER 41 7.161 -12.840 10.990
322 HA SER 41 HA SER 41 8.466 -12.939 8.440
323 HB2 SER 41 2HB SER 41 9.002 -11.338 10.341
324 HB3 SER 41 3HB SER 41 9.811 -12.704 11.128
325 HG SER 41 HG SER 41 10.503 -11.336 8.783
326 HA PRO 42 HA PRO 42 10.558 -16.851 8.921
327 HB2 PRO 42 2HB PRO 42 12.126 -16.834 6.682
328 HB3 PRO 42 3HB PRO 42 10.354 -17.076 6.613
329 HG2 PRO 42 2HG PRO 42 11.904 -14.510 6.182
330 HG3 PRO 42 3HG PRO 42 10.594 -15.190 5.169
331 HD2 PRO 42 2HD PRO 42 10.175 -13.260 7.109
332 HD3 PRO 42 3HD PRO 42 8.935 -14.468 6.676
333 H MET 43 H MET 43 11.867 -13.682 9.175
334 HA MET 43 HA MET 43 14.485 -14.750 10.147
335 HB2 MET 43 2HB MET 43 15.629 -12.923 9.346
336 HB3 MET 43 3HB MET 43 14.576 -13.489 8.061
337 HG2 MET 43 2HG MET 43 12.983 -11.560 9.098
338 HG3 MET 43 3HG MET 43 14.526 -10.936 9.645
339 HE1 MET 43 3HE MET 43 12.167 -11.837 6.763
340 HE2 MET 43 1HE MET 43 13.116 -11.541 5.283
341 HE3 MET 43 2HE MET 43 13.520 -12.905 6.352
342 H PHE 44 H PHE 44 11.760 -12.776 11.011
343 HA PHE 44 HA PHE 44 13.102 -11.810 13.499
344 HB2 PHE 44 2HB PHE 44 12.509 -10.038 11.944
345 HB3 PHE 44 3HB PHE 44 10.853 -10.612 11.855
346 HD1 PHE 44 HD1 PHE 44 13.386 -9.335 14.329
347 HD2 PHE 44 HD2 PHE 44 9.215 -9.712 13.291
348 HE1 PHE 44 HE1 PHE 44 12.768 -7.919 16.277
349 HE2 PHE 44 HE2 PHE 44 8.604 -8.288 15.231
350 HZ PHE 44 HZ PHE 44 10.377 -7.397 16.730
351 H ASP 45 H ASP 45 11.748 -11.543 15.372
352 HA ASP 45 HA ASP 45 10.175 -13.996 15.857
353 HB2 ASP 45 2HB ASP 45 12.144 -13.437 17.252
354 HB3 ASP 45 3HB ASP 45 11.329 -11.974 17.804
355 H GLY 46 H GLY 46 8.641 -12.491 14.292
356 HA2 GLY 46 2HA GLY 46 6.216 -12.005 15.582
357 HA3 GLY 46 3HA GLY 46 7.080 -10.467 15.606
358 H LYS 47 H LYS 47 5.420 -9.609 14.344
359 HA LYS 47 HA LYS 47 5.007 -10.565 11.570
360 HB2 LYS 47 2HB LYS 47 3.474 -8.620 13.337
361 HB3 LYS 47 3HB LYS 47 3.020 -9.029 11.691
362 HG2 LYS 47 2HG LYS 47 3.403 -11.290 13.696
363 HG3 LYS 47 3HG LYS 47 1.975 -10.283 13.848
364 HD2 LYS 47 2HD LYS 47 2.750 -11.635 11.254
365 HD3 LYS 47 3HD LYS 47 1.798 -12.466 12.477
366 HE2 LYS 47 2HE LYS 47 0.980 -9.787 11.290
367 HE3 LYS 47 3HE LYS 47 0.527 -11.330 10.551
368 HZ1 LYS 47 3HZ LYS 47 -0.205 -10.509 13.316
369 HZ2 LYS 47 1HZ LYS 47 -1.219 -10.539 12.037
370 HZ3 LYS 47 2HZ LYS 47 -0.605 -11.930 12.619
371 H VAL 48 H VAL 48 5.464 -9.385 9.816
372 HA VAL 48 HA VAL 48 6.941 -6.824 10.150
373 HB VAL 48 HB VAL 48 8.520 -7.635 8.383
374 HG11 VAL 48 1HG1 VAL 48 9.914 -8.929 9.940
375 HG12 VAL 48 2HG1 VAL 48 9.136 -7.578 10.775
376 HG13 VAL 48 3HG1 VAL 48 8.512 -9.223 10.987
377 HG21 VAL 48 3HG2 VAL 48 7.389 -10.395 8.983
378 HG22 VAL 48 1HG2 VAL 48 7.220 -9.517 7.454
379 HG23 VAL 48 2HG2 VAL 48 8.820 -10.018 8.000
380 HA PRO 49 HA PRO 49 4.456 -5.656 6.659
381 HB2 PRO 49 2HB PRO 49 5.509 -3.228 6.006
382 HB3 PRO 49 3HB PRO 49 4.625 -3.520 7.536
383 HG2 PRO 49 2HG PRO 49 7.625 -3.491 7.086
384 HG3 PRO 49 3HG PRO 49 6.691 -2.690 8.385
385 HD2 PRO 49 2HD PRO 49 7.940 -5.129 8.694
386 HD3 PRO 49 3HD PRO 49 6.436 -4.690 9.560
387 H HIS 50 H HIS 50 4.509 -6.492 4.624
388 HA HIS 50 HA HIS 50 7.056 -6.584 3.065
389 HB2 HIS 50 2HB HIS 50 4.380 -7.991 2.863
390 HB3 HIS 50 3HB HIS 50 5.454 -7.888 1.471
391 HD2 HIS 50 HD2 HIS 50 6.943 -8.312 4.960
392 HE1 HIS 50 HE1 HIS 50 7.445 -12.051 2.972
393 HE2 HIS 50 HE2 HIS 50 8.093 -10.701 5.032
394 H TRP 51 H TRP 51 7.475 -4.618 2.243
395 HA TRP 51 HA TRP 51 5.402 -2.831 1.358
396 HB2 TRP 51 2HB TRP 51 8.425 -2.732 1.072
397 HB3 TRP 51 3HB TRP 51 7.320 -1.425 0.671
398 HD1 TRP 51 HD1 TRP 51 9.029 -3.045 3.620
399 HE1 TRP 51 HE1 TRP 51 8.506 -1.749 5.768
400 HE3 TRP 51 HE3 TRP 51 5.450 0.128 1.789
401 HZ2 TRP 51 HZ2 TRP 51 6.623 0.264 6.636
402 HZ3 TRP 51 HZ3 TRP 51 4.250 1.668 3.322
403 HH2 TRP 51 HH2 TRP 51 4.821 1.736 5.743
404 H TYR 52 H TYR 52 4.872 -2.165 -0.690
405 HA TYR 52 HA TYR 52 6.427 -3.037 -2.996
406 HB2 TYR 52 2HB TYR 52 3.543 -3.472 -3.465
407 HB3 TYR 52 3HB TYR 52 4.986 -4.287 -4.072
408 HD1 TYR 52 HD1 TYR 52 2.958 -4.155 -0.871
409 HD2 TYR 52 HD2 TYR 52 5.245 -6.477 -3.683
410 HE1 TYR 52 HE1 TYR 52 2.284 -6.258 0.303
411 HE2 TYR 52 HE2 TYR 52 4.545 -8.570 -2.527
412 HH TYR 52 HH TYR 52 2.462 -8.553 0.363
413 H HIS 53 H HIS 53 5.800 -1.833 -4.948
414 HA HIS 53 HA HIS 53 5.047 0.936 -4.619
415 HB2 HIS 53 2HB HIS 53 4.737 -0.827 -7.087
416 HB3 HIS 53 3HB HIS 53 4.660 0.912 -7.059
417 HD2 HIS 53 HD2 HIS 53 6.947 2.284 -6.454
418 HE1 HIS 53 HE1 HIS 53 9.571 -0.772 -7.841
419 HE2 HIS 53 HE2 HIS 53 9.384 1.690 -7.260
420 H PHE 54 H PHE 54 3.007 2.001 -5.268
421 HA PHE 54 HA PHE 54 0.657 1.019 -4.180
422 HB2 PHE 54 2HB PHE 54 0.760 3.303 -4.763
423 HB3 PHE 54 3HB PHE 54 1.162 2.963 -6.441
424 HD1 PHE 54 HD2 PHE 54 -1.639 2.869 -3.944
425 HD2 PHE 54 HD1 PHE 54 -0.520 2.597 -8.104
426 HE1 PHE 54 HE2 PHE 54 -4.035 3.025 -4.615
427 HE2 PHE 54 HE1 PHE 54 -2.917 2.687 -8.750
428 HZ PHE 54 HZ PHE 54 -4.670 2.884 -7.001
429 H SER 55 H SER 55 1.631 0.582 -7.667
430 HA SER 55 HA SER 55 -0.812 -0.892 -8.268
431 HB2 SER 55 2HB SER 55 0.238 -1.278 -10.446
432 HB3 SER 55 3HB SER 55 0.150 0.435 -10.003
433 HG SER 55 HG SER 55 2.220 0.540 -10.072
434 H CYS 56 HN CYS 56 2.480 -1.758 -7.291
435 HA CYS 56 HA CYS 56 2.378 -4.460 -8.080
436 HB2 CYS 56 2HB CYS 56 3.974 -2.980 -5.986
437 HB3 CYS 56 3HB CYS 56 4.232 -4.681 -6.366
438 H PHE 57 H PHE 57 1.265 -2.894 -5.064
439 HA PHE 57 HA PHE 57 0.427 -5.230 -3.633
440 HB2 PHE 57 2HB PHE 57 0.444 -2.999 -2.690
441 HB3 PHE 57 3HB PHE 57 -0.824 -2.472 -3.794
442 HD1 PHE 57 HD2 PHE 57 -3.128 -3.588 -3.658
443 HD2 PHE 57 HD1 PHE 57 -0.112 -4.075 -0.614
444 HE1 PHE 57 HE2 PHE 57 -4.849 -4.426 -2.094
445 HE2 PHE 57 HE1 PHE 57 -1.868 -4.799 0.985
446 HZ PHE 57 HZ PHE 57 -4.229 -5.020 0.237
447 H TRP 58 H TRP 58 -1.280 -3.351 -6.196
448 HA TRP 58 HA TRP 58 -3.560 -5.137 -6.210
449 HB2 TRP 58 2HB TRP 58 -2.737 -3.047 -8.234
450 HB3 TRP 58 3HB TRP 58 -4.309 -3.801 -8.085
451 HD1 TRP 58 HD1 TRP 58 -2.573 -0.778 -7.194
452 HE1 TRP 58 HE1 TRP 58 -3.535 0.499 -5.222
453 HE3 TRP 58 HE3 TRP 58 -5.972 -4.273 -5.551
454 HZ2 TRP 58 HZ2 TRP 58 -5.559 0.092 -3.186
455 HZ3 TRP 58 HZ3 TRP 58 -7.428 -3.756 -3.633
456 HH2 TRP 58 HH2 TRP 58 -7.236 -1.575 -2.461
457 H LYS 59 H LYS 59 -0.448 -5.371 -7.729
458 HA LYS 59 HA LYS 59 -1.265 -7.416 -9.701
459 HB2 LYS 59 2HB LYS 59 1.456 -6.552 -8.677
460 HB3 LYS 59 3HB LYS 59 1.209 -7.766 -9.932
461 HG2 LYS 59 2HG LYS 59 0.331 -6.199 -11.486
462 HG3 LYS 59 3HG LYS 59 0.056 -4.994 -10.243
463 HD2 LYS 59 2HD LYS 59 2.798 -5.354 -10.009
464 HD3 LYS 59 3HD LYS 59 2.566 -5.628 -11.738
465 HE2 LYS 59 2HE LYS 59 1.665 -3.457 -12.080
466 HE3 LYS 59 3HE LYS 59 1.180 -3.316 -10.390
467 HZ1 LYS 59 3HZ LYS 59 3.613 -3.201 -9.824
468 HZ2 LYS 59 1HZ LYS 59 3.935 -3.018 -11.428
469 HZ3 LYS 59 2HZ LYS 59 3.019 -1.918 -10.626
470 H VAL 60 H VAL 60 -0.156 -7.317 -6.349
471 HA VAL 60 HA VAL 60 -0.094 -10.245 -6.034
472 HB VAL 60 HB VAL 60 -0.132 -7.980 -4.002
473 HG11 VAL 60 1HG1 VAL 60 0.273 -10.966 -3.564
474 HG12 VAL 60 2HG1 VAL 60 0.600 -9.695 -2.365
475 HG13 VAL 60 3HG1 VAL 60 -1.049 -9.963 -2.923
476 HG21 VAL 60 3HG2 VAL 60 1.937 -8.130 -5.381
477 HG22 VAL 60 1HG2 VAL 60 2.221 -8.564 -3.697
478 HG23 VAL 60 2HG2 VAL 60 2.099 -9.842 -4.923
479 H GLY 61 H GLY 61 -2.477 -7.646 -5.664
480 HA2 GLY 61 2HA GLY 61 -4.692 -7.789 -6.256
481 HA3 GLY 61 3HA GLY 61 -4.491 -9.516 -6.545
482 H HIS 62 H HIS 62 -3.798 -8.164 -3.355
483 HA HIS 62 HA HIS 62 -5.844 -9.823 -2.090
484 HB2 HIS 62 2HB HIS 62 -3.841 -7.791 -1.069
485 HB3 HIS 62 3HB HIS 62 -5.099 -8.461 -0.043
486 HD2 HIS 62 HD2 HIS 62 -3.447 -10.887 -2.540
487 HE1 HIS 62 HE1 HIS 62 -1.936 -11.846 1.328
488 HE2 HIS 62 HE2 HIS 62 -2.037 -12.579 -1.109
489 H SER 63 H SER 63 -7.847 -9.328 -1.461
490 HA SER 63 HA SER 63 -9.033 -6.835 -2.443
491 HB2 SER 63 2HB SER 63 -10.312 -9.246 -1.097
492 HB3 SER 63 3HB SER 63 -11.171 -7.905 -1.877
493 HG SER 63 HG SER 63 -10.925 -9.720 -3.276
494 H ILE 64 H ILE 64 -10.080 -5.298 -1.383
495 HA ILE 64 HA ILE 64 -9.817 -5.145 1.586
496 HB ILE 64 HB ILE 64 -9.440 -2.800 -0.273
497 HG12 ILE 64 2HG1 ILE 64 -7.243 -4.664 0.632
498 HG13 ILE 64 3HG1 ILE 64 -7.665 -4.160 -0.999
499 HG21 ILE 64 1HG2 ILE 64 -8.592 -3.287 2.615
500 HG22 ILE 64 2HG2 ILE 64 -8.405 -1.774 1.715
501 HG23 ILE 64 3HG2 ILE 64 -10.025 -2.365 2.118
502 HD11 ILE 64 3HD1 ILE 64 -6.273 -2.542 1.134
503 HD12 ILE 64 1HD1 ILE 64 -5.738 -2.925 -0.503
504 HD13 ILE 64 2HD1 ILE 64 -7.051 -1.765 -0.266
505 H ARG 65 H ARG 65 -11.624 -4.464 2.595
506 HA ARG 65 HA ARG 65 -14.018 -3.724 0.927
507 HB2 ARG 65 2HB ARG 65 -15.325 -5.246 2.530
508 HB3 ARG 65 3HB ARG 65 -14.440 -5.974 1.208
509 HG2 ARG 65 2HG ARG 65 -13.102 -5.773 3.911
510 HG3 ARG 65 3HG ARG 65 -14.339 -6.986 3.669
511 HD2 ARG 65 2HD ARG 65 -13.084 -8.252 2.257
512 HD3 ARG 65 3HD ARG 65 -12.277 -6.872 1.511
513 HE ARG 65 HE ARG 65 -11.103 -6.743 3.910
514 HH11 ARG 65 1HH2 ARG 65 -11.546 -9.640 1.949
515 HH12 ARG 65 2HH2 ARG 65 -10.103 -10.362 2.608
516 HH21 ARG 65 1HH1 ARG 65 -9.449 -7.651 4.660
517 HH22 ARG 65 2HH1 ARG 65 -8.899 -9.256 4.151
518 H HIS 66 H HIS 66 -12.280 -3.172 3.857
519 HA HIS 66 HA HIS 66 -13.898 -0.733 4.165
520 HB2 HIS 66 2HB HIS 66 -13.891 -0.824 6.602
521 HB3 HIS 66 3HB HIS 66 -14.983 -1.936 5.806
522 HD2 HIS 66 HD2 HIS 66 -13.035 -4.484 5.491
523 HE1 HIS 66 HE1 HIS 66 -13.044 -4.434 9.719
524 HE2 HIS 66 HE2 HIS 66 -12.587 -5.853 7.672
525 HA PRO 67 HA PRO 67 -9.399 -0.530 3.582
526 HB2 PRO 67 2HB PRO 67 -9.310 1.777 1.978
527 HB3 PRO 67 3HB PRO 67 -9.565 0.121 1.364
528 HG2 PRO 67 2HG PRO 67 -11.669 2.165 2.103
529 HG3 PRO 67 3HG PRO 67 -11.554 1.187 0.596
530 HD2 PRO 67 2HD PRO 67 -13.182 0.438 2.566
531 HD3 PRO 67 3HD PRO 67 -12.153 -0.804 1.785
532 H ASP 68 H ASP 68 -11.407 2.270 4.602
533 HA ASP 68 HA ASP 68 -9.219 3.741 5.721
534 HB2 ASP 68 2HB ASP 68 -11.391 4.746 5.162
535 HB3 ASP 68 3HB ASP 68 -12.213 3.686 6.304
536 H VAL 69 H VAL 69 -10.694 0.842 6.754
537 HA VAL 69 HA VAL 69 -9.756 1.125 9.545
538 HB VAL 69 HB VAL 69 -11.414 -1.123 8.375
539 HG11 VAL 69 1HG1 VAL 69 -10.984 -0.180 11.240
540 HG12 VAL 69 2HG1 VAL 69 -12.069 -1.492 10.730
541 HG13 VAL 69 3HG1 VAL 69 -10.329 -1.666 10.509
542 HG21 VAL 69 3HG2 VAL 69 -12.397 1.418 9.739
543 HG22 VAL 69 1HG2 VAL 69 -12.733 0.902 8.067
544 HG23 VAL 69 2HG2 VAL 69 -13.393 -0.022 9.414
545 H GLU 70 H GLU 70 -9.436 -0.882 6.642
546 HA GLU 70 HA GLU 70 -7.586 -2.786 7.950
547 HB2 GLU 70 2HB GLU 70 -8.574 -2.552 5.056
548 HB3 GLU 70 3HB GLU 70 -7.627 -3.894 5.697
549 HG2 GLU 70 2HG GLU 70 -9.463 -4.498 7.221
550 HG3 GLU 70 3HG GLU 70 -10.433 -3.164 6.598
551 H VAL 71 H VAL 71 -7.285 -0.169 5.622
552 HA VAL 71 HA VAL 71 -4.370 -0.649 5.150
553 HB VAL 71 HB VAL 71 -6.088 1.546 4.017
554 HG11 VAL 71 1HG1 VAL 71 -3.473 0.203 3.213
555 HG12 VAL 71 2HG1 VAL 71 -4.261 1.615 2.462
556 HG13 VAL 71 3HG1 VAL 71 -3.593 1.726 4.119
557 HG21 VAL 71 3HG2 VAL 71 -6.118 0.119 1.960
558 HG22 VAL 71 1HG2 VAL 71 -5.431 -1.226 2.906
559 HG23 VAL 71 2HG2 VAL 71 -7.052 -0.612 3.271
560 H ASP 72 H ASP 72 -3.453 -0.335 7.060
561 HA ASP 72 HA ASP 72 -3.778 2.030 8.704
562 HB2 ASP 72 2HB ASP 72 -2.939 0.041 9.630
563 HB3 ASP 72 3HB ASP 72 -1.681 -0.127 8.398
564 H GLY 73 H GLY 73 -2.596 3.936 8.698
565 HA2 GLY 73 2HA GLY 73 -1.109 5.592 7.955
566 HA3 GLY 73 3HA GLY 73 -0.482 4.486 6.732
567 H PHE 74 H PHE 74 -3.639 4.218 6.131
568 HA PHE 74 HA PHE 74 -3.964 5.985 3.919
569 HB2 PHE 74 2HB PHE 74 -5.232 3.907 4.434
570 HB3 PHE 74 3HB PHE 74 -5.951 4.678 5.842
571 HD1 PHE 74 HD2 PHE 74 -5.961 4.432 2.166
572 HD2 PHE 74 HD1 PHE 74 -7.785 6.271 5.619
573 HE1 PHE 74 HE2 PHE 74 -7.897 5.155 0.778
574 HE2 PHE 74 HE1 PHE 74 -9.713 6.984 4.217
575 HZ PHE 74 HZ PHE 74 -9.719 6.462 1.792
576 H SER 75 H SER 75 -4.332 6.604 7.372
577 HA SER 75 HA SER 75 -5.726 9.125 7.245
578 HB2 SER 75 2HB SER 75 -4.596 9.426 9.502
579 HB3 SER 75 3HB SER 75 -5.622 7.988 9.329
580 HG SER 75 HG SER 75 -3.579 7.524 10.313
581 H GLU 76 H GLU 76 -2.350 8.223 6.659
582 HA GLU 76 HA GLU 76 -1.338 10.959 6.873
583 HB2 GLU 76 2HB GLU 76 0.055 8.485 5.770
584 HB3 GLU 76 3HB GLU 76 0.794 10.013 6.228
585 HG2 GLU 76 2HG GLU 76 0.073 9.644 8.594
586 HG3 GLU 76 3HG GLU 76 -0.593 8.076 8.136
587 H LEU 77 H LEU 77 -2.813 9.067 4.399
588 HA LEU 77 HA LEU 77 -1.923 10.644 2.089
589 HB2 LEU 77 2HB LEU 77 -4.161 8.653 2.584
590 HB3 LEU 77 3HB LEU 77 -4.071 9.575 1.105
591 HG LEU 77 HG LEU 77 -2.092 8.541 0.392
592 HD11 LEU 77 1HD1 LEU 77 -1.919 7.103 3.047
593 HD12 LEU 77 2HD1 LEU 77 -0.956 6.726 1.597
594 HD13 LEU 77 3HD1 LEU 77 -0.769 8.290 2.391
595 HD21 LEU 77 3HD2 LEU 77 -4.001 6.488 1.547
596 HD22 LEU 77 1HD2 LEU 77 -4.203 7.367 0.021
597 HD23 LEU 77 2HD2 LEU 77 -2.870 6.223 0.202
598 H ARG 78 H ARG 78 -3.538 11.894 0.841
599 HA ARG 78 HA ARG 78 -5.596 13.324 2.484
600 HB2 ARG 78 2HB ARG 78 -3.795 14.398 0.272
601 HB3 ARG 78 3HB ARG 78 -5.261 15.224 0.764
602 HG2 ARG 78 2HG ARG 78 -2.874 14.654 2.579
603 HG3 ARG 78 3HG ARG 78 -3.334 16.195 1.860
604 HD2 ARG 78 2HD ARG 78 -4.292 16.525 3.886
605 HD3 ARG 78 3HD ARG 78 -5.660 15.704 3.098
606 HE ARG 78 HE ARG 78 -4.257 13.616 4.222
607 HH11 ARG 78 1HH2 ARG 78 -5.606 16.527 5.639
608 HH12 ARG 78 2HH2 ARG 78 -5.846 15.756 7.182
609 HH21 ARG 78 1HH1 ARG 78 -4.553 12.712 6.202
610 HH22 ARG 78 2HH1 ARG 78 -5.256 13.652 7.483
611 H TRP 79 H TRP 79 -7.292 14.321 1.183
612 HA TRP 79 HA TRP 79 -8.973 12.285 0.713
613 HB2 TRP 79 2HB TRP 79 -10.267 14.032 1.056
614 HB3 TRP 79 3HB TRP 79 -9.068 15.162 0.474
615 HD1 TRP 79 HD1 TRP 79 -12.273 13.477 -0.566
616 HE1 TRP 79 HE1 TRP 79 -13.096 14.482 -2.786
617 HE3 TRP 79 HE3 TRP 79 -8.107 16.155 -1.819
618 HZ2 TRP 79 HZ2 TRP 79 -12.067 16.248 -4.841
619 HZ3 TRP 79 HZ3 TRP 79 -8.045 17.507 -3.893
620 HH2 TRP 79 HH2 TRP 79 -10.020 17.564 -5.417
621 H ASP 80 H ASP 80 -7.274 13.946 -2.005
622 HA ASP 80 HA ASP 80 -8.694 12.572 -4.052
623 HB2 ASP 80 2HB ASP 80 -7.415 14.685 -4.337
624 HB3 ASP 80 3HB ASP 80 -5.910 13.794 -4.132
625 H ASP 81 H ASP 81 -6.069 11.491 -2.086
626 HA ASP 81 HA ASP 81 -5.253 9.280 -3.909
627 HB2 ASP 81 2HB ASP 81 -3.946 10.546 -1.482
628 HB3 ASP 81 3HB ASP 81 -3.505 8.937 -2.049
629 H GLN 82 H GLN 82 -6.598 10.000 -0.692
630 HA GLN 82 HA GLN 82 -7.176 7.368 0.193
631 HB2 GLN 82 2HB GLN 82 -8.488 10.085 0.555
632 HB3 GLN 82 3HB GLN 82 -9.175 8.651 1.303
633 HG2 GLN 82 2HG GLN 82 -7.104 8.204 2.504
634 HG3 GLN 82 3HG GLN 82 -6.312 9.577 1.728
635 HE21 GLN 82 2HE2 GLN 82 -6.375 9.413 4.511
636 HE22 GLN 82 1HE2 GLN 82 -7.426 10.704 5.103
637 H GLN 83 H GLN 83 -9.241 9.616 -1.746
638 HA GLN 83 HA GLN 83 -11.325 7.703 -2.178
639 HB2 GLN 83 2HB GLN 83 -10.533 10.239 -3.654
640 HB3 GLN 83 3HB GLN 83 -12.010 9.337 -3.992
641 HG2 GLN 83 2HG GLN 83 -11.355 10.391 -1.200
642 HG3 GLN 83 3HG GLN 83 -12.199 11.344 -2.408
643 HE21 GLN 83 2HE2 GLN 83 -14.358 10.583 -3.161
644 HE22 GLN 83 1HE2 GLN 83 -15.274 9.504 -2.120
645 H LYS 84 H LYS 84 -8.255 8.163 -3.904
646 HA LYS 84 HA LYS 84 -9.021 6.574 -6.231
647 HB2 LYS 84 2HB LYS 84 -7.488 8.351 -6.531
648 HB3 LYS 84 3HB LYS 84 -6.497 7.869 -5.168
649 HG2 LYS 84 2HG LYS 84 -6.770 6.022 -7.544
650 HG3 LYS 84 3HG LYS 84 -5.732 7.437 -7.653
651 HD2 LYS 84 2HD LYS 84 -5.485 5.233 -5.579
652 HD3 LYS 84 3HD LYS 84 -4.462 5.436 -7.003
653 HE2 LYS 84 2HE LYS 84 -4.645 7.281 -4.584
654 HE3 LYS 84 3HE LYS 84 -3.352 6.149 -4.940
655 HZ1 LYS 84 3HZ LYS 84 -2.712 7.460 -6.836
656 HZ2 LYS 84 1HZ LYS 84 -4.017 8.448 -6.701
657 HZ3 LYS 84 2HZ LYS 84 -2.863 8.487 -5.558
658 H VAL 85 H VAL 85 -7.293 6.068 -3.136
659 HA VAL 85 HA VAL 85 -6.687 3.266 -3.677
660 HB VAL 85 HB VAL 85 -6.811 4.926 -1.143
661 HG11 VAL 85 1HG1 VAL 85 -6.072 1.969 -1.319
662 HG12 VAL 85 2HG1 VAL 85 -5.728 3.024 0.064
663 HG13 VAL 85 3HG1 VAL 85 -7.399 2.679 -0.367
664 HG21 VAL 85 3HG2 VAL 85 -4.884 5.210 -2.756
665 HG22 VAL 85 1HG2 VAL 85 -4.422 4.689 -1.132
666 HG23 VAL 85 2HG2 VAL 85 -4.461 3.508 -2.453
667 H LYS 86 H LYS 86 -9.389 4.867 -1.939
668 HA LYS 86 HA LYS 86 -10.920 2.516 -1.381
669 HB2 LYS 86 2HB LYS 86 -11.758 5.398 -1.914
670 HB3 LYS 86 3HB LYS 86 -12.864 4.135 -1.370
671 HG2 LYS 86 2HG LYS 86 -11.638 3.849 0.712
672 HG3 LYS 86 3HG LYS 86 -10.364 4.939 0.193
673 HD2 LYS 86 2HD LYS 86 -11.792 6.136 1.720
674 HD3 LYS 86 3HD LYS 86 -12.021 6.800 0.096
675 HE2 LYS 86 2HE LYS 86 -14.079 5.230 -0.024
676 HE3 LYS 86 3HE LYS 86 -13.807 4.937 1.709
677 HZ1 LYS 86 3HZ LYS 86 -14.116 7.314 2.091
678 HZ2 LYS 86 1HZ LYS 86 -14.208 7.635 0.491
679 HZ3 LYS 86 2HZ LYS 86 -15.403 6.788 1.235
680 H LYS 87 H LYS 87 -11.084 4.684 -4.257
681 HA LYS 87 HA LYS 87 -13.053 3.110 -5.671
682 HB2 LYS 87 2HB LYS 87 -11.053 5.171 -6.577
683 HB3 LYS 87 3HB LYS 87 -12.081 4.281 -7.708
684 HG2 LYS 87 2HG LYS 87 -14.120 4.982 -6.526
685 HG3 LYS 87 3HG LYS 87 -13.160 5.891 -5.344
686 HD2 LYS 87 2HD LYS 87 -12.207 7.238 -7.204
687 HD3 LYS 87 3HD LYS 87 -13.221 6.322 -8.346
688 HE2 LYS 87 2HE LYS 87 -15.261 7.117 -7.145
689 HE3 LYS 87 3HE LYS 87 -14.244 8.049 -6.039
690 HZ1 LYS 87 3HZ LYS 87 -14.423 8.490 -8.976
691 HZ2 LYS 87 1HZ LYS 87 -15.105 9.439 -7.840
692 HZ3 LYS 87 2HZ LYS 87 -13.479 9.355 -7.960
693 H THR 88 H THR 88 -9.474 2.986 -5.783
694 HA THR 88 HA THR 88 -9.298 0.945 -7.736
695 HB THR 88 HB THR 88 -7.339 1.581 -5.507
696 HG1 THR 88 1HG THR 88 -7.643 3.317 -6.817
697 HG21 THR 88 1HG2 THR 88 -7.108 0.049 -8.116
698 HG22 THR 88 2HG2 THR 88 -5.711 0.629 -7.183
699 HG23 THR 88 3HG2 THR 88 -6.812 -0.578 -6.488
700 H ALA 89 H ALA 89 -9.811 0.661 -4.201
701 HA ALA 89 HA ALA 89 -9.519 -2.211 -4.102
702 HB1 ALA 89 1HB ALA 89 -10.942 -0.232 -2.274
703 HB2 ALA 89 2HB ALA 89 -10.617 -1.936 -1.919
704 HB3 ALA 89 3HB ALA 89 -9.265 -0.799 -2.126
705 H GLU 90 H GLU 90 -12.290 0.043 -4.567
706 HA GLU 90 HA GLU 90 -14.262 -2.045 -4.775
707 HB2 GLU 90 2HB GLU 90 -14.271 0.838 -5.755
708 HB3 GLU 90 3HB GLU 90 -15.655 -0.250 -5.885
709 HG2 GLU 90 2HG GLU 90 -15.635 -0.571 -3.419
710 HG3 GLU 90 3HG GLU 90 -14.320 0.594 -3.286
711 H ALA 91 H ALA 91 -12.180 -0.486 -7.137
712 HA ALA 91 HA ALA 91 -13.312 -1.714 -9.483
713 HB1 ALA 91 1HB ALA 91 -11.359 -0.613 -10.559
714 HB2 ALA 91 2HB ALA 91 -12.200 0.489 -9.447
715 HB3 ALA 91 3HB ALA 91 -10.679 -0.265 -8.950
716 H GLY 92 H GLY 92 -11.339 -3.063 -7.059
717 HA2 GLY 92 2HA GLY 92 -10.370 -5.143 -6.888
718 HA3 GLY 92 3HA GLY 92 -10.885 -5.520 -8.536
719 H GLY 93 H GLY 93 -8.856 -2.701 -7.805
720 HA2 GLY 93 2HA GLY 93 -6.500 -2.634 -7.709
721 HA3 GLY 93 3HA GLY 93 -6.381 -4.109 -8.660
722 H VAL 94 H VAL 94 -5.125 -1.499 -8.932
723 HA VAL 94 HA VAL 94 -5.650 -0.998 -11.827
724 HB VAL 94 HB VAL 94 -5.315 1.088 -9.648
725 HG11 VAL 94 1HG1 VAL 94 -4.949 1.501 -12.650
726 HG12 VAL 94 2HG1 VAL 94 -5.170 2.801 -11.457
727 HG13 VAL 94 3HG1 VAL 94 -3.734 1.780 -11.388
728 HG21 VAL 94 3HG2 VAL 94 -7.638 0.364 -10.292
729 HG22 VAL 94 1HG2 VAL 94 -7.318 2.057 -10.681
730 HG23 VAL 94 2HG2 VAL 94 -7.289 0.824 -11.965
731 H THR 95 H THR 95 -3.922 -0.660 -13.082
732 HA THR 95 HA THR 95 -1.190 -0.663 -11.914
733 HB THR 95 HB THR 95 -0.415 -2.106 -13.726
734 HG1 THR 95 1HG THR 95 -1.959 -3.150 -15.024
735 HG21 THR 95 1HG2 THR 95 -2.797 -3.385 -12.314
736 HG22 THR 95 2HG2 THR 95 -1.339 -4.203 -12.927
737 HG23 THR 95 3HG2 THR 95 -1.228 -3.089 -11.546
738 H GLY 96 H GLY 96 0.475 0.053 -13.610
739 HA2 GLY 96 2HA GLY 96 1.082 1.553 -15.338
740 HA3 GLY 96 3HA GLY 96 -0.576 2.155 -15.420
741 H LYS 97 H LYS 97 0.379 2.075 -12.189
742 HA LYS 97 HA LYS 97 1.530 4.832 -12.164
743 HB2 LYS 97 2HB LYS 97 -0.708 3.793 -10.369
744 HB3 LYS 97 3HB LYS 97 0.162 5.319 -10.143
745 HG2 LYS 97 2HG LYS 97 -0.590 6.063 -12.411
746 HG3 LYS 97 3HG LYS 97 -1.536 4.572 -12.568
747 HD2 LYS 97 2HD LYS 97 -2.881 5.205 -10.584
748 HD3 LYS 97 3HD LYS 97 -1.943 6.712 -10.438
749 HE2 LYS 97 2HE LYS 97 -2.637 7.348 -12.750
750 HE3 LYS 97 3HE LYS 97 -3.587 5.865 -12.871
751 HZ1 LYS 97 3HZ LYS 97 -4.960 6.675 -11.022
752 HZ2 LYS 97 1HZ LYS 97 -4.079 8.056 -10.922
753 HZ3 LYS 97 2HZ LYS 97 -4.975 7.750 -12.249
754 H GLY 98 H GLY 98 3.114 5.198 -10.649
755 HA2 GLY 98 2HA GLY 98 4.937 4.573 -9.309
756 HA3 GLY 98 3HA GLY 98 4.066 3.125 -8.804
757 H GLN 99 H GLN 99 6.097 1.981 -9.094
758 HA GLN 99 HA GLN 99 7.727 0.847 -10.135
759 HB2 GLN 99 2HB GLN 99 5.587 -0.398 -10.720
760 HB3 GLN 99 3HB GLN 99 5.733 0.280 -12.346
761 HG2 GLN 99 2HG GLN 99 7.989 -0.819 -12.555
762 HG3 GLN 99 3HG GLN 99 7.813 -1.459 -10.929
763 HE21 GLN 99 2HE2 GLN 99 8.330 -3.344 -12.727
764 HE22 GLN 99 1HE2 GLN 99 6.875 -4.211 -13.201
765 H ASP 100 H ASP 100 8.106 3.452 -10.446
766 HA ASP 100 HA ASP 100 9.802 3.582 -12.846
767 HB2 ASP 100 2HB ASP 100 7.655 4.523 -13.594
768 HB3 ASP 100 3HB ASP 100 7.630 5.618 -12.210
769 H GLY 101 H GLY 101 11.662 4.730 -12.454
770 HA2 GLY 101 2HA GLY 101 13.351 5.690 -11.160
771 HA3 GLY 101 3HA GLY 101 12.150 6.293 -10.018
772 H ILE 102 H ILE 102 14.191 5.473 -8.711
773 HA ILE 102 HA ILE 102 13.456 2.903 -7.491
774 HB ILE 102 HB ILE 102 15.049 2.384 -9.343
775 HG12 ILE 102 2HG1 ILE 102 16.042 1.717 -6.549
776 HG13 ILE 102 3HG1 ILE 102 14.731 0.912 -7.418
777 HG21 ILE 102 1HG2 ILE 102 16.461 4.459 -9.135
778 HG22 ILE 102 2HG2 ILE 102 17.181 3.765 -7.667
779 HG23 ILE 102 3HG2 ILE 102 17.383 2.962 -9.235
780 HD11 ILE 102 3HD1 ILE 102 17.677 0.912 -8.171
781 HD12 ILE 102 1HD1 ILE 102 16.702 -0.446 -7.589
782 HD13 ILE 102 2HD1 ILE 102 16.379 0.246 -9.192
783 H GLY 103 H GLY 103 14.029 2.681 -5.362
784 HA2 GLY 103 2HA GLY 103 14.842 5.028 -3.809
785 HA3 GLY 103 3HA GLY 103 14.539 3.402 -3.193
786 H SER 104 H SER 104 16.865 5.574 -3.171
787 HA SER 104 HA SER 104 19.149 3.712 -3.719
788 HB2 SER 104 2HB SER 104 18.908 6.662 -4.407
789 HB3 SER 104 3HB SER 104 20.388 5.698 -4.552
790 HG SER 104 HG SER 104 19.216 5.834 -6.531
791 H LYS 105 H LYS 105 21.074 4.056 -2.641
792 HA LYS 105 HA LYS 105 20.916 4.990 0.119
793 HB2 LYS 105 2HB LYS 105 23.223 4.165 0.281
794 HB3 LYS 105 3HB LYS 105 22.125 2.961 -0.381
795 HG2 LYS 105 2HG LYS 105 22.941 3.400 -2.664
796 HG3 LYS 105 3HG LYS 105 24.012 4.671 -2.076
797 HD2 LYS 105 2HD LYS 105 24.154 1.757 -1.180
798 HD3 LYS 105 3HD LYS 105 25.076 2.390 -2.539
799 HE2 LYS 105 2HE LYS 105 25.289 3.502 0.297
800 HE3 LYS 105 3HE LYS 105 26.320 2.218 -0.330
801 HZ1 LYS 105 3HZ LYS 105 26.149 4.928 -1.529
802 HZ2 LYS 105 1HZ LYS 105 27.359 4.411 -0.563
803 HZ3 LYS 105 2HZ LYS 105 27.133 3.720 -2.027
804 H ALA 106 H ALA 106 22.542 6.379 1.099
805 HA ALA 106 HA ALA 106 23.917 8.376 -0.473
806 HB1 ALA 106 1HB ALA 106 22.817 10.291 0.658
807 HB2 ALA 106 2HB ALA 106 21.665 9.394 -0.348
808 HB3 ALA 106 3HB ALA 106 21.654 9.183 1.419
809 H GLU 107 H GLU 107 25.610 9.156 0.649
810 HA GLU 107 HA GLU 107 25.971 8.672 3.549
811 HB2 GLU 107 2HB GLU 107 28.077 7.530 3.283
812 HB3 GLU 107 3HB GLU 107 26.804 6.638 2.458
813 HG2 GLU 107 2HG GLU 107 27.575 7.650 0.275
814 HG3 GLU 107 3HG GLU 107 28.910 8.413 1.143
815 H LYS 108 H LYS 108 27.929 9.685 4.435
816 HA LYS 108 HA LYS 108 28.194 12.447 3.475
817 HB2 LYS 108 2HB LYS 108 29.330 11.016 5.912
818 HB3 LYS 108 3HB LYS 108 29.531 12.735 5.557
819 HG2 LYS 108 2HG LYS 108 27.068 13.053 5.619
820 HG3 LYS 108 3HG LYS 108 26.857 11.336 6.019
821 HD2 LYS 108 2HD LYS 108 28.190 11.651 8.090
822 HD3 LYS 108 3HD LYS 108 28.390 13.373 7.696
823 HE2 LYS 108 2HE LYS 108 25.923 13.667 7.747
824 HE3 LYS 108 3HE LYS 108 25.722 11.954 8.135
825 HZ1 LYS 108 3HZ LYS 108 27.135 13.931 9.849
826 HZ2 LYS 108 1HZ LYS 108 25.647 13.329 10.136
827 HZ3 LYS 108 2HZ LYS 108 26.947 12.348 10.207
Start of MODEL 14
1 H1 MET 1 H1 MET 1 -3.322 -2.881 23.832
2 H2 MET 1 H2 MET 1 -2.303 -3.513 24.946
3 H3 MET 1 H3 MET 1 -1.700 -2.864 23.567
4 HA MET 1 HA MET 1 -3.103 -1.399 25.698
5 HB2 MET 1 2HB MET 1 -0.832 -2.113 26.353
6 HB3 MET 1 3HB MET 1 -0.152 -1.284 24.949
7 HG2 MET 1 2HG MET 1 -1.008 0.876 25.815
8 HG3 MET 1 3HG MET 1 -1.735 0.037 27.192
9 HE1 MET 1 1HE MET 1 -0.573 1.759 28.827
10 HE2 MET 1 2HE MET 1 1.170 2.114 28.816
11 HE3 MET 1 3HE MET 1 0.160 2.588 27.432
12 H ALA 2 H ALA 2 -0.958 -0.723 22.865
13 HA ALA 2 HA ALA 2 -2.868 1.320 21.880
14 HB1 ALA 2 1HB ALA 2 0.018 1.941 22.660
15 HB2 ALA 2 2HB ALA 2 -1.130 3.069 21.904
16 HB3 ALA 2 3HB ALA 2 -1.431 2.474 23.543
17 H GLU 3 H GLU 3 -1.111 -1.303 21.079
18 HA GLU 3 HA GLU 3 0.465 -0.515 18.861
19 HB2 GLU 3 2HB GLU 3 -0.765 -3.257 19.351
20 HB3 GLU 3 3HB GLU 3 0.622 -2.863 18.346
21 HG2 GLU 3 2HG GLU 3 1.778 -3.565 20.150
22 HG3 GLU 3 3HG GLU 3 1.599 -1.891 20.652
23 H SER 4 H SER 4 0.234 -0.701 16.650
24 HA SER 4 HA SER 4 -2.553 -0.613 15.582
25 HB2 SER 4 2HB SER 4 -0.034 0.672 14.484
26 HB3 SER 4 3HB SER 4 -1.677 0.842 13.837
27 HG SER 4 HG SER 4 -1.094 2.601 15.194
28 H SER 5 H SER 5 -0.571 -3.009 15.830
29 HA SER 5 HA SER 5 -0.122 -3.727 13.009
30 HB2 SER 5 2HB SER 5 0.703 -5.232 15.512
31 HB3 SER 5 3HB SER 5 1.321 -5.465 13.865
32 HG SER 5 HG SER 5 2.724 -4.173 15.165
33 H ASP 6 H ASP 6 -2.785 -4.143 14.800
34 HA ASP 6 HA ASP 6 -3.321 -6.865 13.938
35 HB2 ASP 6 2HB ASP 6 -4.088 -6.017 16.141
36 HB3 ASP 6 3HB ASP 6 -5.158 -4.878 15.320
37 H LYS 7 H LYS 7 -2.669 -5.702 11.736
38 HA LYS 7 HA LYS 7 -5.076 -5.086 10.106
39 HB2 LYS 7 2HB LYS 7 -2.265 -3.875 9.967
40 HB3 LYS 7 3HB LYS 7 -3.637 -3.413 8.965
41 HG2 LYS 7 2HG LYS 7 -3.481 -3.025 11.991
42 HG3 LYS 7 3HG LYS 7 -3.108 -1.803 10.803
43 HD2 LYS 7 2HD LYS 7 -5.405 -1.821 9.959
44 HD3 LYS 7 3HD LYS 7 -5.827 -3.163 11.048
45 HE2 LYS 7 2HE LYS 7 -5.173 -1.748 13.006
46 HE3 LYS 7 3HE LYS 7 -4.876 -0.400 11.898
47 HZ1 LYS 7 3HZ LYS 7 -7.109 -0.180 12.724
48 HZ2 LYS 7 1HZ LYS 7 -7.253 -0.684 11.161
49 HZ3 LYS 7 2HZ LYS 7 -7.485 -1.735 12.385
50 H LEU 8 H LEU 8 -4.469 -5.288 7.791
51 HA LEU 8 HA LEU 8 -2.594 -7.585 7.247
52 HB2 LEU 8 2HB LEU 8 -5.040 -6.625 5.695
53 HB3 LEU 8 3HB LEU 8 -4.054 -8.027 5.295
54 HG LEU 8 HG LEU 8 -5.776 -7.776 7.807
55 HD11 LEU 8 1HD1 LEU 8 -7.288 -9.289 6.612
56 HD12 LEU 8 2HD1 LEU 8 -7.056 -7.759 5.733
57 HD13 LEU 8 3HD1 LEU 8 -6.220 -9.230 5.179
58 HD21 LEU 8 3HD2 LEU 8 -3.882 -9.319 8.108
59 HD22 LEU 8 1HD2 LEU 8 -5.403 -10.219 7.971
60 HD23 LEU 8 2HD2 LEU 8 -4.288 -10.140 6.585
61 H TYR 9 H TYR 9 -3.303 -4.251 6.610
62 HA TYR 9 HA TYR 9 -1.558 -4.234 4.202
63 HB2 TYR 9 2HB TYR 9 -4.325 -3.024 4.408
64 HB3 TYR 9 3HB TYR 9 -3.278 -3.004 2.987
65 HD1 TYR 9 HD2 TYR 9 -2.444 -5.849 2.797
66 HD2 TYR 9 HD1 TYR 9 -6.261 -4.110 3.740
67 HE1 TYR 9 HE2 TYR 9 -3.569 -7.952 2.076
68 HE2 TYR 9 HE1 TYR 9 -7.396 -6.198 2.999
69 HH TYR 9 HH TYR 9 -7.109 -8.203 1.924
70 H ARG 10 H ARG 10 -0.700 -2.240 3.669
71 HA ARG 10 HA ARG 10 -1.012 0.049 5.518
72 HB2 ARG 10 2HB ARG 10 0.902 -0.943 6.438
73 HB3 ARG 10 3HB ARG 10 1.446 -1.549 4.893
74 HG2 ARG 10 2HG ARG 10 3.011 0.086 5.625
75 HG3 ARG 10 3HG ARG 10 2.192 0.691 4.204
76 HD2 ARG 10 2HD ARG 10 2.339 2.549 5.668
77 HD3 ARG 10 3HD ARG 10 0.672 2.018 5.780
78 HE ARG 10 HE ARG 10 1.021 1.217 7.985
79 HH11 ARG 10 1HH2 ARG 10 3.963 2.932 6.909
80 HH12 ARG 10 2HH2 ARG 10 4.615 2.807 8.513
81 HH21 ARG 10 1HH1 ARG 10 1.814 1.378 9.872
82 HH22 ARG 10 2HH1 ARG 10 3.436 1.993 10.185
83 H VAL 11 H VAL 11 -0.804 2.061 4.490
84 HA VAL 11 HA VAL 11 0.288 2.237 1.732
85 HB VAL 11 HB VAL 11 -2.245 1.979 1.692
86 HG11 VAL 11 1HG1 VAL 11 -2.257 4.885 2.640
87 HG12 VAL 11 2HG1 VAL 11 -3.652 3.884 2.188
88 HG13 VAL 11 3HG1 VAL 11 -2.712 3.526 3.652
89 HG21 VAL 11 3HG2 VAL 11 -2.526 3.630 -0.086
90 HG22 VAL 11 1HG2 VAL 11 -1.176 4.606 0.534
91 HG23 VAL 11 2HG2 VAL 11 -0.864 3.030 -0.182
92 H GLU 12 H GLU 12 1.337 4.188 1.293
93 HA GLU 12 HA GLU 12 1.075 6.549 2.916
94 HB2 GLU 12 2HB GLU 12 3.351 6.511 3.918
95 HB3 GLU 12 3HB GLU 12 2.331 5.259 4.598
96 HG2 GLU 12 2HG GLU 12 3.417 3.562 3.133
97 HG3 GLU 12 3HG GLU 12 4.431 4.826 2.429
98 H TYR 13 H TYR 13 2.352 8.251 2.263
99 HA TYR 13 HA TYR 13 3.740 8.086 -0.319
100 HB2 TYR 13 2HB TYR 13 3.793 10.293 1.755
101 HB3 TYR 13 3HB TYR 13 4.252 10.405 0.061
102 HD1 TYR 13 HD1 TYR 13 2.099 9.215 -1.451
103 HD2 TYR 13 HD2 TYR 13 1.819 11.415 2.236
104 HE1 TYR 13 HE1 TYR 13 -0.134 10.089 -2.146
105 HE2 TYR 13 HE2 TYR 13 -0.417 12.281 1.556
106 HH TYR 13 HH TYR 13 -1.863 11.480 -1.630
107 H ALA 14 H ALA 14 5.842 7.663 -0.599
108 HA ALA 14 HA ALA 14 7.403 6.562 1.549
109 HB1 ALA 14 1HB ALA 14 8.025 7.190 -1.367
110 HB2 ALA 14 2HB ALA 14 9.056 6.217 -0.295
111 HB3 ALA 14 3HB ALA 14 7.422 5.661 -0.722
112 H LYS 15 H LYS 15 8.174 7.900 3.096
113 HA LYS 15 HA LYS 15 9.215 10.561 2.606
114 HB2 LYS 15 2HB LYS 15 8.080 9.804 4.693
115 HB3 LYS 15 3HB LYS 15 9.425 8.721 5.031
116 HG2 LYS 15 2HG LYS 15 9.557 10.705 6.406
117 HG3 LYS 15 3HG LYS 15 10.940 10.652 5.317
118 HD2 LYS 15 2HD LYS 15 9.874 12.344 3.851
119 HD3 LYS 15 3HD LYS 15 8.423 12.332 4.882
120 HE2 LYS 15 2HE LYS 15 9.815 13.080 6.810
121 HE3 LYS 15 3HE LYS 15 11.242 13.108 5.766
122 HZ1 LYS 15 3HZ LYS 15 10.253 15.317 5.974
123 HZ2 LYS 15 1HZ LYS 15 10.142 14.825 4.423
124 HZ3 LYS 15 2HZ LYS 15 8.822 14.796 5.390
125 H SER 16 H SER 16 10.666 7.428 2.564
126 HA SER 16 HA SER 16 13.254 8.440 1.701
127 HB2 SER 16 2HB SER 16 13.443 8.452 4.199
128 HB3 SER 16 3HB SER 16 13.140 6.703 4.198
129 HG SER 16 HG SER 16 15.415 7.465 4.150
130 H GLY 17 H GLY 17 14.381 6.863 0.526
131 HA2 GLY 17 2HA GLY 17 12.569 4.947 -0.689
132 HA3 GLY 17 3HA GLY 17 14.151 5.416 -1.287
133 H ARG 18 H ARG 18 13.494 4.050 1.929
134 HA ARG 18 HA ARG 18 15.589 2.023 1.509
135 HB2 ARG 18 2HB ARG 18 13.916 2.617 3.984
136 HB3 ARG 18 3HB ARG 18 15.387 1.650 3.925
137 HG2 ARG 18 2HG ARG 18 15.189 4.642 3.391
138 HG3 ARG 18 3HG ARG 18 15.815 3.877 4.848
139 HD2 ARG 18 2HD ARG 18 17.660 2.876 3.582
140 HD3 ARG 18 3HD ARG 18 17.036 3.572 2.071
141 HE ARG 18 HE ARG 18 17.321 5.746 3.773
142 HH11 ARG 18 1HH2 ARG 18 19.565 3.368 2.509
143 HH12 ARG 18 2HH2 ARG 18 20.905 4.480 2.545
144 HH21 ARG 18 1HH1 ARG 18 19.081 7.103 3.819
145 HH22 ARG 18 2HH1 ARG 18 20.628 6.541 3.258
146 H ALA 19 H ALA 19 12.184 1.933 1.248
147 HA ALA 19 HA ALA 19 11.848 -0.883 1.910
148 HB1 ALA 19 1HB ALA 19 10.040 1.086 0.448
149 HB2 ALA 19 2HB ALA 19 9.588 -0.535 1.004
150 HB3 ALA 19 3HB ALA 19 10.005 0.712 2.191
151 H SER 20 H SER 20 11.515 -2.600 0.480
152 HA SER 20 HA SER 20 12.437 -2.227 -2.327
153 HB2 SER 20 2HB SER 20 13.345 -4.506 -2.238
154 HB3 SER 20 3HB SER 20 14.173 -3.360 -1.173
155 HG SER 20 HG SER 20 13.781 -5.334 -0.104
156 H CYS 21 HN CYS 21 11.234 -3.042 -3.930
157 HA CYS 21 HA CYS 21 8.482 -3.753 -3.268
158 HB2 CYS 21 2HB CYS 21 9.087 -2.235 -5.110
159 HB3 CYS 21 3HB CYS 21 9.903 -3.574 -5.938
160 H LYS 22 H LYS 22 8.006 -5.748 -2.623
161 HA LYS 22 HA LYS 22 9.676 -8.049 -3.191
162 HB2 LYS 22 2HB LYS 22 6.849 -8.146 -2.126
163 HB3 LYS 22 3HB LYS 22 8.111 -9.320 -1.854
164 HG2 LYS 22 2HG LYS 22 8.016 -6.482 -0.761
165 HG3 LYS 22 3HG LYS 22 7.568 -7.914 0.122
166 HD2 LYS 22 2HD LYS 22 10.365 -7.281 -0.909
167 HD3 LYS 22 3HD LYS 22 9.789 -7.063 0.753
168 HE2 LYS 22 2HE LYS 22 9.336 -9.493 0.938
169 HE3 LYS 22 3HE LYS 22 9.933 -9.735 -0.710
170 HZ1 LYS 22 3HZ LYS 22 12.107 -8.909 0.025
171 HZ2 LYS 22 1HZ LYS 22 11.558 -8.692 1.549
172 HZ3 LYS 22 2HZ LYS 22 11.664 -10.196 0.925
173 H LYS 23 H LYS 23 7.414 -6.582 -5.167
174 HA LYS 23 HA LYS 23 6.501 -9.097 -6.482
175 HB2 LYS 23 2HB LYS 23 4.762 -7.563 -5.742
176 HB3 LYS 23 3HB LYS 23 5.498 -6.246 -6.653
177 HG2 LYS 23 2HG LYS 23 3.512 -7.126 -7.773
178 HG3 LYS 23 3HG LYS 23 4.947 -7.332 -8.775
179 HD2 LYS 23 2HD LYS 23 5.061 -9.729 -8.179
180 HD3 LYS 23 3HD LYS 23 3.697 -9.532 -7.062
181 HE2 LYS 23 2HE LYS 23 2.263 -8.829 -8.967
182 HE3 LYS 23 3HE LYS 23 3.628 -9.041 -10.072
183 HZ1 LYS 23 3HZ LYS 23 3.640 -11.410 -9.493
184 HZ2 LYS 23 1HZ LYS 23 2.384 -11.214 -8.461
185 HZ3 LYS 23 2HZ LYS 23 2.167 -10.989 -10.059
186 H CYS 24 HN CYS 24 7.923 -5.926 -7.459
187 HA CYS 24 HA CYS 24 8.773 -7.251 -9.985
188 HB2 CYS 24 2HB CYS 24 8.653 -5.278 -11.137
189 HB3 CYS 24 3HB CYS 24 7.164 -5.388 -10.207
190 H SER 25 H SER 25 10.141 -6.654 -7.117
191 HA SER 25 HA SER 25 12.214 -6.769 -6.322
192 HB2 SER 25 2HB SER 25 12.976 -7.852 -9.041
193 HB3 SER 25 3HB SER 25 13.887 -8.040 -7.533
194 HG SER 25 HG SER 25 12.557 -9.862 -7.983
195 H GLU 26 H GLU 26 11.514 -4.212 -7.682
196 HA GLU 26 HA GLU 26 14.249 -3.013 -7.892
197 HB2 GLU 26 2HB GLU 26 11.508 -1.785 -8.383
198 HB3 GLU 26 3HB GLU 26 13.060 -0.947 -8.510
199 HG2 GLU 26 2HG GLU 26 13.745 -2.649 -10.256
200 HG3 GLU 26 3HG GLU 26 12.073 -3.221 -10.269
201 H SER 27 H SER 27 14.251 -0.765 -6.634
202 HA SER 27 HA SER 27 13.018 -1.180 -3.943
203 HB2 SER 27 2HB SER 27 15.522 0.390 -4.483
204 HB3 SER 27 3HB SER 27 14.699 0.113 -2.922
205 HG SER 27 HG SER 27 16.480 -1.336 -3.296
206 H ILE 28 H ILE 28 11.899 0.433 -2.977
207 HA ILE 28 HA ILE 28 10.436 1.887 -5.012
208 HB ILE 28 HB ILE 28 9.947 1.593 -2.033
209 HG12 ILE 28 2HG1 ILE 28 8.629 0.090 -4.341
210 HG13 ILE 28 3HG1 ILE 28 9.950 -0.567 -3.378
211 HG21 ILE 28 1HG2 ILE 28 8.756 3.570 -2.973
212 HG22 ILE 28 2HG2 ILE 28 8.084 2.553 -4.266
213 HG23 ILE 28 3HG2 ILE 28 7.628 2.281 -2.580
214 HD11 ILE 28 3HD1 ILE 28 8.568 -0.308 -1.315
215 HD12 ILE 28 1HD1 ILE 28 7.182 0.107 -2.353
216 HD13 ILE 28 2HD1 ILE 28 7.957 -1.478 -2.496
217 HA PRO 29 HA PRO 29 12.787 5.598 -4.069
218 HB2 PRO 29 2HB PRO 29 11.745 7.354 -5.875
219 HB3 PRO 29 3HB PRO 29 12.793 5.981 -6.350
220 HG2 PRO 29 2HG PRO 29 9.756 6.092 -6.356
221 HG3 PRO 29 3HG PRO 29 10.841 5.563 -7.682
222 HD2 PRO 29 2HD PRO 29 9.671 3.792 -5.971
223 HD3 PRO 29 3HD PRO 29 11.334 3.529 -6.590
224 H LYS 30 H LYS 30 12.567 7.588 -3.013
225 HA LYS 30 HA LYS 30 10.143 8.015 -1.444
226 HB2 LYS 30 2HB LYS 30 11.293 9.876 -0.432
227 HB3 LYS 30 3HB LYS 30 12.301 8.432 -0.447
228 HG2 LYS 30 2HG LYS 30 13.540 9.308 -2.402
229 HG3 LYS 30 3HG LYS 30 12.560 10.779 -2.368
230 HD2 LYS 30 2HD LYS 30 14.399 9.791 -0.144
231 HD3 LYS 30 3HD LYS 30 14.819 11.034 -1.312
232 HE2 LYS 30 2HE LYS 30 12.520 11.256 0.689
233 HE3 LYS 30 3HE LYS 30 14.144 11.886 0.952
234 HZ1 LYS 30 3HZ LYS 30 12.730 13.627 0.115
235 HZ2 LYS 30 1HZ LYS 30 13.830 13.292 -1.043
236 HZ3 LYS 30 2HZ LYS 30 12.278 12.778 -1.195
237 H ASP 31 H ASP 31 9.078 10.104 -1.314
238 HA ASP 31 HA ASP 31 7.526 11.473 -2.195
239 HB2 ASP 31 2HB ASP 31 9.621 12.168 -4.275
240 HB3 ASP 31 3HB ASP 31 8.155 13.080 -3.932
241 H SER 32 H SER 32 7.254 8.810 -2.826
242 HA SER 32 HA SER 32 5.426 8.942 -5.147
243 HB2 SER 32 2HB SER 32 7.618 7.892 -5.869
244 HB3 SER 32 3HB SER 32 7.306 6.594 -4.697
245 HG SER 32 HG SER 32 6.538 6.117 -6.837
246 H LEU 33 H LEU 33 3.986 6.863 -5.064
247 HA LEU 33 HA LEU 33 3.011 6.613 -2.261
248 HB2 LEU 33 2HB LEU 33 1.466 7.564 -3.968
249 HB3 LEU 33 3HB LEU 33 1.617 6.076 -4.904
250 HG LEU 33 HG LEU 33 0.660 4.819 -2.921
251 HD11 LEU 33 1HD1 LEU 33 -0.043 7.620 -1.940
252 HD12 LEU 33 2HD1 LEU 33 -0.645 6.093 -1.271
253 HD13 LEU 33 3HD1 LEU 33 1.067 6.501 -1.134
254 HD21 LEU 33 3HD2 LEU 33 -0.705 5.496 -4.879
255 HD22 LEU 33 1HD2 LEU 33 -1.643 5.469 -3.375
256 HD23 LEU 33 2HD2 LEU 33 -1.098 7.027 -4.047
257 H ARG 34 H ARG 34 2.915 4.680 -1.223
258 HA ARG 34 HA ARG 34 3.491 2.163 -2.661
259 HB2 ARG 34 2HB ARG 34 5.305 1.531 -1.249
260 HB3 ARG 34 3HB ARG 34 5.668 3.069 -2.029
261 HG2 ARG 34 2HG ARG 34 5.225 4.282 0.066
262 HG3 ARG 34 3HG ARG 34 4.779 2.760 0.873
263 HD2 ARG 34 2HD ARG 34 7.043 1.862 0.479
264 HD3 ARG 34 3HD ARG 34 7.482 3.328 -0.410
265 HE ARG 34 HE ARG 34 6.612 3.685 2.414
266 HH11 ARG 34 1HH2 ARG 34 9.428 3.533 0.295
267 HH12 ARG 34 2HH2 ARG 34 10.411 4.368 1.478
268 HH21 ARG 34 1HH1 ARG 34 7.868 4.558 3.795
269 HH22 ARG 34 2HH1 ARG 34 9.604 4.759 3.513
270 H MET 35 H MET 35 3.192 0.298 -1.415
271 HA MET 35 HA MET 35 1.347 0.501 0.876
272 HB2 MET 35 2HB MET 35 0.880 -1.051 -1.699
273 HB3 MET 35 3HB MET 35 0.038 -1.425 -0.183
274 HG2 MET 35 2HG MET 35 -0.821 0.879 -0.091
275 HG3 MET 35 3HG MET 35 -0.046 1.234 -1.639
276 HE1 MET 35 3HE MET 35 -3.879 -1.251 -0.921
277 HE2 MET 35 1HE MET 35 -2.331 -1.694 -0.157
278 HE3 MET 35 2HE MET 35 -3.110 -0.146 0.240
279 H ALA 36 H ALA 36 1.128 -1.548 2.034
280 HA ALA 36 HA ALA 36 3.332 -3.447 1.633
281 HB1 ALA 36 1HB ALA 36 3.278 -2.828 4.465
282 HB2 ALA 36 2HB ALA 36 4.630 -2.808 3.323
283 HB3 ALA 36 3HB ALA 36 3.623 -1.364 3.519
284 H ILE 37 H ILE 37 3.118 -5.403 2.960
285 HA ILE 37 HA ILE 37 0.328 -5.899 3.901
286 HB ILE 37 HB ILE 37 1.960 -7.311 1.914
287 HG12 ILE 37 2HG1 ILE 37 -0.976 -7.552 2.693
288 HG13 ILE 37 3HG1 ILE 37 -0.332 -6.223 1.729
289 HG21 ILE 37 1HG2 ILE 37 0.575 -9.036 3.988
290 HG22 ILE 37 2HG2 ILE 37 1.298 -9.568 2.437
291 HG23 ILE 37 3HG2 ILE 37 2.331 -8.927 3.709
292 HD11 ILE 37 3HD1 ILE 37 0.398 -7.797 -0.018
293 HD12 ILE 37 1HD1 ILE 37 -0.291 -9.148 0.910
294 HD13 ILE 37 2HD1 ILE 37 -1.348 -7.871 0.274
295 H MET 38 H MET 38 -0.010 -6.961 5.711
296 HA MET 38 HA MET 38 2.281 -6.981 7.563
297 HB2 MET 38 2HB MET 38 0.026 -5.569 7.720
298 HB3 MET 38 3HB MET 38 -0.652 -7.077 8.291
299 HG2 MET 38 2HG MET 38 -0.123 -6.150 10.290
300 HG3 MET 38 3HG MET 38 1.415 -6.948 9.977
301 HE1 MET 38 3HE MET 38 2.515 -4.854 7.618
302 HE2 MET 38 1HE MET 38 3.607 -3.929 8.684
303 HE3 MET 38 2HE MET 38 3.470 -5.695 8.861
304 H VAL 39 H VAL 39 3.274 -8.867 7.597
305 HA VAL 39 HA VAL 39 1.629 -11.343 8.040
306 HB VAL 39 HB VAL 39 2.605 -11.330 5.833
307 HG11 VAL 39 1HG1 VAL 39 5.340 -11.233 7.167
308 HG12 VAL 39 2HG1 VAL 39 4.998 -11.507 5.448
309 HG13 VAL 39 3HG1 VAL 39 4.611 -9.945 6.181
310 HG21 VAL 39 3HG2 VAL 39 4.025 -13.388 7.540
311 HG22 VAL 39 1HG2 VAL 39 2.318 -13.473 7.034
312 HG23 VAL 39 2HG2 VAL 39 3.608 -13.495 5.825
313 H GLN 40 H GLN 40 2.218 -12.803 9.545
314 HA GLN 40 HA GLN 40 3.855 -11.961 11.784
315 HB2 GLN 40 2HB GLN 40 3.391 -14.291 12.596
316 HB3 GLN 40 3HB GLN 40 1.981 -13.274 12.294
317 HG2 GLN 40 2HG GLN 40 1.552 -14.427 10.146
318 HG3 GLN 40 3HG GLN 40 2.986 -15.423 10.373
319 HE21 GLN 40 2HE2 GLN 40 0.961 -16.987 9.964
320 HE22 GLN 40 1HE2 GLN 40 0.261 -17.607 11.453
321 H SER 41 H SER 41 6.002 -12.212 12.107
322 HA SER 41 HA SER 41 7.523 -13.229 9.852
323 HB2 SER 41 2HB SER 41 8.047 -11.097 11.047
324 HB3 SER 41 3HB SER 41 8.653 -12.092 12.396
325 HG SER 41 HG SER 41 10.125 -11.382 10.544
326 HA PRO 42 HA PRO 42 9.018 -16.988 11.726
327 HB2 PRO 42 2HB PRO 42 11.052 -16.724 9.515
328 HB3 PRO 42 3HB PRO 42 10.135 -18.172 10.027
329 HG2 PRO 42 2HG PRO 42 9.412 -16.803 7.796
330 HG3 PRO 42 3HG PRO 42 8.157 -17.399 8.935
331 HD2 PRO 42 2HD PRO 42 9.332 -14.605 8.745
332 HD3 PRO 42 3HD PRO 42 7.620 -15.109 8.886
333 H MET 43 H MET 43 10.645 -13.947 11.311
334 HA MET 43 HA MET 43 12.892 -14.782 13.090
335 HB2 MET 43 2HB MET 43 14.453 -13.674 11.769
336 HB3 MET 43 3HB MET 43 13.452 -14.632 10.690
337 HG2 MET 43 2HG MET 43 12.162 -12.182 10.637
338 HG3 MET 43 3HG MET 43 13.831 -11.698 10.874
339 HE1 MET 43 3HE MET 43 12.091 -14.655 8.957
340 HE2 MET 43 1HE MET 43 11.144 -13.217 8.526
341 HE3 MET 43 2HE MET 43 12.103 -14.052 7.282
342 H PHE 44 H PHE 44 10.276 -12.920 13.317
343 HA PHE 44 HA PHE 44 11.556 -11.014 15.186
344 HB2 PHE 44 2HB PHE 44 11.391 -9.761 13.107
345 HB3 PHE 44 3HB PHE 44 9.702 -10.197 12.922
346 HD1 PHE 44 HD2 PHE 44 12.050 -8.361 15.204
347 HD2 PHE 44 HD1 PHE 44 7.989 -8.839 13.828
348 HE1 PHE 44 HE2 PHE 44 11.366 -6.360 16.511
349 HE2 PHE 44 HE1 PHE 44 7.313 -6.834 15.125
350 HZ PHE 44 HZ PHE 44 8.999 -5.596 16.474
351 H ASP 45 H ASP 45 10.101 -10.109 16.723
352 HA ASP 45 HA ASP 45 8.256 -12.176 17.696
353 HB2 ASP 45 2HB ASP 45 9.416 -9.705 19.027
354 HB3 ASP 45 3HB ASP 45 8.405 -10.911 19.828
355 H GLY 46 H GLY 46 7.056 -11.049 15.540
356 HA2 GLY 46 2HA GLY 46 4.502 -10.236 16.279
357 HA3 GLY 46 3HA GLY 46 5.430 -8.742 16.102
358 H LYS 47 H LYS 47 4.098 -8.147 14.354
359 HA LYS 47 HA LYS 47 4.274 -9.728 11.852
360 HB2 LYS 47 2HB LYS 47 2.556 -7.295 12.402
361 HB3 LYS 47 3HB LYS 47 2.462 -8.412 11.045
362 HG2 LYS 47 2HG LYS 47 2.116 -9.786 13.656
363 HG3 LYS 47 3HG LYS 47 0.965 -8.483 13.435
364 HD2 LYS 47 2HD LYS 47 1.417 -10.801 11.528
365 HD3 LYS 47 3HD LYS 47 0.120 -10.706 12.707
366 HE2 LYS 47 2HE LYS 47 0.498 -8.752 10.399
367 HE3 LYS 47 3HE LYS 47 -0.528 -10.179 10.330
368 HZ1 LYS 47 3HZ LYS 47 -0.937 -7.891 12.202
369 HZ2 LYS 47 1HZ LYS 47 -1.833 -8.227 10.873
370 HZ3 LYS 47 2HZ LYS 47 -1.856 -9.250 12.149
371 H VAL 48 H VAL 48 5.033 -8.865 9.944
372 HA VAL 48 HA VAL 48 6.602 -6.339 10.112
373 HB VAL 48 HB VAL 48 8.355 -7.389 8.736
374 HG11 VAL 48 1HG1 VAL 48 8.588 -7.194 11.198
375 HG12 VAL 48 2HG1 VAL 48 7.881 -8.807 11.394
376 HG13 VAL 48 3HG1 VAL 48 9.435 -8.611 10.562
377 HG21 VAL 48 3HG2 VAL 48 8.567 -9.832 8.606
378 HG22 VAL 48 1HG2 VAL 48 6.959 -10.031 9.326
379 HG23 VAL 48 2HG2 VAL 48 7.136 -9.274 7.732
380 HA PRO 49 HA PRO 49 4.556 -5.448 6.315
381 HB2 PRO 49 2HB PRO 49 5.888 -3.244 5.423
382 HB3 PRO 49 3HB PRO 49 4.904 -3.239 6.915
383 HG2 PRO 49 2HG PRO 49 7.909 -3.583 6.659
384 HG3 PRO 49 3HG PRO 49 7.007 -2.514 7.778
385 HD2 PRO 49 2HD PRO 49 7.955 -4.988 8.506
386 HD3 PRO 49 3HD PRO 49 6.446 -4.302 9.177
387 H HIS 50 H HIS 50 4.576 -6.371 4.324
388 HA HIS 50 HA HIS 50 7.128 -6.692 2.781
389 HB2 HIS 50 2HB HIS 50 4.376 -7.968 2.600
390 HB3 HIS 50 3HB HIS 50 5.513 -8.015 1.261
391 HD2 HIS 50 HD2 HIS 50 6.774 -8.424 4.873
392 HE1 HIS 50 HE1 HIS 50 7.077 -12.244 3.006
393 HE2 HIS 50 HE2 HIS 50 7.702 -10.892 5.074
394 H TRP 51 H TRP 51 7.594 -4.821 1.776
395 HA TRP 51 HA TRP 51 5.512 -2.933 1.071
396 HB2 TRP 51 2HB TRP 51 8.519 -2.903 0.659
397 HB3 TRP 51 3HB TRP 51 7.424 -1.564 0.332
398 HD1 TRP 51 HD1 TRP 51 9.285 -3.224 3.139
399 HE1 TRP 51 HE1 TRP 51 8.928 -1.921 5.321
400 HE3 TRP 51 HE3 TRP 51 5.565 -0.060 1.583
401 HZ2 TRP 51 HZ2 TRP 51 7.144 0.121 6.315
402 HZ3 TRP 51 HZ3 TRP 51 4.524 1.525 3.191
403 HH2 TRP 51 HH2 TRP 51 5.301 1.608 5.552
404 H TYR 52 H TYR 52 4.873 -2.241 -0.927
405 HA TYR 52 HA TYR 52 6.345 -3.055 -3.307
406 HB2 TYR 52 2HB TYR 52 3.479 -3.544 -3.742
407 HB3 TYR 52 3HB TYR 52 4.926 -4.386 -4.305
408 HD1 TYR 52 HD1 TYR 52 2.728 -4.138 -1.242
409 HD2 TYR 52 HD2 TYR 52 5.391 -6.518 -3.647
410 HE1 TYR 52 HE1 TYR 52 2.078 -6.187 0.049
411 HE2 TYR 52 HE2 TYR 52 4.697 -8.560 -2.387
412 HH TYR 52 HH TYR 52 2.360 -8.469 0.280
413 H HIS 53 H HIS 53 5.688 -1.818 -5.201
414 HA HIS 53 HA HIS 53 4.958 0.941 -4.783
415 HB2 HIS 53 2HB HIS 53 4.634 -0.757 -7.294
416 HB3 HIS 53 3HB HIS 53 4.551 0.982 -7.223
417 HD2 HIS 53 HD2 HIS 53 6.826 2.338 -6.529
418 HE1 HIS 53 HE1 HIS 53 9.473 -0.626 -8.061
419 HE2 HIS 53 HE2 HIS 53 9.267 1.803 -7.357
420 H PHE 54 H PHE 54 2.914 2.040 -5.395
421 HA PHE 54 HA PHE 54 0.605 0.989 -4.240
422 HB2 PHE 54 2HB PHE 54 0.680 3.303 -4.680
423 HB3 PHE 54 3HB PHE 54 0.989 3.072 -6.396
424 HD1 PHE 54 HD1 PHE 54 -1.688 2.399 -3.791
425 HD2 PHE 54 HD2 PHE 54 -0.782 3.157 -7.945
426 HE1 PHE 54 HE1 PHE 54 -4.109 2.406 -4.331
427 HE2 PHE 54 HE2 PHE 54 -3.211 3.189 -8.461
428 HZ PHE 54 HZ PHE 54 -4.870 2.784 -6.663
429 H SER 55 H SER 55 1.556 0.707 -7.729
430 HA SER 55 HA SER 55 -0.888 -0.675 -8.504
431 HB2 SER 55 2HB SER 55 0.338 -0.968 -10.652
432 HB3 SER 55 3HB SER 55 0.206 0.718 -10.113
433 HG SER 55 HG SER 55 2.336 0.252 -10.793
434 H CYS 56 HN CYS 56 2.433 -1.622 -7.611
435 HA CYS 56 HA CYS 56 2.251 -4.326 -8.305
436 HB2 CYS 56 2HB CYS 56 3.927 -2.874 -6.269
437 HB3 CYS 56 3HB CYS 56 4.136 -4.578 -6.661
438 H PHE 57 H PHE 57 1.180 -2.760 -5.283
439 HA PHE 57 HA PHE 57 0.455 -5.092 -3.824
440 HB2 PHE 57 2HB PHE 57 0.363 -2.797 -2.969
441 HB3 PHE 57 3HB PHE 57 -1.006 -2.435 -4.018
442 HD1 PHE 57 HD2 PHE 57 -3.184 -3.767 -3.715
443 HD2 PHE 57 HD1 PHE 57 0.020 -3.820 -0.825
444 HE1 PHE 57 HE2 PHE 57 -4.718 -4.732 -2.037
445 HE2 PHE 57 HE1 PHE 57 -1.568 -4.641 0.896
446 HZ PHE 57 HZ PHE 57 -3.925 -5.157 0.276
447 H TRP 58 H TRP 58 -1.457 -3.340 -6.338
448 HA TRP 58 HA TRP 58 -3.604 -5.277 -6.258
449 HB2 TRP 58 2HB TRP 58 -3.051 -3.197 -8.372
450 HB3 TRP 58 3HB TRP 58 -4.573 -3.994 -8.027
451 HD1 TRP 58 HD1 TRP 58 -2.675 -0.975 -7.324
452 HE1 TRP 58 HE1 TRP 58 -3.510 0.377 -5.338
453 HE3 TRP 58 HE3 TRP 58 -6.112 -4.316 -5.447
454 HZ2 TRP 58 HZ2 TRP 58 -5.499 0.099 -3.230
455 HZ3 TRP 58 HZ3 TRP 58 -7.476 -3.705 -3.492
456 HH2 TRP 58 HH2 TRP 58 -7.183 -1.495 -2.395
457 H LYS 59 H LYS 59 -0.557 -5.323 -7.899
458 HA LYS 59 HA LYS 59 -1.380 -7.448 -9.806
459 HB2 LYS 59 2HB LYS 59 1.333 -6.261 -9.136
460 HB3 LYS 59 3HB LYS 59 1.066 -7.541 -10.321
461 HG2 LYS 59 2HG LYS 59 -0.376 -6.104 -11.670
462 HG3 LYS 59 3HG LYS 59 -0.207 -4.786 -10.514
463 HD2 LYS 59 2HD LYS 59 2.073 -5.985 -12.152
464 HD3 LYS 59 3HD LYS 59 1.222 -4.467 -12.503
465 HE2 LYS 59 2HE LYS 59 1.893 -3.618 -10.234
466 HE3 LYS 59 3HE LYS 59 2.840 -5.088 -9.998
467 HZ1 LYS 59 3HZ LYS 59 4.208 -4.428 -11.899
468 HZ2 LYS 59 1HZ LYS 59 3.368 -3.021 -12.045
469 HZ3 LYS 59 2HZ LYS 59 4.225 -3.335 -10.674
470 H VAL 60 H VAL 60 -0.092 -7.216 -6.552
471 HA VAL 60 HA VAL 60 0.276 -10.126 -6.251
472 HB VAL 60 HB VAL 60 0.060 -7.869 -4.223
473 HG11 VAL 60 1HG1 VAL 60 0.699 -10.809 -3.760
474 HG12 VAL 60 2HG1 VAL 60 0.952 -9.502 -2.580
475 HG13 VAL 60 3HG1 VAL 60 -0.682 -9.900 -3.105
476 HG21 VAL 60 3HG2 VAL 60 2.120 -7.907 -5.656
477 HG22 VAL 60 1HG2 VAL 60 2.437 -8.193 -3.949
478 HG23 VAL 60 2HG2 VAL 60 2.440 -9.560 -5.082
479 H GLY 61 H GLY 61 -2.340 -7.765 -5.800
480 HA2 GLY 61 2HA GLY 61 -4.532 -8.128 -6.392
481 HA3 GLY 61 3HA GLY 61 -4.178 -9.835 -6.646
482 H HIS 62 H HIS 62 -3.501 -8.519 -3.472
483 HA HIS 62 HA HIS 62 -5.536 -10.171 -2.175
484 HB2 HIS 62 2HB HIS 62 -3.548 -8.099 -1.197
485 HB3 HIS 62 3HB HIS 62 -4.796 -8.755 -0.155
486 HD2 HIS 62 HD2 HIS 62 -2.842 -11.021 -2.653
487 HE1 HIS 62 HE1 HIS 62 -1.768 -12.206 1.296
488 HE2 HIS 62 HE2 HIS 62 -1.527 -12.753 -1.180
489 H SER 63 H SER 63 -7.560 -9.622 -1.490
490 HA SER 63 HA SER 63 -8.687 -7.124 -2.546
491 HB2 SER 63 2HB SER 63 -10.842 -8.070 -2.029
492 HB3 SER 63 3HB SER 63 -9.855 -9.258 -2.893
493 HG SER 63 HG SER 63 -10.843 -10.287 -1.183
494 H ILE 64 H ILE 64 -9.860 -5.621 -1.465
495 HA ILE 64 HA ILE 64 -9.505 -5.416 1.486
496 HB ILE 64 HB ILE 64 -9.137 -3.084 -0.395
497 HG12 ILE 64 2HG1 ILE 64 -6.933 -4.858 0.672
498 HG13 ILE 64 3HG1 ILE 64 -7.297 -4.434 -0.999
499 HG21 ILE 64 1HG2 ILE 64 -8.226 -1.998 1.633
500 HG22 ILE 64 2HG2 ILE 64 -9.836 -2.644 1.984
501 HG23 ILE 64 3HG2 ILE 64 -8.391 -3.510 2.540
502 HD11 ILE 64 3HD1 ILE 64 -6.820 -1.973 -0.270
503 HD12 ILE 64 1HD1 ILE 64 -6.017 -2.730 1.127
504 HD13 ILE 64 2HD1 ILE 64 -5.463 -3.073 -0.510
505 H ARG 65 H ARG 65 -11.309 -4.832 2.487
506 HA ARG 65 HA ARG 65 -13.748 -4.188 0.842
507 HB2 ARG 65 2HB ARG 65 -14.919 -5.871 2.409
508 HB3 ARG 65 3HB ARG 65 -14.023 -6.460 1.027
509 HG2 ARG 65 2HG ARG 65 -12.670 -6.331 3.730
510 HG3 ARG 65 3HG ARG 65 -13.784 -7.633 3.378
511 HD2 ARG 65 2HD ARG 65 -12.392 -8.678 1.917
512 HD3 ARG 65 3HD ARG 65 -11.739 -7.184 1.249
513 HE ARG 65 HE ARG 65 -10.641 -7.108 3.725
514 HH11 ARG 65 1HH2 ARG 65 -10.383 -9.608 1.244
515 HH12 ARG 65 2HH2 ARG 65 -9.099 -10.384 2.109
516 HH21 ARG 65 1HH1 ARG 65 -9.010 -7.961 4.562
517 HH22 ARG 65 2HH1 ARG 65 -8.244 -9.428 3.941
518 H HIS 66 H HIS 66 -12.021 -3.590 3.752
519 HA HIS 66 HA HIS 66 -13.779 -1.263 4.116
520 HB2 HIS 66 2HB HIS 66 -13.739 -1.416 6.568
521 HB3 HIS 66 3HB HIS 66 -14.782 -2.550 5.743
522 HD2 HIS 66 HD2 HIS 66 -12.891 -5.035 5.311
523 HE1 HIS 66 HE1 HIS 66 -12.560 -5.073 9.525
524 HE2 HIS 66 HE2 HIS 66 -12.267 -6.448 7.421
525 HA PRO 67 HA PRO 67 -9.304 -0.904 3.456
526 HB2 PRO 67 2HB PRO 67 -9.304 1.450 1.909
527 HB3 PRO 67 3HB PRO 67 -9.514 -0.200 1.261
528 HG2 PRO 67 2HG PRO 67 -11.667 1.760 2.070
529 HG3 PRO 67 3HG PRO 67 -11.546 0.808 0.548
530 HD2 PRO 67 2HD PRO 67 -13.123 -0.014 2.535
531 HD3 PRO 67 3HD PRO 67 -12.067 -1.217 1.728
532 H ASP 68 H ASP 68 -11.291 1.875 4.579
533 HA ASP 68 HA ASP 68 -8.970 3.226 5.670
534 HB2 ASP 68 2HB ASP 68 -10.606 4.747 6.706
535 HB3 ASP 68 3HB ASP 68 -10.842 4.535 4.978
536 H VAL 69 H VAL 69 -10.559 0.458 6.666
537 HA VAL 69 HA VAL 69 -9.744 0.733 9.506
538 HB VAL 69 HB VAL 69 -11.264 -1.562 8.245
539 HG11 VAL 69 1HG1 VAL 69 -10.976 -0.653 11.136
540 HG12 VAL 69 2HG1 VAL 69 -11.975 -2.008 10.563
541 HG13 VAL 69 3HG1 VAL 69 -10.223 -2.090 10.399
542 HG21 VAL 69 3HG2 VAL 69 -12.431 0.890 9.619
543 HG22 VAL 69 1HG2 VAL 69 -12.668 0.402 7.922
544 HG23 VAL 69 2HG2 VAL 69 -13.330 -0.595 9.214
545 H GLU 70 H GLU 70 -9.320 -1.316 6.611
546 HA GLU 70 HA GLU 70 -7.371 -3.071 7.948
547 HB2 GLU 70 2HB GLU 70 -8.279 -2.944 5.025
548 HB3 GLU 70 3HB GLU 70 -7.361 -4.255 5.768
549 HG2 GLU 70 2HG GLU 70 -9.268 -4.840 7.187
550 HG3 GLU 70 3HG GLU 70 -10.213 -3.518 6.505
551 H VAL 71 H VAL 71 -7.170 -0.455 5.605
552 HA VAL 71 HA VAL 71 -4.244 -0.832 5.128
553 HB VAL 71 HB VAL 71 -6.025 1.302 3.982
554 HG11 VAL 71 1HG1 VAL 71 -3.348 0.071 3.208
555 HG12 VAL 71 2HG1 VAL 71 -4.194 1.442 2.438
556 HG13 VAL 71 3HG1 VAL 71 -3.543 1.597 4.094
557 HG21 VAL 71 3HG2 VAL 71 -6.892 -0.902 3.247
558 HG22 VAL 71 1HG2 VAL 71 -5.968 -0.154 1.936
559 HG23 VAL 71 2HG2 VAL 71 -5.242 -1.455 2.917
560 H ASP 72 H ASP 72 -3.298 -0.482 6.967
561 HA ASP 72 HA ASP 72 -3.643 1.812 8.681
562 HB2 ASP 72 2HB ASP 72 -2.688 -0.292 9.367
563 HB3 ASP 72 3HB ASP 72 -1.391 -0.163 8.182
564 H GLY 73 H GLY 73 -2.522 3.752 8.690
565 HA2 GLY 73 2HA GLY 73 -1.165 5.503 7.948
566 HA3 GLY 73 3HA GLY 73 -0.529 4.477 6.665
567 H PHE 74 H PHE 74 -3.755 4.116 6.230
568 HA PHE 74 HA PHE 74 -4.128 5.824 4.004
569 HB2 PHE 74 2HB PHE 74 -5.424 3.805 4.483
570 HB3 PHE 74 3HB PHE 74 -6.096 4.537 5.937
571 HD1 PHE 74 HD2 PHE 74 -6.169 4.502 2.236
572 HD2 PHE 74 HD1 PHE 74 -7.924 6.148 5.820
573 HE1 PHE 74 HE2 PHE 74 -8.100 5.344 0.917
574 HE2 PHE 74 HE1 PHE 74 -9.849 6.989 4.485
575 HZ PHE 74 HZ PHE 74 -9.928 6.595 2.043
576 H SER 75 H SER 75 -4.601 6.485 7.438
577 HA SER 75 HA SER 75 -6.054 8.950 7.274
578 HB2 SER 75 2HB SER 75 -5.027 9.274 9.576
579 HB3 SER 75 3HB SER 75 -5.986 7.796 9.347
580 HG SER 75 HG SER 75 -3.964 7.410 10.412
581 H GLU 76 H GLU 76 -2.684 8.235 6.599
582 HA GLU 76 HA GLU 76 -1.863 11.054 6.955
583 HB2 GLU 76 2HB GLU 76 -0.207 8.632 6.156
584 HB3 GLU 76 3HB GLU 76 0.391 10.246 6.543
585 HG2 GLU 76 2HG GLU 76 -0.644 10.002 8.846
586 HG3 GLU 76 3HG GLU 76 -0.991 8.315 8.453
587 H LEU 77 H LEU 77 -3.206 9.230 4.450
588 HA LEU 77 HA LEU 77 -1.890 10.546 2.187
589 HB2 LEU 77 2HB LEU 77 -4.471 8.971 2.419
590 HB3 LEU 77 3HB LEU 77 -3.804 9.571 0.909
591 HG LEU 77 HG LEU 77 -2.520 7.474 2.715
592 HD11 LEU 77 1HD1 LEU 77 -4.534 6.694 1.536
593 HD12 LEU 77 2HD1 LEU 77 -3.931 7.355 0.003
594 HD13 LEU 77 3HD1 LEU 77 -3.100 5.997 0.765
595 HD21 LEU 77 3HD2 LEU 77 -1.639 8.489 -0.016
596 HD22 LEU 77 1HD2 LEU 77 -0.777 8.745 1.519
597 HD23 LEU 77 2HD2 LEU 77 -0.943 7.115 0.876
598 H ARG 78 H ARG 78 -2.880 12.067 0.773
599 HA ARG 78 HA ARG 78 -4.757 13.995 1.997
600 HB2 ARG 78 2HB ARG 78 -3.327 13.816 -0.687
601 HB3 ARG 78 3HB ARG 78 -4.659 14.936 -0.477
602 HG2 ARG 78 2HG ARG 78 -2.200 14.925 1.323
603 HG3 ARG 78 3HG ARG 78 -2.403 15.948 -0.111
604 HD2 ARG 78 2HD ARG 78 -4.480 16.912 0.876
605 HD3 ARG 78 3HD ARG 78 -4.216 15.965 2.346
606 HE ARG 78 HE ARG 78 -1.838 17.424 1.838
607 HH11 ARG 78 1HH2 ARG 78 -5.130 18.169 2.786
608 HH12 ARG 78 2HH2 ARG 78 -4.654 19.621 3.624
609 HH21 ARG 78 1HH1 ARG 78 -1.305 19.288 2.919
610 HH22 ARG 78 2HH1 ARG 78 -2.544 20.232 3.692
611 H TRP 79 H TRP 79 -6.726 14.612 1.014
612 HA TRP 79 HA TRP 79 -8.575 12.573 0.912
613 HB2 TRP 79 2HB TRP 79 -9.647 14.493 1.333
614 HB3 TRP 79 3HB TRP 79 -8.551 15.458 0.364
615 HD1 TRP 79 HD1 TRP 79 -11.868 13.596 0.081
616 HE1 TRP 79 HE1 TRP 79 -13.019 14.246 -2.125
617 HE3 TRP 79 HE3 TRP 79 -8.066 16.259 -2.035
618 HZ2 TRP 79 HZ2 TRP 79 -12.369 15.771 -4.505
619 HZ3 TRP 79 HZ3 TRP 79 -8.320 17.266 -4.289
620 HH2 TRP 79 HH2 TRP 79 -10.471 17.037 -5.534
621 H ASP 80 H ASP 80 -6.872 13.965 -1.902
622 HA ASP 80 HA ASP 80 -8.487 12.644 -3.848
623 HB2 ASP 80 2HB ASP 80 -7.114 14.684 -4.250
624 HB3 ASP 80 3HB ASP 80 -5.663 13.680 -4.182
625 H ASP 81 H ASP 81 -5.687 11.476 -2.025
626 HA ASP 81 HA ASP 81 -5.485 9.099 -3.753
627 HB2 ASP 81 2HB ASP 81 -3.773 9.958 -1.434
628 HB3 ASP 81 3HB ASP 81 -3.672 8.392 -2.263
629 H GLN 82 H GLN 82 -6.687 10.121 -0.543
630 HA GLN 82 HA GLN 82 -7.448 7.535 0.374
631 HB2 GLN 82 2HB GLN 82 -8.673 10.289 0.765
632 HB3 GLN 82 3HB GLN 82 -9.337 8.843 1.525
633 HG2 GLN 82 2HG GLN 82 -7.150 8.371 2.586
634 HG3 GLN 82 3HG GLN 82 -6.483 9.840 1.872
635 HE21 GLN 82 2HE2 GLN 82 -6.494 9.334 4.661
636 HE22 GLN 82 1HE2 GLN 82 -7.529 10.566 5.395
637 H GLN 83 H GLN 83 -9.311 9.839 -1.733
638 HA GLN 83 HA GLN 83 -11.392 7.915 -2.149
639 HB2 GLN 83 2HB GLN 83 -12.338 9.389 -3.724
640 HB3 GLN 83 3HB GLN 83 -11.710 10.333 -2.374
641 HG2 GLN 83 2HG GLN 83 -9.700 10.873 -3.775
642 HG3 GLN 83 3HG GLN 83 -10.444 10.050 -5.141
643 HE21 GLN 83 2HE2 GLN 83 -9.793 12.676 -5.651
644 HE22 GLN 83 1HE2 GLN 83 -11.237 13.663 -5.531
645 H LYS 84 H LYS 84 -8.265 8.234 -3.888
646 HA LYS 84 HA LYS 84 -9.219 6.549 -6.073
647 HB2 LYS 84 2HB LYS 84 -7.259 6.930 -7.139
648 HB3 LYS 84 3HB LYS 84 -7.495 8.430 -6.245
649 HG2 LYS 84 2HG LYS 84 -5.323 8.192 -5.885
650 HG3 LYS 84 3HG LYS 84 -5.863 7.210 -4.518
651 HD2 LYS 84 2HD LYS 84 -5.516 5.172 -5.730
652 HD3 LYS 84 3HD LYS 84 -5.158 6.042 -7.227
653 HE2 LYS 84 2HE LYS 84 -3.488 6.106 -4.673
654 HE3 LYS 84 3HE LYS 84 -3.115 5.189 -6.132
655 HZ1 LYS 84 3HZ LYS 84 -3.111 7.439 -7.301
656 HZ2 LYS 84 1HZ LYS 84 -3.078 8.131 -5.800
657 HZ3 LYS 84 2HZ LYS 84 -1.866 7.165 -6.280
658 H VAL 85 H VAL 85 -7.340 6.138 -3.091
659 HA VAL 85 HA VAL 85 -6.714 3.351 -3.639
660 HB VAL 85 HB VAL 85 -6.756 4.981 -1.070
661 HG11 VAL 85 1HG1 VAL 85 -5.759 2.123 -1.445
662 HG12 VAL 85 2HG1 VAL 85 -5.414 3.153 -0.041
663 HG13 VAL 85 3HG1 VAL 85 -7.075 2.659 -0.372
664 HG21 VAL 85 3HG2 VAL 85 -4.402 3.844 -2.640
665 HG22 VAL 85 1HG2 VAL 85 -5.021 5.482 -2.891
666 HG23 VAL 85 2HG2 VAL 85 -4.360 5.019 -1.315
667 H LYS 86 H LYS 86 -9.399 4.937 -1.799
668 HA LYS 86 HA LYS 86 -10.752 2.437 -1.250
669 HB2 LYS 86 2HB LYS 86 -11.835 5.286 -1.392
670 HB3 LYS 86 3HB LYS 86 -12.768 3.864 -0.902
671 HG2 LYS 86 2HG LYS 86 -10.926 3.423 0.841
672 HG3 LYS 86 3HG LYS 86 -10.296 4.995 0.453
673 HD2 LYS 86 2HD LYS 86 -11.635 5.054 2.490
674 HD3 LYS 86 3HD LYS 86 -12.375 6.073 1.238
675 HE2 LYS 86 2HE LYS 86 -14.056 4.432 0.790
676 HE3 LYS 86 3HE LYS 86 -13.189 3.193 1.713
677 HZ1 LYS 86 3HZ LYS 86 -13.720 4.284 3.743
678 HZ2 LYS 86 1HZ LYS 86 -14.327 5.618 2.983
679 HZ3 LYS 86 2HZ LYS 86 -15.113 4.187 2.913
680 H LYS 87 H LYS 87 -11.148 4.748 -3.993
681 HA LYS 87 HA LYS 87 -13.151 3.185 -5.323
682 HB2 LYS 87 2HB LYS 87 -12.669 5.519 -5.857
683 HB3 LYS 87 3HB LYS 87 -11.087 5.098 -6.512
684 HG2 LYS 87 2HG LYS 87 -13.591 3.821 -7.656
685 HG3 LYS 87 3HG LYS 87 -13.211 5.498 -8.042
686 HD2 LYS 87 2HD LYS 87 -11.016 4.851 -8.956
687 HD3 LYS 87 3HD LYS 87 -11.362 3.142 -8.624
688 HE2 LYS 87 2HE LYS 87 -13.357 3.243 -10.081
689 HE3 LYS 87 3HE LYS 87 -13.054 4.957 -10.396
690 HZ1 LYS 87 3HZ LYS 87 -12.183 3.568 -12.182
691 HZ2 LYS 87 1HZ LYS 87 -10.946 4.331 -11.443
692 HZ3 LYS 87 2HZ LYS 87 -11.218 2.743 -11.156
693 H THR 88 H THR 88 -9.579 2.990 -5.566
694 HA THR 88 HA THR 88 -9.521 0.928 -7.513
695 HB THR 88 HB THR 88 -7.476 1.562 -5.364
696 HG1 THR 88 1HG THR 88 -7.790 3.280 -6.697
697 HG21 THR 88 1HG2 THR 88 -7.302 0.022 -7.980
698 HG22 THR 88 2HG2 THR 88 -5.911 0.534 -6.994
699 HG23 THR 88 3HG2 THR 88 -7.058 -0.645 -6.351
700 H ALA 89 H ALA 89 -9.865 0.709 -3.950
701 HA ALA 89 HA ALA 89 -9.602 -2.167 -3.833
702 HB1 ALA 89 1HB ALA 89 -10.832 -0.122 -1.938
703 HB2 ALA 89 2HB ALA 89 -10.526 -1.827 -1.566
704 HB3 ALA 89 3HB ALA 89 -9.164 -0.736 -1.913
705 H GLU 90 H GLU 90 -12.366 0.120 -4.143
706 HA GLU 90 HA GLU 90 -14.383 -1.928 -4.224
707 HB2 GLU 90 2HB GLU 90 -14.366 0.929 -5.278
708 HB3 GLU 90 3HB GLU 90 -15.780 -0.128 -5.326
709 HG2 GLU 90 2HG GLU 90 -15.677 -0.383 -2.857
710 HG3 GLU 90 3HG GLU 90 -14.323 0.743 -2.803
711 H ALA 91 H ALA 91 -12.397 -0.443 -6.727
712 HA ALA 91 HA ALA 91 -13.646 -1.739 -8.977
713 HB1 ALA 91 1HB ALA 91 -10.991 -0.278 -8.619
714 HB2 ALA 91 2HB ALA 91 -11.741 -0.686 -10.181
715 HB3 ALA 91 3HB ALA 91 -12.536 0.456 -9.074
716 H GLY 92 H GLY 92 -11.548 -3.017 -6.617
717 HA2 GLY 92 2HA GLY 92 -10.616 -5.112 -6.425
718 HA3 GLY 92 3HA GLY 92 -11.206 -5.527 -8.037
719 H GLY 93 H GLY 93 -9.088 -2.721 -7.492
720 HA2 GLY 93 2HA GLY 93 -6.725 -2.698 -7.551
721 HA3 GLY 93 3HA GLY 93 -6.698 -4.197 -8.472
722 H VAL 94 H VAL 94 -5.386 -1.675 -8.949
723 HA VAL 94 HA VAL 94 -6.108 -1.353 -11.799
724 HB VAL 94 HB VAL 94 -7.167 0.492 -10.336
725 HG11 VAL 94 1HG1 VAL 94 -4.390 1.732 -10.495
726 HG12 VAL 94 2HG1 VAL 94 -5.853 2.392 -9.737
727 HG13 VAL 94 3HG1 VAL 94 -5.040 0.988 -9.027
728 HG21 VAL 94 3HG2 VAL 94 -7.035 0.562 -12.796
729 HG22 VAL 94 1HG2 VAL 94 -6.892 2.161 -12.051
730 HG23 VAL 94 2HG2 VAL 94 -5.447 1.359 -12.686
731 H THR 95 H THR 95 -4.439 -0.623 -13.154
732 HA THR 95 HA THR 95 -1.675 -0.462 -12.073
733 HB THR 95 HB THR 95 -0.869 -1.869 -13.949
734 HG1 THR 95 1HG THR 95 -2.379 -3.159 -15.031
735 HG21 THR 95 1HG2 THR 95 -2.879 -3.363 -12.213
736 HG22 THR 95 2HG2 THR 95 -1.439 -4.028 -13.013
737 HG23 THR 95 3HG2 THR 95 -1.259 -2.861 -11.688
738 H GLY 96 H GLY 96 -0.116 0.386 -13.736
739 HA2 GLY 96 2HA GLY 96 -1.049 1.900 -16.004
740 HA3 GLY 96 3HA GLY 96 -0.873 2.936 -14.587
741 H LYS 97 H LYS 97 0.688 4.009 -16.001
742 HA LYS 97 HA LYS 97 3.181 2.795 -16.809
743 HB2 LYS 97 2HB LYS 97 2.376 5.718 -16.486
744 HB3 LYS 97 3HB LYS 97 3.882 5.164 -17.226
745 HG2 LYS 97 2HG LYS 97 2.593 3.927 -18.956
746 HG3 LYS 97 3HG LYS 97 1.078 4.525 -18.251
747 HD2 LYS 97 2HD LYS 97 1.795 6.862 -18.685
748 HD3 LYS 97 3HD LYS 97 3.304 6.262 -19.406
749 HE2 LYS 97 2HE LYS 97 1.990 5.021 -21.113
750 HE3 LYS 97 3HE LYS 97 0.488 5.614 -20.393
751 HZ1 LYS 97 3HZ LYS 97 2.585 7.333 -21.612
752 HZ2 LYS 97 1HZ LYS 97 1.152 6.968 -22.297
753 HZ3 LYS 97 2HZ LYS 97 1.197 7.881 -20.947
754 H GLY 98 H GLY 98 5.295 3.317 -16.112
755 HA2 GLY 98 2HA GLY 98 5.748 3.051 -13.268
756 HA3 GLY 98 3HA GLY 98 6.968 3.229 -14.524
757 H GLN 99 H GLN 99 7.755 4.403 -12.440
758 HA GLN 99 HA GLN 99 7.342 7.335 -12.783
759 HB2 GLN 99 2HB GLN 99 7.473 5.810 -10.151
760 HB3 GLN 99 3HB GLN 99 7.599 7.560 -10.285
761 HG2 GLN 99 2HG GLN 99 5.149 5.965 -11.165
762 HG3 GLN 99 3HG GLN 99 5.344 6.726 -9.596
763 HE21 GLN 99 2HE2 GLN 99 4.996 7.442 -13.103
764 HE22 GLN 99 1HE2 GLN 99 4.472 9.105 -12.826
765 H ASP 100 H ASP 100 9.132 8.635 -12.034
766 HA ASP 100 HA ASP 100 11.648 7.536 -12.957
767 HB2 ASP 100 2HB ASP 100 10.852 9.797 -13.524
768 HB3 ASP 100 3HB ASP 100 10.943 10.265 -11.823
769 H GLY 101 H GLY 101 13.616 7.384 -11.892
770 HA2 GLY 101 2HA GLY 101 15.139 7.225 -10.162
771 HA3 GLY 101 3HA GLY 101 13.944 7.830 -9.024
772 H ILE 102 H ILE 102 15.647 5.916 -8.238
773 HA ILE 102 HA ILE 102 13.895 3.664 -7.568
774 HB ILE 102 HB ILE 102 15.020 2.934 -9.637
775 HG12 ILE 102 2HG1 ILE 102 15.911 1.396 -7.166
776 HG13 ILE 102 3HG1 ILE 102 14.311 1.338 -7.918
777 HG21 ILE 102 1HG2 ILE 102 17.165 4.226 -9.354
778 HG22 ILE 102 2HG2 ILE 102 17.668 3.037 -8.133
779 HG23 ILE 102 3HG2 ILE 102 17.390 2.544 -9.815
780 HD11 ILE 102 3HD1 ILE 102 16.912 0.383 -9.173
781 HD12 ILE 102 1HD1 ILE 102 15.570 -0.608 -8.590
782 HD13 ILE 102 2HD1 ILE 102 15.337 0.439 -10.005
783 H GLY 103 H GLY 103 14.235 2.918 -5.541
784 HA2 GLY 103 2HA GLY 103 14.990 2.831 -3.368
785 HA3 GLY 103 3HA GLY 103 16.613 2.916 -4.046
786 H SER 104 H SER 104 17.204 4.028 -2.076
787 HA SER 104 HA SER 104 16.161 6.677 -1.455
788 HB2 SER 104 2HB SER 104 18.038 6.672 0.199
789 HB3 SER 104 3HB SER 104 16.949 5.279 0.332
790 HG SER 104 HG SER 104 19.240 4.740 0.378
791 H LYS 105 H LYS 105 18.989 5.438 -3.189
792 HA LYS 105 HA LYS 105 19.380 8.005 -4.540
793 HB2 LYS 105 2HB LYS 105 20.778 7.838 -2.254
794 HB3 LYS 105 3HB LYS 105 21.865 6.861 -3.241
795 HG2 LYS 105 2HG LYS 105 22.024 8.783 -4.866
796 HG3 LYS 105 3HG LYS 105 20.920 9.710 -3.829
797 HD2 LYS 105 2HD LYS 105 22.592 9.456 -1.943
798 HD3 LYS 105 3HD LYS 105 23.696 8.686 -3.103
799 HE2 LYS 105 2HE LYS 105 23.477 10.781 -4.539
800 HE3 LYS 105 3HE LYS 105 22.567 11.524 -3.215
801 HZ1 LYS 105 3HZ LYS 105 24.555 11.144 -1.795
802 HZ2 LYS 105 1HZ LYS 105 25.361 10.526 -3.092
803 HZ3 LYS 105 2HZ LYS 105 24.914 12.102 -3.072
804 H ALA 106 H ALA 106 20.768 7.834 -6.400
805 HA ALA 106 HA ALA 106 21.106 5.058 -7.446
806 HB1 ALA 106 1HB ALA 106 18.976 6.086 -8.173
807 HB2 ALA 106 2HB ALA 106 19.881 7.444 -8.883
808 HB3 ALA 106 3HB ALA 106 20.076 5.800 -9.531
809 H GLU 107 H GLU 107 23.283 6.513 -6.349
810 HA GLU 107 HA GLU 107 24.909 7.495 -8.568
811 HB2 GLU 107 2HB GLU 107 25.638 6.706 -5.720
812 HB3 GLU 107 3HB GLU 107 26.798 7.282 -6.920
813 HG2 GLU 107 2HG GLU 107 25.377 9.370 -7.186
814 HG3 GLU 107 3HG GLU 107 24.448 8.833 -5.784
815 H LYS 108 H LYS 108 26.784 6.530 -9.418
816 HA LYS 108 HA LYS 108 26.546 3.675 -10.019
817 HB2 LYS 108 2HB LYS 108 27.046 5.399 -11.737
818 HB3 LYS 108 3HB LYS 108 28.585 5.744 -10.932
819 HG2 LYS 108 2HG LYS 108 29.338 3.420 -11.359
820 HG3 LYS 108 3HG LYS 108 27.773 3.047 -12.113
821 HD2 LYS 108 2HD LYS 108 28.205 4.758 -13.858
822 HD3 LYS 108 3HD LYS 108 29.765 5.143 -13.096
823 HE2 LYS 108 2HE LYS 108 30.514 2.800 -13.455
824 HE3 LYS 108 3HE LYS 108 28.963 2.417 -14.213
825 HZ1 LYS 108 3HZ LYS 108 29.484 4.047 -15.950
826 HZ2 LYS 108 1HZ LYS 108 30.918 4.402 -15.250
827 HZ3 LYS 108 2HZ LYS 108 30.659 2.919 -15.876
Start of MODEL 15
1 H1 MET 1 H1 MET 1 3.538 -9.052 23.135
2 H2 MET 1 H2 MET 1 2.185 -9.021 24.062
3 H3 MET 1 H3 MET 1 2.656 -7.675 23.263
4 HA MET 1 HA MET 1 2.230 -8.673 21.136
5 HB2 MET 1 2HB MET 1 1.495 -11.107 22.819
6 HB3 MET 1 3HB MET 1 0.927 -10.878 21.167
7 HG2 MET 1 2HG MET 1 2.826 -12.281 21.063
8 HG3 MET 1 3HG MET 1 3.253 -10.729 20.352
9 HE1 MET 1 1HE MET 1 5.795 -11.407 20.344
10 HE2 MET 1 2HE MET 1 6.663 -12.025 21.766
11 HE3 MET 1 3HE MET 1 5.359 -12.986 21.036
12 H ALA 2 H ALA 2 0.118 -8.643 20.134
13 HA ALA 2 HA ALA 2 -2.199 -7.934 21.837
14 HB1 ALA 2 1HB ALA 2 -2.549 -5.841 20.569
15 HB2 ALA 2 2HB ALA 2 -0.992 -5.809 21.412
16 HB3 ALA 2 3HB ALA 2 -1.048 -6.123 19.662
17 H GLU 3 H GLU 3 -4.206 -7.685 20.497
18 HA GLU 3 HA GLU 3 -4.576 -9.938 18.714
19 HB2 GLU 3 2HB GLU 3 -6.377 -7.580 19.385
20 HB3 GLU 3 3HB GLU 3 -6.869 -9.011 18.470
21 HG2 GLU 3 2HG GLU 3 -6.303 -10.453 20.422
22 HG3 GLU 3 3HG GLU 3 -5.895 -9.015 21.358
23 H SER 4 H SER 4 -3.806 -6.590 18.078
24 HA SER 4 HA SER 4 -3.300 -7.185 15.279
25 HB2 SER 4 2HB SER 4 -5.754 -6.779 15.332
26 HB3 SER 4 3HB SER 4 -5.455 -5.153 15.971
27 HG SER 4 HG SER 4 -5.698 -5.215 13.651
28 H SER 5 H SER 5 -2.190 -5.444 14.202
29 HA SER 5 HA SER 5 -1.421 -2.983 15.402
30 HB2 SER 5 2HB SER 5 0.602 -5.273 15.458
31 HB3 SER 5 3HB SER 5 1.097 -3.574 15.393
32 HG SER 5 HG SER 5 -0.749 -4.422 17.347
33 H ASP 6 H ASP 6 -0.754 -1.689 13.790
34 HA ASP 6 HA ASP 6 -0.531 -0.876 11.758
35 HB2 ASP 6 2HB ASP 6 1.328 -3.220 11.273
36 HB3 ASP 6 3HB ASP 6 1.312 -1.714 10.368
37 H LYS 7 H LYS 7 -2.309 -3.556 11.906
38 HA LYS 7 HA LYS 7 -3.861 -4.631 10.762
39 HB2 LYS 7 2HB LYS 7 -4.058 -2.184 8.994
40 HB3 LYS 7 3HB LYS 7 -5.242 -3.471 9.174
41 HG2 LYS 7 2HG LYS 7 -6.207 -2.133 10.716
42 HG3 LYS 7 3HG LYS 7 -4.971 -2.769 11.810
43 HD2 LYS 7 2HD LYS 7 -3.500 -0.820 11.059
44 HD3 LYS 7 3HD LYS 7 -4.928 -0.170 10.227
45 HE2 LYS 7 2HE LYS 7 -6.100 -0.137 12.463
46 HE3 LYS 7 3HE LYS 7 -4.598 -0.716 13.206
47 HZ1 LYS 7 3HZ LYS 7 -4.549 1.639 13.394
48 HZ2 LYS 7 1HZ LYS 7 -3.529 1.330 12.133
49 HZ3 LYS 7 2HZ LYS 7 -5.035 1.885 11.854
50 H LEU 8 H LEU 8 -4.596 -5.586 8.710
51 HA LEU 8 HA LEU 8 -2.580 -7.209 7.590
52 HB2 LEU 8 2HB LEU 8 -5.166 -6.223 6.271
53 HB3 LEU 8 3HB LEU 8 -4.273 -7.657 5.797
54 HG LEU 8 HG LEU 8 -5.722 -7.320 8.457
55 HD11 LEU 8 1HD1 LEU 8 -7.399 -8.807 7.443
56 HD12 LEU 8 2HD1 LEU 8 -7.218 -7.311 6.501
57 HD13 LEU 8 3HD1 LEU 8 -6.479 -8.815 5.917
58 HD21 LEU 8 3HD2 LEU 8 -4.451 -9.757 7.130
59 HD22 LEU 8 1HD2 LEU 8 -3.863 -8.937 8.596
60 HD23 LEU 8 2HD2 LEU 8 -5.423 -9.776 8.620
61 H TYR 9 H TYR 9 -3.524 -3.929 6.722
62 HA TYR 9 HA TYR 9 -1.799 -4.005 4.314
63 HB2 TYR 9 2HB TYR 9 -4.578 -2.828 4.368
64 HB3 TYR 9 3HB TYR 9 -3.510 -2.964 2.972
65 HD1 TYR 9 HD1 TYR 9 -2.691 -5.759 2.910
66 HD2 TYR 9 HD2 TYR 9 -6.470 -4.059 4.045
67 HE1 TYR 9 HE1 TYR 9 -3.793 -7.948 2.479
68 HE2 TYR 9 HE2 TYR 9 -7.586 -6.231 3.608
69 HH TYR 9 HH TYR 9 -5.743 -9.139 2.562
70 H ARG 10 H ARG 10 -0.836 -2.109 3.861
71 HA ARG 10 HA ARG 10 -1.195 0.274 5.635
72 HB2 ARG 10 2HB ARG 10 0.659 -0.972 6.530
73 HB3 ARG 10 3HB ARG 10 1.270 -1.323 4.932
74 HG2 ARG 10 2HG ARG 10 2.768 0.209 5.924
75 HG3 ARG 10 3HG ARG 10 1.926 1.073 4.645
76 HD2 ARG 10 2HD ARG 10 0.367 2.005 6.404
77 HD3 ARG 10 3HD ARG 10 1.346 1.205 7.644
78 HE ARG 10 HE ARG 10 3.010 2.884 6.028
79 HH11 ARG 10 1HH2 ARG 10 0.562 3.273 8.617
80 HH12 ARG 10 2HH2 ARG 10 0.998 4.987 8.714
81 HH21 ARG 10 1HH1 ARG 10 3.556 5.024 6.582
82 HH22 ARG 10 2HH1 ARG 10 2.478 5.849 7.712
83 H VAL 11 H VAL 11 -0.888 2.257 4.594
84 HA VAL 11 HA VAL 11 0.215 2.327 1.849
85 HB VAL 11 HB VAL 11 -2.327 2.161 1.810
86 HG11 VAL 11 1HG1 VAL 11 -2.231 5.094 2.653
87 HG12 VAL 11 2HG1 VAL 11 -3.661 4.126 2.234
88 HG13 VAL 11 3HG1 VAL 11 -2.734 3.784 3.710
89 HG21 VAL 11 3HG2 VAL 11 -1.159 4.698 0.554
90 HG22 VAL 11 1HG2 VAL 11 -0.890 3.080 -0.088
91 HG23 VAL 11 2HG2 VAL 11 -2.532 3.735 -0.034
92 H GLU 12 H GLU 12 1.340 4.229 1.370
93 HA GLU 12 HA GLU 12 0.931 6.668 2.870
94 HB2 GLU 12 2HB GLU 12 3.117 6.872 3.894
95 HB3 GLU 12 3HB GLU 12 2.339 5.445 4.541
96 HG2 GLU 12 2HG GLU 12 3.707 3.983 3.134
97 HG3 GLU 12 3HG GLU 12 4.415 5.368 2.304
98 H TYR 13 H TYR 13 2.129 8.419 2.249
99 HA TYR 13 HA TYR 13 3.623 8.386 -0.270
100 HB2 TYR 13 2HB TYR 13 3.542 10.467 1.934
101 HB3 TYR 13 3HB TYR 13 4.106 10.690 0.282
102 HD1 TYR 13 HD1 TYR 13 1.798 9.233 -1.162
103 HD2 TYR 13 HD2 TYR 13 1.791 12.032 2.114
104 HE1 TYR 13 HE1 TYR 13 -0.371 10.152 -1.955
105 HE2 TYR 13 HE2 TYR 13 -0.426 12.895 1.368
106 HH TYR 13 HH TYR 13 -1.966 11.758 -1.665
107 H ALA 14 H ALA 14 5.708 7.892 -0.428
108 HA ALA 14 HA ALA 14 7.028 6.570 1.724
109 HB1 ALA 14 1HB ALA 14 7.884 7.314 -1.099
110 HB2 ALA 14 2HB ALA 14 8.748 6.168 -0.056
111 HB3 ALA 14 3HB ALA 14 7.090 5.821 -0.599
112 H LYS 15 H LYS 15 8.478 7.231 3.174
113 HA LYS 15 HA LYS 15 9.312 10.030 3.334
114 HB2 LYS 15 2HB LYS 15 9.774 7.599 5.111
115 HB3 LYS 15 3HB LYS 15 10.515 9.158 5.427
116 HG2 LYS 15 2HG LYS 15 8.585 8.955 6.805
117 HG3 LYS 15 3HG LYS 15 8.312 10.236 5.619
118 HD2 LYS 15 2HD LYS 15 6.882 8.778 4.304
119 HD3 LYS 15 3HD LYS 15 7.251 7.386 5.354
120 HE2 LYS 15 2HE LYS 15 6.180 8.595 7.248
121 HE3 LYS 15 3HE LYS 15 5.821 9.951 6.158
122 HZ1 LYS 15 3HZ LYS 15 3.910 8.396 6.363
123 HZ2 LYS 15 1HZ LYS 15 4.493 8.423 4.813
124 HZ3 LYS 15 2HZ LYS 15 4.836 7.165 5.804
125 H SER 16 H SER 16 10.945 6.993 2.646
126 HA SER 16 HA SER 16 13.405 8.276 1.693
127 HB2 SER 16 2HB SER 16 13.641 8.090 4.203
128 HB3 SER 16 3HB SER 16 13.511 6.336 4.031
129 HG SER 16 HG SER 16 15.510 8.094 2.986
130 H GLY 17 H GLY 17 14.694 6.787 0.459
131 HA2 GLY 17 2HA GLY 17 13.033 5.006 -1.069
132 HA3 GLY 17 3HA GLY 17 14.710 5.426 -1.395
133 H ARG 18 H ARG 18 13.679 3.938 1.611
134 HA ARG 18 HA ARG 18 15.915 2.076 1.422
135 HB2 ARG 18 2HB ARG 18 13.972 2.536 3.697
136 HB3 ARG 18 3HB ARG 18 15.537 1.712 3.763
137 HG2 ARG 18 2HG ARG 18 16.490 3.964 2.750
138 HG3 ARG 18 3HG ARG 18 14.939 4.635 3.294
139 HD2 ARG 18 2HD ARG 18 15.461 3.661 5.580
140 HD3 ARG 18 3HD ARG 18 17.072 3.270 4.923
141 HE ARG 18 HE ARG 18 16.351 6.056 4.487
142 HH11 ARG 18 1HH2 ARG 18 17.547 3.984 7.102
143 HH12 ARG 18 2HH2 ARG 18 18.324 5.377 7.870
144 HH21 ARG 18 1HH1 ARG 18 17.415 7.696 5.646
145 HH22 ARG 18 2HH1 ARG 18 18.255 7.243 7.135
146 H ALA 19 H ALA 19 12.497 1.709 1.034
147 HA ALA 19 HA ALA 19 12.379 -1.102 1.809
148 HB1 ALA 19 1HB ALA 19 10.303 0.760 0.582
149 HB2 ALA 19 2HB ALA 19 10.000 -0.854 1.258
150 HB3 ALA 19 3HB ALA 19 10.543 0.455 2.319
151 H SER 20 H SER 20 11.642 -2.810 0.406
152 HA SER 20 HA SER 20 12.460 -2.515 -2.443
153 HB2 SER 20 2HB SER 20 13.352 -4.784 -2.377
154 HB3 SER 20 3HB SER 20 14.236 -3.651 -1.343
155 HG SER 20 HG SER 20 13.914 -5.560 -0.226
156 H CYS 21 HN CYS 21 11.144 -3.304 -3.946
157 HA CYS 21 HA CYS 21 8.416 -3.829 -3.086
158 HB2 CYS 21 2HB CYS 21 9.092 -2.340 -4.956
159 HB3 CYS 21 3HB CYS 21 9.657 -3.761 -5.850
160 H LYS 22 H LYS 22 7.720 -5.755 -2.498
161 HA LYS 22 HA LYS 22 9.226 -8.158 -3.061
162 HB2 LYS 22 2HB LYS 22 6.507 -8.191 -1.760
163 HB3 LYS 22 3HB LYS 22 7.863 -9.265 -1.490
164 HG2 LYS 22 2HG LYS 22 7.678 -6.360 -0.654
165 HG3 LYS 22 3HG LYS 22 7.394 -7.738 0.384
166 HD2 LYS 22 2HD LYS 22 9.723 -8.481 0.157
167 HD3 LYS 22 3HD LYS 22 10.057 -7.136 -0.971
168 HE2 LYS 22 2HE LYS 22 9.287 -5.551 0.837
169 HE3 LYS 22 3HE LYS 22 9.205 -6.939 1.945
170 HZ1 LYS 22 3HZ LYS 22 11.643 -5.921 0.567
171 HZ2 LYS 22 1HZ LYS 22 11.340 -5.823 2.166
172 HZ3 LYS 22 2HZ LYS 22 11.615 -7.280 1.484
173 H LYS 23 H LYS 23 7.156 -6.686 -5.094
174 HA LYS 23 HA LYS 23 6.191 -9.223 -6.371
175 HB2 LYS 23 2HB LYS 23 4.375 -7.786 -5.699
176 HB3 LYS 23 3HB LYS 23 5.100 -6.401 -6.510
177 HG2 LYS 23 2HG LYS 23 3.187 -7.322 -7.730
178 HG3 LYS 23 3HG LYS 23 4.661 -7.361 -8.696
179 HD2 LYS 23 2HD LYS 23 4.908 -9.771 -8.328
180 HD3 LYS 23 3HD LYS 23 3.559 -9.773 -7.180
181 HE2 LYS 23 2HE LYS 23 2.020 -9.051 -8.979
182 HE3 LYS 23 3HE LYS 23 3.364 -9.010 -10.129
183 HZ1 LYS 23 3HZ LYS 23 3.631 -11.409 -9.806
184 HZ2 LYS 23 1HZ LYS 23 2.402 -11.452 -8.727
185 HZ3 LYS 23 2HZ LYS 23 2.106 -11.085 -10.288
186 H CYS 24 HN CYS 24 7.397 -5.953 -7.381
187 HA CYS 24 HA CYS 24 8.277 -7.226 -9.896
188 HB2 CYS 24 2HB CYS 24 8.335 -5.183 -10.921
189 HB3 CYS 24 3HB CYS 24 6.856 -5.206 -9.966
190 H SER 25 H SER 25 9.751 -6.763 -6.993
191 HA SER 25 HA SER 25 11.789 -7.026 -6.202
192 HB2 SER 25 2HB SER 25 13.379 -8.411 -7.236
193 HB3 SER 25 3HB SER 25 11.766 -9.010 -7.630
194 HG SER 25 HG SER 25 12.089 -7.635 -9.631
195 H GLU 26 H GLU 26 11.183 -4.464 -7.743
196 HA GLU 26 HA GLU 26 13.917 -3.301 -7.952
197 HB2 GLU 26 2HB GLU 26 11.163 -2.067 -8.310
198 HB3 GLU 26 3HB GLU 26 12.689 -1.240 -8.594
199 HG2 GLU 26 2HG GLU 26 11.798 -3.686 -10.180
200 HG3 GLU 26 3HG GLU 26 11.479 -2.027 -10.643
201 H SER 27 H SER 27 13.715 -0.866 -6.825
202 HA SER 27 HA SER 27 12.847 -1.291 -4.002
203 HB2 SER 27 2HB SER 27 15.110 0.530 -4.744
204 HB3 SER 27 3HB SER 27 14.591 -0.062 -3.146
205 HG SER 27 HG SER 27 15.254 -2.170 -3.806
206 H ILE 28 H ILE 28 11.909 0.427 -2.890
207 HA ILE 28 HA ILE 28 10.184 1.871 -4.780
208 HB ILE 28 HB ILE 28 9.867 1.473 -1.797
209 HG12 ILE 28 2HG1 ILE 28 8.488 -0.132 -3.990
210 HG13 ILE 28 3HG1 ILE 28 9.944 -0.704 -3.177
211 HG21 ILE 28 1HG2 ILE 28 8.519 3.362 -2.708
212 HG22 ILE 28 2HG2 ILE 28 7.890 2.312 -3.987
213 HG23 ILE 28 3HG2 ILE 28 7.477 2.000 -2.301
214 HD11 ILE 28 3HD1 ILE 28 8.825 -0.577 -0.983
215 HD12 ILE 28 1HD1 ILE 28 7.303 -0.153 -1.799
216 HD13 ILE 28 2HD1 ILE 28 8.081 -1.714 -2.111
217 HA PRO 29 HA PRO 29 12.580 5.556 -3.723
218 HB2 PRO 29 2HB PRO 29 11.492 7.366 -5.459
219 HB3 PRO 29 3HB PRO 29 12.552 6.031 -5.990
220 HG2 PRO 29 2HG PRO 29 9.524 6.115 -5.993
221 HG3 PRO 29 3HG PRO 29 10.615 5.612 -7.321
222 HD2 PRO 29 2HD PRO 29 9.423 3.820 -5.637
223 HD3 PRO 29 3HD PRO 29 11.071 3.551 -6.287
224 H LYS 30 H LYS 30 12.381 7.591 -2.697
225 HA LYS 30 HA LYS 30 10.026 7.985 -1.024
226 HB2 LYS 30 2HB LYS 30 11.143 9.844 -0.074
227 HB3 LYS 30 3HB LYS 30 12.270 8.497 -0.211
228 HG2 LYS 30 2HG LYS 30 13.309 9.520 -2.193
229 HG3 LYS 30 3HG LYS 30 12.181 10.882 -2.106
230 HD2 LYS 30 2HD LYS 30 14.185 10.127 0.067
231 HD3 LYS 30 3HD LYS 30 14.433 11.378 -1.158
232 HE2 LYS 30 2HE LYS 30 12.457 12.620 -0.325
233 HE3 LYS 30 3HE LYS 30 12.184 11.383 0.909
234 HZ1 LYS 30 3HZ LYS 30 14.618 13.074 0.729
235 HZ2 LYS 30 1HZ LYS 30 13.408 13.271 1.805
236 HZ3 LYS 30 2HZ LYS 30 14.339 11.937 1.872
237 H ASP 31 H ASP 31 8.835 9.999 -0.915
238 HA ASP 31 HA ASP 31 7.186 11.227 -1.813
239 HB2 ASP 31 2HB ASP 31 9.160 12.704 -2.176
240 HB3 ASP 31 3HB ASP 31 9.244 12.140 -3.843
241 H SER 32 H SER 32 7.169 8.562 -2.596
242 HA SER 32 HA SER 32 5.432 8.719 -4.990
243 HB2 SER 32 2HB SER 32 6.132 6.665 -5.843
244 HB3 SER 32 3HB SER 32 7.640 7.513 -5.491
245 HG SER 32 HG SER 32 7.986 6.181 -3.766
246 H LEU 33 H LEU 33 3.896 6.721 -4.933
247 HA LEU 33 HA LEU 33 2.784 6.562 -2.186
248 HB2 LEU 33 2HB LEU 33 1.362 7.523 -4.016
249 HB3 LEU 33 3HB LEU 33 1.482 5.981 -4.868
250 HG LEU 33 HG LEU 33 0.410 4.890 -2.848
251 HD11 LEU 33 1HD1 LEU 33 0.797 6.595 -1.135
252 HD12 LEU 33 2HD1 LEU 33 -0.206 7.748 -2.040
253 HD13 LEU 33 3HD1 LEU 33 -0.925 6.282 -1.340
254 HD21 LEU 33 3HD2 LEU 33 -1.230 7.072 -4.190
255 HD22 LEU 33 1HD2 LEU 33 -0.858 5.490 -4.909
256 HD23 LEU 33 2HD2 LEU 33 -1.854 5.577 -3.446
257 H ARG 34 H ARG 34 2.868 4.701 -1.093
258 HA ARG 34 HA ARG 34 3.391 2.130 -2.481
259 HB2 ARG 34 2HB ARG 34 5.251 1.574 -1.101
260 HB3 ARG 34 3HB ARG 34 5.556 3.081 -1.959
261 HG2 ARG 34 2HG ARG 34 5.171 4.358 0.128
262 HG3 ARG 34 3HG ARG 34 4.838 2.841 0.996
263 HD2 ARG 34 2HD ARG 34 7.102 2.003 0.411
264 HD3 ARG 34 3HD ARG 34 7.423 3.501 -0.480
265 HE ARG 34 HE ARG 34 6.732 3.930 2.341
266 HH11 ARG 34 1HH2 ARG 34 9.495 3.420 0.202
267 HH12 ARG 34 2HH2 ARG 34 10.570 4.193 1.339
268 HH21 ARG 34 1HH1 ARG 34 8.080 4.667 3.684
269 HH22 ARG 34 2HH1 ARG 34 9.829 4.617 3.422
270 H MET 35 H MET 35 3.073 0.268 -1.218
271 HA MET 35 HA MET 35 1.219 0.569 1.061
272 HB2 MET 35 2HB MET 35 0.743 -1.061 -1.466
273 HB3 MET 35 3HB MET 35 -0.084 -1.415 0.058
274 HG2 MET 35 2HG MET 35 -0.959 0.897 0.114
275 HG3 MET 35 3HG MET 35 -0.216 1.205 -1.458
276 HE1 MET 35 3HE MET 35 -2.403 -1.796 0.082
277 HE2 MET 35 1HE MET 35 -3.191 -0.265 0.547
278 HE3 MET 35 2HE MET 35 -3.988 -1.361 -0.598
279 H ALA 36 H ALA 36 1.008 -1.406 2.378
280 HA ALA 36 HA ALA 36 3.210 -3.324 2.051
281 HB1 ALA 36 1HB ALA 36 4.537 -2.553 3.669
282 HB2 ALA 36 2HB ALA 36 3.471 -1.142 3.839
283 HB3 ALA 36 3HB ALA 36 3.217 -2.586 4.842
284 H ILE 37 H ILE 37 3.125 -5.180 3.655
285 HA ILE 37 HA ILE 37 0.331 -5.771 4.500
286 HB ILE 37 HB ILE 37 2.036 -7.080 2.460
287 HG12 ILE 37 2HG1 ILE 37 -0.950 -7.136 3.039
288 HG13 ILE 37 3HG1 ILE 37 -0.124 -5.890 2.098
289 HG21 ILE 37 1HG2 ILE 37 0.446 -8.877 4.316
290 HG22 ILE 37 2HG2 ILE 37 1.227 -9.341 2.779
291 HG23 ILE 37 3HG2 ILE 37 2.223 -8.843 4.132
292 HD11 ILE 37 3HD1 ILE 37 -0.428 -8.813 1.350
293 HD12 ILE 37 1HD1 ILE 37 -1.171 -7.406 0.575
294 HD13 ILE 37 2HD1 ILE 37 0.582 -7.650 0.458
295 H MET 38 H MET 38 0.030 -6.906 6.393
296 HA MET 38 HA MET 38 2.418 -7.523 8.013
297 HB2 MET 38 2HB MET 38 -0.551 -7.709 8.525
298 HB3 MET 38 3HB MET 38 0.614 -8.452 9.612
299 HG2 MET 38 2HG MET 38 0.630 -5.516 8.921
300 HG3 MET 38 3HG MET 38 -0.160 -6.224 10.326
301 HE1 MET 38 3HE MET 38 4.051 -4.859 9.813
302 HE2 MET 38 1HE MET 38 3.682 -6.212 8.732
303 HE3 MET 38 2HE MET 38 2.652 -4.772 8.699
304 H VAL 39 H VAL 39 3.616 -9.127 7.433
305 HA VAL 39 HA VAL 39 2.363 -11.852 7.455
306 HB VAL 39 HB VAL 39 3.158 -11.342 5.212
307 HG11 VAL 39 1HG1 VAL 39 5.936 -11.080 6.430
308 HG12 VAL 39 2HG1 VAL 39 5.508 -11.110 4.708
309 HG13 VAL 39 3HG1 VAL 39 4.974 -9.765 5.723
310 HG21 VAL 39 3HG2 VAL 39 4.957 -13.435 6.454
311 HG22 VAL 39 1HG2 VAL 39 3.236 -13.676 6.041
312 HG23 VAL 39 2HG2 VAL 39 4.417 -13.309 4.776
313 H GLN 40 H GLN 40 3.553 -13.504 8.508
314 HA GLN 40 HA GLN 40 5.090 -12.604 10.836
315 HB2 GLN 40 2HB GLN 40 5.210 -15.136 11.241
316 HB3 GLN 40 3HB GLN 40 3.661 -14.312 11.416
317 HG2 GLN 40 2HG GLN 40 2.872 -15.102 9.280
318 HG3 GLN 40 3HG GLN 40 4.454 -15.765 8.863
319 HE21 GLN 40 2HE2 GLN 40 2.791 -17.675 8.497
320 HE22 GLN 40 1HE2 GLN 40 2.600 -18.738 9.884
321 H SER 41 H SER 41 7.210 -12.733 11.209
322 HA SER 41 HA SER 41 8.924 -12.997 8.862
323 HB2 SER 41 2HB SER 41 9.071 -11.081 10.413
324 HB3 SER 41 3HB SER 41 9.603 -12.185 11.682
325 HG SER 41 HG SER 41 10.934 -11.348 9.338
326 HA PRO 42 HA PRO 42 10.917 -16.752 10.200
327 HB2 PRO 42 2HB PRO 42 12.923 -16.023 8.083
328 HB3 PRO 42 3HB PRO 42 12.082 -17.578 8.341
329 HG2 PRO 42 2HG PRO 42 11.341 -15.900 6.325
330 HG3 PRO 42 3HG PRO 42 10.106 -16.781 7.286
331 HD2 PRO 42 2HD PRO 42 11.045 -13.912 7.632
332 HD3 PRO 42 3HD PRO 42 9.379 -14.569 7.588
333 H MET 43 H MET 43 12.177 -13.540 10.200
334 HA MET 43 HA MET 43 14.678 -14.303 11.662
335 HB2 MET 43 2HB MET 43 14.005 -11.942 9.903
336 HB3 MET 43 3HB MET 43 15.462 -12.027 10.887
337 HG2 MET 43 2HG MET 43 16.474 -13.615 9.614
338 HG3 MET 43 3HG MET 43 14.976 -14.411 9.155
339 HE1 MET 43 3HE MET 43 13.575 -12.469 6.208
340 HE2 MET 43 1HE MET 43 13.563 -13.976 7.155
341 HE3 MET 43 2HE MET 43 13.113 -12.446 7.927
342 H PHE 44 H PHE 44 11.743 -12.404 11.902
343 HA PHE 44 HA PHE 44 12.635 -11.171 14.473
344 HB2 PHE 44 2HB PHE 44 12.202 -9.538 12.746
345 HB3 PHE 44 3HB PHE 44 10.634 -10.238 12.399
346 HD1 PHE 44 HD1 PHE 44 12.575 -8.611 15.180
347 HD2 PHE 44 HD2 PHE 44 8.697 -9.413 13.465
348 HE1 PHE 44 HE1 PHE 44 11.513 -7.138 16.876
349 HE2 PHE 44 HE2 PHE 44 7.644 -7.928 15.151
350 HZ PHE 44 HZ PHE 44 9.048 -6.797 16.866
351 H ASP 45 H ASP 45 11.029 -10.876 16.105
352 HA ASP 45 HA ASP 45 9.646 -13.427 16.613
353 HB2 ASP 45 2HB ASP 45 10.358 -11.114 18.448
354 HB3 ASP 45 3HB ASP 45 9.608 -12.626 18.962
355 H GLY 46 H GLY 46 8.203 -12.097 14.712
356 HA2 GLY 46 2HA GLY 46 5.569 -11.907 15.576
357 HA3 GLY 46 3HA GLY 46 6.233 -10.279 15.750
358 H LYS 47 H LYS 47 5.031 -9.352 14.166
359 HA LYS 47 HA LYS 47 5.071 -10.446 11.401
360 HB2 LYS 47 2HB LYS 47 3.255 -8.370 12.655
361 HB3 LYS 47 3HB LYS 47 3.077 -9.038 11.045
362 HG2 LYS 47 2HG LYS 47 3.036 -10.876 13.492
363 HG3 LYS 47 3HG LYS 47 1.625 -9.913 13.093
364 HD2 LYS 47 2HD LYS 47 2.886 -11.998 11.288
365 HD3 LYS 47 3HD LYS 47 1.473 -12.221 12.322
366 HE2 LYS 47 2HE LYS 47 0.453 -10.200 11.045
367 HE3 LYS 47 3HE LYS 47 1.741 -10.471 9.862
368 HZ1 LYS 47 3HZ LYS 47 0.853 -12.797 9.652
369 HZ2 LYS 47 1HZ LYS 47 -0.381 -12.403 10.643
370 HZ3 LYS 47 2HZ LYS 47 -0.233 -11.663 9.196
371 H VAL 48 H VAL 48 5.671 -9.240 9.673
372 HA VAL 48 HA VAL 48 7.059 -6.650 10.161
373 HB VAL 48 HB VAL 48 8.786 -7.380 8.507
374 HG11 VAL 48 1HG1 VAL 48 8.616 -8.998 11.087
375 HG12 VAL 48 2HG1 VAL 48 10.089 -8.677 10.150
376 HG13 VAL 48 3HG1 VAL 48 9.226 -7.344 10.930
377 HG21 VAL 48 3HG2 VAL 48 7.657 -9.260 7.420
378 HG22 VAL 48 1HG2 VAL 48 9.186 -9.772 8.142
379 HG23 VAL 48 2HG2 VAL 48 7.650 -10.171 8.939
380 HA PRO 49 HA PRO 49 4.628 -5.440 6.720
381 HB2 PRO 49 2HB PRO 49 5.645 -2.988 6.088
382 HB3 PRO 49 3HB PRO 49 4.790 -3.322 7.624
383 HG2 PRO 49 2HG PRO 49 7.785 -3.266 7.135
384 HG3 PRO 49 3HG PRO 49 6.864 -2.486 8.457
385 HD2 PRO 49 2HD PRO 49 8.120 -4.910 8.746
386 HD3 PRO 49 3HD PRO 49 6.593 -4.516 9.591
387 H HIS 50 H HIS 50 4.666 -6.399 4.776
388 HA HIS 50 HA HIS 50 7.105 -6.379 3.055
389 HB2 HIS 50 2HB HIS 50 4.498 -7.892 3.060
390 HB3 HIS 50 3HB HIS 50 5.393 -7.703 1.554
391 HD2 HIS 50 HD2 HIS 50 7.238 -8.071 4.883
392 HE1 HIS 50 HE1 HIS 50 7.904 -11.684 2.715
393 HE2 HIS 50 HE2 HIS 50 8.605 -10.344 4.767
394 H TRP 51 H TRP 51 7.420 -4.329 2.409
395 HA TRP 51 HA TRP 51 5.293 -2.646 1.427
396 HB2 TRP 51 2HB TRP 51 8.294 -2.371 1.168
397 HB3 TRP 51 3HB TRP 51 7.110 -1.119 0.818
398 HD1 TRP 51 HD1 TRP 51 8.984 -2.725 3.657
399 HE1 TRP 51 HE1 TRP 51 8.570 -1.443 5.834
400 HE3 TRP 51 HE3 TRP 51 5.180 0.349 2.085
401 HZ2 TRP 51 HZ2 TRP 51 6.778 0.581 6.805
402 HZ3 TRP 51 HZ3 TRP 51 4.074 1.882 3.720
403 HH2 TRP 51 HH2 TRP 51 4.921 2.051 6.050
404 H TYR 52 H TYR 52 4.705 -2.191 -0.645
405 HA TYR 52 HA TYR 52 6.362 -3.042 -2.942
406 HB2 TYR 52 2HB TYR 52 3.385 -3.290 -3.187
407 HB3 TYR 52 3HB TYR 52 4.688 -4.005 -4.138
408 HD1 TYR 52 HD1 TYR 52 3.088 -4.288 -0.722
409 HD2 TYR 52 HD2 TYR 52 5.040 -6.236 -4.026
410 HE1 TYR 52 HE1 TYR 52 2.569 -6.507 0.280
411 HE2 TYR 52 HE2 TYR 52 4.461 -8.461 -3.057
412 HH TYR 52 HH TYR 52 2.713 -8.790 0.044
413 H HIS 53 H HIS 53 5.784 -1.734 -4.884
414 HA HIS 53 HA HIS 53 4.997 1.034 -4.465
415 HB2 HIS 53 2HB HIS 53 4.627 -0.641 -6.977
416 HB3 HIS 53 3HB HIS 53 4.559 1.093 -6.869
417 HD2 HIS 53 HD2 HIS 53 6.870 2.448 -6.329
418 HE1 HIS 53 HE1 HIS 53 9.396 -0.548 -8.001
419 HE2 HIS 53 HE2 HIS 53 9.255 1.888 -7.305
420 H PHE 54 H PHE 54 2.868 2.035 -4.850
421 HA PHE 54 HA PHE 54 0.678 0.669 -3.692
422 HB2 PHE 54 2HB PHE 54 0.464 2.920 -3.632
423 HB3 PHE 54 3HB PHE 54 1.010 3.183 -5.284
424 HD1 PHE 54 HD2 PHE 54 -1.943 2.354 -3.183
425 HD2 PHE 54 HD1 PHE 54 -0.490 3.069 -7.181
426 HE1 PHE 54 HE2 PHE 54 -4.291 2.452 -4.038
427 HE2 PHE 54 HE1 PHE 54 -2.830 3.148 -8.012
428 HZ PHE 54 HZ PHE 54 -4.718 2.762 -6.452
429 H SER 55 H SER 55 1.537 0.972 -7.168
430 HA SER 55 HA SER 55 -0.890 -0.301 -8.109
431 HB2 SER 55 2HB SER 55 0.203 -0.358 -10.284
432 HB3 SER 55 3HB SER 55 0.322 1.239 -9.542
433 HG SER 55 HG SER 55 2.465 0.837 -9.033
434 H CYS 56 HN CYS 56 2.349 -1.456 -7.238
435 HA CYS 56 HA CYS 56 2.097 -4.046 -8.264
436 HB2 CYS 56 2HB CYS 56 3.834 -2.879 -6.083
437 HB3 CYS 56 3HB CYS 56 3.995 -4.533 -6.659
438 H PHE 57 H PHE 57 1.119 -2.764 -5.093
439 HA PHE 57 HA PHE 57 0.399 -5.119 -3.700
440 HB2 PHE 57 2HB PHE 57 0.291 -2.836 -2.819
441 HB3 PHE 57 3HB PHE 57 -1.088 -2.482 -3.854
442 HD1 PHE 57 HD1 PHE 57 -3.241 -3.826 -3.561
443 HD2 PHE 57 HD2 PHE 57 -0.029 -3.896 -0.687
444 HE1 PHE 57 HE1 PHE 57 -4.800 -4.696 -1.853
445 HE2 PHE 57 HE2 PHE 57 -1.620 -4.693 1.048
446 HZ PHE 57 HZ PHE 57 -3.996 -5.133 0.457
447 H TRP 58 H TRP 58 -1.566 -3.306 -6.117
448 HA TRP 58 HA TRP 58 -3.643 -5.326 -6.164
449 HB2 TRP 58 2HB TRP 58 -3.265 -3.086 -8.146
450 HB3 TRP 58 3HB TRP 58 -4.751 -3.924 -7.705
451 HD1 TRP 58 HD1 TRP 58 -2.644 -1.001 -6.851
452 HE1 TRP 58 HE1 TRP 58 -3.464 0.256 -4.793
453 HE3 TRP 58 HE3 TRP 58 -6.203 -4.335 -5.239
454 HZ2 TRP 58 HZ2 TRP 58 -5.515 -0.070 -2.760
455 HZ3 TRP 58 HZ3 TRP 58 -7.564 -3.823 -3.247
456 HH2 TRP 58 HH2 TRP 58 -7.248 -1.681 -2.025
457 H LYS 59 H LYS 59 -0.616 -5.124 -7.821
458 HA LYS 59 HA LYS 59 -1.334 -7.029 -9.956
459 HB2 LYS 59 2HB LYS 59 1.373 -6.147 -8.921
460 HB3 LYS 59 3HB LYS 59 1.120 -7.226 -10.288
461 HG2 LYS 59 2HG LYS 59 0.061 -5.524 -11.605
462 HG3 LYS 59 3HG LYS 59 -0.095 -4.458 -10.217
463 HD2 LYS 59 2HD LYS 59 2.635 -4.808 -10.230
464 HD3 LYS 59 3HD LYS 59 2.294 -4.964 -11.956
465 HE2 LYS 59 2HE LYS 59 1.356 -2.783 -12.085
466 HE3 LYS 59 3HE LYS 59 0.995 -2.761 -10.359
467 HZ1 LYS 59 3HZ LYS 59 3.692 -2.449 -11.540
468 HZ2 LYS 59 1HZ LYS 59 2.839 -1.337 -10.662
469 HZ3 LYS 59 2HZ LYS 59 3.433 -2.661 -9.936
470 H VAL 60 H VAL 60 -0.199 -7.193 -6.590
471 HA VAL 60 HA VAL 60 0.019 -10.140 -6.629
472 HB VAL 60 HB VAL 60 -0.340 -8.303 -4.231
473 HG11 VAL 60 1HG1 VAL 60 0.631 -11.188 -4.458
474 HG12 VAL 60 2HG1 VAL 60 0.654 -10.205 -2.980
475 HG13 VAL 60 3HG1 VAL 60 -0.890 -10.654 -3.713
476 HG21 VAL 60 3HG2 VAL 60 2.217 -9.504 -5.366
477 HG22 VAL 60 1HG2 VAL 60 1.773 -7.785 -5.459
478 HG23 VAL 60 2HG2 VAL 60 2.061 -8.532 -3.892
479 H GLY 61 H GLY 61 -2.475 -7.713 -5.931
480 HA2 GLY 61 2HA GLY 61 -4.707 -7.914 -6.546
481 HA3 GLY 61 3HA GLY 61 -4.507 -9.646 -6.795
482 H HIS 62 H HIS 62 -3.629 -8.134 -3.711
483 HA HIS 62 HA HIS 62 -5.529 -9.701 -2.177
484 HB2 HIS 62 2HB HIS 62 -3.757 -7.336 -1.497
485 HB3 HIS 62 3HB HIS 62 -4.875 -8.049 -0.335
486 HD2 HIS 62 HD2 HIS 62 -1.517 -8.690 -2.024
487 HE1 HIS 62 HE1 HIS 62 -2.157 -11.955 0.646
488 HE2 HIS 62 HE2 HIS 62 -0.469 -10.830 -0.890
489 H SER 63 H SER 63 -7.541 -9.263 -1.523
490 HA SER 63 HA SER 63 -8.900 -6.813 -2.537
491 HB2 SER 63 2HB SER 63 -10.018 -9.389 -1.367
492 HB3 SER 63 3HB SER 63 -10.981 -8.001 -1.903
493 HG SER 63 HG SER 63 -9.192 -9.523 -3.531
494 H ILE 64 H ILE 64 -10.061 -5.446 -1.280
495 HA ILE 64 HA ILE 64 -9.709 -5.519 1.685
496 HB ILE 64 HB ILE 64 -9.256 -3.040 0.002
497 HG12 ILE 64 2HG1 ILE 64 -7.125 -4.969 0.970
498 HG13 ILE 64 3HG1 ILE 64 -7.452 -4.441 -0.681
499 HG21 ILE 64 1HG2 ILE 64 -8.539 -3.718 2.884
500 HG22 ILE 64 2HG2 ILE 64 -8.290 -2.158 2.088
501 HG23 ILE 64 3HG2 ILE 64 -9.935 -2.739 2.389
502 HD11 ILE 64 3HD1 ILE 64 -5.558 -3.212 -0.085
503 HD12 ILE 64 1HD1 ILE 64 -6.869 -2.052 0.148
504 HD13 ILE 64 2HD1 ILE 64 -6.144 -2.884 1.544
505 H ARG 65 H ARG 65 -11.550 -5.019 2.725
506 HA ARG 65 HA ARG 65 -13.950 -4.371 1.021
507 HB2 ARG 65 2HB ARG 65 -15.201 -5.835 2.704
508 HB3 ARG 65 3HB ARG 65 -14.266 -6.607 1.445
509 HG2 ARG 65 2HG ARG 65 -13.003 -6.181 4.161
510 HG3 ARG 65 3HG ARG 65 -14.169 -7.470 3.950
511 HD2 ARG 65 2HD ARG 65 -12.778 -8.768 2.732
512 HD3 ARG 65 3HD ARG 65 -12.120 -7.414 1.808
513 HE ARG 65 HE ARG 65 -11.023 -7.063 4.339
514 HH11 ARG 65 1HH2 ARG 65 -10.801 -9.624 1.923
515 HH12 ARG 65 2HH2 ARG 65 -9.145 -9.949 2.369
516 HH21 ARG 65 1HH1 ARG 65 -9.111 -7.566 4.852
517 HH22 ARG 65 2HH1 ARG 65 -8.133 -8.685 3.896
518 H HIS 66 H HIS 66 -12.279 -3.530 3.911
519 HA HIS 66 HA HIS 66 -13.991 -1.141 4.028
520 HB2 HIS 66 2HB HIS 66 -14.117 -1.093 6.459
521 HB3 HIS 66 3HB HIS 66 -15.112 -2.308 5.690
522 HD2 HIS 66 HD2 HIS 66 -12.946 -4.742 5.626
523 HE1 HIS 66 HE1 HIS 66 -13.250 -4.450 9.839
524 HE2 HIS 66 HE2 HIS 66 -12.555 -5.946 7.914
525 HA PRO 67 HA PRO 67 -9.455 -0.737 3.744
526 HB2 PRO 67 2HB PRO 67 -9.382 1.390 1.907
527 HB3 PRO 67 3HB PRO 67 -9.465 -0.332 1.449
528 HG2 PRO 67 2HG PRO 67 -11.762 1.613 1.777
529 HG3 PRO 67 3HG PRO 67 -11.443 0.498 0.407
530 HD2 PRO 67 2HD PRO 67 -13.194 -0.167 2.312
531 HD3 PRO 67 3HD PRO 67 -12.030 -1.401 1.737
532 H ASP 68 H ASP 68 -11.828 1.756 4.467
533 HA ASP 68 HA ASP 68 -10.030 3.736 5.475
534 HB2 ASP 68 2HB ASP 68 -12.507 3.891 4.827
535 HB3 ASP 68 3HB ASP 68 -12.892 3.087 6.342
536 H VAL 69 H VAL 69 -11.103 0.708 6.713
537 HA VAL 69 HA VAL 69 -10.104 1.203 9.455
538 HB VAL 69 HB VAL 69 -11.645 -1.180 8.365
539 HG11 VAL 69 1HG1 VAL 69 -10.443 -1.681 10.444
540 HG12 VAL 69 2HG1 VAL 69 -11.137 -0.236 11.218
541 HG13 VAL 69 3HG1 VAL 69 -12.178 -1.599 10.747
542 HG21 VAL 69 3HG2 VAL 69 -12.712 1.293 9.785
543 HG22 VAL 69 1HG2 VAL 69 -13.093 0.753 8.130
544 HG23 VAL 69 2HG2 VAL 69 -13.635 -0.204 9.504
545 H GLU 70 H GLU 70 -9.675 -0.858 6.605
546 HA GLU 70 HA GLU 70 -7.682 -2.577 7.980
547 HB2 GLU 70 2HB GLU 70 -8.735 -2.635 5.108
548 HB3 GLU 70 3HB GLU 70 -7.723 -3.869 5.865
549 HG2 GLU 70 2HG GLU 70 -9.513 -4.412 7.453
550 HG3 GLU 70 3HG GLU 70 -10.562 -3.216 6.691
551 H VAL 71 H VAL 71 -7.527 0.041 5.647
552 HA VAL 71 HA VAL 71 -4.630 -0.500 5.140
553 HB VAL 71 HB VAL 71 -6.324 1.644 3.888
554 HG11 VAL 71 1HG1 VAL 71 -3.598 0.397 3.299
555 HG12 VAL 71 2HG1 VAL 71 -4.405 1.707 2.390
556 HG13 VAL 71 3HG1 VAL 71 -3.853 1.975 4.063
557 HG21 VAL 71 3HG2 VAL 71 -6.149 0.089 1.897
558 HG22 VAL 71 1HG2 VAL 71 -5.489 -1.160 2.991
559 HG23 VAL 71 2HG2 VAL 71 -7.148 -0.572 3.200
560 H ASP 72 H ASP 72 -3.584 -0.099 6.894
561 HA ASP 72 HA ASP 72 -3.880 2.177 8.637
562 HB2 ASP 72 2HB ASP 72 -2.842 -0.029 9.118
563 HB3 ASP 72 3HB ASP 72 -1.501 0.378 8.047
564 H GLY 73 H GLY 73 -2.753 4.146 8.612
565 HA2 GLY 73 2HA GLY 73 -1.435 5.890 7.801
566 HA3 GLY 73 3HA GLY 73 -0.755 4.808 6.583
567 H PHE 74 H PHE 74 -4.033 4.485 6.215
568 HA PHE 74 HA PHE 74 -4.407 6.095 3.901
569 HB2 PHE 74 2HB PHE 74 -5.724 4.131 4.555
570 HB3 PHE 74 3HB PHE 74 -6.356 4.983 5.961
571 HD1 PHE 74 HD1 PHE 74 -6.462 4.662 2.279
572 HD2 PHE 74 HD2 PHE 74 -8.157 6.613 5.735
573 HE1 PHE 74 HE1 PHE 74 -8.398 5.405 0.917
574 HE2 PHE 74 HE2 PHE 74 -10.086 7.362 4.367
575 HZ PHE 74 HZ PHE 74 -10.210 6.753 1.962
576 H SER 75 H SER 75 -4.665 6.903 7.330
577 HA SER 75 HA SER 75 -5.897 9.497 7.110
578 HB2 SER 75 2HB SER 75 -4.812 9.752 9.401
579 HB3 SER 75 3HB SER 75 -5.946 8.396 9.212
580 HG SER 75 HG SER 75 -3.974 7.790 10.269
581 H GLU 76 H GLU 76 -2.620 8.402 6.445
582 HA GLU 76 HA GLU 76 -1.429 11.072 6.780
583 HB2 GLU 76 2HB GLU 76 -0.241 8.519 5.618
584 HB3 GLU 76 3HB GLU 76 0.630 10.003 5.975
585 HG2 GLU 76 2HG GLU 76 0.215 9.764 8.366
586 HG3 GLU 76 3HG GLU 76 -0.815 8.356 8.091
587 H LEU 77 H LEU 77 -3.129 9.403 4.320
588 HA LEU 77 HA LEU 77 -1.963 10.761 2.000
589 HB2 LEU 77 2HB LEU 77 -4.532 9.177 2.316
590 HB3 LEU 77 3HB LEU 77 -3.833 9.701 0.793
591 HG LEU 77 HG LEU 77 -2.686 7.628 2.706
592 HD11 LEU 77 1HD1 LEU 77 -3.929 7.475 -0.078
593 HD12 LEU 77 2HD1 LEU 77 -3.175 6.121 0.765
594 HD13 LEU 77 3HD1 LEU 77 -4.635 6.871 1.434
595 HD21 LEU 77 3HD2 LEU 77 -1.608 8.565 0.016
596 HD22 LEU 77 1HD2 LEU 77 -0.833 8.832 1.594
597 HD23 LEU 77 2HD2 LEU 77 -1.001 7.190 0.968
598 H ARG 78 H ARG 78 -3.089 12.207 0.626
599 HA ARG 78 HA ARG 78 -5.138 13.961 1.877
600 HB2 ARG 78 2HB ARG 78 -3.554 14.105 -0.727
601 HB3 ARG 78 3HB ARG 78 -4.920 15.163 -0.427
602 HG2 ARG 78 2HG ARG 78 -2.459 15.009 1.366
603 HG3 ARG 78 3HG ARG 78 -2.756 16.224 0.113
604 HD2 ARG 78 2HD ARG 78 -4.877 16.874 1.294
605 HD3 ARG 78 3HD ARG 78 -4.457 15.761 2.603
606 HE ARG 78 HE ARG 78 -2.242 17.500 2.156
607 HH11 ARG 78 1HH2 ARG 78 -5.476 17.711 3.496
608 HH12 ARG 78 2HH2 ARG 78 -5.050 19.035 4.545
609 HH21 ARG 78 1HH1 ARG 78 -1.773 19.191 3.517
610 HH22 ARG 78 2HH1 ARG 78 -3.008 19.847 4.550
611 H TRP 79 H TRP 79 -6.989 14.591 0.620
612 HA TRP 79 HA TRP 79 -8.737 12.483 0.524
613 HB2 TRP 79 2HB TRP 79 -9.948 14.325 0.809
614 HB3 TRP 79 3HB TRP 79 -8.818 15.340 -0.061
615 HD1 TRP 79 HD1 TRP 79 -12.030 13.367 -0.603
616 HE1 TRP 79 HE1 TRP 79 -13.029 13.975 -2.894
617 HE3 TRP 79 HE3 TRP 79 -8.166 16.150 -2.436
618 HZ2 TRP 79 HZ2 TRP 79 -12.263 15.540 -5.211
619 HZ3 TRP 79 HZ3 TRP 79 -8.295 17.167 -4.702
620 HH2 TRP 79 HH2 TRP 79 -10.339 16.872 -6.096
621 H ASP 80 H ASP 80 -6.985 13.807 -2.291
622 HA ASP 80 HA ASP 80 -8.511 12.361 -4.226
623 HB2 ASP 80 2HB ASP 80 -7.210 14.434 -4.682
624 HB3 ASP 80 3HB ASP 80 -5.721 13.494 -4.538
625 H ASP 81 H ASP 81 -5.754 11.372 -2.283
626 HA ASP 81 HA ASP 81 -5.283 8.947 -3.915
627 HB2 ASP 81 2HB ASP 81 -3.871 10.084 -1.488
628 HB3 ASP 81 3HB ASP 81 -3.532 8.492 -2.177
629 H GLN 82 H GLN 82 -6.686 10.006 -0.785
630 HA GLN 82 HA GLN 82 -7.448 7.457 0.197
631 HB2 GLN 82 2HB GLN 82 -8.670 10.231 0.403
632 HB3 GLN 82 3HB GLN 82 -9.429 8.841 1.169
633 HG2 GLN 82 2HG GLN 82 -7.382 8.362 2.427
634 HG3 GLN 82 3HG GLN 82 -6.574 9.741 1.671
635 HE21 GLN 82 2HE2 GLN 82 -6.663 9.626 4.422
636 HE22 GLN 82 1HE2 GLN 82 -7.763 10.884 5.003
637 H GLN 83 H GLN 83 -9.373 9.670 -1.956
638 HA GLN 83 HA GLN 83 -11.456 7.751 -2.285
639 HB2 GLN 83 2HB GLN 83 -12.395 9.174 -3.910
640 HB3 GLN 83 3HB GLN 83 -11.704 10.182 -2.640
641 HG2 GLN 83 2HG GLN 83 -9.710 10.566 -4.133
642 HG3 GLN 83 3HG GLN 83 -10.524 9.681 -5.415
643 HE21 GLN 83 2HE2 GLN 83 -9.785 12.303 -6.038
644 HE22 GLN 83 1HE2 GLN 83 -11.224 13.301 -5.987
645 H LYS 84 H LYS 84 -8.349 7.957 -3.937
646 HA LYS 84 HA LYS 84 -9.125 6.225 -6.163
647 HB2 LYS 84 2HB LYS 84 -7.621 8.071 -6.518
648 HB3 LYS 84 3HB LYS 84 -6.573 7.571 -5.198
649 HG2 LYS 84 2HG LYS 84 -6.971 5.725 -7.551
650 HG3 LYS 84 3HG LYS 84 -5.944 7.141 -7.730
651 HD2 LYS 84 2HD LYS 84 -5.599 4.974 -5.638
652 HD3 LYS 84 3HD LYS 84 -4.649 5.142 -7.121
653 HE2 LYS 84 2HE LYS 84 -4.678 6.988 -4.700
654 HE3 LYS 84 3HE LYS 84 -3.393 5.883 -5.164
655 HZ1 LYS 84 3HZ LYS 84 -4.237 8.176 -6.855
656 HZ2 LYS 84 1HZ LYS 84 -3.024 8.257 -5.777
657 HZ3 LYS 84 2HZ LYS 84 -2.909 7.238 -7.070
658 H VAL 85 H VAL 85 -7.343 5.954 -3.041
659 HA VAL 85 HA VAL 85 -6.739 3.119 -3.409
660 HB VAL 85 HB VAL 85 -6.954 4.843 -0.910
661 HG11 VAL 85 1HG1 VAL 85 -6.004 1.941 -1.095
662 HG12 VAL 85 2HG1 VAL 85 -5.768 3.007 0.301
663 HG13 VAL 85 3HG1 VAL 85 -7.401 2.542 -0.172
664 HG21 VAL 85 3HG2 VAL 85 -4.996 5.192 -2.548
665 HG22 VAL 85 1HG2 VAL 85 -4.573 4.817 -0.874
666 HG23 VAL 85 2HG2 VAL 85 -4.472 3.557 -2.112
667 H LYS 86 H LYS 86 -9.500 4.826 -1.837
668 HA LYS 86 HA LYS 86 -11.010 2.446 -1.259
669 HB2 LYS 86 2HB LYS 86 -11.870 5.325 -1.782
670 HB3 LYS 86 3HB LYS 86 -12.992 4.021 -1.363
671 HG2 LYS 86 2HG LYS 86 -11.621 3.562 0.696
672 HG3 LYS 86 3HG LYS 86 -10.671 5.012 0.357
673 HD2 LYS 86 2HD LYS 86 -12.589 6.436 0.636
674 HD3 LYS 86 3HD LYS 86 -13.708 5.051 0.678
675 HE2 LYS 86 2HE LYS 86 -12.907 4.274 2.761
676 HE3 LYS 86 3HE LYS 86 -11.470 5.278 2.698
677 HZ1 LYS 86 3HZ LYS 86 -12.978 6.296 4.204
678 HZ2 LYS 86 1HZ LYS 86 -12.983 7.249 2.882
679 HZ3 LYS 86 2HZ LYS 86 -14.241 6.237 3.148
680 H LYS 87 H LYS 87 -11.077 4.533 -4.194
681 HA LYS 87 HA LYS 87 -12.938 2.968 -5.678
682 HB2 LYS 87 2HB LYS 87 -12.179 5.246 -6.331
683 HB3 LYS 87 3HB LYS 87 -10.560 4.622 -6.648
684 HG2 LYS 87 2HG LYS 87 -11.656 4.960 -8.733
685 HG3 LYS 87 3HG LYS 87 -11.496 3.218 -8.505
686 HD2 LYS 87 2HD LYS 87 -13.868 3.111 -7.747
687 HD3 LYS 87 3HD LYS 87 -13.989 4.877 -7.936
688 HE2 LYS 87 2HE LYS 87 -13.469 4.636 -10.361
689 HE3 LYS 87 3HE LYS 87 -13.357 2.882 -10.165
690 HZ1 LYS 87 3HZ LYS 87 -15.810 4.497 -9.691
691 HZ2 LYS 87 1HZ LYS 87 -15.544 3.544 -10.988
692 HZ3 LYS 87 2HZ LYS 87 -15.710 2.875 -9.509
693 H THR 88 H THR 88 -9.371 2.679 -5.574
694 HA THR 88 HA THR 88 -9.229 0.521 -7.393
695 HB THR 88 HB THR 88 -7.191 1.220 -5.263
696 HG1 THR 88 1HG THR 88 -7.593 2.988 -6.546
697 HG21 THR 88 1HG2 THR 88 -5.644 0.295 -6.990
698 HG22 THR 88 2HG2 THR 88 -6.777 -0.940 -6.403
699 HG23 THR 88 3HG2 THR 88 -7.056 -0.166 -7.966
700 H ALA 89 H ALA 89 -9.794 0.493 -3.877
701 HA ALA 89 HA ALA 89 -9.479 -2.361 -3.548
702 HB1 ALA 89 1HB ALA 89 -10.953 -0.257 -1.912
703 HB2 ALA 89 2HB ALA 89 -10.599 -1.916 -1.398
704 HB3 ALA 89 3HB ALA 89 -9.268 -0.776 -1.689
705 H GLU 90 H GLU 90 -12.221 -0.203 -4.391
706 HA GLU 90 HA GLU 90 -14.135 -2.373 -4.517
707 HB2 GLU 90 2HB GLU 90 -14.200 0.406 -5.762
708 HB3 GLU 90 3HB GLU 90 -15.531 -0.750 -5.809
709 HG2 GLU 90 2HG GLU 90 -15.555 -0.782 -3.302
710 HG3 GLU 90 3HG GLU 90 -14.342 0.499 -3.305
711 H ALA 91 H ALA 91 -11.988 -0.846 -6.877
712 HA ALA 91 HA ALA 91 -13.034 -2.195 -9.190
713 HB1 ALA 91 1HB ALA 91 -10.440 -0.650 -8.720
714 HB2 ALA 91 2HB ALA 91 -11.154 -1.037 -10.299
715 HB3 ALA 91 3HB ALA 91 -11.994 0.059 -9.184
716 H GLY 92 H GLY 92 -10.492 -3.056 -6.904
717 HA2 GLY 92 2HA GLY 92 -9.237 -4.983 -6.674
718 HA3 GLY 92 3HA GLY 92 -10.013 -5.684 -8.098
719 H GLY 93 H GLY 93 -8.701 -2.563 -8.668
720 HA2 GLY 93 2HA GLY 93 -6.018 -2.838 -9.276
721 HA3 GLY 93 3HA GLY 93 -6.859 -3.523 -10.675
722 H VAL 94 H VAL 94 -5.280 -0.945 -10.124
723 HA VAL 94 HA VAL 94 -7.213 1.204 -10.295
724 HB VAL 94 HB VAL 94 -5.100 1.347 -9.059
725 HG11 VAL 94 1HG1 VAL 94 -3.549 0.303 -10.688
726 HG12 VAL 94 2HG1 VAL 94 -3.750 1.697 -11.768
727 HG13 VAL 94 3HG1 VAL 94 -3.002 1.903 -10.174
728 HG21 VAL 94 3HG2 VAL 94 -5.376 3.550 -11.131
729 HG22 VAL 94 1HG2 VAL 94 -6.384 3.364 -9.674
730 HG23 VAL 94 2HG2 VAL 94 -4.650 3.664 -9.525
731 H THR 95 H THR 95 -7.576 2.713 -11.956
732 HA THR 95 HA THR 95 -7.642 1.542 -14.624
733 HB THR 95 HB THR 95 -8.836 3.692 -15.183
734 HG1 THR 95 1HG THR 95 -9.359 5.028 -13.449
735 HG21 THR 95 1HG2 THR 95 -10.094 1.690 -14.404
736 HG22 THR 95 2HG2 THR 95 -9.921 2.240 -12.723
737 HG23 THR 95 3HG2 THR 95 -10.856 3.204 -13.890
738 H GLY 96 H GLY 96 -5.444 3.711 -13.107
739 HA2 GLY 96 2HA GLY 96 -4.444 4.732 -15.665
740 HA3 GLY 96 3HA GLY 96 -3.798 5.100 -14.062
741 H LYS 97 H LYS 97 -1.920 4.762 -15.791
742 HA LYS 97 HA LYS 97 -0.994 2.024 -16.213
743 HB2 LYS 97 2HB LYS 97 0.407 4.714 -16.528
744 HB3 LYS 97 3HB LYS 97 1.097 3.155 -16.995
745 HG2 LYS 97 2HG LYS 97 -0.796 2.776 -18.566
746 HG3 LYS 97 3HG LYS 97 -1.451 4.372 -18.151
747 HD2 LYS 97 2HD LYS 97 0.635 5.444 -18.969
748 HD3 LYS 97 3HD LYS 97 1.283 3.844 -19.399
749 HE2 LYS 97 2HE LYS 97 -0.637 3.488 -20.940
750 HE3 LYS 97 3HE LYS 97 -1.277 5.080 -20.515
751 HZ1 LYS 97 3HZ LYS 97 1.342 4.595 -21.837
752 HZ2 LYS 97 1HZ LYS 97 0.003 5.162 -22.576
753 HZ3 LYS 97 2HZ LYS 97 0.751 6.068 -21.445
754 H GLY 98 H GLY 98 1.003 1.155 -15.424
755 HA2 GLY 98 2HA GLY 98 1.244 1.147 -12.563
756 HA3 GLY 98 3HA GLY 98 2.338 0.367 -13.704
757 H GLN 99 H GLN 99 3.156 1.572 -11.308
758 HA GLN 99 HA GLN 99 4.175 4.256 -11.733
759 HB2 GLN 99 2HB GLN 99 4.612 2.172 -9.571
760 HB3 GLN 99 3HB GLN 99 5.346 3.779 -9.526
761 HG2 GLN 99 2HG GLN 99 3.194 4.880 -9.481
762 HG3 GLN 99 3HG GLN 99 2.334 3.367 -9.781
763 HE21 GLN 99 2HE2 GLN 99 4.186 5.162 -7.304
764 HE22 GLN 99 1HE2 GLN 99 3.605 4.159 -5.972
765 H ASP 100 H ASP 100 6.422 4.878 -11.478
766 HA ASP 100 HA ASP 100 8.442 3.056 -12.669
767 HB2 ASP 100 2HB ASP 100 7.280 4.290 -14.498
768 HB3 ASP 100 3HB ASP 100 7.712 5.816 -13.726
769 H GLY 101 H GLY 101 10.637 3.992 -12.588
770 HA2 GLY 101 2HA GLY 101 12.372 5.183 -11.542
771 HA3 GLY 101 3HA GLY 101 11.234 5.962 -10.449
772 H ILE 102 H ILE 102 13.623 5.000 -9.532
773 HA ILE 102 HA ILE 102 12.901 2.665 -7.850
774 HB ILE 102 HB ILE 102 14.158 1.895 -9.821
775 HG12 ILE 102 2HG1 ILE 102 15.664 1.563 -7.196
776 HG13 ILE 102 3HG1 ILE 102 14.188 0.716 -7.664
777 HG21 ILE 102 1HG2 ILE 102 15.606 3.924 -10.147
778 HG22 ILE 102 2HG2 ILE 102 16.557 3.428 -8.730
779 HG23 ILE 102 3HG2 ILE 102 16.495 2.406 -10.178
780 HD11 ILE 102 3HD1 ILE 102 16.056 -0.751 -8.015
781 HD12 ILE 102 1HD1 ILE 102 15.407 -0.288 -9.601
782 HD13 ILE 102 2HD1 ILE 102 16.907 0.456 -8.991
783 H GLY 103 H GLY 103 13.609 2.655 -5.817
784 HA2 GLY 103 2HA GLY 103 14.588 5.134 -4.623
785 HA3 GLY 103 3HA GLY 103 14.137 3.654 -3.776
786 H SER 104 H SER 104 16.266 5.183 -2.988
787 HA SER 104 HA SER 104 18.512 3.280 -3.240
788 HB2 SER 104 2HB SER 104 20.141 5.097 -3.464
789 HB3 SER 104 3HB SER 104 19.033 5.045 -4.843
790 HG SER 104 HG SER 104 19.338 7.183 -4.073
791 H LYS 105 H LYS 105 20.105 3.515 -1.544
792 HA LYS 105 HA LYS 105 19.037 4.592 1.036
793 HB2 LYS 105 2HB LYS 105 18.560 2.166 0.705
794 HB3 LYS 105 3HB LYS 105 20.293 1.855 0.563
795 HG2 LYS 105 2HG LYS 105 20.613 2.737 2.885
796 HG3 LYS 105 3HG LYS 105 18.867 2.982 3.020
797 HD2 LYS 105 2HD LYS 105 20.294 0.315 2.596
798 HD3 LYS 105 3HD LYS 105 19.616 0.902 4.121
799 HE2 LYS 105 2HE LYS 105 17.348 0.945 3.085
800 HE3 LYS 105 3HE LYS 105 18.025 0.303 1.583
801 HZ1 LYS 105 3HZ LYS 105 17.074 -1.454 2.941
802 HZ2 LYS 105 1HZ LYS 105 18.683 -1.693 2.804
803 HZ3 LYS 105 2HZ LYS 105 18.059 -1.107 4.197
804 H ALA 106 H ALA 106 20.463 5.608 2.289
805 HA ALA 106 HA ALA 106 23.374 5.577 1.604
806 HB1 ALA 106 1HB ALA 106 23.361 8.019 1.798
807 HB2 ALA 106 2HB ALA 106 22.196 7.496 0.570
808 HB3 ALA 106 3HB ALA 106 21.625 8.005 2.177
809 H GLU 107 H GLU 107 21.572 4.483 3.951
810 HA GLU 107 HA GLU 107 23.422 5.206 6.140
811 HB2 GLU 107 2HB GLU 107 21.586 6.862 6.235
812 HB3 GLU 107 3HB GLU 107 20.402 5.556 6.284
813 HG2 GLU 107 2HG GLU 107 21.258 4.822 8.471
814 HG3 GLU 107 3HG GLU 107 22.565 6.011 8.382
815 H LYS 108 H LYS 108 23.671 3.586 7.642
816 HA LYS 108 HA LYS 108 22.044 1.114 7.537
817 HB2 LYS 108 2HB LYS 108 23.864 0.882 5.843
818 HB3 LYS 108 3HB LYS 108 25.065 1.163 7.111
819 HG2 LYS 108 2HG LYS 108 24.299 -0.882 8.293
820 HG3 LYS 108 3HG LYS 108 23.053 -1.137 7.052
821 HD2 LYS 108 2HD LYS 108 24.822 -1.370 5.327
822 HD3 LYS 108 3HD LYS 108 26.068 -1.099 6.565
823 HE2 LYS 108 2HE LYS 108 25.271 -3.108 7.796
824 HE3 LYS 108 3HE LYS 108 24.038 -3.380 6.559
825 HZ1 LYS 108 3HZ LYS 108 26.007 -4.745 6.161
826 HZ2 LYS 108 1HZ LYS 108 25.832 -3.685 4.934
827 HZ3 LYS 108 2HZ LYS 108 26.972 -3.433 6.079
Start of MODEL 16
1 H1 MET 1 H1 MET 1 9.357 -7.450 21.157
2 H2 MET 1 H2 MET 1 9.000 -8.803 22.004
3 H3 MET 1 H3 MET 1 8.461 -7.331 22.524
4 HA MET 1 HA MET 1 7.646 -8.801 20.117
5 HB2 MET 1 2HB MET 1 6.687 -9.550 22.342
6 HB3 MET 1 3HB MET 1 5.908 -7.968 22.467
7 HG2 MET 1 2HG MET 1 4.689 -8.441 20.333
8 HG3 MET 1 3HG MET 1 5.521 -9.993 20.223
9 HE1 MET 1 1HE MET 1 3.726 -8.107 23.309
10 HE2 MET 1 2HE MET 1 2.722 -7.870 21.858
11 HE3 MET 1 3HE MET 1 2.137 -8.888 23.192
12 H ALA 2 H ALA 2 6.402 -7.778 18.581
13 HA ALA 2 HA ALA 2 6.589 -4.944 18.255
14 HB1 ALA 2 1HB ALA 2 5.148 -5.342 16.308
15 HB2 ALA 2 2HB ALA 2 6.399 -6.592 16.424
16 HB3 ALA 2 3HB ALA 2 4.729 -6.955 16.923
17 H GLU 3 H GLU 3 4.787 -3.444 17.954
18 HA GLU 3 HA GLU 3 2.450 -3.811 19.788
19 HB2 GLU 3 2HB GLU 3 4.251 -1.368 19.599
20 HB3 GLU 3 3HB GLU 3 2.710 -1.447 20.460
21 HG2 GLU 3 2HG GLU 3 3.628 -3.261 21.913
22 HG3 GLU 3 3HG GLU 3 5.193 -3.092 21.111
23 H SER 4 H SER 4 0.575 -2.827 19.246
24 HA SER 4 HA SER 4 -1.082 -2.108 17.876
25 HB2 SER 4 2HB SER 4 1.083 -0.082 17.313
26 HB3 SER 4 3HB SER 4 -0.631 0.146 16.877
27 HG SER 4 HG SER 4 -0.114 1.069 18.923
28 H SER 5 H SER 5 0.548 -4.183 16.610
29 HA SER 5 HA SER 5 0.552 -3.539 13.739
30 HB2 SER 5 2HB SER 5 1.839 -5.627 13.554
31 HB3 SER 5 3HB SER 5 2.557 -4.489 14.704
32 HG SER 5 HG SER 5 2.474 -6.606 15.582
33 H ASP 6 H ASP 6 -1.994 -4.057 15.255
34 HA ASP 6 HA ASP 6 -2.875 -6.549 14.105
35 HB2 ASP 6 2HB ASP 6 -3.387 -5.899 16.437
36 HB3 ASP 6 3HB ASP 6 -4.391 -4.574 15.845
37 H LYS 7 H LYS 7 -2.338 -5.380 11.952
38 HA LYS 7 HA LYS 7 -4.886 -4.942 10.552
39 HB2 LYS 7 2HB LYS 7 -3.805 -3.280 9.085
40 HB3 LYS 7 3HB LYS 7 -4.147 -2.711 10.704
41 HG2 LYS 7 2HG LYS 7 -1.444 -3.908 10.393
42 HG3 LYS 7 3HG LYS 7 -1.726 -2.494 9.366
43 HD2 LYS 7 2HD LYS 7 -2.454 -1.218 11.365
44 HD3 LYS 7 3HD LYS 7 -2.128 -2.627 12.384
45 HE2 LYS 7 2HE LYS 7 0.239 -2.567 11.858
46 HE3 LYS 7 3HE LYS 7 -0.016 -1.393 10.562
47 HZ1 LYS 7 3HZ LYS 7 -0.671 0.249 12.197
48 HZ2 LYS 7 1HZ LYS 7 -0.454 -0.818 13.445
49 HZ3 LYS 7 2HZ LYS 7 0.825 -0.303 12.561
50 H LEU 8 H LEU 8 -4.543 -5.259 8.212
51 HA LEU 8 HA LEU 8 -2.569 -7.421 7.555
52 HB2 LEU 8 2HB LEU 8 -5.077 -6.374 6.149
53 HB3 LEU 8 3HB LEU 8 -4.112 -7.729 5.585
54 HG LEU 8 HG LEU 8 -5.656 -7.720 8.221
55 HD11 LEU 8 1HD1 LEU 8 -6.332 -8.900 5.498
56 HD12 LEU 8 2HD1 LEU 8 -7.275 -9.110 6.997
57 HD13 LEU 8 3HD1 LEU 8 -7.115 -7.501 6.258
58 HD21 LEU 8 3HD2 LEU 8 -4.296 -9.945 6.645
59 HD22 LEU 8 1HD2 LEU 8 -3.760 -9.282 8.206
60 HD23 LEU 8 2HD2 LEU 8 -5.295 -10.162 8.104
61 H TYR 9 H TYR 9 -3.288 -4.060 6.907
62 HA TYR 9 HA TYR 9 -1.561 -4.100 4.482
63 HB2 TYR 9 2HB TYR 9 -4.322 -2.876 4.727
64 HB3 TYR 9 3HB TYR 9 -3.277 -2.796 3.311
65 HD1 TYR 9 HD1 TYR 9 -2.404 -5.509 2.862
66 HD2 TYR 9 HD2 TYR 9 -6.229 -4.080 4.193
67 HE1 TYR 9 HE1 TYR 9 -3.482 -7.546 1.911
68 HE2 TYR 9 HE2 TYR 9 -7.315 -6.133 3.276
69 HH TYR 9 HH TYR 9 -5.444 -8.640 1.526
70 H ARG 10 H ARG 10 -0.734 -2.117 3.849
71 HA ARG 10 HA ARG 10 -0.887 0.189 5.706
72 HB2 ARG 10 2HB ARG 10 1.053 -1.037 6.451
73 HB3 ARG 10 3HB ARG 10 1.548 -1.348 4.805
74 HG2 ARG 10 2HG ARG 10 3.100 0.180 5.710
75 HG3 ARG 10 3HG ARG 10 2.161 1.068 4.523
76 HD2 ARG 10 2HD ARG 10 0.711 1.909 6.436
77 HD3 ARG 10 3HD ARG 10 1.818 1.110 7.562
78 HE ARG 10 HE ARG 10 3.390 2.877 6.004
79 HH11 ARG 10 1HH2 ARG 10 0.836 3.231 8.460
80 HH12 ARG 10 2HH2 ARG 10 1.166 4.964 8.554
81 HH21 ARG 10 1HH1 ARG 10 3.813 4.913 6.453
82 HH22 ARG 10 2HH1 ARG 10 2.717 5.903 7.440
83 H VAL 11 H VAL 11 -0.671 2.196 4.640
84 HA VAL 11 HA VAL 11 0.342 2.319 1.849
85 HB VAL 11 HB VAL 11 -2.185 2.098 1.886
86 HG11 VAL 11 1HG1 VAL 11 -2.172 5.002 2.829
87 HG12 VAL 11 2HG1 VAL 11 -3.573 3.991 2.426
88 HG13 VAL 11 3HG1 VAL 11 -2.587 3.638 3.858
89 HG21 VAL 11 3HG2 VAL 11 -0.838 3.152 -0.022
90 HG22 VAL 11 1HG2 VAL 11 -2.506 3.730 0.108
91 HG23 VAL 11 2HG2 VAL 11 -1.155 4.724 0.697
92 H GLU 12 H GLU 12 1.464 4.191 1.369
93 HA GLU 12 HA GLU 12 1.222 6.613 2.964
94 HB2 GLU 12 2HB GLU 12 3.492 6.618 3.891
95 HB3 GLU 12 3HB GLU 12 2.611 5.229 4.500
96 HG2 GLU 12 2HG GLU 12 3.768 3.764 2.841
97 HG3 GLU 12 3HG GLU 12 4.659 5.169 2.241
98 H TYR 13 H TYR 13 2.292 8.349 2.294
99 HA TYR 13 HA TYR 13 3.741 8.361 -0.259
100 HB2 TYR 13 2HB TYR 13 3.571 10.469 1.915
101 HB3 TYR 13 3HB TYR 13 4.137 10.693 0.264
102 HD1 TYR 13 HD1 TYR 13 1.944 9.166 -1.224
103 HD2 TYR 13 HD2 TYR 13 1.725 11.889 2.104
104 HE1 TYR 13 HE1 TYR 13 -0.256 9.993 -2.052
105 HE2 TYR 13 HE2 TYR 13 -0.500 12.685 1.306
106 HH TYR 13 HH TYR 13 -1.949 11.497 -1.754
107 H ALA 14 H ALA 14 5.762 7.739 -0.437
108 HA ALA 14 HA ALA 14 7.254 6.665 1.724
109 HB1 ALA 14 1HB ALA 14 7.939 7.296 -1.175
110 HB2 ALA 14 2HB ALA 14 8.941 6.293 -0.103
111 HB3 ALA 14 3HB ALA 14 7.295 5.779 -0.544
112 H LYS 15 H LYS 15 8.426 7.692 3.204
113 HA LYS 15 HA LYS 15 9.379 10.433 2.869
114 HB2 LYS 15 2HB LYS 15 8.354 9.488 4.956
115 HB3 LYS 15 3HB LYS 15 9.751 8.435 5.145
116 HG2 LYS 15 2HG LYS 15 9.936 10.309 6.637
117 HG3 LYS 15 3HG LYS 15 11.216 10.431 5.432
118 HD2 LYS 15 2HD LYS 15 9.941 12.171 4.221
119 HD3 LYS 15 3HD LYS 15 8.573 11.965 5.340
120 HE2 LYS 15 2HE LYS 15 10.054 12.638 7.234
121 HE3 LYS 15 3HE LYS 15 11.387 12.879 6.099
122 HZ1 LYS 15 3HZ LYS 15 10.250 14.969 6.591
123 HZ2 LYS 15 1HZ LYS 15 10.049 14.615 5.013
124 HZ3 LYS 15 2HZ LYS 15 8.821 14.385 6.067
125 H SER 16 H SER 16 10.874 7.272 2.700
126 HA SER 16 HA SER 16 13.390 8.433 1.720
127 HB2 SER 16 2HB SER 16 13.615 8.257 4.228
128 HB3 SER 16 3HB SER 16 13.475 6.494 4.053
129 HG SER 16 HG SER 16 15.673 7.364 4.024
130 H GLY 17 H GLY 17 14.661 6.976 0.543
131 HA2 GLY 17 2HA GLY 17 13.221 4.809 -0.804
132 HA3 GLY 17 3HA GLY 17 14.832 5.423 -1.189
133 H ARG 18 H ARG 18 13.177 3.748 1.490
134 HA ARG 18 HA ARG 18 15.454 1.814 1.789
135 HB2 ARG 18 2HB ARG 18 13.942 3.258 4.007
136 HB3 ARG 18 3HB ARG 18 15.178 2.027 4.258
137 HG2 ARG 18 2HG ARG 18 15.664 4.728 2.936
138 HG3 ARG 18 3HG ARG 18 16.022 4.318 4.610
139 HD2 ARG 18 2HD ARG 18 17.632 2.611 3.900
140 HD3 ARG 18 3HD ARG 18 17.275 2.917 2.204
141 HE ARG 18 HE ARG 18 18.800 4.646 4.060
142 HH11 ARG 18 1HH2 ARG 18 17.496 4.375 0.790
143 HH12 ARG 18 2HH2 ARG 18 18.549 5.634 0.202
144 HH21 ARG 18 1HH1 ARG 18 20.066 6.245 3.217
145 HH22 ARG 18 2HH1 ARG 18 19.940 6.669 1.536
146 H ALA 19 H ALA 19 12.834 1.539 0.451
147 HA ALA 19 HA ALA 19 12.003 -0.988 1.787
148 HB1 ALA 19 1HB ALA 19 10.285 0.709 2.286
149 HB2 ALA 19 2HB ALA 19 10.133 1.075 0.549
150 HB3 ALA 19 3HB ALA 19 9.670 -0.520 1.166
151 H SER 20 H SER 20 11.662 -2.693 0.420
152 HA SER 20 HA SER 20 12.389 -2.315 -2.457
153 HB2 SER 20 2HB SER 20 12.805 -4.742 -0.690
154 HB3 SER 20 3HB SER 20 13.222 -4.606 -2.410
155 HG SER 20 HG SER 20 15.024 -4.193 -1.026
156 H CYS 21 HN CYS 21 11.163 -3.273 -4.046
157 HA CYS 21 HA CYS 21 8.384 -3.787 -3.280
158 HB2 CYS 21 2HB CYS 21 9.100 -2.319 -5.158
159 HB3 CYS 21 3HB CYS 21 9.721 -3.753 -5.998
160 H LYS 22 H LYS 22 7.710 -5.710 -2.697
161 HA LYS 22 HA LYS 22 9.242 -8.130 -3.116
162 HB2 LYS 22 2HB LYS 22 6.426 -7.785 -2.054
163 HB3 LYS 22 3HB LYS 22 7.422 -9.207 -1.824
164 HG2 LYS 22 2HG LYS 22 8.059 -6.413 -0.797
165 HG3 LYS 22 3HG LYS 22 7.245 -7.632 0.142
166 HD2 LYS 22 2HD LYS 22 10.062 -7.886 -0.996
167 HD3 LYS 22 3HD LYS 22 9.670 -7.404 0.664
168 HE2 LYS 22 2HE LYS 22 8.511 -9.583 1.027
169 HE3 LYS 22 3HE LYS 22 8.961 -10.087 -0.607
170 HZ1 LYS 22 3HZ LYS 22 11.304 -9.895 0.050
171 HZ2 LYS 22 1HZ LYS 22 10.886 -9.436 1.563
172 HZ3 LYS 22 2HZ LYS 22 10.528 -10.937 1.034
173 H LYS 23 H LYS 23 7.086 -6.651 -5.185
174 HA LYS 23 HA LYS 23 6.192 -9.206 -6.459
175 HB2 LYS 23 2HB LYS 23 4.409 -7.715 -5.749
176 HB3 LYS 23 3HB LYS 23 5.096 -6.393 -6.692
177 HG2 LYS 23 2HG LYS 23 3.150 -7.377 -7.786
178 HG3 LYS 23 3HG LYS 23 4.593 -7.575 -8.780
179 HD2 LYS 23 2HD LYS 23 4.779 -9.940 -8.107
180 HD3 LYS 23 3HD LYS 23 3.422 -9.748 -6.974
181 HE2 LYS 23 2HE LYS 23 1.923 -9.198 -8.836
182 HE3 LYS 23 3HE LYS 23 3.263 -9.296 -9.987
183 HZ1 LYS 23 3HZ LYS 23 3.468 -11.659 -9.462
184 HZ2 LYS 23 1HZ LYS 23 2.259 -11.581 -8.363
185 HZ3 LYS 23 2HZ LYS 23 1.942 -11.345 -9.945
186 H CYS 24 HN CYS 24 7.499 -6.001 -7.516
187 HA CYS 24 HA CYS 24 8.337 -7.326 -10.028
188 HB2 CYS 24 2HB CYS 24 8.431 -5.304 -11.092
189 HB3 CYS 24 3HB CYS 24 6.934 -5.302 -10.167
190 H SER 25 H SER 25 9.754 -6.865 -7.118
191 HA SER 25 HA SER 25 11.770 -7.151 -6.278
192 HB2 SER 25 2HB SER 25 13.378 -8.538 -7.281
193 HB3 SER 25 3HB SER 25 11.772 -9.126 -7.717
194 HG SER 25 HG SER 25 12.147 -7.743 -9.702
195 H GLU 26 H GLU 26 11.214 -4.571 -7.785
196 HA GLU 26 HA GLU 26 13.970 -3.458 -7.983
197 HB2 GLU 26 2HB GLU 26 11.269 -2.161 -8.457
198 HB3 GLU 26 3HB GLU 26 12.831 -1.434 -8.799
199 HG2 GLU 26 2HG GLU 26 11.793 -3.922 -10.221
200 HG3 GLU 26 3HG GLU 26 11.558 -2.279 -10.776
201 H SER 27 H SER 27 13.713 -0.940 -7.018
202 HA SER 27 HA SER 27 12.943 -1.225 -4.141
203 HB2 SER 27 2HB SER 27 15.350 -1.092 -4.469
204 HB3 SER 27 3HB SER 27 15.110 0.493 -5.281
205 HG SER 27 HG SER 27 15.647 0.559 -2.965
206 H ILE 28 H ILE 28 12.119 0.591 -3.111
207 HA ILE 28 HA ILE 28 10.314 1.984 -4.982
208 HB ILE 28 HB ILE 28 9.982 1.511 -2.007
209 HG12 ILE 28 2HG1 ILE 28 8.595 0.023 -4.282
210 HG13 ILE 28 3HG1 ILE 28 9.997 -0.614 -3.426
211 HG21 ILE 28 1HG2 ILE 28 8.004 2.468 -4.142
212 HG22 ILE 28 2HG2 ILE 28 7.618 2.119 -2.455
213 HG23 ILE 28 3HG2 ILE 28 8.683 3.467 -2.842
214 HD11 ILE 28 3HD1 ILE 28 8.069 -1.609 -2.462
215 HD12 ILE 28 1HD1 ILE 28 8.765 -0.499 -1.275
216 HD13 ILE 28 2HD1 ILE 28 7.297 -0.046 -2.172
217 HA PRO 29 HA PRO 29 12.672 5.681 -3.918
218 HB2 PRO 29 2HB PRO 29 11.518 7.499 -5.575
219 HB3 PRO 29 3HB PRO 29 12.505 6.144 -6.200
220 HG2 PRO 29 2HG PRO 29 9.480 6.265 -5.926
221 HG3 PRO 29 3HG PRO 29 10.430 5.830 -7.375
222 HD2 PRO 29 2HD PRO 29 9.423 3.944 -5.686
223 HD3 PRO 29 3HD PRO 29 11.019 3.726 -6.464
224 H LYS 30 H LYS 30 12.429 7.719 -2.864
225 HA LYS 30 HA LYS 30 10.020 8.098 -1.232
226 HB2 LYS 30 2HB LYS 30 11.129 9.903 -0.188
227 HB3 LYS 30 3HB LYS 30 12.214 8.527 -0.281
228 HG2 LYS 30 2HG LYS 30 13.469 9.541 -2.104
229 HG3 LYS 30 3HG LYS 30 12.342 10.907 -2.190
230 HD2 LYS 30 2HD LYS 30 13.942 10.201 0.305
231 HD3 LYS 30 3HD LYS 30 14.524 11.328 -0.922
232 HE2 LYS 30 2HE LYS 30 12.893 12.940 -0.470
233 HE3 LYS 30 3HE LYS 30 11.781 11.786 0.266
234 HZ1 LYS 30 3HZ LYS 30 12.903 13.231 1.903
235 HZ2 LYS 30 1HZ LYS 30 13.143 11.643 2.189
236 HZ3 LYS 30 2HZ LYS 30 14.347 12.561 1.532
237 H ASP 31 H ASP 31 8.990 10.238 -1.098
238 HA ASP 31 HA ASP 31 7.423 11.576 -1.987
239 HB2 ASP 31 2HB ASP 31 9.458 12.913 -2.484
240 HB3 ASP 31 3HB ASP 31 9.465 12.260 -4.121
241 H SER 32 H SER 32 7.084 8.970 -2.536
242 HA SER 32 HA SER 32 5.405 8.957 -4.957
243 HB2 SER 32 2HB SER 32 7.797 7.964 -5.389
244 HB3 SER 32 3HB SER 32 7.228 6.600 -4.404
245 HG SER 32 HG SER 32 6.699 6.185 -6.549
246 H LEU 33 H LEU 33 4.029 6.872 -4.947
247 HA LEU 33 HA LEU 33 2.973 6.590 -2.177
248 HB2 LEU 33 2HB LEU 33 1.474 7.558 -3.906
249 HB3 LEU 33 3HB LEU 33 1.641 6.076 -4.851
250 HG LEU 33 HG LEU 33 0.659 4.806 -2.882
251 HD11 LEU 33 1HD1 LEU 33 -0.049 7.600 -1.895
252 HD12 LEU 33 2HD1 LEU 33 -0.694 6.076 -1.261
253 HD13 LEU 33 3HD1 LEU 33 1.019 6.451 -1.071
254 HD21 LEU 33 3HD2 LEU 33 -1.088 7.019 -4.009
255 HD22 LEU 33 1HD2 LEU 33 -0.672 5.503 -4.862
256 HD23 LEU 33 2HD2 LEU 33 -1.633 5.447 -3.372
257 H ARG 34 H ARG 34 3.002 4.703 -1.132
258 HA ARG 34 HA ARG 34 3.485 2.159 -2.565
259 HB2 ARG 34 2HB ARG 34 5.352 1.525 -1.230
260 HB3 ARG 34 3HB ARG 34 5.685 3.050 -2.049
261 HG2 ARG 34 2HG ARG 34 5.319 4.281 0.070
262 HG3 ARG 34 3HG ARG 34 4.986 2.743 0.904
263 HD2 ARG 34 2HD ARG 34 7.247 1.922 0.322
264 HD3 ARG 34 3HD ARG 34 7.563 3.421 -0.572
265 HE ARG 34 HE ARG 34 6.887 3.808 2.269
266 HH11 ARG 34 1HH2 ARG 34 9.612 3.494 0.044
267 HH12 ARG 34 2HH2 ARG 34 10.656 4.339 1.163
268 HH21 ARG 34 1HH1 ARG 34 8.222 4.661 3.568
269 HH22 ARG 34 2HH1 ARG 34 9.959 4.759 3.230
270 H MET 35 H MET 35 3.172 0.313 -1.316
271 HA MET 35 HA MET 35 1.376 0.577 1.015
272 HB2 MET 35 2HB MET 35 0.836 -0.999 -1.542
273 HB3 MET 35 3HB MET 35 -0.005 -1.315 -0.014
274 HG2 MET 35 2HG MET 35 -0.782 1.013 0.050
275 HG3 MET 35 3HG MET 35 -0.004 1.328 -1.506
276 HE1 MET 35 3HE MET 35 -3.901 -1.021 -0.727
277 HE2 MET 35 1HE MET 35 -2.343 -1.695 -0.183
278 HE3 MET 35 2HE MET 35 -2.921 -0.144 0.473
279 H ALA 36 H ALA 36 1.116 -1.467 2.191
280 HA ALA 36 HA ALA 36 3.272 -3.410 1.766
281 HB1 ALA 36 1HB ALA 36 3.325 -2.788 4.591
282 HB2 ALA 36 2HB ALA 36 4.639 -2.763 3.409
283 HB3 ALA 36 3HB ALA 36 3.641 -1.320 3.645
284 H ILE 37 H ILE 37 3.080 -5.330 3.161
285 HA ILE 37 HA ILE 37 0.298 -5.799 4.140
286 HB ILE 37 HB ILE 37 1.883 -7.219 2.098
287 HG12 ILE 37 2HG1 ILE 37 -1.062 -7.332 2.878
288 HG13 ILE 37 3HG1 ILE 37 -0.349 -6.023 1.938
289 HG21 ILE 37 1HG2 ILE 37 0.420 -8.918 4.143
290 HG22 ILE 37 2HG2 ILE 37 1.111 -9.453 2.578
291 HG23 ILE 37 3HG2 ILE 37 2.180 -8.889 3.853
292 HD11 ILE 37 3HD1 ILE 37 -0.462 -8.930 1.069
293 HD12 ILE 37 1HD1 ILE 37 -1.418 -7.578 0.427
294 HD13 ILE 37 2HD1 ILE 37 0.337 -7.614 0.177
295 H MET 38 H MET 38 -0.008 -6.848 5.982
296 HA MET 38 HA MET 38 2.384 -7.043 7.701
297 HB2 MET 38 2HB MET 38 -0.567 -7.055 8.351
298 HB3 MET 38 3HB MET 38 0.722 -6.880 9.537
299 HG2 MET 38 2HG MET 38 0.474 -4.829 7.323
300 HG3 MET 38 3HG MET 38 -0.682 -4.829 8.622
301 HE1 MET 38 3HE MET 38 3.178 -5.820 9.206
302 HE2 MET 38 1HE MET 38 2.970 -4.907 7.700
303 HE3 MET 38 2HE MET 38 3.856 -4.182 9.078
304 H VAL 39 H VAL 39 3.363 -8.926 7.544
305 HA VAL 39 HA VAL 39 1.719 -11.401 8.011
306 HB VAL 39 HB VAL 39 2.659 -11.381 5.790
307 HG11 VAL 39 1HG1 VAL 39 5.412 -11.361 7.089
308 HG12 VAL 39 2HG1 VAL 39 5.040 -11.588 5.368
309 HG13 VAL 39 3HG1 VAL 39 4.697 -10.034 6.142
310 HG21 VAL 39 3HG2 VAL 39 4.056 -13.475 7.473
311 HG22 VAL 39 1HG2 VAL 39 2.345 -13.525 6.977
312 HG23 VAL 39 2HG2 VAL 39 3.627 -13.566 5.760
313 H GLN 40 H GLN 40 2.323 -12.867 9.498
314 HA GLN 40 HA GLN 40 4.003 -12.034 11.715
315 HB2 GLN 40 2HB GLN 40 3.529 -14.388 12.515
316 HB3 GLN 40 3HB GLN 40 2.145 -13.317 12.306
317 HG2 GLN 40 2HG GLN 40 1.519 -14.405 10.207
318 HG3 GLN 40 3HG GLN 40 2.973 -15.401 10.234
319 HE21 GLN 40 2HE2 GLN 40 -0.122 -14.790 11.994
320 HE22 GLN 40 1HE2 GLN 40 -0.174 -16.398 12.701
321 H SER 41 H SER 41 6.130 -12.343 12.028
322 HA SER 41 HA SER 41 7.651 -13.517 9.817
323 HB2 SER 41 2HB SER 41 8.229 -11.309 10.674
324 HB3 SER 41 3HB SER 41 8.585 -12.023 12.257
325 HG SER 41 HG SER 41 9.999 -12.194 9.836
326 HA PRO 42 HA PRO 42 8.951 -17.091 12.133
327 HB2 PRO 42 2HB PRO 42 10.910 -17.404 9.874
328 HB3 PRO 42 3HB PRO 42 9.802 -18.619 10.574
329 HG2 PRO 42 2HG PRO 42 9.256 -17.446 8.178
330 HG3 PRO 42 3HG PRO 42 7.947 -17.741 9.370
331 HD2 PRO 42 2HD PRO 42 9.467 -15.159 8.864
332 HD3 PRO 42 3HD PRO 42 7.705 -15.431 9.032
333 H MET 43 H MET 43 10.825 -14.341 11.230
334 HA MET 43 HA MET 43 13.221 -15.196 12.814
335 HB2 MET 43 2HB MET 43 12.906 -13.305 10.480
336 HB3 MET 43 3HB MET 43 14.380 -13.415 11.436
337 HG2 MET 43 2HG MET 43 14.981 -15.462 10.648
338 HG3 MET 43 3HG MET 43 13.330 -16.028 10.443
339 HE1 MET 43 3HE MET 43 11.804 -14.149 8.726
340 HE2 MET 43 1HE MET 43 12.146 -14.730 7.077
341 HE3 MET 43 2HE MET 43 11.908 -15.888 8.407
342 H PHE 44 H PHE 44 10.738 -12.732 12.569
343 HA PHE 44 HA PHE 44 12.005 -11.112 14.738
344 HB2 PHE 44 2HB PHE 44 11.820 -9.867 12.704
345 HB3 PHE 44 3HB PHE 44 10.155 -10.354 12.466
346 HD1 PHE 44 HD2 PHE 44 12.378 -8.324 14.693
347 HD2 PHE 44 HD1 PHE 44 8.343 -9.134 13.403
348 HE1 PHE 44 HE2 PHE 44 11.581 -6.300 15.896
349 HE2 PHE 44 HE1 PHE 44 7.562 -7.083 14.545
350 HZ PHE 44 HZ PHE 44 9.173 -5.673 15.822
351 H ASP 45 H ASP 45 10.653 -10.210 16.332
352 HA ASP 45 HA ASP 45 8.796 -12.234 17.362
353 HB2 ASP 45 2HB ASP 45 10.756 -11.410 18.642
354 HB3 ASP 45 3HB ASP 45 10.024 -9.807 18.709
355 H GLY 46 H GLY 46 7.367 -11.324 15.424
356 HA2 GLY 46 2HA GLY 46 4.926 -10.464 16.244
357 HA3 GLY 46 3HA GLY 46 5.806 -8.946 16.044
358 H LYS 47 H LYS 47 4.475 -8.297 14.388
359 HA LYS 47 HA LYS 47 4.413 -9.801 11.830
360 HB2 LYS 47 2HB LYS 47 2.921 -7.317 12.713
361 HB3 LYS 47 3HB LYS 47 2.644 -8.194 11.222
362 HG2 LYS 47 2HG LYS 47 2.386 -9.826 13.739
363 HG3 LYS 47 3HG LYS 47 1.237 -8.511 13.591
364 HD2 LYS 47 2HD LYS 47 1.652 -10.750 11.586
365 HD3 LYS 47 3HD LYS 47 0.348 -10.660 12.760
366 HE2 LYS 47 2HE LYS 47 0.810 -8.698 10.477
367 HE3 LYS 47 3HE LYS 47 -0.331 -10.038 10.444
368 HZ1 LYS 47 3HZ LYS 47 -0.504 -7.703 12.301
369 HZ2 LYS 47 1HZ LYS 47 -1.458 -7.969 11.008
370 HZ3 LYS 47 2HZ LYS 47 -1.531 -8.982 12.292
371 H VAL 48 H VAL 48 5.184 -8.943 9.927
372 HA VAL 48 HA VAL 48 6.796 -6.439 10.083
373 HB VAL 48 HB VAL 48 8.417 -7.417 8.536
374 HG11 VAL 48 1HG1 VAL 48 8.124 -9.013 11.113
375 HG12 VAL 48 2HG1 VAL 48 9.619 -8.759 10.192
376 HG13 VAL 48 3HG1 VAL 48 8.827 -7.387 10.985
377 HG21 VAL 48 3HG2 VAL 48 7.047 -10.088 9.070
378 HG22 VAL 48 1HG2 VAL 48 7.107 -9.239 7.513
379 HG23 VAL 48 2HG2 VAL 48 8.597 -9.853 8.240
380 HA PRO 49 HA PRO 49 4.576 -5.416 6.392
381 HB2 PRO 49 2HB PRO 49 5.839 -3.146 5.575
382 HB3 PRO 49 3HB PRO 49 4.891 -3.222 7.090
383 HG2 PRO 49 2HG PRO 49 7.895 -3.484 6.751
384 HG3 PRO 49 3HG PRO 49 6.995 -2.493 7.940
385 HD2 PRO 49 2HD PRO 49 8.022 -4.989 8.506
386 HD3 PRO 49 3HD PRO 49 6.539 -4.351 9.276
387 H HIS 50 H HIS 50 4.585 -6.380 4.462
388 HA HIS 50 HA HIS 50 7.088 -6.638 2.837
389 HB2 HIS 50 2HB HIS 50 4.343 -7.939 2.776
390 HB3 HIS 50 3HB HIS 50 5.392 -7.965 1.370
391 HD2 HIS 50 HD2 HIS 50 6.771 -8.391 4.952
392 HE1 HIS 50 HE1 HIS 50 7.170 -12.162 3.011
393 HE2 HIS 50 HE2 HIS 50 7.774 -10.830 5.094
394 H TRP 51 H TRP 51 7.495 -4.674 1.956
395 HA TRP 51 HA TRP 51 5.380 -2.852 1.200
396 HB2 TRP 51 2HB TRP 51 8.368 -2.711 0.720
397 HB3 TRP 51 3HB TRP 51 7.213 -1.410 0.460
398 HD1 TRP 51 HD1 TRP 51 9.203 -3.115 3.152
399 HE1 TRP 51 HE1 TRP 51 8.930 -1.887 5.382
400 HE3 TRP 51 HE3 TRP 51 5.423 0.119 1.850
401 HZ2 TRP 51 HZ2 TRP 51 7.182 0.090 6.522
402 HZ3 TRP 51 HZ3 TRP 51 4.405 1.595 3.604
403 HH2 TRP 51 HH2 TRP 51 5.306 1.604 5.907
404 H TYR 52 H TYR 52 4.831 -2.116 -0.856
405 HA TYR 52 HA TYR 52 6.295 -3.038 -3.207
406 HB2 TYR 52 2HB TYR 52 3.374 -3.346 -3.580
407 HB3 TYR 52 3HB TYR 52 4.762 -4.197 -4.270
408 HD1 TYR 52 HD1 TYR 52 2.901 -4.077 -0.957
409 HD2 TYR 52 HD2 TYR 52 4.919 -6.403 -3.965
410 HE1 TYR 52 HE1 TYR 52 2.226 -6.190 0.208
411 HE2 TYR 52 HE2 TYR 52 4.215 -8.500 -2.820
412 HH TYR 52 HH TYR 52 2.333 -8.485 0.207
413 H HIS 53 H HIS 53 5.754 -1.745 -5.115
414 HA HIS 53 HA HIS 53 5.028 1.032 -4.720
415 HB2 HIS 53 2HB HIS 53 4.697 -0.649 -7.239
416 HB3 HIS 53 3HB HIS 53 4.647 1.089 -7.153
417 HD2 HIS 53 HD2 HIS 53 6.969 2.407 -6.545
418 HE1 HIS 53 HE1 HIS 53 9.481 -0.618 -8.184
419 HE2 HIS 53 HE2 HIS 53 9.356 1.821 -7.499
420 H PHE 54 H PHE 54 2.970 2.122 -5.300
421 HA PHE 54 HA PHE 54 0.688 1.054 -4.156
422 HB2 PHE 54 2HB PHE 54 0.726 3.364 -4.625
423 HB3 PHE 54 3HB PHE 54 1.005 3.119 -6.343
424 HD1 PHE 54 HD1 PHE 54 -1.606 2.521 -3.662
425 HD2 PHE 54 HD2 PHE 54 -0.794 2.996 -7.875
426 HE1 PHE 54 HE1 PHE 54 -4.032 2.400 -4.155
427 HE2 PHE 54 HE2 PHE 54 -3.229 2.911 -8.347
428 HZ PHE 54 HZ PHE 54 -4.844 2.602 -6.491
429 H SER 55 H SER 55 1.462 0.845 -7.703
430 HA SER 55 HA SER 55 -0.996 -0.578 -8.311
431 HB2 SER 55 2HB SER 55 1.519 -0.200 -9.968
432 HB3 SER 55 3HB SER 55 -0.040 -0.807 -10.554
433 HG SER 55 HG SER 55 -0.970 1.203 -9.951
434 H CYS 56 HN CYS 56 2.327 -1.522 -7.503
435 HA CYS 56 HA CYS 56 2.187 -4.190 -8.377
436 HB2 CYS 56 2HB CYS 56 3.886 -2.802 -6.308
437 HB3 CYS 56 3HB CYS 56 4.109 -4.484 -6.764
438 H PHE 57 H PHE 57 1.202 -2.766 -5.297
439 HA PHE 57 HA PHE 57 0.595 -5.043 -3.739
440 HB2 PHE 57 2HB PHE 57 0.456 -2.744 -2.959
441 HB3 PHE 57 3HB PHE 57 -0.910 -2.425 -4.022
442 HD1 PHE 57 HD2 PHE 57 -3.098 -3.670 -3.676
443 HD2 PHE 57 HD1 PHE 57 0.113 -3.767 -0.798
444 HE1 PHE 57 HE2 PHE 57 -4.659 -4.550 -1.980
445 HE2 PHE 57 HE1 PHE 57 -1.495 -4.510 0.939
446 HZ PHE 57 HZ PHE 57 -3.868 -4.962 0.339
447 H TRP 58 H TRP 58 -1.497 -3.403 -6.176
448 HA TRP 58 HA TRP 58 -3.585 -5.388 -5.945
449 HB2 TRP 58 2HB TRP 58 -3.217 -3.348 -8.148
450 HB3 TRP 58 3HB TRP 58 -4.695 -4.160 -7.648
451 HD1 TRP 58 HD1 TRP 58 -2.586 -1.179 -6.999
452 HE1 TRP 58 HE1 TRP 58 -3.416 0.242 -5.057
453 HE3 TRP 58 HE3 TRP 58 -6.275 -4.293 -5.246
454 HZ2 TRP 58 HZ2 TRP 58 -5.453 0.066 -2.982
455 HZ3 TRP 58 HZ3 TRP 58 -7.637 -3.621 -3.310
456 HH2 TRP 58 HH2 TRP 58 -7.219 -1.448 -2.166
457 H LYS 59 H LYS 59 -0.759 -5.087 -8.062
458 HA LYS 59 HA LYS 59 -1.505 -7.251 -9.865
459 HB2 LYS 59 2HB LYS 59 1.193 -6.061 -9.153
460 HB3 LYS 59 3HB LYS 59 0.970 -7.334 -10.349
461 HG2 LYS 59 2HG LYS 59 -0.520 -5.896 -11.684
462 HG3 LYS 59 3HG LYS 59 -0.305 -4.575 -10.537
463 HD2 LYS 59 2HD LYS 59 1.902 -5.847 -12.226
464 HD3 LYS 59 3HD LYS 59 1.112 -4.288 -12.535
465 HE2 LYS 59 2HE LYS 59 1.899 -3.481 -10.299
466 HE3 LYS 59 3HE LYS 59 2.750 -5.010 -10.067
467 HZ1 LYS 59 3HZ LYS 59 4.137 -4.462 -11.981
468 HZ2 LYS 59 1HZ LYS 59 3.377 -3.019 -12.164
469 HZ3 LYS 59 2HZ LYS 59 4.231 -3.334 -10.792
470 H VAL 60 H VAL 60 -0.276 -7.301 -6.543
471 HA VAL 60 HA VAL 60 0.441 -10.119 -6.582
472 HB VAL 60 HB VAL 60 -0.760 -8.668 -4.208
473 HG11 VAL 60 1HG1 VAL 60 1.169 -11.025 -4.410
474 HG12 VAL 60 2HG1 VAL 60 0.695 -10.224 -2.900
475 HG13 VAL 60 3HG1 VAL 60 -0.511 -11.089 -3.836
476 HG21 VAL 60 3HG2 VAL 60 1.572 -8.208 -3.494
477 HG22 VAL 60 1HG2 VAL 60 2.155 -8.732 -5.092
478 HG23 VAL 60 2HG2 VAL 60 1.109 -7.304 -4.909
479 H GLY 61 H GLY 61 -2.650 -8.507 -6.758
480 HA2 GLY 61 2HA GLY 61 -4.670 -9.515 -7.360
481 HA3 GLY 61 3HA GLY 61 -4.096 -11.091 -6.814
482 H HIS 62 H HIS 62 -3.545 -8.612 -4.477
483 HA HIS 62 HA HIS 62 -5.628 -9.582 -2.671
484 HB2 HIS 62 2HB HIS 62 -3.498 -7.444 -2.520
485 HB3 HIS 62 3HB HIS 62 -4.842 -7.422 -1.385
486 HD2 HIS 62 HD2 HIS 62 -1.802 -9.599 -2.320
487 HE1 HIS 62 HE1 HIS 62 -3.340 -11.118 1.354
488 HE2 HIS 62 HE2 HIS 62 -1.441 -11.294 -0.334
489 H SER 63 H SER 63 -7.390 -8.497 -1.889
490 HA SER 63 HA SER 63 -8.343 -6.035 -3.224
491 HB2 SER 63 2HB SER 63 -9.322 -7.965 -4.481
492 HB3 SER 63 3HB SER 63 -10.067 -8.525 -2.967
493 HG SER 63 HG SER 63 -11.489 -7.203 -4.212
494 H ILE 64 H ILE 64 -9.503 -4.728 -1.846
495 HA ILE 64 HA ILE 64 -9.209 -5.533 1.015
496 HB ILE 64 HB ILE 64 -8.935 -2.763 -0.176
497 HG12 ILE 64 2HG1 ILE 64 -6.759 -4.762 0.579
498 HG13 ILE 64 3HG1 ILE 64 -7.106 -4.128 -1.027
499 HG21 ILE 64 1HG2 ILE 64 -8.190 -3.845 2.577
500 HG22 ILE 64 2HG2 ILE 64 -8.003 -2.181 1.998
501 HG23 ILE 64 3HG2 ILE 64 -9.622 -2.848 2.219
502 HD11 ILE 64 3HD1 ILE 64 -6.640 -1.776 0.016
503 HD12 ILE 64 1HD1 ILE 64 -5.824 -2.716 1.295
504 HD13 ILE 64 2HD1 ILE 64 -5.289 -2.836 -0.382
505 H ARG 65 H ARG 65 -10.983 -5.725 2.098
506 HA ARG 65 HA ARG 65 -13.532 -5.025 0.850
507 HB2 ARG 65 2HB ARG 65 -14.388 -6.374 2.943
508 HB3 ARG 65 3HB ARG 65 -13.719 -7.171 1.537
509 HG2 ARG 65 2HG ARG 65 -11.920 -6.534 3.891
510 HG3 ARG 65 3HG ARG 65 -13.034 -7.886 3.990
511 HD2 ARG 65 2HD ARG 65 -11.023 -7.598 1.718
512 HD3 ARG 65 3HD ARG 65 -10.695 -8.475 3.217
513 HE ARG 65 HE ARG 65 -12.946 -9.706 2.498
514 HH11 ARG 65 1HH2 ARG 65 -10.227 -8.943 0.350
515 HH12 ARG 65 2HH2 ARG 65 -10.507 -10.387 -0.579
516 HH21 ARG 65 1HH1 ARG 65 -13.231 -11.454 1.195
517 HH22 ARG 65 2HH1 ARG 65 -12.163 -11.731 -0.148
518 H HIS 66 H HIS 66 -11.732 -3.793 3.475
519 HA HIS 66 HA HIS 66 -13.643 -1.598 3.913
520 HB2 HIS 66 2HB HIS 66 -13.398 -1.945 6.458
521 HB3 HIS 66 3HB HIS 66 -14.591 -2.835 5.547
522 HD2 HIS 66 HD2 HIS 66 -10.956 -4.185 5.630
523 HE1 HIS 66 HE1 HIS 66 -13.379 -6.809 7.958
524 HE2 HIS 66 HE2 HIS 66 -11.068 -6.459 6.954
525 HA PRO 67 HA PRO 67 -9.178 -0.953 3.458
526 HB2 PRO 67 2HB PRO 67 -9.175 1.329 1.850
527 HB3 PRO 67 3HB PRO 67 -9.382 -0.338 1.238
528 HG2 PRO 67 2HG PRO 67 -11.555 1.642 1.988
529 HG3 PRO 67 3HG PRO 67 -11.406 0.694 0.467
530 HD2 PRO 67 2HD PRO 67 -13.007 -0.134 2.444
531 HD3 PRO 67 3HD PRO 67 -11.958 -1.328 1.616
532 H ASP 68 H ASP 68 -11.357 1.707 4.452
533 HA ASP 68 HA ASP 68 -9.164 3.184 5.664
534 HB2 ASP 68 2HB ASP 68 -10.905 4.645 6.572
535 HB3 ASP 68 3HB ASP 68 -11.054 4.394 4.839
536 H VAL 69 H VAL 69 -10.676 0.329 6.574
537 HA VAL 69 HA VAL 69 -10.250 0.703 9.488
538 HB VAL 69 HB VAL 69 -11.444 -1.698 8.057
539 HG11 VAL 69 1HG1 VAL 69 -11.486 -0.847 10.980
540 HG12 VAL 69 2HG1 VAL 69 -12.351 -2.238 10.288
541 HG13 VAL 69 3HG1 VAL 69 -10.587 -2.222 10.295
542 HG21 VAL 69 3HG2 VAL 69 -12.862 0.653 9.381
543 HG22 VAL 69 1HG2 VAL 69 -12.918 0.219 7.657
544 HG23 VAL 69 2HG2 VAL 69 -13.644 -0.856 8.853
545 H GLU 70 H GLU 70 -9.203 -1.310 6.716
546 HA GLU 70 HA GLU 70 -7.154 -2.605 8.453
547 HB2 GLU 70 2HB GLU 70 -8.487 -3.355 5.843
548 HB3 GLU 70 3HB GLU 70 -6.995 -4.139 6.339
549 HG2 GLU 70 2HG GLU 70 -9.542 -4.073 7.992
550 HG3 GLU 70 3HG GLU 70 -8.991 -5.422 6.989
551 H VAL 71 H VAL 71 -7.165 -0.356 5.751
552 HA VAL 71 HA VAL 71 -4.247 -0.712 5.278
553 HB VAL 71 HB VAL 71 -6.014 1.409 4.097
554 HG11 VAL 71 1HG1 VAL 71 -3.340 0.142 3.345
555 HG12 VAL 71 2HG1 VAL 71 -4.186 1.476 2.511
556 HG13 VAL 71 3HG1 VAL 71 -3.533 1.709 4.153
557 HG21 VAL 71 3HG2 VAL 71 -5.230 -1.378 3.105
558 HG22 VAL 71 1HG2 VAL 71 -6.874 -0.829 3.443
559 HG23 VAL 71 2HG2 VAL 71 -5.979 -0.110 2.096
560 H ASP 72 H ASP 72 -3.255 -0.340 7.125
561 HA ASP 72 HA ASP 72 -3.515 1.946 8.830
562 HB2 ASP 72 2HB ASP 72 -2.350 -0.151 9.363
563 HB3 ASP 72 3HB ASP 72 -1.129 0.184 8.136
564 H GLY 73 H GLY 73 -2.647 3.994 8.674
565 HA2 GLY 73 2HA GLY 73 -1.432 5.795 7.828
566 HA3 GLY 73 3HA GLY 73 -0.713 4.751 6.603
567 H PHE 74 H PHE 74 -4.047 4.295 6.349
568 HA PHE 74 HA PHE 74 -4.462 5.830 3.996
569 HB2 PHE 74 2HB PHE 74 -5.833 3.930 4.746
570 HB3 PHE 74 3HB PHE 74 -6.431 4.866 6.111
571 HD1 PHE 74 HD2 PHE 74 -6.379 4.633 2.383
572 HD2 PHE 74 HD1 PHE 74 -8.325 6.328 5.842
573 HE1 PHE 74 HE2 PHE 74 -8.257 5.411 0.954
574 HE2 PHE 74 HE1 PHE 74 -10.207 7.089 4.402
575 HZ PHE 74 HZ PHE 74 -10.168 6.635 1.966
576 H SER 75 H SER 75 -4.830 6.753 7.402
577 HA SER 75 HA SER 75 -5.928 9.379 6.951
578 HB2 SER 75 2HB SER 75 -4.388 8.324 9.347
579 HB3 SER 75 3HB SER 75 -5.449 9.745 9.306
580 HG SER 75 HG SER 75 -6.525 7.893 10.134
581 H GLU 76 H GLU 76 -2.727 8.239 6.400
582 HA GLU 76 HA GLU 76 -1.418 10.860 6.880
583 HB2 GLU 76 2HB GLU 76 -0.296 8.231 5.837
584 HB3 GLU 76 3HB GLU 76 0.630 9.686 6.173
585 HG2 GLU 76 2HG GLU 76 0.193 9.556 8.536
586 HG3 GLU 76 3HG GLU 76 -1.002 8.279 8.320
587 H LEU 77 H LEU 77 -3.152 9.336 4.382
588 HA LEU 77 HA LEU 77 -1.820 10.636 2.110
589 HB2 LEU 77 2HB LEU 77 -4.461 9.154 2.331
590 HB3 LEU 77 3HB LEU 77 -3.710 9.675 0.832
591 HG LEU 77 HG LEU 77 -2.571 7.583 2.740
592 HD11 LEU 77 1HD1 LEU 77 -3.190 6.035 0.889
593 HD12 LEU 77 2HD1 LEU 77 -4.608 6.853 1.562
594 HD13 LEU 77 3HD1 LEU 77 -3.926 7.382 0.010
595 HD21 LEU 77 3HD2 LEU 77 -0.769 8.754 1.513
596 HD22 LEU 77 1HD2 LEU 77 -0.976 7.099 0.947
597 HD23 LEU 77 2HD2 LEU 77 -1.619 8.446 -0.018
598 H ARG 78 H ARG 78 -2.909 12.110 0.674
599 HA ARG 78 HA ARG 78 -4.743 14.057 1.945
600 HB2 ARG 78 2HB ARG 78 -3.386 13.893 -0.780
601 HB3 ARG 78 3HB ARG 78 -4.692 15.025 -0.503
602 HG2 ARG 78 2HG ARG 78 -2.158 14.959 1.189
603 HG3 ARG 78 3HG ARG 78 -2.422 16.012 -0.211
604 HD2 ARG 78 2HD ARG 78 -4.454 16.955 0.902
605 HD3 ARG 78 3HD ARG 78 -4.099 15.989 2.340
606 HE ARG 78 HE ARG 78 -1.759 17.463 1.712
607 HH11 ARG 78 1HH2 ARG 78 -4.993 18.187 2.859
608 HH12 ARG 78 2HH2 ARG 78 -4.473 19.633 3.680
609 HH21 ARG 78 1HH1 ARG 78 -1.170 19.318 2.780
610 HH22 ARG 78 2HH1 ARG 78 -2.365 20.250 3.632
611 H TRP 79 H TRP 79 -6.699 14.693 0.939
612 HA TRP 79 HA TRP 79 -8.548 12.652 0.970
613 HB2 TRP 79 2HB TRP 79 -9.614 14.569 1.394
614 HB3 TRP 79 3HB TRP 79 -8.549 15.525 0.386
615 HD1 TRP 79 HD1 TRP 79 -11.906 13.751 0.262
616 HE1 TRP 79 HE1 TRP 79 -13.135 14.411 -1.897
617 HE3 TRP 79 HE3 TRP 79 -8.121 16.270 -2.057
618 HZ2 TRP 79 HZ2 TRP 79 -12.515 15.808 -4.365
619 HZ3 TRP 79 HZ3 TRP 79 -8.439 17.239 -4.319
620 HH2 TRP 79 HH2 TRP 79 -10.633 17.019 -5.484
621 H ASP 80 H ASP 80 -7.005 13.990 -1.969
622 HA ASP 80 HA ASP 80 -8.694 12.632 -3.840
623 HB2 ASP 80 2HB ASP 80 -7.303 14.641 -4.318
624 HB3 ASP 80 3HB ASP 80 -5.849 13.660 -4.159
625 H ASP 81 H ASP 81 -5.792 11.503 -2.121
626 HA ASP 81 HA ASP 81 -5.658 9.088 -3.792
627 HB2 ASP 81 2HB ASP 81 -3.935 10.010 -1.495
628 HB3 ASP 81 3HB ASP 81 -3.838 8.406 -2.240
629 H GLN 82 H GLN 82 -6.831 10.152 -0.579
630 HA GLN 82 HA GLN 82 -7.715 7.571 0.287
631 HB2 GLN 82 2HB GLN 82 -8.836 10.357 0.744
632 HB3 GLN 82 3HB GLN 82 -9.518 8.915 1.485
633 HG2 GLN 82 2HG GLN 82 -7.367 8.400 2.560
634 HG3 GLN 82 3HG GLN 82 -6.622 9.809 1.806
635 HE21 GLN 82 2HE2 GLN 82 -6.549 9.495 4.562
636 HE22 GLN 82 1HE2 GLN 82 -7.564 10.754 5.282
637 H GLN 83 H GLN 83 -9.173 9.876 -2.075
638 HA GLN 83 HA GLN 83 -11.501 8.223 -2.530
639 HB2 GLN 83 2HB GLN 83 -10.256 10.160 -4.518
640 HB3 GLN 83 3HB GLN 83 -11.856 9.454 -4.570
641 HG2 GLN 83 2HG GLN 83 -10.863 11.744 -2.952
642 HG3 GLN 83 3HG GLN 83 -12.344 11.562 -3.845
643 HE21 GLN 83 2HE2 GLN 83 -10.859 11.279 -0.741
644 HE22 GLN 83 1HE2 GLN 83 -12.295 10.703 0.124
645 H LYS 84 H LYS 84 -8.233 8.237 -4.121
646 HA LYS 84 HA LYS 84 -9.146 6.414 -6.172
647 HB2 LYS 84 2HB LYS 84 -7.159 6.775 -7.222
648 HB3 LYS 84 3HB LYS 84 -7.433 8.298 -6.384
649 HG2 LYS 84 2HG LYS 84 -5.263 8.088 -5.961
650 HG3 LYS 84 3HG LYS 84 -5.840 7.173 -4.562
651 HD2 LYS 84 2HD LYS 84 -5.448 5.073 -5.679
652 HD3 LYS 84 3HD LYS 84 -5.051 5.885 -7.195
653 HE2 LYS 84 2HE LYS 84 -3.470 6.075 -4.597
654 HE3 LYS 84 3HE LYS 84 -3.041 5.080 -5.990
655 HZ1 LYS 84 3HZ LYS 84 -1.803 7.112 -6.076
656 HZ2 LYS 84 1HZ LYS 84 -2.863 7.175 -7.302
657 HZ3 LYS 84 2HZ LYS 84 -3.110 8.049 -5.894
658 H VAL 85 H VAL 85 -7.326 6.122 -3.145
659 HA VAL 85 HA VAL 85 -6.671 3.333 -3.589
660 HB VAL 85 HB VAL 85 -6.808 5.005 -1.047
661 HG11 VAL 85 1HG1 VAL 85 -7.059 2.674 -0.336
662 HG12 VAL 85 2HG1 VAL 85 -5.689 2.180 -1.363
663 HG13 VAL 85 3HG1 VAL 85 -5.432 3.240 0.037
664 HG21 VAL 85 3HG2 VAL 85 -4.395 3.945 -2.584
665 HG22 VAL 85 1HG2 VAL 85 -5.047 5.574 -2.803
666 HG23 VAL 85 2HG2 VAL 85 -4.394 5.088 -1.231
667 H LYS 86 H LYS 86 -9.459 4.953 -1.941
668 HA LYS 86 HA LYS 86 -10.768 2.416 -1.362
669 HB2 LYS 86 2HB LYS 86 -11.884 5.249 -1.502
670 HB3 LYS 86 3HB LYS 86 -12.812 3.809 -1.055
671 HG2 LYS 86 2HG LYS 86 -10.997 3.356 0.717
672 HG3 LYS 86 3HG LYS 86 -10.385 4.948 0.374
673 HD2 LYS 86 2HD LYS 86 -11.775 4.941 2.382
674 HD3 LYS 86 3HD LYS 86 -12.513 5.966 1.131
675 HE2 LYS 86 2HE LYS 86 -14.132 4.283 0.604
676 HE3 LYS 86 3HE LYS 86 -13.255 3.052 1.533
677 HZ1 LYS 86 3HZ LYS 86 -14.498 5.424 2.810
678 HZ2 LYS 86 1HZ LYS 86 -15.247 3.978 2.685
679 HZ3 LYS 86 2HZ LYS 86 -13.884 4.087 3.559
680 H LYS 87 H LYS 87 -11.073 4.688 -4.128
681 HA LYS 87 HA LYS 87 -13.019 3.203 -5.586
682 HB2 LYS 87 2HB LYS 87 -12.339 5.469 -6.130
683 HB3 LYS 87 3HB LYS 87 -10.762 4.885 -6.700
684 HG2 LYS 87 2HG LYS 87 -11.783 3.654 -8.509
685 HG3 LYS 87 3HG LYS 87 -13.408 3.855 -7.817
686 HD2 LYS 87 2HD LYS 87 -13.301 6.268 -8.169
687 HD3 LYS 87 3HD LYS 87 -11.660 6.125 -8.844
688 HE2 LYS 87 2HE LYS 87 -12.537 4.678 -10.664
689 HE3 LYS 87 3HE LYS 87 -14.165 4.794 -9.985
690 HZ1 LYS 87 3HZ LYS 87 -14.103 7.194 -10.410
691 HZ2 LYS 87 1HZ LYS 87 -12.596 7.091 -11.037
692 HZ3 LYS 87 2HZ LYS 87 -13.851 6.377 -11.798
693 H THR 88 H THR 88 -9.456 2.857 -5.576
694 HA THR 88 HA THR 88 -9.366 0.714 -7.450
695 HB THR 88 HB THR 88 -7.310 1.391 -5.326
696 HG1 THR 88 1HG THR 88 -7.676 3.135 -6.636
697 HG21 THR 88 1HG2 THR 88 -7.202 -0.091 -7.978
698 HG22 THR 88 2HG2 THR 88 -5.771 0.396 -7.043
699 HG23 THR 88 3HG2 THR 88 -6.904 -0.794 -6.377
700 H ALA 89 H ALA 89 -9.824 0.717 -3.917
701 HA ALA 89 HA ALA 89 -9.466 -2.112 -3.550
702 HB1 ALA 89 1HB ALA 89 -10.879 -0.000 -1.874
703 HB2 ALA 89 2HB ALA 89 -10.463 -1.638 -1.353
704 HB3 ALA 89 3HB ALA 89 -9.173 -0.484 -1.745
705 H GLU 90 H GLU 90 -12.345 -0.007 -4.184
706 HA GLU 90 HA GLU 90 -14.074 -2.359 -4.143
707 HB2 GLU 90 2HB GLU 90 -15.877 -0.996 -4.894
708 HB3 GLU 90 3HB GLU 90 -15.058 -0.255 -3.512
709 HG2 GLU 90 2HG GLU 90 -13.969 1.347 -5.017
710 HG3 GLU 90 3HG GLU 90 -14.706 0.580 -6.426
711 H ALA 91 H ALA 91 -12.333 -0.623 -6.648
712 HA ALA 91 HA ALA 91 -13.480 -1.997 -8.875
713 HB1 ALA 91 1HB ALA 91 -12.322 0.166 -9.060
714 HB2 ALA 91 2HB ALA 91 -10.805 -0.562 -8.504
715 HB3 ALA 91 3HB ALA 91 -11.498 -1.037 -10.071
716 H GLY 92 H GLY 92 -11.269 -3.122 -6.475
717 HA2 GLY 92 2HA GLY 92 -10.241 -5.163 -6.185
718 HA3 GLY 92 3HA GLY 92 -10.930 -5.733 -7.710
719 H GLY 93 H GLY 93 -8.899 -2.825 -7.399
720 HA2 GLY 93 2HA GLY 93 -6.541 -2.708 -7.801
721 HA3 GLY 93 3HA GLY 93 -6.617 -4.156 -8.800
722 H VAL 94 H VAL 94 -5.559 -1.494 -9.319
723 HA VAL 94 HA VAL 94 -6.599 -1.169 -12.040
724 HB VAL 94 HB VAL 94 -7.827 0.467 -10.402
725 HG11 VAL 94 1HG1 VAL 94 -5.302 2.113 -10.841
726 HG12 VAL 94 2HG1 VAL 94 -6.778 2.589 -9.980
727 HG13 VAL 94 3HG1 VAL 94 -5.724 1.339 -9.303
728 HG21 VAL 94 3HG2 VAL 94 -6.540 1.612 -12.910
729 HG22 VAL 94 1HG2 VAL 94 -7.972 0.554 -12.868
730 HG23 VAL 94 2HG2 VAL 94 -8.027 2.150 -12.108
731 H THR 95 H THR 95 -5.140 0.108 -13.399
732 HA THR 95 HA THR 95 -2.370 0.470 -12.344
733 HB THR 95 HB THR 95 -1.513 -0.166 -14.574
734 HG1 THR 95 1HG THR 95 -2.901 -1.299 -15.954
735 HG21 THR 95 1HG2 THR 95 -1.601 -1.812 -12.693
736 HG22 THR 95 2HG2 THR 95 -3.181 -2.369 -13.274
737 HG23 THR 95 3HG2 THR 95 -1.734 -2.579 -14.287
738 H GLY 96 H GLY 96 -1.101 2.086 -13.469
739 HA2 GLY 96 2HA GLY 96 -0.796 4.086 -14.631
740 HA3 GLY 96 3HA GLY 96 -2.497 4.078 -15.103
741 H LYS 97 H LYS 97 -2.782 3.694 -11.898
742 HA LYS 97 HA LYS 97 -3.098 6.609 -11.349
743 HB2 LYS 97 2HB LYS 97 -4.287 4.099 -10.136
744 HB3 LYS 97 3HB LYS 97 -4.366 5.643 -9.315
745 HG2 LYS 97 2HG LYS 97 -6.422 5.246 -10.475
746 HG3 LYS 97 3HG LYS 97 -5.609 6.670 -11.121
747 HD2 LYS 97 2HD LYS 97 -4.939 5.468 -13.121
748 HD3 LYS 97 3HD LYS 97 -5.507 3.926 -12.438
749 HE2 LYS 97 2HE LYS 97 -7.821 4.770 -12.431
750 HE3 LYS 97 3HE LYS 97 -7.272 6.339 -13.037
751 HZ1 LYS 97 3HZ LYS 97 -8.106 4.900 -14.830
752 HZ2 LYS 97 1HZ LYS 97 -6.531 5.245 -15.069
753 HZ3 LYS 97 2HZ LYS 97 -6.965 3.773 -14.513
754 H GLY 98 H GLY 98 -0.714 4.389 -10.804
755 HA2 GLY 98 2HA GLY 98 0.273 5.481 -8.226
756 HA3 GLY 98 3HA GLY 98 1.010 4.220 -9.212
757 H GLN 99 H GLN 99 3.029 5.280 -8.986
758 HA GLN 99 HA GLN 99 3.525 7.363 -11.031
759 HB2 GLN 99 2HB GLN 99 3.316 8.579 -8.907
760 HB3 GLN 99 3HB GLN 99 4.489 7.499 -8.149
761 HG2 GLN 99 2HG GLN 99 6.256 8.327 -9.680
762 HG3 GLN 99 3HG GLN 99 5.075 9.359 -10.500
763 HE21 GLN 99 2HE2 GLN 99 6.278 8.685 -7.141
764 HE22 GLN 99 1HE2 GLN 99 6.364 10.383 -6.685
765 H ASP 100 H ASP 100 5.450 7.107 -12.112
766 HA ASP 100 HA ASP 100 6.866 4.550 -11.779
767 HB2 ASP 100 2HB ASP 100 6.136 5.275 -13.997
768 HB3 ASP 100 3HB ASP 100 7.086 6.756 -13.854
769 H GLY 101 H GLY 101 8.933 4.250 -11.115
770 HA2 GLY 101 2HA GLY 101 11.141 5.849 -11.191
771 HA3 GLY 101 3HA GLY 101 10.365 6.373 -9.696
772 H ILE 102 H ILE 102 12.844 5.360 -9.497
773 HA ILE 102 HA ILE 102 12.438 2.793 -8.086
774 HB ILE 102 HB ILE 102 13.248 2.331 -10.391
775 HG12 ILE 102 2HG1 ILE 102 15.122 1.513 -8.143
776 HG13 ILE 102 3HG1 ILE 102 13.549 0.796 -8.498
777 HG21 ILE 102 1HG2 ILE 102 15.504 2.814 -11.084
778 HG22 ILE 102 2HG2 ILE 102 14.761 4.341 -10.611
779 HG23 ILE 102 3HG2 ILE 102 15.907 3.536 -9.515
780 HD11 ILE 102 3HD1 ILE 102 14.410 0.135 -10.764
781 HD12 ILE 102 1HD1 ILE 102 16.024 0.699 -10.263
782 HD13 ILE 102 2HD1 ILE 102 15.247 -0.639 -9.404
783 H GLY 103 H GLY 103 13.513 2.547 -6.236
784 HA2 GLY 103 2HA GLY 103 14.853 4.894 -5.062
785 HA3 GLY 103 3HA GLY 103 14.301 3.441 -4.232
786 H SER 104 H SER 104 16.126 2.259 -6.740
787 HA SER 104 HA SER 104 17.959 1.159 -4.923
788 HB2 SER 104 2HB SER 104 18.105 1.162 -7.959
789 HB3 SER 104 3HB SER 104 18.933 0.038 -6.864
790 HG SER 104 HG SER 104 17.032 -0.901 -7.603
791 H LYS 105 H LYS 105 18.410 4.081 -6.787
792 HA LYS 105 HA LYS 105 21.157 4.377 -5.738
793 HB2 LYS 105 2HB LYS 105 21.227 3.198 -8.020
794 HB3 LYS 105 3HB LYS 105 20.627 4.704 -8.722
795 HG2 LYS 105 2HG LYS 105 22.651 5.884 -7.831
796 HG3 LYS 105 3HG LYS 105 23.200 4.361 -7.106
797 HD2 LYS 105 2HD LYS 105 23.272 3.348 -9.405
798 HD3 LYS 105 3HD LYS 105 22.810 4.926 -10.079
799 HE2 LYS 105 2HE LYS 105 24.851 5.921 -8.962
800 HE3 LYS 105 3HE LYS 105 25.315 4.292 -8.449
801 HZ1 LYS 105 3HZ LYS 105 26.439 4.867 -10.500
802 HZ2 LYS 105 1HZ LYS 105 25.366 3.684 -10.848
803 HZ3 LYS 105 2HZ LYS 105 25.040 5.245 -11.254
804 H ALA 106 H ALA 106 21.863 6.465 -5.558
805 HA ALA 106 HA ALA 106 19.999 8.696 -6.260
806 HB1 ALA 106 1HB ALA 106 21.767 8.402 -3.795
807 HB2 ALA 106 2HB ALA 106 20.751 9.804 -4.199
808 HB3 ALA 106 3HB ALA 106 19.997 8.239 -3.843
809 H GLU 107 H GLU 107 21.352 8.277 -8.299
810 HA GLU 107 HA GLU 107 24.142 8.877 -8.321
811 HB2 GLU 107 2HB GLU 107 22.880 7.443 -9.927
812 HB3 GLU 107 3HB GLU 107 22.146 8.891 -10.622
813 HG2 GLU 107 2HG GLU 107 24.357 9.691 -11.351
814 HG3 GLU 107 3HG GLU 107 25.145 8.346 -10.518
815 H LYS 108 H LYS 108 21.346 10.968 -8.739
816 HA LYS 108 HA LYS 108 22.992 13.383 -8.581
817 HB2 LYS 108 2HB LYS 108 22.038 14.455 -10.551
818 HB3 LYS 108 3HB LYS 108 22.973 13.028 -10.989
819 HG2 LYS 108 2HG LYS 108 20.854 11.729 -11.263
820 HG3 LYS 108 3HG LYS 108 19.925 13.183 -10.844
821 HD2 LYS 108 2HD LYS 108 20.898 14.368 -12.794
822 HD3 LYS 108 3HD LYS 108 21.832 12.912 -13.212
823 HE2 LYS 108 2HE LYS 108 19.715 11.634 -13.469
824 HE3 LYS 108 3HE LYS 108 18.787 13.081 -13.053
825 HZ1 LYS 108 3HZ LYS 108 19.705 14.159 -15.040
826 HZ2 LYS 108 1HZ LYS 108 20.563 12.821 -15.423
827 HZ3 LYS 108 2HZ LYS 108 18.932 12.784 -15.458
Start of MODEL 17
1 H1 MET 1 H1 MET 1 4.811 6.873 19.980
2 H2 MET 1 H2 MET 1 3.400 7.288 19.241
3 H3 MET 1 H3 MET 1 4.108 5.852 18.908
4 HA MET 1 HA MET 1 3.753 5.060 21.132
5 HB2 MET 1 2HB MET 1 2.277 7.708 21.508
6 HB3 MET 1 3HB MET 1 2.225 6.346 22.628
7 HG2 MET 1 2HG MET 1 4.675 7.997 21.926
8 HG3 MET 1 3HG MET 1 3.771 8.013 23.435
9 HE1 MET 1 1HE MET 1 7.208 6.494 24.517
10 HE2 MET 1 2HE MET 1 6.925 7.750 23.291
11 HE3 MET 1 3HE MET 1 5.999 7.763 24.810
12 H ALA 2 H ALA 2 1.779 3.982 21.751
13 HA ALA 2 HA ALA 2 -0.006 2.737 21.273
14 HB1 ALA 2 1HB ALA 2 -1.178 5.307 20.166
15 HB2 ALA 2 2HB ALA 2 -2.070 3.899 20.776
16 HB3 ALA 2 3HB ALA 2 -1.080 4.862 21.885
17 H GLU 3 H GLU 3 2.030 2.511 19.296
18 HA GLU 3 HA GLU 3 1.017 2.175 16.649
19 HB2 GLU 3 2HB GLU 3 3.227 0.727 18.181
20 HB3 GLU 3 3HB GLU 3 2.885 0.483 16.478
21 HG2 GLU 3 2HG GLU 3 4.711 1.962 16.578
22 HG3 GLU 3 3HG GLU 3 3.315 2.868 16.006
23 H SER 4 H SER 4 0.423 0.270 15.503
24 HA SER 4 HA SER 4 -0.470 -2.108 17.022
25 HB2 SER 4 2HB SER 4 -2.444 -0.656 16.943
26 HB3 SER 4 3HB SER 4 -2.296 -0.523 15.179
27 HG SER 4 HG SER 4 -3.806 -2.161 15.989
28 H SER 5 H SER 5 -0.641 -3.955 15.838
29 HA SER 5 HA SER 5 0.039 -3.988 12.953
30 HB2 SER 5 2HB SER 5 1.353 -5.869 14.961
31 HB3 SER 5 3HB SER 5 1.604 -5.844 13.208
32 HG SER 5 HG SER 5 2.303 -3.792 15.061
33 H ASP 6 H ASP 6 -2.368 -4.419 14.765
34 HA ASP 6 HA ASP 6 -3.113 -7.131 13.955
35 HB2 ASP 6 2HB ASP 6 -4.588 -5.013 15.557
36 HB3 ASP 6 3HB ASP 6 -5.275 -6.586 15.146
37 H LYS 7 H LYS 7 -2.449 -5.863 11.770
38 HA LYS 7 HA LYS 7 -4.908 -5.269 10.211
39 HB2 LYS 7 2HB LYS 7 -2.139 -3.982 9.976
40 HB3 LYS 7 3HB LYS 7 -3.549 -3.584 9.003
41 HG2 LYS 7 2HG LYS 7 -3.259 -3.095 12.001
42 HG3 LYS 7 3HG LYS 7 -3.062 -1.894 10.742
43 HD2 LYS 7 2HD LYS 7 -5.388 -2.033 10.094
44 HD3 LYS 7 3HD LYS 7 -5.666 -3.423 11.164
45 HE2 LYS 7 2HE LYS 7 -5.003 -2.030 13.123
46 HE3 LYS 7 3HE LYS 7 -4.856 -0.630 12.049
47 HZ1 LYS 7 3HZ LYS 7 -7.057 -0.609 13.006
48 HZ2 LYS 7 1HZ LYS 7 -7.243 -1.031 11.425
49 HZ3 LYS 7 2HZ LYS 7 -7.343 -2.165 12.592
50 H LEU 8 H LEU 8 -4.372 -5.505 7.869
51 HA LEU 8 HA LEU 8 -2.491 -7.794 7.326
52 HB2 LEU 8 2HB LEU 8 -4.945 -6.781 5.830
53 HB3 LEU 8 3HB LEU 8 -3.980 -8.171 5.344
54 HG LEU 8 HG LEU 8 -5.620 -8.016 7.920
55 HD11 LEU 8 1HD1 LEU 8 -7.003 -7.863 5.908
56 HD12 LEU 8 2HD1 LEU 8 -6.223 -9.306 5.233
57 HD13 LEU 8 3HD1 LEU 8 -7.219 -9.436 6.709
58 HD21 LEU 8 3HD2 LEU 8 -4.244 -10.339 6.505
59 HD22 LEU 8 1HD2 LEU 8 -3.750 -9.606 8.049
60 HD23 LEU 8 2HD2 LEU 8 -5.295 -10.466 7.937
61 H TYR 9 H TYR 9 -3.165 -4.457 6.688
62 HA TYR 9 HA TYR 9 -1.400 -4.434 4.299
63 HB2 TYR 9 2HB TYR 9 -4.153 -3.201 4.515
64 HB3 TYR 9 3HB TYR 9 -3.117 -3.222 3.086
65 HD1 TYR 9 HD1 TYR 9 -2.373 -5.934 2.649
66 HD2 TYR 9 HD2 TYR 9 -6.078 -4.414 4.226
67 HE1 TYR 9 HE1 TYR 9 -3.522 -8.019 1.933
68 HE2 TYR 9 HE2 TYR 9 -7.229 -6.512 3.533
69 HH TYR 9 HH TYR 9 -5.508 -9.154 1.840
70 H ARG 10 H ARG 10 -0.638 -2.389 3.727
71 HA ARG 10 HA ARG 10 -0.910 -0.120 5.614
72 HB2 ARG 10 2HB ARG 10 1.025 -1.259 6.449
73 HB3 ARG 10 3HB ARG 10 1.588 -1.625 4.839
74 HG2 ARG 10 2HG ARG 10 3.082 -0.040 5.753
75 HG3 ARG 10 3HG ARG 10 2.182 0.784 4.489
76 HD2 ARG 10 2HD ARG 10 0.682 1.747 6.265
77 HD3 ARG 10 3HD ARG 10 1.675 0.948 7.497
78 HE ARG 10 HE ARG 10 3.313 2.635 5.853
79 HH11 ARG 10 1HH2 ARG 10 0.942 2.960 8.493
80 HH12 ARG 10 2HH2 ARG 10 1.319 4.693 8.592
81 HH21 ARG 10 1HH1 ARG 10 3.858 4.802 6.440
82 HH22 ARG 10 2HH1 ARG 10 2.761 5.600 7.558
83 H VAL 11 H VAL 11 -0.693 1.889 4.589
84 HA VAL 11 HA VAL 11 0.396 2.074 1.854
85 HB VAL 11 HB VAL 11 -2.114 1.790 1.754
86 HG11 VAL 11 1HG1 VAL 11 -2.219 4.674 2.726
87 HG12 VAL 11 2HG1 VAL 11 -3.574 3.640 2.239
88 HG13 VAL 11 3HG1 VAL 11 -2.651 3.292 3.717
89 HG21 VAL 11 3HG2 VAL 11 -2.391 3.438 -0.016
90 HG22 VAL 11 1HG2 VAL 11 -1.111 4.470 0.654
91 HG23 VAL 11 2HG2 VAL 11 -0.695 2.934 -0.067
92 H GLU 12 H GLU 12 1.427 4.053 1.439
93 HA GLU 12 HA GLU 12 0.958 6.321 3.210
94 HB2 GLU 12 2HB GLU 12 3.161 6.593 4.061
95 HB3 GLU 12 3HB GLU 12 2.551 5.026 4.560
96 HG2 GLU 12 2HG GLU 12 3.956 3.878 2.937
97 HG3 GLU 12 3HG GLU 12 4.474 5.407 2.229
98 H TYR 13 H TYR 13 1.958 8.259 2.594
99 HA TYR 13 HA TYR 13 3.329 8.496 -0.007
100 HB2 TYR 13 2HB TYR 13 2.607 10.360 2.249
101 HB3 TYR 13 3HB TYR 13 4.013 10.725 1.271
102 HD1 TYR 13 HD1 TYR 13 0.572 9.384 0.369
103 HD2 TYR 13 HD2 TYR 13 3.582 12.430 -0.209
104 HE1 TYR 13 HE1 TYR 13 -0.812 10.415 -1.414
105 HE2 TYR 13 HE2 TYR 13 2.182 13.466 -1.982
106 HH TYR 13 HH TYR 13 -0.954 12.093 -3.017
107 H ALA 14 H ALA 14 5.353 7.946 -0.254
108 HA ALA 14 HA ALA 14 6.741 6.474 1.690
109 HB1 ALA 14 1HB ALA 14 7.567 7.569 -1.025
110 HB2 ALA 14 2HB ALA 14 8.451 6.314 -0.137
111 HB3 ALA 14 3HB ALA 14 6.791 6.017 -0.701
112 H LYS 15 H LYS 15 8.130 6.972 3.234
113 HA LYS 15 HA LYS 15 8.909 9.719 3.753
114 HB2 LYS 15 2HB LYS 15 9.789 7.194 5.214
115 HB3 LYS 15 3HB LYS 15 9.826 8.846 5.825
116 HG2 LYS 15 2HG LYS 15 7.367 7.156 5.242
117 HG3 LYS 15 3HG LYS 15 7.981 7.649 6.819
118 HD2 LYS 15 2HD LYS 15 7.544 10.038 6.238
119 HD3 LYS 15 3HD LYS 15 6.843 9.534 4.692
120 HE2 LYS 15 2HE LYS 15 5.825 8.710 7.443
121 HE3 LYS 15 3HE LYS 15 5.147 9.995 6.432
122 HZ1 LYS 15 3HZ LYS 15 5.205 7.097 5.740
123 HZ2 LYS 15 1HZ LYS 15 3.891 7.984 6.122
124 HZ3 LYS 15 2HZ LYS 15 4.717 8.281 4.717
125 H SER 16 H SER 16 10.701 6.890 2.687
126 HA SER 16 HA SER 16 13.044 8.423 1.839
127 HB2 SER 16 2HB SER 16 13.423 8.087 4.295
128 HB3 SER 16 3HB SER 16 13.368 6.332 4.029
129 HG SER 16 HG SER 16 15.517 7.324 3.974
130 H GLY 17 H GLY 17 14.494 7.086 0.572
131 HA2 GLY 17 2HA GLY 17 13.091 5.161 -1.073
132 HA3 GLY 17 3HA GLY 17 14.741 5.740 -1.289
133 H ARG 18 H ARG 18 13.715 4.189 1.708
134 HA ARG 18 HA ARG 18 15.801 2.111 1.391
135 HB2 ARG 18 2HB ARG 18 13.984 2.830 3.734
136 HB3 ARG 18 3HB ARG 18 15.287 1.654 3.791
137 HG2 ARG 18 2HG ARG 18 15.584 4.649 3.322
138 HG3 ARG 18 3HG ARG 18 15.972 3.777 4.798
139 HD2 ARG 18 2HD ARG 18 17.376 3.477 2.111
140 HD3 ARG 18 3HD ARG 18 17.989 4.344 3.523
141 HE ARG 18 HE ARG 18 17.506 1.790 4.482
142 HH11 ARG 18 1HH2 ARG 18 19.568 3.057 1.949
143 HH12 ARG 18 2HH2 ARG 18 20.701 1.741 2.091
144 HH21 ARG 18 1HH1 ARG 18 18.984 0.139 4.603
145 HH22 ARG 18 2HH1 ARG 18 20.376 0.140 3.563
146 H ALA 19 H ALA 19 12.361 2.194 1.022
147 HA ALA 19 HA ALA 19 11.963 -0.627 1.658
148 HB1 ALA 19 1HB ALA 19 10.087 1.350 0.318
149 HB2 ALA 19 2HB ALA 19 9.662 -0.226 1.000
150 HB3 ALA 19 3HB ALA 19 10.211 1.070 2.075
151 H SER 20 H SER 20 11.862 -2.330 0.313
152 HA SER 20 HA SER 20 12.461 -1.952 -2.584
153 HB2 SER 20 2HB SER 20 13.416 -4.204 -2.546
154 HB3 SER 20 3HB SER 20 14.264 -3.079 -1.470
155 HG SER 20 HG SER 20 13.958 -4.998 -0.381
156 H CYS 21 HN CYS 21 11.322 -3.113 -4.127
157 HA CYS 21 HA CYS 21 8.561 -3.684 -3.329
158 HB2 CYS 21 2HB CYS 21 9.162 -2.264 -5.255
159 HB3 CYS 21 3HB CYS 21 9.908 -3.670 -6.042
160 H LYS 22 H LYS 22 7.810 -5.576 -2.864
161 HA LYS 22 HA LYS 22 9.466 -7.981 -3.111
162 HB2 LYS 22 2HB LYS 22 6.731 -7.607 -1.852
163 HB3 LYS 22 3HB LYS 22 7.812 -8.968 -1.573
164 HG2 LYS 22 2HG LYS 22 8.560 -6.110 -0.905
165 HG3 LYS 22 3HG LYS 22 7.656 -7.128 0.189
166 HD2 LYS 22 2HD LYS 22 9.485 -8.787 0.186
167 HD3 LYS 22 3HD LYS 22 10.420 -7.777 -0.952
168 HE2 LYS 22 2HE LYS 22 9.422 -6.881 1.776
169 HE3 LYS 22 3HE LYS 22 11.019 -7.599 1.532
170 HZ1 LYS 22 3HZ LYS 22 10.149 -5.108 0.129
171 HZ2 LYS 22 1HZ LYS 22 11.060 -5.131 1.501
172 HZ3 LYS 22 2HZ LYS 22 11.636 -5.747 0.122
173 H LYS 23 H LYS 23 7.455 -6.667 -5.274
174 HA LYS 23 HA LYS 23 6.456 -9.280 -6.370
175 HB2 LYS 23 2HB LYS 23 4.667 -7.822 -5.620
176 HB3 LYS 23 3HB LYS 23 5.299 -6.489 -6.587
177 HG2 LYS 23 2HG LYS 23 3.334 -7.479 -7.604
178 HG3 LYS 23 3HG LYS 23 4.735 -7.695 -8.655
179 HD2 LYS 23 2HD LYS 23 4.935 -10.050 -7.974
180 HD3 LYS 23 3HD LYS 23 3.649 -9.840 -6.765
181 HE2 LYS 23 2HE LYS 23 2.040 -9.298 -8.549
182 HE3 LYS 23 3HE LYS 23 3.318 -9.435 -9.769
183 HZ1 LYS 23 3HZ LYS 23 2.370 -11.671 -8.044
184 HZ2 LYS 23 1HZ LYS 23 1.987 -11.474 -9.617
185 HZ3 LYS 23 2HZ LYS 23 3.529 -11.790 -9.190
186 H CYS 24 HN CYS 24 7.663 -6.075 -7.524
187 HA CYS 24 HA CYS 24 8.518 -7.434 -10.017
188 HB2 CYS 24 2HB CYS 24 8.477 -5.450 -11.146
189 HB3 CYS 24 3HB CYS 24 7.007 -5.463 -10.179
190 H SER 25 H SER 25 9.922 -6.869 -7.134
191 HA SER 25 HA SER 25 11.995 -6.971 -6.316
192 HB2 SER 25 2HB SER 25 12.834 -8.018 -9.023
193 HB3 SER 25 3HB SER 25 13.725 -8.174 -7.501
194 HG SER 25 HG SER 25 12.469 -10.043 -7.974
195 H GLU 26 H GLU 26 11.213 -4.452 -7.823
196 HA GLU 26 HA GLU 26 13.894 -3.196 -8.142
197 HB2 GLU 26 2HB GLU 26 11.097 -2.179 -8.702
198 HB3 GLU 26 3HB GLU 26 12.555 -1.233 -8.969
199 HG2 GLU 26 2HG GLU 26 12.073 -3.877 -10.392
200 HG3 GLU 26 3HG GLU 26 11.484 -2.333 -10.984
201 H SER 27 H SER 27 13.130 -0.579 -7.321
202 HA SER 27 HA SER 27 12.766 -0.857 -4.374
203 HB2 SER 27 2HB SER 27 15.162 -0.596 -5.064
204 HB3 SER 27 3HB SER 27 14.722 1.027 -5.666
205 HG SER 27 HG SER 27 15.496 1.057 -3.484
206 H ILE 28 H ILE 28 12.023 1.027 -3.293
207 HA ILE 28 HA ILE 28 10.007 2.381 -5.015
208 HB ILE 28 HB ILE 28 9.729 1.706 -2.086
209 HG12 ILE 28 2HG1 ILE 28 8.428 0.157 -4.361
210 HG13 ILE 28 3HG1 ILE 28 9.928 -0.377 -3.609
211 HG21 ILE 28 1HG2 ILE 28 7.762 2.571 -4.287
212 HG22 ILE 28 2HG2 ILE 28 7.313 2.131 -2.645
213 HG23 ILE 28 3HG2 ILE 28 8.292 3.574 -2.931
214 HD11 ILE 28 3HD1 ILE 28 8.861 -0.449 -1.395
215 HD12 ILE 28 1HD1 ILE 28 7.301 -0.030 -2.137
216 HD13 ILE 28 2HD1 ILE 28 8.120 -1.539 -2.568
217 HA PRO 29 HA PRO 29 12.411 5.962 -3.622
218 HB2 PRO 29 2HB PRO 29 11.417 7.864 -5.313
219 HB3 PRO 29 3HB PRO 29 12.525 6.563 -5.849
220 HG2 PRO 29 2HG PRO 29 9.493 6.607 -6.020
221 HG3 PRO 29 3HG PRO 29 10.667 6.230 -7.323
222 HD2 PRO 29 2HD PRO 29 9.455 4.282 -5.872
223 HD3 PRO 29 3HD PRO 29 11.163 4.118 -6.387
224 H LYS 30 H LYS 30 12.088 7.984 -2.565
225 HA LYS 30 HA LYS 30 9.737 8.169 -0.871
226 HB2 LYS 30 2HB LYS 30 10.795 9.973 0.225
227 HB3 LYS 30 3HB LYS 30 11.937 8.652 -0.034
228 HG2 LYS 30 2HG LYS 30 12.942 9.846 -1.934
229 HG3 LYS 30 3HG LYS 30 11.776 11.173 -1.728
230 HD2 LYS 30 2HD LYS 30 12.657 11.630 0.533
231 HD3 LYS 30 3HD LYS 30 13.811 10.275 0.370
232 HE2 LYS 30 2HE LYS 30 14.776 11.316 -1.625
233 HE3 LYS 30 3HE LYS 30 13.616 12.647 -1.519
234 HZ1 LYS 30 3HZ LYS 30 14.625 13.268 0.623
235 HZ2 LYS 30 1HZ LYS 30 15.699 12.039 0.525
236 HZ3 LYS 30 2HZ LYS 30 15.765 13.272 -0.542
237 H ASP 31 H ASP 31 8.565 10.205 -0.536
238 HA ASP 31 HA ASP 31 6.904 11.543 -1.233
239 HB2 ASP 31 2HB ASP 31 8.927 12.969 -1.563
240 HB3 ASP 31 3HB ASP 31 8.887 12.574 -3.281
241 H SER 32 H SER 32 6.806 8.975 -2.290
242 HA SER 32 HA SER 32 5.035 9.275 -4.661
243 HB2 SER 32 2HB SER 32 7.115 7.085 -4.235
244 HB3 SER 32 3HB SER 32 5.903 7.123 -5.522
245 HG SER 32 HG SER 32 7.972 9.037 -5.097
246 H LEU 33 H LEU 33 3.698 7.097 -4.827
247 HA LEU 33 HA LEU 33 2.582 6.666 -2.108
248 HB2 LEU 33 2HB LEU 33 1.124 7.642 -3.880
249 HB3 LEU 33 3HB LEU 33 1.367 6.189 -4.850
250 HG LEU 33 HG LEU 33 0.317 4.842 -2.997
251 HD11 LEU 33 1HD1 LEU 33 -1.109 6.059 -1.358
252 HD12 LEU 33 2HD1 LEU 33 0.605 6.360 -1.081
253 HD13 LEU 33 3HD1 LEU 33 -0.386 7.596 -1.880
254 HD21 LEU 33 3HD2 LEU 33 -1.385 7.099 -4.123
255 HD22 LEU 33 1HD2 LEU 33 -0.962 5.596 -4.977
256 HD23 LEU 33 2HD2 LEU 33 -1.978 5.531 -3.524
257 H ARG 34 H ARG 34 2.724 4.735 -1.122
258 HA ARG 34 HA ARG 34 3.307 2.267 -2.651
259 HB2 ARG 34 2HB ARG 34 5.261 1.696 -1.448
260 HB3 ARG 34 3HB ARG 34 5.478 3.284 -2.184
261 HG2 ARG 34 2HG ARG 34 5.126 4.355 0.038
262 HG3 ARG 34 3HG ARG 34 4.944 2.744 0.773
263 HD2 ARG 34 2HD ARG 34 7.208 2.114 -0.031
264 HD3 ARG 34 3HD ARG 34 7.377 3.709 -0.788
265 HE ARG 34 HE ARG 34 6.855 3.845 2.092
266 HH11 ARG 34 1HH2 ARG 34 9.486 3.708 -0.275
267 HH12 ARG 34 2HH2 ARG 34 10.597 4.380 0.888
268 HH21 ARG 34 1HH1 ARG 34 8.278 4.512 3.417
269 HH22 ARG 34 2HH1 ARG 34 10.008 4.547 3.025
270 H MET 35 H MET 35 3.159 0.341 -1.446
271 HA MET 35 HA MET 35 1.378 0.469 0.925
272 HB2 MET 35 2HB MET 35 0.899 -1.069 -1.651
273 HB3 MET 35 3HB MET 35 0.081 -1.446 -0.122
274 HG2 MET 35 2HG MET 35 -0.813 0.819 -0.020
275 HG3 MET 35 3HG MET 35 -0.052 1.211 -1.569
276 HE1 MET 35 3HE MET 35 -3.829 -1.368 -0.840
277 HE2 MET 35 1HE MET 35 -2.269 -1.689 -0.047
278 HE3 MET 35 2HE MET 35 -3.147 -0.176 0.289
279 H ALA 36 H ALA 36 1.201 -1.594 2.066
280 HA ALA 36 HA ALA 36 3.422 -3.451 1.648
281 HB1 ALA 36 1HB ALA 36 4.761 -2.658 3.260
282 HB2 ALA 36 2HB ALA 36 3.613 -1.365 3.620
283 HB3 ALA 36 3HB ALA 36 3.494 -2.925 4.460
284 H ILE 37 H ILE 37 3.278 -5.395 3.066
285 HA ILE 37 HA ILE 37 0.490 -5.954 3.995
286 HB ILE 37 HB ILE 37 2.175 -7.337 1.993
287 HG12 ILE 37 2HG1 ILE 37 -0.800 -7.521 2.625
288 HG13 ILE 37 3HG1 ILE 37 -0.089 -6.151 1.776
289 HG21 ILE 37 1HG2 ILE 37 0.625 -9.055 3.954
290 HG22 ILE 37 2HG2 ILE 37 1.378 -9.569 2.415
291 HG23 ILE 37 3HG2 ILE 37 2.397 -9.020 3.738
292 HD11 ILE 37 3HD1 ILE 37 0.725 -7.636 -0.010
293 HD12 ILE 37 1HD1 ILE 37 -0.060 -9.016 0.785
294 HD13 ILE 37 2HD1 ILE 37 -1.035 -7.662 0.165
295 H MET 38 H MET 38 0.184 -7.083 5.802
296 HA MET 38 HA MET 38 2.515 -7.183 7.605
297 HB2 MET 38 2HB MET 38 -0.434 -7.542 8.216
298 HB3 MET 38 3HB MET 38 0.840 -7.278 9.402
299 HG2 MET 38 2HG MET 38 0.221 -5.171 7.310
300 HG3 MET 38 3HG MET 38 -0.787 -5.370 8.722
301 HE1 MET 38 3HE MET 38 3.615 -4.050 8.791
302 HE2 MET 38 1HE MET 38 3.249 -5.781 8.919
303 HE3 MET 38 2HE MET 38 2.752 -4.886 7.465
304 H VAL 39 H VAL 39 3.670 -8.956 7.360
305 HA VAL 39 HA VAL 39 2.254 -11.592 7.630
306 HB VAL 39 HB VAL 39 3.493 -11.462 5.583
307 HG11 VAL 39 1HG1 VAL 39 5.264 -9.866 6.164
308 HG12 VAL 39 2HG1 VAL 39 6.000 -11.061 7.262
309 HG13 VAL 39 3HG1 VAL 39 5.927 -11.375 5.519
310 HG21 VAL 39 3HG2 VAL 39 3.303 -13.632 6.758
311 HG22 VAL 39 1HG2 VAL 39 4.741 -13.503 5.736
312 HG23 VAL 39 2HG2 VAL 39 4.904 -13.351 7.492
313 H GLN 40 H GLN 40 2.755 -12.992 9.213
314 HA GLN 40 HA GLN 40 3.880 -11.946 11.666
315 HB2 GLN 40 2HB GLN 40 3.560 -14.380 12.408
316 HB3 GLN 40 3HB GLN 40 2.137 -13.419 12.019
317 HG2 GLN 40 2HG GLN 40 1.850 -14.506 9.878
318 HG3 GLN 40 3HG GLN 40 3.402 -15.337 10.018
319 HE21 GLN 40 2HE2 GLN 40 0.096 -15.154 11.462
320 HE22 GLN 40 1HE2 GLN 40 0.156 -16.789 12.105
321 H SER 41 H SER 41 5.895 -12.004 12.431
322 HA SER 41 HA SER 41 7.984 -13.180 10.724
323 HB2 SER 41 2HB SER 41 8.120 -10.818 11.236
324 HB3 SER 41 3HB SER 41 8.131 -11.170 12.974
325 HG SER 41 HG SER 41 10.220 -10.938 11.511
326 HA PRO 42 HA PRO 42 9.138 -16.035 13.955
327 HB2 PRO 42 2HB PRO 42 11.249 -17.277 12.773
328 HB3 PRO 42 3HB PRO 42 9.568 -17.517 12.201
329 HG2 PRO 42 2HG PRO 42 11.659 -15.622 11.102
330 HG3 PRO 42 3HG PRO 42 10.628 -16.768 10.189
331 HD2 PRO 42 2HD PRO 42 10.003 -14.087 10.517
332 HD3 PRO 42 3HD PRO 42 8.751 -15.352 10.363
333 H MET 43 H MET 43 10.889 -13.315 12.782
334 HA MET 43 HA MET 43 13.115 -13.577 14.744
335 HB2 MET 43 2HB MET 43 12.723 -11.810 12.341
336 HB3 MET 43 3HB MET 43 14.037 -11.592 13.491
337 HG2 MET 43 2HG MET 43 15.101 -13.577 12.962
338 HG3 MET 43 3HG MET 43 13.648 -14.341 12.321
339 HE1 MET 43 3HE MET 43 12.288 -12.899 10.513
340 HE2 MET 43 1HE MET 43 13.062 -12.827 8.904
341 HE3 MET 43 2HE MET 43 12.964 -14.367 9.791
342 H PHE 44 H PHE 44 10.366 -11.498 13.899
343 HA PHE 44 HA PHE 44 10.917 -9.657 16.172
344 HB2 PHE 44 2HB PHE 44 10.785 -8.583 14.017
345 HB3 PHE 44 3HB PHE 44 9.259 -9.368 13.653
346 HD1 PHE 44 HD1 PHE 44 10.819 -7.016 16.146
347 HD2 PHE 44 HD2 PHE 44 7.232 -8.261 14.099
348 HE1 PHE 44 HE1 PHE 44 9.571 -5.125 17.170
349 HE2 PHE 44 HE2 PHE 44 5.994 -6.361 15.110
350 HZ PHE 44 HZ PHE 44 7.159 -4.799 16.655
351 H ASP 45 H ASP 45 9.147 -8.944 17.458
352 HA ASP 45 HA ASP 45 7.541 -11.218 18.386
353 HB2 ASP 45 2HB ASP 45 9.001 -9.899 19.898
354 HB3 ASP 45 3HB ASP 45 7.981 -8.485 19.632
355 H GLY 46 H GLY 46 6.507 -10.558 16.032
356 HA2 GLY 46 2HA GLY 46 3.779 -10.205 16.212
357 HA3 GLY 46 3HA GLY 46 4.392 -8.549 16.144
358 H LYS 47 H LYS 47 3.549 -8.059 14.152
359 HA LYS 47 HA LYS 47 4.423 -9.697 11.818
360 HB2 LYS 47 2HB LYS 47 2.057 -7.806 11.847
361 HB3 LYS 47 3HB LYS 47 2.508 -8.996 10.626
362 HG2 LYS 47 2HG LYS 47 2.301 -10.589 12.897
363 HG3 LYS 47 3HG LYS 47 1.090 -9.359 13.231
364 HD2 LYS 47 2HD LYS 47 1.302 -11.219 10.846
365 HD3 LYS 47 3HD LYS 47 0.132 -11.330 12.155
366 HE2 LYS 47 2HE LYS 47 0.302 -9.130 10.052
367 HE3 LYS 47 3HE LYS 47 -0.821 -10.482 10.032
368 HZ1 LYS 47 3HZ LYS 47 -1.812 -9.618 12.088
369 HZ2 LYS 47 1HZ LYS 47 -0.787 -8.333 12.109
370 HZ3 LYS 47 2HZ LYS 47 -1.867 -8.486 10.900
371 H VAL 48 H VAL 48 5.141 -8.789 9.965
372 HA VAL 48 HA VAL 48 6.391 -6.092 10.250
373 HB VAL 48 HB VAL 48 8.402 -7.002 9.177
374 HG11 VAL 48 1HG1 VAL 48 7.617 -8.541 11.691
375 HG12 VAL 48 2HG1 VAL 48 9.262 -8.196 11.125
376 HG13 VAL 48 3HG1 VAL 48 8.215 -6.871 11.654
377 HG21 VAL 48 3HG2 VAL 48 7.094 -9.742 9.505
378 HG22 VAL 48 1HG2 VAL 48 7.465 -8.943 7.966
379 HG23 VAL 48 2HG2 VAL 48 8.779 -9.435 9.043
380 HA PRO 49 HA PRO 49 4.644 -5.340 6.337
381 HB2 PRO 49 2HB PRO 49 5.872 -3.038 5.529
382 HB3 PRO 49 3HB PRO 49 4.816 -3.116 6.969
383 HG2 PRO 49 2HG PRO 49 7.846 -3.266 6.862
384 HG3 PRO 49 3HG PRO 49 6.824 -2.266 7.939
385 HD2 PRO 49 2HD PRO 49 7.879 -4.676 8.715
386 HD3 PRO 49 3HD PRO 49 6.287 -4.097 9.291
387 H HIS 50 H HIS 50 4.785 -6.291 4.399
388 HA HIS 50 HA HIS 50 7.385 -6.402 2.908
389 HB2 HIS 50 2HB HIS 50 4.770 -7.935 2.751
390 HB3 HIS 50 3HB HIS 50 5.838 -7.846 1.359
391 HD2 HIS 50 HD2 HIS 50 7.157 -8.160 4.962
392 HE1 HIS 50 HE1 HIS 50 8.135 -11.794 2.956
393 HE2 HIS 50 HE2 HIS 50 8.491 -10.445 5.086
394 H TRP 51 H TRP 51 7.706 -4.449 1.954
395 HA TRP 51 HA TRP 51 5.491 -2.798 1.118
396 HB2 TRP 51 2HB TRP 51 8.468 -2.448 0.698
397 HB3 TRP 51 3HB TRP 51 7.229 -1.238 0.394
398 HD1 TRP 51 HD1 TRP 51 9.261 -2.763 3.166
399 HE1 TRP 51 HE1 TRP 51 8.865 -1.503 5.360
400 HE3 TRP 51 HE3 TRP 51 5.288 0.170 1.728
401 HZ2 TRP 51 HZ2 TRP 51 7.034 0.450 6.389
402 HZ3 TRP 51 HZ3 TRP 51 4.203 1.683 3.393
403 HH2 TRP 51 HH2 TRP 51 5.126 1.875 5.694
404 H TYR 52 H TYR 52 4.965 -2.071 -0.938
405 HA TYR 52 HA TYR 52 6.456 -2.988 -3.271
406 HB2 TYR 52 2HB TYR 52 3.548 -3.391 -3.639
407 HB3 TYR 52 3HB TYR 52 4.962 -4.208 -4.313
408 HD1 TYR 52 HD2 TYR 52 3.104 -4.076 -1.004
409 HD2 TYR 52 HD1 TYR 52 5.198 -6.404 -3.956
410 HE1 TYR 52 HE2 TYR 52 2.491 -6.186 0.200
411 HE2 TYR 52 HE1 TYR 52 4.558 -8.499 -2.775
412 HH TYR 52 HH TYR 52 3.525 -9.407 -0.956
413 H HIS 53 H HIS 53 5.837 -1.771 -5.203
414 HA HIS 53 HA HIS 53 5.086 0.997 -4.868
415 HB2 HIS 53 2HB HIS 53 4.749 -0.753 -7.340
416 HB3 HIS 53 3HB HIS 53 4.698 0.989 -7.302
417 HD2 HIS 53 HD2 HIS 53 7.022 2.305 -6.635
418 HE1 HIS 53 HE1 HIS 53 9.587 -0.756 -8.098
419 HE2 HIS 53 HE2 HIS 53 9.477 1.660 -7.369
420 H PHE 54 H PHE 54 3.030 2.058 -5.454
421 HA PHE 54 HA PHE 54 0.732 1.016 -4.288
422 HB2 PHE 54 2HB PHE 54 0.777 3.320 -4.779
423 HB3 PHE 54 3HB PHE 54 1.122 3.057 -6.483
424 HD1 PHE 54 HD1 PHE 54 -1.594 2.790 -3.895
425 HD2 PHE 54 HD2 PHE 54 -0.610 2.732 -8.100
426 HE1 PHE 54 HE1 PHE 54 -4.015 2.842 -4.481
427 HE2 PHE 54 HE2 PHE 54 -3.028 2.723 -8.661
428 HZ PHE 54 HZ PHE 54 -4.725 2.748 -6.852
429 H SER 55 H SER 55 1.661 0.643 -7.783
430 HA SER 55 HA SER 55 -0.832 -0.731 -8.425
431 HB2 SER 55 2HB SER 55 0.108 -0.954 -10.644
432 HB3 SER 55 3HB SER 55 0.264 0.708 -10.054
433 HG SER 55 HG SER 55 2.263 0.357 -10.737
434 H CYS 56 HN CYS 56 2.483 -1.698 -7.595
435 HA CYS 56 HA CYS 56 2.302 -4.394 -8.352
436 HB2 CYS 56 2HB CYS 56 3.970 -2.952 -6.277
437 HB3 CYS 56 3HB CYS 56 4.213 -4.642 -6.716
438 H PHE 57 H PHE 57 1.326 -2.817 -5.319
439 HA PHE 57 HA PHE 57 0.573 -5.100 -3.777
440 HB2 PHE 57 2HB PHE 57 0.660 -2.776 -3.012
441 HB3 PHE 57 3HB PHE 57 -0.758 -2.385 -3.982
442 HD1 PHE 57 HD2 PHE 57 -2.967 -3.545 -3.483
443 HD2 PHE 57 HD1 PHE 57 0.444 -3.807 -0.857
444 HE1 PHE 57 HE2 PHE 57 -4.445 -4.279 -1.646
445 HE2 PHE 57 HE1 PHE 57 -1.065 -4.411 1.020
446 HZ PHE 57 HZ PHE 57 -3.492 -4.693 0.622
447 H TRP 58 H TRP 58 -1.302 -3.282 -6.261
448 HA TRP 58 HA TRP 58 -3.529 -5.130 -6.195
449 HB2 TRP 58 2HB TRP 58 -2.826 -3.039 -8.251
450 HB3 TRP 58 3HB TRP 58 -4.383 -3.798 -8.024
451 HD1 TRP 58 HD1 TRP 58 -2.694 -0.743 -7.341
452 HE1 TRP 58 HE1 TRP 58 -3.514 0.570 -5.326
453 HE3 TRP 58 HE3 TRP 58 -5.755 -4.307 -5.220
454 HZ2 TRP 58 HZ2 TRP 58 -5.306 0.176 -3.097
455 HZ3 TRP 58 HZ3 TRP 58 -6.979 -3.792 -3.145
456 HH2 TRP 58 HH2 TRP 58 -6.753 -1.565 -2.062
457 H LYS 59 H LYS 59 -0.465 -5.318 -7.806
458 HA LYS 59 HA LYS 59 -1.329 -7.368 -9.750
459 HB2 LYS 59 2HB LYS 59 1.440 -6.562 -8.811
460 HB3 LYS 59 3HB LYS 59 1.112 -7.754 -10.065
461 HG2 LYS 59 2HG LYS 59 0.171 -6.135 -11.547
462 HG3 LYS 59 3HG LYS 59 0.041 -4.943 -10.264
463 HD2 LYS 59 2HD LYS 59 2.750 -5.355 -10.213
464 HD3 LYS 59 3HD LYS 59 2.426 -5.684 -11.917
465 HE2 LYS 59 2HE LYS 59 1.523 -3.510 -12.284
466 HE3 LYS 59 3HE LYS 59 1.173 -3.286 -10.568
467 HZ1 LYS 59 3HZ LYS 59 3.601 -3.173 -10.161
468 HZ2 LYS 59 1HZ LYS 59 3.872 -3.180 -11.780
469 HZ3 LYS 59 2HZ LYS 59 3.040 -1.949 -11.061
470 H VAL 60 H VAL 60 -0.239 -7.290 -6.385
471 HA VAL 60 HA VAL 60 -0.278 -10.237 -6.143
472 HB VAL 60 HB VAL 60 -0.429 -8.150 -3.938
473 HG11 VAL 60 1HG1 VAL 60 0.278 -11.115 -3.857
474 HG12 VAL 60 2HG1 VAL 60 0.336 -9.984 -2.486
475 HG13 VAL 60 3HG1 VAL 60 -1.215 -10.394 -3.228
476 HG21 VAL 60 3HG2 VAL 60 1.702 -7.937 -5.188
477 HG22 VAL 60 1HG2 VAL 60 1.963 -8.636 -3.592
478 HG23 VAL 60 2HG2 VAL 60 1.972 -9.687 -5.023
479 H GLY 61 H GLY 61 -2.537 -7.529 -5.651
480 HA2 GLY 61 2HA GLY 61 -4.732 -7.491 -6.330
481 HA3 GLY 61 3HA GLY 61 -4.586 -9.178 -6.809
482 H HIS 62 H HIS 62 -4.309 -7.757 -3.520
483 HA HIS 62 HA HIS 62 -6.209 -9.638 -2.369
484 HB2 HIS 62 2HB HIS 62 -4.831 -7.149 -1.305
485 HB3 HIS 62 3HB HIS 62 -6.013 -8.058 -0.374
486 HD2 HIS 62 HD2 HIS 62 -2.512 -8.557 -1.988
487 HE1 HIS 62 HE1 HIS 62 -2.945 -11.506 1.062
488 HE2 HIS 62 HE2 HIS 62 -1.354 -10.510 -0.650
489 H SER 63 H SER 63 -8.328 -9.409 -1.833
490 HA SER 63 HA SER 63 -9.843 -7.142 -2.993
491 HB2 SER 63 2HB SER 63 -10.783 -9.711 -1.672
492 HB3 SER 63 3HB SER 63 -11.827 -8.478 -2.406
493 HG SER 63 HG SER 63 -11.345 -10.212 -3.854
494 H ILE 64 H ILE 64 -10.273 -5.395 -1.820
495 HA ILE 64 HA ILE 64 -10.372 -5.527 1.179
496 HB ILE 64 HB ILE 64 -8.949 -3.505 -0.596
497 HG12 ILE 64 2HG1 ILE 64 -7.814 -5.583 1.304
498 HG13 ILE 64 3HG1 ILE 64 -7.720 -5.620 -0.454
499 HG21 ILE 64 1HG2 ILE 64 -8.971 -3.607 2.465
500 HG22 ILE 64 2HG2 ILE 64 -8.175 -2.404 1.435
501 HG23 ILE 64 3HG2 ILE 64 -9.929 -2.474 1.485
502 HD11 ILE 64 3HD1 ILE 64 -6.322 -3.636 1.358
503 HD12 ILE 64 1HD1 ILE 64 -5.634 -4.884 0.314
504 HD13 ILE 64 2HD1 ILE 64 -6.433 -3.467 -0.412
505 H ARG 65 H ARG 65 -12.266 -4.921 1.832
506 HA ARG 65 HA ARG 65 -13.834 -2.883 0.332
507 HB2 ARG 65 2HB ARG 65 -15.904 -3.998 0.902
508 HB3 ARG 65 3HB ARG 65 -14.875 -4.957 -0.134
509 HG2 ARG 65 2HG ARG 65 -15.064 -5.419 2.876
510 HG3 ARG 65 3HG ARG 65 -16.138 -6.173 1.695
511 HD2 ARG 65 2HD ARG 65 -14.134 -7.130 0.523
512 HD3 ARG 65 3HD ARG 65 -13.129 -6.527 1.849
513 HE ARG 65 HE ARG 65 -15.326 -8.131 2.823
514 HH11 ARG 65 1HH2 ARG 65 -12.104 -8.499 1.420
515 HH12 ARG 65 2HH2 ARG 65 -11.892 -10.055 2.158
516 HH21 ARG 65 1HH1 ARG 65 -14.957 -10.127 3.700
517 HH22 ARG 65 2HH1 ARG 65 -13.457 -10.952 3.400
518 H HIS 66 H HIS 66 -12.027 -3.035 2.761
519 HA HIS 66 HA HIS 66 -13.363 -1.096 4.532
520 HB2 HIS 66 2HB HIS 66 -12.500 -2.605 6.448
521 HB3 HIS 66 3HB HIS 66 -13.913 -3.166 5.579
522 HD2 HIS 66 HD2 HIS 66 -13.863 -5.573 4.979
523 HE1 HIS 66 HE1 HIS 66 -9.740 -6.181 4.088
524 HE2 HIS 66 HE2 HIS 66 -12.011 -7.332 4.254
525 HA PRO 67 HA PRO 67 -8.805 -0.895 3.516
526 HB2 PRO 67 2HB PRO 67 -8.602 1.471 2.040
527 HB3 PRO 67 3HB PRO 67 -8.852 -0.146 1.327
528 HG2 PRO 67 2HG PRO 67 -10.937 1.923 2.030
529 HG3 PRO 67 3HG PRO 67 -10.781 0.965 0.513
530 HD2 PRO 67 2HD PRO 67 -12.527 0.246 2.477
531 HD3 PRO 67 3HD PRO 67 -11.605 -0.980 1.567
532 H ASP 68 H ASP 68 -11.037 1.625 4.638
533 HA ASP 68 HA ASP 68 -8.923 3.106 5.998
534 HB2 ASP 68 2HB ASP 68 -10.743 4.476 6.917
535 HB3 ASP 68 3HB ASP 68 -10.790 4.341 5.166
536 H VAL 69 H VAL 69 -10.401 0.185 6.675
537 HA VAL 69 HA VAL 69 -10.034 0.357 9.621
538 HB VAL 69 HB VAL 69 -11.101 -2.019 8.077
539 HG11 VAL 69 1HG1 VAL 69 -11.453 -1.146 10.969
540 HG12 VAL 69 2HG1 VAL 69 -12.140 -2.604 10.216
541 HG13 VAL 69 3HG1 VAL 69 -10.392 -2.451 10.392
542 HG21 VAL 69 3HG2 VAL 69 -13.393 -1.319 8.656
543 HG22 VAL 69 1HG2 VAL 69 -12.768 0.242 9.249
544 HG23 VAL 69 2HG2 VAL 69 -12.644 -0.195 7.528
545 H GLU 70 H GLU 70 -9.014 -1.494 6.732
546 HA GLU 70 HA GLU 70 -7.009 -2.962 8.385
547 HB2 GLU 70 2HB GLU 70 -8.323 -3.605 5.728
548 HB3 GLU 70 3HB GLU 70 -7.055 -4.582 6.452
549 HG2 GLU 70 2HG GLU 70 -9.797 -4.053 7.655
550 HG3 GLU 70 3HG GLU 70 -9.243 -5.549 6.913
551 H VAL 71 H VAL 71 -7.059 -0.860 5.518
552 HA VAL 71 HA VAL 71 -4.117 -1.135 5.102
553 HB VAL 71 HB VAL 71 -5.948 0.888 3.849
554 HG11 VAL 71 1HG1 VAL 71 -3.182 -0.175 3.199
555 HG12 VAL 71 2HG1 VAL 71 -4.098 1.105 2.353
556 HG13 VAL 71 3HG1 VAL 71 -3.526 1.365 4.019
557 HG21 VAL 71 3HG2 VAL 71 -6.642 -1.439 3.193
558 HG22 VAL 71 1HG2 VAL 71 -5.849 -0.576 1.867
559 HG23 VAL 71 2HG2 VAL 71 -4.963 -1.804 2.796
560 H ASP 72 H ASP 72 -3.184 -0.709 6.997
561 HA ASP 72 HA ASP 72 -3.595 1.591 8.655
562 HB2 ASP 72 2HB ASP 72 -2.297 -0.397 9.315
563 HB3 ASP 72 3HB ASP 72 -1.092 -0.047 8.075
564 H GLY 73 H GLY 73 -2.701 3.652 8.589
565 HA2 GLY 73 2HA GLY 73 -1.317 5.409 7.926
566 HA3 GLY 73 3HA GLY 73 -0.575 4.363 6.715
567 H PHE 74 H PHE 74 -3.787 4.087 6.072
568 HA PHE 74 HA PHE 74 -4.025 5.795 3.803
569 HB2 PHE 74 2HB PHE 74 -5.426 3.839 4.288
570 HB3 PHE 74 3HB PHE 74 -6.009 4.561 5.776
571 HD1 PHE 74 HD2 PHE 74 -6.234 4.659 2.080
572 HD2 PHE 74 HD1 PHE 74 -7.816 6.166 5.801
573 HE1 PHE 74 HE2 PHE 74 -8.243 5.497 0.894
574 HE2 PHE 74 HE1 PHE 74 -9.821 7.013 4.606
575 HZ PHE 74 HZ PHE 74 -10.055 6.653 2.163
576 H SER 75 H SER 75 -4.389 6.535 7.218
577 HA SER 75 HA SER 75 -5.649 9.115 7.045
578 HB2 SER 75 2HB SER 75 -4.505 9.399 9.299
579 HB3 SER 75 3HB SER 75 -5.599 8.008 9.143
580 HG SER 75 HG SER 75 -3.581 7.465 10.140
581 H GLU 76 H GLU 76 -2.386 8.101 6.256
582 HA GLU 76 HA GLU 76 -1.207 10.768 6.614
583 HB2 GLU 76 2HB GLU 76 0.008 8.236 5.441
584 HB3 GLU 76 3HB GLU 76 0.868 9.688 5.929
585 HG2 GLU 76 2HG GLU 76 0.343 9.319 8.273
586 HG3 GLU 76 3HG GLU 76 -0.708 7.954 7.880
587 H LEU 77 H LEU 77 -2.985 9.298 4.148
588 HA LEU 77 HA LEU 77 -1.525 10.289 1.816
589 HB2 LEU 77 2HB LEU 77 -4.089 8.777 2.332
590 HB3 LEU 77 3HB LEU 77 -3.843 9.513 0.766
591 HG LEU 77 HG LEU 77 -1.965 8.186 0.262
592 HD11 LEU 77 1HD1 LEU 77 -2.042 7.051 3.063
593 HD12 LEU 77 2HD1 LEU 77 -1.023 6.472 1.721
594 HD13 LEU 77 3HD1 LEU 77 -0.769 8.087 2.377
595 HD21 LEU 77 3HD2 LEU 77 -4.094 6.472 1.583
596 HD22 LEU 77 1HD2 LEU 77 -4.167 7.169 -0.050
597 HD23 LEU 77 2HD2 LEU 77 -2.947 5.947 0.332
598 H ARG 78 H ARG 78 -2.305 11.715 0.248
599 HA ARG 78 HA ARG 78 -3.834 14.041 1.106
600 HB2 ARG 78 2HB ARG 78 -2.524 13.093 -1.437
601 HB3 ARG 78 3HB ARG 78 -3.826 14.252 -1.622
602 HG2 ARG 78 2HG ARG 78 -1.484 14.717 0.269
603 HG3 ARG 78 3HG ARG 78 -1.464 15.220 -1.421
604 HD2 ARG 78 2HD ARG 78 -3.614 16.091 0.560
605 HD3 ARG 78 3HD ARG 78 -2.143 17.021 0.224
606 HE ARG 78 HE ARG 78 -3.182 16.628 -2.284
607 HH11 ARG 78 1HH2 ARG 78 -4.510 18.109 0.604
608 HH12 ARG 78 2HH2 ARG 78 -5.586 19.126 -0.310
609 HH21 ARG 78 1HH1 ARG 78 -4.551 17.984 -3.381
610 HH22 ARG 78 2HH1 ARG 78 -5.598 19.058 -2.504
611 H TRP 79 H TRP 79 -5.778 14.767 0.232
612 HA TRP 79 HA TRP 79 -7.893 12.973 0.576
613 HB2 TRP 79 2HB TRP 79 -8.643 15.025 1.014
614 HB3 TRP 79 3HB TRP 79 -7.495 15.805 -0.044
615 HD1 TRP 79 HD1 TRP 79 -11.101 14.812 0.133
616 HE1 TRP 79 HE1 TRP 79 -12.352 15.766 -1.902
617 HE3 TRP 79 HE3 TRP 79 -7.077 16.281 -2.665
618 HZ2 TRP 79 HZ2 TRP 79 -11.677 16.923 -4.473
619 HZ3 TRP 79 HZ3 TRP 79 -7.395 17.267 -4.915
620 HH2 TRP 79 HH2 TRP 79 -9.689 17.595 -5.833
621 H ASP 80 H ASP 80 -6.387 13.931 -2.520
622 HA ASP 80 HA ASP 80 -8.321 12.567 -4.196
623 HB2 ASP 80 2HB ASP 80 -6.854 14.433 -4.933
624 HB3 ASP 80 3HB ASP 80 -5.445 13.392 -4.738
625 H ASP 81 H ASP 81 -5.646 11.415 -2.321
626 HA ASP 81 HA ASP 81 -5.186 9.005 -3.993
627 HB2 ASP 81 2HB ASP 81 -3.657 10.179 -1.649
628 HB3 ASP 81 3HB ASP 81 -3.346 8.576 -2.314
629 H GLN 82 H GLN 82 -6.367 10.008 -0.764
630 HA GLN 82 HA GLN 82 -7.141 7.451 0.205
631 HB2 GLN 82 2HB GLN 82 -8.337 10.242 0.490
632 HB3 GLN 82 3HB GLN 82 -9.021 8.831 1.307
633 HG2 GLN 82 2HG GLN 82 -6.874 8.381 2.419
634 HG3 GLN 82 3HG GLN 82 -6.149 9.785 1.630
635 HE21 GLN 82 2HE2 GLN 82 -6.227 9.424 4.446
636 HE22 GLN 82 1HE2 GLN 82 -7.222 10.736 5.097
637 H GLN 83 H GLN 83 -9.001 9.751 -1.873
638 HA GLN 83 HA GLN 83 -11.256 8.060 -2.263
639 HB2 GLN 83 2HB GLN 83 -10.059 10.240 -4.023
640 HB3 GLN 83 3HB GLN 83 -11.640 9.497 -4.299
641 HG2 GLN 83 2HG GLN 83 -12.466 10.291 -2.141
642 HG3 GLN 83 3HG GLN 83 -10.869 10.928 -1.729
643 HE21 GLN 83 2HE2 GLN 83 -10.086 12.797 -2.811
644 HE22 GLN 83 1HE2 GLN 83 -11.165 13.854 -3.723
645 H LYS 84 H LYS 84 -8.149 8.136 -4.046
646 HA LYS 84 HA LYS 84 -9.046 6.380 -6.178
647 HB2 LYS 84 2HB LYS 84 -7.542 8.178 -6.618
648 HB3 LYS 84 3HB LYS 84 -6.450 7.702 -5.332
649 HG2 LYS 84 2HG LYS 84 -6.953 5.824 -7.647
650 HG3 LYS 84 3HG LYS 84 -5.906 7.218 -7.871
651 HD2 LYS 84 2HD LYS 84 -5.530 5.060 -5.775
652 HD3 LYS 84 3HD LYS 84 -4.624 5.207 -7.288
653 HE2 LYS 84 2HE LYS 84 -4.557 7.069 -4.882
654 HE3 LYS 84 3HE LYS 84 -3.302 5.945 -5.379
655 HZ1 LYS 84 3HZ LYS 84 -2.935 8.313 -6.014
656 HZ2 LYS 84 1HZ LYS 84 -2.851 7.280 -7.300
657 HZ3 LYS 84 2HZ LYS 84 -4.169 8.229 -7.067
658 H VAL 85 H VAL 85 -7.221 6.053 -3.112
659 HA VAL 85 HA VAL 85 -6.643 3.228 -3.533
660 HB VAL 85 HB VAL 85 -6.668 4.991 -1.054
661 HG11 VAL 85 1HG1 VAL 85 -7.263 2.787 -0.175
662 HG12 VAL 85 2HG1 VAL 85 -5.982 2.016 -1.144
663 HG13 VAL 85 3HG1 VAL 85 -5.570 3.115 0.184
664 HG21 VAL 85 3HG2 VAL 85 -4.388 3.460 -2.378
665 HG22 VAL 85 1HG2 VAL 85 -4.776 5.155 -2.754
666 HG23 VAL 85 2HG2 VAL 85 -4.275 4.697 -1.121
667 H LYS 86 H LYS 86 -9.325 4.930 -1.783
668 HA LYS 86 HA LYS 86 -10.721 2.489 -1.160
669 HB2 LYS 86 2HB LYS 86 -11.841 5.299 -1.573
670 HB3 LYS 86 3HB LYS 86 -12.751 3.906 -0.991
671 HG2 LYS 86 2HG LYS 86 -10.746 3.766 0.795
672 HG3 LYS 86 3HG LYS 86 -10.550 5.447 0.361
673 HD2 LYS 86 2HD LYS 86 -11.890 5.254 2.368
674 HD3 LYS 86 3HD LYS 86 -12.889 5.921 1.062
675 HE2 LYS 86 2HE LYS 86 -13.986 3.806 0.726
676 HE3 LYS 86 3HE LYS 86 -12.795 2.960 1.729
677 HZ1 LYS 86 3HZ LYS 86 -14.992 3.433 2.827
678 HZ2 LYS 86 1HZ LYS 86 -13.692 3.893 3.677
679 HZ3 LYS 86 2HZ LYS 86 -14.595 5.017 2.868
680 H LYS 87 H LYS 87 -11.045 4.640 -4.029
681 HA LYS 87 HA LYS 87 -13.026 3.015 -5.324
682 HB2 LYS 87 2HB LYS 87 -12.521 5.337 -5.908
683 HB3 LYS 87 3HB LYS 87 -10.964 4.846 -6.604
684 HG2 LYS 87 2HG LYS 87 -12.062 3.543 -8.324
685 HG3 LYS 87 3HG LYS 87 -13.637 3.679 -7.510
686 HD2 LYS 87 2HD LYS 87 -13.612 6.109 -7.829
687 HD3 LYS 87 3HD LYS 87 -12.072 6.010 -8.697
688 HE2 LYS 87 2HE LYS 87 -14.666 4.626 -9.543
689 HE3 LYS 87 3HE LYS 87 -14.143 6.200 -10.152
690 HZ1 LYS 87 3HZ LYS 87 -12.152 5.124 -11.061
691 HZ2 LYS 87 1HZ LYS 87 -12.653 3.657 -10.533
692 HZ3 LYS 87 2HZ LYS 87 -13.501 4.448 -11.678
693 H THR 88 H THR 88 -9.446 2.861 -5.580
694 HA THR 88 HA THR 88 -9.390 0.737 -7.461
695 HB THR 88 HB THR 88 -7.265 1.482 -5.436
696 HG1 THR 88 1HG THR 88 -7.690 3.186 -6.741
697 HG21 THR 88 1HG2 THR 88 -7.212 -0.072 -8.052
698 HG22 THR 88 2HG2 THR 88 -5.771 0.505 -7.181
699 HG23 THR 88 3HG2 THR 88 -6.823 -0.704 -6.434
700 H ALA 89 H ALA 89 -9.602 0.673 -3.890
701 HA ALA 89 HA ALA 89 -9.202 -2.175 -3.628
702 HB1 ALA 89 1HB ALA 89 -9.964 -1.712 -1.332
703 HB2 ALA 89 2HB ALA 89 -8.759 -0.530 -1.847
704 HB3 ALA 89 3HB ALA 89 -10.482 -0.091 -1.804
705 H GLU 90 H GLU 90 -12.085 -0.020 -3.892
706 HA GLU 90 HA GLU 90 -14.028 -2.123 -3.807
707 HB2 GLU 90 2HB GLU 90 -14.130 0.656 -5.058
708 HB3 GLU 90 3HB GLU 90 -15.507 -0.448 -5.008
709 HG2 GLU 90 2HG GLU 90 -15.339 -0.523 -2.518
710 HG3 GLU 90 3HG GLU 90 -14.059 0.685 -2.593
711 H ALA 91 H ALA 91 -12.189 -0.715 -6.469
712 HA ALA 91 HA ALA 91 -13.433 -2.209 -8.587
713 HB1 ALA 91 1HB ALA 91 -10.808 -0.664 -8.383
714 HB2 ALA 91 2HB ALA 91 -11.571 -1.199 -9.898
715 HB3 ALA 91 3HB ALA 91 -12.374 -0.001 -8.859
716 H GLY 92 H GLY 92 -11.350 -3.328 -6.156
717 HA2 GLY 92 2HA GLY 92 -10.292 -5.340 -5.849
718 HA3 GLY 92 3HA GLY 92 -10.920 -5.897 -7.405
719 H GLY 93 H GLY 93 -8.930 -2.982 -7.179
720 HA2 GLY 93 2HA GLY 93 -6.591 -2.802 -7.359
721 HA3 GLY 93 3HA GLY 93 -6.484 -4.399 -8.085
722 H VAL 94 H VAL 94 -5.410 -1.822 -8.904
723 HA VAL 94 HA VAL 94 -6.120 -2.052 -11.762
724 HB VAL 94 HB VAL 94 -7.270 -0.009 -10.729
725 HG11 VAL 94 1HG1 VAL 94 -5.261 0.784 -9.395
726 HG12 VAL 94 2HG1 VAL 94 -4.504 1.255 -10.924
727 HG13 VAL 94 3HG1 VAL 94 -6.024 2.014 -10.413
728 HG21 VAL 94 3HG2 VAL 94 -5.398 0.490 -13.079
729 HG22 VAL 94 1HG2 VAL 94 -6.961 -0.359 -13.160
730 HG23 VAL 94 2HG2 VAL 94 -6.900 1.349 -12.698
731 H THR 95 H THR 95 -4.400 -1.641 -13.202
732 HA THR 95 HA THR 95 -1.688 -1.567 -11.955
733 HB THR 95 HB THR 95 -0.952 -3.161 -13.675
734 HG1 THR 95 1HG THR 95 -2.546 -4.312 -14.807
735 HG21 THR 95 1HG2 THR 95 -3.307 -4.262 -12.073
736 HG22 THR 95 2HG2 THR 95 -1.872 -5.146 -12.636
737 HG23 THR 95 3HG2 THR 95 -1.716 -3.901 -11.379
738 H GLY 96 H GLY 96 -0.014 -0.629 -13.046
739 HA2 GLY 96 2HA GLY 96 -0.734 1.430 -15.063
740 HA3 GLY 96 3HA GLY 96 0.717 1.374 -14.071
741 H LYS 97 H LYS 97 1.641 1.906 -16.210
742 HA LYS 97 HA LYS 97 2.581 -0.546 -17.639
743 HB2 LYS 97 2HB LYS 97 1.779 2.098 -18.928
744 HB3 LYS 97 3HB LYS 97 2.636 0.788 -19.752
745 HG2 LYS 97 2HG LYS 97 0.723 -0.752 -19.237
746 HG3 LYS 97 3HG LYS 97 -0.178 0.624 -18.588
747 HD2 LYS 97 2HD LYS 97 0.852 0.371 -21.448
748 HD3 LYS 97 3HD LYS 97 -0.806 0.059 -20.916
749 HE2 LYS 97 2HE LYS 97 -0.997 2.419 -20.135
750 HE3 LYS 97 3HE LYS 97 0.642 2.739 -20.717
751 HZ1 LYS 97 3HZ LYS 97 -0.122 2.192 -22.967
752 HZ2 LYS 97 1HZ LYS 97 -1.638 1.901 -22.429
753 HZ3 LYS 97 2HZ LYS 97 -1.019 3.408 -22.353
754 H GLY 98 H GLY 98 4.648 -0.280 -18.701
755 HA2 GLY 98 2HA GLY 98 6.843 0.484 -18.896
756 HA3 GLY 98 3HA GLY 98 6.410 1.945 -18.020
757 H GLN 99 H GLN 99 8.423 1.770 -16.945
758 HA GLN 99 HA GLN 99 8.578 -0.140 -14.660
759 HB2 GLN 99 2HB GLN 99 9.859 -1.002 -16.603
760 HB3 GLN 99 3HB GLN 99 10.783 0.503 -16.663
761 HG2 GLN 99 2HG GLN 99 11.747 -0.002 -14.428
762 HG3 GLN 99 3HG GLN 99 10.786 -1.483 -14.346
763 HE21 GLN 99 2HE2 GLN 99 13.372 -2.061 -14.016
764 HE22 GLN 99 1HE2 GLN 99 14.095 -2.616 -15.525
765 H ASP 100 H ASP 100 9.430 0.749 -12.788
766 HA ASP 100 HA ASP 100 10.651 3.439 -12.810
767 HB2 ASP 100 2HB ASP 100 8.197 3.820 -12.726
768 HB3 ASP 100 3HB ASP 100 8.092 2.792 -11.293
769 H GLY 101 H GLY 101 11.827 3.956 -10.968
770 HA2 GLY 101 2HA GLY 101 13.116 3.576 -9.074
771 HA3 GLY 101 3HA GLY 101 12.124 2.175 -8.684
772 H ILE 102 H ILE 102 14.616 1.754 -8.113
773 HA ILE 102 HA ILE 102 15.518 -0.222 -10.085
774 HB ILE 102 HB ILE 102 16.652 1.744 -10.869
775 HG12 ILE 102 2HG1 ILE 102 18.952 1.055 -10.863
776 HG13 ILE 102 3HG1 ILE 102 18.741 0.094 -9.402
777 HG21 ILE 102 1HG2 ILE 102 16.681 3.114 -8.790
778 HG22 ILE 102 2HG2 ILE 102 17.953 2.061 -8.135
779 HG23 ILE 102 3HG2 ILE 102 18.259 3.036 -9.581
780 HD11 ILE 102 3HD1 ILE 102 17.338 -1.507 -10.590
781 HD12 ILE 102 1HD1 ILE 102 17.335 -0.479 -12.044
782 HD13 ILE 102 2HD1 ILE 102 18.836 -1.262 -11.497
783 H GLY 103 H GLY 103 15.854 -2.046 -9.059
784 HA2 GLY 103 2HA GLY 103 16.399 -2.183 -6.180
785 HA3 GLY 103 3HA GLY 103 16.199 -3.535 -7.298
786 H SER 104 H SER 104 17.966 -4.510 -6.119
787 HA SER 104 HA SER 104 20.661 -3.700 -7.089
788 HB2 SER 104 2HB SER 104 20.233 -2.780 -4.776
789 HB3 SER 104 3HB SER 104 20.124 -4.455 -4.199
790 HG SER 104 HG SER 104 22.253 -3.540 -4.013
791 H LYS 105 H LYS 105 22.293 -5.385 -6.724
792 HA LYS 105 HA LYS 105 21.417 -7.846 -7.962
793 HB2 LYS 105 2HB LYS 105 23.496 -6.719 -8.544
794 HB3 LYS 105 3HB LYS 105 24.127 -6.940 -6.908
795 HG2 LYS 105 2HG LYS 105 24.258 -9.347 -7.205
796 HG3 LYS 105 3HG LYS 105 23.395 -9.250 -8.759
797 HD2 LYS 105 2HD LYS 105 25.243 -8.009 -9.771
798 HD3 LYS 105 3HD LYS 105 26.060 -7.868 -8.213
799 HE2 LYS 105 2HE LYS 105 27.140 -9.546 -9.608
800 HE3 LYS 105 3HE LYS 105 26.488 -10.263 -8.133
801 HZ1 LYS 105 3HZ LYS 105 26.038 -11.566 -10.181
802 HZ2 LYS 105 1HZ LYS 105 24.698 -11.201 -9.351
803 HZ3 LYS 105 2HZ LYS 105 25.063 -10.374 -10.738
804 H ALA 106 H ALA 106 21.018 -9.786 -7.174
805 HA ALA 106 HA ALA 106 22.012 -10.771 -4.634
806 HB1 ALA 106 1HB ALA 106 19.754 -11.320 -3.752
807 HB2 ALA 106 2HB ALA 106 19.991 -9.566 -3.870
808 HB3 ALA 106 3HB ALA 106 19.008 -10.411 -5.086
809 H GLU 107 H GLU 107 22.422 -12.872 -4.887
810 HA GLU 107 HA GLU 107 21.955 -14.049 -7.508
811 HB2 GLU 107 2HB GLU 107 23.471 -15.183 -5.134
812 HB3 GLU 107 3HB GLU 107 23.579 -15.724 -6.809
813 HG2 GLU 107 2HG GLU 107 24.497 -13.031 -5.711
814 HG3 GLU 107 3HG GLU 107 25.513 -14.371 -6.205
815 H LYS 108 H LYS 108 20.342 -14.450 -4.508
816 HA LYS 108 HA LYS 108 18.647 -16.604 -5.588
817 HB2 LYS 108 2HB LYS 108 20.522 -17.757 -4.386
818 HB3 LYS 108 3HB LYS 108 20.062 -16.910 -2.901
819 HG2 LYS 108 2HG LYS 108 17.843 -18.006 -2.952
820 HG3 LYS 108 3HG LYS 108 18.248 -18.783 -4.495
821 HD2 LYS 108 2HD LYS 108 20.113 -19.998 -3.393
822 HD3 LYS 108 3HD LYS 108 19.701 -19.222 -1.847
823 HE2 LYS 108 2HE LYS 108 17.440 -20.246 -1.938
824 HE3 LYS 108 3HE LYS 108 17.838 -21.005 -3.485
825 HZ1 LYS 108 3HZ LYS 108 19.223 -21.558 -0.913
826 HZ2 LYS 108 1HZ LYS 108 18.148 -22.549 -1.637
827 HZ3 LYS 108 2HZ LYS 108 19.590 -22.259 -2.343
Start of MODEL 18
1 H1 MET 1 H1 MET 1 1.194 1.961 27.763
2 H2 MET 1 H2 MET 1 1.429 3.560 28.003
3 H3 MET 1 H3 MET 1 2.643 2.638 27.411
4 HA MET 1 HA MET 1 0.089 3.222 26.069
5 HB2 MET 1 2HB MET 1 1.598 5.177 26.142
6 HB3 MET 1 3HB MET 1 2.853 4.252 25.310
7 HG2 MET 1 2HG MET 1 1.341 3.969 23.362
8 HG3 MET 1 3HG MET 1 0.069 4.847 24.220
9 HE1 MET 1 1HE MET 1 1.064 7.292 21.328
10 HE2 MET 1 2HE MET 1 1.037 5.516 21.263
11 HE3 MET 1 3HE MET 1 -0.255 6.395 22.113
12 H ALA 2 H ALA 2 3.371 2.112 25.029
13 HA ALA 2 HA ALA 2 4.051 0.549 23.590
14 HB1 ALA 2 1HB ALA 2 1.711 -1.123 24.561
15 HB2 ALA 2 2HB ALA 2 3.230 -1.699 23.848
16 HB3 ALA 2 3HB ALA 2 3.248 -0.911 25.430
17 H GLU 3 H GLU 3 3.055 -1.218 21.832
18 HA GLU 3 HA GLU 3 1.256 0.282 19.982
19 HB2 GLU 3 2HB GLU 3 3.971 -0.903 19.278
20 HB3 GLU 3 3HB GLU 3 2.778 -0.322 18.112
21 HG2 GLU 3 2HG GLU 3 2.903 1.954 19.118
22 HG3 GLU 3 3HG GLU 3 4.154 1.386 20.230
23 H SER 4 H SER 4 0.166 -0.980 18.438
24 HA SER 4 HA SER 4 0.369 -3.903 18.434
25 HB2 SER 4 2HB SER 4 -1.098 -3.326 20.416
26 HB3 SER 4 3HB SER 4 -2.245 -2.591 19.281
27 HG SER 4 HG SER 4 -2.720 -4.808 19.791
28 H SER 5 H SER 5 -1.172 -4.852 16.842
29 HA SER 5 HA SER 5 -2.121 -3.008 14.710
30 HB2 SER 5 2HB SER 5 -0.195 -5.320 14.282
31 HB3 SER 5 3HB SER 5 -1.202 -4.643 12.994
32 HG SER 5 HG SER 5 0.795 -3.319 14.519
33 H ASP 6 H ASP 6 -4.048 -3.462 14.022
34 HA ASP 6 HA ASP 6 -5.065 -6.250 14.024
35 HB2 ASP 6 2HB ASP 6 -5.958 -4.912 15.956
36 HB3 ASP 6 3HB ASP 6 -6.681 -3.794 14.800
37 H LYS 7 H LYS 7 -3.754 -4.914 11.908
38 HA LYS 7 HA LYS 7 -5.717 -4.873 9.766
39 HB2 LYS 7 2HB LYS 7 -4.237 -2.785 8.926
40 HB3 LYS 7 3HB LYS 7 -5.797 -2.660 9.715
41 HG2 LYS 7 2HG LYS 7 -4.351 -1.018 10.620
42 HG3 LYS 7 3HG LYS 7 -4.722 -2.194 11.871
43 HD2 LYS 7 2HD LYS 7 -2.487 -3.236 11.578
44 HD3 LYS 7 3HD LYS 7 -2.139 -2.150 10.232
45 HE2 LYS 7 2HE LYS 7 -2.574 -0.202 11.872
46 HE3 LYS 7 3HE LYS 7 -2.590 -1.402 13.164
47 HZ1 LYS 7 3HZ LYS 7 -0.309 -0.758 11.364
48 HZ2 LYS 7 1HZ LYS 7 -0.407 -0.447 12.956
49 HZ3 LYS 7 2HZ LYS 7 -0.282 -1.998 12.481
50 H LEU 8 H LEU 8 -4.857 -5.415 7.842
51 HA LEU 8 HA LEU 8 -2.251 -6.843 7.929
52 HB2 LEU 8 2HB LEU 8 -3.164 -8.438 6.473
53 HB3 LEU 8 3HB LEU 8 -4.207 -8.301 7.875
54 HG LEU 8 HG LEU 8 -4.815 -6.940 5.221
55 HD11 LEU 8 1HD1 LEU 8 -5.771 -9.643 6.255
56 HD12 LEU 8 2HD1 LEU 8 -6.301 -8.847 4.752
57 HD13 LEU 8 3HD1 LEU 8 -4.628 -9.385 4.915
58 HD21 LEU 8 3HD2 LEU 8 -6.199 -5.959 6.907
59 HD22 LEU 8 1HD2 LEU 8 -7.196 -7.109 6.046
60 HD23 LEU 8 2HD2 LEU 8 -6.544 -7.551 7.640
61 H TYR 9 H TYR 9 -3.560 -4.032 6.640
62 HA TYR 9 HA TYR 9 -1.701 -4.151 4.321
63 HB2 TYR 9 2HB TYR 9 -4.408 -2.807 4.262
64 HB3 TYR 9 3HB TYR 9 -3.265 -2.948 2.942
65 HD1 TYR 9 HD2 TYR 9 -2.551 -5.752 2.857
66 HD2 TYR 9 HD1 TYR 9 -6.356 -3.942 3.667
67 HE1 TYR 9 HE2 TYR 9 -3.694 -7.823 2.054
68 HE2 TYR 9 HE1 TYR 9 -7.514 -6.003 2.877
69 HH TYR 9 HH TYR 9 -7.250 -8.016 1.808
70 H ARG 10 H ARG 10 -0.861 -2.148 3.707
71 HA ARG 10 HA ARG 10 -1.134 0.170 5.526
72 HB2 ARG 10 2HB ARG 10 0.745 -0.914 6.459
73 HB3 ARG 10 3HB ARG 10 1.298 -1.481 4.904
74 HG2 ARG 10 2HG ARG 10 2.873 0.120 5.713
75 HG3 ARG 10 3HG ARG 10 2.087 0.763 4.287
76 HD2 ARG 10 2HD ARG 10 2.243 2.571 5.815
77 HD3 ARG 10 3HD ARG 10 0.559 2.085 5.834
78 HE ARG 10 HE ARG 10 0.898 0.993 7.989
79 HH11 ARG 10 1HH2 ARG 10 3.632 3.149 7.153
80 HH12 ARG 10 2HH2 ARG 10 4.089 3.207 8.827
81 HH21 ARG 10 1HH1 ARG 10 1.482 1.311 9.995
82 HH22 ARG 10 2HH1 ARG 10 2.942 2.200 10.394
83 H VAL 11 H VAL 11 -0.880 2.152 4.459
84 HA VAL 11 HA VAL 11 0.278 2.269 1.750
85 HB VAL 11 HB VAL 11 -2.252 1.994 1.600
86 HG11 VAL 11 1HG1 VAL 11 -2.315 4.931 2.410
87 HG12 VAL 11 2HG1 VAL 11 -3.683 3.904 1.958
88 HG13 VAL 11 3HG1 VAL 11 -2.800 3.629 3.476
89 HG21 VAL 11 3HG2 VAL 11 -0.781 2.976 -0.241
90 HG22 VAL 11 1HG2 VAL 11 -2.444 3.583 -0.247
91 HG23 VAL 11 2HG2 VAL 11 -1.123 4.576 0.406
92 H GLU 12 H GLU 12 1.357 4.234 1.326
93 HA GLU 12 HA GLU 12 1.056 6.580 2.961
94 HB2 GLU 12 2HB GLU 12 3.307 6.511 4.024
95 HB3 GLU 12 3HB GLU 12 2.214 5.309 4.686
96 HG2 GLU 12 2HG GLU 12 3.294 3.537 3.348
97 HG3 GLU 12 3HG GLU 12 4.349 4.734 2.585
98 H TYR 13 H TYR 13 2.415 8.276 2.355
99 HA TYR 13 HA TYR 13 3.698 8.136 -0.272
100 HB2 TYR 13 2HB TYR 13 3.798 10.325 1.823
101 HB3 TYR 13 3HB TYR 13 4.204 10.463 0.118
102 HD1 TYR 13 HD1 TYR 13 2.072 9.365 -1.401
103 HD2 TYR 13 HD2 TYR 13 1.784 11.331 2.417
104 HE1 TYR 13 HE1 TYR 13 -0.184 10.232 -2.020
105 HE2 TYR 13 HE2 TYR 13 -0.481 12.176 1.817
106 HH TYR 13 HH TYR 13 -1.929 11.569 -1.412
107 H ALA 14 H ALA 14 5.804 7.761 -0.651
108 HA ALA 14 HA ALA 14 7.509 6.787 1.482
109 HB1 ALA 14 1HB ALA 14 7.946 7.200 -1.504
110 HB2 ALA 14 2HB ALA 14 9.053 6.333 -0.415
111 HB3 ALA 14 3HB ALA 14 7.414 5.712 -0.708
112 H LYS 15 H LYS 15 8.263 8.303 2.881
113 HA LYS 15 HA LYS 15 9.276 10.910 2.055
114 HB2 LYS 15 2HB LYS 15 8.120 10.442 4.215
115 HB3 LYS 15 3HB LYS 15 9.460 9.414 4.707
116 HG2 LYS 15 2HG LYS 15 9.593 11.553 5.804
117 HG3 LYS 15 3HG LYS 15 10.977 11.369 4.732
118 HD2 LYS 15 2HD LYS 15 9.897 12.829 3.050
119 HD3 LYS 15 3HD LYS 15 8.458 12.977 4.063
120 HE2 LYS 15 2HE LYS 15 11.268 13.868 4.870
121 HE3 LYS 15 3HE LYS 15 10.065 14.928 4.133
122 HZ1 LYS 15 3HZ LYS 15 8.609 14.514 6.044
123 HZ2 LYS 15 1HZ LYS 15 9.736 13.561 6.751
124 HZ3 LYS 15 2HZ LYS 15 10.028 15.149 6.532
125 H SER 16 H SER 16 10.709 7.790 2.480
126 HA SER 16 HA SER 16 13.281 8.734 1.440
127 HB2 SER 16 2HB SER 16 13.482 8.797 3.960
128 HB3 SER 16 3HB SER 16 13.248 7.034 3.957
129 HG SER 16 HG SER 16 15.490 7.793 3.864
130 H GLY 17 H GLY 17 14.424 7.112 0.365
131 HA2 GLY 17 2HA GLY 17 12.735 5.018 -0.767
132 HA3 GLY 17 3HA GLY 17 14.355 5.477 -1.299
133 H ARG 18 H ARG 18 12.811 4.070 1.597
134 HA ARG 18 HA ARG 18 15.059 2.108 1.898
135 HB2 ARG 18 2HB ARG 18 13.632 3.729 4.049
136 HB3 ARG 18 3HB ARG 18 14.876 2.518 4.364
137 HG2 ARG 18 2HG ARG 18 15.343 5.031 2.707
138 HG3 ARG 18 3HG ARG 18 15.686 4.900 4.425
139 HD2 ARG 18 2HD ARG 18 17.494 3.462 4.125
140 HD3 ARG 18 3HD ARG 18 16.888 2.825 2.605
141 HE ARG 18 HE ARG 18 17.953 4.456 1.420
142 HH11 ARG 18 1HH2 ARG 18 17.979 5.609 4.740
143 HH12 ARG 18 2HH2 ARG 18 19.096 6.890 4.350
144 HH21 ARG 18 1HH1 ARG 18 19.354 5.971 1.030
145 HH22 ARG 18 2HH1 ARG 18 19.859 7.112 2.261
146 H ALA 19 H ALA 19 12.588 1.585 0.601
147 HA ALA 19 HA ALA 19 11.748 -0.804 2.165
148 HB1 ALA 19 1HB ALA 19 9.441 -0.470 1.303
149 HB2 ALA 19 2HB ALA 19 9.937 0.823 2.409
150 HB3 ALA 19 3HB ALA 19 9.914 1.108 0.651
151 H SER 20 H SER 20 11.186 -2.644 0.829
152 HA SER 20 HA SER 20 12.261 -2.497 -1.952
153 HB2 SER 20 2HB SER 20 12.797 -4.942 -1.563
154 HB3 SER 20 3HB SER 20 13.826 -3.733 -0.800
155 HG SER 20 HG SER 20 13.379 -4.656 1.014
156 H CYS 21 HN CYS 21 11.034 -3.153 -3.579
157 HA CYS 21 HA CYS 21 8.255 -3.829 -3.052
158 HB2 CYS 21 2HB CYS 21 9.001 -2.301 -4.863
159 HB3 CYS 21 3HB CYS 21 9.777 -3.676 -5.669
160 H LYS 22 H LYS 22 7.777 -5.819 -2.402
161 HA LYS 22 HA LYS 22 9.431 -8.130 -2.985
162 HB2 LYS 22 2HB LYS 22 6.623 -8.223 -1.882
163 HB3 LYS 22 3HB LYS 22 7.900 -9.404 -1.652
164 HG2 LYS 22 2HG LYS 22 7.826 -6.595 -0.512
165 HG3 LYS 22 3HG LYS 22 7.440 -8.069 0.352
166 HD2 LYS 22 2HD LYS 22 9.781 -8.878 0.021
167 HD3 LYS 22 3HD LYS 22 10.167 -7.338 -0.801
168 HE2 LYS 22 2HE LYS 22 9.305 -6.193 1.329
169 HE3 LYS 22 3HE LYS 22 9.329 -7.804 2.079
170 HZ1 LYS 22 3HZ LYS 22 11.781 -7.848 1.376
171 HZ2 LYS 22 1HZ LYS 22 11.630 -6.266 1.005
172 HZ3 LYS 22 2HZ LYS 22 11.416 -6.754 2.543
173 H LYS 23 H LYS 23 7.218 -6.655 -4.992
174 HA LYS 23 HA LYS 23 6.318 -9.178 -6.307
175 HB2 LYS 23 2HB LYS 23 4.568 -7.654 -5.590
176 HB3 LYS 23 3HB LYS 23 5.300 -6.332 -6.492
177 HG2 LYS 23 2HG LYS 23 3.325 -7.256 -7.618
178 HG3 LYS 23 3HG LYS 23 4.770 -7.397 -8.617
179 HD2 LYS 23 2HD LYS 23 4.954 -9.798 -8.087
180 HD3 LYS 23 3HD LYS 23 3.596 -9.677 -6.954
181 HE2 LYS 23 2HE LYS 23 2.116 -8.982 -8.810
182 HE3 LYS 23 3HE LYS 23 3.471 -9.082 -9.943
183 HZ1 LYS 23 3HZ LYS 23 3.601 -11.469 -9.476
184 HZ2 LYS 23 1HZ LYS 23 2.363 -11.380 -8.410
185 HZ3 LYS 23 2HZ LYS 23 2.098 -11.094 -9.990
186 H CYS 24 HN CYS 24 7.750 -6.004 -7.279
187 HA CYS 24 HA CYS 24 8.616 -7.332 -9.796
188 HB2 CYS 24 2HB CYS 24 8.587 -5.335 -10.915
189 HB3 CYS 24 3HB CYS 24 7.082 -5.399 -10.004
190 H SER 25 H SER 25 9.959 -6.770 -6.888
191 HA SER 25 HA SER 25 12.019 -6.942 -6.063
192 HB2 SER 25 2HB SER 25 12.794 -8.086 -8.757
193 HB3 SER 25 3HB SER 25 13.660 -8.305 -7.230
194 HG SER 25 HG SER 25 11.887 -9.428 -6.402
195 H GLU 26 H GLU 26 11.421 -4.386 -7.295
196 HA GLU 26 HA GLU 26 14.206 -3.296 -7.479
197 HB2 GLU 26 2HB GLU 26 11.554 -1.902 -8.023
198 HB3 GLU 26 3HB GLU 26 13.162 -1.175 -8.116
199 HG2 GLU 26 2HG GLU 26 13.756 -2.904 -9.875
200 HG3 GLU 26 3HG GLU 26 12.053 -3.367 -9.912
201 H SER 27 H SER 27 14.378 -1.170 -6.143
202 HA SER 27 HA SER 27 12.930 -1.457 -3.546
203 HB2 SER 27 2HB SER 27 15.604 -0.131 -3.921
204 HB3 SER 27 3HB SER 27 14.629 -0.225 -2.431
205 HG SER 27 HG SER 27 15.588 -2.481 -3.883
206 H ILE 28 H ILE 28 11.906 0.279 -2.674
207 HA ILE 28 HA ILE 28 10.583 1.663 -4.827
208 HB ILE 28 HB ILE 28 10.002 1.544 -1.854
209 HG12 ILE 28 2HG1 ILE 28 8.723 -0.010 -4.155
210 HG13 ILE 28 3HG1 ILE 28 9.969 -0.668 -3.101
211 HG21 ILE 28 1HG2 ILE 28 7.728 2.280 -2.435
212 HG22 ILE 28 2HG2 ILE 28 8.885 3.514 -2.902
213 HG23 ILE 28 3HG2 ILE 28 8.178 2.451 -4.137
214 HD11 ILE 28 3HD1 ILE 28 7.168 0.109 -2.261
215 HD12 ILE 28 1HD1 ILE 28 7.910 -1.499 -2.299
216 HD13 ILE 28 2HD1 ILE 28 8.481 -0.297 -1.128
217 HA PRO 29 HA PRO 29 12.866 5.499 -4.105
218 HB2 PRO 29 2HB PRO 29 11.704 7.118 -5.962
219 HB3 PRO 29 3HB PRO 29 12.769 5.753 -6.413
220 HG2 PRO 29 2HG PRO 29 9.732 5.775 -6.279
221 HG3 PRO 29 3HG PRO 29 10.765 5.230 -7.636
222 HD2 PRO 29 2HD PRO 29 9.745 3.494 -5.812
223 HD3 PRO 29 3HD PRO 29 11.389 3.260 -6.489
224 H LYS 30 H LYS 30 12.532 7.635 -3.269
225 HA LYS 30 HA LYS 30 10.073 8.040 -1.711
226 HB2 LYS 30 2HB LYS 30 11.122 9.970 -0.772
227 HB3 LYS 30 3HB LYS 30 12.181 8.577 -0.677
228 HG2 LYS 30 2HG LYS 30 13.573 9.393 -2.473
229 HG3 LYS 30 3HG LYS 30 12.466 10.736 -2.810
230 HD2 LYS 30 2HD LYS 30 13.864 10.342 -0.133
231 HD3 LYS 30 3HD LYS 30 14.555 11.304 -1.442
232 HE2 LYS 30 2HE LYS 30 12.879 12.949 -1.345
233 HE3 LYS 30 3HE LYS 30 11.742 11.904 -0.490
234 HZ1 LYS 30 3HZ LYS 30 14.250 12.893 0.743
235 HZ2 LYS 30 1HZ LYS 30 12.785 13.585 0.961
236 HZ3 LYS 30 2HZ LYS 30 13.035 12.057 1.483
237 H ASP 31 H ASP 31 9.057 10.203 -1.709
238 HA ASP 31 HA ASP 31 7.517 11.510 -2.665
239 HB2 ASP 31 2HB ASP 31 9.576 12.744 -3.338
240 HB3 ASP 31 3HB ASP 31 9.486 11.976 -4.921
241 H SER 32 H SER 32 7.235 8.811 -3.056
242 HA SER 32 HA SER 32 5.380 8.656 -5.370
243 HB2 SER 32 2HB SER 32 7.451 6.556 -4.590
244 HB3 SER 32 3HB SER 32 6.101 6.273 -5.701
245 HG SER 32 HG SER 32 8.131 8.240 -6.044
246 H LEU 33 H LEU 33 3.916 6.636 -5.022
247 HA LEU 33 HA LEU 33 3.099 6.540 -2.161
248 HB2 LEU 33 2HB LEU 33 1.462 7.484 -3.837
249 HB3 LEU 33 3HB LEU 33 1.472 5.916 -4.647
250 HG LEU 33 HG LEU 33 0.715 4.901 -2.418
251 HD11 LEU 33 1HD1 LEU 33 1.279 6.905 -0.978
252 HD12 LEU 33 2HD1 LEU 33 -0.005 7.799 -1.797
253 HD13 LEU 33 3HD1 LEU 33 -0.400 6.380 -0.817
254 HD21 LEU 33 3HD2 LEU 33 -1.165 6.943 -3.659
255 HD22 LEU 33 1HD2 LEU 33 -0.820 5.330 -4.337
256 HD23 LEU 33 2HD2 LEU 33 -1.622 5.476 -2.763
257 H ARG 34 H ARG 34 3.029 4.640 -1.098
258 HA ARG 34 HA ARG 34 3.554 2.096 -2.534
259 HB2 ARG 34 2HB A