Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
9828 | 1oq6 RC | 5768 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 H1 MET 1 -1.995 20.790 16.375
2 2H MET 1 H2 MET 1 -3.503 20.939 15.681
3 3H MET 1 H3 MET 1 -2.957 19.469 16.230
4 HA MET 1 HA MET 1 -2.677 19.434 13.900
5 1HB MET 1 2HB MET 1 -2.701 22.004 13.763
6 2HB MET 1 3HB MET 1 -1.024 21.963 14.319
7 1HG MET 1 2HG MET 1 -0.777 20.287 12.212
8 2HG MET 1 3HG MET 1 -2.199 21.180 11.673
9 1HE MET 1 1HE MET 1 -0.622 24.871 11.678
10 2HE MET 1 2HE MET 1 -2.139 23.950 11.542
11 3HE MET 1 3HE MET 1 -1.321 24.109 13.120
12 H LEU 2 H LEU 2 -1.008 17.874 13.517
13 HA LEU 2 HA LEU 2 1.654 18.437 14.231
14 1HB LEU 2 2HB LEU 2 0.544 17.608 16.488
15 2HB LEU 2 3HB LEU 2 0.727 16.003 15.813
16 HG LEU 2 HG LEU 2 3.008 18.032 16.000
17 1HD1 LEU 2 1HD1 LEU 2 2.101 17.663 18.240
18 2HD1 LEU 2 2HD1 LEU 2 2.211 15.902 18.020
19 3HD1 LEU 2 3HD1 LEU 2 3.686 16.895 18.071
20 1HD2 LEU 2 1HD2 LEU 2 3.450 16.139 14.455
21 2HD2 LEU 2 2HD2 LEU 2 4.444 16.015 15.910
22 3HD2 LEU 2 3HD2 LEU 2 3.008 14.987 15.735
23 H SER 3 H SER 3 -0.156 15.343 14.085
24 HA SER 3 HA SER 3 -0.068 13.595 12.711
25 1HB SER 3 2HB SER 3 -0.086 15.726 10.554
26 2HB SER 3 3HB SER 3 -0.651 14.052 10.409
27 HG SER 3 HG SER 3 -2.291 14.501 11.860
28 H GLU 4 H GLU 4 1.804 12.340 12.706
29 HA GLU 4 HA GLU 4 4.343 13.555 11.768
30 1HB GLU 4 2HB GLU 4 3.603 11.269 13.505
31 2HB GLU 4 3HB GLU 4 5.011 11.070 12.496
32 1HG GLU 4 2HG GLU 4 5.716 13.358 13.456
33 2HG GLU 4 3HG GLU 4 4.517 12.993 14.699
34 H GLN 5 H GLN 5 5.605 11.863 10.334
35 HA GLN 5 HA GLN 5 3.726 10.309 8.649
36 1HB GLN 5 2HB GLN 5 6.055 12.006 7.785
37 2HB GLN 5 3HB GLN 5 5.283 10.865 6.698
38 1HG GLN 5 2HG GLN 5 3.717 13.128 8.069
39 2HG GLN 5 3HG GLN 5 4.632 13.366 6.601
40 1HE2 GLN 5 1HE2 GLN 5 3.288 10.153 6.706
41 2HE2 GLN 5 2HE2 GLN 5 1.981 10.499 5.602
42 H LYS 6 H LYS 6 4.455 8.327 8.206
43 HA LYS 6 HA LYS 6 7.280 7.717 8.517
44 1HB LYS 6 2HB LYS 6 5.099 6.179 10.000
45 2HB LYS 6 3HB LYS 6 6.690 5.522 9.642
46 1HG LYS 6 2HG LYS 6 7.503 7.861 10.789
47 2HG LYS 6 3HG LYS 6 5.918 7.722 11.536
48 1HD LYS 6 2HD LYS 6 7.202 6.556 13.054
49 2HD LYS 6 3HD LYS 6 6.729 5.209 12.023
50 1HE LYS 6 2HE LYS 6 9.363 6.789 12.038
51 2HE LYS 6 3HE LYS 6 9.125 5.104 12.510
52 1HZ LYS 6 1HZ LYS 6 9.019 6.154 9.708
53 2HZ LYS 6 2HZ LYS 6 10.132 5.210 10.368
54 3HZ LYS 6 3HZ LYS 6 8.619 4.634 10.148
55 H GLU 7 H GLU 7 7.865 5.873 7.570
56 HA GLU 7 HA GLU 7 6.496 5.218 5.064
57 1HB GLU 7 2HB GLU 7 9.411 4.672 5.421
58 2HB GLU 7 3HB GLU 7 8.526 5.467 4.128
59 1HG GLU 7 2HG GLU 7 9.943 7.075 4.926
60 2HG GLU 7 3HG GLU 7 8.431 7.540 5.688
61 H ILE 8 H ILE 8 5.489 3.214 5.389
62 HA ILE 8 HA ILE 8 7.004 1.118 6.938
63 HB ILE 8 HB ILE 8 5.173 -0.325 6.705
64 1HG1 ILE 8 2HG1 ILE 8 2.955 0.570 5.945
65 2HG1 ILE 8 3HG1 ILE 8 3.855 1.865 5.103
66 1HG2 ILE 8 1HG2 ILE 8 3.623 0.770 8.107
67 2HG2 ILE 8 2HG2 ILE 8 5.286 1.140 8.611
68 3HG2 ILE 8 3HG2 ILE 8 4.336 2.368 7.741
69 1HD1 ILE 8 1HD1 ILE 8 4.892 0.201 3.697
70 2HD1 ILE 8 2HD1 ILE 8 4.443 -1.090 4.846
71 3HD1 ILE 8 3HD1 ILE 8 3.195 -0.290 3.854
72 H ALA 9 H ALA 9 7.273 -0.983 5.848
73 HA ALA 9 HA ALA 9 7.602 -0.873 2.936
74 1HB ALA 9 1HB ALA 9 9.796 -1.979 3.097
75 2HB ALA 9 2HB ALA 9 9.873 -0.381 3.870
76 3HB ALA 9 3HB ALA 9 9.762 -1.843 4.869
77 H MET 10 H MET 10 6.725 -2.835 2.150
78 HA MET 10 HA MET 10 6.741 -5.206 3.858
79 1HB MET 10 2HB MET 10 4.286 -5.528 3.787
80 2HB MET 10 3HB MET 10 4.761 -4.128 4.765
81 1HG MET 10 2HG MET 10 4.240 -2.685 2.758
82 2HG MET 10 3HG MET 10 3.603 -4.162 1.977
83 1HE MET 10 1HE MET 10 1.495 -2.726 1.410
84 2HE MET 10 2HE MET 10 0.431 -1.993 2.629
85 3HE MET 10 3HE MET 10 2.044 -1.322 2.314
86 H GLN 11 H GLN 11 5.545 -7.043 2.661
87 HA GLN 11 HA GLN 11 6.557 -6.993 -0.132
88 1HB GLN 11 2HB GLN 11 6.047 -9.139 1.975
89 2HB GLN 11 3HB GLN 11 6.034 -9.586 0.277
90 1HG GLN 11 2HG GLN 11 8.335 -8.295 1.804
91 2HG GLN 11 3HG GLN 11 8.248 -9.974 1.248
92 1HE2 GLN 11 1HE2 GLN 11 7.297 -9.792 -1.337
93 2HE2 GLN 11 2HE2 GLN 11 8.190 -8.604 -2.281
94 H VAL 12 H VAL 12 5.279 -8.212 -1.709
95 HA VAL 12 HA VAL 12 2.328 -7.859 -1.387
96 HB VAL 12 HB VAL 12 2.458 -7.418 -3.910
97 1HG1 VAL 12 1HG1 VAL 12 1.733 -5.719 -2.309
98 2HG1 VAL 12 2HG1 VAL 12 3.422 -5.347 -1.904
99 3HG1 VAL 12 3HG1 VAL 12 2.792 -4.974 -3.520
100 1HG2 VAL 12 1HG2 VAL 12 4.443 -6.413 -4.757
101 2HG2 VAL 12 2HG2 VAL 12 5.254 -6.454 -3.186
102 3HG2 VAL 12 3HG2 VAL 12 4.936 -7.969 -4.074
103 H SER 13 H SER 13 1.005 -9.338 -2.591
104 HA SER 13 HA SER 13 2.258 -11.388 -4.232
105 1HB SER 13 2HB SER 13 0.845 -12.029 -1.605
106 2HB SER 13 3HB SER 13 1.050 -13.220 -2.897
107 HG SER 13 HG SER 13 3.343 -11.845 -2.103
108 H GLY 14 H GLY 14 0.493 -12.730 -5.230
109 1HA GLY 14 2HA GLY 14 -1.478 -12.919 -6.395
110 2HA GLY 14 3HA GLY 14 -2.256 -12.031 -5.075
111 H MET 15 H MET 15 -0.275 -11.577 -8.067
112 HA MET 15 HA MET 15 -1.710 -9.079 -8.644
113 1HB MET 15 2HB MET 15 0.277 -7.782 -8.827
114 2HB MET 15 3HB MET 15 0.271 -8.518 -7.211
115 1HG MET 15 2HG MET 15 2.456 -8.912 -7.782
116 2HG MET 15 3HG MET 15 1.747 -10.374 -8.468
117 1HE MET 15 1HE MET 15 4.396 -9.805 -11.178
118 2HE MET 15 2HE MET 15 4.521 -9.841 -9.401
119 3HE MET 15 3HE MET 15 3.466 -11.003 -10.251
120 H THR 16 H THR 16 -1.498 -8.402 -10.843
121 HA THR 16 HA THR 16 -0.887 -10.475 -12.809
122 HB THR 16 HB THR 16 -1.650 -8.327 -14.215
123 HG1 THR 16 1HG THR 16 -2.831 -6.901 -12.932
124 1HG2 THR 16 1HG2 THR 16 -4.020 -8.956 -13.834
125 2HG2 THR 16 2HG2 THR 16 -2.974 -10.376 -14.019
126 3HG2 THR 16 3HG2 THR 16 -3.536 -9.897 -12.402
127 H CYS 17 H CYS 17 -0.050 -7.001 -12.376
128 HA CYS 17 HA CYS 17 2.738 -7.490 -13.196
129 1HB CYS 17 2HB CYS 17 2.311 -5.720 -15.081
130 2HB CYS 17 3HB CYS 17 1.859 -7.409 -15.340
131 H ALA 18 H ALA 18 4.022 -5.616 -13.263
132 HA ALA 18 HA ALA 18 3.808 -4.020 -10.887
133 1HB ALA 18 1HB ALA 18 6.011 -3.204 -11.591
134 2HB ALA 18 2HB ALA 18 5.929 -4.964 -11.820
135 3HB ALA 18 3HB ALA 18 5.779 -3.884 -13.214
136 H ALA 19 H ALA 19 1.604 -3.302 -12.029
137 HA ALA 19 HA ALA 19 1.938 -0.487 -12.872
138 1HB ALA 19 1HB ALA 19 0.529 -2.574 -14.605
139 2HB ALA 19 2HB ALA 19 0.474 -0.814 -14.854
140 3HB ALA 19 3HB ALA 19 2.010 -1.687 -15.014
141 H CYS 20 H CYS 20 -0.411 -3.205 -12.470
142 HA CYS 20 HA CYS 20 -2.520 -1.579 -11.407
143 1HB CYS 20 2HB CYS 20 -1.909 -4.524 -10.825
144 2HB CYS 20 3HB CYS 20 -3.475 -3.702 -10.691
145 H ALA 21 H ALA 21 0.229 -3.302 -10.058
146 HA ALA 21 HA ALA 21 0.214 -2.828 -7.361
147 1HB ALA 21 1HB ALA 21 2.016 -3.873 -8.914
148 2HB ALA 21 2HB ALA 21 2.624 -2.223 -9.116
149 3HB ALA 21 3HB ALA 21 2.577 -2.976 -7.508
150 H ALA 22 H ALA 22 0.636 -0.316 -9.926
151 HA ALA 22 HA ALA 22 1.435 1.739 -8.004
152 1HB ALA 22 1HB ALA 22 1.129 3.271 -9.857
153 2HB ALA 22 2HB ALA 22 2.007 1.840 -10.440
154 3HB ALA 22 3HB ALA 22 0.279 2.046 -10.806
155 H ARG 23 H ARG 23 -1.545 0.780 -9.743
156 HA ARG 23 HA ARG 23 -3.123 2.955 -8.751
157 1HB ARG 23 2HB ARG 23 -3.894 0.286 -9.985
158 2HB ARG 23 3HB ARG 23 -5.065 1.503 -9.463
159 1HG ARG 23 2HG ARG 23 -4.829 2.608 -11.398
160 2HG ARG 23 3HG ARG 23 -3.168 2.982 -10.960
161 1HD ARG 23 2HD ARG 23 -3.061 2.014 -13.082
162 2HD ARG 23 3HD ARG 23 -2.464 0.775 -11.959
163 HE ARG 23 HE ARG 23 -5.232 0.346 -12.259
164 1HH1 ARG 23 2HH2 ARG 23 -2.314 0.177 -14.204
165 2HH1 ARG 23 1HH2 ARG 23 -2.983 -0.838 -15.447
166 1HH2 ARG 23 2HH1 ARG 23 -6.201 -0.970 -13.917
167 2HH2 ARG 23 1HH1 ARG 23 -5.249 -1.520 -15.257
168 H ILE 24 H ILE 24 -2.530 -0.332 -7.402
169 HA ILE 24 HA ILE 24 -4.474 -0.010 -5.374
170 HB ILE 24 HB ILE 24 -3.603 -1.722 -4.149
171 1HG1 ILE 24 2HG1 ILE 24 -0.999 -1.172 -5.463
172 2HG1 ILE 24 3HG1 ILE 24 -1.446 -1.102 -3.741
173 1HG2 ILE 24 1HG2 ILE 24 -3.597 -3.465 -5.700
174 2HG2 ILE 24 2HG2 ILE 24 -4.445 -2.180 -6.564
175 3HG2 ILE 24 3HG2 ILE 24 -2.744 -2.524 -6.933
176 1HD1 ILE 24 1HD1 ILE 24 -1.711 -3.555 -3.729
177 2HD1 ILE 24 2HD1 ILE 24 -1.147 -3.582 -5.429
178 3HD1 ILE 24 3HD1 ILE 24 -0.057 -3.046 -4.147
179 H GLU 25 H GLU 25 -0.977 0.779 -5.043
180 HA GLU 25 HA GLU 25 -1.165 2.159 -2.622
181 1HB GLU 25 2HB GLU 25 0.743 2.157 -4.934
182 2HB GLU 25 3HB GLU 25 0.858 3.515 -3.803
183 1HG GLU 25 2HG GLU 25 2.334 1.608 -3.180
184 2HG GLU 25 3HG GLU 25 1.180 2.023 -1.909
185 H LYS 26 H LYS 26 -1.727 3.454 -5.889
186 HA LYS 26 HA LYS 26 -1.780 6.199 -4.950
187 1HB LYS 26 2HB LYS 26 -2.481 4.928 -7.587
188 2HB LYS 26 3HB LYS 26 -3.034 6.555 -7.201
189 1HG LYS 26 2HG LYS 26 -1.033 6.907 -8.325
190 2HG LYS 26 3HG LYS 26 -0.640 7.202 -6.620
191 1HD LYS 26 2HD LYS 26 0.476 5.092 -6.426
192 2HD LYS 26 3HD LYS 26 -0.125 4.611 -8.029
193 1HE LYS 26 2HE LYS 26 1.208 6.182 -9.198
194 2HE LYS 26 3HE LYS 26 1.592 7.095 -7.730
195 1HZ LYS 26 1HZ LYS 26 2.934 5.319 -6.977
196 2HZ LYS 26 2HZ LYS 26 2.538 4.362 -8.263
197 3HZ LYS 26 3HZ LYS 26 3.415 5.735 -8.493
198 H GLY 27 H GLY 27 -4.303 3.745 -5.666
199 1HA GLY 27 2HA GLY 27 -6.573 5.340 -4.936
200 2HA GLY 27 3HA GLY 27 -6.445 3.569 -4.891
201 H LEU 28 H LEU 28 -4.289 3.251 -3.121
202 HA LEU 28 HA LEU 28 -5.735 3.304 -0.680
203 1HB LEU 28 2HB LEU 28 -4.132 1.599 -1.159
204 2HB LEU 28 3HB LEU 28 -2.812 2.755 -1.261
205 HG LEU 28 HG LEU 28 -3.000 1.260 0.802
206 1HD1 LEU 28 1HD1 LEU 28 -2.024 2.950 2.245
207 2HD1 LEU 28 2HD1 LEU 28 -1.503 3.265 0.586
208 3HD1 LEU 28 3HD1 LEU 28 -2.785 4.242 1.329
209 1HD2 LEU 28 1HD2 LEU 28 -5.276 1.435 1.329
210 2HD2 LEU 28 2HD2 LEU 28 -4.405 2.205 2.660
211 3HD2 LEU 28 3HD2 LEU 28 -5.263 3.187 1.515
212 H LYS 29 H LYS 29 -3.135 5.448 -1.904
213 HA LYS 29 HA LYS 29 -2.731 7.154 0.206
214 1HB LYS 29 2HB LYS 29 -1.768 7.342 -2.123
215 2HB LYS 29 3HB LYS 29 -3.292 8.114 -2.598
216 1HG LYS 29 2HG LYS 29 -2.796 9.793 -0.625
217 2HG LYS 29 3HG LYS 29 -1.172 9.143 -0.674
218 1HD LYS 29 2HD LYS 29 -2.643 10.241 -3.121
219 2HD LYS 29 3HD LYS 29 -1.757 11.290 -2.001
220 1HE LYS 29 2HE LYS 29 0.309 10.485 -2.530
221 2HE LYS 29 3HE LYS 29 -0.267 8.920 -3.152
222 1HZ LYS 29 1HZ LYS 29 -1.048 10.124 -5.074
223 2HZ LYS 29 2HZ LYS 29 -0.518 11.555 -4.431
224 3HZ LYS 29 3HZ LYS 29 0.569 10.379 -4.802
225 H ARG 30 H ARG 30 -5.771 6.828 -1.590
226 HA ARG 30 HA ARG 30 -6.730 9.404 -0.807
227 1HB ARG 30 2HB ARG 30 -7.236 7.897 -2.866
228 2HB ARG 30 3HB ARG 30 -8.465 7.139 -1.858
229 1HG ARG 30 2HG ARG 30 -8.448 10.145 -1.922
230 2HG ARG 30 3HG ARG 30 -8.747 9.377 -3.473
231 1HD ARG 30 2HD ARG 30 -10.700 8.314 -2.791
232 2HD ARG 30 3HD ARG 30 -10.353 8.445 -1.074
233 HE ARG 30 HE ARG 30 -11.554 10.449 -2.823
234 1HH1 ARG 30 2HH2 ARG 30 -9.770 9.969 0.234
235 2HH1 ARG 30 1HH2 ARG 30 -10.263 11.482 0.913
236 1HH2 ARG 30 2HH1 ARG 30 -12.154 12.493 -1.936
237 2HH2 ARG 30 1HH1 ARG 30 -11.636 12.950 -0.347
238 H MET 31 H MET 31 -6.352 6.679 1.177
239 HA MET 31 HA MET 31 -8.740 7.084 2.818
240 1HB MET 31 2HB MET 31 -6.513 5.136 2.512
241 2HB MET 31 3HB MET 31 -6.831 5.502 4.185
242 1HG MET 31 2HG MET 31 -8.095 3.584 3.267
243 2HG MET 31 3HG MET 31 -9.125 4.824 3.980
244 1HE MET 31 1HE MET 31 -10.431 2.653 2.646
245 2HE MET 31 2HE MET 31 -11.362 4.095 3.090
246 3HE MET 31 3HE MET 31 -11.551 3.397 1.465
247 HA PRO 32 HA PRO 32 -7.093 10.044 5.565
248 1HB PRO 32 2HB PRO 32 -7.806 9.279 8.086
249 2HB PRO 32 3HB PRO 32 -9.006 9.741 6.846
250 1HG PRO 32 2HG PRO 32 -8.098 6.952 7.591
251 2HG PRO 32 3HG PRO 32 -9.779 7.541 7.433
252 1HD PRO 32 2HD PRO 32 -8.489 6.215 5.460
253 2HD PRO 32 3HD PRO 32 -9.632 7.524 5.049
254 H GLY 33 H GLY 33 -5.475 10.501 7.264
255 1HA GLY 33 2HA GLY 33 -3.430 10.340 8.154
256 2HA GLY 33 3HA GLY 33 -3.671 8.597 8.271
257 H VAL 34 H VAL 34 -3.926 8.160 5.331
258 HA VAL 34 HA VAL 34 -1.118 8.059 4.705
259 HB VAL 34 HB VAL 34 -3.436 7.623 2.840
260 1HG1 VAL 34 1HG1 VAL 34 -0.512 6.619 2.986
261 2HG1 VAL 34 2HG1 VAL 34 -1.669 6.036 1.802
262 3HG1 VAL 34 3HG1 VAL 34 -1.162 7.725 1.768
263 1HG2 VAL 34 1HG2 VAL 34 -2.161 5.648 4.785
264 2HG2 VAL 34 2HG2 VAL 34 -3.858 6.166 4.739
265 3HG2 VAL 34 3HG2 VAL 34 -3.214 5.187 3.432
266 H THR 35 H THR 35 0.067 9.245 3.269
267 HA THR 35 HA THR 35 -1.260 11.625 2.059
268 HB THR 35 HB THR 35 0.670 11.592 4.246
269 HG1 THR 35 1HG THR 35 -1.399 12.570 4.164
270 1HG2 THR 35 1HG2 THR 35 1.839 13.646 3.489
271 2HG2 THR 35 2HG2 THR 35 2.336 12.172 2.643
272 3HG2 THR 35 3HG2 THR 35 1.252 13.355 1.842
273 H ASP 36 H ASP 36 1.538 9.309 1.928
274 HA ASP 36 HA ASP 36 1.067 9.474 -0.868
275 1HB ASP 36 2HB ASP 36 3.222 11.023 -0.114
276 2HB ASP 36 3HB ASP 36 4.003 9.477 -0.470
277 H ALA 37 H ALA 37 2.357 7.866 -2.077
278 HA ALA 37 HA ALA 37 2.939 5.444 -0.586
279 1HB ALA 37 1HB ALA 37 1.043 4.101 -1.330
280 2HB ALA 37 2HB ALA 37 0.445 5.488 -0.418
281 3HB ALA 37 3HB ALA 37 0.351 5.496 -2.192
282 H ASN 38 H ASN 38 4.043 3.889 -1.809
283 HA ASN 38 HA ASN 38 4.595 4.570 -4.640
284 1HB ASN 38 2HB ASN 38 7.152 4.373 -3.473
285 2HB ASN 38 3HB ASN 38 6.391 5.782 -4.186
286 1HD2 ASN 38 1HD2 ASN 38 5.906 4.125 -0.992
287 2HD2 ASN 38 2HD2 ASN 38 6.281 5.578 -0.066
288 H VAL 39 H VAL 39 4.251 2.597 -5.447
289 HA VAL 39 HA VAL 39 5.007 0.234 -3.939
290 HB VAL 39 HB VAL 39 3.014 0.462 -5.392
291 1HG1 VAL 39 1HG1 VAL 39 4.072 1.559 -7.379
292 2HG1 VAL 39 2HG1 VAL 39 4.926 0.041 -7.741
293 3HG1 VAL 39 3HG1 VAL 39 3.179 0.089 -7.793
294 1HG2 VAL 39 1HG2 VAL 39 4.510 -1.879 -6.431
295 2HG2 VAL 39 2HG2 VAL 39 4.323 -1.751 -4.671
296 3HG2 VAL 39 3HG2 VAL 39 2.892 -1.770 -5.698
297 H ASN 40 H ASN 40 7.049 -0.714 -3.939
298 HA ASN 40 HA ASN 40 9.058 0.349 -5.878
299 1HB ASN 40 2HB ASN 40 9.453 0.809 -3.460
300 2HB ASN 40 3HB ASN 40 9.496 -0.935 -3.159
301 1HD2 ASN 40 1HD2 ASN 40 11.728 0.131 -2.364
302 2HD2 ASN 40 2HD2 ASN 40 13.021 0.016 -3.548
303 H LEU 41 H LEU 41 7.488 -1.226 -7.058
304 HA LEU 41 HA LEU 41 7.752 -4.015 -6.574
305 1HB LEU 41 2HB LEU 41 6.061 -2.387 -8.052
306 2HB LEU 41 3HB LEU 41 6.950 -3.198 -9.323
307 HG LEU 41 HG LEU 41 4.772 -4.219 -8.636
308 1HD1 LEU 41 1HD1 LEU 41 7.123 -6.109 -8.170
309 2HD1 LEU 41 2HD1 LEU 41 5.492 -6.537 -8.715
310 3HD1 LEU 41 3HD1 LEU 41 6.560 -5.581 -9.760
311 1HD2 LEU 41 1HD2 LEU 41 6.014 -5.436 -6.190
312 2HD2 LEU 41 2HD2 LEU 41 5.269 -3.846 -6.068
313 3HD2 LEU 41 3HD2 LEU 41 4.315 -5.220 -6.650
314 H ALA 42 H ALA 42 9.767 -1.776 -8.248
315 HA ALA 42 HA ALA 42 11.339 -3.319 -9.955
316 1HB ALA 42 1HB ALA 42 11.697 -0.902 -9.504
317 2HB ALA 42 2HB ALA 42 12.255 -1.306 -7.858
318 3HB ALA 42 3HB ALA 42 13.187 -1.846 -9.264
319 H THR 43 H THR 43 11.217 -3.340 -6.368
320 HA THR 43 HA THR 43 12.866 -5.815 -6.466
321 HB THR 43 HB THR 43 14.276 -4.023 -5.681
322 HG1 THR 43 1HG THR 43 13.463 -6.015 -3.872
323 1HG2 THR 43 1HG2 THR 43 12.324 -3.685 -3.358
324 2HG2 THR 43 2HG2 THR 43 13.917 -2.930 -3.518
325 3HG2 THR 43 3HG2 THR 43 12.629 -2.514 -4.657
326 H GLU 44 H GLU 44 10.098 -5.593 -6.746
327 HA GLU 44 HA GLU 44 8.135 -6.414 -6.000
328 1HB GLU 44 2HB GLU 44 10.174 -8.338 -4.807
329 2HB GLU 44 3HB GLU 44 8.447 -8.690 -4.965
330 1HG GLU 44 2HG GLU 44 8.518 -8.432 -7.384
331 2HG GLU 44 3HG GLU 44 10.227 -7.965 -7.326
332 H THR 45 H THR 45 9.023 -4.236 -4.233
333 HA THR 45 HA THR 45 7.886 -5.089 -1.607
334 HB THR 45 HB THR 45 10.090 -3.098 -2.327
335 HG1 THR 45 1HG THR 45 10.656 -5.377 -2.371
336 1HG2 THR 45 1HG2 THR 45 8.963 -3.930 0.368
337 2HG2 THR 45 2HG2 THR 45 10.461 -3.007 0.134
338 3HG2 THR 45 3HG2 THR 45 8.917 -2.293 -0.350
339 H VAL 46 H VAL 46 6.672 -3.315 -0.520
340 HA VAL 46 HA VAL 46 5.920 -1.031 -2.297
341 HB VAL 46 HB VAL 46 4.099 -2.600 -2.450
342 1HG1 VAL 46 1HG1 VAL 46 4.475 -3.942 -0.401
343 2HG1 VAL 46 2HG1 VAL 46 3.991 -2.520 0.560
344 3HG1 VAL 46 3HG1 VAL 46 2.820 -3.336 -0.495
345 1HG2 VAL 46 1HG2 VAL 46 3.384 -0.364 -0.487
346 2HG2 VAL 46 2HG2 VAL 46 3.474 -0.227 -2.259
347 3HG2 VAL 46 3HG2 VAL 46 2.281 -1.304 -1.488
348 H ASN 47 H ASN 47 5.641 0.990 -1.264
349 HA ASN 47 HA ASN 47 6.288 1.061 1.632
350 1HB ASN 47 2HB ASN 47 7.471 2.664 -0.682
351 2HB ASN 47 3HB ASN 47 7.493 3.248 0.985
352 1HD2 ASN 47 1HD2 ASN 47 8.475 1.697 2.647
353 2HD2 ASN 47 2HD2 ASN 47 10.009 1.023 2.124
354 H VAL 48 H VAL 48 5.085 2.683 2.752
355 HA VAL 48 HA VAL 48 3.039 4.160 1.206
356 HB VAL 48 HB VAL 48 2.509 2.257 3.517
357 1HG1 VAL 48 1HG1 VAL 48 0.498 3.983 2.056
358 2HG1 VAL 48 2HG1 VAL 48 0.238 2.896 3.450
359 3HG1 VAL 48 3HG1 VAL 48 1.175 4.376 3.645
360 1HG2 VAL 48 1HG2 VAL 48 2.671 1.031 1.410
361 2HG2 VAL 48 2HG2 VAL 48 0.983 1.128 1.921
362 3HG2 VAL 48 3HG2 VAL 48 1.573 2.186 0.624
363 H ILE 49 H ILE 49 3.070 6.209 1.934
364 HA ILE 49 HA ILE 49 4.660 6.842 4.304
365 HB ILE 49 HB ILE 49 3.838 8.711 2.047
366 1HG1 ILE 49 2HG1 ILE 49 5.081 6.992 0.945
367 2HG1 ILE 49 3HG1 ILE 49 6.038 8.460 1.062
368 1HG2 ILE 49 1HG2 ILE 49 5.766 10.041 2.852
369 2HG2 ILE 49 2HG2 ILE 49 4.491 9.862 4.064
370 3HG2 ILE 49 3HG2 ILE 49 5.973 8.902 4.201
371 1HD1 ILE 49 1HD1 ILE 49 7.294 7.489 2.992
372 2HD1 ILE 49 2HD1 ILE 49 6.366 5.983 2.806
373 3HD1 ILE 49 3HD1 ILE 49 7.446 6.529 1.513
374 H TYR 50 H TYR 50 3.212 7.011 6.049
375 HA TYR 50 HA TYR 50 0.763 8.659 5.724
376 1HB TYR 50 2HB TYR 50 -0.689 6.962 6.606
377 2HB TYR 50 3HB TYR 50 0.132 6.295 5.209
378 HD1 TYR 50 HD1 TYR 50 2.105 4.686 5.602
379 HD2 TYR 50 HD2 TYR 50 -0.628 5.887 8.691
380 HE1 TYR 50 HE1 TYR 50 2.324 2.489 6.688
381 HE2 TYR 50 HE2 TYR 50 -0.067 3.846 9.970
382 HH TYR 50 HH TYR 50 1.047 1.849 9.963
383 H ASP 51 H ASP 51 -0.410 8.768 7.826
384 HA ASP 51 HA ASP 51 1.592 9.352 9.977
385 1HB ASP 51 2HB ASP 51 0.152 11.197 9.616
386 2HB ASP 51 3HB ASP 51 -1.276 10.175 9.680
387 HA PRO 52 HA PRO 52 0.099 5.388 11.501
388 1HB PRO 52 2HB PRO 52 2.075 4.683 13.177
389 2HB PRO 52 3HB PRO 52 2.333 4.795 11.419
390 1HG PRO 52 2HG PRO 52 2.918 6.944 13.499
391 2HG PRO 52 3HG PRO 52 4.043 6.295 12.271
392 1HD PRO 52 2HD PRO 52 2.585 8.588 11.877
393 2HD PRO 52 3HD PRO 52 2.940 7.459 10.534
394 H ALA 53 H ALA 53 -0.457 8.297 12.963
395 HA ALA 53 HA ALA 53 -1.427 7.056 15.484
396 1HB ALA 53 1HB ALA 53 -1.984 9.286 16.135
397 2HB ALA 53 2HB ALA 53 -0.300 9.301 15.563
398 3HB ALA 53 3HB ALA 53 -1.604 9.934 14.534
399 H GLU 54 H GLU 54 -2.311 8.243 12.242
400 HA GLU 54 HA GLU 54 -5.181 8.188 12.946
401 1HB GLU 54 2HB GLU 54 -3.728 10.114 11.696
402 2HB GLU 54 3HB GLU 54 -4.238 9.182 10.292
403 1HG GLU 54 2HG GLU 54 -6.627 9.383 11.137
404 2HG GLU 54 3HG GLU 54 -6.006 10.464 12.397
405 H THR 55 H THR 55 -2.942 7.120 10.377
406 HA THR 55 HA THR 55 -4.540 4.711 10.071
407 HB THR 55 HB THR 55 -2.695 4.307 8.053
408 HG1 THR 55 1HG THR 55 -3.825 6.689 7.470
409 1HG2 THR 55 1HG2 THR 55 -5.507 5.522 8.085
410 2HG2 THR 55 2HG2 THR 55 -4.686 4.802 6.672
411 3HG2 THR 55 3HG2 THR 55 -5.121 3.765 8.064
412 H GLY 56 H GLY 56 -3.030 2.912 9.388
413 1HA GLY 56 2HA GLY 56 -0.948 2.085 11.111
414 2HA GLY 56 3HA GLY 56 -2.546 1.554 11.704
415 H THR 57 H THR 57 -2.501 -0.588 10.963
416 HA THR 57 HA THR 57 -1.767 -1.349 8.223
417 HB THR 57 HB THR 57 -2.343 -3.617 9.237
418 HG1 THR 57 1HG THR 57 -3.072 -3.619 11.253
419 1HG2 THR 57 1HG2 THR 57 0.002 -2.746 9.141
420 2HG2 THR 57 2HG2 THR 57 -0.222 -1.930 10.698
421 3HG2 THR 57 3HG2 THR 57 -0.268 -3.702 10.611
422 H ALA 58 H ALA 58 -4.426 -0.762 10.427
423 HA ALA 58 HA ALA 58 -6.345 -2.334 9.550
424 1HB ALA 58 1HB ALA 58 -6.543 -0.923 11.534
425 2HB ALA 58 2HB ALA 58 -6.760 0.515 10.514
426 3HB ALA 58 3HB ALA 58 -7.990 -0.767 10.520
427 H ALA 59 H ALA 59 -6.012 0.903 8.316
428 HA ALA 59 HA ALA 59 -8.380 0.560 6.567
429 1HB ALA 59 1HB ALA 59 -7.914 2.765 5.725
430 2HB ALA 59 2HB ALA 59 -7.708 2.799 7.490
431 3HB ALA 59 3HB ALA 59 -6.281 2.753 6.414
432 H ILE 60 H ILE 60 -4.897 0.347 6.330
433 HA ILE 60 HA ILE 60 -4.689 0.185 3.510
434 HB ILE 60 HB ILE 60 -2.927 -0.373 5.918
435 1HG1 ILE 60 2HG1 ILE 60 -1.394 1.077 4.538
436 2HG1 ILE 60 3HG1 ILE 60 -2.662 1.098 3.307
437 1HG2 ILE 60 1HG2 ILE 60 -2.417 -2.363 4.559
438 2HG2 ILE 60 2HG2 ILE 60 -2.146 -1.320 3.141
439 3HG2 ILE 60 3HG2 ILE 60 -1.099 -1.198 4.579
440 1HD1 ILE 60 1HD1 ILE 60 -2.932 2.121 6.196
441 2HD1 ILE 60 2HD1 ILE 60 -2.544 3.153 4.812
442 3HD1 ILE 60 3HD1 ILE 60 -4.126 2.370 4.907
443 H GLN 61 H GLN 61 -5.010 -2.376 6.007
444 HA GLN 61 HA GLN 61 -4.812 -4.510 4.089
445 1HB GLN 61 2HB GLN 61 -5.308 -4.264 6.957
446 2HB GLN 61 3HB GLN 61 -6.460 -5.364 6.201
447 1HG GLN 61 2HG GLN 61 -4.781 -6.787 6.821
448 2HG GLN 61 3HG GLN 61 -4.482 -6.554 5.101
449 1HE2 GLN 61 1HE2 GLN 61 -3.338 -3.687 6.006
450 2HE2 GLN 61 2HE2 GLN 61 -1.710 -4.143 6.479
451 H GLU 62 H GLU 62 -7.603 -2.780 5.579
452 HA GLU 62 HA GLU 62 -9.735 -4.056 4.282
453 1HB GLU 62 2HB GLU 62 -9.185 -1.300 5.386
454 2HB GLU 62 3HB GLU 62 -10.547 -1.441 4.291
455 1HG GLU 62 2HG GLU 62 -11.418 -3.344 5.722
456 2HG GLU 62 3HG GLU 62 -10.153 -2.930 6.900
457 H LYS 63 H LYS 63 -7.842 -1.226 3.084
458 HA LYS 63 HA LYS 63 -9.225 -1.104 0.632
459 1HB LYS 63 2HB LYS 63 -6.775 0.022 1.889
460 2HB LYS 63 3HB LYS 63 -6.778 0.060 0.152
461 1HG LYS 63 2HG LYS 63 -9.134 1.119 1.730
462 2HG LYS 63 3HG LYS 63 -7.685 2.082 1.487
463 1HD LYS 63 2HD LYS 63 -9.185 2.765 -0.237
464 2HD LYS 63 3HD LYS 63 -7.834 1.916 -0.944
465 1HE LYS 63 2HE LYS 63 -9.924 1.328 -2.066
466 2HE LYS 63 3HE LYS 63 -9.224 -0.091 -1.302
467 1HZ LYS 63 1HZ LYS 63 -10.787 0.232 0.529
468 2HZ LYS 63 2HZ LYS 63 -11.447 1.531 -0.237
469 3HZ LYS 63 3HZ LYS 63 -11.562 0.031 -0.902
470 H ILE 64 H ILE 64 -6.157 -2.702 1.533
471 HA ILE 64 HA ILE 64 -5.038 -3.305 -0.872
472 HB ILE 64 HB ILE 64 -5.046 -4.319 1.886
473 1HG1 ILE 64 2HG1 ILE 64 -3.636 -2.454 0.869
474 2HG1 ILE 64 3HG1 ILE 64 -2.853 -3.671 1.877
475 1HG2 ILE 64 1HG2 ILE 64 -4.003 -6.062 -0.310
476 2HG2 ILE 64 2HG2 ILE 64 -3.525 -6.165 1.409
477 3HG2 ILE 64 3HG2 ILE 64 -5.197 -6.451 0.957
478 1HD1 ILE 64 1HD1 ILE 64 -1.544 -3.157 -0.125
479 2HD1 ILE 64 2HD1 ILE 64 -2.059 -4.858 -0.062
480 3HD1 ILE 64 3HD1 ILE 64 -2.873 -3.726 -1.164
481 H GLU 65 H GLU 65 -7.408 -5.240 1.059
482 HA GLU 65 HA GLU 65 -7.909 -7.323 -0.786
483 1HB GLU 65 2HB GLU 65 -9.646 -6.010 1.355
484 2HB GLU 65 3HB GLU 65 -10.127 -7.469 0.479
485 1HG GLU 65 2HG GLU 65 -7.449 -7.453 1.867
486 2HG GLU 65 3HG GLU 65 -8.929 -7.639 2.815
487 H LYS 66 H LYS 66 -9.812 -4.324 -0.237
488 HA LYS 66 HA LYS 66 -11.661 -4.762 -2.314
489 1HB LYS 66 2HB LYS 66 -10.900 -2.555 -0.530
490 2HB LYS 66 3HB LYS 66 -11.365 -1.940 -2.114
491 1HG LYS 66 2HG LYS 66 -13.055 -3.940 -0.560
492 2HG LYS 66 3HG LYS 66 -13.227 -2.192 -0.375
493 1HD LYS 66 2HD LYS 66 -13.669 -1.947 -2.812
494 2HD LYS 66 3HD LYS 66 -13.534 -3.700 -3.020
495 1HE LYS 66 2HE LYS 66 -15.442 -4.039 -1.453
496 2HE LYS 66 3HE LYS 66 -15.582 -2.287 -1.235
497 1HZ LYS 66 1HZ LYS 66 -16.099 -2.100 -3.576
498 2HZ LYS 66 2HZ LYS 66 -15.964 -3.728 -3.779
499 3HZ LYS 66 3HZ LYS 66 -17.154 -3.112 -2.829
500 H LEU 67 H LEU 67 -8.458 -3.354 -2.498
501 HA LEU 67 HA LEU 67 -8.634 -2.365 -5.212
502 1HB LEU 67 2HB LEU 67 -6.351 -2.920 -3.305
503 2HB LEU 67 3HB LEU 67 -6.113 -2.249 -4.916
504 HG LEU 67 HG LEU 67 -8.034 -0.948 -2.955
505 1HD1 LEU 67 1HD1 LEU 67 -5.869 -1.119 -1.823
506 2HD1 LEU 67 2HD1 LEU 67 -5.076 -0.373 -3.205
507 3HD1 LEU 67 3HD1 LEU 67 -6.241 0.560 -2.257
508 1HD2 LEU 67 1HD2 LEU 67 -6.672 -0.058 -5.507
509 2HD2 LEU 67 2HD2 LEU 67 -8.390 -0.053 -5.096
510 3HD2 LEU 67 3HD2 LEU 67 -7.297 1.105 -4.326
511 H GLY 68 H GLY 68 -8.248 -5.526 -3.815
512 1HA GLY 68 2HA GLY 68 -8.297 -7.523 -4.938
513 2HA GLY 68 3HA GLY 68 -7.970 -6.714 -6.478
514 H TYR 69 H TYR 69 -6.170 -6.610 -3.334
515 HA TYR 69 HA TYR 69 -3.861 -8.030 -4.583
516 1HB TYR 69 2HB TYR 69 -4.046 -5.214 -4.034
517 2HB TYR 69 3HB TYR 69 -2.998 -5.898 -2.817
518 HD1 TYR 69 HD1 TYR 69 -0.729 -6.340 -3.359
519 HD2 TYR 69 HD2 TYR 69 -3.641 -5.938 -6.513
520 HE1 TYR 69 HE1 TYR 69 1.069 -5.973 -4.993
521 HE2 TYR 69 HE2 TYR 69 -1.850 -5.764 -8.160
522 HH TYR 69 HH TYR 69 0.462 -5.590 -8.493
523 H HIS 70 H HIS 70 -2.227 -8.561 -2.777
524 HA HIS 70 HA HIS 70 -3.276 -8.277 -0.084
525 1HB HIS 70 2HB HIS 70 -4.057 -10.567 -0.991
526 2HB HIS 70 3HB HIS 70 -2.358 -11.046 -0.913
527 HD1 HIS 70 1HD HIS 70 -4.290 -8.954 1.741
528 HD2 HIS 70 2HD HIS 70 -2.690 -12.790 1.096
529 HE1 HIS 70 1HE HIS 70 -4.469 -10.199 3.955
530 H VAL 71 H VAL 71 -1.620 -7.799 1.354
531 HA VAL 71 HA VAL 71 1.121 -7.870 0.291
532 HB VAL 71 HB VAL 71 1.517 -6.294 2.174
533 1HG1 VAL 71 1HG1 VAL 71 1.600 -5.292 0.130
534 2HG1 VAL 71 2HG1 VAL 71 -0.058 -5.712 -0.304
535 3HG1 VAL 71 3HG1 VAL 71 0.245 -4.397 0.846
536 1HG2 VAL 71 1HG2 VAL 71 -0.563 -6.770 3.487
537 2HG2 VAL 71 2HG2 VAL 71 -0.279 -5.052 3.172
538 3HG2 VAL 71 3HG2 VAL 71 -1.492 -5.919 2.232
539 H VAL 72 H VAL 72 2.800 -8.303 1.866
540 HA VAL 72 HA VAL 72 2.061 -10.434 3.800
541 HB VAL 72 HB VAL 72 4.362 -10.617 1.923
542 1HG1 VAL 72 1HG1 VAL 72 4.550 -11.898 4.053
543 2HG1 VAL 72 2HG1 VAL 72 3.004 -12.692 3.697
544 3HG1 VAL 72 3HG1 VAL 72 4.416 -12.971 2.657
545 1HG2 VAL 72 1HG2 VAL 72 2.377 -10.799 0.506
546 2HG2 VAL 72 2HG2 VAL 72 3.038 -12.416 0.753
547 3HG2 VAL 72 3HG2 VAL 72 1.609 -11.901 1.672
548 H ILE 73 H ILE 73 3.329 -10.465 5.603
549 HA ILE 73 HA ILE 73 5.172 -8.149 6.051
550 HB ILE 73 HB ILE 73 3.212 -9.381 7.986
551 1HG1 ILE 73 2HG1 ILE 73 2.067 -8.016 6.248
552 2HG1 ILE 73 3HG1 ILE 73 1.989 -7.358 7.873
553 1HG2 ILE 73 1HG2 ILE 73 5.168 -8.575 9.170
554 2HG2 ILE 73 2HG2 ILE 73 5.196 -7.073 8.249
555 3HG2 ILE 73 3HG2 ILE 73 3.877 -7.398 9.398
556 1HD1 ILE 73 1HD1 ILE 73 2.363 -5.624 6.135
557 2HD1 ILE 73 2HD1 ILE 73 3.623 -5.640 7.377
558 3HD1 ILE 73 3HD1 ILE 73 3.935 -6.357 5.784
559 H GLU 74 H GLU 74 6.839 -9.768 5.260
560 HA GLU 74 HA GLU 74 7.476 -11.905 6.940
561 1HB GLU 74 2HB GLU 74 8.894 -10.475 4.681
562 2HB GLU 74 3HB GLU 74 9.546 -11.886 5.498
563 1HG GLU 74 2HG GLU 74 7.550 -13.216 4.879
564 2HG GLU 74 3HG GLU 74 6.836 -11.799 4.088
565 H GLY 75 H GLY 75 7.702 -8.812 7.578
566 1HA GLY 75 2HA GLY 75 10.418 -8.610 8.723
567 2HA GLY 75 3HA GLY 75 9.229 -7.317 8.558
568 H ARG 76 H ARG 76 7.073 -8.906 9.914
569 HA ARG 76 HA ARG 76 7.848 -8.245 12.675
570 1HB ARG 76 2HB ARG 76 5.774 -7.211 11.853
571 2HB ARG 76 3HB ARG 76 5.154 -8.816 11.397
572 1HG ARG 76 2HG ARG 76 5.156 -9.547 13.716
573 2HG ARG 76 3HG ARG 76 5.828 -8.001 14.248
574 1HD ARG 76 2HD ARG 76 3.219 -8.222 12.670
575 2HD ARG 76 3HD ARG 76 3.218 -8.477 14.401
576 HE ARG 76 HE ARG 76 3.441 -5.955 12.973
577 1HH1 ARG 76 2HH2 ARG 76 4.410 -7.567 15.931
578 2HH1 ARG 76 1HH2 ARG 76 4.259 -6.182 16.969
579 1HH2 ARG 76 2HH1 ARG 76 3.224 -4.047 14.296
580 2HH2 ARG 76 1HH1 ARG 76 3.600 -4.112 15.987
Start of MODEL 2
1 1H MET 1 H1 MET 1 3.331 17.682 12.713
2 2H MET 1 H2 MET 1 4.705 17.236 13.523
3 3H MET 1 H3 MET 1 3.385 16.232 13.427
4 HA MET 1 HA MET 1 3.749 17.440 15.594
5 1HB MET 1 2HB MET 1 2.838 19.678 13.746
6 2HB MET 1 3HB MET 1 2.353 19.658 15.447
7 1HG MET 1 2HG MET 1 4.675 19.585 16.177
8 2HG MET 1 3HG MET 1 5.226 19.704 14.494
9 1HE MET 1 1HE MET 1 5.954 21.661 17.046
10 2HE MET 1 2HE MET 1 6.709 21.805 15.436
11 3HE MET 1 3HE MET 1 5.968 23.228 16.207
12 H LEU 2 H LEU 2 0.848 18.679 13.946
13 HA LEU 2 HA LEU 2 -0.924 17.474 15.683
14 1HB LEU 2 2HB LEU 2 -1.138 19.227 13.586
15 2HB LEU 2 3HB LEU 2 -1.807 17.796 12.821
16 HG LEU 2 HG LEU 2 -3.597 19.063 13.680
17 1HD1 LEU 2 1HD1 LEU 2 -3.781 16.607 14.106
18 2HD1 LEU 2 2HD1 LEU 2 -3.205 16.879 15.768
19 3HD1 LEU 2 3HD1 LEU 2 -4.726 17.602 15.228
20 1HD2 LEU 2 1HD2 LEU 2 -2.235 19.170 16.404
21 2HD2 LEU 2 2HD2 LEU 2 -2.336 20.496 15.228
22 3HD2 LEU 2 3HD2 LEU 2 -3.809 19.858 15.975
23 H SER 3 H SER 3 0.267 16.291 12.575
24 HA SER 3 HA SER 3 -0.255 13.480 13.344
25 1HB SER 3 2HB SER 3 -0.208 14.808 10.582
26 2HB SER 3 3HB SER 3 -0.096 13.063 10.839
27 HG SER 3 HG SER 3 -2.103 12.967 11.478
28 H GLU 4 H GLU 4 1.578 12.150 12.619
29 HA GLU 4 HA GLU 4 4.041 13.513 11.765
30 1HB GLU 4 2HB GLU 4 3.529 11.256 13.641
31 2HB GLU 4 3HB GLU 4 4.947 11.209 12.638
32 1HG GLU 4 2HG GLU 4 5.329 13.612 13.510
33 2HG GLU 4 3HG GLU 4 4.169 13.143 14.753
34 H GLN 5 H GLN 5 5.249 11.495 10.502
35 HA GLN 5 HA GLN 5 3.309 9.958 8.893
36 1HB GLN 5 2HB GLN 5 5.644 11.651 7.968
37 2HB GLN 5 3HB GLN 5 4.906 10.460 6.918
38 1HG GLN 5 2HG GLN 5 3.282 12.730 8.199
39 2HG GLN 5 3HG GLN 5 4.244 12.959 6.760
40 1HE2 GLN 5 1HE2 GLN 5 3.022 9.736 6.690
41 2HE2 GLN 5 2HE2 GLN 5 1.677 10.088 5.633
42 H LYS 6 H LYS 6 4.243 7.915 8.250
43 HA LYS 6 HA LYS 6 7.113 7.636 8.451
44 1HB LYS 6 2HB LYS 6 5.264 5.825 10.076
45 2HB LYS 6 3HB LYS 6 6.833 5.294 9.459
46 1HG LYS 6 2HG LYS 6 7.844 7.374 10.529
47 2HG LYS 6 3HG LYS 6 6.350 7.536 11.450
48 1HD LYS 6 2HD LYS 6 6.806 5.691 12.766
49 2HD LYS 6 3HD LYS 6 7.581 4.797 11.446
50 1HE LYS 6 2HE LYS 6 9.565 6.327 11.575
51 2HE LYS 6 3HE LYS 6 8.840 7.107 12.994
52 1HZ LYS 6 1HZ LYS 6 8.949 4.966 14.102
53 2HZ LYS 6 2HZ LYS 6 9.604 4.267 12.760
54 3HZ LYS 6 3HZ LYS 6 10.439 5.423 13.574
55 H GLU 7 H GLU 7 7.878 5.728 7.445
56 HA GLU 7 HA GLU 7 6.431 5.180 4.936
57 1HB GLU 7 2HB GLU 7 9.441 5.224 5.262
58 2HB GLU 7 3HB GLU 7 8.409 5.507 3.869
59 1HG GLU 7 2HG GLU 7 9.309 7.610 4.405
60 2HG GLU 7 3HG GLU 7 7.735 7.711 5.204
61 H ILE 8 H ILE 8 5.602 3.181 5.695
62 HA ILE 8 HA ILE 8 7.448 1.260 6.956
63 HB ILE 8 HB ILE 8 4.557 1.185 6.285
64 1HG1 ILE 8 2HG1 ILE 8 4.388 0.987 8.885
65 2HG1 ILE 8 3HG1 ILE 8 6.100 1.415 8.951
66 1HG2 ILE 8 1HG2 ILE 8 5.315 -0.999 6.154
67 2HG2 ILE 8 2HG2 ILE 8 6.265 -0.784 7.680
68 3HG2 ILE 8 3HG2 ILE 8 4.469 -0.792 7.695
69 1HD1 ILE 8 1HD1 ILE 8 4.324 3.224 9.334
70 2HD1 ILE 8 2HD1 ILE 8 5.615 3.615 8.182
71 3HD1 ILE 8 3HD1 ILE 8 4.010 3.107 7.581
72 H ALA 9 H ALA 9 7.476 -0.872 5.932
73 HA ALA 9 HA ALA 9 7.633 -0.827 2.958
74 1HB ALA 9 1HB ALA 9 9.671 -2.077 4.849
75 2HB ALA 9 2HB ALA 9 9.654 -2.214 3.080
76 3HB ALA 9 3HB ALA 9 9.940 -0.639 3.844
77 H MET 10 H MET 10 6.522 -2.581 2.113
78 HA MET 10 HA MET 10 5.886 -4.874 3.870
79 1HB MET 10 2HB MET 10 4.100 -2.705 3.195
80 2HB MET 10 3HB MET 10 3.605 -4.103 2.235
81 1HG MET 10 2HG MET 10 3.473 -5.463 4.122
82 2HG MET 10 3HG MET 10 4.103 -4.238 5.228
83 1HE MET 10 1HE MET 10 2.713 -1.655 4.992
84 2HE MET 10 2HE MET 10 1.200 -1.883 5.903
85 3HE MET 10 3HE MET 10 2.713 -2.590 6.510
86 H GLN 11 H GLN 11 4.988 -6.676 2.555
87 HA GLN 11 HA GLN 11 6.411 -6.847 -0.060
88 1HB GLN 11 2HB GLN 11 5.664 -8.835 2.117
89 2HB GLN 11 3HB GLN 11 5.711 -9.405 0.458
90 1HG GLN 11 2HG GLN 11 7.989 -8.115 2.021
91 2HG GLN 11 3HG GLN 11 7.850 -9.824 1.567
92 1HE2 GLN 11 1HE2 GLN 11 6.974 -9.658 -1.104
93 2HE2 GLN 11 2HE2 GLN 11 8.018 -8.602 -2.036
94 H VAL 12 H VAL 12 5.293 -7.602 -1.883
95 HA VAL 12 HA VAL 12 2.337 -7.150 -1.754
96 HB VAL 12 HB VAL 12 4.293 -7.020 -4.092
97 1HG1 VAL 12 1HG1 VAL 12 1.338 -6.318 -3.831
98 2HG1 VAL 12 2HG1 VAL 12 2.360 -5.872 -5.213
99 3HG1 VAL 12 3HG1 VAL 12 2.044 -7.577 -4.875
100 1HG2 VAL 12 1HG2 VAL 12 4.725 -5.162 -2.561
101 2HG2 VAL 12 2HG2 VAL 12 3.826 -4.544 -3.948
102 3HG2 VAL 12 3HG2 VAL 12 2.980 -4.833 -2.419
103 H SER 13 H SER 13 0.904 -8.728 -2.775
104 HA SER 13 HA SER 13 2.100 -10.991 -4.171
105 1HB SER 13 2HB SER 13 0.616 -11.356 -1.533
106 2HB SER 13 3HB SER 13 0.861 -12.662 -2.699
107 HG SER 13 HG SER 13 3.164 -11.286 -2.061
108 H GLY 14 H GLY 14 0.384 -12.388 -5.089
109 1HA GLY 14 2HA GLY 14 -1.555 -12.704 -6.272
110 2HA GLY 14 3HA GLY 14 -2.371 -11.691 -5.072
111 H MET 15 H MET 15 -0.251 -11.499 -8.005
112 HA MET 15 HA MET 15 -1.672 -9.153 -8.993
113 1HB MET 15 2HB MET 15 0.321 -7.758 -9.013
114 2HB MET 15 3HB MET 15 -0.051 -8.259 -7.351
115 1HG MET 15 2HG MET 15 2.240 -8.507 -7.413
116 2HG MET 15 3HG MET 15 1.706 -10.143 -7.776
117 1HE MET 15 1HE MET 15 2.863 -11.449 -9.541
118 2HE MET 15 2HE MET 15 4.271 -10.753 -10.371
119 3HE MET 15 3HE MET 15 4.167 -10.683 -8.593
120 H THR 16 H THR 16 -0.630 -8.468 -11.105
121 HA THR 16 HA THR 16 0.731 -10.736 -12.510
122 HB THR 16 HB THR 16 -0.198 -9.394 -14.588
123 HG1 THR 16 1HG THR 16 -2.203 -8.931 -12.630
124 1HG2 THR 16 1HG2 THR 16 -0.679 -11.744 -14.142
125 2HG2 THR 16 2HG2 THR 16 -1.886 -11.304 -12.915
126 3HG2 THR 16 3HG2 THR 16 -2.160 -10.901 -14.627
127 H CYS 17 H CYS 17 0.571 -7.097 -12.169
128 HA CYS 17 HA CYS 17 3.432 -7.054 -12.862
129 1HB CYS 17 2HB CYS 17 3.121 -5.536 -14.720
130 2HB CYS 17 3HB CYS 17 2.121 -6.961 -15.010
131 H ALA 18 H ALA 18 4.146 -4.676 -12.913
132 HA ALA 18 HA ALA 18 3.637 -3.590 -10.293
133 1HB ALA 18 1HB ALA 18 5.203 -2.433 -12.631
134 2HB ALA 18 2HB ALA 18 5.271 -1.891 -10.939
135 3HB ALA 18 3HB ALA 18 5.849 -3.513 -11.375
136 H ALA 19 H ALA 19 2.211 -3.029 -13.466
137 HA ALA 19 HA ALA 19 1.533 -0.280 -13.106
138 1HB ALA 19 1HB ALA 19 1.551 -1.443 -15.306
139 2HB ALA 19 2HB ALA 19 0.082 -2.325 -14.829
140 3HB ALA 19 3HB ALA 19 0.044 -0.563 -14.985
141 H CYS 20 H CYS 20 -0.379 -3.301 -12.491
142 HA CYS 20 HA CYS 20 -2.542 -1.756 -11.340
143 1HB CYS 20 2HB CYS 20 -3.283 -3.994 -10.403
144 2HB CYS 20 3HB CYS 20 -3.251 -3.833 -12.162
145 H ALA 21 H ALA 21 0.308 -3.414 -10.008
146 HA ALA 21 HA ALA 21 -0.116 -2.799 -7.326
147 1HB ALA 21 1HB ALA 21 1.818 -4.103 -8.587
148 2HB ALA 21 2HB ALA 21 2.671 -2.556 -8.404
149 3HB ALA 21 3HB ALA 21 2.045 -3.429 -6.983
150 H ALA 22 H ALA 22 0.877 -0.560 -9.914
151 HA ALA 22 HA ALA 22 1.452 1.656 -8.153
152 1HB ALA 22 1HB ALA 22 1.328 3.010 -10.148
153 2HB ALA 22 2HB ALA 22 2.190 1.506 -10.543
154 3HB ALA 22 3HB ALA 22 0.501 1.728 -11.042
155 H ARG 23 H ARG 23 -1.418 0.642 -10.077
156 HA ARG 23 HA ARG 23 -3.188 2.696 -9.305
157 1HB ARG 23 2HB ARG 23 -3.659 -0.193 -10.101
158 2HB ARG 23 3HB ARG 23 -4.937 0.696 -9.311
159 1HG ARG 23 2HG ARG 23 -5.474 1.006 -11.443
160 2HG ARG 23 3HG ARG 23 -4.689 2.533 -11.048
161 1HD ARG 23 2HD ARG 23 -2.745 1.938 -12.402
162 2HD ARG 23 3HD ARG 23 -3.166 0.237 -12.340
163 HE ARG 23 HE ARG 23 -4.532 0.390 -14.098
164 1HH1 ARG 23 2HH2 ARG 23 -3.973 3.654 -12.939
165 2HH1 ARG 23 1HH2 ARG 23 -5.009 4.437 -14.097
166 1HH2 ARG 23 2HH1 ARG 23 -5.998 1.355 -15.602
167 2HH2 ARG 23 1HH1 ARG 23 -6.190 3.075 -15.656
168 H ILE 24 H ILE 24 -2.581 -0.437 -7.559
169 HA ILE 24 HA ILE 24 -4.488 0.166 -5.587
170 HB ILE 24 HB ILE 24 -3.709 -1.522 -4.200
171 1HG1 ILE 24 2HG1 ILE 24 -1.161 -1.248 -5.691
172 2HG1 ILE 24 3HG1 ILE 24 -1.458 -1.093 -3.947
173 1HG2 ILE 24 1HG2 ILE 24 -3.985 -3.303 -5.616
174 2HG2 ILE 24 2HG2 ILE 24 -4.734 -2.001 -6.532
175 3HG2 ILE 24 3HG2 ILE 24 -3.107 -2.563 -6.967
176 1HD1 ILE 24 1HD1 ILE 24 -0.245 -3.141 -4.395
177 2HD1 ILE 24 2HD1 ILE 24 -1.894 -3.534 -3.841
178 3HD1 ILE 24 3HD1 ILE 24 -1.467 -3.617 -5.577
179 H GLU 25 H GLU 25 -0.919 0.709 -5.210
180 HA GLU 25 HA GLU 25 -1.066 2.135 -2.825
181 1HB GLU 25 2HB GLU 25 0.835 2.065 -5.150
182 2HB GLU 25 3HB GLU 25 0.987 3.427 -4.028
183 1HG GLU 25 2HG GLU 25 2.438 1.486 -3.431
184 2HG GLU 25 3HG GLU 25 1.347 1.973 -2.139
185 H LYS 26 H LYS 26 -1.625 3.434 -6.122
186 HA LYS 26 HA LYS 26 -1.730 6.142 -5.091
187 1HB LYS 26 2HB LYS 26 -2.445 5.040 -7.776
188 2HB LYS 26 3HB LYS 26 -2.919 6.665 -7.277
189 1HG LYS 26 2HG LYS 26 -0.874 7.003 -8.334
190 2HG LYS 26 3HG LYS 26 -0.495 7.143 -6.612
191 1HD LYS 26 2HD LYS 26 0.331 4.743 -6.658
192 2HD LYS 26 3HD LYS 26 -0.173 4.717 -8.339
193 1HE LYS 26 2HE LYS 26 2.041 5.153 -8.710
194 2HE LYS 26 3HE LYS 26 1.494 6.820 -8.536
195 1HZ LYS 26 1HZ LYS 26 3.424 6.419 -7.210
196 2HZ LYS 26 2HZ LYS 26 2.183 6.638 -6.154
197 3HZ LYS 26 3HZ LYS 26 2.741 5.135 -6.453
198 H GLY 27 H GLY 27 -4.196 3.641 -5.757
199 1HA GLY 27 2HA GLY 27 -6.473 5.284 -5.040
200 2HA GLY 27 3HA GLY 27 -6.425 3.525 -5.154
201 H LEU 28 H LEU 28 -4.062 3.427 -3.247
202 HA LEU 28 HA LEU 28 -5.484 3.356 -0.730
203 1HB LEU 28 2HB LEU 28 -3.294 2.085 -1.697
204 2HB LEU 28 3HB LEU 28 -2.479 3.349 -0.777
205 HG LEU 28 HG LEU 28 -4.640 1.472 0.299
206 1HD1 LEU 28 1HD1 LEU 28 -2.814 0.209 1.343
207 2HD1 LEU 28 2HD1 LEU 28 -2.658 0.192 -0.420
208 3HD1 LEU 28 3HD1 LEU 28 -1.612 1.251 0.547
209 1HD2 LEU 28 1HD2 LEU 28 -4.313 3.612 1.586
210 2HD2 LEU 28 2HD2 LEU 28 -3.836 2.188 2.503
211 3HD2 LEU 28 3HD2 LEU 28 -2.589 3.188 1.715
212 H LYS 29 H LYS 29 -3.059 5.466 -2.222
213 HA LYS 29 HA LYS 29 -2.707 7.435 -0.331
214 1HB LYS 29 2HB LYS 29 -1.932 7.079 -2.930
215 2HB LYS 29 3HB LYS 29 -3.140 8.361 -3.159
216 1HG LYS 29 2HG LYS 29 -1.918 9.558 -1.225
217 2HG LYS 29 3HG LYS 29 -0.703 8.287 -1.432
218 1HD LYS 29 2HD LYS 29 0.262 9.714 -3.005
219 2HD LYS 29 3HD LYS 29 -1.020 9.133 -4.051
220 1HE LYS 29 2HE LYS 29 -0.999 11.535 -4.155
221 2HE LYS 29 3HE LYS 29 -2.461 11.073 -3.260
222 1HZ LYS 29 1HZ LYS 29 -1.190 11.580 -1.209
223 2HZ LYS 29 2HZ LYS 29 0.115 11.937 -2.074
224 3HZ LYS 29 3HZ LYS 29 -1.214 12.902 -2.196
225 H ARG 30 H ARG 30 -5.632 6.814 -2.116
226 HA ARG 30 HA ARG 30 -6.764 9.469 -1.614
227 1HB ARG 30 2HB ARG 30 -7.402 7.080 -3.266
228 2HB ARG 30 3HB ARG 30 -8.825 7.875 -2.625
229 1HG ARG 30 2HG ARG 30 -6.560 9.363 -4.001
230 2HG ARG 30 3HG ARG 30 -7.945 8.715 -4.891
231 1HD ARG 30 2HD ARG 30 -9.440 10.245 -4.061
232 2HD ARG 30 3HD ARG 30 -8.636 10.354 -2.487
233 HE ARG 30 HE ARG 30 -7.008 11.495 -4.577
234 1HH1 ARG 30 2HH2 ARG 30 -9.820 12.149 -2.561
235 2HH1 ARG 30 1HH2 ARG 30 -9.568 13.864 -2.458
236 1HH2 ARG 30 2HH1 ARG 30 -6.617 13.782 -4.460
237 2HH2 ARG 30 1HH1 ARG 30 -7.702 14.809 -3.584
238 H MET 31 H MET 31 -6.257 6.949 0.491
239 HA MET 31 HA MET 31 -8.918 7.113 1.740
240 1HB MET 31 2HB MET 31 -8.511 5.100 2.556
241 2HB MET 31 3HB MET 31 -7.257 5.017 1.326
242 1HG MET 31 2HG MET 31 -5.550 5.588 2.910
243 2HG MET 31 3HG MET 31 -6.753 5.760 4.192
244 1HE MET 31 1HE MET 31 -8.039 2.217 4.894
245 2HE MET 31 2HE MET 31 -8.089 3.931 5.386
246 3HE MET 31 3HE MET 31 -8.779 3.407 3.837
247 HA PRO 32 HA PRO 32 -7.634 9.918 4.976
248 1HB PRO 32 2HB PRO 32 -8.858 8.908 7.223
249 2HB PRO 32 3HB PRO 32 -9.749 9.738 5.914
250 1HG PRO 32 2HG PRO 32 -9.367 6.758 6.297
251 2HG PRO 32 3HG PRO 32 -10.898 7.630 5.994
252 1HD PRO 32 2HD PRO 32 -9.552 6.436 3.990
253 2HD PRO 32 3HD PRO 32 -10.303 8.031 3.712
254 H GLY 33 H GLY 33 -5.725 10.022 6.133
255 1HA GLY 33 2HA GLY 33 -4.224 9.278 7.769
256 2HA GLY 33 3HA GLY 33 -4.711 7.600 7.532
257 H VAL 34 H VAL 34 -4.444 7.575 4.547
258 HA VAL 34 HA VAL 34 -1.477 7.431 4.531
259 HB VAL 34 HB VAL 34 -3.450 6.471 2.456
260 1HG1 VAL 34 1HG1 VAL 34 -1.220 7.007 1.521
261 2HG1 VAL 34 2HG1 VAL 34 -0.443 6.067 2.804
262 3HG1 VAL 34 3HG1 VAL 34 -1.467 5.264 1.592
263 1HG2 VAL 34 1HG2 VAL 34 -2.172 5.287 4.944
264 2HG2 VAL 34 2HG2 VAL 34 -3.801 5.061 4.320
265 3HG2 VAL 34 3HG2 VAL 34 -2.428 4.247 3.554
266 H THR 35 H THR 35 -0.266 9.052 3.857
267 HA THR 35 HA THR 35 -1.567 11.321 2.516
268 HB THR 35 HB THR 35 1.120 10.980 3.737
269 HG1 THR 35 1HG THR 35 0.110 12.262 5.336
270 1HG2 THR 35 1HG2 THR 35 -0.232 13.435 2.547
271 2HG2 THR 35 2HG2 THR 35 1.186 13.493 3.616
272 3HG2 THR 35 3HG2 THR 35 1.311 12.703 2.038
273 H ASP 36 H ASP 36 1.302 9.105 1.950
274 HA ASP 36 HA ASP 36 0.924 9.472 -0.916
275 1HB ASP 36 2HB ASP 36 3.364 10.344 0.607
276 2HB ASP 36 3HB ASP 36 3.492 9.695 -1.027
277 H ALA 37 H ALA 37 2.212 7.829 -2.102
278 HA ALA 37 HA ALA 37 2.900 5.417 -0.640
279 1HB ALA 37 1HB ALA 37 0.401 5.362 -0.516
280 2HB ALA 37 2HB ALA 37 0.338 5.453 -2.288
281 3HB ALA 37 3HB ALA 37 1.050 4.037 -1.483
282 H ASN 38 H ASN 38 4.019 3.871 -1.871
283 HA ASN 38 HA ASN 38 4.580 4.535 -4.698
284 1HB ASN 38 2HB ASN 38 7.129 4.360 -3.490
285 2HB ASN 38 3HB ASN 38 6.380 5.751 -4.250
286 1HD2 ASN 38 1HD2 ASN 38 5.920 4.135 -1.033
287 2HD2 ASN 38 2HD2 ASN 38 6.224 5.616 -0.129
288 H VAL 39 H VAL 39 4.321 2.537 -5.527
289 HA VAL 39 HA VAL 39 5.023 0.198 -3.950
290 HB VAL 39 HB VAL 39 3.068 0.335 -5.469
291 1HG1 VAL 39 1HG1 VAL 39 3.340 -0.029 -7.871
292 2HG1 VAL 39 2HG1 VAL 39 4.088 1.508 -7.412
293 3HG1 VAL 39 3HG1 VAL 39 5.093 0.080 -7.742
294 1HG2 VAL 39 1HG2 VAL 39 4.308 -1.806 -4.679
295 2HG2 VAL 39 2HG2 VAL 39 3.127 -1.895 -5.978
296 3HG2 VAL 39 3HG2 VAL 39 4.864 -1.903 -6.368
297 H ASN 40 H ASN 40 6.922 -1.078 -4.235
298 HA ASN 40 HA ASN 40 9.010 0.036 -6.063
299 1HB ASN 40 2HB ASN 40 9.316 0.729 -3.673
300 2HB ASN 40 3HB ASN 40 9.403 -0.981 -3.221
301 1HD2 ASN 40 1HD2 ASN 40 11.574 0.142 -2.430
302 2HD2 ASN 40 2HD2 ASN 40 12.908 0.004 -3.564
303 H LEU 41 H LEU 41 7.447 -1.688 -7.052
304 HA LEU 41 HA LEU 41 7.897 -4.424 -6.452
305 1HB LEU 41 2HB LEU 41 6.193 -2.882 -8.140
306 2HB LEU 41 3HB LEU 41 7.039 -3.966 -9.220
307 HG LEU 41 HG LEU 41 4.801 -4.690 -8.319
308 1HD1 LEU 41 1HD1 LEU 41 6.320 -6.279 -9.400
309 2HD1 LEU 41 2HD1 LEU 41 7.154 -6.573 -7.862
310 3HD1 LEU 41 3HD1 LEU 41 5.458 -7.060 -8.063
311 1HD2 LEU 41 1HD2 LEU 41 5.329 -4.023 -5.883
312 2HD2 LEU 41 2HD2 LEU 41 4.462 -5.537 -6.194
313 3HD2 LEU 41 3HD2 LEU 41 6.171 -5.578 -5.770
314 H ALA 42 H ALA 42 9.766 -2.157 -8.231
315 HA ALA 42 HA ALA 42 11.488 -3.686 -9.800
316 1HB ALA 42 1HB ALA 42 13.220 -2.077 -9.143
317 2HB ALA 42 2HB ALA 42 11.685 -1.227 -9.448
318 3HB ALA 42 3HB ALA 42 12.232 -1.535 -7.778
319 H THR 43 H THR 43 11.273 -3.513 -6.216
320 HA THR 43 HA THR 43 12.992 -5.928 -6.133
321 HB THR 43 HB THR 43 14.364 -4.078 -5.440
322 HG1 THR 43 1HG THR 43 14.283 -6.210 -4.267
323 1HG2 THR 43 1HG2 THR 43 12.698 -2.493 -4.620
324 2HG2 THR 43 2HG2 THR 43 12.323 -3.551 -3.241
325 3HG2 THR 43 3HG2 THR 43 13.924 -2.805 -3.381
326 H GLU 44 H GLU 44 10.251 -5.833 -6.506
327 HA GLU 44 HA GLU 44 8.299 -6.692 -5.772
328 1HB GLU 44 2HB GLU 44 10.371 -8.392 -4.329
329 2HB GLU 44 3HB GLU 44 8.671 -8.844 -4.515
330 1HG GLU 44 2HG GLU 44 8.824 -8.798 -6.942
331 2HG GLU 44 3HG GLU 44 10.501 -8.231 -6.871
332 H THR 45 H THR 45 9.210 -4.360 -4.034
333 HA THR 45 HA THR 45 7.902 -5.083 -1.451
334 HB THR 45 HB THR 45 10.063 -3.046 -2.162
335 HG1 THR 45 1HG THR 45 10.718 -5.296 -2.119
336 1HG2 THR 45 1HG2 THR 45 8.800 -2.253 -0.217
337 2HG2 THR 45 2HG2 THR 45 8.927 -3.872 0.530
338 3HG2 THR 45 3HG2 THR 45 10.373 -2.877 0.289
339 H VAL 46 H VAL 46 6.676 -3.246 -0.479
340 HA VAL 46 HA VAL 46 5.905 -1.061 -2.347
341 HB VAL 46 HB VAL 46 3.970 -2.453 -2.347
342 1HG1 VAL 46 1HG1 VAL 46 2.827 -3.190 -0.255
343 2HG1 VAL 46 2HG1 VAL 46 4.391 -3.968 -0.483
344 3HG1 VAL 46 3HG1 VAL 46 4.230 -2.618 0.669
345 1HG2 VAL 46 1HG2 VAL 46 2.296 -1.107 -1.230
346 2HG2 VAL 46 2HG2 VAL 46 3.493 -0.335 -0.197
347 3HG2 VAL 46 3HG2 VAL 46 3.528 -0.042 -1.952
348 H ASN 47 H ASN 47 5.726 1.024 -1.335
349 HA ASN 47 HA ASN 47 6.353 1.068 1.555
350 1HB ASN 47 2HB ASN 47 7.616 2.671 -0.703
351 2HB ASN 47 3HB ASN 47 7.466 3.347 0.924
352 1HD2 ASN 47 1HD2 ASN 47 8.207 1.728 2.764
353 2HD2 ASN 47 2HD2 ASN 47 9.843 1.171 2.459
354 H VAL 48 H VAL 48 5.060 2.533 2.693
355 HA VAL 48 HA VAL 48 3.049 4.033 1.126
356 HB VAL 48 HB VAL 48 2.082 1.860 1.467
357 1HG1 VAL 48 1HG1 VAL 48 2.654 2.181 4.431
358 2HG1 VAL 48 2HG1 VAL 48 1.584 0.962 3.716
359 3HG1 VAL 48 3HG1 VAL 48 3.307 0.964 3.329
360 1HG2 VAL 48 1HG2 VAL 48 0.041 2.552 2.722
361 2HG2 VAL 48 2HG2 VAL 48 0.879 4.047 3.187
362 3HG2 VAL 48 3HG2 VAL 48 0.581 3.695 1.483
363 H ILE 49 H ILE 49 2.859 6.024 1.921
364 HA ILE 49 HA ILE 49 4.514 6.655 4.267
365 HB ILE 49 HB ILE 49 3.607 8.543 2.071
366 1HG1 ILE 49 2HG1 ILE 49 4.822 6.886 0.870
367 2HG1 ILE 49 3HG1 ILE 49 5.812 8.329 1.047
368 1HG2 ILE 49 1HG2 ILE 49 4.297 9.659 4.086
369 2HG2 ILE 49 2HG2 ILE 49 5.793 8.721 4.166
370 3HG2 ILE 49 3HG2 ILE 49 5.536 9.879 2.844
371 1HD1 ILE 49 1HD1 ILE 49 7.244 6.437 1.417
372 2HD1 ILE 49 2HD1 ILE 49 6.993 7.212 2.981
373 3HD1 ILE 49 3HD1 ILE 49 6.119 5.717 2.580
374 H TYR 50 H TYR 50 3.052 6.600 6.000
375 HA TYR 50 HA TYR 50 0.470 8.092 5.691
376 1HB TYR 50 2HB TYR 50 -0.754 6.344 6.682
377 2HB TYR 50 3HB TYR 50 0.027 5.779 5.239
378 HD1 TYR 50 HD1 TYR 50 1.239 3.729 5.303
379 HD2 TYR 50 HD2 TYR 50 0.201 5.681 8.975
380 HE1 TYR 50 HE1 TYR 50 1.631 1.615 6.545
381 HE2 TYR 50 HE2 TYR 50 0.824 3.654 10.239
382 HH TYR 50 HH TYR 50 1.642 1.493 10.087
383 H ASP 51 H ASP 51 -0.635 8.453 7.655
384 HA ASP 51 HA ASP 51 1.215 9.400 9.757
385 1HB ASP 51 2HB ASP 51 -0.501 10.926 9.165
386 2HB ASP 51 3HB ASP 51 -1.756 9.703 9.383
387 HA PRO 52 HA PRO 52 0.372 5.374 11.658
388 1HB PRO 52 2HB PRO 52 2.365 5.237 13.470
389 2HB PRO 52 3HB PRO 52 2.679 5.149 11.713
390 1HG PRO 52 2HG PRO 52 2.831 7.619 13.481
391 2HG PRO 52 3HG PRO 52 4.096 6.996 12.379
392 1HD PRO 52 2HD PRO 52 2.342 8.943 11.625
393 2HD PRO 52 3HD PRO 52 2.892 7.683 10.477
394 H ALA 53 H ALA 53 -0.423 8.443 12.859
395 HA ALA 53 HA ALA 53 -1.346 7.445 15.487
396 1HB ALA 53 1HB ALA 53 -2.239 9.690 15.697
397 2HB ALA 53 2HB ALA 53 -0.542 9.806 15.175
398 3HB ALA 53 3HB ALA 53 -1.859 10.049 14.002
399 H GLU 54 H GLU 54 -2.267 7.786 12.100
400 HA GLU 54 HA GLU 54 -5.125 7.657 12.778
401 1HB GLU 54 2HB GLU 54 -3.921 9.514 11.363
402 2HB GLU 54 3HB GLU 54 -4.042 8.363 10.036
403 1HG GLU 54 2HG GLU 54 -6.414 9.292 11.738
404 2HG GLU 54 3HG GLU 54 -5.871 10.127 10.284
405 H THR 55 H THR 55 -2.795 6.475 10.375
406 HA THR 55 HA THR 55 -4.063 3.818 10.324
407 HB THR 55 HB THR 55 -2.231 3.577 8.305
408 HG1 THR 55 1HG THR 55 -3.158 6.220 8.248
409 1HG2 THR 55 1HG2 THR 55 -4.166 4.175 6.839
410 2HG2 THR 55 2HG2 THR 55 -4.543 3.071 8.185
411 3HG2 THR 55 3HG2 THR 55 -5.044 4.790 8.270
412 H GLY 56 H GLY 56 -2.062 2.254 9.747
413 1HA GLY 56 2HA GLY 56 -0.337 1.358 11.595
414 2HA GLY 56 3HA GLY 56 -1.756 1.771 12.589
415 H THR 57 H THR 57 -0.637 0.000 10.080
416 HA THR 57 HA THR 57 -1.398 -0.785 8.201
417 HB THR 57 HB THR 57 -1.008 -3.251 8.401
418 HG1 THR 57 1HG THR 57 -2.003 -3.598 10.427
419 1HG2 THR 57 1HG2 THR 57 0.906 -1.607 8.370
420 2HG2 THR 57 2HG2 THR 57 0.895 -1.612 10.146
421 3HG2 THR 57 3HG2 THR 57 1.253 -3.102 9.264
422 H ALA 58 H ALA 58 -3.635 -1.511 10.719
423 HA ALA 58 HA ALA 58 -5.722 -2.956 9.816
424 1HB ALA 58 1HB ALA 58 -5.692 -0.107 10.878
425 2HB ALA 58 2HB ALA 58 -7.063 -1.240 11.014
426 3HB ALA 58 3HB ALA 58 -5.522 -1.553 11.867
427 H ALA 59 H ALA 59 -5.078 0.418 8.756
428 HA ALA 59 HA ALA 59 -7.581 0.184 7.189
429 1HB ALA 59 1HB ALA 59 -6.095 2.651 6.729
430 2HB ALA 59 2HB ALA 59 -7.783 2.357 7.147
431 3HB ALA 59 3HB ALA 59 -6.597 2.347 8.432
432 H ILE 60 H ILE 60 -4.140 0.071 6.689
433 HA ILE 60 HA ILE 60 -4.124 0.232 3.834
434 HB ILE 60 HB ILE 60 -2.192 -0.619 5.994
435 1HG1 ILE 60 2HG1 ILE 60 -0.758 0.936 4.617
436 2HG1 ILE 60 3HG1 ILE 60 -2.148 1.153 3.539
437 1HG2 ILE 60 1HG2 ILE 60 -1.847 -2.462 4.449
438 2HG2 ILE 60 2HG2 ILE 60 -1.772 -1.333 3.073
439 3HG2 ILE 60 3HG2 ILE 60 -0.525 -1.307 4.338
440 1HD1 ILE 60 1HD1 ILE 60 -3.364 2.304 5.327
441 2HD1 ILE 60 2HD1 ILE 60 -2.202 1.733 6.554
442 3HD1 ILE 60 3HD1 ILE 60 -1.709 2.945 5.367
443 H GLN 61 H GLN 61 -4.275 -2.587 6.091
444 HA GLN 61 HA GLN 61 -4.328 -4.507 3.977
445 1HB GLN 61 2HB GLN 61 -4.763 -4.514 6.873
446 2HB GLN 61 3HB GLN 61 -5.919 -5.536 6.002
447 1HG GLN 61 2HG GLN 61 -4.352 -7.084 6.370
448 2HG GLN 61 3HG GLN 61 -3.824 -6.534 4.783
449 1HE2 GLN 61 1HE2 GLN 61 -2.456 -4.163 5.410
450 2HE2 GLN 61 2HE2 GLN 61 -1.074 -4.576 6.416
451 H GLU 62 H GLU 62 -7.004 -2.906 5.803
452 HA GLU 62 HA GLU 62 -9.236 -3.911 4.489
453 1HB GLU 62 2HB GLU 62 -8.500 -1.310 5.795
454 2HB GLU 62 3HB GLU 62 -9.936 -1.284 4.780
455 1HG GLU 62 2HG GLU 62 -9.516 -3.330 6.993
456 2HG GLU 62 3HG GLU 62 -10.338 -1.779 7.225
457 H LYS 63 H LYS 63 -7.399 -0.969 3.431
458 HA LYS 63 HA LYS 63 -8.929 -0.805 1.038
459 1HB LYS 63 2HB LYS 63 -6.613 0.598 2.276
460 2HB LYS 63 3HB LYS 63 -6.705 0.651 0.540
461 1HG LYS 63 2HG LYS 63 -9.079 1.286 2.337
462 2HG LYS 63 3HG LYS 63 -7.914 2.510 1.825
463 1HD LYS 63 2HD LYS 63 -9.493 0.917 -0.225
464 2HD LYS 63 3HD LYS 63 -10.057 2.430 0.510
465 1HE LYS 63 2HE LYS 63 -7.888 3.530 -0.191
466 2HE LYS 63 3HE LYS 63 -7.460 2.049 -1.051
467 1HZ LYS 63 1HZ LYS 63 -9.291 2.412 -2.499
468 2HZ LYS 63 2HZ LYS 63 -9.819 3.711 -1.614
469 3HZ LYS 63 3HZ LYS 63 -8.367 3.787 -2.385
470 H ILE 64 H ILE 64 -5.878 -2.518 1.784
471 HA ILE 64 HA ILE 64 -4.899 -2.939 -0.778
472 HB ILE 64 HB ILE 64 -4.697 -4.149 1.889
473 1HG1 ILE 64 2HG1 ILE 64 -3.245 -2.337 0.916
474 2HG1 ILE 64 3HG1 ILE 64 -2.441 -3.729 1.636
475 1HG2 ILE 64 1HG2 ILE 64 -4.060 -5.843 -0.482
476 2HG2 ILE 64 2HG2 ILE 64 -3.317 -6.031 1.128
477 3HG2 ILE 64 3HG2 ILE 64 -5.060 -6.208 0.945
478 1HD1 ILE 64 1HD1 ILE 64 -2.139 -4.716 -0.628
479 2HD1 ILE 64 2HD1 ILE 64 -2.838 -3.259 -1.342
480 3HD1 ILE 64 3HD1 ILE 64 -1.327 -3.154 -0.407
481 H GLU 65 H GLU 65 -7.151 -4.867 1.294
482 HA GLU 65 HA GLU 65 -7.972 -6.809 -0.600
483 1HB GLU 65 2HB GLU 65 -9.339 -5.594 1.843
484 2HB GLU 65 3HB GLU 65 -10.033 -6.928 0.924
485 1HG GLU 65 2HG GLU 65 -7.227 -7.099 2.043
486 2HG GLU 65 3HG GLU 65 -8.648 -7.495 3.013
487 H LYS 66 H LYS 66 -9.606 -3.727 0.348
488 HA LYS 66 HA LYS 66 -11.675 -4.039 -1.524
489 1HB LYS 66 2HB LYS 66 -10.736 -1.918 0.269
490 2HB LYS 66 3HB LYS 66 -11.393 -1.229 -1.215
491 1HG LYS 66 2HG LYS 66 -12.820 -3.363 0.413
492 2HG LYS 66 3HG LYS 66 -13.042 -1.635 0.703
493 1HD LYS 66 2HD LYS 66 -13.944 -1.232 -1.470
494 2HD LYS 66 3HD LYS 66 -13.439 -2.810 -2.087
495 1HE LYS 66 2HE LYS 66 -14.997 -3.948 -0.519
496 2HE LYS 66 3HE LYS 66 -15.549 -2.374 0.080
497 1HZ LYS 66 1HZ LYS 66 -16.350 -1.890 -2.132
498 2HZ LYS 66 2HZ LYS 66 -15.798 -3.335 -2.700
499 3HZ LYS 66 3HZ LYS 66 -17.009 -3.295 -1.590
500 H LEU 67 H LEU 67 -8.485 -2.681 -2.070
501 HA LEU 67 HA LEU 67 -9.020 -1.667 -4.734
502 1HB LEU 67 2HB LEU 67 -6.493 -2.316 -3.203
503 2HB LEU 67 3HB LEU 67 -6.483 -1.664 -4.842
504 HG LEU 67 HG LEU 67 -8.006 -0.221 -2.636
505 1HD1 LEU 67 1HD1 LEU 67 -5.748 -0.462 -1.765
506 2HD1 LEU 67 2HD1 LEU 67 -5.066 -0.038 -3.330
507 3HD1 LEU 67 3HD1 LEU 67 -5.916 1.188 -2.394
508 1HD2 LEU 67 1HD2 LEU 67 -8.430 0.481 -4.989
509 2HD2 LEU 67 2HD2 LEU 67 -7.602 1.734 -4.056
510 3HD2 LEU 67 3HD2 LEU 67 -6.691 0.749 -5.211
511 H GLY 68 H GLY 68 -8.562 -4.830 -3.390
512 1HA GLY 68 2HA GLY 68 -9.065 -6.774 -4.518
513 2HA GLY 68 3HA GLY 68 -8.729 -6.016 -6.078
514 H TYR 69 H TYR 69 -6.626 -6.073 -3.114
515 HA TYR 69 HA TYR 69 -4.639 -7.741 -4.601
516 1HB TYR 69 2HB TYR 69 -4.568 -4.914 -3.998
517 2HB TYR 69 3HB TYR 69 -3.360 -5.707 -3.015
518 HD1 TYR 69 HD1 TYR 69 -4.686 -5.550 -6.518
519 HD2 TYR 69 HD2 TYR 69 -1.304 -6.428 -3.992
520 HE1 TYR 69 HE1 TYR 69 -3.205 -5.398 -8.458
521 HE2 TYR 69 HE2 TYR 69 0.182 -6.174 -5.920
522 HH TYR 69 HH TYR 69 0.361 -5.709 -8.204
523 H HIS 70 H HIS 70 -2.747 -8.236 -3.054
524 HA HIS 70 HA HIS 70 -3.577 -8.401 -0.235
525 1HB HIS 70 2HB HIS 70 -3.015 -10.695 -2.025
526 2HB HIS 70 3HB HIS 70 -1.967 -10.661 -0.615
527 HD1 HIS 70 1HD HIS 70 -4.404 -9.527 1.407
528 HD2 HIS 70 2HD HIS 70 -4.178 -12.926 -1.069
529 HE1 HIS 70 1HE HIS 70 -5.794 -11.332 2.518
530 H VAL 71 H VAL 71 -1.906 -8.276 1.226
531 HA VAL 71 HA VAL 71 0.754 -7.513 0.213
532 HB VAL 71 HB VAL 71 -0.776 -5.531 0.847
533 1HG1 VAL 71 1HG1 VAL 71 -1.741 -6.531 2.930
534 2HG1 VAL 71 2HG1 VAL 71 -0.139 -6.408 3.691
535 3HG1 VAL 71 3HG1 VAL 71 -0.992 -4.945 3.183
536 1HG2 VAL 71 1HG2 VAL 71 1.607 -5.288 0.548
537 2HG2 VAL 71 2HG2 VAL 71 1.022 -4.278 1.871
538 3HG2 VAL 71 3HG2 VAL 71 1.890 -5.789 2.234
539 H VAL 72 H VAL 72 2.402 -8.025 1.807
540 HA VAL 72 HA VAL 72 1.612 -9.973 3.911
541 HB VAL 72 HB VAL 72 3.961 -10.294 2.112
542 1HG1 VAL 72 1HG1 VAL 72 3.958 -12.608 3.007
543 2HG1 VAL 72 2HG1 VAL 72 4.109 -11.426 4.309
544 3HG1 VAL 72 3HG1 VAL 72 2.546 -12.216 4.008
545 1HG2 VAL 72 1HG2 VAL 72 2.675 -12.170 1.016
546 2HG2 VAL 72 2HG2 VAL 72 1.215 -11.590 1.845
547 3HG2 VAL 72 3HG2 VAL 72 2.035 -10.570 0.639
548 H ILE 73 H ILE 73 2.896 -9.788 5.762
549 HA ILE 73 HA ILE 73 4.664 -7.382 5.859
550 HB ILE 73 HB ILE 73 2.865 -8.443 8.053
551 1HG1 ILE 73 2HG1 ILE 73 2.043 -5.949 7.765
552 2HG1 ILE 73 3HG1 ILE 73 2.755 -6.090 6.163
553 1HG2 ILE 73 1HG2 ILE 73 4.997 -7.422 8.872
554 2HG2 ILE 73 2HG2 ILE 73 4.659 -5.982 7.893
555 3HG2 ILE 73 3HG2 ILE 73 3.580 -6.428 9.233
556 1HD1 ILE 73 1HD1 ILE 73 1.190 -7.931 5.673
557 2HD1 ILE 73 2HD1 ILE 73 0.617 -7.849 7.367
558 3HD1 ILE 73 3HD1 ILE 73 0.346 -6.484 6.247
559 H GLU 74 H GLU 74 6.394 -8.859 5.127
560 HA GLU 74 HA GLU 74 7.380 -10.801 6.875
561 1HB GLU 74 2HB GLU 74 8.386 -9.394 4.401
562 2HB GLU 74 3HB GLU 74 9.393 -10.534 5.287
563 1HG GLU 74 2HG GLU 74 6.624 -11.313 4.286
564 2HG GLU 74 3HG GLU 74 8.099 -11.525 3.330
565 H GLY 75 H GLY 75 7.255 -7.658 7.315
566 1HA GLY 75 2HA GLY 75 9.622 -7.519 9.148
567 2HA GLY 75 3HA GLY 75 9.211 -6.160 8.080
568 H ARG 76 H ARG 76 7.514 -8.460 10.219
569 HA ARG 76 HA ARG 76 5.478 -6.500 10.886
570 1HB ARG 76 2HB ARG 76 5.395 -9.217 10.640
571 2HB ARG 76 3HB ARG 76 5.713 -9.090 12.377
572 1HG ARG 76 2HG ARG 76 3.755 -7.234 12.162
573 2HG ARG 76 3HG ARG 76 3.343 -8.202 10.745
574 1HD ARG 76 2HD ARG 76 3.309 -10.245 12.195
575 2HD ARG 76 3HD ARG 76 3.575 -9.230 13.617
576 HE ARG 76 HE ARG 76 1.116 -9.685 12.184
577 1HH1 ARG 76 2HH2 ARG 76 2.843 -7.169 13.965
578 2HH1 ARG 76 1HH2 ARG 76 1.434 -6.231 14.344
579 1HH2 ARG 76 2HH1 ARG 76 -0.775 -8.435 12.600
580 2HH2 ARG 76 1HH1 ARG 76 -0.684 -6.978 13.532
Start of MODEL 3
1 1H MET 1 H1 MET 1 1.089 18.258 18.805
2 2H MET 1 H2 MET 1 2.691 18.715 18.945
3 3H MET 1 H3 MET 1 1.551 19.723 18.265
4 HA MET 1 HA MET 1 2.648 18.833 16.446
5 1HB MET 1 2HB MET 1 2.969 16.579 18.237
6 2HB MET 1 3HB MET 1 2.147 15.993 16.794
7 1HG MET 1 2HG MET 1 3.925 16.829 15.367
8 2HG MET 1 3HG MET 1 4.715 17.629 16.743
9 1HE MET 1 1HE MET 1 6.194 15.653 14.669
10 2HE MET 1 2HE MET 1 6.992 16.532 16.001
11 3HE MET 1 3HE MET 1 7.221 14.776 15.824
12 H LEU 2 H LEU 2 1.458 17.701 14.584
13 HA LEU 2 HA LEU 2 -1.508 17.698 15.038
14 1HB LEU 2 2HB LEU 2 0.196 18.398 12.619
15 2HB LEU 2 3HB LEU 2 -1.540 18.091 12.513
16 HG LEU 2 HG LEU 2 -0.438 20.177 14.435
17 1HD1 LEU 2 1HD1 LEU 2 -0.810 21.873 12.676
18 2HD1 LEU 2 2HD1 LEU 2 0.474 20.737 12.230
19 3HD1 LEU 2 3HD1 LEU 2 -1.138 20.582 11.499
20 1HD2 LEU 2 1HD2 LEU 2 -3.107 19.898 12.972
21 2HD2 LEU 2 2HD2 LEU 2 -2.835 19.505 14.681
22 3HD2 LEU 2 3HD2 LEU 2 -2.676 21.175 14.123
23 H SER 3 H SER 3 0.702 16.377 12.552
24 HA SER 3 HA SER 3 -0.022 13.585 13.239
25 1HB SER 3 2HB SER 3 -0.282 15.030 10.555
26 2HB SER 3 3HB SER 3 -0.093 13.278 10.674
27 HG SER 3 HG SER 3 -1.963 13.071 11.655
28 H GLU 4 H GLU 4 1.790 12.236 12.952
29 HA GLU 4 HA GLU 4 4.306 13.410 11.931
30 1HB GLU 4 2HB GLU 4 3.574 11.116 13.675
31 2HB GLU 4 3HB GLU 4 5.004 10.987 12.688
32 1HG GLU 4 2HG GLU 4 5.733 13.165 13.647
33 2HG GLU 4 3HG GLU 4 4.389 13.011 14.780
34 H GLN 5 H GLN 5 5.454 11.523 10.582
35 HA GLN 5 HA GLN 5 3.564 10.017 8.883
36 1HB GLN 5 2HB GLN 5 5.997 11.659 8.115
37 2HB GLN 5 3HB GLN 5 5.272 10.525 6.999
38 1HG GLN 5 2HG GLN 5 3.776 12.898 8.269
39 2HG GLN 5 3HG GLN 5 4.657 12.974 6.769
40 1HE2 GLN 5 1HE2 GLN 5 3.431 9.865 6.629
41 2HE2 GLN 5 2HE2 GLN 5 1.939 10.232 5.808
42 H LYS 6 H LYS 6 4.443 7.962 8.375
43 HA LYS 6 HA LYS 6 7.304 7.550 8.751
44 1HB LYS 6 2HB LYS 6 5.304 5.643 10.020
45 2HB LYS 6 3HB LYS 6 7.047 5.385 9.851
46 1HG LYS 6 2HG LYS 6 7.370 7.586 11.162
47 2HG LYS 6 3HG LYS 6 5.643 7.524 11.502
48 1HD LYS 6 2HD LYS 6 6.555 6.544 13.389
49 2HD LYS 6 3HD LYS 6 6.133 5.117 12.415
50 1HE LYS 6 2HE LYS 6 8.536 5.073 11.573
51 2HE LYS 6 3HE LYS 6 8.884 6.481 12.587
52 1HZ LYS 6 1HZ LYS 6 8.066 3.828 13.558
53 2HZ LYS 6 2HZ LYS 6 9.572 4.487 13.646
54 3HZ LYS 6 3HZ LYS 6 8.338 5.149 14.510
55 H GLU 7 H GLU 7 8.096 5.806 7.576
56 HA GLU 7 HA GLU 7 6.599 5.269 5.090
57 1HB GLU 7 2HB GLU 7 9.609 5.169 5.453
58 2HB GLU 7 3HB GLU 7 8.615 5.410 4.018
59 1HG GLU 7 2HG GLU 7 9.721 7.467 4.534
60 2HG GLU 7 3HG GLU 7 8.038 7.721 5.016
61 H ILE 8 H ILE 8 5.661 3.256 5.697
62 HA ILE 8 HA ILE 8 7.344 1.277 7.055
63 HB ILE 8 HB ILE 8 4.522 1.168 6.120
64 1HG1 ILE 8 2HG1 ILE 8 3.921 1.306 8.567
65 2HG1 ILE 8 3HG1 ILE 8 5.620 1.549 8.983
66 1HG2 ILE 8 1HG2 ILE 8 4.381 -0.641 7.772
67 2HG2 ILE 8 2HG2 ILE 8 5.463 -1.000 6.413
68 3HG2 ILE 8 3HG2 ILE 8 6.154 -0.470 7.987
69 1HD1 ILE 8 1HD1 ILE 8 5.600 3.717 8.183
70 2HD1 ILE 8 2HD1 ILE 8 4.136 3.441 7.186
71 3HD1 ILE 8 3HD1 ILE 8 4.020 3.538 8.965
72 H ALA 9 H ALA 9 7.432 -0.880 5.988
73 HA ALA 9 HA ALA 9 7.557 -0.827 3.019
74 1HB ALA 9 1HB ALA 9 9.879 -0.534 3.911
75 2HB ALA 9 2HB ALA 9 9.683 -2.025 4.847
76 3HB ALA 9 3HB ALA 9 9.647 -2.082 3.072
77 H MET 10 H MET 10 6.338 -2.545 2.273
78 HA MET 10 HA MET 10 6.199 -5.018 3.921
79 1HB MET 10 2HB MET 10 3.762 -3.778 2.581
80 2HB MET 10 3HB MET 10 3.857 -5.283 3.501
81 1HG MET 10 2HG MET 10 3.064 -4.027 5.170
82 2HG MET 10 3HG MET 10 4.755 -3.654 5.423
83 1HE MET 10 1HE MET 10 1.242 -2.581 4.404
84 2HE MET 10 2HE MET 10 1.422 -0.933 3.775
85 3HE MET 10 3HE MET 10 1.986 -2.296 2.806
86 H GLN 11 H GLN 11 5.178 -6.794 2.484
87 HA GLN 11 HA GLN 11 6.568 -6.709 -0.148
88 1HB GLN 11 2HB GLN 11 5.867 -8.875 1.880
89 2HB GLN 11 3HB GLN 11 5.995 -9.314 0.182
90 1HG GLN 11 2HG GLN 11 8.177 -7.972 1.850
91 2HG GLN 11 3HG GLN 11 8.140 -9.676 1.342
92 1HE2 GLN 11 1HE2 GLN 11 7.538 -9.819 -1.192
93 2HE2 GLN 11 2HE2 GLN 11 8.252 -8.584 -2.209
94 H VAL 12 H VAL 12 5.477 -7.334 -2.035
95 HA VAL 12 HA VAL 12 2.507 -7.029 -1.838
96 HB VAL 12 HB VAL 12 4.387 -6.716 -4.214
97 1HG1 VAL 12 1HG1 VAL 12 1.383 -6.257 -3.916
98 2HG1 VAL 12 2HG1 VAL 12 2.354 -5.704 -5.293
99 3HG1 VAL 12 3HG1 VAL 12 2.179 -7.431 -4.993
100 1HG2 VAL 12 1HG2 VAL 12 3.665 -4.282 -3.942
101 2HG2 VAL 12 2HG2 VAL 12 2.937 -4.739 -2.399
102 3HG2 VAL 12 3HG2 VAL 12 4.695 -4.890 -2.642
103 H SER 13 H SER 13 1.139 -8.540 -2.932
104 HA SER 13 HA SER 13 2.371 -10.866 -4.191
105 1HB SER 13 2HB SER 13 2.014 -11.492 -1.749
106 2HB SER 13 3HB SER 13 0.276 -11.214 -2.006
107 HG SER 13 HG SER 13 1.987 -13.168 -3.134
108 H GLY 14 H GLY 14 0.340 -12.232 -4.932
109 1HA GLY 14 2HA GLY 14 -1.222 -12.308 -6.651
110 2HA GLY 14 3HA GLY 14 -2.098 -11.141 -5.644
111 H MET 15 H MET 15 0.819 -11.101 -7.799
112 HA MET 15 HA MET 15 -0.359 -8.881 -9.352
113 1HB MET 15 2HB MET 15 1.603 -7.525 -9.156
114 2HB MET 15 3HB MET 15 1.046 -7.926 -7.522
115 1HG MET 15 2HG MET 15 3.290 -8.271 -7.247
116 2HG MET 15 3HG MET 15 2.823 -9.892 -7.738
117 1HE MET 15 1HE MET 15 6.280 -9.803 -9.386
118 2HE MET 15 2HE MET 15 5.741 -9.389 -7.742
119 3HE MET 15 3HE MET 15 5.056 -10.805 -8.575
120 H THR 16 H THR 16 -0.072 -9.240 -11.477
121 HA THR 16 HA THR 16 2.539 -10.329 -12.381
122 HB THR 16 HB THR 16 0.969 -11.487 -14.247
123 HG1 THR 16 1HG THR 16 -0.777 -12.473 -13.078
124 1HG2 THR 16 1HG2 THR 16 1.289 -13.612 -13.129
125 2HG2 THR 16 2HG2 THR 16 2.728 -12.612 -12.889
126 3HG2 THR 16 3HG2 THR 16 1.558 -12.819 -11.569
127 H CYS 17 H CYS 17 0.683 -7.703 -12.422
128 HA CYS 17 HA CYS 17 0.873 -7.098 -15.303
129 1HB CYS 17 2HB CYS 17 -0.498 -5.538 -13.092
130 2HB CYS 17 3HB CYS 17 -0.817 -5.487 -14.830
131 H ALA 18 H ALA 18 2.374 -6.339 -12.274
132 HA ALA 18 HA ALA 18 3.723 -4.764 -11.461
133 1HB ALA 18 1HB ALA 18 4.245 -3.821 -14.315
134 2HB ALA 18 2HB ALA 18 5.181 -3.445 -12.861
135 3HB ALA 18 3HB ALA 18 5.116 -5.111 -13.465
136 H ALA 19 H ALA 19 2.095 -3.118 -14.182
137 HA ALA 19 HA ALA 19 1.838 -0.576 -13.168
138 1HB ALA 19 1HB ALA 19 -0.078 -0.325 -14.716
139 2HB ALA 19 2HB ALA 19 1.255 -1.228 -15.463
140 3HB ALA 19 3HB ALA 19 -0.183 -2.091 -14.879
141 H CYS 20 H CYS 20 -0.604 -3.176 -12.732
142 HA CYS 20 HA CYS 20 -2.484 -1.764 -11.295
143 1HB CYS 20 2HB CYS 20 -1.591 -4.691 -11.104
144 2HB CYS 20 3HB CYS 20 -3.091 -4.122 -10.395
145 H ALA 21 H ALA 21 0.567 -3.044 -10.032
146 HA ALA 21 HA ALA 21 -0.178 -2.840 -7.274
147 1HB ALA 21 1HB ALA 21 2.099 -3.273 -6.824
148 2HB ALA 21 2HB ALA 21 1.713 -4.188 -8.277
149 3HB ALA 21 3HB ALA 21 2.621 -2.667 -8.421
150 H ALA 22 H ALA 22 0.668 -0.441 -9.694
151 HA ALA 22 HA ALA 22 1.363 1.688 -7.815
152 1HB ALA 22 1HB ALA 22 1.170 3.124 -9.757
153 2HB ALA 22 2HB ALA 22 2.055 1.658 -10.240
154 3HB ALA 22 3HB ALA 22 0.344 1.859 -10.684
155 H ARG 23 H ARG 23 -1.473 0.674 -9.736
156 HA ARG 23 HA ARG 23 -3.236 2.773 -9.053
157 1HB ARG 23 2HB ARG 23 -3.704 -0.131 -9.793
158 2HB ARG 23 3HB ARG 23 -5.037 0.984 -9.503
159 1HG ARG 23 2HG ARG 23 -4.694 2.209 -11.379
160 2HG ARG 23 3HG ARG 23 -2.943 2.001 -11.380
161 1HD ARG 23 2HD ARG 23 -2.964 0.104 -12.598
162 2HD ARG 23 3HD ARG 23 -4.435 -0.540 -11.900
163 HE ARG 23 HE ARG 23 -4.138 1.128 -14.274
164 1HH1 ARG 23 2HH2 ARG 23 -6.377 0.097 -11.765
165 2HH1 ARG 23 1HH2 ARG 23 -7.811 0.225 -12.734
166 1HH2 ARG 23 2HH1 ARG 23 -6.025 1.376 -15.603
167 2HH2 ARG 23 1HH1 ARG 23 -7.597 1.019 -14.969
168 H ILE 24 H ILE 24 -2.744 -0.415 -7.410
169 HA ILE 24 HA ILE 24 -4.684 0.128 -5.452
170 HB ILE 24 HB ILE 24 -3.830 -1.602 -4.081
171 1HG1 ILE 24 2HG1 ILE 24 -1.407 -1.355 -5.793
172 2HG1 ILE 24 3HG1 ILE 24 -1.521 -1.175 -4.026
173 1HG2 ILE 24 1HG2 ILE 24 -5.012 -1.999 -6.362
174 2HG2 ILE 24 2HG2 ILE 24 -3.422 -2.524 -6.941
175 3HG2 ILE 24 3HG2 ILE 24 -4.200 -3.351 -5.573
176 1HD1 ILE 24 1HD1 ILE 24 -0.467 -3.289 -4.484
177 2HD1 ILE 24 2HD1 ILE 24 -2.106 -3.605 -3.867
178 3HD1 ILE 24 3HD1 ILE 24 -1.755 -3.731 -5.613
179 H GLU 25 H GLU 25 -1.144 0.725 -5.152
180 HA GLU 25 HA GLU 25 -1.181 1.959 -2.648
181 1HB GLU 25 2HB GLU 25 0.590 2.133 -5.090
182 2HB GLU 25 3HB GLU 25 0.886 3.230 -3.736
183 1HG GLU 25 2HG GLU 25 0.561 0.254 -3.214
184 2HG GLU 25 3HG GLU 25 2.103 0.937 -3.737
185 H LYS 26 H LYS 26 -1.831 3.450 -5.838
186 HA LYS 26 HA LYS 26 -1.955 6.133 -4.677
187 1HB LYS 26 2HB LYS 26 -2.966 5.127 -7.353
188 2HB LYS 26 3HB LYS 26 -2.798 6.826 -6.888
189 1HG LYS 26 2HG LYS 26 -0.486 4.838 -7.033
190 2HG LYS 26 3HG LYS 26 -0.962 5.933 -8.333
191 1HD LYS 26 2HD LYS 26 -0.363 7.878 -6.947
192 2HD LYS 26 3HD LYS 26 -0.106 6.846 -5.536
193 1HE LYS 26 2HE LYS 26 2.040 7.458 -6.465
194 2HE LYS 26 3HE LYS 26 1.779 5.716 -6.543
195 1HZ LYS 26 1HZ LYS 26 1.446 7.585 -8.802
196 2HZ LYS 26 2HZ LYS 26 2.725 6.581 -8.563
197 3HZ LYS 26 3HZ LYS 26 1.239 5.950 -8.867
198 H GLY 27 H GLY 27 -4.470 3.758 -5.672
199 1HA GLY 27 2HA GLY 27 -6.701 5.368 -4.833
200 2HA GLY 27 3HA GLY 27 -6.686 3.610 -5.012
201 H LEU 28 H LEU 28 -4.411 3.293 -3.142
202 HA LEU 28 HA LEU 28 -5.735 3.124 -0.579
203 1HB LEU 28 2HB LEU 28 -4.259 1.524 -1.391
204 2HB LEU 28 3HB LEU 28 -2.915 2.655 -1.478
205 HG LEU 28 HG LEU 28 -4.267 2.161 1.172
206 1HD1 LEU 28 1HD1 LEU 28 -2.651 0.231 1.432
207 2HD1 LEU 28 2HD1 LEU 28 -3.991 -0.018 0.300
208 3HD1 LEU 28 3HD1 LEU 28 -2.354 0.337 -0.310
209 1HD2 LEU 28 1HD2 LEU 28 -2.127 2.894 1.998
210 2HD2 LEU 28 2HD2 LEU 28 -1.326 2.536 0.450
211 3HD2 LEU 28 3HD2 LEU 28 -2.416 3.917 0.600
212 H LYS 29 H LYS 29 -3.128 5.291 -1.886
213 HA LYS 29 HA LYS 29 -2.849 6.959 0.309
214 1HB LYS 29 2HB LYS 29 -1.504 7.068 -1.826
215 2HB LYS 29 3HB LYS 29 -2.856 7.938 -2.556
216 1HG LYS 29 2HG LYS 29 -2.394 9.351 -0.158
217 2HG LYS 29 3HG LYS 29 -0.797 8.853 -0.609
218 1HD LYS 29 2HD LYS 29 -2.657 10.169 -2.636
219 2HD LYS 29 3HD LYS 29 -1.881 11.151 -1.406
220 1HE LYS 29 2HE LYS 29 0.009 9.350 -2.835
221 2HE LYS 29 3HE LYS 29 -0.774 10.531 -3.885
222 1HZ LYS 29 1HZ LYS 29 1.364 11.194 -2.764
223 2HZ LYS 29 2HZ LYS 29 0.141 12.298 -2.638
224 3HZ LYS 29 3HZ LYS 29 0.552 11.342 -1.378
225 H ARG 30 H ARG 30 -5.480 6.973 -2.040
226 HA ARG 30 HA ARG 30 -6.617 9.435 -1.206
227 1HB ARG 30 2HB ARG 30 -7.392 7.151 -2.903
228 2HB ARG 30 3HB ARG 30 -8.779 7.912 -2.157
229 1HG ARG 30 2HG ARG 30 -6.610 9.439 -3.671
230 2HG ARG 30 3HG ARG 30 -8.084 8.801 -4.413
231 1HD ARG 30 2HD ARG 30 -9.467 10.109 -2.798
232 2HD ARG 30 3HD ARG 30 -8.038 10.894 -2.168
233 HE ARG 30 HE ARG 30 -9.426 11.331 -4.709
234 1HH1 ARG 30 2HH2 ARG 30 -6.375 11.837 -3.020
235 2HH1 ARG 30 1HH2 ARG 30 -5.885 13.207 -3.968
236 1HH2 ARG 30 2HH1 ARG 30 -8.793 13.107 -6.028
237 2HH2 ARG 30 1HH1 ARG 30 -7.291 13.921 -5.749
238 H MET 31 H MET 31 -6.379 6.729 0.828
239 HA MET 31 HA MET 31 -8.887 7.164 2.275
240 1HB MET 31 2HB MET 31 -6.323 5.629 2.666
241 2HB MET 31 3HB MET 31 -7.251 5.964 4.101
242 1HG MET 31 2HG MET 31 -9.299 4.999 3.030
243 2HG MET 31 3HG MET 31 -8.272 4.516 1.676
244 1HE MET 31 1HE MET 31 -5.860 2.010 3.389
245 2HE MET 31 2HE MET 31 -6.148 3.116 2.036
246 3HE MET 31 3HE MET 31 -5.559 3.740 3.599
247 HA PRO 32 HA PRO 32 -7.295 10.274 5.227
248 1HB PRO 32 2HB PRO 32 -8.040 9.222 7.651
249 2HB PRO 32 3HB PRO 32 -9.199 9.990 6.533
250 1HG PRO 32 2HG PRO 32 -8.597 7.033 6.819
251 2HG PRO 32 3HG PRO 32 -10.201 7.823 6.834
252 1HD PRO 32 2HD PRO 32 -9.253 6.699 4.586
253 2HD PRO 32 3HD PRO 32 -10.092 8.254 4.486
254 H GLY 33 H GLY 33 -5.669 10.251 7.064
255 1HA GLY 33 2HA GLY 33 -3.783 9.714 8.061
256 2HA GLY 33 3HA GLY 33 -4.235 8.005 7.819
257 H VAL 34 H VAL 34 -4.105 8.076 4.958
258 HA VAL 34 HA VAL 34 -1.222 7.734 4.688
259 HB VAL 34 HB VAL 34 -3.452 7.355 2.699
260 1HG1 VAL 34 1HG1 VAL 34 -1.090 7.350 1.739
261 2HG1 VAL 34 2HG1 VAL 34 -0.583 6.219 3.001
262 3HG1 VAL 34 3HG1 VAL 34 -1.701 5.687 1.749
263 1HG2 VAL 34 1HG2 VAL 34 -3.248 4.895 3.364
264 2HG2 VAL 34 2HG2 VAL 34 -2.351 5.466 4.798
265 3HG2 VAL 34 3HG2 VAL 34 -4.039 5.943 4.538
266 H THR 35 H THR 35 0.171 9.037 3.602
267 HA THR 35 HA THR 35 -0.946 11.559 2.439
268 HB THR 35 HB THR 35 1.607 11.021 3.855
269 HG1 THR 35 1HG THR 35 0.505 12.335 5.426
270 1HG2 THR 35 1HG2 THR 35 1.827 13.504 3.858
271 2HG2 THR 35 2HG2 THR 35 1.947 12.817 2.229
272 3HG2 THR 35 3HG2 THR 35 0.438 13.608 2.754
273 H ASP 36 H ASP 36 1.647 9.041 2.041
274 HA ASP 36 HA ASP 36 1.358 9.374 -0.816
275 1HB ASP 36 2HB ASP 36 3.740 10.461 0.547
276 2HB ASP 36 3HB ASP 36 4.151 9.214 -0.641
277 H ALA 37 H ALA 37 2.626 7.734 -1.981
278 HA ALA 37 HA ALA 37 2.919 5.193 -0.619
279 1HB ALA 37 1HB ALA 37 0.383 5.581 -0.680
280 2HB ALA 37 2HB ALA 37 0.501 5.592 -2.451
281 3HB ALA 37 3HB ALA 37 0.901 4.135 -1.524
282 H ASN 38 H ASN 38 3.864 3.594 -1.955
283 HA ASN 38 HA ASN 38 4.689 4.403 -4.622
284 1HB ASN 38 2HB ASN 38 7.197 4.226 -3.233
285 2HB ASN 38 3HB ASN 38 6.565 5.484 -4.287
286 1HD2 ASN 38 1HD2 ASN 38 5.886 4.421 -0.879
287 2HD2 ASN 38 2HD2 ASN 38 6.233 6.011 -0.204
288 H VAL 39 H VAL 39 4.591 2.508 -5.588
289 HA VAL 39 HA VAL 39 5.076 0.078 -4.083
290 HB VAL 39 HB VAL 39 3.140 0.558 -5.604
291 1HG1 VAL 39 1HG1 VAL 39 4.393 1.420 -7.581
292 2HG1 VAL 39 2HG1 VAL 39 4.924 -0.248 -7.913
293 3HG1 VAL 39 3HG1 VAL 39 3.219 0.144 -7.928
294 1HG2 VAL 39 1HG2 VAL 39 2.727 -1.600 -5.520
295 2HG2 VAL 39 2HG2 VAL 39 4.089 -2.008 -6.589
296 3HG2 VAL 39 3HG2 VAL 39 4.330 -1.817 -4.839
297 H ASN 40 H ASN 40 7.203 -0.532 -3.802
298 HA ASN 40 HA ASN 40 9.195 0.166 -5.882
299 1HB ASN 40 2HB ASN 40 9.605 0.673 -3.480
300 2HB ASN 40 3HB ASN 40 9.586 -1.063 -3.133
301 1HD2 ASN 40 1HD2 ASN 40 11.851 -0.095 -2.355
302 2HD2 ASN 40 2HD2 ASN 40 13.141 -0.270 -3.534
303 H LEU 41 H LEU 41 7.570 -1.414 -7.034
304 HA LEU 41 HA LEU 41 7.899 -4.232 -6.549
305 1HB LEU 41 2HB LEU 41 6.326 -2.517 -8.295
306 2HB LEU 41 3HB LEU 41 7.016 -3.816 -9.250
307 HG LEU 41 HG LEU 41 4.733 -4.176 -8.246
308 1HD1 LEU 41 1HD1 LEU 41 5.164 -6.568 -7.699
309 2HD1 LEU 41 2HD1 LEU 41 5.925 -6.035 -9.211
310 3HD1 LEU 41 3HD1 LEU 41 6.906 -6.243 -7.750
311 1HD2 LEU 41 1HD2 LEU 41 4.362 -4.616 -6.039
312 2HD2 LEU 41 2HD2 LEU 41 6.019 -5.126 -5.692
313 3HD2 LEU 41 3HD2 LEU 41 5.653 -3.406 -5.850
314 H ALA 42 H ALA 42 9.813 -1.945 -8.239
315 HA ALA 42 HA ALA 42 11.431 -3.468 -9.912
316 1HB ALA 42 1HB ALA 42 13.248 -1.970 -9.241
317 2HB ALA 42 2HB ALA 42 11.742 -1.043 -9.449
318 3HB ALA 42 3HB ALA 42 12.332 -1.455 -7.815
319 H THR 43 H THR 43 11.308 -3.507 -6.313
320 HA THR 43 HA THR 43 12.974 -5.968 -6.443
321 HB THR 43 HB THR 43 14.379 -4.217 -5.570
322 HG1 THR 43 1HG THR 43 13.464 -6.130 -3.709
323 1HG2 THR 43 1HG2 THR 43 13.943 -3.137 -3.421
324 2HG2 THR 43 2HG2 THR 43 12.661 -2.732 -4.574
325 3HG2 THR 43 3HG2 THR 43 12.362 -3.929 -3.295
326 H GLU 44 H GLU 44 10.116 -5.627 -6.632
327 HA GLU 44 HA GLU 44 8.229 -6.516 -5.917
328 1HB GLU 44 2HB GLU 44 10.224 -8.401 -5.854
329 2HB GLU 44 3HB GLU 44 9.507 -8.636 -4.265
330 1HG GLU 44 2HG GLU 44 7.286 -8.937 -5.342
331 2HG GLU 44 3HG GLU 44 7.997 -8.572 -6.930
332 H THR 45 H THR 45 9.174 -4.341 -4.130
333 HA THR 45 HA THR 45 7.855 -5.122 -1.562
334 HB THR 45 HB THR 45 10.134 -3.207 -2.221
335 HG1 THR 45 1HG THR 45 10.014 -5.796 -1.082
336 1HG2 THR 45 1HG2 THR 45 8.950 -2.334 -0.280
337 2HG2 THR 45 2HG2 THR 45 8.978 -3.949 0.486
338 3HG2 THR 45 3HG2 THR 45 10.486 -3.059 0.206
339 H VAL 46 H VAL 46 6.745 -3.259 -0.473
340 HA VAL 46 HA VAL 46 5.990 -1.017 -2.269
341 HB VAL 46 HB VAL 46 4.122 -2.502 -2.378
342 1HG1 VAL 46 1HG1 VAL 46 4.403 -3.912 -0.389
343 2HG1 VAL 46 2HG1 VAL 46 4.103 -2.514 0.671
344 3HG1 VAL 46 3HG1 VAL 46 2.811 -3.151 -0.359
345 1HG2 VAL 46 1HG2 VAL 46 3.419 -0.299 -0.411
346 2HG2 VAL 46 2HG2 VAL 46 3.715 -0.069 -2.149
347 3HG2 VAL 46 3HG2 VAL 46 2.366 -1.082 -1.602
348 H ASN 47 H ASN 47 5.801 0.991 -1.229
349 HA ASN 47 HA ASN 47 6.442 1.028 1.663
350 1HB ASN 47 2HB ASN 47 7.701 2.594 -0.630
351 2HB ASN 47 3HB ASN 47 7.623 3.271 0.998
352 1HD2 ASN 47 1HD2 ASN 47 8.363 1.667 2.816
353 2HD2 ASN 47 2HD2 ASN 47 9.972 1.045 2.475
354 H VAL 48 H VAL 48 5.089 2.459 2.821
355 HA VAL 48 HA VAL 48 3.243 4.109 1.218
356 HB VAL 48 HB VAL 48 2.044 2.059 1.538
357 1HG1 VAL 48 1HG1 VAL 48 3.115 0.996 3.379
358 2HG1 VAL 48 2HG1 VAL 48 2.722 2.315 4.490
359 3HG1 VAL 48 3HG1 VAL 48 1.430 1.297 3.848
360 1HG2 VAL 48 1HG2 VAL 48 1.072 4.304 3.346
361 2HG2 VAL 48 2HG2 VAL 48 0.768 4.095 1.615
362 3HG2 VAL 48 3HG2 VAL 48 0.096 2.940 2.780
363 H ILE 49 H ILE 49 3.067 6.058 2.054
364 HA ILE 49 HA ILE 49 4.678 6.613 4.432
365 HB ILE 49 HB ILE 49 3.800 8.601 2.295
366 1HG1 ILE 49 2HG1 ILE 49 4.956 7.042 0.985
367 2HG1 ILE 49 3HG1 ILE 49 6.038 8.397 1.295
368 1HG2 ILE 49 1HG2 ILE 49 5.763 9.872 3.115
369 2HG2 ILE 49 2HG2 ILE 49 4.519 9.627 4.347
370 3HG2 ILE 49 3HG2 ILE 49 5.996 8.657 4.389
371 1HD1 ILE 49 1HD1 ILE 49 6.173 5.604 2.477
372 2HD1 ILE 49 2HD1 ILE 49 7.405 6.491 1.569
373 3HD1 ILE 49 3HD1 ILE 49 6.995 6.984 3.220
374 H TYR 50 H TYR 50 3.227 6.688 6.199
375 HA TYR 50 HA TYR 50 0.740 8.304 5.887
376 1HB TYR 50 2HB TYR 50 -0.655 6.617 6.797
377 2HB TYR 50 3HB TYR 50 0.108 6.008 5.360
378 HD1 TYR 50 HD1 TYR 50 1.620 4.063 5.479
379 HD2 TYR 50 HD2 TYR 50 -0.081 5.749 9.041
380 HE1 TYR 50 HE1 TYR 50 1.939 1.900 6.668
381 HE2 TYR 50 HE2 TYR 50 0.471 3.688 10.284
382 HH TYR 50 HH TYR 50 1.365 1.556 10.139
383 H ASP 51 H ASP 51 -0.377 8.635 7.854
384 HA ASP 51 HA ASP 51 1.486 9.352 10.030
385 1HB ASP 51 2HB ASP 51 -0.085 11.039 9.423
386 2HB ASP 51 3HB ASP 51 -1.441 9.927 9.580
387 HA PRO 52 HA PRO 52 0.214 5.359 11.774
388 1HB PRO 52 2HB PRO 52 2.029 5.077 13.754
389 2HB PRO 52 3HB PRO 52 2.472 4.952 12.027
390 1HG PRO 52 2HG PRO 52 2.670 7.417 13.791
391 2HG PRO 52 3HG PRO 52 3.967 6.675 12.814
392 1HD PRO 52 2HD PRO 52 2.475 8.748 11.889
393 2HD PRO 52 3HD PRO 52 2.966 7.423 10.786
394 H ALA 53 H ALA 53 -0.451 8.473 12.965
395 HA ALA 53 HA ALA 53 -1.642 7.501 15.491
396 1HB ALA 53 1HB ALA 53 -2.249 9.823 15.779
397 2HB ALA 53 2HB ALA 53 -0.523 9.742 15.357
398 3HB ALA 53 3HB ALA 53 -1.723 10.221 14.135
399 H GLU 54 H GLU 54 -2.318 8.027 12.059
400 HA GLU 54 HA GLU 54 -5.209 8.141 12.638
401 1HB GLU 54 2HB GLU 54 -3.691 9.871 11.067
402 2HB GLU 54 3HB GLU 54 -4.442 8.774 9.900
403 1HG GLU 54 2HG GLU 54 -6.674 9.256 10.919
404 2HG GLU 54 3HG GLU 54 -5.881 10.407 12.009
405 H THR 55 H THR 55 -2.787 6.715 10.451
406 HA THR 55 HA THR 55 -4.415 4.259 10.321
407 HB THR 55 HB THR 55 -2.748 3.657 8.299
408 HG1 THR 55 1HG THR 55 -3.058 6.430 8.209
409 1HG2 THR 55 1HG2 THR 55 -5.141 3.608 8.258
410 2HG2 THR 55 2HG2 THR 55 -5.240 5.403 8.176
411 3HG2 THR 55 3HG2 THR 55 -4.525 4.480 6.826
412 H GLY 56 H GLY 56 -2.721 2.435 9.830
413 1HA GLY 56 2HA GLY 56 -0.732 1.660 11.538
414 2HA GLY 56 3HA GLY 56 -2.128 1.983 12.596
415 H THR 57 H THR 57 -1.129 0.418 9.877
416 HA THR 57 HA THR 57 -1.809 -0.432 8.110
417 HB THR 57 HB THR 57 -1.545 -2.949 8.237
418 HG1 THR 57 1HG THR 57 -1.327 -2.327 10.997
419 1HG2 THR 57 1HG2 THR 57 0.549 -1.329 9.762
420 2HG2 THR 57 2HG2 THR 57 0.777 -2.912 9.004
421 3HG2 THR 57 3HG2 THR 57 0.442 -1.492 7.996
422 H ALA 58 H ALA 58 -4.090 -1.228 10.610
423 HA ALA 58 HA ALA 58 -6.170 -2.537 9.687
424 1HB ALA 58 1HB ALA 58 -6.056 0.320 10.705
425 2HB ALA 58 2HB ALA 58 -7.538 -0.683 10.725
426 3HB ALA 58 3HB ALA 58 -6.114 -1.141 11.695
427 H ALA 59 H ALA 59 -5.565 0.782 8.497
428 HA ALA 59 HA ALA 59 -8.058 0.493 6.903
429 1HB ALA 59 1HB ALA 59 -7.216 2.686 7.997
430 2HB ALA 59 2HB ALA 59 -6.214 2.821 6.512
431 3HB ALA 59 3HB ALA 59 -7.977 2.724 6.411
432 H ILE 60 H ILE 60 -4.601 0.472 6.456
433 HA ILE 60 HA ILE 60 -4.451 0.376 3.628
434 HB ILE 60 HB ILE 60 -2.639 -0.238 5.945
435 1HG1 ILE 60 2HG1 ILE 60 -1.155 1.176 4.445
436 2HG1 ILE 60 3HG1 ILE 60 -2.525 1.246 3.322
437 1HG2 ILE 60 1HG2 ILE 60 -2.200 -2.250 4.649
438 2HG2 ILE 60 2HG2 ILE 60 -2.047 -1.292 3.156
439 3HG2 ILE 60 3HG2 ILE 60 -0.882 -1.099 4.488
440 1HD1 ILE 60 1HD1 ILE 60 -2.634 2.185 6.236
441 2HD1 ILE 60 2HD1 ILE 60 -2.193 3.236 4.884
442 3HD1 ILE 60 3HD1 ILE 60 -3.820 2.538 4.954
443 H GLN 61 H GLN 61 -4.591 -2.354 5.988
444 HA GLN 61 HA GLN 61 -4.591 -4.322 3.932
445 1HB GLN 61 2HB GLN 61 -4.940 -4.327 6.810
446 2HB GLN 61 3HB GLN 61 -6.167 -5.322 6.022
447 1HG GLN 61 2HG GLN 61 -4.620 -6.915 6.272
448 2HG GLN 61 3HG GLN 61 -4.142 -6.357 4.676
449 1HE2 GLN 61 1HE2 GLN 61 -2.860 -3.854 5.710
450 2HE2 GLN 61 2HE2 GLN 61 -1.402 -4.401 6.534
451 H GLU 62 H GLU 62 -7.323 -2.720 5.672
452 HA GLU 62 HA GLU 62 -9.504 -3.896 4.450
453 1HB GLU 62 2HB GLU 62 -8.905 -1.182 5.587
454 2HB GLU 62 3HB GLU 62 -10.343 -1.310 4.589
455 1HG GLU 62 2HG GLU 62 -11.195 -3.133 6.019
456 2HG GLU 62 3HG GLU 62 -9.722 -3.049 7.008
457 H LYS 63 H LYS 63 -7.786 -0.983 3.132
458 HA LYS 63 HA LYS 63 -9.358 -1.072 0.747
459 1HB LYS 63 2HB LYS 63 -7.031 0.471 1.810
460 2HB LYS 63 3HB LYS 63 -7.189 0.407 0.087
461 1HG LYS 63 2HG LYS 63 -9.375 1.262 2.027
462 2HG LYS 63 3HG LYS 63 -8.304 2.360 1.145
463 1HD LYS 63 2HD LYS 63 -10.254 0.542 -0.301
464 2HD LYS 63 3HD LYS 63 -10.663 2.154 0.277
465 1HE LYS 63 2HE LYS 63 -8.176 1.796 -1.413
466 2HE LYS 63 3HE LYS 63 -9.749 1.760 -2.211
467 1HZ LYS 63 1HZ LYS 63 -8.936 3.955 -0.433
468 2HZ LYS 63 2HZ LYS 63 -8.611 3.971 -2.019
469 3HZ LYS 63 3HZ LYS 63 -10.184 3.935 -1.513
470 H ILE 64 H ILE 64 -6.131 -2.353 1.580
471 HA ILE 64 HA ILE 64 -5.117 -3.059 -0.872
472 HB ILE 64 HB ILE 64 -4.793 -3.805 1.886
473 1HG1 ILE 64 2HG1 ILE 64 -3.345 -2.330 0.499
474 2HG1 ILE 64 3HG1 ILE 64 -2.542 -3.553 1.479
475 1HG2 ILE 64 1HG2 ILE 64 -3.480 -5.853 1.544
476 2HG2 ILE 64 2HG2 ILE 64 -5.225 -6.049 1.469
477 3HG2 ILE 64 3HG2 ILE 64 -4.276 -6.039 -0.037
478 1HD1 ILE 64 1HD1 ILE 64 -1.538 -3.445 -0.740
479 2HD1 ILE 64 2HD1 ILE 64 -2.303 -5.023 -0.471
480 3HD1 ILE 64 3HD1 ILE 64 -3.104 -3.818 -1.498
481 H GLU 65 H GLU 65 -7.278 -4.949 1.311
482 HA GLU 65 HA GLU 65 -7.913 -7.120 -0.393
483 1HB GLU 65 2HB GLU 65 -9.274 -5.797 1.981
484 2HB GLU 65 3HB GLU 65 -10.030 -7.155 1.144
485 1HG GLU 65 2HG GLU 65 -7.170 -7.407 2.071
486 2HG GLU 65 3HG GLU 65 -8.504 -7.610 3.213
487 H LYS 66 H LYS 66 -9.878 -4.154 0.268
488 HA LYS 66 HA LYS 66 -11.912 -4.808 -1.585
489 1HB LYS 66 2HB LYS 66 -11.087 -2.378 -0.084
490 2HB LYS 66 3HB LYS 66 -11.881 -2.029 -1.617
491 1HG LYS 66 2HG LYS 66 -13.554 -2.100 0.056
492 2HG LYS 66 3HG LYS 66 -13.763 -3.497 -1.019
493 1HD LYS 66 2HD LYS 66 -12.456 -4.878 0.723
494 2HD LYS 66 3HD LYS 66 -12.552 -3.490 1.801
495 1HE LYS 66 2HE LYS 66 -14.880 -5.078 0.584
496 2HE LYS 66 3HE LYS 66 -14.320 -5.173 2.258
497 1HZ LYS 66 1HZ LYS 66 -16.250 -3.792 2.063
498 2HZ LYS 66 2HZ LYS 66 -14.971 -2.874 2.542
499 3HZ LYS 66 3HZ LYS 66 -15.511 -2.798 0.986
500 H LEU 67 H LEU 67 -8.828 -3.248 -2.221
501 HA LEU 67 HA LEU 67 -9.408 -2.446 -4.928
502 1HB LEU 67 2HB LEU 67 -6.855 -2.848 -3.354
503 2HB LEU 67 3HB LEU 67 -6.871 -2.280 -5.023
504 HG LEU 67 HG LEU 67 -8.539 -0.842 -2.925
505 1HD1 LEU 67 1HD1 LEU 67 -6.258 -0.925 -2.010
506 2HD1 LEU 67 2HD1 LEU 67 -5.610 -0.392 -3.556
507 3HD1 LEU 67 3HD1 LEU 67 -6.611 0.707 -2.610
508 1HD2 LEU 67 1HD2 LEU 67 -8.934 -0.270 -5.309
509 2HD2 LEU 67 2HD2 LEU 67 -8.184 1.075 -4.441
510 3HD2 LEU 67 3HD2 LEU 67 -7.204 0.061 -5.517
511 H GLY 68 H GLY 68 -8.791 -5.528 -3.490
512 1HA GLY 68 2HA GLY 68 -9.011 -7.561 -4.551
513 2HA GLY 68 3HA GLY 68 -8.741 -6.819 -6.136
514 H TYR 69 H TYR 69 -6.799 -6.633 -3.085
515 HA TYR 69 HA TYR 69 -4.537 -8.062 -4.384
516 1HB TYR 69 2HB TYR 69 -4.790 -5.178 -3.911
517 2HB TYR 69 3HB TYR 69 -3.474 -5.846 -2.970
518 HD1 TYR 69 HD1 TYR 69 -4.865 -5.611 -6.428
519 HD2 TYR 69 HD2 TYR 69 -1.455 -6.641 -3.999
520 HE1 TYR 69 HE1 TYR 69 -3.437 -5.556 -8.416
521 HE2 TYR 69 HE2 TYR 69 -0.024 -6.563 -5.969
522 HH TYR 69 HH TYR 69 0.097 -6.168 -8.248
523 H HIS 70 H HIS 70 -2.748 -8.347 -2.699
524 HA HIS 70 HA HIS 70 -3.670 -8.301 0.091
525 1HB HIS 70 2HB HIS 70 -4.226 -10.566 -0.964
526 2HB HIS 70 3HB HIS 70 -2.486 -10.848 -1.053
527 HD1 HIS 70 1HD HIS 70 -1.573 -9.917 1.865
528 HD2 HIS 70 2HD HIS 70 -5.127 -12.004 0.957
529 HE1 HIS 70 1HE HIS 70 -2.294 -11.076 3.985
530 H VAL 71 H VAL 71 -2.046 -7.500 1.289
531 HA VAL 71 HA VAL 71 0.705 -7.368 0.172
532 HB VAL 71 HB VAL 71 -0.556 -5.277 0.882
533 1HG1 VAL 71 1HG1 VAL 71 0.062 -6.217 3.710
534 2HG1 VAL 71 2HG1 VAL 71 -0.658 -4.677 3.218
535 3HG1 VAL 71 3HG1 VAL 71 -1.564 -6.182 2.999
536 1HG2 VAL 71 1HG2 VAL 71 1.390 -4.241 1.877
537 2HG2 VAL 71 2HG2 VAL 71 2.102 -5.836 2.196
538 3HG2 VAL 71 3HG2 VAL 71 1.829 -5.284 0.524
539 H VAL 72 H VAL 72 2.466 -8.033 1.591
540 HA VAL 72 HA VAL 72 1.712 -10.013 3.687
541 HB VAL 72 HB VAL 72 4.000 -10.181 1.795
542 1HG1 VAL 72 1HG1 VAL 72 4.468 -11.286 3.922
543 2HG1 VAL 72 2HG1 VAL 72 2.908 -12.134 3.865
544 3HG1 VAL 72 3HG1 VAL 72 4.178 -12.513 2.687
545 1HG2 VAL 72 1HG2 VAL 72 1.361 -11.732 1.821
546 2HG2 VAL 72 2HG2 VAL 72 1.882 -10.598 0.556
547 3HG2 VAL 72 3HG2 VAL 72 2.751 -12.119 0.787
548 H ILE 73 H ILE 73 2.964 -9.962 5.507
549 HA ILE 73 HA ILE 73 4.364 -7.358 5.928
550 HB ILE 73 HB ILE 73 3.087 -9.062 8.052
551 1HG1 ILE 73 2HG1 ILE 73 1.304 -8.368 6.545
552 2HG1 ILE 73 3HG1 ILE 73 1.276 -7.438 8.035
553 1HG2 ILE 73 1HG2 ILE 73 4.783 -7.560 8.932
554 2HG2 ILE 73 2HG2 ILE 73 4.238 -6.240 7.904
555 3HG2 ILE 73 3HG2 ILE 73 3.218 -6.809 9.250
556 1HD1 ILE 73 1HD1 ILE 73 2.308 -5.505 6.896
557 2HD1 ILE 73 2HD1 ILE 73 2.321 -6.420 5.366
558 3HD1 ILE 73 3HD1 ILE 73 0.788 -6.003 6.143
559 H GLU 74 H GLU 74 6.084 -8.691 4.785
560 HA GLU 74 HA GLU 74 7.320 -10.753 6.122
561 1HB GLU 74 2HB GLU 74 7.600 -9.588 3.648
562 2HB GLU 74 3HB GLU 74 9.211 -9.436 4.382
563 1HG GLU 74 2HG GLU 74 9.193 -11.512 3.209
564 2HG GLU 74 3HG GLU 74 8.994 -11.962 4.909
565 H GLY 75 H GLY 75 7.431 -7.641 6.907
566 1HA GLY 75 2HA GLY 75 10.046 -7.240 8.071
567 2HA GLY 75 3HA GLY 75 8.580 -6.314 8.439
568 H ARG 76 H ARG 76 6.987 -8.650 9.203
569 HA ARG 76 HA ARG 76 6.316 -9.723 10.989
570 1HB ARG 76 2HB ARG 76 8.040 -11.184 10.160
571 2HB ARG 76 3HB ARG 76 9.277 -10.363 11.099
572 1HG ARG 76 2HG ARG 76 8.711 -12.518 12.026
573 2HG ARG 76 3HG ARG 76 8.416 -11.220 13.171
574 1HD ARG 76 2HD ARG 76 6.026 -11.914 11.524
575 2HD ARG 76 3HD ARG 76 6.673 -13.272 12.468
576 HE ARG 76 HE ARG 76 6.363 -10.688 13.860
577 1HH1 ARG 76 2HH2 ARG 76 4.561 -13.507 12.898
578 2HH1 ARG 76 1HH2 ARG 76 3.737 -13.785 14.405
579 1HH2 ARG 76 2HH1 ARG 76 5.435 -11.072 16.005
580 2HH2 ARG 76 1HH1 ARG 76 4.236 -12.311 16.236
Start of MODEL 4
1 1H MET 1 H1 MET 1 1.109 14.436 18.632
2 2H MET 1 H2 MET 1 0.773 14.707 20.227
3 3H MET 1 H3 MET 1 -0.427 14.788 19.093
4 HA MET 1 HA MET 1 0.153 16.975 19.746
5 1HB MET 1 2HB MET 1 2.935 15.994 19.046
6 2HB MET 1 3HB MET 1 2.514 17.699 18.819
7 1HG MET 1 2HG MET 1 1.859 17.942 21.130
8 2HG MET 1 3HG MET 1 2.231 16.242 21.467
9 1HE MET 1 1HE MET 1 3.327 19.027 22.927
10 2HE MET 1 2HE MET 1 3.581 17.377 23.553
11 3HE MET 1 3HE MET 1 4.968 18.467 23.316
12 H LEU 2 H LEU 2 2.152 16.095 16.904
13 HA LEU 2 HA LEU 2 0.069 17.249 15.117
14 1HB LEU 2 2HB LEU 2 2.467 18.324 15.417
15 2HB LEU 2 3HB LEU 2 3.029 16.900 14.541
16 HG LEU 2 HG LEU 2 1.356 17.594 12.680
17 1HD1 LEU 2 1HD1 LEU 2 -0.014 19.196 14.027
18 2HD1 LEU 2 2HD1 LEU 2 1.430 20.193 14.298
19 3HD1 LEU 2 3HD1 LEU 2 0.764 20.011 12.665
20 1HD2 LEU 2 1HD2 LEU 2 2.937 19.283 11.795
21 2HD2 LEU 2 2HD2 LEU 2 3.693 19.414 13.397
22 3HD2 LEU 2 3HD2 LEU 2 3.783 17.890 12.488
23 H SER 3 H SER 3 -0.276 15.994 13.100
24 HA SER 3 HA SER 3 -0.066 13.182 13.296
25 1HB SER 3 2HB SER 3 -0.312 14.755 10.707
26 2HB SER 3 3HB SER 3 -1.014 13.187 11.134
27 HG SER 3 HG SER 3 -2.608 14.742 11.366
28 H GLU 4 H GLU 4 2.027 12.375 13.588
29 HA GLU 4 HA GLU 4 4.307 13.335 12.055
30 1HB GLU 4 2HB GLU 4 3.790 11.276 14.117
31 2HB GLU 4 3HB GLU 4 5.099 10.932 13.009
32 1HG GLU 4 2HG GLU 4 6.020 13.160 13.523
33 2HG GLU 4 3HG GLU 4 4.782 13.302 14.781
34 H GLN 5 H GLN 5 5.542 11.403 10.840
35 HA GLN 5 HA GLN 5 3.640 9.939 9.107
36 1HB GLN 5 2HB GLN 5 6.049 11.589 8.286
37 2HB GLN 5 3HB GLN 5 5.285 10.441 7.201
38 1HG GLN 5 2HG GLN 5 3.589 12.624 8.501
39 2HG GLN 5 3HG GLN 5 4.657 13.007 7.162
40 1HE2 GLN 5 1HE2 GLN 5 3.189 9.755 7.113
41 2HE2 GLN 5 2HE2 GLN 5 2.118 10.169 5.791
42 H LYS 6 H LYS 6 4.544 7.917 8.297
43 HA LYS 6 HA LYS 6 7.314 7.313 8.925
44 1HB LYS 6 2HB LYS 6 6.269 6.542 10.907
45 2HB LYS 6 3HB LYS 6 4.964 5.734 10.003
46 1HG LYS 6 2HG LYS 6 6.356 4.034 9.252
47 2HG LYS 6 3HG LYS 6 7.853 4.898 9.675
48 1HD LYS 6 2HD LYS 6 5.945 4.354 11.916
49 2HD LYS 6 3HD LYS 6 6.830 2.962 11.261
50 1HE LYS 6 2HE LYS 6 8.966 3.920 11.682
51 2HE LYS 6 3HE LYS 6 8.303 5.535 11.972
52 1HZ LYS 6 1HZ LYS 6 8.957 4.385 13.982
53 2HZ LYS 6 2HZ LYS 6 7.368 4.800 13.992
54 3HZ LYS 6 3HZ LYS 6 7.810 3.231 13.733
55 H GLU 7 H GLU 7 7.931 5.404 7.760
56 HA GLU 7 HA GLU 7 6.526 4.999 5.177
57 1HB GLU 7 2HB GLU 7 9.532 4.767 5.414
58 2HB GLU 7 3HB GLU 7 8.515 5.117 4.033
59 1HG GLU 7 2HG GLU 7 9.686 7.110 4.498
60 2HG GLU 7 3HG GLU 7 8.086 7.420 5.200
61 H ILE 8 H ILE 8 5.595 2.965 5.693
62 HA ILE 8 HA ILE 8 7.269 0.961 7.066
63 HB ILE 8 HB ILE 8 4.493 0.916 6.033
64 1HG1 ILE 8 2HG1 ILE 8 4.590 2.567 7.838
65 2HG1 ILE 8 3HG1 ILE 8 3.615 1.138 8.215
66 1HG2 ILE 8 1HG2 ILE 8 6.088 -0.996 7.633
67 2HG2 ILE 8 2HG2 ILE 8 4.291 -1.043 7.588
68 3HG2 ILE 8 3HG2 ILE 8 5.217 -1.228 6.089
69 1HD1 ILE 8 1HD1 ILE 8 5.046 1.760 10.094
70 2HD1 ILE 8 2HD1 ILE 8 5.387 0.136 9.451
71 3HD1 ILE 8 3HD1 ILE 8 6.476 1.489 9.052
72 H ALA 9 H ALA 9 7.366 -1.165 5.904
73 HA ALA 9 HA ALA 9 7.542 -0.982 2.962
74 1HB ALA 9 1HB ALA 9 9.771 -2.102 4.704
75 2HB ALA 9 2HB ALA 9 9.710 -2.077 2.933
76 3HB ALA 9 3HB ALA 9 9.846 -0.557 3.844
77 H MET 10 H MET 10 6.427 -2.760 2.166
78 HA MET 10 HA MET 10 6.247 -5.237 3.838
79 1HB MET 10 2HB MET 10 3.882 -3.866 2.529
80 2HB MET 10 3HB MET 10 3.868 -5.414 3.368
81 1HG MET 10 2HG MET 10 4.016 -4.512 5.455
82 2HG MET 10 3HG MET 10 4.770 -3.023 4.923
83 1HE MET 10 1HE MET 10 1.900 -0.813 3.644
84 2HE MET 10 2HE MET 10 3.635 -0.929 4.007
85 3HE MET 10 3HE MET 10 2.946 -1.827 2.635
86 H GLN 11 H GLN 11 5.103 -6.970 2.398
87 HA GLN 11 HA GLN 11 6.394 -6.964 -0.297
88 1HB GLN 11 2HB GLN 11 5.760 -9.079 1.827
89 2HB GLN 11 3HB GLN 11 5.876 -9.558 0.141
90 1HG GLN 11 2HG GLN 11 8.052 -8.209 1.810
91 2HG GLN 11 3HG GLN 11 8.028 -9.904 1.287
92 1HE2 GLN 11 1HE2 GLN 11 7.263 -9.838 -1.334
93 2HE2 GLN 11 2HE2 GLN 11 8.087 -8.601 -2.258
94 H VAL 12 H VAL 12 5.104 -7.905 -2.075
95 HA VAL 12 HA VAL 12 2.155 -7.915 -1.544
96 HB VAL 12 HB VAL 12 1.958 -7.244 -3.953
97 1HG1 VAL 12 1HG1 VAL 12 3.216 -5.202 -2.098
98 2HG1 VAL 12 2HG1 VAL 12 2.238 -4.842 -3.531
99 3HG1 VAL 12 3HG1 VAL 12 1.497 -5.650 -2.136
100 1HG2 VAL 12 1HG2 VAL 12 3.722 -6.215 -5.098
101 2HG2 VAL 12 2HG2 VAL 12 4.796 -6.215 -3.680
102 3HG2 VAL 12 3HG2 VAL 12 4.403 -7.738 -4.513
103 H SER 13 H SER 13 0.955 -9.210 -3.117
104 HA SER 13 HA SER 13 2.425 -11.483 -4.324
105 1HB SER 13 2HB SER 13 0.027 -11.717 -2.448
106 2HB SER 13 3HB SER 13 0.760 -13.052 -3.363
107 HG SER 13 HG SER 13 1.558 -12.926 -1.203
108 H GLY 14 H GLY 14 0.811 -12.714 -5.789
109 1HA GLY 14 2HA GLY 14 -0.992 -12.855 -7.209
110 2HA GLY 14 3HA GLY 14 -1.669 -11.378 -6.517
111 H MET 15 H MET 15 0.374 -9.569 -6.993
112 HA MET 15 HA MET 15 -0.211 -8.413 -9.296
113 1HB MET 15 2HB MET 15 1.791 -7.158 -9.248
114 2HB MET 15 3HB MET 15 1.216 -7.414 -7.589
115 1HG MET 15 2HG MET 15 3.575 -8.816 -8.900
116 2HG MET 15 3HG MET 15 3.636 -7.521 -7.730
117 1HE MET 15 1HE MET 15 3.991 -11.174 -8.205
118 2HE MET 15 2HE MET 15 5.307 -10.196 -7.503
119 3HE MET 15 3HE MET 15 4.549 -11.490 -6.548
120 H THR 16 H THR 16 -0.216 -8.890 -11.360
121 HA THR 16 HA THR 16 2.159 -10.165 -12.612
122 HB THR 16 HB THR 16 0.123 -11.293 -14.015
123 HG1 THR 16 1HG THR 16 -0.710 -11.364 -11.289
124 1HG2 THR 16 1HG2 THR 16 0.557 -13.363 -12.738
125 2HG2 THR 16 2HG2 THR 16 2.070 -12.498 -13.068
126 3HG2 THR 16 3HG2 THR 16 1.343 -12.427 -11.445
127 H CYS 17 H CYS 17 0.617 -7.431 -12.435
128 HA CYS 17 HA CYS 17 0.689 -6.792 -15.341
129 1HB CYS 17 2HB CYS 17 -0.502 -5.155 -13.080
130 2HB CYS 17 3HB CYS 17 -0.824 -5.035 -14.819
131 H ALA 18 H ALA 18 2.170 -6.167 -12.232
132 HA ALA 18 HA ALA 18 3.589 -4.690 -11.373
133 1HB ALA 18 1HB ALA 18 5.216 -3.497 -12.680
134 2HB ALA 18 2HB ALA 18 5.070 -5.154 -13.290
135 3HB ALA 18 3HB ALA 18 4.345 -3.806 -14.190
136 H ALA 19 H ALA 19 2.137 -3.029 -14.190
137 HA ALA 19 HA ALA 19 1.835 -0.465 -13.289
138 1HB ALA 19 1HB ALA 19 1.219 -1.241 -15.537
139 2HB ALA 19 2HB ALA 19 -0.192 -2.095 -14.884
140 3HB ALA 19 3HB ALA 19 -0.116 -0.322 -14.812
141 H CYS 20 H CYS 20 -0.699 -2.986 -12.800
142 HA CYS 20 HA CYS 20 -2.432 -1.442 -11.282
143 1HB CYS 20 2HB CYS 20 -1.857 -4.442 -11.267
144 2HB CYS 20 3HB CYS 20 -3.235 -3.753 -10.415
145 H ALA 21 H ALA 21 0.577 -2.915 -10.154
146 HA ALA 21 HA ALA 21 -0.081 -2.814 -7.359
147 1HB ALA 21 1HB ALA 21 2.695 -2.586 -8.548
148 2HB ALA 21 2HB ALA 21 2.183 -3.285 -6.992
149 3HB ALA 21 3HB ALA 21 1.801 -4.123 -8.492
150 H ALA 22 H ALA 22 0.810 -0.368 -9.772
151 HA ALA 22 HA ALA 22 1.435 1.691 -7.780
152 1HB ALA 22 1HB ALA 22 1.326 3.223 -9.637
153 2HB ALA 22 2HB ALA 22 2.253 1.794 -10.144
154 3HB ALA 22 3HB ALA 22 0.569 2.007 -10.681
155 H ARG 23 H ARG 23 -1.346 0.700 -9.816
156 HA ARG 23 HA ARG 23 -3.120 2.755 -9.061
157 1HB ARG 23 2HB ARG 23 -3.826 -0.126 -9.775
158 2HB ARG 23 3HB ARG 23 -4.953 1.220 -9.623
159 1HG ARG 23 2HG ARG 23 -3.579 2.461 -11.377
160 2HG ARG 23 3HG ARG 23 -2.740 0.937 -11.701
161 1HD ARG 23 2HD ARG 23 -5.741 1.451 -11.827
162 2HD ARG 23 3HD ARG 23 -4.672 1.352 -13.236
163 HE ARG 23 HE ARG 23 -4.174 -1.055 -12.212
164 1HH1 ARG 23 2HH2 ARG 23 -7.300 0.524 -12.724
165 2HH1 ARG 23 1HH2 ARG 23 -8.173 -0.963 -12.918
166 1HH2 ARG 23 2HH1 ARG 23 -5.252 -2.980 -12.600
167 2HH2 ARG 23 1HH1 ARG 23 -6.989 -3.030 -12.783
168 H ILE 24 H ILE 24 -2.591 -0.452 -7.459
169 HA ILE 24 HA ILE 24 -4.561 0.056 -5.492
170 HB ILE 24 HB ILE 24 -3.731 -1.669 -4.151
171 1HG1 ILE 24 2HG1 ILE 24 -1.247 -1.330 -5.750
172 2HG1 ILE 24 3HG1 ILE 24 -1.456 -1.222 -3.984
173 1HG2 ILE 24 1HG2 ILE 24 -4.836 -2.073 -6.468
174 2HG2 ILE 24 2HG2 ILE 24 -3.226 -2.597 -6.990
175 3HG2 ILE 24 3HG2 ILE 24 -4.045 -3.415 -5.645
176 1HD1 ILE 24 1HD1 ILE 24 -0.263 -3.250 -4.549
177 2HD1 ILE 24 2HD1 ILE 24 -1.875 -3.649 -3.902
178 3HD1 ILE 24 3HD1 ILE 24 -1.556 -3.709 -5.664
179 H GLU 25 H GLU 25 -0.985 0.633 -5.134
180 HA GLU 25 HA GLU 25 -1.160 1.920 -2.678
181 1HB GLU 25 2HB GLU 25 0.783 1.933 -4.940
182 2HB GLU 25 3HB GLU 25 0.881 3.324 -3.848
183 1HG GLU 25 2HG GLU 25 2.343 1.421 -3.161
184 2HG GLU 25 3HG GLU 25 1.195 1.902 -1.908
185 H LYS 26 H LYS 26 -1.800 3.398 -5.863
186 HA LYS 26 HA LYS 26 -2.033 6.066 -4.658
187 1HB LYS 26 2HB LYS 26 -3.024 5.103 -7.354
188 2HB LYS 26 3HB LYS 26 -2.862 6.787 -6.838
189 1HG LYS 26 2HG LYS 26 -0.568 4.805 -7.147
190 2HG LYS 26 3HG LYS 26 -1.043 6.023 -8.329
191 1HD LYS 26 2HD LYS 26 -0.358 7.815 -6.786
192 2HD LYS 26 3HD LYS 26 -0.115 6.653 -5.478
193 1HE LYS 26 2HE LYS 26 2.038 7.268 -6.378
194 2HE LYS 26 3HE LYS 26 1.710 5.551 -6.616
195 1HZ LYS 26 1HZ LYS 26 1.431 7.640 -8.681
196 2HZ LYS 26 2HZ LYS 26 2.663 6.558 -8.562
197 3HZ LYS 26 3HZ LYS 26 1.146 6.031 -8.901
198 H GLY 27 H GLY 27 -4.383 3.557 -5.648
199 1HA GLY 27 2HA GLY 27 -6.732 5.040 -4.890
200 2HA GLY 27 3HA GLY 27 -6.594 3.288 -5.131
201 H LEU 28 H LEU 28 -4.380 3.128 -3.152
202 HA LEU 28 HA LEU 28 -5.760 2.795 -0.604
203 1HB LEU 28 2HB LEU 28 -4.095 1.310 -1.394
204 2HB LEU 28 3HB LEU 28 -2.885 2.579 -1.451
205 HG LEU 28 HG LEU 28 -4.260 1.769 1.126
206 1HD1 LEU 28 1HD1 LEU 28 -3.291 -0.201 0.116
207 2HD1 LEU 28 2HD1 LEU 28 -1.764 0.656 -0.198
208 3HD1 LEU 28 3HD1 LEU 28 -2.267 0.303 1.467
209 1HD2 LEU 28 1HD2 LEU 28 -2.067 2.702 2.035
210 2HD2 LEU 28 2HD2 LEU 28 -1.685 3.258 0.402
211 3HD2 LEU 28 3HD2 LEU 28 -3.094 3.899 1.277
212 H LYS 29 H LYS 29 -3.196 4.952 -1.821
213 HA LYS 29 HA LYS 29 -2.891 6.663 0.285
214 1HB LYS 29 2HB LYS 29 -1.682 6.442 -2.001
215 2HB LYS 29 3HB LYS 29 -2.867 7.591 -2.601
216 1HG LYS 29 2HG LYS 29 -1.694 8.656 -0.168
217 2HG LYS 29 3HG LYS 29 -0.435 7.882 -1.097
218 1HD LYS 29 2HD LYS 29 -0.457 10.144 -1.966
219 2HD LYS 29 3HD LYS 29 -1.215 9.140 -3.174
220 1HE LYS 29 2HE LYS 29 -2.304 11.294 -2.683
221 2HE LYS 29 3HE LYS 29 -3.406 9.909 -2.493
222 1HZ LYS 29 1HZ LYS 29 -1.974 11.128 -0.225
223 2HZ LYS 29 2HZ LYS 29 -3.480 11.639 -0.670
224 3HZ LYS 29 3HZ LYS 29 -3.270 10.096 -0.154
225 H ARG 30 H ARG 30 -5.678 6.491 -1.715
226 HA ARG 30 HA ARG 30 -6.681 9.168 -1.308
227 1HB ARG 30 2HB ARG 30 -7.349 6.826 -2.838
228 2HB ARG 30 3HB ARG 30 -8.770 7.227 -1.887
229 1HG ARG 30 2HG ARG 30 -7.228 9.196 -3.649
230 2HG ARG 30 3HG ARG 30 -8.618 8.235 -4.177
231 1HD ARG 30 2HD ARG 30 -9.964 9.247 -2.299
232 2HD ARG 30 3HD ARG 30 -8.622 10.376 -2.007
233 HE ARG 30 HE ARG 30 -9.168 10.531 -4.742
234 1HH1 ARG 30 2HH2 ARG 30 -10.864 11.217 -1.738
235 2HH1 ARG 30 1HH2 ARG 30 -12.029 12.299 -2.437
236 1HH2 ARG 30 2HH1 ARG 30 -10.702 11.952 -5.735
237 2HH2 ARG 30 1HH1 ARG 30 -11.909 12.742 -4.778
238 H MET 31 H MET 31 -6.513 6.427 0.808
239 HA MET 31 HA MET 31 -8.962 6.818 2.240
240 1HB MET 31 2HB MET 31 -8.039 5.193 3.788
241 2HB MET 31 3HB MET 31 -7.515 4.766 2.167
242 1HG MET 31 2HG MET 31 -5.302 5.798 2.631
243 2HG MET 31 3HG MET 31 -5.829 6.268 4.226
244 1HE MET 31 1HE MET 31 -5.524 1.839 3.208
245 2HE MET 31 2HE MET 31 -7.084 2.658 3.368
246 3HE MET 31 3HE MET 31 -5.953 3.092 2.032
247 HA PRO 32 HA PRO 32 -7.696 10.117 5.101
248 1HB PRO 32 2HB PRO 32 -8.706 9.268 7.512
249 2HB PRO 32 3HB PRO 32 -9.723 9.930 6.204
250 1HG PRO 32 2HG PRO 32 -9.169 7.020 6.831
251 2HG PRO 32 3HG PRO 32 -10.760 7.794 6.572
252 1HD PRO 32 2HD PRO 32 -9.529 6.477 4.585
253 2HD PRO 32 3HD PRO 32 -10.358 8.009 4.227
254 H GLY 33 H GLY 33 -5.734 10.419 6.173
255 1HA GLY 33 2HA GLY 33 -4.162 9.912 7.728
256 2HA GLY 33 3HA GLY 33 -4.421 8.172 7.552
257 H VAL 34 H VAL 34 -4.148 7.750 4.824
258 HA VAL 34 HA VAL 34 -1.266 7.861 4.693
259 HB VAL 34 HB VAL 34 -3.225 6.889 2.612
260 1HG1 VAL 34 1HG1 VAL 34 -0.205 6.490 2.941
261 2HG1 VAL 34 2HG1 VAL 34 -1.222 5.618 1.777
262 3HG1 VAL 34 3HG1 VAL 34 -0.988 7.360 1.623
263 1HG2 VAL 34 1HG2 VAL 34 -2.692 4.665 3.505
264 2HG2 VAL 34 2HG2 VAL 34 -1.610 5.347 4.706
265 3HG2 VAL 34 3HG2 VAL 34 -3.326 5.688 4.819
266 H THR 35 H THR 35 -0.126 9.609 4.145
267 HA THR 35 HA THR 35 -1.360 11.649 2.464
268 HB THR 35 HB THR 35 0.579 11.690 4.494
269 HG1 THR 35 1HG THR 35 -0.191 13.797 2.792
270 1HG2 THR 35 1HG2 THR 35 1.758 12.735 1.872
271 2HG2 THR 35 2HG2 THR 35 2.336 13.126 3.492
272 3HG2 THR 35 3HG2 THR 35 2.434 11.456 2.918
273 H ASP 36 H ASP 36 1.400 9.255 2.109
274 HA ASP 36 HA ASP 36 1.087 9.495 -0.792
275 1HB ASP 36 2HB ASP 36 3.504 10.394 0.720
276 2HB ASP 36 3HB ASP 36 3.735 9.479 -0.771
277 H ALA 37 H ALA 37 1.967 7.810 -1.940
278 HA ALA 37 HA ALA 37 3.007 5.484 -0.460
279 1HB ALA 37 1HB ALA 37 1.202 3.970 -1.015
280 2HB ALA 37 2HB ALA 37 0.488 5.380 -0.211
281 3HB ALA 37 3HB ALA 37 0.384 5.221 -1.976
282 H ASN 38 H ASN 38 3.927 3.775 -1.761
283 HA ASN 38 HA ASN 38 4.364 4.374 -4.608
284 1HB ASN 38 2HB ASN 38 6.990 4.210 -3.544
285 2HB ASN 38 3HB ASN 38 6.213 5.574 -4.325
286 1HD2 ASN 38 1HD2 ASN 38 5.838 4.139 -0.992
287 2HD2 ASN 38 2HD2 ASN 38 6.292 5.644 -0.197
288 H VAL 39 H VAL 39 4.568 2.442 -5.594
289 HA VAL 39 HA VAL 39 5.008 0.059 -3.961
290 HB VAL 39 HB VAL 39 3.074 0.438 -5.474
291 1HG1 VAL 39 1HG1 VAL 39 3.223 0.050 -7.836
292 2HG1 VAL 39 2HG1 VAL 39 4.320 1.379 -7.454
293 3HG1 VAL 39 3HG1 VAL 39 4.939 -0.257 -7.783
294 1HG2 VAL 39 1HG2 VAL 39 2.752 -1.740 -5.457
295 2HG2 VAL 39 2HG2 VAL 39 4.117 -2.048 -6.542
296 3HG2 VAL 39 3HG2 VAL 39 4.373 -1.906 -4.784
297 H ASN 40 H ASN 40 7.142 -0.639 -3.717
298 HA ASN 40 HA ASN 40 9.137 0.211 -5.743
299 1HB ASN 40 2HB ASN 40 9.521 0.708 -3.341
300 2HB ASN 40 3HB ASN 40 9.574 -1.030 -3.013
301 1HD2 ASN 40 1HD2 ASN 40 11.805 0.104 -2.253
302 2HD2 ASN 40 2HD2 ASN 40 13.092 -0.034 -3.441
303 H LEU 41 H LEU 41 7.623 -1.362 -6.953
304 HA LEU 41 HA LEU 41 7.927 -4.179 -6.534
305 1HB LEU 41 2HB LEU 41 6.431 -2.411 -8.257
306 2HB LEU 41 3HB LEU 41 7.201 -3.600 -9.282
307 HG LEU 41 HG LEU 41 4.887 -4.090 -8.430
308 1HD1 LEU 41 1HD1 LEU 41 6.407 -6.469 -7.497
309 2HD1 LEU 41 2HD1 LEU 41 5.225 -6.280 -8.797
310 3HD1 LEU 41 3HD1 LEU 41 6.912 -5.841 -9.068
311 1HD2 LEU 41 1HD2 LEU 41 5.939 -5.130 -5.818
312 2HD2 LEU 41 2HD2 LEU 41 5.729 -3.395 -5.963
313 3HD2 LEU 41 3HD2 LEU 41 4.353 -4.469 -6.263
314 H ALA 42 H ALA 42 9.968 -1.888 -8.066
315 HA ALA 42 HA ALA 42 11.644 -3.410 -9.695
316 1HB ALA 42 1HB ALA 42 12.498 -1.471 -7.512
317 2HB ALA 42 2HB ALA 42 13.440 -1.946 -8.934
318 3HB ALA 42 3HB ALA 42 11.953 -0.984 -9.141
319 H THR 43 H THR 43 11.293 -3.508 -6.126
320 HA THR 43 HA THR 43 12.956 -5.976 -6.147
321 HB THR 43 HB THR 43 14.357 -4.316 -5.174
322 HG1 THR 43 1HG THR 43 13.108 -5.942 -3.239
323 1HG2 THR 43 1HG2 THR 43 11.987 -3.554 -3.424
324 2HG2 THR 43 2HG2 THR 43 13.664 -3.072 -3.098
325 3HG2 THR 43 3HG2 THR 43 12.870 -2.544 -4.589
326 H GLU 44 H GLU 44 10.154 -5.732 -6.596
327 HA GLU 44 HA GLU 44 8.131 -6.481 -5.915
328 1HB GLU 44 2HB GLU 44 10.016 -8.488 -4.599
329 2HB GLU 44 3HB GLU 44 8.281 -8.739 -4.828
330 1HG GLU 44 2HG GLU 44 8.519 -8.452 -7.273
331 2HG GLU 44 3HG GLU 44 10.273 -8.281 -7.075
332 H THR 45 H THR 45 9.227 -4.360 -4.006
333 HA THR 45 HA THR 45 7.878 -5.196 -1.493
334 HB THR 45 HB THR 45 9.930 -2.990 -1.914
335 HG1 THR 45 1HG THR 45 10.537 -5.473 -2.270
336 1HG2 THR 45 1HG2 THR 45 10.396 -3.386 0.469
337 2HG2 THR 45 2HG2 THR 45 8.692 -2.948 0.240
338 3HG2 THR 45 3HG2 THR 45 9.155 -4.655 0.497
339 H VAL 46 H VAL 46 6.706 -3.337 -0.416
340 HA VAL 46 HA VAL 46 5.899 -1.111 -2.232
341 HB VAL 46 HB VAL 46 4.074 -2.618 -2.378
342 1HG1 VAL 46 1HG1 VAL 46 4.188 -2.820 0.655
343 2HG1 VAL 46 2HG1 VAL 46 2.869 -3.451 -0.347
344 3HG1 VAL 46 3HG1 VAL 46 4.489 -4.141 -0.499
345 1HG2 VAL 46 1HG2 VAL 46 2.269 -1.414 -1.317
346 2HG2 VAL 46 2HG2 VAL 46 3.364 -0.567 -0.231
347 3HG2 VAL 46 3HG2 VAL 46 3.459 -0.267 -1.984
348 H ASN 47 H ASN 47 5.564 0.912 -1.188
349 HA ASN 47 HA ASN 47 6.229 0.995 1.697
350 1HB ASN 47 2HB ASN 47 7.409 2.616 -0.604
351 2HB ASN 47 3HB ASN 47 7.435 3.183 1.070
352 1HD2 ASN 47 1HD2 ASN 47 8.323 1.480 2.718
353 2HD2 ASN 47 2HD2 ASN 47 9.865 0.815 2.195
354 H VAL 48 H VAL 48 4.935 2.462 2.839
355 HA VAL 48 HA VAL 48 3.013 4.082 1.269
356 HB VAL 48 HB VAL 48 2.256 2.284 3.595
357 1HG1 VAL 48 1HG1 VAL 48 0.575 4.000 1.716
358 2HG1 VAL 48 2HG1 VAL 48 -0.013 3.033 3.076
359 3HG1 VAL 48 3HG1 VAL 48 0.991 4.459 3.376
360 1HG2 VAL 48 1HG2 VAL 48 2.589 0.877 1.622
361 2HG2 VAL 48 2HG2 VAL 48 0.860 1.075 1.928
362 3HG2 VAL 48 3HG2 VAL 48 1.635 1.998 0.626
363 H ILE 49 H ILE 49 3.084 6.111 2.019
364 HA ILE 49 HA ILE 49 4.775 6.644 4.361
365 HB ILE 49 HB ILE 49 3.964 8.577 2.154
366 1HG1 ILE 49 2HG1 ILE 49 5.104 6.906 0.952
367 2HG1 ILE 49 3HG1 ILE 49 6.201 8.262 1.182
368 1HG2 ILE 49 1HG2 ILE 49 5.932 9.844 2.951
369 2HG2 ILE 49 2HG2 ILE 49 4.691 9.655 4.195
370 3HG2 ILE 49 3HG2 ILE 49 6.154 8.662 4.260
371 1HD1 ILE 49 1HD1 ILE 49 7.460 6.239 1.523
372 2HD1 ILE 49 2HD1 ILE 49 7.259 7.014 3.098
373 3HD1 ILE 49 3HD1 ILE 49 6.272 5.600 2.670
374 H TYR 50 H TYR 50 3.312 6.700 6.097
375 HA TYR 50 HA TYR 50 0.788 8.276 5.761
376 1HB TYR 50 2HB TYR 50 -0.580 6.541 6.513
377 2HB TYR 50 3HB TYR 50 0.382 5.928 5.189
378 HD1 TYR 50 HD1 TYR 50 1.696 3.919 5.476
379 HD2 TYR 50 HD2 TYR 50 -0.057 5.865 8.895
380 HE1 TYR 50 HE1 TYR 50 1.894 1.838 6.794
381 HE2 TYR 50 HE2 TYR 50 0.576 3.959 10.307
382 HH TYR 50 HH TYR 50 1.389 1.781 10.315
383 H ASP 51 H ASP 51 -0.458 8.279 7.854
384 HA ASP 51 HA ASP 51 1.445 9.317 9.818
385 1HB ASP 51 2HB ASP 51 -0.429 10.546 10.685
386 2HB ASP 51 3HB ASP 51 -0.197 10.818 8.959
387 HA PRO 52 HA PRO 52 0.353 5.609 12.221
388 1HB PRO 52 2HB PRO 52 2.258 5.705 14.146
389 2HB PRO 52 3HB PRO 52 2.583 5.208 12.461
390 1HG PRO 52 2HG PRO 52 2.978 7.963 13.669
391 2HG PRO 52 3HG PRO 52 4.173 7.005 12.744
392 1HD PRO 52 2HD PRO 52 2.649 8.920 11.590
393 2HD PRO 52 3HD PRO 52 3.027 7.415 10.697
394 H ALA 53 H ALA 53 -0.602 8.667 12.661
395 HA ALA 53 HA ALA 53 -1.554 8.377 15.448
396 1HB ALA 53 1HB ALA 53 -0.420 10.502 14.909
397 2HB ALA 53 2HB ALA 53 -1.533 10.755 13.543
398 3HB ALA 53 3HB ALA 53 -2.155 10.744 15.207
399 H GLU 54 H GLU 54 -2.478 8.366 11.981
400 HA GLU 54 HA GLU 54 -5.315 8.124 12.827
401 1HB GLU 54 2HB GLU 54 -4.600 10.247 11.469
402 2HB GLU 54 3HB GLU 54 -4.609 9.137 10.087
403 1HG GLU 54 2HG GLU 54 -6.956 8.584 10.509
404 2HG GLU 54 3HG GLU 54 -6.954 9.601 11.964
405 H THR 55 H THR 55 -2.976 7.254 10.196
406 HA THR 55 HA THR 55 -4.204 4.595 10.188
407 HB THR 55 HB THR 55 -2.515 4.230 8.160
408 HG1 THR 55 1HG THR 55 -2.695 6.998 8.441
409 1HG2 THR 55 1HG2 THR 55 -4.911 3.854 8.247
410 2HG2 THR 55 2HG2 THR 55 -5.228 5.615 8.140
411 3HG2 THR 55 3HG2 THR 55 -4.457 4.756 6.784
412 H GLY 56 H GLY 56 -2.347 2.963 9.635
413 1HA GLY 56 2HA GLY 56 -0.578 2.034 11.453
414 2HA GLY 56 3HA GLY 56 -1.982 2.443 12.463
415 H THR 57 H THR 57 -0.943 0.727 9.846
416 HA THR 57 HA THR 57 -1.715 -0.177 8.080
417 HB THR 57 HB THR 57 -1.294 -2.650 8.364
418 HG1 THR 57 1HG THR 57 -2.094 -2.921 10.470
419 1HG2 THR 57 1HG2 THR 57 0.579 -1.008 8.053
420 2HG2 THR 57 2HG2 THR 57 0.707 -0.876 9.825
421 3HG2 THR 57 3HG2 THR 57 1.020 -2.422 9.029
422 H ALA 58 H ALA 58 -3.935 -0.783 10.634
423 HA ALA 58 HA ALA 58 -6.000 -2.252 9.848
424 1HB ALA 58 1HB ALA 58 -5.897 -0.662 11.727
425 2HB ALA 58 2HB ALA 58 -5.943 0.688 10.591
426 3HB ALA 58 3HB ALA 58 -7.374 -0.369 10.764
427 H ALA 59 H ALA 59 -5.371 0.949 8.395
428 HA ALA 59 HA ALA 59 -7.883 0.587 6.826
429 1HB ALA 59 1HB ALA 59 -7.263 2.819 7.742
430 2HB ALA 59 2HB ALA 59 -5.875 2.823 6.621
431 3HB ALA 59 3HB ALA 59 -7.532 2.808 5.986
432 H ILE 60 H ILE 60 -4.432 0.529 6.393
433 HA ILE 60 HA ILE 60 -4.190 0.213 3.580
434 HB ILE 60 HB ILE 60 -2.543 -0.286 6.026
435 1HG1 ILE 60 2HG1 ILE 60 -1.890 1.098 3.471
436 2HG1 ILE 60 3HG1 ILE 60 -3.032 1.875 4.557
437 1HG2 ILE 60 1HG2 ILE 60 -0.638 -1.008 4.663
438 2HG2 ILE 60 2HG2 ILE 60 -1.896 -2.240 4.748
439 3HG2 ILE 60 3HG2 ILE 60 -1.718 -1.266 3.270
440 1HD1 ILE 60 1HD1 ILE 60 -0.159 1.192 5.286
441 2HD1 ILE 60 2HD1 ILE 60 -0.900 2.802 5.128
442 3HD1 ILE 60 3HD1 ILE 60 -1.395 1.740 6.445
443 H GLN 61 H GLN 61 -4.433 -2.367 6.119
444 HA GLN 61 HA GLN 61 -4.413 -4.421 4.121
445 1HB GLN 61 2HB GLN 61 -4.784 -4.286 7.016
446 2HB GLN 61 3HB GLN 61 -5.960 -5.360 6.253
447 1HG GLN 61 2HG GLN 61 -4.381 -6.899 6.581
448 2HG GLN 61 3HG GLN 61 -3.840 -6.366 4.995
449 1HE2 GLN 61 1HE2 GLN 61 -2.619 -3.848 5.851
450 2HE2 GLN 61 2HE2 GLN 61 -1.218 -4.291 6.823
451 H GLU 62 H GLU 62 -7.130 -2.715 5.790
452 HA GLU 62 HA GLU 62 -9.305 -3.984 4.592
453 1HB GLU 62 2HB GLU 62 -8.751 -1.218 5.674
454 2HB GLU 62 3HB GLU 62 -10.197 -1.419 4.703
455 1HG GLU 62 2HG GLU 62 -10.840 -3.366 6.206
456 2HG GLU 62 3HG GLU 62 -9.505 -2.874 7.270
457 H LYS 63 H LYS 63 -7.682 -1.019 3.308
458 HA LYS 63 HA LYS 63 -9.218 -1.061 0.913
459 1HB LYS 63 2HB LYS 63 -6.897 0.436 2.040
460 2HB LYS 63 3HB LYS 63 -7.127 0.501 0.332
461 1HG LYS 63 2HG LYS 63 -9.362 1.078 2.354
462 2HG LYS 63 3HG LYS 63 -8.321 2.338 1.707
463 1HD LYS 63 2HD LYS 63 -10.267 0.728 0.036
464 2HD LYS 63 3HD LYS 63 -10.381 2.414 0.564
465 1HE LYS 63 2HE LYS 63 -7.943 2.563 -0.551
466 2HE LYS 63 3HE LYS 63 -8.522 1.181 -1.489
467 1HZ LYS 63 1HZ LYS 63 -10.231 2.587 -2.359
468 2HZ LYS 63 2HZ LYS 63 -9.877 3.791 -1.273
469 3HZ LYS 63 3HZ LYS 63 -8.784 3.415 -2.419
470 H ILE 64 H ILE 64 -6.042 -2.517 1.768
471 HA ILE 64 HA ILE 64 -5.017 -3.078 -0.722
472 HB ILE 64 HB ILE 64 -4.848 -4.141 2.001
473 1HG1 ILE 64 2HG1 ILE 64 -3.383 -2.393 0.920
474 2HG1 ILE 64 3HG1 ILE 64 -2.589 -3.721 1.754
475 1HG2 ILE 64 1HG2 ILE 64 -5.177 -6.256 1.203
476 2HG2 ILE 64 2HG2 ILE 64 -4.172 -5.969 -0.243
477 3HG2 ILE 64 3HG2 ILE 64 -3.441 -6.049 1.381
478 1HD1 ILE 64 1HD1 ILE 64 -1.455 -3.270 -0.336
479 2HD1 ILE 64 2HD1 ILE 64 -2.212 -4.874 -0.399
480 3HD1 ILE 64 3HD1 ILE 64 -2.952 -3.518 -1.264
481 H GLU 65 H GLU 65 -7.238 -5.036 1.374
482 HA GLU 65 HA GLU 65 -7.968 -7.040 -0.504
483 1HB GLU 65 2HB GLU 65 -9.279 -5.900 1.985
484 2HB GLU 65 3HB GLU 65 -10.078 -7.146 1.022
485 1HG GLU 65 2HG GLU 65 -7.221 -7.652 1.819
486 2HG GLU 65 3HG GLU 65 -8.483 -7.777 3.051
487 H LYS 66 H LYS 66 -9.730 -4.004 0.378
488 HA LYS 66 HA LYS 66 -11.776 -4.431 -1.507
489 1HB LYS 66 2HB LYS 66 -10.990 -2.290 0.265
490 2HB LYS 66 3HB LYS 66 -11.450 -1.578 -1.272
491 1HG LYS 66 2HG LYS 66 -13.087 -3.536 0.388
492 2HG LYS 66 3HG LYS 66 -13.304 -1.794 0.386
493 1HD LYS 66 2HD LYS 66 -13.853 -3.670 -1.981
494 2HD LYS 66 3HD LYS 66 -15.013 -2.919 -0.905
495 1HE LYS 66 2HE LYS 66 -15.202 -1.434 -2.605
496 2HE LYS 66 3HE LYS 66 -13.906 -0.635 -1.711
497 1HZ LYS 66 1HZ LYS 66 -13.349 -0.751 -4.020
498 2HZ LYS 66 2HZ LYS 66 -12.373 -1.872 -3.293
499 3HZ LYS 66 3HZ LYS 66 -13.670 -2.360 -4.103
500 H LEU 67 H LEU 67 -8.565 -3.154 -2.109
501 HA LEU 67 HA LEU 67 -9.140 -2.145 -4.779
502 1HB LEU 67 2HB LEU 67 -6.595 -2.733 -3.253
503 2HB LEU 67 3HB LEU 67 -6.602 -2.111 -4.903
504 HG LEU 67 HG LEU 67 -8.203 -0.684 -2.761
505 1HD1 LEU 67 1HD1 LEU 67 -5.902 -0.926 -1.854
506 2HD1 LEU 67 2HD1 LEU 67 -5.264 -0.233 -3.341
507 3HD1 LEU 67 3HD1 LEU 67 -6.280 0.751 -2.280
508 1HD2 LEU 67 1HD2 LEU 67 -7.715 1.289 -4.181
509 2HD2 LEU 67 2HD2 LEU 67 -6.853 0.246 -5.328
510 3HD2 LEU 67 3HD2 LEU 67 -8.594 0.035 -5.069
511 H GLY 68 H GLY 68 -8.700 -5.281 -3.408
512 1HA GLY 68 2HA GLY 68 -8.985 -7.292 -4.492
513 2HA GLY 68 3HA GLY 68 -8.713 -6.538 -6.070
514 H TYR 69 H TYR 69 -6.660 -6.297 -3.084
515 HA TYR 69 HA TYR 69 -4.529 -7.889 -4.428
516 1HB TYR 69 2HB TYR 69 -4.584 -5.029 -3.946
517 2HB TYR 69 3HB TYR 69 -3.363 -5.750 -2.921
518 HD1 TYR 69 HD1 TYR 69 -1.272 -6.463 -3.850
519 HD2 TYR 69 HD2 TYR 69 -4.640 -5.718 -6.435
520 HE1 TYR 69 HE1 TYR 69 0.234 -6.246 -5.752
521 HE2 TYR 69 HE2 TYR 69 -3.156 -5.587 -8.354
522 HH TYR 69 HH TYR 69 -0.957 -5.322 -9.021
523 H HIS 70 H HIS 70 -2.691 -8.180 -2.734
524 HA HIS 70 HA HIS 70 -3.633 -8.262 0.024
525 1HB HIS 70 2HB HIS 70 -3.907 -10.569 -1.423
526 2HB HIS 70 3HB HIS 70 -2.248 -10.765 -0.866
527 HD1 HIS 70 1HD HIS 70 -4.883 -12.480 0.050
528 HD2 HIS 70 2HD HIS 70 -3.042 -9.336 2.157
529 HE1 HIS 70 1HE HIS 70 -5.504 -12.770 2.506
530 H VAL 71 H VAL 71 -1.904 -7.871 1.416
531 HA VAL 71 HA VAL 71 0.797 -7.578 0.230
532 HB VAL 71 HB VAL 71 -0.366 -5.434 0.614
533 1HG1 VAL 71 1HG1 VAL 71 -0.065 -6.046 3.601
534 2HG1 VAL 71 2HG1 VAL 71 -0.707 -4.569 2.878
535 3HG1 VAL 71 3HG1 VAL 71 -1.622 -6.082 2.752
536 1HG2 VAL 71 1HG2 VAL 71 1.458 -4.318 1.847
537 2HG2 VAL 71 2HG2 VAL 71 2.104 -5.932 2.227
538 3HG2 VAL 71 3HG2 VAL 71 1.967 -5.383 0.534
539 H VAL 72 H VAL 72 2.400 -8.549 1.364
540 HA VAL 72 HA VAL 72 1.686 -10.253 3.681
541 HB VAL 72 HB VAL 72 3.986 -10.451 1.804
542 1HG1 VAL 72 1HG1 VAL 72 2.963 -12.351 3.955
543 2HG1 VAL 72 2HG1 VAL 72 4.225 -12.751 2.772
544 3HG1 VAL 72 3HG1 VAL 72 4.513 -11.479 3.961
545 1HG2 VAL 72 1HG2 VAL 72 2.768 -12.460 0.893
546 2HG2 VAL 72 2HG2 VAL 72 1.372 -12.032 1.904
547 3HG2 VAL 72 3HG2 VAL 72 1.890 -10.956 0.589
548 H ILE 73 H ILE 73 2.909 -10.144 5.500
549 HA ILE 73 HA ILE 73 4.400 -7.590 5.923
550 HB ILE 73 HB ILE 73 3.193 -9.384 8.007
551 1HG1 ILE 73 2HG1 ILE 73 1.319 -8.666 6.722
552 2HG1 ILE 73 3HG1 ILE 73 1.416 -7.664 8.165
553 1HG2 ILE 73 1HG2 ILE 73 5.095 -7.692 8.551
554 2HG2 ILE 73 2HG2 ILE 73 3.911 -6.435 8.228
555 3HG2 ILE 73 3HG2 ILE 73 3.609 -7.621 9.515
556 1HD1 ILE 73 1HD1 ILE 73 0.774 -6.342 6.224
557 2HD1 ILE 73 2HD1 ILE 73 2.337 -5.786 6.824
558 3HD1 ILE 73 3HD1 ILE 73 2.247 -6.791 5.361
559 H GLU 74 H GLU 74 6.134 -8.860 4.686
560 HA GLU 74 HA GLU 74 7.917 -10.130 6.537
561 1HB GLU 74 2HB GLU 74 7.105 -10.806 3.754
562 2HB GLU 74 3HB GLU 74 8.794 -11.015 4.194
563 1HG GLU 74 2HG GLU 74 6.603 -12.229 5.909
564 2HG GLU 74 3HG GLU 74 7.267 -13.070 4.497
565 H GLY 75 H GLY 75 7.323 -7.330 5.252
566 1HA GLY 75 2HA GLY 75 9.908 -6.688 3.984
567 2HA GLY 75 3HA GLY 75 8.535 -5.609 4.180
568 H ARG 76 H ARG 76 8.043 -5.613 6.898
569 HA ARG 76 HA ARG 76 10.420 -4.974 8.429
570 1HB ARG 76 2HB ARG 76 10.066 -3.115 6.705
571 2HB ARG 76 3HB ARG 76 8.505 -2.791 7.452
572 1HG ARG 76 2HG ARG 76 11.270 -2.509 8.738
573 2HG ARG 76 3HG ARG 76 10.292 -1.220 8.042
574 1HD ARG 76 2HD ARG 76 9.685 -0.888 10.200
575 2HD ARG 76 3HD ARG 76 8.457 -2.101 9.754
576 HE ARG 76 HE ARG 76 10.699 -3.517 10.648
577 1HH1 ARG 76 2HH2 ARG 76 7.925 -1.794 11.782
578 2HH1 ARG 76 1HH2 ARG 76 7.958 -2.429 13.400
579 1HH2 ARG 76 2HH1 ARG 76 10.919 -4.305 12.786
580 2HH2 ARG 76 1HH1 ARG 76 9.735 -3.904 13.990
Start of MODEL 5
1 1H MET 1 H1 MET 1 4.571 19.511 12.163
2 2H MET 1 H2 MET 1 4.359 21.018 11.471
3 3H MET 1 H3 MET 1 4.419 20.810 13.133
4 HA MET 1 HA MET 1 2.151 21.037 12.658
5 1HB MET 1 2HB MET 1 2.931 19.263 10.334
6 2HB MET 1 3HB MET 1 1.289 19.155 10.957
7 1HG MET 1 2HG MET 1 1.361 20.647 9.115
8 2HG MET 1 3HG MET 1 0.890 21.532 10.558
9 1HE MET 1 1HE MET 1 3.442 24.316 10.764
10 2HE MET 1 2HE MET 1 1.764 23.797 11.016
11 3HE MET 1 3HE MET 1 3.085 23.050 11.950
12 H LEU 2 H LEU 2 0.428 19.263 13.062
13 HA LEU 2 HA LEU 2 1.463 17.172 14.887
14 1HB LEU 2 2HB LEU 2 -0.828 16.764 15.442
15 2HB LEU 2 3HB LEU 2 -0.472 18.461 15.711
16 HG LEU 2 HG LEU 2 -1.704 17.717 13.044
17 1HD1 LEU 2 1HD1 LEU 2 -3.258 17.751 15.654
18 2HD1 LEU 2 2HD1 LEU 2 -3.954 17.688 14.019
19 3HD1 LEU 2 3HD1 LEU 2 -2.979 16.337 14.612
20 1HD2 LEU 2 1HD2 LEU 2 -2.943 19.810 13.404
21 2HD2 LEU 2 2HD2 LEU 2 -2.221 19.991 15.013
22 3HD2 LEU 2 3HD2 LEU 2 -1.213 20.116 13.560
23 H SER 3 H SER 3 0.263 14.997 14.450
24 HA SER 3 HA SER 3 -0.117 13.208 13.127
25 1HB SER 3 2HB SER 3 0.050 14.582 10.470
26 2HB SER 3 3HB SER 3 -0.995 13.284 11.030
27 HG SER 3 HG SER 3 -1.164 16.052 11.510
28 H GLU 4 H GLU 4 1.903 12.321 13.762
29 HA GLU 4 HA GLU 4 4.387 13.078 12.452
30 1HB GLU 4 2HB GLU 4 3.502 10.845 14.217
31 2HB GLU 4 3HB GLU 4 5.143 11.063 13.673
32 1HG GLU 4 2HG GLU 4 5.585 12.746 15.080
33 2HG GLU 4 3HG GLU 4 3.961 13.428 14.985
34 H GLN 5 H GLN 5 5.420 11.545 10.981
35 HA GLN 5 HA GLN 5 3.520 9.786 9.492
36 1HB GLN 5 2HB GLN 5 5.613 11.681 8.388
37 2HB GLN 5 3HB GLN 5 4.829 10.414 7.469
38 1HG GLN 5 2HG GLN 5 2.725 11.860 8.786
39 2HG GLN 5 3HG GLN 5 3.831 13.080 8.172
40 1HE2 GLN 5 1HE2 GLN 5 2.850 9.853 6.924
41 2HE2 GLN 5 2HE2 GLN 5 2.258 10.429 5.379
42 H LYS 6 H LYS 6 4.362 7.900 8.612
43 HA LYS 6 HA LYS 6 7.212 7.470 8.760
44 1HB LYS 6 2HB LYS 6 5.314 5.600 10.229
45 2HB LYS 6 3HB LYS 6 6.912 5.120 9.670
46 1HG LYS 6 2HG LYS 6 7.678 7.362 10.969
47 2HG LYS 6 3HG LYS 6 6.168 7.073 11.823
48 1HD LYS 6 2HD LYS 6 7.618 5.888 13.146
49 2HD LYS 6 3HD LYS 6 7.169 4.586 12.049
50 1HE LYS 6 2HE LYS 6 9.666 6.383 11.929
51 2HE LYS 6 3HE LYS 6 9.623 4.695 12.447
52 1HZ LYS 6 1HZ LYS 6 10.432 4.864 10.213
53 2HZ LYS 6 2HZ LYS 6 8.963 4.137 10.134
54 3HZ LYS 6 3HZ LYS 6 9.173 5.703 9.690
55 H GLU 7 H GLU 7 7.932 5.696 7.686
56 HA GLU 7 HA GLU 7 6.594 5.154 5.129
57 1HB GLU 7 2HB GLU 7 9.507 4.614 5.435
58 2HB GLU 7 3HB GLU 7 8.625 5.468 4.197
59 1HG GLU 7 2HG GLU 7 10.063 7.042 5.073
60 2HG GLU 7 3HG GLU 7 8.561 7.467 5.893
61 H ILE 8 H ILE 8 5.576 3.095 5.506
62 HA ILE 8 HA ILE 8 7.071 1.085 7.037
63 HB ILE 8 HB ILE 8 4.466 0.806 5.655
64 1HG1 ILE 8 2HG1 ILE 8 3.972 2.743 6.899
65 2HG1 ILE 8 3HG1 ILE 8 3.239 1.309 7.638
66 1HG2 ILE 8 1HG2 ILE 8 4.137 -0.778 7.606
67 2HG2 ILE 8 2HG2 ILE 8 5.385 -1.217 6.419
68 3HG2 ILE 8 3HG2 ILE 8 5.856 -0.470 7.969
69 1HD1 ILE 8 1HD1 ILE 8 5.825 2.535 8.533
70 2HD1 ILE 8 2HD1 ILE 8 4.231 2.786 9.307
71 3HD1 ILE 8 3HD1 ILE 8 4.967 1.158 9.267
72 H ALA 9 H ALA 9 7.459 -1.010 5.913
73 HA ALA 9 HA ALA 9 7.571 -0.884 2.953
74 1HB ALA 9 1HB ALA 9 9.635 -2.206 3.020
75 2HB ALA 9 2HB ALA 9 9.893 -0.656 3.848
76 3HB ALA 9 3HB ALA 9 9.657 -2.135 4.794
77 H MET 10 H MET 10 6.600 -2.748 2.071
78 HA MET 10 HA MET 10 6.351 -5.145 3.785
79 1HB MET 10 2HB MET 10 3.918 -3.891 2.447
80 2HB MET 10 3HB MET 10 4.000 -5.430 3.313
81 1HG MET 10 2HG MET 10 4.500 -4.254 5.405
82 2HG MET 10 3HG MET 10 4.323 -2.699 4.565
83 1HE MET 10 1HE MET 10 2.735 -3.560 7.215
84 2HE MET 10 2HE MET 10 2.524 -1.971 6.427
85 3HE MET 10 3HE MET 10 1.102 -2.958 6.832
86 H GLN 11 H GLN 11 5.450 -6.970 2.461
87 HA GLN 11 HA GLN 11 6.717 -6.998 -0.216
88 1HB GLN 11 2HB GLN 11 5.928 -9.056 1.886
89 2HB GLN 11 3HB GLN 11 5.898 -9.567 0.209
90 1HG GLN 11 2HG GLN 11 8.289 -8.456 1.735
91 2HG GLN 11 3HG GLN 11 8.049 -10.135 1.203
92 1HE2 GLN 11 1HE2 GLN 11 7.063 -9.741 -1.421
93 2HE2 GLN 11 2HE2 GLN 11 8.098 -8.652 -2.323
94 H VAL 12 H VAL 12 5.551 -7.869 -2.030
95 HA VAL 12 HA VAL 12 2.600 -7.352 -1.878
96 HB VAL 12 HB VAL 12 4.594 -7.083 -4.166
97 1HG1 VAL 12 1HG1 VAL 12 2.592 -6.071 -5.348
98 2HG1 VAL 12 2HG1 VAL 12 2.471 -7.811 -5.092
99 3HG1 VAL 12 3HG1 VAL 12 1.577 -6.693 -4.035
100 1HG2 VAL 12 1HG2 VAL 12 4.760 -5.248 -2.512
101 2HG2 VAL 12 2HG2 VAL 12 4.010 -4.670 -4.002
102 3HG2 VAL 12 3HG2 VAL 12 2.999 -5.013 -2.587
103 H SER 13 H SER 13 1.172 -8.940 -2.535
104 HA SER 13 HA SER 13 2.170 -11.219 -4.139
105 1HB SER 13 2HB SER 13 0.518 -11.369 -1.577
106 2HB SER 13 3HB SER 13 0.743 -12.720 -2.707
107 HG SER 13 HG SER 13 2.277 -12.787 -1.015
108 H GLY 14 H GLY 14 0.329 -12.386 -5.132
109 1HA GLY 14 2HA GLY 14 -1.643 -12.511 -6.293
110 2HA GLY 14 3HA GLY 14 -2.340 -11.392 -5.112
111 H MET 15 H MET 15 -0.207 -11.494 -8.038
112 HA MET 15 HA MET 15 -1.380 -9.017 -9.060
113 1HB MET 15 2HB MET 15 0.740 -7.867 -9.163
114 2HB MET 15 3HB MET 15 0.446 -8.342 -7.475
115 1HG MET 15 2HG MET 15 2.654 -8.939 -7.674
116 2HG MET 15 3HG MET 15 1.916 -10.452 -8.193
117 1HE MET 15 1HE MET 15 4.774 -10.340 -8.830
118 2HE MET 15 2HE MET 15 3.699 -11.520 -9.628
119 3HE MET 15 3HE MET 15 4.870 -10.590 -10.592
120 H THR 16 H THR 16 -0.843 -8.692 -11.306
121 HA THR 16 HA THR 16 0.458 -10.976 -12.711
122 HB THR 16 HB THR 16 -0.620 -9.528 -14.689
123 HG1 THR 16 1HG THR 16 -2.649 -8.704 -13.865
124 1HG2 THR 16 1HG2 THR 16 -1.149 -11.868 -14.231
125 2HG2 THR 16 2HG2 THR 16 -2.186 -11.405 -12.864
126 3HG2 THR 16 3HG2 THR 16 -2.641 -10.963 -14.529
127 H CYS 17 H CYS 17 0.296 -7.341 -12.758
128 HA CYS 17 HA CYS 17 3.068 -7.363 -13.863
129 1HB CYS 17 2HB CYS 17 2.411 -5.612 -15.405
130 2HB CYS 17 3HB CYS 17 1.390 -7.040 -15.638
131 H ALA 18 H ALA 18 4.284 -5.475 -13.559
132 HA ALA 18 HA ALA 18 3.987 -4.276 -10.924
133 1HB ALA 18 1HB ALA 18 5.978 -3.775 -13.182
134 2HB ALA 18 2HB ALA 18 6.133 -3.198 -11.512
135 3HB ALA 18 3HB ALA 18 6.183 -4.939 -11.861
136 H ALA 19 H ALA 19 1.701 -3.582 -12.108
137 HA ALA 19 HA ALA 19 1.952 -0.671 -12.570
138 1HB ALA 19 1HB ALA 19 0.718 -2.466 -14.691
139 2HB ALA 19 2HB ALA 19 0.765 -0.693 -14.693
140 3HB ALA 19 3HB ALA 19 2.273 -1.619 -14.821
141 H CYS 20 H CYS 20 -0.426 -3.451 -12.565
142 HA CYS 20 HA CYS 20 -2.569 -1.803 -11.564
143 1HB CYS 20 2HB CYS 20 -3.462 -3.974 -10.634
144 2HB CYS 20 3HB CYS 20 -3.237 -3.903 -12.389
145 H ALA 21 H ALA 21 0.036 -3.617 -9.990
146 HA ALA 21 HA ALA 21 -0.318 -3.023 -7.350
147 1HB ALA 21 1HB ALA 21 2.403 -2.733 -8.654
148 2HB ALA 21 2HB ALA 21 1.973 -3.406 -7.060
149 3HB ALA 21 3HB ALA 21 1.603 -4.305 -8.530
150 H ALA 22 H ALA 22 0.319 -0.560 -9.816
151 HA ALA 22 HA ALA 22 1.203 1.454 -7.878
152 1HB ALA 22 1HB ALA 22 1.827 1.579 -10.287
153 2HB ALA 22 2HB ALA 22 0.112 1.836 -10.690
154 3HB ALA 22 3HB ALA 22 0.972 3.018 -9.695
155 H ARG 23 H ARG 23 -1.851 0.375 -9.439
156 HA ARG 23 HA ARG 23 -3.353 2.699 -8.611
157 1HB ARG 23 2HB ARG 23 -4.163 -0.039 -9.684
158 2HB ARG 23 3HB ARG 23 -5.335 1.010 -8.897
159 1HG ARG 23 2HG ARG 23 -5.664 1.745 -11.000
160 2HG ARG 23 3HG ARG 23 -4.456 2.896 -10.480
161 1HD ARG 23 2HD ARG 23 -3.442 2.347 -12.401
162 2HD ARG 23 3HD ARG 23 -2.818 0.937 -11.519
163 HE ARG 23 HE ARG 23 -5.289 0.110 -12.440
164 1HH1 ARG 23 2HH2 ARG 23 -2.325 1.233 -13.942
165 2HH1 ARG 23 1HH2 ARG 23 -2.758 0.780 -15.564
166 1HH2 ARG 23 2HH1 ARG 23 -5.941 -0.505 -14.583
167 2HH2 ARG 23 1HH1 ARG 23 -4.857 -0.296 -15.916
168 H ILE 24 H ILE 24 -2.660 -0.452 -7.072
169 HA ILE 24 HA ILE 24 -4.535 -0.042 -5.009
170 HB ILE 24 HB ILE 24 -3.597 -1.715 -3.750
171 1HG1 ILE 24 2HG1 ILE 24 -1.101 -1.223 -5.272
172 2HG1 ILE 24 3HG1 ILE 24 -1.361 -1.137 -3.518
173 1HG2 ILE 24 1HG2 ILE 24 -3.713 -3.456 -5.285
174 2HG2 ILE 24 2HG2 ILE 24 -4.599 -2.179 -6.109
175 3HG2 ILE 24 3HG2 ILE 24 -2.934 -2.546 -6.598
176 1HD1 ILE 24 1HD1 ILE 24 -1.224 -3.629 -5.244
177 2HD1 ILE 24 2HD1 ILE 24 -0.070 -3.121 -4.009
178 3HD1 ILE 24 3HD1 ILE 24 -1.703 -3.637 -3.528
179 H GLU 25 H GLU 25 -1.053 0.743 -4.952
180 HA GLU 25 HA GLU 25 -1.049 2.110 -2.503
181 1HB GLU 25 2HB GLU 25 0.667 2.283 -5.001
182 2HB GLU 25 3HB GLU 25 0.961 3.360 -3.620
183 1HG GLU 25 2HG GLU 25 0.780 0.345 -3.254
184 2HG GLU 25 3HG GLU 25 2.286 1.200 -3.617
185 H LYS 26 H LYS 26 -1.728 3.397 -5.773
186 HA LYS 26 HA LYS 26 -1.821 6.145 -4.820
187 1HB LYS 26 2HB LYS 26 -2.588 4.782 -7.405
188 2HB LYS 26 3HB LYS 26 -3.144 6.420 -7.060
189 1HG LYS 26 2HG LYS 26 -1.121 6.593 -8.317
190 2HG LYS 26 3HG LYS 26 -0.833 7.192 -6.676
191 1HD LYS 26 2HD LYS 26 0.306 5.085 -6.094
192 2HD LYS 26 3HD LYS 26 -0.028 4.474 -7.734
193 1HE LYS 26 2HE LYS 26 1.326 6.202 -8.756
194 2HE LYS 26 3HE LYS 26 1.559 7.018 -7.199
195 1HZ LYS 26 1HZ LYS 26 2.798 5.166 -6.427
196 2HZ LYS 26 2HZ LYS 26 2.549 4.321 -7.827
197 3HZ LYS 26 3HZ LYS 26 3.452 5.696 -7.839
198 H GLY 27 H GLY 27 -4.330 3.673 -5.497
199 1HA GLY 27 2HA GLY 27 -6.553 5.320 -4.705
200 2HA GLY 27 3HA GLY 27 -6.533 3.558 -4.861
201 H LEU 28 H LEU 28 -4.183 3.382 -2.926
202 HA LEU 28 HA LEU 28 -5.623 3.455 -0.389
203 1HB LEU 28 2HB LEU 28 -4.132 1.670 -0.901
204 2HB LEU 28 3HB LEU 28 -2.776 2.760 -1.145
205 HG LEU 28 HG LEU 28 -2.886 1.375 0.974
206 1HD1 LEU 28 1HD1 LEU 28 -1.851 3.144 2.316
207 2HD1 LEU 28 2HD1 LEU 28 -1.277 3.167 0.639
208 3HD1 LEU 28 3HD1 LEU 28 -2.456 4.362 1.201
209 1HD2 LEU 28 1HD2 LEU 28 -4.838 3.520 1.902
210 2HD2 LEU 28 2HD2 LEU 28 -5.226 1.817 1.605
211 3HD2 LEU 28 3HD2 LEU 28 -4.101 2.280 2.889
212 H LYS 29 H LYS 29 -3.098 5.400 -1.961
213 HA LYS 29 HA LYS 29 -2.507 7.169 0.071
214 1HB LYS 29 2HB LYS 29 -1.554 6.843 -2.370
215 2HB LYS 29 3HB LYS 29 -2.713 8.094 -2.795
216 1HG LYS 29 2HG LYS 29 -1.372 9.094 -0.486
217 2HG LYS 29 3HG LYS 29 -0.177 8.155 -1.340
218 1HD LYS 29 2HD LYS 29 0.018 10.400 -2.253
219 2HD LYS 29 3HD LYS 29 -0.744 9.406 -3.475
220 1HE LYS 29 2HE LYS 29 -1.718 11.656 -3.147
221 2HE LYS 29 3HE LYS 29 -2.923 10.366 -2.946
222 1HZ LYS 29 1HZ LYS 29 -2.919 12.199 -1.216
223 2HZ LYS 29 2HZ LYS 29 -2.904 10.657 -0.634
224 3HZ LYS 29 3HZ LYS 29 -1.512 11.549 -0.650
225 H ARG 30 H ARG 30 -5.451 6.917 -1.564
226 HA ARG 30 HA ARG 30 -6.431 9.645 -1.119
227 1HB ARG 30 2HB ARG 30 -7.095 7.283 -2.723
228 2HB ARG 30 3HB ARG 30 -8.520 7.807 -1.863
229 1HG ARG 30 2HG ARG 30 -6.826 9.874 -3.305
230 2HG ARG 30 3HG ARG 30 -7.824 8.769 -4.254
231 1HD ARG 30 2HD ARG 30 -9.829 9.398 -3.107
232 2HD ARG 30 3HD ARG 30 -8.941 10.439 -1.966
233 HE ARG 30 HE ARG 30 -8.245 11.449 -4.428
234 1HH1 ARG 30 2HH2 ARG 30 -11.324 10.865 -2.811
235 2HH1 ARG 30 1HH2 ARG 30 -12.187 12.130 -3.628
236 1HH2 ARG 30 2HH1 ARG 30 -9.337 13.195 -5.488
237 2HH2 ARG 30 1HH1 ARG 30 -11.009 13.505 -5.165
238 H MET 31 H MET 31 -6.005 6.958 0.934
239 HA MET 31 HA MET 31 -8.528 7.188 2.335
240 1HB MET 31 2HB MET 31 -5.896 5.780 2.967
241 2HB MET 31 3HB MET 31 -7.288 5.696 4.034
242 1HG MET 31 2HG MET 31 -7.282 4.832 1.133
243 2HG MET 31 3HG MET 31 -7.117 3.764 2.527
244 1HE MET 31 1HE MET 31 -9.225 4.421 4.624
245 2HE MET 31 2HE MET 31 -10.688 3.621 4.012
246 3HE MET 31 3HE MET 31 -9.118 2.804 3.892
247 HA PRO 32 HA PRO 32 -7.450 10.395 5.245
248 1HB PRO 32 2HB PRO 32 -8.584 9.437 7.576
249 2HB PRO 32 3HB PRO 32 -9.522 10.166 6.241
250 1HG PRO 32 2HG PRO 32 -9.017 7.223 6.749
251 2HG PRO 32 3HG PRO 32 -10.584 8.021 6.420
252 1HD PRO 32 2HD PRO 32 -9.231 6.800 4.453
253 2HD PRO 32 3HD PRO 32 -10.003 8.368 4.121
254 H GLY 33 H GLY 33 -5.590 10.714 6.406
255 1HA GLY 33 2HA GLY 33 -3.898 10.231 7.915
256 2HA GLY 33 3HA GLY 33 -4.387 8.534 7.964
257 H VAL 34 H VAL 34 -4.214 8.953 4.659
258 HA VAL 34 HA VAL 34 -1.314 8.246 4.692
259 HB VAL 34 HB VAL 34 -3.329 7.651 2.522
260 1HG1 VAL 34 1HG1 VAL 34 -1.008 7.860 1.753
261 2HG1 VAL 34 2HG1 VAL 34 -0.421 6.871 3.092
262 3HG1 VAL 34 3HG1 VAL 34 -1.402 6.141 1.826
263 1HG2 VAL 34 1HG2 VAL 34 -3.928 6.355 4.530
264 2HG2 VAL 34 2HG2 VAL 34 -3.170 5.306 3.329
265 3HG2 VAL 34 3HG2 VAL 34 -2.239 5.850 4.738
266 H THR 35 H THR 35 0.074 9.724 3.975
267 HA THR 35 HA THR 35 -0.972 12.041 2.456
268 HB THR 35 HB THR 35 0.989 11.722 4.471
269 HG1 THR 35 1HG THR 35 0.723 13.812 4.604
270 1HG2 THR 35 1HG2 THR 35 2.790 11.519 2.855
271 2HG2 THR 35 2HG2 THR 35 2.138 12.869 1.881
272 3HG2 THR 35 3HG2 THR 35 2.799 13.165 3.488
273 H ASP 36 H ASP 36 1.661 9.489 2.111
274 HA ASP 36 HA ASP 36 1.314 9.697 -0.783
275 1HB ASP 36 2HB ASP 36 3.768 10.571 0.697
276 2HB ASP 36 3HB ASP 36 3.967 9.647 -0.794
277 H ALA 37 H ALA 37 2.242 8.000 -1.932
278 HA ALA 37 HA ALA 37 2.977 5.563 -0.468
279 1HB ALA 37 1HB ALA 37 0.386 5.648 -2.073
280 2HB ALA 37 2HB ALA 37 0.977 4.298 -1.095
281 3HB ALA 37 3HB ALA 37 0.429 5.772 -0.300
282 H ASN 38 H ASN 38 3.761 3.795 -1.801
283 HA ASN 38 HA ASN 38 4.335 4.477 -4.569
284 1HB ASN 38 2HB ASN 38 6.959 4.293 -3.474
285 2HB ASN 38 3HB ASN 38 6.223 5.580 -4.410
286 1HD2 ASN 38 1HD2 ASN 38 5.929 4.470 -0.964
287 2HD2 ASN 38 2HD2 ASN 38 6.376 6.043 -0.309
288 H VAL 39 H VAL 39 4.111 2.534 -5.454
289 HA VAL 39 HA VAL 39 4.858 0.157 -3.964
290 HB VAL 39 HB VAL 39 2.890 0.397 -5.563
291 1HG1 VAL 39 1HG1 VAL 39 4.890 -0.267 -7.735
292 2HG1 VAL 39 2HG1 VAL 39 3.144 -0.095 -7.862
293 3HG1 VAL 39 3HG1 VAL 39 4.134 1.331 -7.516
294 1HG2 VAL 39 1HG2 VAL 39 4.791 -1.843 -5.179
295 2HG2 VAL 39 2HG2 VAL 39 3.075 -1.704 -4.763
296 3HG2 VAL 39 3HG2 VAL 39 3.559 -2.050 -6.436
297 H ASN 40 H ASN 40 6.941 -0.661 -3.881
298 HA ASN 40 HA ASN 40 8.943 0.312 -5.873
299 1HB ASN 40 2HB ASN 40 9.424 0.811 -3.504
300 2HB ASN 40 3HB ASN 40 9.349 -0.915 -3.126
301 1HD2 ASN 40 1HD2 ASN 40 11.653 -0.172 -2.363
302 2HD2 ASN 40 2HD2 ASN 40 12.925 -0.357 -3.561
303 H LEU 41 H LEU 41 7.330 -1.237 -7.033
304 HA LEU 41 HA LEU 41 7.549 -4.038 -6.536
305 1HB LEU 41 2HB LEU 41 5.875 -2.396 -8.016
306 2HB LEU 41 3HB LEU 41 6.771 -3.214 -9.284
307 HG LEU 41 HG LEU 41 4.599 -4.238 -8.637
308 1HD1 LEU 41 1HD1 LEU 41 5.291 -6.567 -8.575
309 2HD1 LEU 41 2HD1 LEU 41 6.361 -5.666 -9.666
310 3HD1 LEU 41 3HD1 LEU 41 6.922 -6.122 -8.050
311 1HD2 LEU 41 1HD2 LEU 41 5.226 -3.773 -6.045
312 2HD2 LEU 41 2HD2 LEU 41 4.013 -4.934 -6.597
313 3HD2 LEU 41 3HD2 LEU 41 5.635 -5.484 -6.142
314 H ALA 42 H ALA 42 9.611 -1.838 -8.188
315 HA ALA 42 HA ALA 42 11.120 -3.384 -9.939
316 1HB ALA 42 1HB ALA 42 11.539 -0.979 -9.391
317 2HB ALA 42 2HB ALA 42 12.152 -1.492 -7.793
318 3HB ALA 42 3HB ALA 42 13.007 -1.982 -9.265
319 H THR 43 H THR 43 10.932 -3.619 -6.385
320 HA THR 43 HA THR 43 12.581 -6.073 -6.586
321 HB THR 43 HB THR 43 14.087 -4.430 -5.706
322 HG1 THR 43 1HG THR 43 13.018 -6.180 -3.782
323 1HG2 THR 43 1HG2 THR 43 12.589 -2.698 -4.920
324 2HG2 THR 43 2HG2 THR 43 11.934 -3.763 -3.660
325 3HG2 THR 43 3HG2 THR 43 13.621 -3.217 -3.581
326 H GLU 44 H GLU 44 9.761 -5.780 -6.767
327 HA GLU 44 HA GLU 44 7.798 -6.523 -5.925
328 1HB GLU 44 2HB GLU 44 9.764 -8.513 -4.716
329 2HB GLU 44 3HB GLU 44 8.014 -8.736 -4.759
330 1HG GLU 44 2HG GLU 44 8.879 -9.945 -6.590
331 2HG GLU 44 3HG GLU 44 8.030 -8.540 -7.244
332 H THR 45 H THR 45 8.929 -4.331 -4.238
333 HA THR 45 HA THR 45 7.766 -5.042 -1.591
334 HB THR 45 HB THR 45 9.919 -3.044 -2.404
335 HG1 THR 45 1HG THR 45 11.306 -4.561 -1.507
336 1HG2 THR 45 1HG2 THR 45 8.789 -2.339 -0.322
337 2HG2 THR 45 2HG2 THR 45 9.004 -3.985 0.339
338 3HG2 THR 45 3HG2 THR 45 10.411 -2.953 0.021
339 H VAL 46 H VAL 46 6.608 -3.252 -0.520
340 HA VAL 46 HA VAL 46 5.774 -1.004 -2.282
341 HB VAL 46 HB VAL 46 3.948 -2.571 -2.338
342 1HG1 VAL 46 1HG1 VAL 46 4.304 -3.923 -0.334
343 2HG1 VAL 46 2HG1 VAL 46 4.005 -2.503 0.702
344 3HG1 VAL 46 3HG1 VAL 46 2.698 -3.184 -0.281
345 1HG2 VAL 46 1HG2 VAL 46 2.176 -1.160 -1.561
346 2HG2 VAL 46 2HG2 VAL 46 3.230 -0.353 -0.384
347 3HG2 VAL 46 3HG2 VAL 46 3.504 -0.125 -2.123
348 H ASN 47 H ASN 47 5.551 1.029 -1.215
349 HA ASN 47 HA ASN 47 6.361 1.066 1.628
350 1HB ASN 47 2HB ASN 47 7.633 2.490 -0.750
351 2HB ASN 47 3HB ASN 47 7.644 3.229 0.850
352 1HD2 ASN 47 1HD2 ASN 47 8.347 1.621 2.707
353 2HD2 ASN 47 2HD2 ASN 47 9.922 0.940 2.348
354 H VAL 48 H VAL 48 5.123 2.604 2.808
355 HA VAL 48 HA VAL 48 3.297 4.290 1.219
356 HB VAL 48 HB VAL 48 2.048 2.284 1.585
357 1HG1 VAL 48 1HG1 VAL 48 1.514 1.439 3.845
358 2HG1 VAL 48 2HG1 VAL 48 3.207 1.216 3.401
359 3HG1 VAL 48 3HG1 VAL 48 2.756 2.499 4.534
360 1HG2 VAL 48 1HG2 VAL 48 0.227 3.273 3.076
361 2HG2 VAL 48 2HG2 VAL 48 1.270 4.692 3.255
362 3HG2 VAL 48 3HG2 VAL 48 0.730 4.205 1.652
363 H ILE 49 H ILE 49 3.229 6.272 2.051
364 HA ILE 49 HA ILE 49 4.822 6.765 4.455
365 HB ILE 49 HB ILE 49 4.096 8.762 2.270
366 1HG1 ILE 49 2HG1 ILE 49 5.263 7.081 1.080
367 2HG1 ILE 49 3HG1 ILE 49 6.296 8.486 1.297
368 1HG2 ILE 49 1HG2 ILE 49 6.023 10.009 3.147
369 2HG2 ILE 49 2HG2 ILE 49 4.774 9.763 4.374
370 3HG2 ILE 49 3HG2 ILE 49 6.248 8.782 4.415
371 1HD1 ILE 49 1HD1 ILE 49 7.488 7.313 3.158
372 2HD1 ILE 49 2HD1 ILE 49 6.493 5.869 2.849
373 3HD1 ILE 49 3HD1 ILE 49 7.604 6.466 1.608
374 H TYR 50 H TYR 50 3.183 6.677 6.066
375 HA TYR 50 HA TYR 50 0.752 8.379 5.691
376 1HB TYR 50 2HB TYR 50 -0.727 6.720 6.495
377 2HB TYR 50 3HB TYR 50 0.122 6.073 5.120
378 HD1 TYR 50 HD1 TYR 50 1.171 3.960 5.295
379 HD2 TYR 50 HD2 TYR 50 -0.193 5.958 8.835
380 HE1 TYR 50 HE1 TYR 50 1.353 1.856 6.565
381 HE2 TYR 50 HE2 TYR 50 0.423 3.986 10.183
382 HH TYR 50 HH TYR 50 1.260 1.835 10.138
383 H ASP 51 H ASP 51 -0.433 8.523 7.740
384 HA ASP 51 HA ASP 51 1.450 9.338 9.826
385 1HB ASP 51 2HB ASP 51 -1.476 9.997 9.395
386 2HB ASP 51 3HB ASP 51 -0.404 10.679 10.634
387 HA PRO 52 HA PRO 52 -0.197 5.534 11.704
388 1HB PRO 52 2HB PRO 52 1.735 4.935 13.533
389 2HB PRO 52 3HB PRO 52 1.924 4.654 11.789
390 1HG PRO 52 2HG PRO 52 2.831 7.091 13.359
391 2HG PRO 52 3HG PRO 52 3.817 6.082 12.259
392 1HD PRO 52 2HD PRO 52 2.698 8.364 11.404
393 2HD PRO 52 3HD PRO 52 2.673 6.929 10.342
394 H ALA 53 H ALA 53 -0.609 8.552 12.745
395 HA ALA 53 HA ALA 53 -1.552 7.923 15.464
396 1HB ALA 53 1HB ALA 53 -1.786 10.383 13.677
397 2HB ALA 53 2HB ALA 53 -2.376 10.247 15.345
398 3HB ALA 53 3HB ALA 53 -0.631 10.171 15.015
399 H GLU 54 H GLU 54 -2.473 8.013 12.035
400 HA GLU 54 HA GLU 54 -5.333 7.909 12.770
401 1HB GLU 54 2HB GLU 54 -3.832 9.651 10.973
402 2HB GLU 54 3HB GLU 54 -5.010 8.699 10.058
403 1HG GLU 54 2HG GLU 54 -6.037 10.763 10.735
404 2HG GLU 54 3HG GLU 54 -6.824 9.405 11.554
405 H THR 55 H THR 55 -3.080 6.946 10.098
406 HA THR 55 HA THR 55 -4.525 4.452 9.878
407 HB THR 55 HB THR 55 -2.634 4.110 7.912
408 HG1 THR 55 1HG THR 55 -3.630 6.436 7.278
409 1HG2 THR 55 1HG2 THR 55 -4.609 4.602 6.503
410 2HG2 THR 55 2HG2 THR 55 -5.063 3.626 7.922
411 3HG2 THR 55 3HG2 THR 55 -5.449 5.368 7.883
412 H GLY 56 H GLY 56 -2.830 2.689 9.226
413 1HA GLY 56 2HA GLY 56 -0.768 1.982 10.978
414 2HA GLY 56 3HA GLY 56 -2.344 1.440 11.623
415 H THR 57 H THR 57 -2.130 -0.753 10.989
416 HA THR 57 HA THR 57 -1.466 -1.599 8.269
417 HB THR 57 HB THR 57 -2.062 -3.823 9.406
418 HG1 THR 57 1HG THR 57 -2.355 -3.679 11.653
419 1HG2 THR 57 1HG2 THR 57 0.288 -2.947 9.290
420 2HG2 THR 57 2HG2 THR 57 0.036 -2.032 10.785
421 3HG2 THR 57 3HG2 THR 57 0.003 -3.806 10.815
422 H ALA 58 H ALA 58 -4.144 -1.132 10.483
423 HA ALA 58 HA ALA 58 -6.219 -2.425 9.527
424 1HB ALA 58 1HB ALA 58 -7.691 -0.648 10.398
425 2HB ALA 58 2HB ALA 58 -6.322 -0.960 11.480
426 3HB ALA 58 3HB ALA 58 -6.315 0.473 10.432
427 H ALA 59 H ALA 59 -5.487 0.792 8.221
428 HA ALA 59 HA ALA 59 -7.870 0.516 6.467
429 1HB ALA 59 1HB ALA 59 -7.102 2.766 7.329
430 2HB ALA 59 2HB ALA 59 -5.751 2.626 6.144
431 3HB ALA 59 3HB ALA 59 -7.421 2.653 5.587
432 H ILE 60 H ILE 60 -4.371 0.310 6.234
433 HA ILE 60 HA ILE 60 -4.120 0.075 3.436
434 HB ILE 60 HB ILE 60 -2.430 -0.532 5.860
435 1HG1 ILE 60 2HG1 ILE 60 -0.827 0.781 4.373
436 2HG1 ILE 60 3HG1 ILE 60 -2.168 0.979 3.236
437 1HG2 ILE 60 1HG2 ILE 60 -1.727 -1.615 3.113
438 2HG2 ILE 60 2HG2 ILE 60 -0.632 -1.481 4.510
439 3HG2 ILE 60 3HG2 ILE 60 -2.007 -2.572 4.593
440 1HD1 ILE 60 1HD1 ILE 60 -1.812 2.962 4.708
441 2HD1 ILE 60 2HD1 ILE 60 -3.352 2.221 5.180
442 3HD1 ILE 60 3HD1 ILE 60 -1.878 1.948 6.142
443 H GLN 61 H GLN 61 -4.462 -2.558 5.890
444 HA GLN 61 HA GLN 61 -4.430 -4.552 3.849
445 1HB GLN 61 2HB GLN 61 -4.735 -4.490 6.733
446 2HB GLN 61 3HB GLN 61 -5.931 -5.554 6.000
447 1HG GLN 61 2HG GLN 61 -4.451 -7.173 5.919
448 2HG GLN 61 3HG GLN 61 -3.567 -6.310 4.673
449 1HE2 GLN 61 1HE2 GLN 61 -2.418 -4.170 6.102
450 2HE2 GLN 61 2HE2 GLN 61 -1.288 -4.874 7.255
451 H GLU 62 H GLU 62 -7.156 -2.892 5.539
452 HA GLU 62 HA GLU 62 -9.365 -4.151 4.363
453 1HB GLU 62 2HB GLU 62 -8.706 -1.368 5.338
454 2HB GLU 62 3HB GLU 62 -10.198 -1.561 4.445
455 1HG GLU 62 2HG GLU 62 -9.524 -3.364 6.800
456 2HG GLU 62 3HG GLU 62 -10.298 -1.786 6.999
457 H LYS 63 H LYS 63 -7.604 -1.271 3.100
458 HA LYS 63 HA LYS 63 -9.103 -1.207 0.693
459 1HB LYS 63 2HB LYS 63 -6.728 0.161 1.890
460 2HB LYS 63 3HB LYS 63 -6.963 0.308 0.186
461 1HG LYS 63 2HG LYS 63 -9.290 0.725 2.105
462 2HG LYS 63 3HG LYS 63 -8.141 2.014 1.800
463 1HD LYS 63 2HD LYS 63 -9.569 0.615 -0.495
464 2HD LYS 63 3HD LYS 63 -10.281 2.001 0.359
465 1HE LYS 63 2HE LYS 63 -8.629 3.502 -0.331
466 2HE LYS 63 3HE LYS 63 -7.441 2.242 -0.659
467 1HZ LYS 63 1HZ LYS 63 -8.559 1.667 -2.613
468 2HZ LYS 63 2HZ LYS 63 -9.811 2.712 -2.312
469 3HZ LYS 63 3HZ LYS 63 -8.285 3.303 -2.555
470 H ILE 64 H ILE 64 -5.987 -2.728 1.563
471 HA ILE 64 HA ILE 64 -4.959 -3.235 -0.935
472 HB ILE 64 HB ILE 64 -4.752 -4.288 1.780
473 1HG1 ILE 64 2HG1 ILE 64 -3.356 -2.474 0.710
474 2HG1 ILE 64 3HG1 ILE 64 -2.502 -3.770 1.546
475 1HG2 ILE 64 1HG2 ILE 64 -3.298 -6.126 1.252
476 2HG2 ILE 64 2HG2 ILE 64 -4.999 -6.425 0.934
477 3HG2 ILE 64 3HG2 ILE 64 -3.900 -6.095 -0.429
478 1HD1 ILE 64 1HD1 ILE 64 -1.397 -3.233 -0.548
479 2HD1 ILE 64 2HD1 ILE 64 -2.044 -4.884 -0.609
480 3HD1 ILE 64 3HD1 ILE 64 -2.881 -3.580 -1.466
481 H GLU 65 H GLU 65 -7.138 -5.214 1.171
482 HA GLU 65 HA GLU 65 -7.813 -7.271 -0.661
483 1HB GLU 65 2HB GLU 65 -9.159 -6.090 1.794
484 2HB GLU 65 3HB GLU 65 -9.916 -7.389 0.872
485 1HG GLU 65 2HG GLU 65 -7.058 -7.691 1.800
486 2HG GLU 65 3HG GLU 65 -8.408 -8.002 2.901
487 H LYS 66 H LYS 66 -9.717 -4.314 0.183
488 HA LYS 66 HA LYS 66 -11.774 -4.725 -1.698
489 1HB LYS 66 2HB LYS 66 -10.643 -2.367 -0.245
490 2HB LYS 66 3HB LYS 66 -11.722 -2.020 -1.584
491 1HG LYS 66 2HG LYS 66 -12.645 -4.142 0.327
492 2HG LYS 66 3HG LYS 66 -12.552 -2.526 1.004
493 1HD LYS 66 2HD LYS 66 -13.911 -3.040 -1.674
494 2HD LYS 66 3HD LYS 66 -14.780 -3.248 -0.143
495 1HE LYS 66 2HE LYS 66 -14.458 -0.952 0.507
496 2HE LYS 66 3HE LYS 66 -13.319 -0.643 -0.806
497 1HZ LYS 66 1HZ LYS 66 -15.481 0.240 -1.272
498 2HZ LYS 66 2HZ LYS 66 -15.090 -0.916 -2.373
499 3HZ LYS 66 3HZ LYS 66 -16.173 -1.247 -1.176
500 H LEU 67 H LEU 67 -8.609 -3.246 -2.287
501 HA LEU 67 HA LEU 67 -9.217 -2.421 -5.007
502 1HB LEU 67 2HB LEU 67 -6.696 -2.663 -3.346
503 2HB LEU 67 3HB LEU 67 -6.632 -2.264 -5.057
504 HG LEU 67 HG LEU 67 -8.506 -0.653 -3.328
505 1HD1 LEU 67 1HD1 LEU 67 -5.515 -0.578 -3.161
506 2HD1 LEU 67 2HD1 LEU 67 -6.382 0.971 -3.180
507 3HD1 LEU 67 3HD1 LEU 67 -6.726 -0.242 -1.944
508 1HD2 LEU 67 1HD2 LEU 67 -6.756 0.029 -5.737
509 2HD2 LEU 67 2HD2 LEU 67 -8.481 -0.367 -5.800
510 3HD2 LEU 67 3HD2 LEU 67 -7.943 1.099 -4.970
511 H GLY 68 H GLY 68 -8.497 -5.469 -3.538
512 1HA GLY 68 2HA GLY 68 -8.720 -7.498 -4.600
513 2HA GLY 68 3HA GLY 68 -8.474 -6.753 -6.183
514 H TYR 69 H TYR 69 -6.459 -6.584 -3.168
515 HA TYR 69 HA TYR 69 -4.240 -8.022 -4.550
516 1HB TYR 69 2HB TYR 69 -4.491 -5.170 -3.969
517 2HB TYR 69 3HB TYR 69 -3.184 -5.849 -3.028
518 HD1 TYR 69 HD1 TYR 69 -1.143 -6.597 -4.047
519 HD2 TYR 69 HD2 TYR 69 -4.536 -5.570 -6.501
520 HE1 TYR 69 HE1 TYR 69 0.316 -6.451 -6.017
521 HE2 TYR 69 HE2 TYR 69 -3.070 -5.438 -8.475
522 HH TYR 69 HH TYR 69 0.445 -6.069 -8.291
523 H HIS 70 H HIS 70 -2.410 -8.393 -2.916
524 HA HIS 70 HA HIS 70 -3.340 -8.539 -0.105
525 1HB HIS 70 2HB HIS 70 -3.788 -10.708 -1.248
526 2HB HIS 70 3HB HIS 70 -2.058 -10.874 -1.562
527 HD1 HIS 70 1HD HIS 70 -1.376 -9.804 1.642
528 HD2 HIS 70 2HD HIS 70 -3.843 -12.920 0.224
529 HE1 HIS 70 1HE HIS 70 -1.577 -11.471 3.513
530 H VAL 71 H VAL 71 -1.871 -7.442 1.038
531 HA VAL 71 HA VAL 71 0.945 -7.259 0.137
532 HB VAL 71 HB VAL 71 -0.406 -5.213 0.803
533 1HG1 VAL 71 1HG1 VAL 71 -0.676 -4.663 3.139
534 2HG1 VAL 71 2HG1 VAL 71 -1.528 -6.188 2.844
535 3HG1 VAL 71 3HG1 VAL 71 0.053 -6.190 3.654
536 1HG2 VAL 71 1HG2 VAL 71 2.000 -5.197 0.616
537 2HG2 VAL 71 2HG2 VAL 71 1.464 -4.166 1.954
538 3HG2 VAL 71 3HG2 VAL 71 2.143 -5.780 2.288
539 H VAL 72 H VAL 72 2.633 -8.010 1.582
540 HA VAL 72 HA VAL 72 1.757 -9.906 3.719
541 HB VAL 72 HB VAL 72 4.014 -10.294 1.824
542 1HG1 VAL 72 1HG1 VAL 72 2.839 -12.108 3.971
543 2HG1 VAL 72 2HG1 VAL 72 4.081 -12.594 2.801
544 3HG1 VAL 72 3HG1 VAL 72 4.448 -11.349 3.993
545 1HG2 VAL 72 1HG2 VAL 72 1.260 -11.615 1.925
546 2HG2 VAL 72 2HG2 VAL 72 1.922 -10.646 0.588
547 3HG2 VAL 72 3HG2 VAL 72 2.622 -12.228 0.969
548 H ILE 73 H ILE 73 3.020 -9.897 5.528
549 HA ILE 73 HA ILE 73 4.791 -7.511 5.836
550 HB ILE 73 HB ILE 73 2.982 -8.812 7.880
551 1HG1 ILE 73 2HG1 ILE 73 2.228 -6.241 7.829
552 2HG1 ILE 73 3HG1 ILE 73 2.904 -6.299 6.201
553 1HG2 ILE 73 1HG2 ILE 73 4.823 -6.403 8.131
554 2HG2 ILE 73 2HG2 ILE 73 3.657 -6.986 9.344
555 3HG2 ILE 73 3HG2 ILE 73 5.077 -7.956 8.959
556 1HD1 ILE 73 1HD1 ILE 73 1.317 -8.090 5.630
557 2HD1 ILE 73 2HD1 ILE 73 0.771 -8.136 7.330
558 3HD1 ILE 73 3HD1 ILE 73 0.462 -6.700 6.323
559 H GLU 74 H GLU 74 6.485 -8.896 4.918
560 HA GLU 74 HA GLU 74 7.524 -11.037 6.395
561 1HB GLU 74 2HB GLU 74 8.220 -9.547 3.948
562 2HB GLU 74 3HB GLU 74 9.536 -10.403 4.752
563 1HG GLU 74 2HG GLU 74 6.954 -11.868 4.161
564 2HG GLU 74 3HG GLU 74 8.253 -11.730 2.964
565 H GLY 75 H GLY 75 7.496 -8.037 7.377
566 1HA GLY 75 2HA GLY 75 8.679 -6.813 8.976
567 2HA GLY 75 3HA GLY 75 9.467 -8.340 9.405
568 H ARG 76 H ARG 76 9.575 -5.578 7.110
569 HA ARG 76 HA ARG 76 12.467 -5.674 6.869
570 1HB ARG 76 2HB ARG 76 10.667 -6.537 4.725
571 2HB ARG 76 3HB ARG 76 11.223 -4.916 4.357
572 1HG ARG 76 2HG ARG 76 12.726 -6.301 3.275
573 2HG ARG 76 3HG ARG 76 13.612 -5.733 4.693
574 1HD ARG 76 2HD ARG 76 12.121 -8.408 4.495
575 2HD ARG 76 3HD ARG 76 13.823 -8.253 4.108
576 HE ARG 76 HE ARG 76 12.508 -8.161 6.757
577 1HH1 ARG 76 2HH2 ARG 76 15.485 -7.407 5.045
578 2HH1 ARG 76 1HH2 ARG 76 16.504 -7.480 6.451
579 1HH2 ARG 76 2HH1 ARG 76 13.701 -8.158 8.583
580 2HH2 ARG 76 1HH1 ARG 76 15.444 -7.968 8.583
Start of MODEL 6
1 1H MET 1 H1 MET 1 -3.931 17.454 17.783
2 2H MET 1 H2 MET 1 -3.592 17.746 19.394
3 3H MET 1 H3 MET 1 -3.211 18.848 18.210
4 HA MET 1 HA MET 1 -1.192 17.802 18.657
5 1HB MET 1 2HB MET 1 -2.780 15.209 18.314
6 2HB MET 1 3HB MET 1 -1.020 15.325 18.401
7 1HG MET 1 2HG MET 1 -1.287 16.428 20.684
8 2HG MET 1 3HG MET 1 -3.010 16.040 20.587
9 1HE MET 1 1HE MET 1 0.616 14.695 20.960
10 2HE MET 1 2HE MET 1 0.367 12.940 21.079
11 3HE MET 1 3HE MET 1 0.144 13.754 19.521
12 H LEU 2 H LEU 2 0.206 16.831 16.840
13 HA LEU 2 HA LEU 2 -1.091 17.296 14.203
14 1HB LEU 2 2HB LEU 2 1.338 18.335 15.337
15 2HB LEU 2 3HB LEU 2 1.834 17.134 14.171
16 HG LEU 2 HG LEU 2 -0.242 18.767 12.933
17 1HD1 LEU 2 1HD1 LEU 2 0.835 20.953 13.012
18 2HD1 LEU 2 2HD1 LEU 2 0.349 20.451 14.641
19 3HD1 LEU 2 3HD1 LEU 2 2.056 20.345 14.151
20 1HD2 LEU 2 1HD2 LEU 2 2.752 18.586 12.427
21 2HD2 LEU 2 2HD2 LEU 2 1.511 17.519 11.730
22 3HD2 LEU 2 3HD2 LEU 2 1.527 19.245 11.323
23 H SER 3 H SER 3 -0.380 15.885 12.478
24 HA SER 3 HA SER 3 -0.062 13.088 13.337
25 1HB SER 3 2HB SER 3 -0.578 14.250 10.563
26 2HB SER 3 3HB SER 3 -0.828 12.608 11.108
27 HG SER 3 HG SER 3 -2.449 13.355 12.526
28 H GLU 4 H GLU 4 2.104 12.554 13.643
29 HA GLU 4 HA GLU 4 4.207 13.483 11.825
30 1HB GLU 4 2HB GLU 4 4.037 11.697 14.182
31 2HB GLU 4 3HB GLU 4 5.238 11.289 12.988
32 1HG GLU 4 2HG GLU 4 5.967 13.722 13.163
33 2HG GLU 4 3HG GLU 4 5.022 13.731 14.660
34 H GLN 5 H GLN 5 5.396 11.735 10.614
35 HA GLN 5 HA GLN 5 3.515 9.865 9.251
36 1HB GLN 5 2HB GLN 5 5.609 11.672 8.018
37 2HB GLN 5 3HB GLN 5 4.778 10.374 7.192
38 1HG GLN 5 2HG GLN 5 2.733 12.000 8.418
39 2HG GLN 5 3HG GLN 5 3.884 13.108 7.670
40 1HE2 GLN 5 1HE2 GLN 5 2.681 9.840 6.866
41 2HE2 GLN 5 2HE2 GLN 5 2.078 10.231 5.268
42 H LYS 6 H LYS 6 4.453 7.952 8.388
43 HA LYS 6 HA LYS 6 7.337 7.629 8.644
44 1HB LYS 6 2HB LYS 6 5.389 5.657 9.833
45 2HB LYS 6 3HB LYS 6 7.013 5.184 9.424
46 1HG LYS 6 2HG LYS 6 6.713 7.524 11.310
47 2HG LYS 6 3HG LYS 6 6.372 5.906 11.899
48 1HD LYS 6 2HD LYS 6 8.685 6.576 12.370
49 2HD LYS 6 3HD LYS 6 8.568 5.099 11.389
50 1HE LYS 6 2HE LYS 6 9.035 6.276 9.386
51 2HE LYS 6 3HE LYS 6 9.006 7.878 10.177
52 1HZ LYS 6 1HZ LYS 6 11.001 5.743 10.523
53 2HZ LYS 6 2HZ LYS 6 11.160 7.140 9.676
54 3HZ LYS 6 3HZ LYS 6 11.010 7.194 11.324
55 H GLU 7 H GLU 7 8.179 6.022 7.359
56 HA GLU 7 HA GLU 7 6.642 5.377 4.911
57 1HB GLU 7 2HB GLU 7 9.618 4.978 5.020
58 2HB GLU 7 3HB GLU 7 8.571 5.512 3.734
59 1HG GLU 7 2HG GLU 7 9.896 7.360 4.224
60 2HG GLU 7 3HG GLU 7 8.446 7.755 5.160
61 H ILE 8 H ILE 8 5.646 3.357 5.478
62 HA ILE 8 HA ILE 8 7.304 1.380 6.872
63 HB ILE 8 HB ILE 8 4.525 1.174 5.883
64 1HG1 ILE 8 2HG1 ILE 8 4.304 3.091 7.214
65 2HG1 ILE 8 3HG1 ILE 8 3.718 1.698 8.141
66 1HG2 ILE 8 1HG2 ILE 8 6.167 -0.189 7.969
67 2HG2 ILE 8 2HG2 ILE 8 4.401 -0.447 7.799
68 3HG2 ILE 8 3HG2 ILE 8 5.498 -0.899 6.480
69 1HD1 ILE 8 1HD1 ILE 8 5.072 3.114 9.547
70 2HD1 ILE 8 2HD1 ILE 8 5.853 1.533 9.286
71 3HD1 ILE 8 3HD1 ILE 8 6.428 2.961 8.398
72 H ALA 9 H ALA 9 7.453 -0.792 5.854
73 HA ALA 9 HA ALA 9 7.526 -0.813 2.892
74 1HB ALA 9 1HB ALA 9 9.737 -1.853 4.722
75 2HB ALA 9 2HB ALA 9 9.695 -1.932 2.948
76 3HB ALA 9 3HB ALA 9 9.849 -0.364 3.769
77 H MET 10 H MET 10 6.766 -2.817 2.095
78 HA MET 10 HA MET 10 6.710 -5.170 3.798
79 1HB MET 10 2HB MET 10 4.230 -5.429 3.783
80 2HB MET 10 3HB MET 10 4.813 -4.089 4.757
81 1HG MET 10 2HG MET 10 4.310 -2.627 2.611
82 2HG MET 10 3HG MET 10 3.352 -4.046 2.142
83 1HE MET 10 1HE MET 10 2.436 -1.173 5.625
84 2HE MET 10 2HE MET 10 3.783 -2.326 5.748
85 3HE MET 10 3HE MET 10 3.823 -1.033 4.517
86 H GLN 11 H GLN 11 5.263 -6.930 2.525
87 HA GLN 11 HA GLN 11 6.332 -6.959 -0.262
88 1HB GLN 11 2HB GLN 11 5.609 -9.134 1.769
89 2HB GLN 11 3HB GLN 11 5.817 -9.485 0.064
90 1HG GLN 11 2HG GLN 11 7.912 -8.338 1.966
91 2HG GLN 11 3HG GLN 11 7.848 -9.999 1.346
92 1HE2 GLN 11 1HE2 GLN 11 7.374 -9.854 -1.295
93 2HE2 GLN 11 2HE2 GLN 11 8.321 -8.633 -2.108
94 H VAL 12 H VAL 12 4.906 -8.054 -1.864
95 HA VAL 12 HA VAL 12 2.003 -7.895 -1.249
96 HB VAL 12 HB VAL 12 1.931 -7.117 -3.796
97 1HG1 VAL 12 1HG1 VAL 12 0.794 -5.917 -2.087
98 2HG1 VAL 12 2HG1 VAL 12 2.312 -5.367 -1.367
99 3HG1 VAL 12 3HG1 VAL 12 1.799 -4.734 -2.948
100 1HG2 VAL 12 1HG2 VAL 12 4.501 -5.773 -2.849
101 2HG2 VAL 12 2HG2 VAL 12 4.410 -7.058 -4.081
102 3HG2 VAL 12 3HG2 VAL 12 3.616 -5.493 -4.347
103 H SER 13 H SER 13 0.657 -9.168 -2.621
104 HA SER 13 HA SER 13 1.967 -11.210 -4.288
105 1HB SER 13 2HB SER 13 0.290 -11.834 -1.813
106 2HB SER 13 3HB SER 13 0.668 -13.016 -3.082
107 HG SER 13 HG SER 13 2.182 -13.145 -1.386
108 H GLY 14 H GLY 14 0.307 -12.468 -5.463
109 1HA GLY 14 2HA GLY 14 -1.632 -12.682 -6.687
110 2HA GLY 14 3HA GLY 14 -2.454 -11.628 -5.524
111 H MET 15 H MET 15 -0.002 -11.511 -8.191
112 HA MET 15 HA MET 15 -1.278 -9.113 -9.286
113 1HB MET 15 2HB MET 15 0.793 -7.856 -9.335
114 2HB MET 15 3HB MET 15 0.344 -8.269 -7.669
115 1HG MET 15 2HG MET 15 2.652 -8.467 -7.773
116 2HG MET 15 3HG MET 15 2.063 -10.127 -7.750
117 1HE MET 15 1HE MET 15 5.462 -10.088 -9.811
118 2HE MET 15 2HE MET 15 5.052 -8.951 -8.511
119 3HE MET 15 3HE MET 15 4.654 -10.676 -8.336
120 H THR 16 H THR 16 -0.353 -8.586 -11.421
121 HA THR 16 HA THR 16 0.953 -10.896 -12.808
122 HB THR 16 HB THR 16 -0.092 -9.638 -14.881
123 HG1 THR 16 1HG THR 16 -2.099 -9.127 -12.965
124 1HG2 THR 16 1HG2 THR 16 -2.098 -11.102 -14.743
125 2HG2 THR 16 2HG2 THR 16 -0.591 -11.946 -14.352
126 3HG2 THR 16 3HG2 THR 16 -1.695 -11.470 -13.047
127 H CYS 17 H CYS 17 0.405 -7.382 -13.458
128 HA CYS 17 HA CYS 17 3.287 -7.245 -14.174
129 1HB CYS 17 2HB CYS 17 2.755 -5.548 -15.691
130 2HB CYS 17 3HB CYS 17 1.556 -6.824 -15.930
131 H ALA 18 H ALA 18 4.554 -5.483 -13.655
132 HA ALA 18 HA ALA 18 4.163 -4.346 -11.007
133 1HB ALA 18 1HB ALA 18 6.300 -3.897 -13.138
134 2HB ALA 18 2HB ALA 18 6.380 -3.337 -11.459
135 3HB ALA 18 3HB ALA 18 6.376 -5.076 -11.814
136 H ALA 19 H ALA 19 1.993 -3.507 -12.270
137 HA ALA 19 HA ALA 19 2.408 -0.583 -12.540
138 1HB ALA 19 1HB ALA 19 2.558 -1.507 -14.866
139 2HB ALA 19 2HB ALA 19 0.897 -2.115 -14.686
140 3HB ALA 19 3HB ALA 19 1.213 -0.375 -14.611
141 H CYS 20 H CYS 20 -0.096 -3.239 -12.632
142 HA CYS 20 HA CYS 20 -2.170 -1.623 -11.561
143 1HB CYS 20 2HB CYS 20 -1.716 -4.609 -11.104
144 2HB CYS 20 3HB CYS 20 -3.229 -3.710 -10.874
145 H ALA 21 H ALA 21 0.451 -3.399 -9.981
146 HA ALA 21 HA ALA 21 -0.107 -2.994 -7.303
147 1HB ALA 21 1HB ALA 21 1.891 -4.187 -8.409
148 2HB ALA 21 2HB ALA 21 2.649 -2.590 -8.514
149 3HB ALA 21 3HB ALA 21 2.208 -3.278 -6.929
150 H ALA 22 H ALA 22 0.683 -0.469 -9.684
151 HA ALA 22 HA ALA 22 1.386 1.524 -7.664
152 1HB ALA 22 1HB ALA 22 2.063 1.518 -10.158
153 2HB ALA 22 2HB ALA 22 0.410 2.087 -10.480
154 3HB ALA 22 3HB ALA 22 1.495 3.043 -9.451
155 H ARG 23 H ARG 23 -1.480 0.486 -9.515
156 HA ARG 23 HA ARG 23 -3.176 2.691 -8.878
157 1HB ARG 23 2HB ARG 23 -3.872 -0.189 -9.598
158 2HB ARG 23 3HB ARG 23 -5.025 1.143 -9.509
159 1HG ARG 23 2HG ARG 23 -3.925 2.356 -11.278
160 2HG ARG 23 3HG ARG 23 -2.564 1.219 -11.311
161 1HD ARG 23 2HD ARG 23 -4.149 -0.605 -11.982
162 2HD ARG 23 3HD ARG 23 -5.440 0.584 -12.071
163 HE ARG 23 HE ARG 23 -4.177 1.814 -13.760
164 1HH1 ARG 23 2HH2 ARG 23 -3.313 -1.688 -13.463
165 2HH1 ARG 23 1HH2 ARG 23 -2.561 -1.722 -14.990
166 1HH2 ARG 23 2HH1 ARG 23 -3.114 1.703 -15.756
167 2HH2 ARG 23 1HH1 ARG 23 -2.456 0.206 -16.326
168 H ILE 24 H ILE 24 -2.600 -0.476 -7.270
169 HA ILE 24 HA ILE 24 -4.562 -0.036 -5.288
170 HB ILE 24 HB ILE 24 -3.772 -1.756 -4.015
171 1HG1 ILE 24 2HG1 ILE 24 -1.170 -1.345 -5.372
172 2HG1 ILE 24 3HG1 ILE 24 -1.535 -1.242 -3.633
173 1HG2 ILE 24 1HG2 ILE 24 -2.968 -2.561 -6.836
174 2HG2 ILE 24 2HG2 ILE 24 -3.831 -3.484 -5.591
175 3HG2 ILE 24 3HG2 ILE 24 -4.650 -2.169 -6.418
176 1HD1 ILE 24 1HD1 ILE 24 -1.361 -3.713 -5.354
177 2HD1 ILE 24 2HD1 ILE 24 -0.242 -3.230 -4.077
178 3HD1 ILE 24 3HD1 ILE 24 -1.900 -3.713 -3.645
179 H GLU 25 H GLU 25 -1.012 0.585 -4.938
180 HA GLU 25 HA GLU 25 -1.177 1.959 -2.531
181 1HB GLU 25 2HB GLU 25 0.763 1.851 -4.791
182 2HB GLU 25 3HB GLU 25 0.855 3.319 -3.802
183 1HG GLU 25 2HG GLU 25 2.338 1.508 -2.959
184 2HG GLU 25 3HG GLU 25 1.145 2.036 -1.767
185 H LYS 26 H LYS 26 -1.928 3.281 -5.766
186 HA LYS 26 HA LYS 26 -1.994 5.994 -4.704
187 1HB LYS 26 2HB LYS 26 -2.740 4.882 -7.383
188 2HB LYS 26 3HB LYS 26 -3.242 6.497 -6.879
189 1HG LYS 26 2HG LYS 26 -1.212 6.843 -8.003
190 2HG LYS 26 3HG LYS 26 -0.840 7.053 -6.284
191 1HD LYS 26 2HD LYS 26 0.089 4.704 -6.248
192 2HD LYS 26 3HD LYS 26 -0.421 4.579 -7.930
193 1HE LYS 26 2HE LYS 26 1.940 4.941 -7.934
194 2HE LYS 26 3HE LYS 26 1.168 6.401 -8.552
195 1HZ LYS 26 1HZ LYS 26 2.186 6.056 -5.763
196 2HZ LYS 26 2HZ LYS 26 2.924 6.876 -6.980
197 3HZ LYS 26 3HZ LYS 26 1.497 7.408 -6.383
198 H GLY 27 H GLY 27 -4.534 3.584 -5.561
199 1HA GLY 27 2HA GLY 27 -6.787 5.167 -4.756
200 2HA GLY 27 3HA GLY 27 -6.707 3.399 -4.857
201 H LEU 28 H LEU 28 -4.528 3.055 -3.053
202 HA LEU 28 HA LEU 28 -5.795 2.970 -0.447
203 1HB LEU 28 2HB LEU 28 -4.242 1.363 -1.259
204 2HB LEU 28 3HB LEU 28 -2.960 2.566 -1.374
205 HG LEU 28 HG LEU 28 -4.300 1.881 1.266
206 1HD1 LEU 28 1HD1 LEU 28 -3.544 -0.182 0.328
207 2HD1 LEU 28 2HD1 LEU 28 -1.998 0.532 -0.178
208 3HD1 LEU 28 3HD1 LEU 28 -2.346 0.295 1.542
209 1HD2 LEU 28 1HD2 LEU 28 -1.614 3.104 0.427
210 2HD2 LEU 28 2HD2 LEU 28 -2.955 3.930 1.248
211 3HD2 LEU 28 3HD2 LEU 28 -2.042 2.694 2.095
212 H LYS 29 H LYS 29 -3.217 5.016 -1.880
213 HA LYS 29 HA LYS 29 -2.827 6.725 0.267
214 1HB LYS 29 2HB LYS 29 -1.506 6.458 -1.869
215 2HB LYS 29 3HB LYS 29 -2.671 7.513 -2.664
216 1HG LYS 29 2HG LYS 29 -1.656 8.744 -0.193
217 2HG LYS 29 3HG LYS 29 -0.368 8.049 -1.138
218 1HD LYS 29 2HD LYS 29 -0.510 10.280 -2.002
219 2HD LYS 29 3HD LYS 29 -1.233 9.240 -3.205
220 1HE LYS 29 2HE LYS 29 -2.434 11.327 -2.754
221 2HE LYS 29 3HE LYS 29 -3.458 9.899 -2.475
222 1HZ LYS 29 1HZ LYS 29 -2.011 11.249 -0.286
223 2HZ LYS 29 2HZ LYS 29 -3.536 11.715 -0.720
224 3HZ LYS 29 3HZ LYS 29 -3.282 10.193 -0.164
225 H ARG 30 H ARG 30 -5.522 6.649 -1.926
226 HA ARG 30 HA ARG 30 -6.472 9.344 -1.406
227 1HB ARG 30 2HB ARG 30 -7.161 7.074 -3.080
228 2HB ARG 30 3HB ARG 30 -8.611 7.627 -2.263
229 1HG ARG 30 2HG ARG 30 -6.735 9.588 -3.648
230 2HG ARG 30 3HG ARG 30 -7.849 8.590 -4.588
231 1HD ARG 30 2HD ARG 30 -9.763 9.396 -3.355
232 2HD ARG 30 3HD ARG 30 -8.737 10.418 -2.319
233 HE ARG 30 HE ARG 30 -8.063 11.232 -4.848
234 1HH1 ARG 30 2HH2 ARG 30 -11.142 10.973 -3.151
235 2HH1 ARG 30 1HH2 ARG 30 -11.950 12.193 -4.083
236 1HH2 ARG 30 2HH1 ARG 30 -9.080 12.906 -6.075
237 2HH2 ARG 30 1HH1 ARG 30 -10.727 13.342 -5.765
238 H MET 31 H MET 31 -6.379 6.572 0.611
239 HA MET 31 HA MET 31 -8.911 6.978 1.913
240 1HB MET 31 2HB MET 31 -8.269 5.164 3.276
241 2HB MET 31 3HB MET 31 -7.487 4.850 1.723
242 1HG MET 31 2HG MET 31 -5.378 5.847 2.809
243 2HG MET 31 3HG MET 31 -6.293 5.798 4.305
244 1HE MET 31 1HE MET 31 -5.220 2.628 5.679
245 2HE MET 31 2HE MET 31 -4.254 4.044 5.424
246 3HE MET 31 3HE MET 31 -5.975 4.223 5.852
247 HA PRO 32 HA PRO 32 -7.686 10.088 4.911
248 1HB PRO 32 2HB PRO 32 -8.977 9.308 7.205
249 2HB PRO 32 3HB PRO 32 -9.832 10.012 5.801
250 1HG PRO 32 2HG PRO 32 -9.482 7.076 6.459
251 2HG PRO 32 3HG PRO 32 -11.003 7.929 6.061
252 1HD PRO 32 2HD PRO 32 -9.646 6.565 4.185
253 2HD PRO 32 3HD PRO 32 -10.370 8.137 3.762
254 H GLY 33 H GLY 33 -5.841 10.255 6.161
255 1HA GLY 33 2HA GLY 33 -4.377 9.583 7.857
256 2HA GLY 33 3HA GLY 33 -4.847 7.897 7.673
257 H VAL 34 H VAL 34 -4.478 8.046 4.559
258 HA VAL 34 HA VAL 34 -1.520 7.862 4.675
259 HB VAL 34 HB VAL 34 -3.372 7.053 2.449
260 1HG1 VAL 34 1HG1 VAL 34 -1.316 5.734 1.777
261 2HG1 VAL 34 2HG1 VAL 34 -1.056 7.483 1.693
262 3HG1 VAL 34 3HG1 VAL 34 -0.404 6.562 3.047
263 1HG2 VAL 34 1HG2 VAL 34 -3.789 5.824 4.502
264 2HG2 VAL 34 2HG2 VAL 34 -2.982 4.765 3.331
265 3HG2 VAL 34 3HG2 VAL 34 -2.078 5.435 4.700
266 H THR 35 H THR 35 -0.248 9.449 4.033
267 HA THR 35 HA THR 35 -1.412 11.707 2.570
268 HB THR 35 HB THR 35 1.202 11.400 3.927
269 HG1 THR 35 1HG THR 35 -0.191 11.704 5.613
270 1HG2 THR 35 1HG2 THR 35 1.208 13.874 3.823
271 2HG2 THR 35 2HG2 THR 35 1.312 13.150 2.201
272 3HG2 THR 35 3HG2 THR 35 -0.235 13.825 2.789
273 H ASP 36 H ASP 36 1.429 9.405 2.112
274 HA ASP 36 HA ASP 36 1.034 9.679 -0.771
275 1HB ASP 36 2HB ASP 36 3.450 10.654 0.653
276 2HB ASP 36 3HB ASP 36 3.726 9.645 -0.770
277 H ALA 37 H ALA 37 1.962 8.003 -1.970
278 HA ALA 37 HA ALA 37 3.072 5.707 -0.539
279 1HB ALA 37 1HB ALA 37 0.537 5.540 -0.202
280 2HB ALA 37 2HB ALA 37 0.434 5.220 -1.947
281 3HB ALA 37 3HB ALA 37 1.338 4.116 -0.891
282 H ASN 38 H ASN 38 3.941 3.918 -1.819
283 HA ASN 38 HA ASN 38 4.372 4.543 -4.674
284 1HB ASN 38 2HB ASN 38 6.986 4.395 -3.625
285 2HB ASN 38 3HB ASN 38 6.184 5.797 -4.304
286 1HD2 ASN 38 1HD2 ASN 38 6.019 4.082 -1.132
287 2HD2 ASN 38 2HD2 ASN 38 6.312 5.544 -0.183
288 H VAL 39 H VAL 39 4.158 2.515 -5.476
289 HA VAL 39 HA VAL 39 4.875 0.226 -3.851
290 HB VAL 39 HB VAL 39 2.907 0.412 -5.361
291 1HG1 VAL 39 1HG1 VAL 39 4.062 1.356 -7.385
292 2HG1 VAL 39 2HG1 VAL 39 4.841 -0.225 -7.637
293 3HG1 VAL 39 3HG1 VAL 39 3.108 -0.095 -7.719
294 1HG2 VAL 39 1HG2 VAL 39 4.059 -2.038 -6.370
295 2HG2 VAL 39 2HG2 VAL 39 4.442 -1.825 -4.650
296 3HG2 VAL 39 3HG2 VAL 39 2.761 -1.789 -5.192
297 H ASN 40 H ASN 40 7.000 -0.552 -3.719
298 HA ASN 40 HA ASN 40 8.950 0.342 -5.788
299 1HB ASN 40 2HB ASN 40 9.317 0.901 -3.382
300 2HB ASN 40 3HB ASN 40 9.523 -0.815 -3.049
301 1HD2 ASN 40 1HD2 ASN 40 11.213 -1.908 -4.575
302 2HD2 ASN 40 2HD2 ASN 40 12.674 -0.956 -4.894
303 H LEU 41 H LEU 41 7.387 -1.277 -6.905
304 HA LEU 41 HA LEU 41 7.778 -4.080 -6.511
305 1HB LEU 41 2HB LEU 41 6.195 -2.349 -8.181
306 2HB LEU 41 3HB LEU 41 7.017 -3.467 -9.248
307 HG LEU 41 HG LEU 41 4.715 -4.071 -8.418
308 1HD1 LEU 41 1HD1 LEU 41 6.132 -5.721 -9.533
309 2HD1 LEU 41 2HD1 LEU 41 6.938 -6.106 -8.001
310 3HD1 LEU 41 3HD1 LEU 41 5.215 -6.475 -8.218
311 1HD2 LEU 41 1HD2 LEU 41 4.237 -4.731 -6.315
312 2HD2 LEU 41 2HD2 LEU 41 5.873 -5.303 -5.949
313 3HD2 LEU 41 3HD2 LEU 41 5.520 -3.576 -5.890
314 H ALA 42 H ALA 42 9.738 -1.721 -8.028
315 HA ALA 42 HA ALA 42 11.418 -3.001 -9.769
316 1HB ALA 42 1HB ALA 42 11.733 -0.684 -8.934
317 2HB ALA 42 2HB ALA 42 12.249 -1.345 -7.357
318 3HB ALA 42 3HB ALA 42 13.227 -1.648 -8.803
319 H THR 43 H THR 43 11.269 -3.548 -6.220
320 HA THR 43 HA THR 43 12.789 -6.040 -6.703
321 HB THR 43 HB THR 43 14.458 -4.610 -5.758
322 HG1 THR 43 1HG THR 43 13.387 -6.487 -3.953
323 1HG2 THR 43 1HG2 THR 43 12.334 -3.887 -3.745
324 2HG2 THR 43 2HG2 THR 43 14.036 -3.919 -3.244
325 3HG2 THR 43 3HG2 THR 43 13.537 -2.874 -4.577
326 H GLU 44 H GLU 44 10.003 -5.628 -6.721
327 HA GLU 44 HA GLU 44 8.109 -6.512 -5.946
328 1HB GLU 44 2HB GLU 44 10.247 -8.451 -5.678
329 2HB GLU 44 3HB GLU 44 9.057 -8.772 -4.433
330 1HG GLU 44 2HG GLU 44 8.351 -8.401 -7.378
331 2HG GLU 44 3HG GLU 44 8.682 -9.961 -6.611
332 H THR 45 H THR 45 9.013 -4.367 -4.279
333 HA THR 45 HA THR 45 7.909 -5.136 -1.631
334 HB THR 45 HB THR 45 9.846 -2.887 -2.306
335 HG1 THR 45 1HG THR 45 11.449 -4.404 -1.530
336 1HG2 THR 45 1HG2 THR 45 10.482 -3.158 0.070
337 2HG2 THR 45 2HG2 THR 45 8.762 -2.768 -0.089
338 3HG2 THR 45 3HG2 THR 45 9.267 -4.449 0.232
339 H VAL 46 H VAL 46 6.689 -3.361 -0.560
340 HA VAL 46 HA VAL 46 5.687 -1.193 -2.363
341 HB VAL 46 HB VAL 46 3.841 -2.598 -2.344
342 1HG1 VAL 46 1HG1 VAL 46 4.467 -4.369 -0.872
343 2HG1 VAL 46 2HG1 VAL 46 4.594 -3.244 0.493
344 3HG1 VAL 46 3HG1 VAL 46 3.002 -3.659 -0.162
345 1HG2 VAL 46 1HG2 VAL 46 3.375 -0.937 0.175
346 2HG2 VAL 46 2HG2 VAL 46 3.283 -0.309 -1.490
347 3HG2 VAL 46 3HG2 VAL 46 2.171 -1.584 -0.941
348 H ASN 47 H ASN 47 5.440 0.919 -1.337
349 HA ASN 47 HA ASN 47 6.199 0.996 1.508
350 1HB ASN 47 2HB ASN 47 7.437 2.531 -0.820
351 2HB ASN 47 3HB ASN 47 7.411 3.190 0.819
352 1HD2 ASN 47 1HD2 ASN 47 8.284 1.681 2.589
353 2HD2 ASN 47 2HD2 ASN 47 9.846 0.999 2.154
354 H VAL 48 H VAL 48 5.188 2.751 2.628
355 HA VAL 48 HA VAL 48 3.171 4.270 1.132
356 HB VAL 48 HB VAL 48 2.075 2.169 1.466
357 1HG1 VAL 48 1HG1 VAL 48 3.359 1.183 3.265
358 2HG1 VAL 48 2HG1 VAL 48 2.741 2.371 4.421
359 3HG1 VAL 48 3HG1 VAL 48 1.646 1.194 3.669
360 1HG2 VAL 48 1HG2 VAL 48 1.064 4.379 3.284
361 2HG2 VAL 48 2HG2 VAL 48 0.653 4.049 1.601
362 3HG2 VAL 48 3HG2 VAL 48 0.148 2.918 2.859
363 H ILE 49 H ILE 49 3.039 6.229 1.953
364 HA ILE 49 HA ILE 49 4.697 6.844 4.301
365 HB ILE 49 HB ILE 49 3.881 8.754 2.081
366 1HG1 ILE 49 2HG1 ILE 49 5.028 7.087 0.858
367 2HG1 ILE 49 3HG1 ILE 49 6.085 8.474 1.076
368 1HG2 ILE 49 1HG2 ILE 49 6.088 8.830 4.169
369 2HG2 ILE 49 2HG2 ILE 49 5.835 10.026 2.877
370 3HG2 ILE 49 3HG2 ILE 49 4.613 9.807 4.136
371 1HD1 ILE 49 1HD1 ILE 49 6.266 5.803 2.525
372 2HD1 ILE 49 2HD1 ILE 49 7.420 6.514 1.387
373 3HD1 ILE 49 3HD1 ILE 49 7.203 7.244 2.983
374 H TYR 50 H TYR 50 3.058 6.636 5.887
375 HA TYR 50 HA TYR 50 0.546 8.254 5.530
376 1HB TYR 50 2HB TYR 50 -0.768 6.559 6.543
377 2HB TYR 50 3HB TYR 50 0.050 5.898 5.145
378 HD1 TYR 50 HD1 TYR 50 -0.114 5.894 8.855
379 HD2 TYR 50 HD2 TYR 50 1.610 4.077 5.362
380 HE1 TYR 50 HE1 TYR 50 0.489 3.905 10.181
381 HE2 TYR 50 HE2 TYR 50 1.893 1.960 6.615
382 HH TYR 50 HH TYR 50 0.478 1.078 8.791
383 H ASP 51 H ASP 51 -0.522 8.529 7.587
384 HA ASP 51 HA ASP 51 1.432 9.458 9.556
385 1HB ASP 51 2HB ASP 51 -1.522 9.981 9.232
386 2HB ASP 51 3HB ASP 51 -0.396 10.698 10.405
387 HA PRO 52 HA PRO 52 0.079 5.659 11.683
388 1HB PRO 52 2HB PRO 52 2.246 5.039 13.192
389 2HB PRO 52 3HB PRO 52 2.226 4.823 11.430
390 1HG PRO 52 2HG PRO 52 3.241 7.262 12.951
391 2HG PRO 52 3HG PRO 52 4.133 6.288 11.747
392 1HD PRO 52 2HD PRO 52 2.867 8.532 11.013
393 2HD PRO 52 3HD PRO 52 2.780 7.072 9.976
394 H ALA 53 H ALA 53 -0.134 8.661 12.704
395 HA ALA 53 HA ALA 53 -0.598 8.144 15.589
396 1HB ALA 53 1HB ALA 53 -1.173 10.562 15.586
397 2HB ALA 53 2HB ALA 53 0.490 10.271 15.025
398 3HB ALA 53 3HB ALA 53 -0.798 10.638 13.848
399 H GLU 54 H GLU 54 -2.042 8.154 12.408
400 HA GLU 54 HA GLU 54 -4.785 8.268 13.519
401 1HB GLU 54 2HB GLU 54 -3.564 9.945 11.632
402 2HB GLU 54 3HB GLU 54 -4.440 8.805 10.613
403 1HG GLU 54 2HG GLU 54 -5.750 10.268 12.953
404 2HG GLU 54 3HG GLU 54 -5.626 10.954 11.332
405 H THR 55 H THR 55 -2.827 6.997 10.794
406 HA THR 55 HA THR 55 -4.399 4.520 10.803
407 HB THR 55 HB THR 55 -2.747 4.155 8.634
408 HG1 THR 55 1HG THR 55 -3.233 6.916 8.860
409 1HG2 THR 55 1HG2 THR 55 -5.440 5.564 8.971
410 2HG2 THR 55 2HG2 THR 55 -4.707 5.170 7.398
411 3HG2 THR 55 3HG2 THR 55 -5.085 3.857 8.555
412 H GLY 56 H GLY 56 -2.985 2.731 9.981
413 1HA GLY 56 2HA GLY 56 -0.503 2.173 11.276
414 2HA GLY 56 3HA GLY 56 -1.877 1.373 12.075
415 H THR 57 H THR 57 -2.228 -0.593 11.203
416 HA THR 57 HA THR 57 -1.544 -1.360 8.455
417 HB THR 57 HB THR 57 -2.103 -3.632 9.535
418 HG1 THR 57 1HG THR 57 -2.052 -3.501 11.857
419 1HG2 THR 57 1HG2 THR 57 0.092 -3.665 10.745
420 2HG2 THR 57 2HG2 THR 57 0.229 -2.774 9.219
421 3HG2 THR 57 3HG2 THR 57 0.137 -1.891 10.750
422 H ALA 58 H ALA 58 -4.133 -0.619 10.679
423 HA ALA 58 HA ALA 58 -6.029 -2.289 9.993
424 1HB ALA 58 1HB ALA 58 -7.664 -0.695 10.947
425 2HB ALA 58 2HB ALA 58 -6.176 -0.795 11.907
426 3HB ALA 58 3HB ALA 58 -6.450 0.595 10.837
427 H ALA 59 H ALA 59 -5.802 0.872 8.593
428 HA ALA 59 HA ALA 59 -8.233 0.309 6.943
429 1HB ALA 59 1HB ALA 59 -7.865 2.663 6.084
430 2HB ALA 59 2HB ALA 59 -8.339 2.442 7.778
431 3HB ALA 59 3HB ALA 59 -6.661 2.807 7.399
432 H ILE 60 H ILE 60 -4.808 0.173 6.706
433 HA ILE 60 HA ILE 60 -4.561 0.374 3.853
434 HB ILE 60 HB ILE 60 -2.822 -0.158 6.234
435 1HG1 ILE 60 2HG1 ILE 60 -2.452 1.153 3.558
436 2HG1 ILE 60 3HG1 ILE 60 -3.235 1.964 4.900
437 1HG2 ILE 60 1HG2 ILE 60 -1.971 -1.193 3.498
438 2HG2 ILE 60 2HG2 ILE 60 -0.939 -0.997 4.935
439 3HG2 ILE 60 3HG2 ILE 60 -2.231 -2.184 4.952
440 1HD1 ILE 60 1HD1 ILE 60 -1.185 1.697 6.302
441 2HD1 ILE 60 2HD1 ILE 60 -0.319 1.136 4.856
442 3HD1 ILE 60 3HD1 ILE 60 -0.998 2.774 4.913
443 H GLN 61 H GLN 61 -4.753 -2.366 6.143
444 HA GLN 61 HA GLN 61 -4.463 -4.359 4.088
445 1HB GLN 61 2HB GLN 61 -5.205 -4.295 6.966
446 2HB GLN 61 3HB GLN 61 -6.037 -5.512 5.996
447 1HG GLN 61 2HG GLN 61 -4.169 -6.593 6.887
448 2HG GLN 61 3HG GLN 61 -3.960 -6.436 5.142
449 1HE2 GLN 61 1HE2 GLN 61 -3.321 -3.472 7.058
450 2HE2 GLN 61 2HE2 GLN 61 -1.583 -3.659 6.936
451 H GLU 62 H GLU 62 -7.309 -2.806 5.632
452 HA GLU 62 HA GLU 62 -9.427 -3.974 4.223
453 1HB GLU 62 2HB GLU 62 -8.868 -1.372 5.585
454 2HB GLU 62 3HB GLU 62 -10.191 -1.326 4.426
455 1HG GLU 62 2HG GLU 62 -10.033 -3.479 6.566
456 2HG GLU 62 3HG GLU 62 -10.750 -1.892 6.868
457 H LYS 63 H LYS 63 -7.652 -0.968 3.245
458 HA LYS 63 HA LYS 63 -8.963 -0.782 0.768
459 1HB LYS 63 2HB LYS 63 -6.526 0.393 2.101
460 2HB LYS 63 3HB LYS 63 -6.728 0.636 0.391
461 1HG LYS 63 2HG LYS 63 -8.969 1.142 2.360
462 2HG LYS 63 3HG LYS 63 -7.789 2.397 1.962
463 1HD LYS 63 2HD LYS 63 -8.651 2.813 -0.118
464 2HD LYS 63 3HD LYS 63 -8.936 1.118 -0.462
465 1HE LYS 63 2HE LYS 63 -11.059 2.298 -0.417
466 2HE LYS 63 3HE LYS 63 -10.988 1.087 0.870
467 1HZ LYS 63 1HZ LYS 63 -10.537 3.982 1.219
468 2HZ LYS 63 2HZ LYS 63 -11.898 3.158 1.643
469 3HZ LYS 63 3HZ LYS 63 -10.482 2.855 2.418
470 H ILE 64 H ILE 64 -5.928 -2.466 1.661
471 HA ILE 64 HA ILE 64 -4.870 -3.071 -0.817
472 HB ILE 64 HB ILE 64 -4.786 -4.081 1.925
473 1HG1 ILE 64 2HG1 ILE 64 -3.230 -2.442 0.892
474 2HG1 ILE 64 3HG1 ILE 64 -2.519 -3.817 1.726
475 1HG2 ILE 64 1HG2 ILE 64 -5.187 -6.223 1.170
476 2HG2 ILE 64 2HG2 ILE 64 -4.176 -6.012 -0.283
477 3HG2 ILE 64 3HG2 ILE 64 -3.442 -6.081 1.337
478 1HD1 ILE 64 1HD1 ILE 64 -2.163 -4.972 -0.436
479 2HD1 ILE 64 2HD1 ILE 64 -2.790 -3.549 -1.289
480 3HD1 ILE 64 3HD1 ILE 64 -1.305 -3.423 -0.313
481 H GLU 65 H GLU 65 -7.211 -4.939 1.212
482 HA GLU 65 HA GLU 65 -7.883 -6.948 -0.682
483 1HB GLU 65 2HB GLU 65 -9.274 -5.794 1.761
484 2HB GLU 65 3HB GLU 65 -10.012 -7.073 0.801
485 1HG GLU 65 2HG GLU 65 -7.187 -7.383 1.828
486 2HG GLU 65 3HG GLU 65 -8.576 -7.728 2.861
487 H LYS 66 H LYS 66 -9.646 -3.917 0.164
488 HA LYS 66 HA LYS 66 -11.728 -4.321 -1.661
489 1HB LYS 66 2HB LYS 66 -10.727 -2.064 -0.043
490 2HB LYS 66 3HB LYS 66 -11.459 -1.510 -1.546
491 1HG LYS 66 2HG LYS 66 -12.766 -3.436 0.412
492 2HG LYS 66 3HG LYS 66 -13.075 -1.702 0.358
493 1HD LYS 66 2HD LYS 66 -14.503 -1.874 -1.389
494 2HD LYS 66 3HD LYS 66 -13.338 -2.788 -2.341
495 1HE LYS 66 2HE LYS 66 -14.009 -4.861 -0.948
496 2HE LYS 66 3HE LYS 66 -15.352 -3.884 -0.333
497 1HZ LYS 66 1HZ LYS 66 -14.810 -4.567 -3.154
498 2HZ LYS 66 2HZ LYS 66 -15.993 -5.208 -2.211
499 3HZ LYS 66 3HZ LYS 66 -16.062 -3.622 -2.647
500 H LEU 67 H LEU 67 -8.586 -2.843 -2.268
501 HA LEU 67 HA LEU 67 -9.166 -2.029 -4.982
502 1HB LEU 67 2HB LEU 67 -6.640 -2.388 -3.340
503 2HB LEU 67 3HB LEU 67 -6.585 -1.891 -5.032
504 HG LEU 67 HG LEU 67 -8.407 -0.380 -3.138
505 1HD1 LEU 67 1HD1 LEU 67 -6.454 -0.174 -1.856
506 2HD1 LEU 67 2HD1 LEU 67 -5.401 -0.194 -3.257
507 3HD1 LEU 67 3HD1 LEU 67 -6.401 1.234 -2.912
508 1HD2 LEU 67 1HD2 LEU 67 -8.002 1.442 -4.688
509 2HD2 LEU 67 2HD2 LEU 67 -6.781 0.500 -5.565
510 3HD2 LEU 67 3HD2 LEU 67 -8.485 0.023 -5.620
511 H GLY 68 H GLY 68 -8.570 -5.110 -3.555
512 1HA GLY 68 2HA GLY 68 -8.876 -7.109 -4.644
513 2HA GLY 68 3HA GLY 68 -8.615 -6.348 -6.219
514 H TYR 69 H TYR 69 -6.528 -6.229 -3.253
515 HA TYR 69 HA TYR 69 -4.453 -7.851 -4.663
516 1HB TYR 69 2HB TYR 69 -4.417 -5.027 -4.073
517 2HB TYR 69 3HB TYR 69 -3.275 -5.805 -3.004
518 HD1 TYR 69 HD1 TYR 69 -4.356 -5.686 -6.586
519 HD2 TYR 69 HD2 TYR 69 -1.155 -6.553 -3.833
520 HE1 TYR 69 HE1 TYR 69 -2.748 -5.519 -8.419
521 HE2 TYR 69 HE2 TYR 69 0.466 -6.347 -5.647
522 HH TYR 69 HH TYR 69 0.766 -5.999 -7.942
523 H HIS 70 H HIS 70 -2.654 -8.368 -2.980
524 HA HIS 70 HA HIS 70 -3.666 -8.418 -0.231
525 1HB HIS 70 2HB HIS 70 -4.280 -10.602 -1.329
526 2HB HIS 70 3HB HIS 70 -2.553 -10.917 -1.553
527 HD1 HIS 70 1HD HIS 70 -3.916 -9.401 1.733
528 HD2 HIS 70 2HD HIS 70 -2.809 -13.099 0.066
529 HE1 HIS 70 1HE HIS 70 -3.681 -11.029 3.673
530 H VAL 71 H VAL 71 -2.045 -8.382 1.292
531 HA VAL 71 HA VAL 71 0.633 -7.539 0.338
532 HB VAL 71 HB VAL 71 -0.815 -5.743 1.157
533 1HG1 VAL 71 1HG1 VAL 71 -2.113 -7.098 2.889
534 2HG1 VAL 71 2HG1 VAL 71 -0.657 -7.069 3.897
535 3HG1 VAL 71 3HG1 VAL 71 -1.477 -5.553 3.469
536 1HG2 VAL 71 1HG2 VAL 71 0.702 -4.739 2.750
537 2HG2 VAL 71 2HG2 VAL 71 1.576 -6.272 2.942
538 3HG2 VAL 71 3HG2 VAL 71 1.544 -5.437 1.364
539 H VAL 72 H VAL 72 2.405 -8.198 1.717
540 HA VAL 72 HA VAL 72 1.829 -10.366 3.663
541 HB VAL 72 HB VAL 72 3.961 -10.576 1.594
542 1HG1 VAL 72 1HG1 VAL 72 4.398 -11.857 3.663
543 2HG1 VAL 72 2HG1 VAL 72 2.786 -12.600 3.546
544 3HG1 VAL 72 3HG1 VAL 72 4.028 -12.950 2.330
545 1HG2 VAL 72 1HG2 VAL 72 1.183 -11.823 1.601
546 2HG2 VAL 72 2HG2 VAL 72 1.891 -10.774 0.346
547 3HG2 VAL 72 3HG2 VAL 72 2.530 -12.403 0.605
548 H ILE 73 H ILE 73 3.303 -10.423 5.359
549 HA ILE 73 HA ILE 73 5.387 -8.321 5.446
550 HB ILE 73 HB ILE 73 3.441 -9.112 7.610
551 1HG1 ILE 73 2HG1 ILE 73 3.269 -6.440 7.367
552 2HG1 ILE 73 3HG1 ILE 73 3.786 -6.777 5.726
553 1HG2 ILE 73 1HG2 ILE 73 5.649 -8.674 8.640
554 2HG2 ILE 73 2HG2 ILE 73 5.797 -7.181 7.687
555 3HG2 ILE 73 3HG2 ILE 73 4.541 -7.344 8.939
556 1HD1 ILE 73 1HD1 ILE 73 1.393 -6.674 5.825
557 2HD1 ILE 73 2HD1 ILE 73 1.811 -8.386 5.613
558 3HD1 ILE 73 3HD1 ILE 73 1.351 -7.785 7.221
559 H GLU 74 H GLU 74 6.817 -10.117 4.632
560 HA GLU 74 HA GLU 74 7.482 -12.183 6.425
561 1HB GLU 74 2HB GLU 74 8.511 -11.196 3.786
562 2HB GLU 74 3HB GLU 74 9.543 -12.197 4.797
563 1HG GLU 74 2HG GLU 74 7.896 -13.977 4.893
564 2HG GLU 74 3HG GLU 74 6.766 -13.031 3.904
565 H GLY 75 H GLY 75 7.890 -9.050 6.775
566 1HA GLY 75 2HA GLY 75 10.756 -8.910 7.458
567 2HA GLY 75 3HA GLY 75 9.596 -7.578 7.388
568 H ARG 76 H ARG 76 7.668 -9.073 9.183
569 HA ARG 76 HA ARG 76 8.932 -8.193 11.697
570 1HB ARG 76 2HB ARG 76 6.755 -7.047 10.743
571 2HB ARG 76 3HB ARG 76 5.965 -8.537 11.299
572 1HG ARG 76 2HG ARG 76 7.225 -8.087 13.549
573 2HG ARG 76 3HG ARG 76 7.521 -6.470 12.902
574 1HD ARG 76 2HD ARG 76 4.992 -6.184 12.703
575 2HD ARG 76 3HD ARG 76 4.817 -7.821 13.325
576 HE ARG 76 HE ARG 76 5.296 -7.186 15.453
577 1HH1 ARG 76 2HH2 ARG 76 6.107 -4.532 13.296
578 2HH1 ARG 76 1HH2 ARG 76 6.447 -3.377 14.549
579 1HH2 ARG 76 2HH1 ARG 76 5.830 -5.726 17.164
580 2HH2 ARG 76 1HH1 ARG 76 6.305 -4.097 16.815
Start of MODEL 7
1 1H MET 1 H1 MET 1 -4.595 17.614 16.010
2 2H MET 1 H2 MET 1 -5.226 18.618 17.163
3 3H MET 1 H3 MET 1 -4.472 19.245 15.832
4 HA MET 1 HA MET 1 -3.064 19.440 17.714
5 1HB MET 1 2HB MET 1 -3.429 16.420 17.810
6 2HB MET 1 3HB MET 1 -2.027 17.237 18.523
7 1HG MET 1 2HG MET 1 -3.458 18.596 19.946
8 2HG MET 1 3HG MET 1 -4.909 17.826 19.281
9 1HE MET 1 1HE MET 1 -5.656 17.425 21.810
10 2HE MET 1 2HE MET 1 -4.671 16.521 22.982
11 3HE MET 1 3HE MET 1 -4.125 18.113 22.410
12 H LEU 2 H LEU 2 -1.935 16.392 16.202
13 HA LEU 2 HA LEU 2 -0.700 17.780 13.983
14 1HB LEU 2 2HB LEU 2 1.540 17.297 14.512
15 2HB LEU 2 3HB LEU 2 0.909 18.133 15.926
16 HG LEU 2 HG LEU 2 1.337 15.105 15.668
17 1HD1 LEU 2 1HD1 LEU 2 3.427 16.406 15.687
18 2HD1 LEU 2 2HD1 LEU 2 2.922 17.194 17.200
19 3HD1 LEU 2 3HD1 LEU 2 3.226 15.443 17.158
20 1HD2 LEU 2 1HD2 LEU 2 1.072 15.135 18.173
21 2HD2 LEU 2 2HD2 LEU 2 0.478 16.804 18.054
22 3HD2 LEU 2 3HD2 LEU 2 -0.427 15.460 17.311
23 H SER 3 H SER 3 0.467 16.101 12.626
24 HA SER 3 HA SER 3 -0.338 13.299 13.167
25 1HB SER 3 2HB SER 3 -0.252 14.402 10.318
26 2HB SER 3 3HB SER 3 -0.884 12.884 10.901
27 HG SER 3 HG SER 3 -1.945 15.446 11.540
28 H GLU 4 H GLU 4 1.641 12.298 13.525
29 HA GLU 4 HA GLU 4 4.106 13.277 12.258
30 1HB GLU 4 2HB GLU 4 3.384 11.201 14.240
31 2HB GLU 4 3HB GLU 4 4.672 10.765 13.137
32 1HG GLU 4 2HG GLU 4 5.689 13.014 13.763
33 2HG GLU 4 3HG GLU 4 4.563 12.968 15.123
34 H GLN 5 H GLN 5 5.264 11.389 10.965
35 HA GLN 5 HA GLN 5 3.335 9.883 9.276
36 1HB GLN 5 2HB GLN 5 5.704 11.497 8.277
37 2HB GLN 5 3HB GLN 5 4.808 10.262 7.378
38 1HG GLN 5 2HG GLN 5 2.813 12.048 8.274
39 2HG GLN 5 3HG GLN 5 4.153 13.083 7.794
40 1HE2 GLN 5 1HE2 GLN 5 2.203 10.338 6.698
41 2HE2 GLN 5 2HE2 GLN 5 2.364 10.595 4.996
42 H LYS 6 H LYS 6 4.159 7.897 8.545
43 HA LYS 6 HA LYS 6 6.940 7.291 8.996
44 1HB LYS 6 2HB LYS 6 4.684 5.602 10.176
45 2HB LYS 6 3HB LYS 6 6.292 4.947 9.895
46 1HG LYS 6 2HG LYS 6 5.717 7.291 11.743
47 2HG LYS 6 3HG LYS 6 5.964 5.611 12.242
48 1HD LYS 6 2HD LYS 6 8.246 5.641 11.214
49 2HD LYS 6 3HD LYS 6 8.010 7.329 10.749
50 1HE LYS 6 2HE LYS 6 7.598 7.903 13.178
51 2HE LYS 6 3HE LYS 6 8.180 6.273 13.580
52 1HZ LYS 6 1HZ LYS 6 10.235 6.853 12.414
53 2HZ LYS 6 2HZ LYS 6 9.642 8.352 12.082
54 3HZ LYS 6 3HZ LYS 6 9.930 7.919 13.643
55 H GLU 7 H GLU 7 7.688 5.545 7.975
56 HA GLU 7 HA GLU 7 6.487 5.173 5.316
57 1HB GLU 7 2HB GLU 7 9.421 4.857 5.946
58 2HB GLU 7 3HB GLU 7 8.571 5.369 4.489
59 1HG GLU 7 2HG GLU 7 9.652 7.289 5.271
60 2HG GLU 7 3HG GLU 7 8.011 7.537 5.876
61 H ILE 8 H ILE 8 5.388 3.171 5.670
62 HA ILE 8 HA ILE 8 6.767 1.053 7.131
63 HB ILE 8 HB ILE 8 4.220 0.911 5.627
64 1HG1 ILE 8 2HG1 ILE 8 3.750 2.815 6.933
65 2HG1 ILE 8 3HG1 ILE 8 2.928 1.395 7.589
66 1HG2 ILE 8 1HG2 ILE 8 5.431 -0.552 7.926
67 2HG2 ILE 8 2HG2 ILE 8 3.716 -0.746 7.462
68 3HG2 ILE 8 3HG2 ILE 8 4.999 -1.181 6.317
69 1HD1 ILE 8 1HD1 ILE 8 3.935 2.729 9.364
70 2HD1 ILE 8 2HD1 ILE 8 4.650 1.097 9.250
71 3HD1 ILE 8 3HD1 ILE 8 5.535 2.500 8.598
72 H ALA 9 H ALA 9 7.112 -1.045 6.038
73 HA ALA 9 HA ALA 9 7.345 -0.988 3.102
74 1HB ALA 9 1HB ALA 9 9.484 -2.173 3.214
75 2HB ALA 9 2HB ALA 9 9.644 -0.603 4.029
76 3HB ALA 9 3HB ALA 9 9.478 -2.085 4.989
77 H MET 10 H MET 10 6.559 -2.964 2.251
78 HA MET 10 HA MET 10 6.686 -5.371 3.822
79 1HB MET 10 2HB MET 10 4.391 -5.968 3.892
80 2HB MET 10 3HB MET 10 4.646 -4.527 4.856
81 1HG MET 10 2HG MET 10 3.557 -4.475 2.020
82 2HG MET 10 3HG MET 10 2.531 -4.696 3.420
83 1HE MET 10 1HE MET 10 2.351 -1.363 5.209
84 2HE MET 10 2HE MET 10 1.611 -2.959 4.952
85 3HE MET 10 3HE MET 10 3.241 -2.839 5.658
86 H GLN 11 H GLN 11 5.373 -7.171 2.468
87 HA GLN 11 HA GLN 11 6.507 -6.954 -0.276
88 1HB GLN 11 2HB GLN 11 5.803 -9.243 1.616
89 2HB GLN 11 3HB GLN 11 6.127 -9.526 -0.093
90 1HG GLN 11 2HG GLN 11 8.035 -8.249 1.932
91 2HG GLN 11 3HG GLN 11 8.129 -9.907 1.314
92 1HE2 GLN 11 1HE2 GLN 11 8.031 -10.031 -1.213
93 2HE2 GLN 11 2HE2 GLN 11 8.744 -8.692 -2.105
94 H VAL 12 H VAL 12 5.238 -8.168 -1.984
95 HA VAL 12 HA VAL 12 2.327 -7.536 -1.753
96 HB VAL 12 HB VAL 12 4.130 -6.971 -4.135
97 1HG1 VAL 12 1HG1 VAL 12 1.219 -6.264 -3.538
98 2HG1 VAL 12 2HG1 VAL 12 2.143 -5.718 -4.951
99 3HG1 VAL 12 3HG1 VAL 12 1.781 -7.436 -4.749
100 1HG2 VAL 12 1HG2 VAL 12 3.712 -4.565 -3.592
101 2HG2 VAL 12 2HG2 VAL 12 2.976 -5.068 -2.058
102 3HG2 VAL 12 3HG2 VAL 12 4.704 -5.378 -2.379
103 H SER 13 H SER 13 1.005 -9.149 -2.451
104 HA SER 13 HA SER 13 2.056 -11.238 -4.308
105 1HB SER 13 2HB SER 13 0.151 -11.483 -1.942
106 2HB SER 13 3HB SER 13 0.262 -12.703 -3.223
107 HG SER 13 HG SER 13 1.670 -13.148 -1.457
108 H GLY 14 H GLY 14 0.028 -12.272 -5.439
109 1HA GLY 14 2HA GLY 14 -1.952 -12.052 -6.606
110 2HA GLY 14 3HA GLY 14 -2.228 -10.455 -5.901
111 H MET 15 H MET 15 0.091 -9.115 -6.598
112 HA MET 15 HA MET 15 -0.252 -8.134 -9.105
113 1HB MET 15 2HB MET 15 2.010 -7.241 -8.992
114 2HB MET 15 3HB MET 15 1.253 -7.192 -7.409
115 1HG MET 15 2HG MET 15 3.322 -7.935 -6.837
116 2HG MET 15 3HG MET 15 2.502 -9.486 -7.009
117 1HE MET 15 1HE MET 15 4.857 -10.685 -7.051
118 2HE MET 15 2HE MET 15 6.201 -10.169 -8.098
119 3HE MET 15 3HE MET 15 5.603 -9.087 -6.817
120 H THR 16 H THR 16 0.383 -8.470 -11.147
121 HA THR 16 HA THR 16 2.373 -10.497 -11.855
122 HB THR 16 HB THR 16 0.622 -11.221 -13.752
123 HG1 THR 16 1HG THR 16 -1.001 -10.835 -11.454
124 1HG2 THR 16 1HG2 THR 16 0.110 -13.236 -12.484
125 2HG2 THR 16 2HG2 THR 16 1.807 -12.780 -12.259
126 3HG2 THR 16 3HG2 THR 16 0.624 -12.474 -10.971
127 H CYS 17 H CYS 17 0.007 -8.020 -13.084
128 HA CYS 17 HA CYS 17 1.558 -7.572 -15.473
129 1HB CYS 17 2HB CYS 17 0.102 -5.574 -15.699
130 2HB CYS 17 3HB CYS 17 -0.812 -7.071 -15.426
131 H ALA 18 H ALA 18 2.049 -6.584 -12.221
132 HA ALA 18 HA ALA 18 3.478 -5.182 -11.187
133 1HB ALA 18 1HB ALA 18 5.042 -5.206 -13.799
134 2HB ALA 18 2HB ALA 18 5.657 -4.810 -12.186
135 3HB ALA 18 3HB ALA 18 5.118 -6.460 -12.545
136 H ALA 19 H ALA 19 1.205 -4.051 -12.701
137 HA ALA 19 HA ALA 19 2.115 -1.193 -12.817
138 1HB ALA 19 1HB ALA 19 0.123 -2.594 -14.648
139 2HB ALA 19 2HB ALA 19 0.509 -0.856 -14.645
140 3HB ALA 19 3HB ALA 19 1.755 -2.042 -15.084
141 H CYS 20 H CYS 20 -0.824 -3.263 -12.583
142 HA CYS 20 HA CYS 20 -2.515 -1.571 -11.186
143 1HB CYS 20 2HB CYS 20 -2.121 -4.587 -11.220
144 2HB CYS 20 3HB CYS 20 -3.390 -3.868 -10.261
145 H ALA 21 H ALA 21 0.260 -3.365 -9.894
146 HA ALA 21 HA ALA 21 -0.221 -3.026 -7.149
147 1HB ALA 21 1HB ALA 21 2.480 -2.829 -8.527
148 2HB ALA 21 2HB ALA 21 2.125 -3.384 -6.870
149 3HB ALA 21 3HB ALA 21 1.613 -4.360 -8.245
150 H ALA 22 H ALA 22 0.602 -0.562 -9.568
151 HA ALA 22 HA ALA 22 1.248 1.501 -7.594
152 1HB ALA 22 1HB ALA 22 2.020 1.519 -10.010
153 2HB ALA 22 2HB ALA 22 0.335 1.862 -10.469
154 3HB ALA 22 3HB ALA 22 1.226 3.004 -9.445
155 H ARG 23 H ARG 23 -1.656 0.356 -9.349
156 HA ARG 23 HA ARG 23 -3.328 2.582 -8.733
157 1HB ARG 23 2HB ARG 23 -4.051 -0.346 -9.231
158 2HB ARG 23 3HB ARG 23 -5.211 0.954 -8.967
159 1HG ARG 23 2HG ARG 23 -4.329 2.198 -10.880
160 2HG ARG 23 3HG ARG 23 -3.177 0.894 -11.232
161 1HD ARG 23 2HD ARG 23 -4.833 -0.487 -12.129
162 2HD ARG 23 3HD ARG 23 -5.990 -0.031 -10.900
163 HE ARG 23 HE ARG 23 -6.926 1.511 -12.220
164 1HH1 ARG 23 2HH2 ARG 23 -3.756 0.777 -13.522
165 2HH1 ARG 23 1HH2 ARG 23 -3.881 1.807 -14.918
166 1HH2 ARG 23 2HH1 ARG 23 -7.161 2.927 -14.032
167 2HH2 ARG 23 1HH1 ARG 23 -5.894 3.068 -15.206
168 H ILE 24 H ILE 24 -2.659 -0.475 -6.942
169 HA ILE 24 HA ILE 24 -4.548 0.127 -4.941
170 HB ILE 24 HB ILE 24 -3.748 -1.536 -3.588
171 1HG1 ILE 24 2HG1 ILE 24 -1.177 -1.243 -5.046
172 2HG1 ILE 24 3HG1 ILE 24 -1.518 -1.108 -3.309
173 1HG2 ILE 24 1HG2 ILE 24 -3.931 -3.351 -5.036
174 2HG2 ILE 24 2HG2 ILE 24 -4.749 -2.065 -5.918
175 3HG2 ILE 24 3HG2 ILE 24 -3.101 -2.539 -6.383
176 1HD1 ILE 24 1HD1 ILE 24 -2.012 -3.594 -3.317
177 2HD1 ILE 24 2HD1 ILE 24 -1.398 -3.609 -4.994
178 3HD1 ILE 24 3HD1 ILE 24 -0.323 -3.156 -3.664
179 H GLU 25 H GLU 25 -0.998 0.719 -4.722
180 HA GLU 25 HA GLU 25 -1.047 2.234 -2.378
181 1HB GLU 25 2HB GLU 25 0.780 2.040 -4.750
182 2HB GLU 25 3HB GLU 25 0.970 3.463 -3.711
183 1HG GLU 25 2HG GLU 25 2.427 1.587 -3.002
184 2HG GLU 25 3HG GLU 25 1.304 2.087 -1.737
185 H LYS 26 H LYS 26 -1.794 3.360 -5.672
186 HA LYS 26 HA LYS 26 -1.717 6.168 -4.841
187 1HB LYS 26 2HB LYS 26 -2.446 4.770 -7.412
188 2HB LYS 26 3HB LYS 26 -2.969 6.429 -7.117
189 1HG LYS 26 2HG LYS 26 -0.911 6.576 -8.291
190 2HG LYS 26 3HG LYS 26 -0.619 7.120 -6.630
191 1HD LYS 26 2HD LYS 26 0.443 5.002 -6.082
192 2HD LYS 26 3HD LYS 26 0.069 4.397 -7.712
193 1HE LYS 26 2HE LYS 26 1.514 5.915 -8.798
194 2HE LYS 26 3HE LYS 26 1.685 6.938 -7.362
195 1HZ LYS 26 1HZ LYS 26 3.608 5.556 -7.775
196 2HZ LYS 26 2HZ LYS 26 2.936 5.258 -6.304
197 3HZ LYS 26 3HZ LYS 26 2.715 4.192 -7.551
198 H GLY 27 H GLY 27 -4.325 3.790 -5.509
199 1HA GLY 27 2HA GLY 27 -6.541 5.461 -4.824
200 2HA GLY 27 3HA GLY 27 -6.473 3.689 -4.725
201 H LEU 28 H LEU 28 -4.385 3.335 -2.923
202 HA LEU 28 HA LEU 28 -5.745 3.606 -0.441
203 1HB LEU 28 2HB LEU 28 -4.294 1.774 -0.941
204 2HB LEU 28 3HB LEU 28 -2.895 2.829 -1.132
205 HG LEU 28 HG LEU 28 -3.158 1.394 0.979
206 1HD1 LEU 28 1HD1 LEU 28 -2.437 4.335 1.049
207 2HD1 LEU 28 2HD1 LEU 28 -2.070 3.218 2.357
208 3HD1 LEU 28 3HD1 LEU 28 -1.379 2.954 0.746
209 1HD2 LEU 28 1HD2 LEU 28 -4.373 2.355 2.853
210 2HD2 LEU 28 2HD2 LEU 28 -4.977 3.670 1.878
211 3HD2 LEU 28 3HD2 LEU 28 -5.486 2.007 1.522
212 H LYS 29 H LYS 29 -2.990 5.468 -1.877
213 HA LYS 29 HA LYS 29 -2.589 7.239 0.232
214 1HB LYS 29 2HB LYS 29 -1.254 7.159 -1.889
215 2HB LYS 29 3HB LYS 29 -2.574 8.019 -2.693
216 1HG LYS 29 2HG LYS 29 -2.040 9.535 -0.329
217 2HG LYS 29 3HG LYS 29 -0.490 8.990 -0.850
218 1HD LYS 29 2HD LYS 29 -2.432 10.290 -2.823
219 2HD LYS 29 3HD LYS 29 -1.509 11.265 -1.668
220 1HE LYS 29 2HE LYS 29 0.593 10.297 -2.455
221 2HE LYS 29 3HE LYS 29 -0.231 9.347 -3.690
222 1HZ LYS 29 1HZ LYS 29 0.848 11.419 -4.359
223 2HZ LYS 29 2HZ LYS 29 -0.775 11.459 -4.715
224 3HZ LYS 29 3HZ LYS 29 -0.162 12.292 -3.417
225 H ARG 30 H ARG 30 -5.367 7.034 -1.923
226 HA ARG 30 HA ARG 30 -6.189 9.733 -1.396
227 1HB ARG 30 2HB ARG 30 -6.693 7.885 -3.372
228 2HB ARG 30 3HB ARG 30 -8.167 7.727 -2.430
229 1HG ARG 30 2HG ARG 30 -7.494 10.559 -2.803
230 2HG ARG 30 3HG ARG 30 -7.357 9.740 -4.343
231 1HD ARG 30 2HD ARG 30 -9.607 9.181 -4.434
232 2HD ARG 30 3HD ARG 30 -9.840 9.199 -2.688
233 HE ARG 30 HE ARG 30 -10.057 11.437 -4.506
234 1HH1 ARG 30 2HH2 ARG 30 -9.231 10.541 -1.119
235 2HH1 ARG 30 1HH2 ARG 30 -9.629 12.100 -0.496
236 1HH2 ARG 30 2HH1 ARG 30 -10.474 13.530 -3.648
237 2HH2 ARG 30 1HH1 ARG 30 -10.312 13.846 -1.953
238 H MET 31 H MET 31 -6.143 7.208 0.707
239 HA MET 31 HA MET 31 -8.758 7.547 1.978
240 1HB MET 31 2HB MET 31 -6.277 5.910 2.688
241 2HB MET 31 3HB MET 31 -7.816 5.756 3.497
242 1HG MET 31 2HG MET 31 -7.315 5.172 0.551
243 2HG MET 31 3HG MET 31 -7.455 3.994 1.836
244 1HE MET 31 1HE MET 31 -10.064 5.146 3.518
245 2HE MET 31 2HE MET 31 -11.264 4.137 2.708
246 3HE MET 31 3HE MET 31 -9.669 3.466 3.133
247 HA PRO 32 HA PRO 32 -7.354 10.503 5.008
248 1HB PRO 32 2HB PRO 32 -8.607 9.703 7.324
249 2HB PRO 32 3HB PRO 32 -9.471 10.466 5.957
250 1HG PRO 32 2HG PRO 32 -9.189 7.507 6.536
251 2HG PRO 32 3HG PRO 32 -10.694 8.409 6.190
252 1HD PRO 32 2HD PRO 32 -9.406 7.061 4.261
253 2HD PRO 32 3HD PRO 32 -10.099 8.659 3.881
254 H GLY 33 H GLY 33 -5.542 10.661 6.289
255 1HA GLY 33 2HA GLY 33 -4.021 9.946 7.933
256 2HA GLY 33 3HA GLY 33 -4.471 8.255 7.666
257 H VAL 34 H VAL 34 -4.253 8.610 4.597
258 HA VAL 34 HA VAL 34 -1.321 8.152 4.631
259 HB VAL 34 HB VAL 34 -3.267 7.582 2.397
260 1HG1 VAL 34 1HG1 VAL 34 -0.911 7.776 1.697
261 2HG1 VAL 34 2HG1 VAL 34 -0.376 6.773 3.045
262 3HG1 VAL 34 3HG1 VAL 34 -1.317 6.059 1.740
263 1HG2 VAL 34 1HG2 VAL 34 -2.275 5.739 4.615
264 2HG2 VAL 34 2HG2 VAL 34 -3.952 6.246 4.335
265 3HG2 VAL 34 3HG2 VAL 34 -3.144 5.221 3.158
266 H THR 35 H THR 35 0.102 9.419 3.484
267 HA THR 35 HA THR 35 -1.054 11.778 2.055
268 HB THR 35 HB THR 35 0.822 11.655 4.296
269 HG1 THR 35 1HG THR 35 -0.851 13.633 3.180
270 1HG2 THR 35 1HG2 THR 35 1.356 13.546 1.970
271 2HG2 THR 35 2HG2 THR 35 1.980 13.724 3.627
272 3HG2 THR 35 3HG2 THR 35 2.474 12.333 2.655
273 H ASP 36 H ASP 36 1.703 9.367 2.062
274 HA ASP 36 HA ASP 36 1.540 9.620 -0.795
275 1HB ASP 36 2HB ASP 36 3.814 10.826 0.564
276 2HB ASP 36 3HB ASP 36 4.318 9.514 -0.507
277 H ALA 37 H ALA 37 2.765 7.995 -1.927
278 HA ALA 37 HA ALA 37 3.198 5.523 -0.481
279 1HB ALA 37 1HB ALA 37 0.689 5.668 -0.490
280 2HB ALA 37 2HB ALA 37 0.736 5.690 -2.267
281 3HB ALA 37 3HB ALA 37 1.313 4.267 -1.371
282 H ASN 38 H ASN 38 4.313 3.934 -1.692
283 HA ASN 38 HA ASN 38 5.064 4.679 -4.461
284 1HB ASN 38 2HB ASN 38 7.532 4.365 -3.123
285 2HB ASN 38 3HB ASN 38 6.870 5.804 -3.869
286 1HD2 ASN 38 1HD2 ASN 38 6.166 4.102 -0.747
287 2HD2 ASN 38 2HD2 ASN 38 6.486 5.535 0.232
288 H VAL 39 H VAL 39 4.485 2.713 -5.247
289 HA VAL 39 HA VAL 39 5.134 0.303 -3.788
290 HB VAL 39 HB VAL 39 3.100 0.487 -5.003
291 1HG1 VAL 39 1HG1 VAL 39 4.725 0.664 -7.589
292 2HG1 VAL 39 2HG1 VAL 39 3.040 0.257 -7.470
293 3HG1 VAL 39 3HG1 VAL 39 3.587 1.858 -6.934
294 1HG2 VAL 39 1HG2 VAL 39 3.094 -1.666 -5.945
295 2HG2 VAL 39 2HG2 VAL 39 4.826 -1.585 -6.330
296 3HG2 VAL 39 3HG2 VAL 39 4.280 -1.707 -4.636
297 H ASN 40 H ASN 40 7.235 -0.420 -3.646
298 HA ASN 40 HA ASN 40 9.162 0.189 -5.803
299 1HB ASN 40 2HB ASN 40 9.761 0.553 -3.435
300 2HB ASN 40 3HB ASN 40 9.529 -1.173 -3.114
301 1HD2 ASN 40 1HD2 ASN 40 11.887 -0.795 -2.375
302 2HD2 ASN 40 2HD2 ASN 40 13.115 -1.022 -3.606
303 H LEU 41 H LEU 41 7.364 -1.251 -6.954
304 HA LEU 41 HA LEU 41 7.841 -4.136 -6.788
305 1HB LEU 41 2HB LEU 41 5.957 -2.346 -8.108
306 2HB LEU 41 3HB LEU 41 6.624 -3.447 -9.284
307 HG LEU 41 HG LEU 41 4.514 -4.189 -8.150
308 1HD1 LEU 41 1HD1 LEU 41 6.935 -6.029 -7.996
309 2HD1 LEU 41 2HD1 LEU 41 5.241 -6.547 -7.921
310 3HD1 LEU 41 3HD1 LEU 41 5.865 -5.773 -9.391
311 1HD2 LEU 41 1HD2 LEU 41 5.501 -3.565 -5.734
312 2HD2 LEU 41 2HD2 LEU 41 4.370 -4.909 -5.968
313 3HD2 LEU 41 3HD2 LEU 41 6.102 -5.219 -5.804
314 H ALA 42 H ALA 42 9.386 -1.485 -8.283
315 HA ALA 42 HA ALA 42 10.833 -2.570 -10.389
316 1HB ALA 42 1HB ALA 42 12.647 -1.065 -9.710
317 2HB ALA 42 2HB ALA 42 11.077 -0.244 -9.563
318 3HB ALA 42 3HB ALA 42 11.910 -0.857 -8.112
319 H THR 43 H THR 43 11.220 -3.212 -6.882
320 HA THR 43 HA THR 43 13.040 -5.443 -7.644
321 HB THR 43 HB THR 43 14.059 -4.019 -6.035
322 HG1 THR 43 1HG THR 43 14.340 -6.336 -6.071
323 1HG2 THR 43 1HG2 THR 43 11.995 -3.286 -4.760
324 2HG2 THR 43 2HG2 THR 43 12.021 -4.873 -3.948
325 3HG2 THR 43 3HG2 THR 43 13.386 -3.771 -3.778
326 H GLU 44 H GLU 44 10.426 -4.901 -5.266
327 HA GLU 44 HA GLU 44 8.398 -6.490 -6.004
328 1HB GLU 44 2HB GLU 44 10.680 -8.294 -5.371
329 2HB GLU 44 3HB GLU 44 9.232 -8.691 -4.504
330 1HG GLU 44 2HG GLU 44 7.880 -8.784 -6.505
331 2HG GLU 44 3HG GLU 44 9.294 -8.466 -7.516
332 H THR 45 H THR 45 8.790 -4.286 -4.338
333 HA THR 45 HA THR 45 7.789 -5.214 -1.692
334 HB THR 45 HB THR 45 10.148 -3.398 -2.374
335 HG1 THR 45 1HG THR 45 9.922 -5.939 -1.129
336 1HG2 THR 45 1HG2 THR 45 10.522 -3.250 0.060
337 2HG2 THR 45 2HG2 THR 45 9.053 -2.420 -0.472
338 3HG2 THR 45 3HG2 THR 45 8.938 -4.010 0.337
339 H VAL 46 H VAL 46 6.728 -3.383 -0.500
340 HA VAL 46 HA VAL 46 5.941 -1.089 -2.255
341 HB VAL 46 HB VAL 46 4.014 -2.463 -2.238
342 1HG1 VAL 46 1HG1 VAL 46 2.952 -3.246 -0.094
343 2HG1 VAL 46 2HG1 VAL 46 4.476 -4.053 -0.461
344 3HG1 VAL 46 3HG1 VAL 46 4.437 -2.760 0.752
345 1HG2 VAL 46 1HG2 VAL 46 3.586 -0.077 -1.753
346 2HG2 VAL 46 2HG2 VAL 46 2.386 -1.164 -1.012
347 3HG2 VAL 46 3HG2 VAL 46 3.619 -0.417 -0.004
348 H ASN 47 H ASN 47 5.834 0.977 -1.198
349 HA ASN 47 HA ASN 47 6.410 0.949 1.689
350 1HB ASN 47 2HB ASN 47 7.790 2.546 -0.509
351 2HB ASN 47 3HB ASN 47 7.607 3.220 1.113
352 1HD2 ASN 47 1HD2 ASN 47 8.284 1.656 2.972
353 2HD2 ASN 47 2HD2 ASN 47 9.919 1.070 2.716
354 H VAL 48 H VAL 48 5.261 2.655 2.825
355 HA VAL 48 HA VAL 48 3.409 4.248 1.209
356 HB VAL 48 HB VAL 48 2.193 2.185 1.509
357 1HG1 VAL 48 1HG1 VAL 48 1.527 1.345 3.708
358 2HG1 VAL 48 2HG1 VAL 48 3.275 1.244 3.476
359 3HG1 VAL 48 3HG1 VAL 48 2.588 2.518 4.507
360 1HG2 VAL 48 1HG2 VAL 48 0.885 4.166 1.463
361 2HG2 VAL 48 2HG2 VAL 48 0.222 3.130 2.738
362 3HG2 VAL 48 3HG2 VAL 48 1.213 4.542 3.158
363 H ILE 49 H ILE 49 3.254 6.218 2.035
364 HA ILE 49 HA ILE 49 4.743 6.767 4.499
365 HB ILE 49 HB ILE 49 4.037 8.711 2.247
366 1HG1 ILE 49 2HG1 ILE 49 5.379 7.042 1.189
367 2HG1 ILE 49 3HG1 ILE 49 6.350 8.485 1.463
368 1HG2 ILE 49 1HG2 ILE 49 5.982 8.873 4.584
369 2HG2 ILE 49 2HG2 ILE 49 5.935 10.012 3.221
370 3HG2 ILE 49 3HG2 ILE 49 4.544 9.850 4.292
371 1HD1 ILE 49 1HD1 ILE 49 7.250 7.419 3.564
372 2HD1 ILE 49 2HD1 ILE 49 6.408 5.929 3.111
373 3HD1 ILE 49 3HD1 ILE 49 7.693 6.564 2.063
374 H TYR 50 H TYR 50 3.103 6.571 6.046
375 HA TYR 50 HA TYR 50 0.690 8.284 5.685
376 1HB TYR 50 2HB TYR 50 -0.783 6.623 6.443
377 2HB TYR 50 3HB TYR 50 0.067 6.014 5.059
378 HD1 TYR 50 HD1 TYR 50 0.603 3.752 5.138
379 HD2 TYR 50 HD2 TYR 50 0.222 5.882 8.857
380 HE1 TYR 50 HE1 TYR 50 0.663 1.629 6.370
381 HE2 TYR 50 HE2 TYR 50 0.505 3.791 10.093
382 HH TYR 50 HH TYR 50 0.877 0.668 8.487
383 H ASP 51 H ASP 51 -0.477 8.636 7.535
384 HA ASP 51 HA ASP 51 1.300 9.368 9.687
385 1HB ASP 51 2HB ASP 51 -1.604 10.086 9.286
386 2HB ASP 51 3HB ASP 51 -0.431 10.780 10.429
387 HA PRO 52 HA PRO 52 -0.168 5.673 11.784
388 1HB PRO 52 2HB PRO 52 1.627 5.477 13.804
389 2HB PRO 52 3HB PRO 52 2.070 5.216 12.093
390 1HG PRO 52 2HG PRO 52 2.341 7.796 13.673
391 2HG PRO 52 3HG PRO 52 3.621 6.941 12.763
392 1HD PRO 52 2HD PRO 52 2.218 8.968 11.663
393 2HD PRO 52 3HD PRO 52 2.647 7.535 10.680
394 H ALA 53 H ALA 53 -1.051 8.679 12.512
395 HA ALA 53 HA ALA 53 -2.096 8.220 15.236
396 1HB ALA 53 1HB ALA 53 -2.330 10.541 13.265
397 2HB ALA 53 2HB ALA 53 -3.054 10.478 14.883
398 3HB ALA 53 3HB ALA 53 -1.285 10.486 14.704
399 H GLU 54 H GLU 54 -2.844 8.190 11.745
400 HA GLU 54 HA GLU 54 -5.721 7.815 12.371
401 1HB GLU 54 2HB GLU 54 -4.292 9.526 10.460
402 2HB GLU 54 3HB GLU 54 -5.392 8.403 9.640
403 1HG GLU 54 2HG GLU 54 -6.640 10.347 10.027
404 2HG GLU 54 3HG GLU 54 -7.253 9.114 11.135
405 H THR 55 H THR 55 -3.105 6.810 10.113
406 HA THR 55 HA THR 55 -4.367 4.157 9.925
407 HB THR 55 HB THR 55 -2.434 3.831 8.091
408 HG1 THR 55 1HG THR 55 -3.205 6.476 7.817
409 1HG2 THR 55 1HG2 THR 55 -4.172 4.473 6.473
410 2HG2 THR 55 2HG2 THR 55 -4.803 3.526 7.847
411 3HG2 THR 55 3HG2 THR 55 -5.105 5.285 7.763
412 H GLY 56 H GLY 56 -2.205 2.606 9.597
413 1HA GLY 56 2HA GLY 56 -0.589 1.830 11.520
414 2HA GLY 56 3HA GLY 56 -2.019 2.232 12.499
415 H THR 57 H THR 57 -0.944 0.547 9.890
416 HA THR 57 HA THR 57 -1.616 -0.381 8.114
417 HB THR 57 HB THR 57 -1.366 -2.915 8.451
418 HG1 THR 57 1HG THR 57 -2.178 -3.013 10.584
419 1HG2 THR 57 1HG2 THR 57 0.738 -1.176 9.799
420 2HG2 THR 57 2HG2 THR 57 0.958 -2.802 9.141
421 3HG2 THR 57 3HG2 THR 57 0.602 -1.461 8.039
422 H ALA 58 H ALA 58 -3.936 -1.021 10.601
423 HA ALA 58 HA ALA 58 -5.998 -2.414 9.695
424 1HB ALA 58 1HB ALA 58 -7.379 -0.516 10.641
425 2HB ALA 58 2HB ALA 58 -5.964 -0.918 11.651
426 3HB ALA 58 3HB ALA 58 -5.904 0.493 10.593
427 H ALA 59 H ALA 59 -5.350 0.887 8.400
428 HA ALA 59 HA ALA 59 -7.832 0.560 6.812
429 1HB ALA 59 1HB ALA 59 -6.983 2.843 7.660
430 2HB ALA 59 2HB ALA 59 -5.917 2.786 6.209
431 3HB ALA 59 3HB ALA 59 -7.658 2.723 6.027
432 H ILE 60 H ILE 60 -4.381 0.564 6.263
433 HA ILE 60 HA ILE 60 -4.294 0.226 3.469
434 HB ILE 60 HB ILE 60 -2.455 -0.344 5.813
435 1HG1 ILE 60 2HG1 ILE 60 -0.957 1.073 4.308
436 2HG1 ILE 60 3HG1 ILE 60 -2.340 1.194 3.212
437 1HG2 ILE 60 1HG2 ILE 60 -2.052 -2.329 4.396
438 2HG2 ILE 60 2HG2 ILE 60 -1.779 -1.258 3.000
439 3HG2 ILE 60 3HG2 ILE 60 -0.702 -1.201 4.420
440 1HD1 ILE 60 1HD1 ILE 60 -2.240 2.098 6.157
441 2HD1 ILE 60 2HD1 ILE 60 -1.954 3.176 4.783
442 3HD1 ILE 60 3HD1 ILE 60 -3.555 2.465 5.012
443 H GLN 61 H GLN 61 -4.492 -2.279 6.059
444 HA GLN 61 HA GLN 61 -4.422 -4.407 4.120
445 1HB GLN 61 2HB GLN 61 -4.688 -4.199 7.026
446 2HB GLN 61 3HB GLN 61 -5.829 -5.348 6.329
447 1HG GLN 61 2HG GLN 61 -4.034 -6.689 6.800
448 2HG GLN 61 3HG GLN 61 -3.912 -6.428 5.062
449 1HE2 GLN 61 1HE2 GLN 61 -2.872 -3.493 6.193
450 2HE2 GLN 61 2HE2 GLN 61 -1.176 -3.884 6.414
451 H GLU 62 H GLU 62 -7.102 -2.731 5.849
452 HA GLU 62 HA GLU 62 -9.241 -4.197 4.832
453 1HB GLU 62 2HB GLU 62 -8.936 -1.804 6.342
454 2HB GLU 62 3HB GLU 62 -9.847 -1.304 4.924
455 1HG GLU 62 2HG GLU 62 -10.565 -3.587 6.804
456 2HG GLU 62 3HG GLU 62 -11.338 -1.997 6.746
457 H LYS 63 H LYS 63 -7.735 -1.240 3.380
458 HA LYS 63 HA LYS 63 -9.405 -1.402 1.100
459 1HB LYS 63 2HB LYS 63 -6.955 0.143 1.956
460 2HB LYS 63 3HB LYS 63 -7.515 0.247 0.320
461 1HG LYS 63 2HG LYS 63 -9.334 0.769 2.712
462 2HG LYS 63 3HG LYS 63 -8.307 1.992 1.967
463 1HD LYS 63 2HD LYS 63 -10.540 2.279 1.188
464 2HD LYS 63 3HD LYS 63 -9.491 1.841 -0.162
465 1HE LYS 63 2HE LYS 63 -10.527 -0.301 -0.350
466 2HE LYS 63 3HE LYS 63 -11.247 -0.197 1.290
467 1HZ LYS 63 1HZ LYS 63 -12.028 1.421 -1.036
468 2HZ LYS 63 2HZ LYS 63 -12.849 0.136 -0.419
469 3HZ LYS 63 3HZ LYS 63 -12.690 1.503 0.474
470 H ILE 64 H ILE 64 -6.151 -2.657 1.792
471 HA ILE 64 HA ILE 64 -5.206 -3.201 -0.696
472 HB ILE 64 HB ILE 64 -4.925 -4.259 2.016
473 1HG1 ILE 64 2HG1 ILE 64 -3.574 -2.410 0.996
474 2HG1 ILE 64 3HG1 ILE 64 -2.675 -3.745 1.718
475 1HG2 ILE 64 1HG2 ILE 64 -5.160 -6.376 1.173
476 2HG2 ILE 64 2HG2 ILE 64 -4.156 -6.023 -0.259
477 3HG2 ILE 64 3HG2 ILE 64 -3.435 -6.091 1.369
478 1HD1 ILE 64 1HD1 ILE 64 -1.615 -3.131 -0.317
479 2HD1 ILE 64 2HD1 ILE 64 -2.393 -4.711 -0.579
480 3HD1 ILE 64 3HD1 ILE 64 -3.127 -3.238 -1.240
481 H GLU 65 H GLU 65 -7.341 -5.210 1.422
482 HA GLU 65 HA GLU 65 -8.044 -7.297 -0.339
483 1HB GLU 65 2HB GLU 65 -9.410 -5.930 1.998
484 2HB GLU 65 3HB GLU 65 -10.281 -7.134 1.059
485 1HG GLU 65 2HG GLU 65 -7.535 -7.945 1.934
486 2HG GLU 65 3HG GLU 65 -8.727 -7.702 3.219
487 H LYS 66 H LYS 66 -9.919 -4.273 0.270
488 HA LYS 66 HA LYS 66 -11.884 -4.938 -1.695
489 1HB LYS 66 2HB LYS 66 -11.210 -2.482 -0.099
490 2HB LYS 66 3HB LYS 66 -12.288 -2.318 -1.489
491 1HG LYS 66 2HG LYS 66 -13.655 -2.671 0.451
492 2HG LYS 66 3HG LYS 66 -13.753 -4.113 -0.567
493 1HD LYS 66 2HD LYS 66 -12.042 -5.212 0.947
494 2HD LYS 66 3HD LYS 66 -12.064 -3.746 1.952
495 1HE LYS 66 2HE LYS 66 -14.505 -4.109 2.354
496 2HE LYS 66 3HE LYS 66 -14.426 -5.603 1.392
497 1HZ LYS 66 1HZ LYS 66 -14.222 -6.038 3.757
498 2HZ LYS 66 2HZ LYS 66 -12.795 -6.424 3.027
499 3HZ LYS 66 3HZ LYS 66 -12.945 -5.040 3.881
500 H LEU 67 H LEU 67 -8.847 -3.263 -2.053
501 HA LEU 67 HA LEU 67 -9.275 -2.280 -4.744
502 1HB LEU 67 2HB LEU 67 -6.813 -2.745 -3.051
503 2HB LEU 67 3HB LEU 67 -6.747 -2.085 -4.684
504 HG LEU 67 HG LEU 67 -8.540 -0.780 -2.609
505 1HD1 LEU 67 1HD1 LEU 67 -6.273 -0.927 -1.611
506 2HD1 LEU 67 2HD1 LEU 67 -5.602 -0.161 -3.048
507 3HD1 LEU 67 3HD1 LEU 67 -6.724 0.741 -2.018
508 1HD2 LEU 67 1HD2 LEU 67 -7.062 0.286 -5.060
509 2HD2 LEU 67 2HD2 LEU 67 -8.798 -0.072 -4.981
510 3HD2 LEU 67 3HD2 LEU 67 -8.117 1.226 -3.989
511 H GLY 68 H GLY 68 -8.670 -5.406 -3.360
512 1HA GLY 68 2HA GLY 68 -8.938 -7.387 -4.499
513 2HA GLY 68 3HA GLY 68 -8.569 -6.609 -6.043
514 H TYR 69 H TYR 69 -6.669 -6.476 -2.965
515 HA TYR 69 HA TYR 69 -4.444 -7.955 -4.286
516 1HB TYR 69 2HB TYR 69 -4.674 -5.095 -3.659
517 2HB TYR 69 3HB TYR 69 -3.314 -5.819 -2.835
518 HD1 TYR 69 HD1 TYR 69 -4.910 -5.497 -6.209
519 HD2 TYR 69 HD2 TYR 69 -1.330 -6.431 -3.995
520 HE1 TYR 69 HE1 TYR 69 -3.620 -5.435 -8.286
521 HE2 TYR 69 HE2 TYR 69 -0.011 -6.155 -6.031
522 HH TYR 69 HH TYR 69 -1.525 -5.557 -9.238
523 H HIS 70 H HIS 70 -2.588 -8.133 -2.677
524 HA HIS 70 HA HIS 70 -3.400 -8.685 0.105
525 1HB HIS 70 2HB HIS 70 -4.075 -10.645 -1.276
526 2HB HIS 70 3HB HIS 70 -2.424 -10.807 -1.866
527 HD1 HIS 70 1HD HIS 70 -0.950 -10.638 1.070
528 HD2 HIS 70 2HD HIS 70 -4.291 -12.935 -0.082
529 HE1 HIS 70 1HE HIS 70 -0.976 -12.676 2.561
530 H VAL 71 H VAL 71 -1.701 -7.565 1.149
531 HA VAL 71 HA VAL 71 1.007 -7.636 0.014
532 HB VAL 71 HB VAL 71 1.519 -6.391 2.127
533 1HG1 VAL 71 1HG1 VAL 71 -0.393 -5.182 0.131
534 2HG1 VAL 71 2HG1 VAL 71 0.601 -4.232 1.259
535 3HG1 VAL 71 3HG1 VAL 71 1.367 -5.243 0.017
536 1HG2 VAL 71 1HG2 VAL 71 -0.453 -7.020 3.481
537 2HG2 VAL 71 2HG2 VAL 71 -0.182 -5.274 3.387
538 3HG2 VAL 71 3HG2 VAL 71 -1.469 -6.009 2.431
539 H VAL 72 H VAL 72 2.772 -8.382 1.479
540 HA VAL 72 HA VAL 72 1.928 -10.632 3.246
541 HB VAL 72 HB VAL 72 4.281 -10.738 1.429
542 1HG1 VAL 72 1HG1 VAL 72 2.957 -12.848 3.190
543 2HG1 VAL 72 2HG1 VAL 72 4.347 -13.112 2.117
544 3HG1 VAL 72 3HG1 VAL 72 4.512 -12.059 3.523
545 1HG2 VAL 72 1HG2 VAL 72 1.553 -12.074 1.183
546 2HG2 VAL 72 2HG2 VAL 72 2.268 -10.908 0.045
547 3HG2 VAL 72 3HG2 VAL 72 2.994 -12.512 0.240
548 H ILE 73 H ILE 73 3.083 -10.852 5.069
549 HA ILE 73 HA ILE 73 4.840 -8.566 5.868
550 HB ILE 73 HB ILE 73 2.903 -10.157 7.572
551 1HG1 ILE 73 2HG1 ILE 73 1.605 -8.750 6.094
552 2HG1 ILE 73 3HG1 ILE 73 1.628 -8.120 7.733
553 1HG2 ILE 73 1HG2 ILE 73 4.890 -7.939 8.154
554 2HG2 ILE 73 2HG2 ILE 73 3.435 -8.149 9.153
555 3HG2 ILE 73 3HG2 ILE 73 4.605 -9.456 9.019
556 1HD1 ILE 73 1HD1 ILE 73 3.385 -6.445 7.034
557 2HD1 ILE 73 2HD1 ILE 73 3.148 -7.021 5.367
558 3HD1 ILE 73 3HD1 ILE 73 1.810 -6.263 6.235
559 H GLU 74 H GLU 74 6.585 -10.049 4.911
560 HA GLU 74 HA GLU 74 7.299 -12.307 6.416
561 1HB GLU 74 2HB GLU 74 8.606 -10.665 4.244
562 2HB GLU 74 3HB GLU 74 9.426 -11.998 5.032
563 1HG GLU 74 2HG GLU 74 7.666 -13.572 4.347
564 2HG GLU 74 3HG GLU 74 6.746 -12.249 3.607
565 H GLY 75 H GLY 75 7.313 -9.276 7.318
566 1HA GLY 75 2HA GLY 75 10.079 -9.010 8.397
567 2HA GLY 75 3HA GLY 75 8.923 -7.723 8.016
568 H ARG 76 H ARG 76 6.823 -9.400 9.584
569 HA ARG 76 HA ARG 76 7.672 -8.991 12.320
570 1HB ARG 76 2HB ARG 76 6.351 -6.836 11.052
571 2HB ARG 76 3HB ARG 76 5.030 -7.754 11.765
572 1HG ARG 76 2HG ARG 76 5.635 -6.271 13.509
573 2HG ARG 76 3HG ARG 76 6.428 -7.786 13.944
574 1HD ARG 76 2HD ARG 76 8.087 -6.089 14.241
575 2HD ARG 76 3HD ARG 76 8.501 -6.917 12.734
576 HE ARG 76 HE ARG 76 6.758 -4.559 12.478
577 1HH1 ARG 76 2HH2 ARG 76 10.065 -5.763 12.238
578 2HH1 ARG 76 1HH2 ARG 76 10.736 -4.285 11.627
579 1HH2 ARG 76 2HH1 ARG 76 7.592 -2.601 11.607
580 2HH2 ARG 76 1HH1 ARG 76 9.269 -2.461 11.198
Start of MODEL 8
1 1H MET 1 H1 MET 1 2.821 19.721 15.977
2 2H MET 1 H2 MET 1 2.976 18.961 17.435
3 3H MET 1 H3 MET 1 2.600 18.095 16.080
4 HA MET 1 HA MET 1 0.632 18.400 17.410
5 1HB MET 1 2HB MET 1 1.472 21.304 17.147
6 2HB MET 1 3HB MET 1 -0.218 20.858 17.418
7 1HG MET 1 2HG MET 1 0.296 19.718 19.467
8 2HG MET 1 3HG MET 1 2.036 19.992 19.263
9 1HE MET 1 1HE MET 1 0.149 20.700 21.853
10 2HE MET 1 2HE MET 1 1.927 20.832 21.817
11 3HE MET 1 3HE MET 1 0.937 22.218 22.337
12 H LEU 2 H LEU 2 0.120 17.185 15.548
13 HA LEU 2 HA LEU 2 -1.809 18.019 13.884
14 1HB LEU 2 2HB LEU 2 0.792 18.924 12.786
15 2HB LEU 2 3HB LEU 2 0.006 17.825 11.683
16 HG LEU 2 HG LEU 2 -1.809 19.916 12.778
17 1HD1 LEU 2 1HD1 LEU 2 0.174 21.278 12.429
18 2HD1 LEU 2 2HD1 LEU 2 0.423 20.569 10.817
19 3HD1 LEU 2 3HD1 LEU 2 -1.004 21.579 11.143
20 1HD2 LEU 2 1HD2 LEU 2 -2.461 18.169 11.080
21 2HD2 LEU 2 2HD2 LEU 2 -2.634 19.827 10.471
22 3HD2 LEU 2 3HD2 LEU 2 -1.247 18.843 9.972
23 H SER 3 H SER 3 1.004 16.287 12.552
24 HA SER 3 HA SER 3 0.041 13.628 13.332
25 1HB SER 3 2HB SER 3 -0.052 14.833 10.516
26 2HB SER 3 3HB SER 3 0.013 13.098 10.803
27 HG SER 3 HG SER 3 -1.955 13.106 11.604
28 H GLU 4 H GLU 4 1.862 12.233 13.248
29 HA GLU 4 HA GLU 4 4.417 13.237 12.184
30 1HB GLU 4 2HB GLU 4 3.537 10.981 13.891
31 2HB GLU 4 3HB GLU 4 4.842 10.624 12.778
32 1HG GLU 4 2HG GLU 4 5.955 12.689 13.644
33 2HG GLU 4 3HG GLU 4 4.742 12.687 14.921
34 H GLN 5 H GLN 5 5.467 11.352 10.776
35 HA GLN 5 HA GLN 5 3.547 10.016 9.004
36 1HB GLN 5 2HB GLN 5 5.941 11.675 8.171
37 2HB GLN 5 3HB GLN 5 5.230 10.481 7.109
38 1HG GLN 5 2HG GLN 5 3.265 12.477 8.186
39 2HG GLN 5 3HG GLN 5 4.553 13.147 7.189
40 1HE2 GLN 5 1HE2 GLN 5 2.798 10.005 7.040
41 2HE2 GLN 5 2HE2 GLN 5 2.322 10.172 5.355
42 H LYS 6 H LYS 6 4.400 7.963 8.398
43 HA LYS 6 HA LYS 6 7.237 7.468 8.819
44 1HB LYS 6 2HB LYS 6 5.118 5.665 10.038
45 2HB LYS 6 3HB LYS 6 6.801 5.191 9.841
46 1HG LYS 6 2HG LYS 6 5.940 7.584 11.493
47 2HG LYS 6 3HG LYS 6 6.171 5.958 12.144
48 1HD LYS 6 2HD LYS 6 8.499 5.966 11.836
49 2HD LYS 6 3HD LYS 6 8.454 7.183 10.569
50 1HE LYS 6 2HE LYS 6 9.392 8.118 12.659
51 2HE LYS 6 3HE LYS 6 7.959 8.969 12.081
52 1HZ LYS 6 1HZ LYS 6 7.589 8.768 14.276
53 2HZ LYS 6 2HZ LYS 6 6.675 7.618 13.683
54 3HZ LYS 6 3HZ LYS 6 8.103 7.190 14.410
55 H GLU 7 H GLU 7 8.024 5.748 7.712
56 HA GLU 7 HA GLU 7 6.616 5.156 5.186
57 1HB GLU 7 2HB GLU 7 9.551 4.654 5.428
58 2HB GLU 7 3HB GLU 7 8.595 5.353 4.143
59 1HG GLU 7 2HG GLU 7 9.964 7.083 4.853
60 2HG GLU 7 3HG GLU 7 8.489 7.471 5.743
61 H ILE 8 H ILE 8 5.524 3.188 5.586
62 HA ILE 8 HA ILE 8 6.905 1.066 7.043
63 HB ILE 8 HB ILE 8 4.363 0.757 5.567
64 1HG1 ILE 8 2HG1 ILE 8 3.839 2.866 6.516
65 2HG1 ILE 8 3HG1 ILE 8 2.988 1.557 7.329
66 1HG2 ILE 8 1HG2 ILE 8 5.345 -1.123 6.766
67 2HG2 ILE 8 2HG2 ILE 8 5.410 -0.125 8.238
68 3HG2 ILE 8 3HG2 ILE 8 3.834 -0.620 7.556
69 1HD1 ILE 8 1HD1 ILE 8 5.615 2.507 8.395
70 2HD1 ILE 8 2HD1 ILE 8 4.108 3.370 8.790
71 3HD1 ILE 8 3HD1 ILE 8 4.304 1.646 9.222
72 H ALA 9 H ALA 9 7.292 -1.068 5.941
73 HA ALA 9 HA ALA 9 7.642 -0.926 3.000
74 1HB ALA 9 1HB ALA 9 9.843 -0.379 4.085
75 2HB ALA 9 2HB ALA 9 9.751 -1.914 4.969
76 3HB ALA 9 3HB ALA 9 9.859 -1.919 3.195
77 H MET 10 H MET 10 6.818 -2.797 2.084
78 HA MET 10 HA MET 10 6.776 -5.312 3.570
79 1HB MET 10 2HB MET 10 4.278 -5.499 3.551
80 2HB MET 10 3HB MET 10 4.910 -4.259 4.626
81 1HG MET 10 2HG MET 10 4.477 -2.606 2.656
82 2HG MET 10 3HG MET 10 3.447 -3.901 2.025
83 1HE MET 10 1HE MET 10 1.452 -1.995 2.004
84 2HE MET 10 2HE MET 10 1.205 -0.942 3.418
85 3HE MET 10 3HE MET 10 2.759 -0.930 2.564
86 H GLN 11 H GLN 11 5.284 -6.901 2.210
87 HA GLN 11 HA GLN 11 6.375 -6.864 -0.545
88 1HB GLN 11 2HB GLN 11 6.277 -8.805 1.616
89 2HB GLN 11 3HB GLN 11 5.343 -9.431 0.264
90 1HG GLN 11 2HG GLN 11 8.183 -8.400 -0.091
91 2HG GLN 11 3HG GLN 11 7.792 -10.061 0.389
92 1HE2 GLN 11 1HE2 GLN 11 7.733 -7.800 -2.301
93 2HE2 GLN 11 2HE2 GLN 11 7.001 -8.901 -3.447
94 H VAL 12 H VAL 12 4.968 -8.017 -2.170
95 HA VAL 12 HA VAL 12 2.087 -7.277 -1.808
96 HB VAL 12 HB VAL 12 3.805 -7.044 -4.317
97 1HG1 VAL 12 1HG1 VAL 12 1.841 -5.826 -5.219
98 2HG1 VAL 12 2HG1 VAL 12 1.440 -7.503 -4.849
99 3HG1 VAL 12 3HG1 VAL 12 0.924 -6.205 -3.747
100 1HG2 VAL 12 1HG2 VAL 12 4.474 -5.294 -2.790
101 2HG2 VAL 12 2HG2 VAL 12 3.370 -4.552 -3.952
102 3HG2 VAL 12 3HG2 VAL 12 2.778 -4.972 -2.342
103 H SER 13 H SER 13 0.561 -8.722 -2.668
104 HA SER 13 HA SER 13 1.512 -11.115 -4.115
105 1HB SER 13 2HB SER 13 1.400 -11.847 -1.811
106 2HB SER 13 3HB SER 13 -0.221 -11.145 -1.613
107 HG SER 13 HG SER 13 -0.245 -13.423 -2.045
108 H GLY 14 H GLY 14 -0.633 -12.325 -4.682
109 1HA GLY 14 2HA GLY 14 -2.239 -12.325 -6.370
110 2HA GLY 14 3HA GLY 14 -3.019 -11.105 -5.346
111 H MET 15 H MET 15 -0.195 -11.265 -7.622
112 HA MET 15 HA MET 15 -1.133 -8.755 -8.904
113 1HB MET 15 2HB MET 15 0.954 -7.699 -8.622
114 2HB MET 15 3HB MET 15 0.572 -8.407 -7.046
115 1HG MET 15 2HG MET 15 2.782 -8.936 -7.240
116 2HG MET 15 3HG MET 15 2.075 -10.408 -7.910
117 1HE MET 15 1HE MET 15 4.414 -11.050 -8.992
118 2HE MET 15 2HE MET 15 5.382 -9.930 -9.978
119 3HE MET 15 3HE MET 15 5.130 -9.595 -8.250
120 H THR 16 H THR 16 -0.507 -8.460 -11.040
121 HA THR 16 HA THR 16 0.676 -10.779 -12.474
122 HB THR 16 HB THR 16 -0.163 -9.076 -14.431
123 HG1 THR 16 1HG THR 16 -2.165 -8.891 -12.449
124 1HG2 THR 16 1HG2 THR 16 -1.815 -11.174 -12.937
125 2HG2 THR 16 2HG2 THR 16 -2.246 -10.470 -14.518
126 3HG2 THR 16 3HG2 THR 16 -0.763 -11.419 -14.347
127 H CYS 17 H CYS 17 0.871 -7.134 -12.444
128 HA CYS 17 HA CYS 17 3.748 -7.409 -13.108
129 1HB CYS 17 2HB CYS 17 3.491 -6.020 -15.067
130 2HB CYS 17 3HB CYS 17 2.387 -7.392 -15.216
131 H ALA 18 H ALA 18 4.842 -5.348 -13.186
132 HA ALA 18 HA ALA 18 4.372 -3.809 -10.771
133 1HB ALA 18 1HB ALA 18 6.630 -4.493 -11.524
134 2HB ALA 18 2HB ALA 18 6.439 -3.521 -12.996
135 3HB ALA 18 3HB ALA 18 6.493 -2.725 -11.411
136 H ALA 19 H ALA 19 2.135 -3.404 -12.106
137 HA ALA 19 HA ALA 19 2.226 -0.520 -12.740
138 1HB ALA 19 1HB ALA 19 2.449 -1.553 -14.967
139 2HB ALA 19 2HB ALA 19 0.995 -2.530 -14.675
140 3HB ALA 19 3HB ALA 19 0.869 -0.766 -14.774
141 H CYS 20 H CYS 20 -0.040 -3.367 -12.785
142 HA CYS 20 HA CYS 20 -2.217 -1.930 -11.734
143 1HB CYS 20 2HB CYS 20 -1.620 -4.882 -11.163
144 2HB CYS 20 3HB CYS 20 -3.197 -4.080 -11.201
145 H ALA 21 H ALA 21 0.400 -3.651 -10.080
146 HA ALA 21 HA ALA 21 -0.364 -3.319 -7.416
147 1HB ALA 21 1HB ALA 21 2.014 -3.573 -6.902
148 2HB ALA 21 2HB ALA 21 1.549 -4.678 -8.207
149 3HB ALA 21 3HB ALA 21 2.438 -3.187 -8.588
150 H ALA 22 H ALA 22 0.535 -0.749 -9.647
151 HA ALA 22 HA ALA 22 1.191 1.173 -7.529
152 1HB ALA 22 1HB ALA 22 0.374 1.679 -10.419
153 2HB ALA 22 2HB ALA 22 1.194 2.795 -9.310
154 3HB ALA 22 3HB ALA 22 2.049 1.357 -9.915
155 H ARG 23 H ARG 23 -1.639 0.183 -9.468
156 HA ARG 23 HA ARG 23 -3.234 2.484 -8.914
157 1HB ARG 23 2HB ARG 23 -4.008 -0.403 -9.534
158 2HB ARG 23 3HB ARG 23 -5.166 0.909 -9.439
159 1HG ARG 23 2HG ARG 23 -2.778 0.889 -11.353
160 2HG ARG 23 3HG ARG 23 -4.376 0.276 -11.765
161 1HD ARG 23 2HD ARG 23 -3.685 3.152 -10.987
162 2HD ARG 23 3HD ARG 23 -4.077 2.601 -12.597
163 HE ARG 23 HE ARG 23 -5.892 3.214 -10.404
164 1HH1 ARG 23 2HH2 ARG 23 -5.585 1.290 -13.333
165 2HH1 ARG 23 1HH2 ARG 23 -7.288 1.163 -13.642
166 1HH2 ARG 23 2HH1 ARG 23 -8.177 3.041 -10.739
167 2HH2 ARG 23 1HH1 ARG 23 -8.795 2.178 -12.109
168 H ILE 24 H ILE 24 -2.886 -0.643 -7.234
169 HA ILE 24 HA ILE 24 -4.844 -0.082 -5.297
170 HB ILE 24 HB ILE 24 -4.038 -1.863 -3.986
171 1HG1 ILE 24 2HG1 ILE 24 -1.526 -1.481 -5.530
172 2HG1 ILE 24 3HG1 ILE 24 -1.790 -1.455 -3.767
173 1HG2 ILE 24 1HG2 ILE 24 -3.490 -2.676 -6.867
174 2HG2 ILE 24 2HG2 ILE 24 -4.286 -3.572 -5.554
175 3HG2 ILE 24 3HG2 ILE 24 -5.116 -2.220 -6.315
176 1HD1 ILE 24 1HD1 ILE 24 -0.579 -3.457 -4.358
177 2HD1 ILE 24 2HD1 ILE 24 -2.227 -3.915 -3.867
178 3HD1 ILE 24 3HD1 ILE 24 -1.779 -3.850 -5.596
179 H GLU 25 H GLU 25 -1.281 0.423 -4.997
180 HA GLU 25 HA GLU 25 -1.345 1.723 -2.560
181 1HB GLU 25 2HB GLU 25 0.592 1.253 -4.647
182 2HB GLU 25 3HB GLU 25 0.738 2.930 -4.102
183 1HG GLU 25 2HG GLU 25 2.151 1.407 -2.766
184 2HG GLU 25 3HG GLU 25 0.910 2.173 -1.764
185 H LYS 26 H LYS 26 -1.954 3.123 -5.755
186 HA LYS 26 HA LYS 26 -1.924 5.871 -4.714
187 1HB LYS 26 2HB LYS 26 -3.051 4.873 -7.344
188 2HB LYS 26 3HB LYS 26 -2.748 6.553 -6.889
189 1HG LYS 26 2HG LYS 26 -0.678 4.383 -7.362
190 2HG LYS 26 3HG LYS 26 -1.021 5.776 -8.376
191 1HD LYS 26 2HD LYS 26 -0.117 7.271 -6.585
192 2HD LYS 26 3HD LYS 26 0.105 5.868 -5.530
193 1HE LYS 26 2HE LYS 26 2.245 6.399 -6.424
194 2HE LYS 26 3HE LYS 26 1.710 4.848 -7.077
195 1HZ LYS 26 1HZ LYS 26 1.622 7.436 -8.495
196 2HZ LYS 26 2HZ LYS 26 2.694 6.222 -8.756
197 3HZ LYS 26 3HZ LYS 26 1.109 5.998 -9.115
198 H GLY 27 H GLY 27 -4.518 3.502 -5.488
199 1HA GLY 27 2HA GLY 27 -6.697 5.214 -4.682
200 2HA GLY 27 3HA GLY 27 -6.699 3.441 -4.753
201 H LEU 28 H LEU 28 -4.526 2.996 -3.009
202 HA LEU 28 HA LEU 28 -5.712 2.924 -0.368
203 1HB LEU 28 2HB LEU 28 -4.336 1.259 -1.154
204 2HB LEU 28 3HB LEU 28 -3.023 2.381 -1.494
205 HG LEU 28 HG LEU 28 -4.042 1.929 1.322
206 1HD1 LEU 28 1HD1 LEU 28 -1.993 0.311 1.332
207 2HD1 LEU 28 2HD1 LEU 28 -3.487 -0.201 0.515
208 3HD1 LEU 28 3HD1 LEU 28 -2.099 0.382 -0.428
209 1HD2 LEU 28 1HD2 LEU 28 -1.482 2.571 1.611
210 2HD2 LEU 28 2HD2 LEU 28 -1.643 3.251 -0.007
211 3HD2 LEU 28 3HD2 LEU 28 -2.687 3.829 1.313
212 H LYS 29 H LYS 29 -3.218 5.048 -1.883
213 HA LYS 29 HA LYS 29 -2.779 6.684 0.309
214 1HB LYS 29 2HB LYS 29 -1.644 6.719 -2.008
215 2HB LYS 29 3HB LYS 29 -2.975 7.784 -2.492
216 1HG LYS 29 2HG LYS 29 -2.173 9.018 -0.158
217 2HG LYS 29 3HG LYS 29 -0.669 8.261 -0.633
218 1HD LYS 29 2HD LYS 29 -2.411 10.112 -2.351
219 2HD LYS 29 3HD LYS 29 -0.995 10.602 -1.431
220 1HE LYS 29 2HE LYS 29 0.252 8.725 -2.843
221 2HE LYS 29 3HE LYS 29 -1.124 8.917 -3.942
222 1HZ LYS 29 1HZ LYS 29 -0.502 11.366 -3.899
223 2HZ LYS 29 2HZ LYS 29 0.860 10.916 -3.066
224 3HZ LYS 29 3HZ LYS 29 0.655 10.381 -4.561
225 H ARG 30 H ARG 30 -5.756 6.470 -1.537
226 HA ARG 30 HA ARG 30 -6.695 9.111 -0.737
227 1HB ARG 30 2HB ARG 30 -7.439 7.136 -2.636
228 2HB ARG 30 3HB ARG 30 -8.825 7.293 -1.560
229 1HG ARG 30 2HG ARG 30 -7.338 9.636 -2.834
230 2HG ARG 30 3HG ARG 30 -8.602 8.743 -3.685
231 1HD ARG 30 2HD ARG 30 -10.333 9.579 -2.367
232 2HD ARG 30 3HD ARG 30 -9.314 9.702 -0.942
233 HE ARG 30 HE ARG 30 -8.976 11.853 -1.344
234 1HH1 ARG 30 2HH2 ARG 30 -9.595 10.359 -4.462
235 2HH1 ARG 30 1HH2 ARG 30 -9.427 11.813 -5.398
236 1HH2 ARG 30 2HH1 ARG 30 -8.775 13.824 -2.521
237 2HH2 ARG 30 1HH1 ARG 30 -8.965 13.847 -4.242
238 H MET 31 H MET 31 -6.121 6.373 1.133
239 HA MET 31 HA MET 31 -8.442 6.500 2.819
240 1HB MET 31 2HB MET 31 -5.613 5.458 3.157
241 2HB MET 31 3HB MET 31 -6.762 5.354 4.479
242 1HG MET 31 2HG MET 31 -7.438 4.212 1.768
243 2HG MET 31 3HG MET 31 -6.428 3.348 2.927
244 1HE MET 31 1HE MET 31 -10.112 5.231 3.212
245 2HE MET 31 2HE MET 31 -9.997 4.086 1.848
246 3HE MET 31 3HE MET 31 -10.970 3.689 3.284
247 HA PRO 32 HA PRO 32 -7.416 10.020 5.379
248 1HB PRO 32 2HB PRO 32 -8.218 9.158 7.877
249 2HB PRO 32 3HB PRO 32 -9.350 9.664 6.592
250 1HG PRO 32 2HG PRO 32 -8.488 6.847 7.284
251 2HG PRO 32 3HG PRO 32 -10.154 7.452 7.038
252 1HD PRO 32 2HD PRO 32 -8.812 6.187 5.081
253 2HD PRO 32 3HD PRO 32 -9.829 7.599 4.679
254 H GLY 33 H GLY 33 -5.566 10.640 6.514
255 1HA GLY 33 2HA GLY 33 -3.683 10.409 7.849
256 2HA GLY 33 3HA GLY 33 -3.937 8.662 7.941
257 H VAL 34 H VAL 34 -4.125 8.478 4.865
258 HA VAL 34 HA VAL 34 -1.223 8.086 4.634
259 HB VAL 34 HB VAL 34 -3.332 7.429 2.567
260 1HG1 VAL 34 1HG1 VAL 34 -1.469 5.809 1.893
261 2HG1 VAL 34 2HG1 VAL 34 -1.039 7.519 1.694
262 3HG1 VAL 34 3HG1 VAL 34 -0.420 6.602 3.066
263 1HG2 VAL 34 1HG2 VAL 34 -3.900 6.221 4.619
264 2HG2 VAL 34 2HG2 VAL 34 -3.162 5.109 3.461
265 3HG2 VAL 34 3HG2 VAL 34 -2.213 5.722 4.834
266 H THR 35 H THR 35 0.130 9.462 3.643
267 HA THR 35 HA THR 35 -1.079 11.814 2.241
268 HB THR 35 HB THR 35 1.133 11.520 4.168
269 HG1 THR 35 1HG THR 35 -0.945 13.399 3.777
270 1HG2 THR 35 1HG2 THR 35 2.312 12.672 2.448
271 2HG2 THR 35 2HG2 THR 35 0.914 13.719 2.080
272 3HG2 THR 35 3HG2 THR 35 1.784 13.884 3.625
273 H ASP 36 H ASP 36 1.551 9.303 2.004
274 HA ASP 36 HA ASP 36 1.217 9.599 -0.825
275 1HB ASP 36 2HB ASP 36 3.587 10.823 0.439
276 2HB ASP 36 3HB ASP 36 4.038 9.570 -0.716
277 H ALA 37 H ALA 37 2.619 7.970 -1.981
278 HA ALA 37 HA ALA 37 3.185 5.562 -0.489
279 1HB ALA 37 1HB ALA 37 0.671 5.539 -0.508
280 2HB ALA 37 2HB ALA 37 0.709 5.597 -2.285
281 3HB ALA 37 3HB ALA 37 1.386 4.203 -1.418
282 H ASN 38 H ASN 38 4.164 3.889 -1.778
283 HA ASN 38 HA ASN 38 4.960 4.639 -4.512
284 1HB ASN 38 2HB ASN 38 7.424 4.256 -3.147
285 2HB ASN 38 3HB ASN 38 6.829 5.678 -3.980
286 1HD2 ASN 38 1HD2 ASN 38 5.973 4.189 -0.771
287 2HD2 ASN 38 2HD2 ASN 38 6.386 5.648 0.126
288 H VAL 39 H VAL 39 4.717 2.754 -5.500
289 HA VAL 39 HA VAL 39 5.082 0.212 -4.088
290 HB VAL 39 HB VAL 39 3.080 0.510 -5.309
291 1HG1 VAL 39 1HG1 VAL 39 3.281 0.593 -7.921
292 2HG1 VAL 39 2HG1 VAL 39 3.301 2.094 -6.970
293 3HG1 VAL 39 3HG1 VAL 39 4.792 1.433 -7.636
294 1HG2 VAL 39 1HG2 VAL 39 4.087 -1.704 -5.259
295 2HG2 VAL 39 2HG2 VAL 39 3.119 -1.447 -6.715
296 3HG2 VAL 39 3HG2 VAL 39 4.878 -1.385 -6.829
297 H ASN 40 H ASN 40 7.320 -0.094 -3.796
298 HA ASN 40 HA ASN 40 9.131 0.337 -6.070
299 1HB ASN 40 2HB ASN 40 9.695 0.917 -3.710
300 2HB ASN 40 3HB ASN 40 9.703 -0.809 -3.317
301 1HD2 ASN 40 1HD2 ASN 40 12.004 0.272 -2.725
302 2HD2 ASN 40 2HD2 ASN 40 13.220 0.034 -3.971
303 H LEU 41 H LEU 41 7.421 -1.318 -7.055
304 HA LEU 41 HA LEU 41 7.858 -4.124 -6.568
305 1HB LEU 41 2HB LEU 41 6.206 -2.465 -8.321
306 2HB LEU 41 3HB LEU 41 6.915 -3.769 -9.239
307 HG LEU 41 HG LEU 41 4.645 -4.154 -8.223
308 1HD1 LEU 41 1HD1 LEU 41 5.958 -5.961 -9.205
309 2HD1 LEU 41 2HD1 LEU 41 6.841 -6.190 -7.682
310 3HD1 LEU 41 3HD1 LEU 41 5.100 -6.537 -7.765
311 1HD2 LEU 41 1HD2 LEU 41 4.294 -4.628 -6.015
312 2HD2 LEU 41 2HD2 LEU 41 5.977 -5.056 -5.677
313 3HD2 LEU 41 3HD2 LEU 41 5.522 -3.358 -5.836
314 H ALA 42 H ALA 42 9.620 -1.740 -8.346
315 HA ALA 42 HA ALA 42 11.157 -3.231 -10.128
316 1HB ALA 42 1HB ALA 42 11.338 -0.775 -9.802
317 2HB ALA 42 2HB ALA 42 12.102 -1.060 -8.216
318 3HB ALA 42 3HB ALA 42 12.920 -1.584 -9.697
319 H THR 43 H THR 43 11.287 -3.211 -6.541
320 HA THR 43 HA THR 43 13.264 -5.432 -6.743
321 HB THR 43 HB THR 43 14.222 -3.320 -5.972
322 HG1 THR 43 1HG THR 43 15.048 -5.431 -5.478
323 1HG2 THR 43 1HG2 THR 43 12.852 -3.867 -3.307
324 2HG2 THR 43 2HG2 THR 43 13.862 -2.485 -3.754
325 3HG2 THR 43 3HG2 THR 43 12.242 -2.673 -4.463
326 H GLU 44 H GLU 44 10.322 -5.468 -6.815
327 HA GLU 44 HA GLU 44 8.468 -6.295 -5.782
328 1HB GLU 44 2HB GLU 44 10.618 -8.271 -4.979
329 2HB GLU 44 3HB GLU 44 8.882 -8.558 -4.794
330 1HG GLU 44 2HG GLU 44 8.506 -8.279 -7.204
331 2HG GLU 44 3HG GLU 44 10.226 -7.933 -7.461
332 H THR 45 H THR 45 9.000 -4.130 -4.315
333 HA THR 45 HA THR 45 8.140 -5.025 -1.649
334 HB THR 45 HB THR 45 10.297 -2.931 -2.258
335 HG1 THR 45 1HG THR 45 10.472 -5.642 -1.913
336 1HG2 THR 45 1HG2 THR 45 9.215 -4.181 0.272
337 2HG2 THR 45 2HG2 THR 45 10.678 -3.161 0.210
338 3HG2 THR 45 3HG2 THR 45 9.101 -2.460 -0.217
339 H VAL 46 H VAL 46 7.002 -3.170 -0.537
340 HA VAL 46 HA VAL 46 6.222 -0.934 -2.321
341 HB VAL 46 HB VAL 46 4.494 -2.545 -2.674
342 1HG1 VAL 46 1HG1 VAL 46 4.360 -2.763 0.348
343 2HG1 VAL 46 2HG1 VAL 46 3.073 -3.349 -0.714
344 3HG1 VAL 46 3HG1 VAL 46 4.684 -4.073 -0.806
345 1HG2 VAL 46 1HG2 VAL 46 3.824 -0.147 -2.283
346 2HG2 VAL 46 2HG2 VAL 46 2.600 -1.399 -2.002
347 3HG2 VAL 46 3HG2 VAL 46 3.380 -0.602 -0.620
348 H ASN 47 H ASN 47 5.744 1.004 -1.223
349 HA ASN 47 HA ASN 47 6.273 0.998 1.683
350 1HB ASN 47 2HB ASN 47 7.558 2.672 -0.528
351 2HB ASN 47 3HB ASN 47 7.513 3.217 1.153
352 1HD2 ASN 47 1HD2 ASN 47 8.366 1.554 2.808
353 2HD2 ASN 47 2HD2 ASN 47 9.927 0.892 2.346
354 H VAL 48 H VAL 48 5.056 2.610 2.825
355 HA VAL 48 HA VAL 48 3.199 4.247 1.219
356 HB VAL 48 HB VAL 48 2.297 2.509 3.537
357 1HG1 VAL 48 1HG1 VAL 48 1.136 4.764 3.082
358 2HG1 VAL 48 2HG1 VAL 48 0.674 4.111 1.505
359 3HG1 VAL 48 3HG1 VAL 48 0.098 3.333 2.993
360 1HG2 VAL 48 1HG2 VAL 48 2.710 1.066 1.558
361 2HG2 VAL 48 2HG2 VAL 48 0.974 1.256 1.838
362 3HG2 VAL 48 3HG2 VAL 48 1.772 2.170 0.544
363 H ILE 49 H ILE 49 3.135 6.265 2.066
364 HA ILE 49 HA ILE 49 4.736 6.735 4.488
365 HB ILE 49 HB ILE 49 4.070 8.743 2.303
366 1HG1 ILE 49 2HG1 ILE 49 5.264 7.053 1.136
367 2HG1 ILE 49 3HG1 ILE 49 6.313 8.437 1.406
368 1HG2 ILE 49 1HG2 ILE 49 6.042 9.925 3.259
369 2HG2 ILE 49 2HG2 ILE 49 4.711 9.746 4.406
370 3HG2 ILE 49 3HG2 ILE 49 6.132 8.701 4.544
371 1HD1 ILE 49 1HD1 ILE 49 6.408 5.793 2.915
372 2HD1 ILE 49 2HD1 ILE 49 7.596 6.424 1.768
373 3HD1 ILE 49 3HD1 ILE 49 7.379 7.225 3.330
374 H TYR 50 H TYR 50 3.182 6.733 6.145
375 HA TYR 50 HA TYR 50 0.768 8.460 5.780
376 1HB TYR 50 2HB TYR 50 -0.681 6.813 6.681
377 2HB TYR 50 3HB TYR 50 0.061 6.251 5.212
378 HD1 TYR 50 HD1 TYR 50 0.500 5.980 8.954
379 HD2 TYR 50 HD2 TYR 50 0.666 3.992 5.151
380 HE1 TYR 50 HE1 TYR 50 0.822 3.836 10.098
381 HE2 TYR 50 HE2 TYR 50 0.657 1.810 6.304
382 HH TYR 50 HH TYR 50 1.072 1.520 9.784
383 H ASP 51 H ASP 51 -0.379 8.895 7.680
384 HA ASP 51 HA ASP 51 1.373 9.522 9.944
385 1HB ASP 51 2HB ASP 51 -0.201 11.184 9.345
386 2HB ASP 51 3HB ASP 51 -1.548 10.039 9.414
387 HA PRO 52 HA PRO 52 0.156 5.488 11.646
388 1HB PRO 52 2HB PRO 52 1.976 5.230 13.623
389 2HB PRO 52 3HB PRO 52 2.430 5.137 11.897
390 1HG PRO 52 2HG PRO 52 2.566 7.579 13.700
391 2HG PRO 52 3HG PRO 52 3.883 6.890 12.703
392 1HD PRO 52 2HD PRO 52 2.327 8.937 11.827
393 2HD PRO 52 3HD PRO 52 2.877 7.654 10.704
394 H ALA 53 H ALA 53 -0.619 8.568 12.828
395 HA ALA 53 HA ALA 53 -1.710 7.598 15.393
396 1HB ALA 53 1HB ALA 53 -1.975 10.280 13.985
397 2HB ALA 53 2HB ALA 53 -2.434 9.887 15.649
398 3HB ALA 53 3HB ALA 53 -0.718 9.894 15.181
399 H GLU 54 H GLU 54 -2.510 8.236 11.979
400 HA GLU 54 HA GLU 54 -5.368 8.002 12.628
401 1HB GLU 54 2HB GLU 54 -4.058 9.822 10.930
402 2HB GLU 54 3HB GLU 54 -4.755 8.613 9.848
403 1HG GLU 54 2HG GLU 54 -6.531 9.961 9.907
404 2HG GLU 54 3HG GLU 54 -6.948 9.007 11.332
405 H THR 55 H THR 55 -2.987 6.953 10.171
406 HA THR 55 HA THR 55 -4.279 4.329 9.983
407 HB THR 55 HB THR 55 -2.387 4.095 8.032
408 HG1 THR 55 1HG THR 55 -3.425 6.613 7.701
409 1HG2 THR 55 1HG2 THR 55 -5.185 5.345 7.952
410 2HG2 THR 55 2HG2 THR 55 -4.290 4.715 6.542
411 3HG2 THR 55 3HG2 THR 55 -4.755 3.614 7.866
412 H GLY 56 H GLY 56 -2.207 2.768 9.462
413 1HA GLY 56 2HA GLY 56 -0.598 1.761 11.311
414 2HA GLY 56 3HA GLY 56 -1.991 2.212 12.315
415 H THR 57 H THR 57 -1.005 0.490 9.685
416 HA THR 57 HA THR 57 -1.712 -0.455 7.915
417 HB THR 57 HB THR 57 -1.585 -2.937 8.313
418 HG1 THR 57 1HG THR 57 -1.281 -3.554 10.520
419 1HG2 THR 57 1HG2 THR 57 0.662 -2.973 9.271
420 2HG2 THR 57 2HG2 THR 57 0.508 -1.584 8.178
421 3HG2 THR 57 3HG2 THR 57 0.456 -1.347 9.941
422 H ALA 58 H ALA 58 -4.054 -0.955 10.441
423 HA ALA 58 HA ALA 58 -6.194 -2.302 9.609
424 1HB ALA 58 1HB ALA 58 -6.020 -0.769 11.534
425 2HB ALA 58 2HB ALA 58 -6.008 0.616 10.444
426 3HB ALA 58 3HB ALA 58 -7.483 -0.379 10.584
427 H ALA 59 H ALA 59 -5.429 0.952 8.292
428 HA ALA 59 HA ALA 59 -7.977 0.756 6.766
429 1HB ALA 59 1HB ALA 59 -6.085 3.002 6.239
430 2HB ALA 59 2HB ALA 59 -7.849 2.968 6.299
431 3HB ALA 59 3HB ALA 59 -6.951 2.925 7.812
432 H ILE 60 H ILE 60 -4.546 0.674 6.201
433 HA ILE 60 HA ILE 60 -4.509 0.569 3.389
434 HB ILE 60 HB ILE 60 -2.652 -0.121 5.684
435 1HG1 ILE 60 2HG1 ILE 60 -1.134 1.205 4.076
436 2HG1 ILE 60 3HG1 ILE 60 -2.601 1.446 3.116
437 1HG2 ILE 60 1HG2 ILE 60 -0.928 -1.040 4.192
438 2HG2 ILE 60 2HG2 ILE 60 -2.251 -2.149 4.469
439 3HG2 ILE 60 3HG2 ILE 60 -2.150 -1.277 2.924
440 1HD1 ILE 60 1HD1 ILE 60 -2.246 2.218 6.067
441 2HD1 ILE 60 2HD1 ILE 60 -2.001 3.329 4.712
442 3HD1 ILE 60 3HD1 ILE 60 -3.617 2.671 5.023
443 H GLN 61 H GLN 61 -4.503 -2.116 5.781
444 HA GLN 61 HA GLN 61 -4.514 -4.107 3.791
445 1HB GLN 61 2HB GLN 61 -4.388 -4.011 6.558
446 2HB GLN 61 3HB GLN 61 -5.813 -5.006 6.229
447 1HG GLN 61 2HG GLN 61 -4.550 -6.680 5.207
448 2HG GLN 61 3HG GLN 61 -3.260 -5.583 4.704
449 1HE2 GLN 61 1HE2 GLN 61 -1.921 -4.548 6.441
450 2HE2 GLN 61 2HE2 GLN 61 -1.506 -5.585 7.802
451 H GLU 62 H GLU 62 -7.220 -2.532 5.529
452 HA GLU 62 HA GLU 62 -9.414 -3.844 4.386
453 1HB GLU 62 2HB GLU 62 -8.821 -1.178 5.570
454 2HB GLU 62 3HB GLU 62 -10.157 -1.143 4.443
455 1HG GLU 62 2HG GLU 62 -10.240 -3.397 6.418
456 2HG GLU 62 3HG GLU 62 -10.378 -1.772 7.085
457 H LYS 63 H LYS 63 -7.749 -0.941 2.977
458 HA LYS 63 HA LYS 63 -9.293 -1.089 0.584
459 1HB LYS 63 2HB LYS 63 -6.872 0.384 1.592
460 2HB LYS 63 3HB LYS 63 -7.206 0.393 -0.112
461 1HG LYS 63 2HG LYS 63 -9.164 1.207 2.054
462 2HG LYS 63 3HG LYS 63 -8.160 2.286 1.073
463 1HD LYS 63 2HD LYS 63 -9.910 2.563 -0.214
464 2HD LYS 63 3HD LYS 63 -9.465 1.019 -0.942
465 1HE LYS 63 2HE LYS 63 -11.192 -0.149 0.299
466 2HE LYS 63 3HE LYS 63 -11.347 1.158 1.477
467 1HZ LYS 63 1HZ LYS 63 -12.359 2.496 -0.192
468 2HZ LYS 63 2HZ LYS 63 -12.158 1.332 -1.343
469 3HZ LYS 63 3HZ LYS 63 -13.157 1.069 -0.065
470 H ILE 64 H ILE 64 -6.104 -2.363 1.438
471 HA ILE 64 HA ILE 64 -5.100 -3.101 -0.986
472 HB ILE 64 HB ILE 64 -4.698 -3.759 1.762
473 1HG1 ILE 64 2HG1 ILE 64 -3.237 -2.449 0.247
474 2HG1 ILE 64 3HG1 ILE 64 -2.434 -3.666 1.230
475 1HG2 ILE 64 1HG2 ILE 64 -4.368 -6.136 -0.029
476 2HG2 ILE 64 2HG2 ILE 64 -3.440 -5.889 1.466
477 3HG2 ILE 64 3HG2 ILE 64 -5.188 -6.025 1.546
478 1HD1 ILE 64 1HD1 ILE 64 -2.393 -5.227 -0.692
479 2HD1 ILE 64 2HD1 ILE 64 -3.221 -4.027 -1.695
480 3HD1 ILE 64 3HD1 ILE 64 -1.586 -3.695 -1.076
481 H GLU 65 H GLU 65 -7.181 -4.991 1.269
482 HA GLU 65 HA GLU 65 -7.840 -7.199 -0.388
483 1HB GLU 65 2HB GLU 65 -9.085 -5.881 2.045
484 2HB GLU 65 3HB GLU 65 -9.897 -7.227 1.238
485 1HG GLU 65 2HG GLU 65 -6.991 -7.632 1.874
486 2HG GLU 65 3HG GLU 65 -8.124 -7.593 3.230
487 H LYS 66 H LYS 66 -9.799 -4.233 0.309
488 HA LYS 66 HA LYS 66 -11.923 -5.043 -1.390
489 1HB LYS 66 2HB LYS 66 -11.123 -2.455 -0.093
490 2HB LYS 66 3HB LYS 66 -12.281 -2.383 -1.422
491 1HG LYS 66 2HG LYS 66 -13.585 -2.544 0.538
492 2HG LYS 66 3HG LYS 66 -13.696 -4.098 -0.293
493 1HD LYS 66 2HD LYS 66 -11.857 -4.929 1.322
494 2HD LYS 66 3HD LYS 66 -12.061 -3.389 2.184
495 1HE LYS 66 2HE LYS 66 -14.529 -3.959 2.424
496 2HE LYS 66 3HE LYS 66 -14.171 -5.556 1.734
497 1HZ LYS 66 1HZ LYS 66 -12.612 -5.861 3.608
498 2HZ LYS 66 2HZ LYS 66 -13.051 -4.405 4.198
499 3HZ LYS 66 3HZ LYS 66 -14.157 -5.602 4.138
500 H LEU 67 H LEU 67 -8.951 -3.368 -2.245
501 HA LEU 67 HA LEU 67 -9.758 -2.647 -4.926
502 1HB LEU 67 2HB LEU 67 -7.138 -2.858 -3.428
503 2HB LEU 67 3HB LEU 67 -7.146 -2.586 -5.166
504 HG LEU 67 HG LEU 67 -8.928 -0.825 -3.482
505 1HD1 LEU 67 1HD1 LEU 67 -6.865 0.793 -3.440
506 2HD1 LEU 67 2HD1 LEU 67 -7.030 -0.449 -2.196
507 3HD1 LEU 67 3HD1 LEU 67 -5.920 -0.710 -3.526
508 1HD2 LEU 67 1HD2 LEU 67 -8.430 0.784 -5.261
509 2HD2 LEU 67 2HD2 LEU 67 -7.234 -0.317 -5.972
510 3HD2 LEU 67 3HD2 LEU 67 -8.956 -0.742 -5.987
511 H GLY 68 H GLY 68 -9.016 -5.689 -3.481
512 1HA GLY 68 2HA GLY 68 -9.261 -7.746 -4.488
513 2HA GLY 68 3HA GLY 68 -9.163 -7.021 -6.101
514 H TYR 69 H TYR 69 -6.989 -6.816 -3.211
515 HA TYR 69 HA TYR 69 -4.776 -8.139 -4.681
516 1HB TYR 69 2HB TYR 69 -5.126 -5.280 -4.262
517 2HB TYR 69 3HB TYR 69 -3.771 -5.842 -3.307
518 HD1 TYR 69 HD1 TYR 69 -1.738 -6.639 -4.328
519 HD2 TYR 69 HD2 TYR 69 -5.185 -5.730 -6.751
520 HE1 TYR 69 HE1 TYR 69 -0.310 -6.449 -6.287
521 HE2 TYR 69 HE2 TYR 69 -3.765 -5.656 -8.748
522 HH TYR 69 HH TYR 69 -0.202 -6.043 -8.567
523 H HIS 70 H HIS 70 -2.842 -8.245 -2.989
524 HA HIS 70 HA HIS 70 -3.782 -8.240 -0.223
525 1HB HIS 70 2HB HIS 70 -4.314 -10.518 -1.189
526 2HB HIS 70 3HB HIS 70 -2.581 -10.764 -1.406
527 HD1 HIS 70 1HD HIS 70 -2.265 -12.621 0.445
528 HD2 HIS 70 2HD HIS 70 -4.455 -9.262 1.724
529 HE1 HIS 70 1HE HIS 70 -2.695 -12.925 2.941
530 H VAL 71 H VAL 71 -2.078 -8.020 1.259
531 HA VAL 71 HA VAL 71 0.576 -7.366 0.078
532 HB VAL 71 HB VAL 71 -0.861 -5.434 0.902
533 1HG1 VAL 71 1HG1 VAL 71 -1.034 -4.966 3.242
534 2HG1 VAL 71 2HG1 VAL 71 -1.738 -6.573 2.984
535 3HG1 VAL 71 3HG1 VAL 71 -0.112 -6.414 3.679
536 1HG2 VAL 71 1HG2 VAL 71 1.850 -5.803 2.183
537 2HG2 VAL 71 2HG2 VAL 71 1.508 -5.191 0.540
538 3HG2 VAL 71 3HG2 VAL 71 0.971 -4.276 1.949
539 H VAL 72 H VAL 72 2.373 -8.132 1.313
540 HA VAL 72 HA VAL 72 1.705 -10.133 3.431
541 HB VAL 72 HB VAL 72 3.871 -10.507 1.436
542 1HG1 VAL 72 1HG1 VAL 72 3.806 -12.829 2.261
543 2HG1 VAL 72 2HG1 VAL 72 4.034 -11.722 3.619
544 3HG1 VAL 72 3HG1 VAL 72 2.440 -12.438 3.324
545 1HG2 VAL 72 1HG2 VAL 72 1.053 -11.659 1.332
546 2HG2 VAL 72 2HG2 VAL 72 1.805 -10.584 0.129
547 3HG2 VAL 72 3HG2 VAL 72 2.425 -12.226 0.354
548 H ILE 73 H ILE 73 3.121 -10.118 5.159
549 HA ILE 73 HA ILE 73 4.991 -7.790 5.247
550 HB ILE 73 HB ILE 73 3.330 -8.995 7.463
551 1HG1 ILE 73 2HG1 ILE 73 2.701 -6.396 7.478
552 2HG1 ILE 73 3HG1 ILE 73 3.205 -6.473 5.792
553 1HG2 ILE 73 1HG2 ILE 73 4.254 -7.180 8.827
554 2HG2 ILE 73 2HG2 ILE 73 5.544 -8.275 8.339
555 3HG2 ILE 73 3HG2 ILE 73 5.350 -6.725 7.494
556 1HD1 ILE 73 1HD1 ILE 73 1.123 -8.224 7.138
557 2HD1 ILE 73 2HD1 ILE 73 0.769 -6.776 6.163
558 3HD1 ILE 73 3HD1 ILE 73 1.490 -8.201 5.391
559 H GLU 74 H GLU 74 6.505 -9.312 4.145
560 HA GLU 74 HA GLU 74 7.653 -11.398 5.555
561 1HB GLU 74 2HB GLU 74 8.340 -9.811 3.160
562 2HB GLU 74 3HB GLU 74 9.686 -10.572 4.010
563 1HG GLU 74 2HG GLU 74 8.816 -12.052 2.242
564 2HG GLU 74 3HG GLU 74 8.664 -12.771 3.851
565 H GLY 75 H GLY 75 7.762 -8.248 6.235
566 1HA GLY 75 2HA GLY 75 8.786 -7.072 8.023
567 2HA GLY 75 3HA GLY 75 9.715 -8.527 8.418
568 H ARG 76 H ARG 76 9.458 -5.788 6.191
569 HA ARG 76 HA ARG 76 10.745 -4.681 4.873
570 1HB ARG 76 2HB ARG 76 11.866 -4.253 6.944
571 2HB ARG 76 3HB ARG 76 12.843 -5.705 6.793
572 1HG ARG 76 2HG ARG 76 14.221 -3.786 6.338
573 2HG ARG 76 3HG ARG 76 14.063 -4.776 4.898
574 1HD ARG 76 2HD ARG 76 12.099 -3.111 4.280
575 2HD ARG 76 3HD ARG 76 12.819 -2.092 5.552
576 HE ARG 76 HE ARG 76 14.517 -3.216 3.384
577 1HH1 ARG 76 2HH2 ARG 76 12.679 -0.402 4.456
578 2HH1 ARG 76 1HH2 ARG 76 13.409 0.714 3.345
579 1HH2 ARG 76 2HH1 ARG 76 15.500 -1.776 1.880
580 2HH2 ARG 76 1HH1 ARG 76 15.044 -0.102 1.822
Start of MODEL 9
1 1H MET 1 H1 MET 1 -2.597 16.146 19.248
2 2H MET 1 H2 MET 1 -1.879 16.403 20.734
3 3H MET 1 H3 MET 1 -2.178 17.658 19.684
4 HA MET 1 HA MET 1 0.082 17.235 19.392
5 1HB MET 1 2HB MET 1 -0.850 14.331 19.302
6 2HB MET 1 3HB MET 1 0.715 14.840 18.658
7 1HG MET 1 2HG MET 1 1.418 15.696 20.817
8 2HG MET 1 3HG MET 1 -0.144 15.277 21.544
9 1HE MET 1 1HE MET 1 2.420 12.791 23.181
10 2HE MET 1 2HE MET 1 2.782 14.448 22.648
11 3HE MET 1 3HE MET 1 1.246 14.093 23.484
12 H LEU 2 H LEU 2 1.076 16.808 17.174
13 HA LEU 2 HA LEU 2 -0.917 17.221 15.015
14 1HB LEU 2 2HB LEU 2 2.061 17.611 15.374
15 2HB LEU 2 3HB LEU 2 1.452 17.335 13.747
16 HG LEU 2 HG LEU 2 0.138 19.450 15.469
17 1HD1 LEU 2 1HD1 LEU 2 2.527 19.978 15.563
18 2HD1 LEU 2 2HD1 LEU 2 2.668 19.790 13.801
19 3HD1 LEU 2 3HD1 LEU 2 1.698 21.113 14.484
20 1HD2 LEU 2 1HD2 LEU 2 0.603 19.164 12.456
21 2HD2 LEU 2 2HD2 LEU 2 -0.908 18.749 13.288
22 3HD2 LEU 2 3HD2 LEU 2 -0.350 20.430 13.251
23 H SER 3 H SER 3 -0.893 15.822 13.139
24 HA SER 3 HA SER 3 -0.516 13.079 13.491
25 1HB SER 3 2HB SER 3 -0.376 14.541 10.825
26 2HB SER 3 3HB SER 3 -1.087 12.976 11.204
27 HG SER 3 HG SER 3 -2.747 14.472 11.083
28 H GLU 4 H GLU 4 1.489 12.334 14.090
29 HA GLU 4 HA GLU 4 3.986 13.146 12.801
30 1HB GLU 4 2HB GLU 4 3.134 11.097 14.754
31 2HB GLU 4 3HB GLU 4 4.412 10.591 13.680
32 1HG GLU 4 2HG GLU 4 5.562 12.759 14.334
33 2HG GLU 4 3HG GLU 4 4.403 12.789 15.670
34 H GLN 5 H GLN 5 5.134 11.290 11.522
35 HA GLN 5 HA GLN 5 3.264 9.843 9.733
36 1HB GLN 5 2HB GLN 5 5.561 11.630 8.916
37 2HB GLN 5 3HB GLN 5 4.860 10.412 7.870
38 1HG GLN 5 2HG GLN 5 2.729 12.101 8.989
39 2HG GLN 5 3HG GLN 5 3.981 13.097 8.249
40 1HE2 GLN 5 1HE2 GLN 5 2.793 9.808 7.405
41 2HE2 GLN 5 2HE2 GLN 5 2.254 10.245 5.794
42 H LYS 6 H LYS 6 4.175 7.957 8.787
43 HA LYS 6 HA LYS 6 6.913 7.220 9.431
44 1HB LYS 6 2HB LYS 6 4.508 5.549 10.289
45 2HB LYS 6 3HB LYS 6 6.134 4.888 10.153
46 1HG LYS 6 2HG LYS 6 5.377 7.146 12.045
47 2HG LYS 6 3HG LYS 6 5.490 5.427 12.454
48 1HD LYS 6 2HD LYS 6 7.932 5.489 11.711
49 2HD LYS 6 3HD LYS 6 7.759 7.218 11.423
50 1HE LYS 6 2HE LYS 6 8.808 6.915 13.559
51 2HE LYS 6 3HE LYS 6 7.213 7.650 13.773
52 1HZ LYS 6 1HZ LYS 6 6.372 5.513 14.424
53 2HZ LYS 6 2HZ LYS 6 7.830 4.790 14.156
54 3HZ LYS 6 3HZ LYS 6 7.660 5.902 15.362
55 H GLU 7 H GLU 7 7.624 5.427 8.266
56 HA GLU 7 HA GLU 7 6.418 5.185 5.585
57 1HB GLU 7 2HB GLU 7 9.356 4.853 6.248
58 2HB GLU 7 3HB GLU 7 8.542 5.307 4.753
59 1HG GLU 7 2HG GLU 7 9.686 7.221 5.570
60 2HG GLU 7 3HG GLU 7 7.983 7.532 5.935
61 H ILE 8 H ILE 8 5.338 3.147 5.844
62 HA ILE 8 HA ILE 8 6.714 1.020 7.314
63 HB ILE 8 HB ILE 8 4.182 0.988 5.770
64 1HG1 ILE 8 2HG1 ILE 8 3.723 2.730 7.266
65 2HG1 ILE 8 3HG1 ILE 8 2.942 1.250 7.850
66 1HG2 ILE 8 1HG2 ILE 8 3.676 -0.838 7.478
67 2HG2 ILE 8 2HG2 ILE 8 4.873 -1.182 6.216
68 3HG2 ILE 8 3HG2 ILE 8 5.421 -0.735 7.857
69 1HD1 ILE 8 1HD1 ILE 8 3.996 2.401 9.692
70 2HD1 ILE 8 2HD1 ILE 8 4.814 0.846 9.359
71 3HD1 ILE 8 3HD1 ILE 8 5.554 2.374 8.821
72 H ALA 9 H ALA 9 7.007 -1.084 6.157
73 HA ALA 9 HA ALA 9 7.329 -0.926 3.248
74 1HB ALA 9 1HB ALA 9 9.465 -2.101 3.321
75 2HB ALA 9 2HB ALA 9 9.616 -0.579 4.223
76 3HB ALA 9 3HB ALA 9 9.442 -2.111 5.098
77 H MET 10 H MET 10 6.580 -2.898 2.315
78 HA MET 10 HA MET 10 6.563 -5.311 3.913
79 1HB MET 10 2HB MET 10 4.227 -5.836 3.771
80 2HB MET 10 3HB MET 10 4.448 -4.377 4.738
81 1HG MET 10 2HG MET 10 3.585 -4.446 1.832
82 2HG MET 10 3HG MET 10 2.467 -4.466 3.168
83 1HE MET 10 1HE MET 10 1.302 -2.506 4.084
84 2HE MET 10 2HE MET 10 2.701 -2.499 5.191
85 3HE MET 10 3HE MET 10 2.128 -0.978 4.458
86 H GLN 11 H GLN 11 5.372 -7.126 2.502
87 HA GLN 11 HA GLN 11 6.532 -6.881 -0.232
88 1HB GLN 11 2HB GLN 11 6.024 -9.189 1.701
89 2HB GLN 11 3HB GLN 11 6.124 -9.498 -0.029
90 1HG GLN 11 2HG GLN 11 8.284 -8.195 1.688
91 2HG GLN 11 3HG GLN 11 8.309 -9.851 1.051
92 1HE2 GLN 11 1HE2 GLN 11 7.723 -9.856 -1.519
93 2HE2 GLN 11 2HE2 GLN 11 8.345 -8.514 -2.432
94 H VAL 12 H VAL 12 5.354 -7.906 -1.975
95 HA VAL 12 HA VAL 12 2.430 -7.324 -1.745
96 HB VAL 12 HB VAL 12 4.310 -7.083 -4.135
97 1HG1 VAL 12 1HG1 VAL 12 2.416 -5.753 -5.112
98 2HG1 VAL 12 2HG1 VAL 12 2.045 -7.461 -4.938
99 3HG1 VAL 12 3HG1 VAL 12 1.388 -6.286 -3.769
100 1HG2 VAL 12 1HG2 VAL 12 4.903 -5.375 -2.562
101 2HG2 VAL 12 2HG2 VAL 12 3.871 -4.586 -3.750
102 3HG2 VAL 12 3HG2 VAL 12 3.188 -5.037 -2.188
103 H SER 13 H SER 13 1.011 -8.631 -3.184
104 HA SER 13 HA SER 13 2.163 -10.890 -4.592
105 1HB SER 13 2HB SER 13 0.144 -11.256 -2.334
106 2HB SER 13 3HB SER 13 0.466 -12.483 -3.569
107 HG SER 13 HG SER 13 2.725 -11.456 -2.333
108 H GLY 14 H GLY 14 0.390 -11.836 -5.997
109 1HA GLY 14 2HA GLY 14 -1.614 -11.643 -7.194
110 2HA GLY 14 3HA GLY 14 -1.946 -10.068 -6.473
111 H MET 15 H MET 15 0.835 -9.071 -7.119
112 HA MET 15 HA MET 15 0.374 -7.831 -9.568
113 1HB MET 15 2HB MET 15 2.743 -7.334 -9.620
114 2HB MET 15 3HB MET 15 1.986 -6.971 -8.053
115 1HG MET 15 2HG MET 15 3.630 -8.150 -7.051
116 2HG MET 15 3HG MET 15 3.002 -9.615 -7.794
117 1HE MET 15 1HE MET 15 6.727 -10.285 -8.289
118 2HE MET 15 2HE MET 15 5.803 -9.735 -6.872
119 3HE MET 15 3HE MET 15 5.136 -10.995 -7.936
120 H THR 16 H THR 16 -0.132 -8.866 -11.389
121 HA THR 16 HA THR 16 2.006 -10.309 -12.753
122 HB THR 16 HB THR 16 -0.003 -12.022 -13.317
123 HG1 THR 16 1HG THR 16 -0.604 -11.089 -10.795
124 1HG2 THR 16 1HG2 THR 16 2.283 -12.701 -12.817
125 2HG2 THR 16 2HG2 THR 16 2.027 -12.458 -11.078
126 3HG2 THR 16 3HG2 THR 16 1.116 -13.699 -11.945
127 H CYS 17 H CYS 17 0.191 -7.782 -13.095
128 HA CYS 17 HA CYS 17 -0.931 -8.478 -15.783
129 1HB CYS 17 2HB CYS 17 -1.456 -5.956 -14.170
130 2HB CYS 17 3HB CYS 17 -2.380 -6.645 -15.506
131 H ALA 18 H ALA 18 0.678 -5.880 -14.049
132 HA ALA 18 HA ALA 18 2.969 -5.627 -15.660
133 1HB ALA 18 1HB ALA 18 1.555 -4.650 -17.409
134 2HB ALA 18 2HB ALA 18 0.782 -3.561 -16.239
135 3HB ALA 18 3HB ALA 18 2.500 -3.362 -16.647
136 H ALA 19 H ALA 19 0.559 -3.567 -13.966
137 HA ALA 19 HA ALA 19 2.409 -3.012 -11.722
138 1HB ALA 19 1HB ALA 19 1.661 -0.970 -13.828
139 2HB ALA 19 2HB ALA 19 2.598 -0.640 -12.341
140 3HB ALA 19 3HB ALA 19 3.268 -1.693 -13.605
141 H CYS 20 H CYS 20 -0.434 -4.020 -12.001
142 HA CYS 20 HA CYS 20 -2.244 -2.038 -11.127
143 1HB CYS 20 2HB CYS 20 -2.067 -5.025 -10.590
144 2HB CYS 20 3HB CYS 20 -3.467 -4.025 -10.154
145 H ALA 21 H ALA 21 0.238 -3.836 -9.332
146 HA ALA 21 HA ALA 21 -0.355 -3.057 -6.729
147 1HB ALA 21 1HB ALA 21 1.410 -4.636 -7.328
148 2HB ALA 21 2HB ALA 21 2.366 -3.313 -8.034
149 3HB ALA 21 3HB ALA 21 2.034 -3.346 -6.284
150 H ALA 22 H ALA 22 0.739 -0.973 -9.387
151 HA ALA 22 HA ALA 22 1.428 1.251 -7.608
152 1HB ALA 22 1HB ALA 22 0.675 1.317 -10.557
153 2HB ALA 22 2HB ALA 22 1.514 2.567 -9.622
154 3HB ALA 22 3HB ALA 22 2.318 1.015 -9.957
155 H ARG 23 H ARG 23 -1.437 0.114 -9.412
156 HA ARG 23 HA ARG 23 -3.018 2.466 -8.947
157 1HB ARG 23 2HB ARG 23 -3.881 -0.413 -9.456
158 2HB ARG 23 3HB ARG 23 -4.949 0.981 -9.482
159 1HG ARG 23 2HG ARG 23 -2.499 0.747 -11.298
160 2HG ARG 23 3HG ARG 23 -4.073 0.101 -11.743
161 1HD ARG 23 2HD ARG 23 -3.587 3.033 -11.044
162 2HD ARG 23 3HD ARG 23 -3.583 2.352 -12.683
163 HE ARG 23 HE ARG 23 -5.988 1.565 -11.409
164 1HH1 ARG 23 2HH2 ARG 23 -4.460 4.482 -12.649
165 2HH1 ARG 23 1HH2 ARG 23 -5.933 5.250 -13.159
166 1HH2 ARG 23 2HH1 ARG 23 -7.982 2.536 -12.080
167 2HH2 ARG 23 1HH1 ARG 23 -7.990 4.105 -12.811
168 H ILE 24 H ILE 24 -2.688 -0.663 -7.174
169 HA ILE 24 HA ILE 24 -4.566 0.072 -5.205
170 HB ILE 24 HB ILE 24 -3.846 -1.593 -3.769
171 1HG1 ILE 24 2HG1 ILE 24 -1.327 -1.493 -5.312
172 2HG1 ILE 24 3HG1 ILE 24 -1.547 -1.275 -3.563
173 1HG2 ILE 24 1HG2 ILE 24 -3.330 -2.716 -6.546
174 2HG2 ILE 24 2HG2 ILE 24 -4.155 -3.457 -5.156
175 3HG2 ILE 24 3HG2 ILE 24 -4.932 -2.147 -6.042
176 1HD1 ILE 24 1HD1 ILE 24 -0.455 -3.392 -3.979
177 2HD1 ILE 24 2HD1 ILE 24 -2.111 -3.712 -3.406
178 3HD1 ILE 24 3HD1 ILE 24 -1.713 -3.844 -5.137
179 H GLU 25 H GLU 25 -0.980 0.474 -4.957
180 HA GLU 25 HA GLU 25 -0.980 1.882 -2.575
181 1HB GLU 25 2HB GLU 25 0.899 1.376 -4.731
182 2HB GLU 25 3HB GLU 25 1.067 3.056 -4.205
183 1HG GLU 25 2HG GLU 25 2.533 1.545 -2.908
184 2HG GLU 25 3HG GLU 25 1.331 2.317 -1.867
185 H LYS 26 H LYS 26 -1.707 3.144 -5.764
186 HA LYS 26 HA LYS 26 -1.475 5.957 -4.951
187 1HB LYS 26 2HB LYS 26 -2.210 4.489 -7.472
188 2HB LYS 26 3HB LYS 26 -2.784 6.139 -7.261
189 1HG LYS 26 2HG LYS 26 -0.655 6.036 -8.489
190 2HG LYS 26 3HG LYS 26 -0.590 7.037 -7.032
191 1HD LYS 26 2HD LYS 26 0.660 5.300 -5.841
192 2HD LYS 26 3HD LYS 26 0.536 4.228 -7.246
193 1HE LYS 26 2HE LYS 26 1.790 5.772 -8.652
194 2HE LYS 26 3HE LYS 26 1.859 6.973 -7.354
195 1HZ LYS 26 1HZ LYS 26 3.101 4.311 -7.258
196 2HZ LYS 26 2HZ LYS 26 3.885 5.723 -7.553
197 3HZ LYS 26 3HZ LYS 26 3.198 5.470 -6.080
198 H GLY 27 H GLY 27 -4.183 3.653 -5.558
199 1HA GLY 27 2HA GLY 27 -6.283 5.459 -4.794
200 2HA GLY 27 3HA GLY 27 -6.336 3.689 -4.716
201 H LEU 28 H LEU 28 -4.299 3.124 -2.997
202 HA LEU 28 HA LEU 28 -5.369 3.348 -0.381
203 1HB LEU 28 2HB LEU 28 -4.040 1.585 -1.207
204 2HB LEU 28 3HB LEU 28 -2.656 2.653 -1.428
205 HG LEU 28 HG LEU 28 -3.892 2.004 1.283
206 1HD1 LEU 28 1HD1 LEU 28 -1.820 0.480 1.366
207 2HD1 LEU 28 2HD1 LEU 28 -3.196 -0.041 0.369
208 3HD1 LEU 28 3HD1 LEU 28 -1.763 0.667 -0.392
209 1HD2 LEU 28 1HD2 LEU 28 -2.556 3.982 1.467
210 2HD2 LEU 28 2HD2 LEU 28 -1.408 2.697 1.853
211 3HD2 LEU 28 3HD2 LEU 28 -1.377 3.429 0.253
212 H LYS 29 H LYS 29 -2.750 5.293 -1.981
213 HA LYS 29 HA LYS 29 -2.292 6.986 0.194
214 1HB LYS 29 2HB LYS 29 -1.035 6.878 -2.008
215 2HB LYS 29 3HB LYS 29 -2.304 7.921 -2.670
216 1HG LYS 29 2HG LYS 29 -1.676 9.381 -0.436
217 2HG LYS 29 3HG LYS 29 -0.170 8.511 -0.617
218 1HD LYS 29 2HD LYS 29 -1.600 10.120 -2.786
219 2HD LYS 29 3HD LYS 29 -0.326 10.786 -1.762
220 1HE LYS 29 2HE LYS 29 1.369 9.621 -2.767
221 2HE LYS 29 3HE LYS 29 0.378 8.238 -3.217
222 1HZ LYS 29 1HZ LYS 29 1.093 9.564 -5.069
223 2HZ LYS 29 2HZ LYS 29 -0.558 9.549 -4.959
224 3HZ LYS 29 3HZ LYS 29 0.304 10.884 -4.492
225 H ARG 30 H ARG 30 -5.082 7.005 -2.004
226 HA ARG 30 HA ARG 30 -5.868 9.712 -1.309
227 1HB ARG 30 2HB ARG 30 -6.822 7.590 -3.105
228 2HB ARG 30 3HB ARG 30 -8.157 8.327 -2.247
229 1HG ARG 30 2HG ARG 30 -6.031 9.750 -3.900
230 2HG ARG 30 3HG ARG 30 -7.679 9.356 -4.406
231 1HD ARG 30 2HD ARG 30 -8.304 11.413 -3.664
232 2HD ARG 30 3HD ARG 30 -8.184 10.725 -2.059
233 HE ARG 30 HE ARG 30 -6.353 12.010 -1.622
234 1HH1 ARG 30 2HH2 ARG 30 -6.736 11.772 -5.098
235 2HH1 ARG 30 1HH2 ARG 30 -5.590 13.013 -5.508
236 1HH2 ARG 30 2HH1 ARG 30 -4.758 13.639 -2.088
237 2HH2 ARG 30 1HH1 ARG 30 -4.416 14.089 -3.725
238 H MET 31 H MET 31 -5.818 6.935 0.618
239 HA MET 31 HA MET 31 -8.460 7.244 1.759
240 1HB MET 31 2HB MET 31 -6.055 5.608 2.670
241 2HB MET 31 3HB MET 31 -7.712 5.390 3.238
242 1HG MET 31 2HG MET 31 -6.834 5.093 0.330
243 2HG MET 31 3HG MET 31 -7.047 3.774 1.449
244 1HE MET 31 1HE MET 31 -9.793 3.687 -1.405
245 2HE MET 31 2HE MET 31 -8.430 4.786 -1.618
246 3HE MET 31 3HE MET 31 -8.142 3.176 -0.913
247 HA PRO 32 HA PRO 32 -7.509 10.257 4.864
248 1HB PRO 32 2HB PRO 32 -8.923 9.351 7.057
249 2HB PRO 32 3HB PRO 32 -9.672 10.150 5.647
250 1HG PRO 32 2HG PRO 32 -9.412 7.179 6.156
251 2HG PRO 32 3HG PRO 32 -10.880 8.078 5.666
252 1HD PRO 32 2HD PRO 32 -9.389 6.777 3.847
253 2HD PRO 32 3HD PRO 32 -10.026 8.397 3.449
254 H GLY 33 H GLY 33 -5.886 10.493 6.393
255 1HA GLY 33 2HA GLY 33 -4.307 9.871 7.934
256 2HA GLY 33 3HA GLY 33 -4.795 8.169 7.768
257 H VAL 34 H VAL 34 -4.273 8.938 4.585
258 HA VAL 34 HA VAL 34 -1.396 8.216 4.834
259 HB VAL 34 HB VAL 34 -3.259 7.617 2.519
260 1HG1 VAL 34 1HG1 VAL 34 -0.384 6.878 3.254
261 2HG1 VAL 34 2HG1 VAL 34 -1.297 6.068 1.977
262 3HG1 VAL 34 3HG1 VAL 34 -0.927 7.802 1.854
263 1HG2 VAL 34 1HG2 VAL 34 -4.000 6.301 4.439
264 2HG2 VAL 34 2HG2 VAL 34 -3.100 5.255 3.343
265 3HG2 VAL 34 3HG2 VAL 34 -2.325 5.853 4.825
266 H THR 35 H THR 35 0.082 9.484 3.896
267 HA THR 35 HA THR 35 -0.886 12.008 2.643
268 HB THR 35 HB THR 35 1.401 11.332 4.391
269 HG1 THR 35 1HG THR 35 -0.091 12.114 5.705
270 1HG2 THR 35 1HG2 THR 35 2.504 12.637 2.789
271 2HG2 THR 35 2HG2 THR 35 1.098 13.709 2.543
272 3HG2 THR 35 3HG2 THR 35 2.038 13.793 4.046
273 H ASP 36 H ASP 36 1.731 9.449 2.334
274 HA ASP 36 HA ASP 36 1.622 9.911 -0.517
275 1HB ASP 36 2HB ASP 36 3.642 11.233 0.765
276 2HB ASP 36 3HB ASP 36 4.434 9.692 0.398
277 H ALA 37 H ALA 37 3.023 8.270 -1.645
278 HA ALA 37 HA ALA 37 3.422 5.777 -0.298
279 1HB ALA 37 1HB ALA 37 0.887 5.798 -0.339
280 2HB ALA 37 2HB ALA 37 0.984 5.713 -2.114
281 3HB ALA 37 3HB ALA 37 1.640 4.399 -1.117
282 H ASN 38 H ASN 38 4.438 4.126 -1.511
283 HA ASN 38 HA ASN 38 5.293 4.850 -4.248
284 1HB ASN 38 2HB ASN 38 7.701 4.386 -2.823
285 2HB ASN 38 3HB ASN 38 7.159 5.842 -3.631
286 1HD2 ASN 38 1HD2 ASN 38 6.192 4.287 -0.486
287 2HD2 ASN 38 2HD2 ASN 38 6.587 5.723 0.455
288 H VAL 39 H VAL 39 4.789 2.952 -5.165
289 HA VAL 39 HA VAL 39 5.192 0.419 -3.785
290 HB VAL 39 HB VAL 39 3.231 0.711 -5.048
291 1HG1 VAL 39 1HG1 VAL 39 4.980 1.731 -7.279
292 2HG1 VAL 39 2HG1 VAL 39 3.567 0.774 -7.691
293 3HG1 VAL 39 3HG1 VAL 39 3.391 2.247 -6.713
294 1HG2 VAL 39 1HG2 VAL 39 4.241 -1.505 -4.994
295 2HG2 VAL 39 2HG2 VAL 39 3.268 -1.236 -6.447
296 3HG2 VAL 39 3HG2 VAL 39 5.031 -1.169 -6.561
297 H ASN 40 H ASN 40 7.358 -0.175 -3.524
298 HA ASN 40 HA ASN 40 9.324 0.359 -5.652
299 1HB ASN 40 2HB ASN 40 9.901 0.711 -3.292
300 2HB ASN 40 3HB ASN 40 9.585 -0.996 -2.948
301 1HD2 ASN 40 1HD2 ASN 40 11.900 -0.896 -2.153
302 2HD2 ASN 40 2HD2 ASN 40 13.164 -1.127 -3.349
303 H LEU 41 H LEU 41 7.568 -1.059 -6.860
304 HA LEU 41 HA LEU 41 7.996 -3.961 -6.753
305 1HB LEU 41 2HB LEU 41 6.292 -2.022 -8.194
306 2HB LEU 41 3HB LEU 41 6.840 -3.309 -9.229
307 HG LEU 41 HG LEU 41 4.631 -3.629 -8.044
308 1HD1 LEU 41 1HD1 LEU 41 6.747 -5.813 -7.902
309 2HD1 LEU 41 2HD1 LEU 41 4.990 -6.061 -7.825
310 3HD1 LEU 41 3HD1 LEU 41 5.728 -5.408 -9.300
311 1HD2 LEU 41 1HD2 LEU 41 5.708 -3.122 -5.673
312 2HD2 LEU 41 2HD2 LEU 41 4.468 -4.375 -5.874
313 3HD2 LEU 41 3HD2 LEU 41 6.172 -4.823 -5.732
314 H ALA 42 H ALA 42 9.688 -1.334 -8.084
315 HA ALA 42 HA ALA 42 11.112 -2.336 -10.240
316 1HB ALA 42 1HB ALA 42 12.290 -0.973 -7.784
317 2HB ALA 42 2HB ALA 42 13.030 -1.072 -9.391
318 3HB ALA 42 3HB ALA 42 11.537 -0.129 -9.165
319 H THR 43 H THR 43 11.371 -3.285 -6.810
320 HA THR 43 HA THR 43 12.886 -5.673 -7.728
321 HB THR 43 HB THR 43 14.193 -4.541 -6.145
322 HG1 THR 43 1HG THR 43 14.084 -6.834 -6.124
323 1HG2 THR 43 1HG2 THR 43 12.159 -4.922 -3.929
324 2HG2 THR 43 2HG2 THR 43 13.697 -4.075 -3.904
325 3HG2 THR 43 3HG2 THR 43 12.346 -3.379 -4.810
326 H GLU 44 H GLU 44 10.585 -5.045 -5.040
327 HA GLU 44 HA GLU 44 8.397 -6.430 -6.072
328 1HB GLU 44 2HB GLU 44 10.385 -8.345 -5.635
329 2HB GLU 44 3HB GLU 44 9.535 -8.387 -4.119
330 1HG GLU 44 2HG GLU 44 7.374 -8.582 -5.496
331 2HG GLU 44 3HG GLU 44 8.407 -8.751 -6.934
332 H THR 45 H THR 45 9.023 -4.140 -4.242
333 HA THR 45 HA THR 45 7.864 -5.048 -1.650
334 HB THR 45 HB THR 45 10.224 -3.227 -2.308
335 HG1 THR 45 1HG THR 45 10.052 -5.857 -1.257
336 1HG2 THR 45 1HG2 THR 45 9.237 -2.434 -0.252
337 2HG2 THR 45 2HG2 THR 45 9.109 -4.101 0.379
338 3HG2 THR 45 3HG2 THR 45 10.700 -3.351 0.127
339 H VAL 46 H VAL 46 7.004 -3.121 -0.396
340 HA VAL 46 HA VAL 46 6.110 -0.849 -2.116
341 HB VAL 46 HB VAL 46 4.232 -2.248 -2.256
342 1HG1 VAL 46 1HG1 VAL 46 3.260 -3.425 -0.246
343 2HG1 VAL 46 2HG1 VAL 46 4.826 -4.059 -0.752
344 3HG1 VAL 46 3HG1 VAL 46 4.743 -2.966 0.631
345 1HG2 VAL 46 1HG2 VAL 46 2.535 -1.302 -0.809
346 2HG2 VAL 46 2HG2 VAL 46 3.726 -0.620 0.286
347 3HG2 VAL 46 3HG2 VAL 46 3.619 -0.005 -1.382
348 H ASN 47 H ASN 47 5.882 1.145 -0.994
349 HA ASN 47 HA ASN 47 6.347 1.066 1.916
350 1HB ASN 47 2HB ASN 47 7.745 2.771 -0.198
351 2HB ASN 47 3HB ASN 47 7.589 3.314 1.477
352 1HD2 ASN 47 1HD2 ASN 47 8.368 1.688 3.193
353 2HD2 ASN 47 2HD2 ASN 47 9.973 1.073 2.832
354 H VAL 48 H VAL 48 5.080 2.663 3.033
355 HA VAL 48 HA VAL 48 3.300 4.341 1.374
356 HB VAL 48 HB VAL 48 2.330 2.617 3.678
357 1HG1 VAL 48 1HG1 VAL 48 1.239 4.905 3.286
358 2HG1 VAL 48 2HG1 VAL 48 0.769 4.321 1.684
359 3HG1 VAL 48 3HG1 VAL 48 0.158 3.522 3.148
360 1HG2 VAL 48 1HG2 VAL 48 2.677 1.141 1.762
361 2HG2 VAL 48 2HG2 VAL 48 0.950 1.444 1.961
362 3HG2 VAL 48 3HG2 VAL 48 1.849 2.286 0.685
363 H ILE 49 H ILE 49 3.307 6.364 2.213
364 HA ILE 49 HA ILE 49 4.804 6.789 4.710
365 HB ILE 49 HB ILE 49 4.197 8.830 2.541
366 1HG1 ILE 49 2HG1 ILE 49 5.438 7.160 1.386
367 2HG1 ILE 49 3HG1 ILE 49 6.463 8.553 1.687
368 1HG2 ILE 49 1HG2 ILE 49 6.116 10.028 3.560
369 2HG2 ILE 49 2HG2 ILE 49 4.762 9.807 4.677
370 3HG2 ILE 49 3HG2 ILE 49 6.200 8.785 4.826
371 1HD1 ILE 49 1HD1 ILE 49 7.729 6.504 2.052
372 2HD1 ILE 49 2HD1 ILE 49 7.547 7.365 3.583
373 3HD1 ILE 49 3HD1 ILE 49 6.552 5.930 3.243
374 H TYR 50 H TYR 50 3.169 6.758 6.295
375 HA TYR 50 HA TYR 50 0.670 8.325 5.756
376 1HB TYR 50 2HB TYR 50 -0.719 6.617 6.585
377 2HB TYR 50 3HB TYR 50 0.165 6.029 5.219
378 HD1 TYR 50 HD1 TYR 50 0.908 3.814 5.362
379 HD2 TYR 50 HD2 TYR 50 0.255 6.021 8.998
380 HE1 TYR 50 HE1 TYR 50 0.862 1.715 6.654
381 HE2 TYR 50 HE2 TYR 50 0.584 3.981 10.304
382 HH TYR 50 HH TYR 50 1.110 1.661 10.147
383 H ASP 51 H ASP 51 -0.592 8.641 7.641
384 HA ASP 51 HA ASP 51 1.145 9.542 9.825
385 1HB ASP 51 2HB ASP 51 -1.736 10.205 9.195
386 2HB ASP 51 3HB ASP 51 -0.679 10.922 10.432
387 HA PRO 52 HA PRO 52 -0.475 5.756 11.775
388 1HB PRO 52 2HB PRO 52 1.262 5.430 13.838
389 2HB PRO 52 3HB PRO 52 1.742 5.178 12.137
390 1HG PRO 52 2HG PRO 52 2.051 7.728 13.757
391 2HG PRO 52 3HG PRO 52 3.335 6.824 12.910
392 1HD PRO 52 2HD PRO 52 2.114 8.893 11.737
393 2HD PRO 52 3HD PRO 52 2.436 7.429 10.762
394 H ALA 53 H ALA 53 -1.150 8.812 12.681
395 HA ALA 53 HA ALA 53 -2.265 8.206 15.356
396 1HB ALA 53 1HB ALA 53 -2.973 10.560 15.260
397 2HB ALA 53 2HB ALA 53 -1.219 10.417 15.024
398 3HB ALA 53 3HB ALA 53 -2.284 10.721 13.632
399 H GLU 54 H GLU 54 -2.925 8.283 11.896
400 HA GLU 54 HA GLU 54 -5.843 8.078 12.404
401 1HB GLU 54 2HB GLU 54 -4.282 9.732 10.541
402 2HB GLU 54 3HB GLU 54 -5.401 8.640 9.706
403 1HG GLU 54 2HG GLU 54 -7.301 9.425 10.955
404 2HG GLU 54 3HG GLU 54 -6.262 10.553 11.851
405 H THR 55 H THR 55 -3.193 6.976 10.210
406 HA THR 55 HA THR 55 -4.574 4.355 10.037
407 HB THR 55 HB THR 55 -2.920 3.810 8.143
408 HG1 THR 55 1HG THR 55 -2.975 6.605 8.083
409 1HG2 THR 55 1HG2 THR 55 -4.481 4.772 6.584
410 2HG2 THR 55 2HG2 THR 55 -5.239 3.957 7.980
411 3HG2 THR 55 3HG2 THR 55 -5.228 5.739 7.887
412 H GLY 56 H GLY 56 -2.021 2.883 9.584
413 1HA GLY 56 2HA GLY 56 -0.593 2.017 11.518
414 2HA GLY 56 3HA GLY 56 -2.016 2.384 12.503
415 H THR 57 H THR 57 -0.957 0.765 9.813
416 HA THR 57 HA THR 57 -1.625 -0.138 8.048
417 HB THR 57 HB THR 57 -1.397 -2.646 8.322
418 HG1 THR 57 1HG THR 57 -0.976 -3.366 10.438
419 1HG2 THR 57 1HG2 THR 57 0.669 -1.052 9.895
420 2HG2 THR 57 2HG2 THR 57 0.898 -2.622 9.109
421 3HG2 THR 57 3HG2 THR 57 0.618 -1.178 8.120
422 H ALA 58 H ALA 58 -3.937 -0.816 10.543
423 HA ALA 58 HA ALA 58 -6.022 -2.135 9.666
424 1HB ALA 58 1HB ALA 58 -5.915 0.775 10.542
425 2HB ALA 58 2HB ALA 58 -7.388 -0.232 10.618
426 3HB ALA 58 3HB ALA 58 -5.961 -0.631 11.609
427 H ALA 59 H ALA 59 -5.358 1.122 8.275
428 HA ALA 59 HA ALA 59 -7.909 0.767 6.761
429 1HB ALA 59 1HB ALA 59 -7.689 2.905 5.838
430 2HB ALA 59 2HB ALA 59 -7.205 3.056 7.533
431 3HB ALA 59 3HB ALA 59 -5.975 3.003 6.215
432 H ILE 60 H ILE 60 -4.469 0.798 6.195
433 HA ILE 60 HA ILE 60 -4.427 0.466 3.398
434 HB ILE 60 HB ILE 60 -2.532 -0.049 5.735
435 1HG1 ILE 60 2HG1 ILE 60 -1.126 1.355 3.996
436 2HG1 ILE 60 3HG1 ILE 60 -2.700 1.634 3.256
437 1HG2 ILE 60 1HG2 ILE 60 -0.757 -0.836 4.272
438 2HG2 ILE 60 2HG2 ILE 60 -2.041 -2.021 4.443
439 3HG2 ILE 60 3HG2 ILE 60 -1.929 -1.073 2.950
440 1HD1 ILE 60 1HD1 ILE 60 -3.462 2.676 5.413
441 2HD1 ILE 60 2HD1 ILE 60 -1.911 2.231 6.170
442 3HD1 ILE 60 3HD1 ILE 60 -1.954 3.431 4.871
443 H GLN 61 H GLN 61 -4.534 -2.026 6.007
444 HA GLN 61 HA GLN 61 -4.384 -4.197 4.129
445 1HB GLN 61 2HB GLN 61 -4.719 -3.938 7.020
446 2HB GLN 61 3HB GLN 61 -5.855 -5.098 6.330
447 1HG GLN 61 2HG GLN 61 -4.071 -6.431 6.862
448 2HG GLN 61 3HG GLN 61 -3.918 -6.212 5.121
449 1HE2 GLN 61 1HE2 GLN 61 -2.889 -3.268 6.048
450 2HE2 GLN 61 2HE2 GLN 61 -1.204 -3.629 6.373
451 H GLU 62 H GLU 62 -7.136 -2.586 5.802
452 HA GLU 62 HA GLU 62 -9.260 -4.005 4.728
453 1HB GLU 62 2HB GLU 62 -8.835 -1.312 5.901
454 2HB GLU 62 3HB GLU 62 -10.087 -1.277 4.666
455 1HG GLU 62 2HG GLU 62 -10.063 -3.206 7.006
456 2HG GLU 62 3HG GLU 62 -11.023 -1.720 6.897
457 H LYS 63 H LYS 63 -7.732 -1.074 3.257
458 HA LYS 63 HA LYS 63 -9.349 -1.291 0.944
459 1HB LYS 63 2HB LYS 63 -6.921 0.292 1.801
460 2HB LYS 63 3HB LYS 63 -7.573 0.422 0.197
461 1HG LYS 63 2HG LYS 63 -9.236 0.843 2.737
462 2HG LYS 63 3HG LYS 63 -8.354 2.106 1.899
463 1HD LYS 63 2HD LYS 63 -10.559 2.377 1.259
464 2HD LYS 63 3HD LYS 63 -9.706 1.725 -0.154
465 1HE LYS 63 2HE LYS 63 -10.857 -0.279 -0.110
466 2HE LYS 63 3HE LYS 63 -11.319 -0.122 1.613
467 1HZ LYS 63 1HZ LYS 63 -13.137 0.244 0.104
468 2HZ LYS 63 2HZ LYS 63 -12.816 1.630 0.924
469 3HZ LYS 63 3HZ LYS 63 -12.348 1.470 -0.649
470 H ILE 64 H ILE 64 -6.078 -2.406 1.696
471 HA ILE 64 HA ILE 64 -5.081 -3.121 -0.732
472 HB ILE 64 HB ILE 64 -4.783 -3.921 2.035
473 1HG1 ILE 64 2HG1 ILE 64 -3.351 -2.354 0.707
474 2HG1 ILE 64 3HG1 ILE 64 -2.529 -3.587 1.662
475 1HG2 ILE 64 1HG2 ILE 64 -4.219 -6.034 0.022
476 2HG2 ILE 64 2HG2 ILE 64 -3.408 -5.923 1.607
477 3HG2 ILE 64 3HG2 ILE 64 -5.149 -6.136 1.541
478 1HD1 ILE 64 1HD1 ILE 64 -2.226 -4.992 -0.314
479 2HD1 ILE 64 2HD1 ILE 64 -3.066 -3.798 -1.320
480 3HD1 ILE 64 3HD1 ILE 64 -1.513 -3.382 -0.555
481 H GLU 65 H GLU 65 -7.190 -5.020 1.511
482 HA GLU 65 HA GLU 65 -7.821 -7.229 -0.135
483 1HB GLU 65 2HB GLU 65 -9.233 -5.879 2.193
484 2HB GLU 65 3HB GLU 65 -9.914 -7.293 1.393
485 1HG GLU 65 2HG GLU 65 -7.053 -7.407 2.331
486 2HG GLU 65 3HG GLU 65 -8.360 -7.548 3.512
487 H LYS 66 H LYS 66 -9.845 -4.296 0.480
488 HA LYS 66 HA LYS 66 -11.865 -5.064 -1.366
489 1HB LYS 66 2HB LYS 66 -11.100 -2.490 -0.022
490 2HB LYS 66 3HB LYS 66 -12.229 -2.423 -1.381
491 1HG LYS 66 2HG LYS 66 -13.584 -2.556 0.530
492 2HG LYS 66 3HG LYS 66 -13.661 -4.142 -0.239
493 1HD LYS 66 2HD LYS 66 -11.953 -4.963 1.445
494 2HD LYS 66 3HD LYS 66 -11.993 -3.355 2.201
495 1HE LYS 66 2HE LYS 66 -14.423 -3.609 2.635
496 2HE LYS 66 3HE LYS 66 -14.382 -5.236 1.917
497 1HZ LYS 66 1HZ LYS 66 -12.773 -5.811 3.709
498 2HZ LYS 66 2HZ LYS 66 -12.922 -4.322 4.320
499 3HZ LYS 66 3HZ LYS 66 -14.214 -5.309 4.325
500 H LEU 67 H LEU 67 -8.838 -3.389 -2.001
501 HA LEU 67 HA LEU 67 -9.470 -2.575 -4.701
502 1HB LEU 67 2HB LEU 67 -6.894 -2.848 -3.137
503 2HB LEU 67 3HB LEU 67 -6.934 -2.316 -4.818
504 HG LEU 67 HG LEU 67 -8.673 -0.911 -2.765
505 1HD1 LEU 67 1HD1 LEU 67 -5.794 -0.190 -3.404
506 2HD1 LEU 67 2HD1 LEU 67 -6.908 0.713 -2.364
507 3HD1 LEU 67 3HD1 LEU 67 -6.336 -0.894 -1.881
508 1HD2 LEU 67 1HD2 LEU 67 -8.401 0.987 -4.319
509 2HD2 LEU 67 2HD2 LEU 67 -7.339 0.013 -5.353
510 3HD2 LEU 67 3HD2 LEU 67 -9.053 -0.414 -5.180
511 H GLY 68 H GLY 68 -8.733 -5.624 -3.252
512 1HA GLY 68 2HA GLY 68 -8.974 -7.651 -4.320
513 2HA GLY 68 3HA GLY 68 -8.705 -6.909 -5.903
514 H TYR 69 H TYR 69 -6.729 -6.686 -2.878
515 HA TYR 69 HA TYR 69 -4.491 -8.148 -4.190
516 1HB TYR 69 2HB TYR 69 -4.739 -5.259 -3.671
517 2HB TYR 69 3HB TYR 69 -3.387 -5.947 -2.802
518 HD1 TYR 69 HD1 TYR 69 -4.924 -5.692 -6.196
519 HD2 TYR 69 HD2 TYR 69 -1.391 -6.639 -3.913
520 HE1 TYR 69 HE1 TYR 69 -3.605 -5.693 -8.252
521 HE2 TYR 69 HE2 TYR 69 -0.044 -6.548 -5.968
522 HH TYR 69 HH TYR 69 -1.529 -6.323 -9.165
523 H HIS 70 H HIS 70 -2.674 -8.434 -2.543
524 HA HIS 70 HA HIS 70 -3.394 -8.078 0.205
525 1HB HIS 70 2HB HIS 70 -4.274 -10.458 -0.672
526 2HB HIS 70 3HB HIS 70 -2.589 -10.913 -0.409
527 HD1 HIS 70 1HD HIS 70 -4.707 -8.569 1.862
528 HD2 HIS 70 2HD HIS 70 -3.251 -12.500 1.674
529 HE1 HIS 70 1HE HIS 70 -5.117 -9.597 4.147
530 H VAL 71 H VAL 71 -1.544 -7.926 1.508
531 HA VAL 71 HA VAL 71 1.060 -7.931 0.101
532 HB VAL 71 HB VAL 71 1.679 -6.605 2.213
533 1HG1 VAL 71 1HG1 VAL 71 0.860 -4.450 1.200
534 2HG1 VAL 71 2HG1 VAL 71 1.635 -5.542 0.040
535 3HG1 VAL 71 3HG1 VAL 71 -0.123 -5.420 0.085
536 1HG2 VAL 71 1HG2 VAL 71 0.016 -5.353 3.376
537 2HG2 VAL 71 2HG2 VAL 71 -1.284 -6.015 2.384
538 3HG2 VAL 71 3HG2 VAL 71 -0.397 -7.069 3.510
539 H VAL 72 H VAL 72 2.859 -8.575 1.579
540 HA VAL 72 HA VAL 72 2.102 -10.819 3.388
541 HB VAL 72 HB VAL 72 4.455 -10.830 1.564
542 1HG1 VAL 72 1HG1 VAL 72 4.534 -13.242 2.190
543 2HG1 VAL 72 2HG1 VAL 72 4.713 -12.207 3.609
544 3HG1 VAL 72 3HG1 VAL 72 3.157 -12.996 3.281
545 1HG2 VAL 72 1HG2 VAL 72 3.196 -12.609 0.297
546 2HG2 VAL 72 2HG2 VAL 72 1.750 -12.200 1.242
547 3HG2 VAL 72 3HG2 VAL 72 2.473 -11.006 0.142
548 H ILE 73 H ILE 73 3.324 -10.988 5.212
549 HA ILE 73 HA ILE 73 5.194 -8.758 5.893
550 HB ILE 73 HB ILE 73 3.116 -9.964 7.714
551 1HG1 ILE 73 2HG1 ILE 73 2.039 -8.559 5.968
552 2HG1 ILE 73 3HG1 ILE 73 1.945 -7.943 7.605
553 1HG2 ILE 73 1HG2 ILE 73 5.089 -9.208 8.932
554 2HG2 ILE 73 2HG2 ILE 73 5.124 -7.682 8.048
555 3HG2 ILE 73 3HG2 ILE 73 3.796 -8.038 9.179
556 1HD1 ILE 73 1HD1 ILE 73 2.383 -6.189 5.867
557 2HD1 ILE 73 2HD1 ILE 73 3.540 -6.207 7.207
558 3HD1 ILE 73 3HD1 ILE 73 3.988 -6.909 5.642
559 H GLU 74 H GLU 74 6.810 -10.505 5.129
560 HA GLU 74 HA GLU 74 7.174 -12.698 6.826
561 1HB GLU 74 2HB GLU 74 8.861 -11.413 4.666
562 2HB GLU 74 3HB GLU 74 9.339 -12.826 5.583
563 1HG GLU 74 2HG GLU 74 7.049 -13.859 4.848
564 2HG GLU 74 3HG GLU 74 7.046 -12.578 3.619
565 H GLY 75 H GLY 75 7.565 -9.634 7.524
566 1HA GLY 75 2HA GLY 75 10.258 -9.613 8.710
567 2HA GLY 75 3HA GLY 75 9.145 -8.251 8.567
568 H ARG 76 H ARG 76 6.862 -9.366 9.916
569 HA ARG 76 HA ARG 76 7.820 -9.403 12.697
570 1HB ARG 76 2HB ARG 76 7.089 -7.105 11.574
571 2HB ARG 76 3HB ARG 76 5.457 -7.712 11.812
572 1HG ARG 76 2HG ARG 76 7.558 -7.346 14.016
573 2HG ARG 76 3HG ARG 76 6.389 -6.120 13.528
574 1HD ARG 76 2HD ARG 76 5.483 -7.132 15.499
575 2HD ARG 76 3HD ARG 76 4.514 -7.639 14.120
576 HE ARG 76 HE ARG 76 5.346 -9.813 14.213
577 1HH1 ARG 76 2HH2 ARG 76 6.945 -7.971 16.762
578 2HH1 ARG 76 1HH2 ARG 76 7.927 -9.316 17.269
579 1HH2 ARG 76 2HH1 ARG 76 6.657 -11.347 14.622
580 2HH2 ARG 76 1HH1 ARG 76 7.694 -11.435 16.048
Start of MODEL 10
1 1H MET 1 H1 MET 1 3.084 16.859 13.033
2 2H MET 1 H2 MET 1 4.453 17.756 13.320
3 3H MET 1 H3 MET 1 3.702 16.896 14.526
4 HA MET 1 HA MET 1 3.223 19.148 14.900
5 1HB MET 1 2HB MET 1 2.121 19.045 12.065
6 2HB MET 1 3HB MET 1 1.715 20.319 13.229
7 1HG MET 1 2HG MET 1 3.589 21.430 12.908
8 2HG MET 1 3HG MET 1 4.604 20.008 13.114
9 1HE MET 1 1HE MET 1 5.398 22.435 11.268
10 2HE MET 1 2HE MET 1 6.394 20.972 11.483
11 3HE MET 1 3HE MET 1 6.017 21.562 9.847
12 H LEU 2 H LEU 2 0.191 19.062 13.492
13 HA LEU 2 HA LEU 2 -1.083 17.698 15.658
14 1HB LEU 2 2HB LEU 2 -3.055 17.659 14.213
15 2HB LEU 2 3HB LEU 2 -2.372 19.265 14.397
16 HG LEU 2 HG LEU 2 -1.390 17.809 11.974
17 1HD1 LEU 2 1HD1 LEU 2 -3.475 18.128 10.715
18 2HD1 LEU 2 2HD1 LEU 2 -3.678 16.947 12.017
19 3HD1 LEU 2 3HD1 LEU 2 -4.317 18.596 12.208
20 1HD2 LEU 2 1HD2 LEU 2 -1.841 19.961 10.908
21 2HD2 LEU 2 2HD2 LEU 2 -2.692 20.539 12.354
22 3HD2 LEU 2 3HD2 LEU 2 -0.945 20.242 12.407
23 H SER 3 H SER 3 0.341 16.623 12.624
24 HA SER 3 HA SER 3 -0.259 13.801 13.246
25 1HB SER 3 2HB SER 3 -0.052 15.207 10.531
26 2HB SER 3 3HB SER 3 -0.389 13.495 10.765
27 HG SER 3 HG SER 3 -2.308 14.087 11.836
28 H GLU 4 H GLU 4 1.386 12.405 12.466
29 HA GLU 4 HA GLU 4 4.114 13.466 11.986
30 1HB GLU 4 2HB GLU 4 3.025 11.199 13.576
31 2HB GLU 4 3HB GLU 4 4.481 10.888 12.676
32 1HG GLU 4 2HG GLU 4 5.269 13.116 13.771
33 2HG GLU 4 3HG GLU 4 3.978 12.772 14.910
34 H GLN 5 H GLN 5 5.329 11.637 10.626
35 HA GLN 5 HA GLN 5 3.543 10.099 8.858
36 1HB GLN 5 2HB GLN 5 5.937 11.822 8.142
37 2HB GLN 5 3HB GLN 5 5.255 10.683 7.007
38 1HG GLN 5 2HG GLN 5 3.708 13.031 8.267
39 2HG GLN 5 3HG GLN 5 4.582 13.091 6.773
40 1HE2 GLN 5 1HE2 GLN 5 3.442 9.975 6.597
41 2HE2 GLN 5 2HE2 GLN 5 1.909 10.304 5.838
42 H LYS 6 H LYS 6 4.482 8.082 8.356
43 HA LYS 6 HA LYS 6 7.354 7.779 8.626
44 1HB LYS 6 2HB LYS 6 5.488 5.828 10.049
45 2HB LYS 6 3HB LYS 6 7.212 5.563 9.720
46 1HG LYS 6 2HG LYS 6 7.671 7.763 10.926
47 2HG LYS 6 3HG LYS 6 5.991 7.710 11.491
48 1HD LYS 6 2HD LYS 6 6.493 5.487 12.561
49 2HD LYS 6 3HD LYS 6 8.178 5.653 12.007
50 1HE LYS 6 2HE LYS 6 8.327 7.859 13.232
51 2HE LYS 6 3HE LYS 6 6.683 7.627 13.835
52 1HZ LYS 6 1HZ LYS 6 8.997 5.904 14.421
53 2HZ LYS 6 2HZ LYS 6 8.304 7.002 15.434
54 3HZ LYS 6 3HZ LYS 6 7.462 5.663 14.982
55 H GLU 7 H GLU 7 8.154 5.987 7.482
56 HA GLU 7 HA GLU 7 6.623 5.445 5.023
57 1HB GLU 7 2HB GLU 7 9.634 5.309 5.286
58 2HB GLU 7 3HB GLU 7 8.588 5.640 3.910
59 1HG GLU 7 2HG GLU 7 9.618 7.690 4.392
60 2HG GLU 7 3HG GLU 7 8.065 7.891 5.216
61 H ILE 8 H ILE 8 5.678 3.478 5.725
62 HA ILE 8 HA ILE 8 7.375 1.471 7.027
63 HB ILE 8 HB ILE 8 4.498 1.480 6.277
64 1HG1 ILE 8 2HG1 ILE 8 4.151 1.586 8.821
65 2HG1 ILE 8 3HG1 ILE 8 5.883 1.859 9.014
66 1HG2 ILE 8 1HG2 ILE 8 5.269 -0.730 6.453
67 2HG2 ILE 8 2HG2 ILE 8 6.164 -0.306 7.962
68 3HG2 ILE 8 3HG2 ILE 8 4.372 -0.334 7.931
69 1HD1 ILE 8 1HD1 ILE 8 5.714 4.010 8.214
70 2HD1 ILE 8 2HD1 ILE 8 4.215 3.672 7.301
71 3HD1 ILE 8 3HD1 ILE 8 4.175 3.818 9.079
72 H ALA 9 H ALA 9 7.277 -0.729 6.017
73 HA ALA 9 HA ALA 9 7.422 -0.701 3.054
74 1HB ALA 9 1HB ALA 9 9.489 -2.020 3.154
75 2HB ALA 9 2HB ALA 9 9.736 -0.446 3.941
76 3HB ALA 9 3HB ALA 9 9.505 -1.902 4.927
77 H MET 10 H MET 10 6.476 -2.578 2.193
78 HA MET 10 HA MET 10 6.244 -4.963 3.935
79 1HB MET 10 2HB MET 10 3.834 -4.003 2.359
80 2HB MET 10 3HB MET 10 3.961 -5.343 3.486
81 1HG MET 10 2HG MET 10 2.736 -3.781 4.593
82 2HG MET 10 3HG MET 10 4.328 -3.635 5.336
83 1HE MET 10 1HE MET 10 2.470 -0.117 5.478
84 2HE MET 10 2HE MET 10 1.580 -1.642 5.285
85 3HE MET 10 3HE MET 10 2.961 -1.558 6.401
86 H GLN 11 H GLN 11 5.336 -6.799 2.585
87 HA GLN 11 HA GLN 11 6.578 -6.975 -0.091
88 1HB GLN 11 2HB GLN 11 6.235 -8.795 2.145
89 2HB GLN 11 3HB GLN 11 5.300 -9.419 0.794
90 1HG GLN 11 2HG GLN 11 8.217 -8.610 0.463
91 2HG GLN 11 3HG GLN 11 7.720 -10.194 1.076
92 1HE2 GLN 11 1HE2 GLN 11 7.716 -8.119 -1.806
93 2HE2 GLN 11 2HE2 GLN 11 7.025 -9.271 -2.906
94 H VAL 12 H VAL 12 5.190 -8.033 -1.774
95 HA VAL 12 HA VAL 12 2.316 -7.223 -1.553
96 HB VAL 12 HB VAL 12 4.212 -7.052 -3.938
97 1HG1 VAL 12 1HG1 VAL 12 1.248 -6.389 -3.668
98 2HG1 VAL 12 2HG1 VAL 12 2.267 -5.887 -5.031
99 3HG1 VAL 12 3HG1 VAL 12 1.985 -7.603 -4.744
100 1HG2 VAL 12 1HG2 VAL 12 3.750 -4.590 -3.742
101 2HG2 VAL 12 2HG2 VAL 12 2.893 -4.903 -2.221
102 3HG2 VAL 12 3HG2 VAL 12 4.638 -5.232 -2.357
103 H SER 13 H SER 13 0.798 -8.706 -2.580
104 HA SER 13 HA SER 13 1.915 -11.001 -4.028
105 1HB SER 13 2HB SER 13 0.175 -11.283 -1.542
106 2HB SER 13 3HB SER 13 0.582 -12.603 -2.650
107 HG SER 13 HG SER 13 2.844 -11.347 -1.911
108 H GLY 14 H GLY 14 0.230 -12.185 -5.143
109 1HA GLY 14 2HA GLY 14 -1.661 -12.348 -6.446
110 2HA GLY 14 3HA GLY 14 -2.472 -11.200 -5.369
111 H MET 15 H MET 15 0.017 -11.369 -7.992
112 HA MET 15 HA MET 15 -0.976 -8.865 -9.157
113 1HB MET 15 2HB MET 15 1.237 -7.842 -9.152
114 2HB MET 15 3HB MET 15 0.753 -8.223 -7.495
115 1HG MET 15 2HG MET 15 2.962 -8.902 -7.508
116 2HG MET 15 3HG MET 15 2.120 -10.416 -7.823
117 1HE MET 15 1HE MET 15 5.084 -11.307 -9.981
118 2HE MET 15 2HE MET 15 4.917 -10.811 -8.277
119 3HE MET 15 3HE MET 15 3.723 -11.916 -9.013
120 H THR 16 H THR 16 -0.263 -8.590 -11.345
121 HA THR 16 HA THR 16 0.839 -11.003 -12.715
122 HB THR 16 HB THR 16 -0.143 -9.654 -14.719
123 HG1 THR 16 1HG THR 16 -1.837 -8.237 -14.031
124 1HG2 THR 16 1HG2 THR 16 -2.412 -10.570 -14.352
125 2HG2 THR 16 2HG2 THR 16 -1.159 -11.739 -13.901
126 3HG2 THR 16 3HG2 THR 16 -2.031 -10.847 -12.636
127 H CYS 17 H CYS 17 0.693 -7.459 -13.150
128 HA CYS 17 HA CYS 17 3.573 -7.459 -13.948
129 1HB CYS 17 2HB CYS 17 2.984 -5.889 -15.670
130 2HB CYS 17 3HB CYS 17 1.901 -7.281 -15.801
131 H ALA 18 H ALA 18 4.665 -5.412 -13.797
132 HA ALA 18 HA ALA 18 4.290 -4.134 -11.211
133 1HB ALA 18 1HB ALA 18 6.366 -2.956 -11.809
134 2HB ALA 18 2HB ALA 18 6.523 -4.698 -12.091
135 3HB ALA 18 3HB ALA 18 6.272 -3.595 -13.461
136 H ALA 19 H ALA 19 1.998 -3.636 -12.424
137 HA ALA 19 HA ALA 19 2.071 -0.686 -12.847
138 1HB ALA 19 1HB ALA 19 0.445 -0.794 -14.652
139 2HB ALA 19 2HB ALA 19 1.903 -1.697 -15.117
140 3HB ALA 19 3HB ALA 19 0.435 -2.564 -14.606
141 H CYS 20 H CYS 20 -0.142 -3.540 -12.522
142 HA CYS 20 HA CYS 20 -2.231 -2.095 -11.405
143 1HB CYS 20 2HB CYS 20 -1.455 -4.994 -10.802
144 2HB CYS 20 3HB CYS 20 -3.072 -4.277 -10.597
145 H ALA 21 H ALA 21 0.496 -3.606 -9.694
146 HA ALA 21 HA ALA 21 -0.353 -3.014 -7.080
147 1HB ALA 21 1HB ALA 21 1.884 -3.444 -6.408
148 2HB ALA 21 2HB ALA 21 1.517 -4.540 -7.742
149 3HB ALA 21 3HB ALA 21 2.519 -3.100 -8.042
150 H ALA 22 H ALA 22 0.663 -0.756 -9.546
151 HA ALA 22 HA ALA 22 1.411 1.387 -7.698
152 1HB ALA 22 1HB ALA 22 2.161 1.248 -10.120
153 2HB ALA 22 2HB ALA 22 0.479 1.591 -10.588
154 3HB ALA 22 3HB ALA 22 1.392 2.780 -9.651
155 H ARG 23 H ARG 23 -1.444 0.288 -9.556
156 HA ARG 23 HA ARG 23 -3.118 2.549 -9.107
157 1HB ARG 23 2HB ARG 23 -3.818 -0.384 -9.563
158 2HB ARG 23 3HB ARG 23 -4.996 0.924 -9.522
159 1HG ARG 23 2HG ARG 23 -4.081 1.982 -11.454
160 2HG ARG 23 3HG ARG 23 -2.642 0.956 -11.447
161 1HD ARG 23 2HD ARG 23 -3.637 -0.719 -12.546
162 2HD ARG 23 3HD ARG 23 -5.065 -0.718 -11.541
163 HE ARG 23 HE ARG 23 -4.655 0.527 -14.138
164 1HH1 ARG 23 2HH2 ARG 23 -6.541 0.750 -11.187
165 2HH1 ARG 23 1HH2 ARG 23 -7.989 1.359 -11.934
166 1HH2 ARG 23 2HH1 ARG 23 -6.540 1.365 -15.198
167 2HH2 ARG 23 1HH1 ARG 23 -7.961 1.753 -14.286
168 H ILE 24 H ILE 24 -2.778 -0.562 -7.333
169 HA ILE 24 HA ILE 24 -4.715 0.072 -5.406
170 HB ILE 24 HB ILE 24 -3.920 -1.636 -3.992
171 1HG1 ILE 24 2HG1 ILE 24 -1.424 -1.419 -5.595
172 2HG1 ILE 24 3HG1 ILE 24 -1.634 -1.227 -3.840
173 1HG2 ILE 24 1HG2 ILE 24 -5.021 -2.127 -6.274
174 2HG2 ILE 24 2HG2 ILE 24 -3.406 -2.617 -6.823
175 3HG2 ILE 24 3HG2 ILE 24 -4.186 -3.449 -5.458
176 1HD1 ILE 24 1HD1 ILE 24 -2.176 -3.669 -3.690
177 2HD1 ILE 24 2HD1 ILE 24 -1.756 -3.805 -5.416
178 3HD1 ILE 24 3HD1 ILE 24 -0.520 -3.330 -4.244
179 H GLU 25 H GLU 25 -1.175 0.588 -5.134
180 HA GLU 25 HA GLU 25 -1.182 1.959 -2.749
181 1HB GLU 25 2HB GLU 25 0.659 1.422 -4.893
182 2HB GLU 25 3HB GLU 25 0.794 3.146 -4.538
183 1HG GLU 25 2HG GLU 25 2.349 1.593 -3.256
184 2HG GLU 25 3HG GLU 25 1.393 2.688 -2.267
185 H LYS 26 H LYS 26 -1.840 3.372 -5.952
186 HA LYS 26 HA LYS 26 -1.815 6.058 -4.841
187 1HB LYS 26 2HB LYS 26 -2.665 5.042 -7.532
188 2HB LYS 26 3HB LYS 26 -3.053 6.673 -6.979
189 1HG LYS 26 2HG LYS 26 -1.041 6.947 -8.122
190 2HG LYS 26 3HG LYS 26 -0.593 7.042 -6.411
191 1HD LYS 26 2HD LYS 26 0.199 4.670 -6.500
192 2HD LYS 26 3HD LYS 26 -0.435 4.590 -8.137
193 1HE LYS 26 2HE LYS 26 1.897 4.867 -8.427
194 2HE LYS 26 3HE LYS 26 1.210 6.452 -8.775
195 1HZ LYS 26 1HZ LYS 26 1.839 7.105 -6.502
196 2HZ LYS 26 2HZ LYS 26 2.483 5.636 -6.213
197 3HZ LYS 26 3HZ LYS 26 3.138 6.604 -7.366
198 H GLY 27 H GLY 27 -4.443 3.737 -5.695
199 1HA GLY 27 2HA GLY 27 -6.597 5.446 -4.818
200 2HA GLY 27 3HA GLY 27 -6.659 3.687 -4.981
201 H LEU 28 H LEU 28 -4.380 3.257 -3.184
202 HA LEU 28 HA LEU 28 -5.669 2.971 -0.615
203 1HB LEU 28 2HB LEU 28 -4.162 1.430 -1.417
204 2HB LEU 28 3HB LEU 28 -2.863 2.616 -1.570
205 HG LEU 28 HG LEU 28 -4.091 2.234 1.145
206 1HD1 LEU 28 1HD1 LEU 28 -2.337 0.292 -0.407
207 2HD1 LEU 28 2HD1 LEU 28 -2.396 0.282 1.351
208 3HD1 LEU 28 3HD1 LEU 28 -3.891 0.002 0.421
209 1HD2 LEU 28 1HD2 LEU 28 -2.244 3.934 0.544
210 2HD2 LEU 28 2HD2 LEU 28 -1.842 2.820 1.836
211 3HD2 LEU 28 3HD2 LEU 28 -1.195 2.549 0.206
212 H LYS 29 H LYS 29 -3.148 5.224 -1.896
213 HA LYS 29 HA LYS 29 -2.804 6.718 0.412
214 1HB LYS 29 2HB LYS 29 -1.506 6.948 -1.728
215 2HB LYS 29 3HB LYS 29 -2.861 7.872 -2.384
216 1HG LYS 29 2HG LYS 29 -2.316 9.136 0.102
217 2HG LYS 29 3HG LYS 29 -0.748 8.651 -0.447
218 1HD LYS 29 2HD LYS 29 -2.733 10.112 -2.254
219 2HD LYS 29 3HD LYS 29 -1.752 10.994 -1.089
220 1HE LYS 29 2HE LYS 29 0.188 10.785 -2.224
221 2HE LYS 29 3HE LYS 29 -0.153 9.132 -2.784
222 1HZ LYS 29 1HZ LYS 29 -1.261 11.620 -3.884
223 2HZ LYS 29 2HZ LYS 29 -0.016 10.742 -4.505
224 3HZ LYS 29 3HZ LYS 29 -1.537 10.093 -4.464
225 H ARG 30 H ARG 30 -5.658 6.710 -1.649
226 HA ARG 30 HA ARG 30 -6.637 9.214 -0.586
227 1HB ARG 30 2HB ARG 30 -7.415 7.433 -2.685
228 2HB ARG 30 3HB ARG 30 -8.792 7.565 -1.595
229 1HG ARG 30 2HG ARG 30 -8.392 10.117 -1.654
230 2HG ARG 30 3HG ARG 30 -7.212 9.801 -2.944
231 1HD ARG 30 2HD ARG 30 -9.040 8.811 -4.323
232 2HD ARG 30 3HD ARG 30 -10.174 9.117 -2.979
233 HE ARG 30 HE ARG 30 -8.726 11.495 -3.782
234 1HH1 ARG 30 2HH2 ARG 30 -11.483 9.495 -4.681
235 2HH1 ARG 30 1HH2 ARG 30 -12.422 10.796 -5.344
236 1HH2 ARG 30 2HH1 ARG 30 -9.931 13.253 -4.659
237 2HH2 ARG 30 1HH1 ARG 30 -11.493 12.986 -5.353
238 H MET 31 H MET 31 -6.117 6.451 1.148
239 HA MET 31 HA MET 31 -8.470 6.558 2.839
240 1HB MET 31 2HB MET 31 -5.655 5.458 3.139
241 2HB MET 31 3HB MET 31 -6.801 5.347 4.463
242 1HG MET 31 2HG MET 31 -7.479 4.253 1.732
243 2HG MET 31 3HG MET 31 -6.491 3.364 2.889
244 1HE MET 31 1HE MET 31 -10.085 4.387 1.925
245 2HE MET 31 2HE MET 31 -11.037 3.831 3.321
246 3HE MET 31 3HE MET 31 -10.121 5.333 3.440
247 HA PRO 32 HA PRO 32 -7.257 10.011 5.414
248 1HB PRO 32 2HB PRO 32 -8.081 9.222 7.915
249 2HB PRO 32 3HB PRO 32 -9.207 9.720 6.621
250 1HG PRO 32 2HG PRO 32 -8.388 6.900 7.359
251 2HG PRO 32 3HG PRO 32 -10.048 7.528 7.126
252 1HD PRO 32 2HD PRO 32 -8.756 6.206 5.155
253 2HD PRO 32 3HD PRO 32 -9.751 7.628 4.755
254 H GLY 33 H GLY 33 -5.608 10.574 6.996
255 1HA GLY 33 2HA GLY 33 -3.663 10.375 8.109
256 2HA GLY 33 3HA GLY 33 -3.992 8.657 8.321
257 H VAL 34 H VAL 34 -4.054 8.300 5.245
258 HA VAL 34 HA VAL 34 -1.181 8.018 4.868
259 HB VAL 34 HB VAL 34 -3.359 7.545 2.827
260 1HG1 VAL 34 1HG1 VAL 34 -1.109 7.576 1.842
261 2HG1 VAL 34 2HG1 VAL 34 -0.450 6.610 3.165
262 3HG1 VAL 34 3HG1 VAL 34 -1.559 5.871 2.019
263 1HG2 VAL 34 1HG2 VAL 34 -3.923 6.177 4.757
264 2HG2 VAL 34 2HG2 VAL 34 -3.202 5.144 3.522
265 3HG2 VAL 34 3HG2 VAL 34 -2.238 5.649 4.930
266 H THR 35 H THR 35 0.118 9.178 3.435
267 HA THR 35 HA THR 35 -1.097 11.653 2.269
268 HB THR 35 HB THR 35 0.834 11.383 4.447
269 HG1 THR 35 1HG THR 35 -1.268 12.347 4.466
270 1HG2 THR 35 1HG2 THR 35 1.990 13.485 3.933
271 2HG2 THR 35 2HG2 THR 35 2.457 12.171 2.844
272 3HG2 THR 35 3HG2 THR 35 1.338 13.448 2.279
273 H ASP 36 H ASP 36 1.618 9.267 2.012
274 HA ASP 36 HA ASP 36 1.151 9.607 -0.758
275 1HB ASP 36 2HB ASP 36 3.316 11.090 -0.033
276 2HB ASP 36 3HB ASP 36 4.088 9.548 -0.438
277 H ALA 37 H ALA 37 2.387 7.983 -2.065
278 HA ALA 37 HA ALA 37 3.044 5.573 -0.634
279 1HB ALA 37 1HB ALA 37 1.183 4.227 -0.864
280 2HB ALA 37 2HB ALA 37 0.412 5.767 -0.549
281 3HB ALA 37 3HB ALA 37 0.509 5.178 -2.219
282 H ASN 38 H ASN 38 4.094 3.975 -1.820
283 HA ASN 38 HA ASN 38 4.649 4.579 -4.668
284 1HB ASN 38 2HB ASN 38 7.194 4.435 -3.448
285 2HB ASN 38 3HB ASN 38 6.442 5.812 -4.224
286 1HD2 ASN 38 1HD2 ASN 38 5.962 4.241 -0.979
287 2HD2 ASN 38 2HD2 ASN 38 6.267 5.738 -0.100
288 H VAL 39 H VAL 39 4.324 2.544 -5.424
289 HA VAL 39 HA VAL 39 5.094 0.269 -3.790
290 HB VAL 39 HB VAL 39 3.064 0.467 -5.347
291 1HG1 VAL 39 1HG1 VAL 39 4.282 1.160 -7.405
292 2HG1 VAL 39 2HG1 VAL 39 5.064 -0.439 -7.454
293 3HG1 VAL 39 3HG1 VAL 39 3.315 -0.307 -7.616
294 1HG2 VAL 39 1HG2 VAL 39 4.885 -1.835 -4.846
295 2HG2 VAL 39 2HG2 VAL 39 3.217 -1.542 -4.321
296 3HG2 VAL 39 3HG2 VAL 39 3.543 -2.070 -5.981
297 H ASN 40 H ASN 40 7.052 -0.872 -3.958
298 HA ASN 40 HA ASN 40 9.064 0.089 -5.954
299 1HB ASN 40 2HB ASN 40 9.653 0.674 -3.665
300 2HB ASN 40 3HB ASN 40 9.405 -0.993 -3.149
301 1HD2 ASN 40 1HD2 ASN 40 11.729 -0.609 -2.371
302 2HD2 ASN 40 2HD2 ASN 40 13.002 -0.950 -3.530
303 H LEU 41 H LEU 41 7.341 -1.446 -6.990
304 HA LEU 41 HA LEU 41 7.866 -4.296 -6.739
305 1HB LEU 41 2HB LEU 41 5.929 -2.571 -8.017
306 2HB LEU 41 3HB LEU 41 6.639 -3.573 -9.262
307 HG LEU 41 HG LEU 41 4.555 -4.466 -8.205
308 1HD1 LEU 41 1HD1 LEU 41 7.008 -6.248 -7.871
309 2HD1 LEU 41 2HD1 LEU 41 5.325 -6.793 -7.994
310 3HD1 LEU 41 3HD1 LEU 41 6.095 -5.983 -9.372
311 1HD2 LEU 41 1HD2 LEU 41 4.411 -5.264 -6.025
312 2HD2 LEU 41 2HD2 LEU 41 6.157 -5.276 -5.759
313 3HD2 LEU 41 3HD2 LEU 41 5.288 -3.738 -5.824
314 H ALA 42 H ALA 42 9.417 -1.694 -8.274
315 HA ALA 42 HA ALA 42 10.918 -2.785 -10.335
316 1HB ALA 42 1HB ALA 42 11.198 -0.474 -9.454
317 2HB ALA 42 2HB ALA 42 11.973 -1.148 -7.995
318 3HB ALA 42 3HB ALA 42 12.746 -1.344 -9.576
319 H THR 43 H THR 43 11.151 -3.493 -6.828
320 HA THR 43 HA THR 43 12.877 -5.792 -7.590
321 HB THR 43 HB THR 43 14.122 -4.340 -6.182
322 HG1 THR 43 1HG THR 43 14.287 -6.658 -6.067
323 1HG2 THR 43 1HG2 THR 43 13.667 -3.898 -3.895
324 2HG2 THR 43 2HG2 THR 43 12.216 -3.390 -4.781
325 3HG2 THR 43 3HG2 THR 43 12.243 -4.934 -3.885
326 H GLU 44 H GLU 44 10.522 -5.013 -4.996
327 HA GLU 44 HA GLU 44 8.407 -6.650 -5.432
328 1HB GLU 44 2HB GLU 44 10.779 -8.319 -4.791
329 2HB GLU 44 3HB GLU 44 9.396 -8.680 -3.803
330 1HG GLU 44 2HG GLU 44 9.038 -8.581 -6.803
331 2HG GLU 44 3HG GLU 44 9.630 -10.012 -5.956
332 H THR 45 H THR 45 8.912 -4.266 -4.088
333 HA THR 45 HA THR 45 7.977 -4.958 -1.382
334 HB THR 45 HB THR 45 9.887 -2.653 -1.849
335 HG1 THR 45 1HG THR 45 11.621 -4.128 -1.410
336 1HG2 THR 45 1HG2 THR 45 10.582 -3.310 0.431
337 2HG2 THR 45 2HG2 THR 45 8.826 -3.035 0.326
338 3HG2 THR 45 3HG2 THR 45 9.468 -4.701 0.328
339 H VAL 46 H VAL 46 6.791 -3.159 -0.365
340 HA VAL 46 HA VAL 46 5.947 -0.993 -2.230
341 HB VAL 46 HB VAL 46 4.135 -2.556 -2.257
342 1HG1 VAL 46 1HG1 VAL 46 2.939 -3.238 -0.181
343 2HG1 VAL 46 2HG1 VAL 46 4.556 -3.932 -0.281
344 3HG1 VAL 46 3HG1 VAL 46 4.248 -2.530 0.780
345 1HG2 VAL 46 1HG2 VAL 46 2.339 -1.287 -1.303
346 2HG2 VAL 46 2HG2 VAL 46 3.424 -0.353 -0.270
347 3HG2 VAL 46 3HG2 VAL 46 3.514 -0.173 -2.041
348 H ASN 47 H ASN 47 5.724 1.088 -1.243
349 HA ASN 47 HA ASN 47 6.324 1.160 1.649
350 1HB ASN 47 2HB ASN 47 7.642 2.705 -0.624
351 2HB ASN 47 3HB ASN 47 7.510 3.395 0.997
352 1HD2 ASN 47 1HD2 ASN 47 8.241 1.842 2.853
353 2HD2 ASN 47 2HD2 ASN 47 9.852 1.213 2.546
354 H VAL 48 H VAL 48 5.099 2.733 2.749
355 HA VAL 48 HA VAL 48 3.244 4.351 1.143
356 HB VAL 48 HB VAL 48 1.995 2.340 1.393
357 1HG1 VAL 48 1HG1 VAL 48 1.453 1.381 3.632
358 2HG1 VAL 48 2HG1 VAL 48 3.136 1.169 3.134
359 3HG1 VAL 48 3HG1 VAL 48 2.724 2.408 4.327
360 1HG2 VAL 48 1HG2 VAL 48 0.107 3.146 2.829
361 2HG2 VAL 48 2HG2 VAL 48 1.099 4.522 3.316
362 3HG2 VAL 48 3HG2 VAL 48 0.676 4.305 1.614
363 H ILE 49 H ILE 49 3.029 6.283 2.012
364 HA ILE 49 HA ILE 49 4.647 6.845 4.396
365 HB ILE 49 HB ILE 49 3.784 8.815 2.243
366 1HG1 ILE 49 2HG1 ILE 49 4.975 7.158 0.997
367 2HG1 ILE 49 3HG1 ILE 49 5.956 8.604 1.186
368 1HG2 ILE 49 1HG2 ILE 49 5.975 8.861 4.348
369 2HG2 ILE 49 2HG2 ILE 49 5.752 10.078 3.072
370 3HG2 ILE 49 3HG2 ILE 49 4.502 9.841 4.301
371 1HD1 ILE 49 1HD1 ILE 49 7.352 6.638 1.471
372 2HD1 ILE 49 2HD1 ILE 49 7.236 7.498 3.010
373 3HD1 ILE 49 3HD1 ILE 49 6.296 6.010 2.747
374 H TYR 50 H TYR 50 3.206 6.864 6.133
375 HA TYR 50 HA TYR 50 0.724 8.477 5.910
376 1HB TYR 50 2HB TYR 50 -0.678 6.731 6.775
377 2HB TYR 50 3HB TYR 50 0.071 6.175 5.303
378 HD1 TYR 50 HD1 TYR 50 -0.268 5.670 8.900
379 HD2 TYR 50 HD2 TYR 50 1.816 4.366 5.376
380 HE1 TYR 50 HE1 TYR 50 0.471 3.616 10.070
381 HE2 TYR 50 HE2 TYR 50 2.238 2.165 6.462
382 HH TYR 50 HH TYR 50 1.400 1.542 9.857
383 H ASP 51 H ASP 51 -0.376 8.605 7.994
384 HA ASP 51 HA ASP 51 1.663 9.100 10.117
385 1HB ASP 51 2HB ASP 51 0.016 10.868 9.670
386 2HB ASP 51 3HB ASP 51 -1.270 9.801 10.224
387 HA PRO 52 HA PRO 52 0.214 5.051 11.625
388 1HB PRO 52 2HB PRO 52 2.204 4.396 13.324
389 2HB PRO 52 3HB PRO 52 2.430 4.392 11.556
390 1HG PRO 52 2HG PRO 52 3.103 6.651 13.483
391 2HG PRO 52 3HG PRO 52 4.184 5.904 12.268
392 1HD PRO 52 2HD PRO 52 2.803 8.190 11.766
393 2HD PRO 52 3HD PRO 52 3.049 6.956 10.491
394 H ALA 53 H ALA 53 -0.051 8.059 13.109
395 HA ALA 53 HA ALA 53 -1.047 7.006 15.673
396 1HB ALA 53 1HB ALA 53 0.043 9.261 15.496
397 2HB ALA 53 2HB ALA 53 -1.241 9.751 14.365
398 3HB ALA 53 3HB ALA 53 -1.649 9.337 16.041
399 H GLU 54 H GLU 54 -2.016 7.819 12.348
400 HA GLU 54 HA GLU 54 -4.834 7.809 13.181
401 1HB GLU 54 2HB GLU 54 -3.869 9.925 12.247
402 2HB GLU 54 3HB GLU 54 -3.739 9.124 10.676
403 1HG GLU 54 2HG GLU 54 -6.204 8.736 10.704
404 2HG GLU 54 3HG GLU 54 -6.299 9.452 12.323
405 H THR 55 H THR 55 -2.816 6.948 10.354
406 HA THR 55 HA THR 55 -4.384 4.525 10.038
407 HB THR 55 HB THR 55 -2.640 4.304 7.892
408 HG1 THR 55 1HG THR 55 -3.843 6.674 7.528
409 1HG2 THR 55 1HG2 THR 55 -5.483 5.440 8.169
410 2HG2 THR 55 2HG2 THR 55 -4.737 4.815 6.672
411 3HG2 THR 55 3HG2 THR 55 -5.047 3.704 8.033
412 H GLY 56 H GLY 56 -2.667 2.791 9.126
413 1HA GLY 56 2HA GLY 56 -0.678 1.904 10.906
414 2HA GLY 56 3HA GLY 56 -2.303 1.448 11.481
415 H THR 57 H THR 57 -2.282 -0.710 10.798
416 HA THR 57 HA THR 57 -1.582 -1.536 8.072
417 HB THR 57 HB THR 57 -2.337 -3.757 9.158
418 HG1 THR 57 1HG THR 57 -2.434 -3.621 11.453
419 1HG2 THR 57 1HG2 THR 57 0.058 -3.079 8.930
420 2HG2 THR 57 2HG2 THR 57 -0.038 -2.169 10.449
421 3HG2 THR 57 3HG2 THR 57 -0.210 -3.938 10.457
422 H ALA 58 H ALA 58 -4.274 -1.159 10.325
423 HA ALA 58 HA ALA 58 -6.234 -2.470 9.179
424 1HB ALA 58 1HB ALA 58 -6.576 0.257 10.470
425 2HB ALA 58 2HB ALA 58 -7.856 -0.959 10.266
426 3HB ALA 58 3HB ALA 58 -6.466 -1.301 11.314
427 H ALA 59 H ALA 59 -5.813 0.928 8.306
428 HA ALA 59 HA ALA 59 -8.253 0.709 6.665
429 1HB ALA 59 1HB ALA 59 -7.333 2.837 7.872
430 2HB ALA 59 2HB ALA 59 -6.360 3.025 6.379
431 3HB ALA 59 3HB ALA 59 -8.127 2.985 6.303
432 H ILE 60 H ILE 60 -4.808 0.671 6.190
433 HA ILE 60 HA ILE 60 -4.690 0.584 3.363
434 HB ILE 60 HB ILE 60 -2.913 -0.179 5.704
435 1HG1 ILE 60 2HG1 ILE 60 -1.349 1.168 4.265
436 2HG1 ILE 60 3HG1 ILE 60 -2.721 1.370 3.150
437 1HG2 ILE 60 1HG2 ILE 60 -2.545 -2.200 4.445
438 2HG2 ILE 60 2HG2 ILE 60 -2.441 -1.305 2.917
439 3HG2 ILE 60 3HG2 ILE 60 -1.190 -1.119 4.160
440 1HD1 ILE 60 1HD1 ILE 60 -2.239 3.281 4.787
441 2HD1 ILE 60 2HD1 ILE 60 -3.913 2.701 4.792
442 3HD1 ILE 60 3HD1 ILE 60 -2.788 2.213 6.085
443 H GLN 61 H GLN 61 -4.888 -2.089 5.770
444 HA GLN 61 HA GLN 61 -4.860 -4.082 3.807
445 1HB GLN 61 2HB GLN 61 -4.683 -4.035 6.481
446 2HB GLN 61 3HB GLN 61 -6.295 -4.724 6.322
447 1HG GLN 61 2HG GLN 61 -5.452 -6.729 5.621
448 2HG GLN 61 3HG GLN 61 -4.289 -6.005 4.519
449 1HE2 GLN 61 1HE2 GLN 61 -2.491 -4.631 5.828
450 2HE2 GLN 61 2HE2 GLN 61 -1.720 -5.612 7.069
451 H GLU 62 H GLU 62 -7.614 -2.513 5.482
452 HA GLU 62 HA GLU 62 -9.818 -3.692 4.314
453 1HB GLU 62 2HB GLU 62 -9.117 -0.957 5.317
454 2HB GLU 62 3HB GLU 62 -10.488 -1.004 4.225
455 1HG GLU 62 2HG GLU 62 -11.374 -1.192 6.396
456 2HG GLU 62 3HG GLU 62 -11.501 -2.813 5.706
457 H LYS 63 H LYS 63 -7.987 -0.931 2.858
458 HA LYS 63 HA LYS 63 -9.481 -1.021 0.429
459 1HB LYS 63 2HB LYS 63 -7.026 0.346 1.516
460 2HB LYS 63 3HB LYS 63 -7.287 0.359 -0.201
461 1HG LYS 63 2HG LYS 63 -9.418 1.168 1.814
462 2HG LYS 63 3HG LYS 63 -8.234 2.296 1.149
463 1HD LYS 63 2HD LYS 63 -10.196 0.780 -0.603
464 2HD LYS 63 3HD LYS 63 -10.496 2.378 0.080
465 1HE LYS 63 2HE LYS 63 -7.850 2.264 -1.220
466 2HE LYS 63 3HE LYS 63 -9.107 1.760 -2.345
467 1HZ LYS 63 1HZ LYS 63 -8.506 4.190 -2.159
468 2HZ LYS 63 2HZ LYS 63 -10.124 3.829 -2.155
469 3HZ LYS 63 3HZ LYS 63 -9.331 4.225 -0.759
470 H ILE 64 H ILE 64 -6.341 -2.353 1.405
471 HA ILE 64 HA ILE 64 -5.240 -3.079 -0.992
472 HB ILE 64 HB ILE 64 -4.891 -3.686 1.770
473 1HG1 ILE 64 2HG1 ILE 64 -3.435 -2.321 0.271
474 2HG1 ILE 64 3HG1 ILE 64 -2.624 -3.479 1.320
475 1HG2 ILE 64 1HG2 ILE 64 -4.364 -6.068 0.019
476 2HG2 ILE 64 2HG2 ILE 64 -3.566 -5.756 1.575
477 3HG2 ILE 64 3HG2 ILE 64 -5.305 -5.975 1.523
478 1HD1 ILE 64 1HD1 ILE 64 -2.393 -5.069 -0.535
479 2HD1 ILE 64 2HD1 ILE 64 -3.258 -3.954 -1.613
480 3HD1 ILE 64 3HD1 ILE 64 -1.674 -3.500 -0.941
481 H GLU 65 H GLU 65 -7.361 -4.979 1.218
482 HA GLU 65 HA GLU 65 -7.889 -7.231 -0.418
483 1HB GLU 65 2HB GLU 65 -9.366 -5.895 1.883
484 2HB GLU 65 3HB GLU 65 -9.967 -7.366 1.112
485 1HG GLU 65 2HG GLU 65 -7.147 -7.221 2.194
486 2HG GLU 65 3HG GLU 65 -8.523 -7.646 3.215
487 H LYS 66 H LYS 66 -9.979 -4.327 0.161
488 HA LYS 66 HA LYS 66 -12.017 -5.051 -1.641
489 1HB LYS 66 2HB LYS 66 -10.996 -2.407 -0.590
490 2HB LYS 66 3HB LYS 66 -12.265 -2.437 -1.807
491 1HG LYS 66 2HG LYS 66 -12.787 -4.345 0.392
492 2HG LYS 66 3HG LYS 66 -12.622 -2.698 0.984
493 1HD LYS 66 2HD LYS 66 -14.384 -3.426 -1.400
494 2HD LYS 66 3HD LYS 66 -14.983 -3.460 0.266
495 1HE LYS 66 2HE LYS 66 -14.585 -1.107 0.597
496 2HE LYS 66 3HE LYS 66 -13.682 -0.954 -0.913
497 1HZ LYS 66 1HZ LYS 66 -15.900 -0.114 -1.116
498 2HZ LYS 66 2HZ LYS 66 -15.684 -1.393 -2.124
499 3HZ LYS 66 3HZ LYS 66 -16.553 -1.574 -0.735
500 H LEU 67 H LEU 67 -8.962 -3.424 -2.402
501 HA LEU 67 HA LEU 67 -9.644 -2.819 -5.146
502 1HB LEU 67 2HB LEU 67 -7.090 -2.899 -3.521
503 2HB LEU 67 3HB LEU 67 -7.050 -2.615 -5.259
504 HG LEU 67 HG LEU 67 -8.936 -0.938 -3.594
505 1HD1 LEU 67 1HD1 LEU 67 -5.933 -0.595 -3.759
506 2HD1 LEU 67 2HD1 LEU 67 -7.025 0.756 -3.407
507 3HD1 LEU 67 3HD1 LEU 67 -6.935 -0.638 -2.320
508 1HD2 LEU 67 1HD2 LEU 67 -7.234 -0.357 -6.066
509 2HD2 LEU 67 2HD2 LEU 67 -8.946 -0.823 -6.103
510 3HD2 LEU 67 3HD2 LEU 67 -8.463 0.710 -5.360
511 H GLY 68 H GLY 68 -8.807 -5.770 -3.555
512 1HA GLY 68 2HA GLY 68 -8.950 -7.865 -4.519
513 2HA GLY 68 3HA GLY 68 -8.751 -7.185 -6.141
514 H TYR 69 H TYR 69 -6.817 -6.947 -3.079
515 HA TYR 69 HA TYR 69 -4.470 -8.201 -4.382
516 1HB TYR 69 2HB TYR 69 -4.906 -5.331 -4.007
517 2HB TYR 69 3HB TYR 69 -3.581 -5.869 -2.998
518 HD1 TYR 69 HD1 TYR 69 -1.502 -6.687 -3.933
519 HD2 TYR 69 HD2 TYR 69 -4.835 -5.716 -6.490
520 HE1 TYR 69 HE1 TYR 69 0.001 -6.619 -5.877
521 HE2 TYR 69 HE2 TYR 69 -3.348 -5.699 -8.435
522 HH TYR 69 HH TYR 69 -1.198 -6.193 -9.196
523 H HIS 70 H HIS 70 -2.671 -8.392 -2.711
524 HA HIS 70 HA HIS 70 -3.612 -8.361 0.099
525 1HB HIS 70 2HB HIS 70 -3.997 -10.630 -0.923
526 2HB HIS 70 3HB HIS 70 -2.254 -10.775 -1.150
527 HD1 HIS 70 1HD HIS 70 -1.202 -9.883 1.738
528 HD2 HIS 70 2HD HIS 70 -4.631 -12.220 0.984
529 HE1 HIS 70 1HE HIS 70 -1.598 -11.267 3.803
530 H VAL 71 H VAL 71 -2.106 -7.308 1.259
531 HA VAL 71 HA VAL 71 0.685 -7.062 0.261
532 HB VAL 71 HB VAL 71 -0.655 -5.013 0.933
533 1HG1 VAL 71 1HG1 VAL 71 -1.748 -6.000 2.999
534 2HG1 VAL 71 2HG1 VAL 71 -0.159 -5.959 3.786
535 3HG1 VAL 71 3HG1 VAL 71 -0.925 -4.452 3.259
536 1HG2 VAL 71 1HG2 VAL 71 1.750 -4.982 0.740
537 2HG2 VAL 71 2HG2 VAL 71 1.223 -3.956 2.083
538 3HG2 VAL 71 3HG2 VAL 71 1.919 -5.559 2.414
539 H VAL 72 H VAL 72 2.408 -7.889 1.647
540 HA VAL 72 HA VAL 72 1.490 -9.654 3.888
541 HB VAL 72 HB VAL 72 3.654 -10.301 1.972
542 1HG1 VAL 72 1HG1 VAL 72 3.642 -12.520 3.081
543 2HG1 VAL 72 2HG1 VAL 72 4.083 -11.227 4.194
544 3HG1 VAL 72 3HG1 VAL 72 2.445 -11.915 4.244
545 1HG2 VAL 72 1HG2 VAL 72 0.865 -11.520 2.232
546 2HG2 VAL 72 2HG2 VAL 72 1.460 -10.588 0.839
547 3HG2 VAL 72 3HG2 VAL 72 2.160 -12.167 1.208
548 H ILE 73 H ILE 73 2.768 -9.581 5.657
549 HA ILE 73 HA ILE 73 4.752 -7.350 5.735
550 HB ILE 73 HB ILE 73 2.865 -8.248 7.909
551 1HG1 ILE 73 2HG1 ILE 73 2.298 -5.662 7.611
552 2HG1 ILE 73 3HG1 ILE 73 2.936 -5.912 5.984
553 1HG2 ILE 73 1HG2 ILE 73 3.731 -6.383 9.178
554 2HG2 ILE 73 2HG2 ILE 73 5.071 -7.457 8.791
555 3HG2 ILE 73 3HG2 ILE 73 4.865 -5.955 7.872
556 1HD1 ILE 73 1HD1 ILE 73 0.461 -6.145 6.210
557 2HD1 ILE 73 2HD1 ILE 73 1.227 -7.623 5.594
558 3HD1 ILE 73 3HD1 ILE 73 0.729 -7.523 7.307
559 H GLU 74 H GLU 74 6.376 -9.046 5.031
560 HA GLU 74 HA GLU 74 7.140 -10.959 6.926
561 1HB GLU 74 2HB GLU 74 8.446 -9.778 4.461
562 2HB GLU 74 3HB GLU 74 9.146 -11.068 5.417
563 1HG GLU 74 2HG GLU 74 7.040 -12.427 5.034
564 2HG GLU 74 3HG GLU 74 6.513 -11.183 3.882
565 H GLY 75 H GLY 75 7.278 -7.789 7.096
566 1HA GLY 75 2HA GLY 75 10.084 -7.317 7.853
567 2HA GLY 75 3HA GLY 75 8.800 -6.127 7.568
568 H ARG 76 H ARG 76 6.998 -7.647 9.550
569 HA ARG 76 HA ARG 76 8.123 -6.857 12.103
570 1HB ARG 76 2HB ARG 76 7.561 -4.691 10.958
571 2HB ARG 76 3HB ARG 76 5.882 -5.233 10.792
572 1HG ARG 76 2HG ARG 76 5.510 -5.169 13.143
573 2HG ARG 76 3HG ARG 76 7.247 -5.182 13.498
574 1HD ARG 76 2HD ARG 76 7.466 -2.953 12.447
575 2HD ARG 76 3HD ARG 76 5.694 -2.871 12.258
576 HE ARG 76 HE ARG 76 5.909 -3.443 14.883
577 1HH1 ARG 76 2HH2 ARG 76 7.482 -0.962 12.940
578 2HH1 ARG 76 1HH2 ARG 76 7.914 0.060 14.275
579 1HH2 ARG 76 2HH1 ARG 76 6.410 -2.094 16.689
580 2HH2 ARG 76 1HH1 ARG 76 7.229 -0.585 16.466
Start of MODEL 11
1 1H MET 1 H1 MET 1 -3.461 14.662 17.191
2 2H MET 1 H2 MET 1 -4.918 15.475 17.147
3 3H MET 1 H3 MET 1 -4.093 15.108 15.755
4 HA MET 1 HA MET 1 -3.600 17.364 16.141
5 1HB MET 1 2HB MET 1 -3.005 16.370 18.964
6 2HB MET 1 3HB MET 1 -2.455 17.935 18.355
7 1HG MET 1 2HG MET 1 -4.694 18.753 18.108
8 2HG MET 1 3HG MET 1 -5.392 17.154 18.372
9 1HE MET 1 1HE MET 1 -3.512 19.633 21.785
10 2HE MET 1 2HE MET 1 -2.497 18.832 20.569
11 3HE MET 1 3HE MET 1 -3.559 20.187 20.096
12 H LEU 2 H LEU 2 -1.485 17.994 15.483
13 HA LEU 2 HA LEU 2 0.504 17.688 14.535
14 1HB LEU 2 2HB LEU 2 0.982 17.916 17.051
15 2HB LEU 2 3HB LEU 2 1.305 16.184 17.036
16 HG LEU 2 HG LEU 2 2.823 16.934 14.881
17 1HD1 LEU 2 1HD1 LEU 2 2.163 19.339 15.140
18 2HD1 LEU 2 2HD1 LEU 2 2.904 19.342 16.754
19 3HD1 LEU 2 3HD1 LEU 2 3.909 19.082 15.314
20 1HD2 LEU 2 1HD2 LEU 2 4.768 16.983 16.380
21 2HD2 LEU 2 2HD2 LEU 2 3.689 17.132 17.788
22 3HD2 LEU 2 3HD2 LEU 2 3.654 15.664 16.782
23 H SER 3 H SER 3 -0.355 16.269 12.837
24 HA SER 3 HA SER 3 -0.269 13.475 12.992
25 1HB SER 3 2HB SER 3 -0.051 15.145 10.459
26 2HB SER 3 3HB SER 3 -0.904 13.618 10.706
27 HG SER 3 HG SER 3 -2.313 14.750 12.125
28 H GLU 4 H GLU 4 1.593 12.422 13.373
29 HA GLU 4 HA GLU 4 4.186 13.135 12.291
30 1HB GLU 4 2HB GLU 4 3.162 10.985 13.955
31 2HB GLU 4 3HB GLU 4 4.219 10.355 12.727
32 1HG GLU 4 2HG GLU 4 5.653 12.536 13.655
33 2HG GLU 4 3HG GLU 4 4.795 12.006 15.081
34 H GLN 5 H GLN 5 5.337 11.418 10.848
35 HA GLN 5 HA GLN 5 3.577 10.001 8.970
36 1HB GLN 5 2HB GLN 5 5.979 11.714 8.322
37 2HB GLN 5 3HB GLN 5 5.287 10.625 7.146
38 1HG GLN 5 2HG GLN 5 3.662 12.879 8.474
39 2HG GLN 5 3HG GLN 5 4.675 13.108 7.085
40 1HE2 GLN 5 1HE2 GLN 5 3.414 9.939 6.873
41 2HE2 GLN 5 2HE2 GLN 5 2.110 10.302 5.777
42 H LYS 6 H LYS 6 4.481 7.975 8.470
43 HA LYS 6 HA LYS 6 7.339 7.582 8.786
44 1HB LYS 6 2HB LYS 6 5.418 5.677 10.168
45 2HB LYS 6 3HB LYS 6 7.153 5.424 9.931
46 1HG LYS 6 2HG LYS 6 7.573 7.591 11.173
47 2HG LYS 6 3HG LYS 6 5.856 7.604 11.610
48 1HD LYS 6 2HD LYS 6 6.291 5.210 12.552
49 2HD LYS 6 3HD LYS 6 8.007 5.587 12.383
50 1HE LYS 6 2HE LYS 6 5.919 6.925 14.168
51 2HE LYS 6 3HE LYS 6 7.387 6.084 14.671
52 1HZ LYS 6 1HZ LYS 6 7.300 8.672 13.206
53 2HZ LYS 6 2HZ LYS 6 7.412 8.580 14.760
54 3HZ LYS 6 3HZ LYS 6 8.658 7.968 13.823
55 H GLU 7 H GLU 7 8.127 5.866 7.622
56 HA GLU 7 HA GLU 7 6.600 5.366 5.152
57 1HB GLU 7 2HB GLU 7 9.609 5.255 5.506
58 2HB GLU 7 3HB GLU 7 8.607 5.491 4.073
59 1HG GLU 7 2HG GLU 7 9.529 7.609 4.513
60 2HG GLU 7 3HG GLU 7 7.929 7.755 5.259
61 H ILE 8 H ILE 8 5.629 3.348 5.771
62 HA ILE 8 HA ILE 8 7.347 1.289 6.916
63 HB ILE 8 HB ILE 8 4.480 1.173 6.180
64 1HG1 ILE 8 2HG1 ILE 8 5.987 2.426 8.490
65 2HG1 ILE 8 3HG1 ILE 8 4.456 2.923 7.763
66 1HG2 ILE 8 1HG2 ILE 8 4.544 -0.658 7.893
67 2HG2 ILE 8 2HG2 ILE 8 5.496 -0.944 6.452
68 3HG2 ILE 8 3HG2 ILE 8 6.315 -0.409 7.951
69 1HD1 ILE 8 1HD1 ILE 8 4.995 0.704 9.762
70 2HD1 ILE 8 2HD1 ILE 8 4.066 2.192 10.020
71 3HD1 ILE 8 3HD1 ILE 8 3.419 0.918 8.961
72 H ALA 9 H ALA 9 7.400 -0.810 5.824
73 HA ALA 9 HA ALA 9 7.368 -0.742 2.861
74 1HB ALA 9 1HB ALA 9 9.535 -1.943 4.622
75 2HB ALA 9 2HB ALA 9 9.471 -2.001 2.847
76 3HB ALA 9 3HB ALA 9 9.726 -0.454 3.685
77 H MET 10 H MET 10 6.378 -2.630 2.059
78 HA MET 10 HA MET 10 6.249 -5.020 3.828
79 1HB MET 10 2HB MET 10 3.808 -4.021 2.321
80 2HB MET 10 3HB MET 10 3.956 -5.408 3.395
81 1HG MET 10 2HG MET 10 2.785 -3.892 4.619
82 2HG MET 10 3HG MET 10 4.412 -3.742 5.288
83 1HE MET 10 1HE MET 10 1.619 -1.831 5.365
84 2HE MET 10 2HE MET 10 3.026 -1.708 6.443
85 3HE MET 10 3HE MET 10 2.451 -0.273 5.557
86 H GLN 11 H GLN 11 5.347 -6.904 2.515
87 HA GLN 11 HA GLN 11 6.597 -6.999 -0.190
88 1HB GLN 11 2HB GLN 11 5.774 -8.984 1.934
89 2HB GLN 11 3HB GLN 11 5.693 -9.505 0.257
90 1HG GLN 11 2HG GLN 11 8.248 -8.145 1.057
91 2HG GLN 11 3HG GLN 11 7.897 -9.695 1.822
92 1HE2 GLN 11 1HE2 GLN 11 7.927 -8.196 -1.553
93 2HE2 GLN 11 2HE2 GLN 11 8.319 -9.725 -2.268
94 H VAL 12 H VAL 12 5.264 -8.002 -1.899
95 HA VAL 12 HA VAL 12 2.349 -7.367 -1.643
96 HB VAL 12 HB VAL 12 4.165 -7.076 -4.076
97 1HG1 VAL 12 1HG1 VAL 12 1.197 -6.496 -3.674
98 2HG1 VAL 12 2HG1 VAL 12 2.150 -5.980 -5.082
99 3HG1 VAL 12 3HG1 VAL 12 1.904 -7.699 -4.777
100 1HG2 VAL 12 1HG2 VAL 12 4.591 -5.262 -2.485
101 2HG2 VAL 12 2HG2 VAL 12 3.623 -4.637 -3.821
102 3HG2 VAL 12 3HG2 VAL 12 2.844 -5.003 -2.273
103 H SER 13 H SER 13 0.927 -8.879 -2.663
104 HA SER 13 HA SER 13 2.039 -11.158 -4.129
105 1HB SER 13 2HB SER 13 0.514 -11.410 -1.496
106 2HB SER 13 3HB SER 13 0.710 -12.748 -2.643
107 HG SER 13 HG SER 13 3.062 -11.435 -2.031
108 H GLY 14 H GLY 14 0.026 -12.517 -4.892
109 1HA GLY 14 2HA GLY 14 -2.066 -12.595 -5.862
110 2HA GLY 14 3HA GLY 14 -2.477 -11.024 -5.169
111 H MET 15 H MET 15 -0.259 -9.550 -6.208
112 HA MET 15 HA MET 15 -1.118 -8.557 -8.556
113 1HB MET 15 2HB MET 15 0.986 -7.429 -8.735
114 2HB MET 15 3HB MET 15 0.598 -7.640 -7.033
115 1HG MET 15 2HG MET 15 2.867 -8.055 -7.136
116 2HG MET 15 3HG MET 15 2.149 -9.660 -7.023
117 1HE MET 15 1HE MET 15 4.065 -7.883 -10.853
118 2HE MET 15 2HE MET 15 2.379 -7.529 -10.442
119 3HE MET 15 3HE MET 15 3.679 -6.940 -9.394
120 H THR 16 H THR 16 -0.461 -8.549 -10.737
121 HA THR 16 HA THR 16 0.847 -11.028 -11.797
122 HB THR 16 HB THR 16 -0.437 -10.326 -13.925
123 HG1 THR 16 1HG THR 16 -2.232 -9.169 -12.087
124 1HG2 THR 16 1HG2 THR 16 -1.005 -12.352 -12.683
125 2HG2 THR 16 2HG2 THR 16 -1.974 -11.421 -11.523
126 3HG2 THR 16 3HG2 THR 16 -2.483 -11.539 -13.226
127 H CYS 17 H CYS 17 0.032 -7.748 -13.010
128 HA CYS 17 HA CYS 17 2.833 -7.519 -13.965
129 1HB CYS 17 2HB CYS 17 2.128 -6.046 -15.588
130 2HB CYS 17 3HB CYS 17 0.868 -7.285 -15.553
131 H ALA 18 H ALA 18 4.112 -5.717 -13.600
132 HA ALA 18 HA ALA 18 3.762 -4.431 -11.002
133 1HB ALA 18 1HB ALA 18 5.907 -4.112 -13.141
134 2HB ALA 18 2HB ALA 18 5.986 -3.503 -11.473
135 3HB ALA 18 3HB ALA 18 5.956 -5.251 -11.778
136 H ALA 19 H ALA 19 1.591 -3.666 -12.349
137 HA ALA 19 HA ALA 19 2.060 -0.761 -12.799
138 1HB ALA 19 1HB ALA 19 0.450 -2.415 -14.776
139 2HB ALA 19 2HB ALA 19 0.776 -0.675 -14.826
140 3HB ALA 19 3HB ALA 19 2.104 -1.828 -15.053
141 H CYS 20 H CYS 20 -0.557 -3.316 -12.661
142 HA CYS 20 HA CYS 20 -2.488 -1.570 -11.537
143 1HB CYS 20 2HB CYS 20 -2.096 -4.542 -10.887
144 2HB CYS 20 3HB CYS 20 -3.577 -3.588 -10.689
145 H ALA 21 H ALA 21 0.163 -3.363 -10.105
146 HA ALA 21 HA ALA 21 -0.093 -2.928 -7.403
147 1HB ALA 21 1HB ALA 21 1.732 -4.157 -8.721
148 2HB ALA 21 2HB ALA 21 2.531 -2.580 -8.881
149 3HB ALA 21 3HB ALA 21 2.227 -3.290 -7.275
150 H ALA 22 H ALA 22 0.683 -0.475 -9.869
151 HA ALA 22 HA ALA 22 1.392 1.588 -7.919
152 1HB ALA 22 1HB ALA 22 2.209 1.627 -10.275
153 2HB ALA 22 2HB ALA 22 0.533 1.847 -10.829
154 3HB ALA 22 3HB ALA 22 1.304 3.087 -9.823
155 H ARG 23 H ARG 23 -1.475 0.695 -9.903
156 HA ARG 23 HA ARG 23 -3.054 2.965 -9.154
157 1HB ARG 23 2HB ARG 23 -3.784 0.221 -10.272
158 2HB ARG 23 3HB ARG 23 -5.010 1.351 -9.705
159 1HG ARG 23 2HG ARG 23 -4.924 1.816 -11.954
160 2HG ARG 23 3HG ARG 23 -4.008 3.130 -11.210
161 1HD ARG 23 2HD ARG 23 -1.882 1.824 -11.799
162 2HD ARG 23 3HD ARG 23 -2.943 0.652 -12.612
163 HE ARG 23 HE ARG 23 -3.248 3.481 -13.389
164 1HH1 ARG 23 2HH2 ARG 23 -1.622 0.442 -14.145
165 2HH1 ARG 23 1HH2 ARG 23 -1.284 0.846 -15.799
166 1HH2 ARG 23 2HH1 ARG 23 -2.747 4.091 -15.543
167 2HH2 ARG 23 1HH1 ARG 23 -1.903 3.005 -16.595
168 H ILE 24 H ILE 24 -2.939 -0.373 -7.835
169 HA ILE 24 HA ILE 24 -4.848 0.069 -5.843
170 HB ILE 24 HB ILE 24 -3.969 -1.825 -4.620
171 1HG1 ILE 24 2HG1 ILE 24 -2.191 -2.995 -6.361
172 2HG1 ILE 24 3HG1 ILE 24 -1.714 -1.305 -6.426
173 1HG2 ILE 24 1HG2 ILE 24 -4.743 -3.337 -6.244
174 2HG2 ILE 24 2HG2 ILE 24 -5.456 -1.828 -6.808
175 3HG2 ILE 24 3HG2 ILE 24 -4.016 -2.447 -7.600
176 1HD1 ILE 24 1HD1 ILE 24 -0.357 -2.581 -4.806
177 2HD1 ILE 24 2HD1 ILE 24 -1.310 -1.345 -3.958
178 3HD1 ILE 24 3HD1 ILE 24 -1.829 -3.039 -3.921
179 H GLU 25 H GLU 25 -1.298 0.564 -5.569
180 HA GLU 25 HA GLU 25 -1.458 1.626 -2.990
181 1HB GLU 25 2HB GLU 25 0.564 0.905 -4.591
182 2HB GLU 25 3HB GLU 25 0.685 2.649 -4.855
183 1HG GLU 25 2HG GLU 25 2.162 1.711 -3.035
184 2HG GLU 25 3HG GLU 25 1.033 2.944 -2.469
185 H LYS 26 H LYS 26 -2.018 3.277 -6.038
186 HA LYS 26 HA LYS 26 -1.952 5.928 -4.768
187 1HB LYS 26 2HB LYS 26 -2.801 5.090 -7.548
188 2HB LYS 26 3HB LYS 26 -2.681 6.763 -6.987
189 1HG LYS 26 2HG LYS 26 -0.350 4.792 -7.022
190 2HG LYS 26 3HG LYS 26 -0.687 5.958 -8.298
191 1HD LYS 26 2HD LYS 26 -0.321 7.818 -6.721
192 2HD LYS 26 3HD LYS 26 -0.068 6.674 -5.386
193 1HE LYS 26 2HE LYS 26 1.854 5.662 -6.663
194 2HE LYS 26 3HE LYS 26 1.708 6.987 -7.830
195 1HZ LYS 26 1HZ LYS 26 2.352 7.188 -4.942
196 2HZ LYS 26 2HZ LYS 26 3.352 7.489 -6.188
197 3HZ LYS 26 3HZ LYS 26 2.095 8.504 -5.895
198 H GLY 27 H GLY 27 -4.497 3.629 -5.690
199 1HA GLY 27 2HA GLY 27 -6.687 5.343 -4.850
200 2HA GLY 27 3HA GLY 27 -6.730 3.582 -4.995
201 H LEU 28 H LEU 28 -4.561 2.927 -3.283
202 HA LEU 28 HA LEU 28 -5.727 2.894 -0.666
203 1HB LEU 28 2HB LEU 28 -4.135 1.326 -1.495
204 2HB LEU 28 3HB LEU 28 -2.863 2.541 -1.554
205 HG LEU 28 HG LEU 28 -4.271 1.807 1.025
206 1HD1 LEU 28 1HD1 LEU 28 -3.336 -0.163 -0.088
207 2HD1 LEU 28 2HD1 LEU 28 -1.751 0.620 -0.190
208 3HD1 LEU 28 3HD1 LEU 28 -2.447 0.217 1.393
209 1HD2 LEU 28 1HD2 LEU 28 -2.028 2.630 1.940
210 2HD2 LEU 28 2HD2 LEU 28 -1.632 3.191 0.312
211 3HD2 LEU 28 3HD2 LEU 28 -3.008 3.882 1.206
212 H LYS 29 H LYS 29 -3.129 4.942 -2.030
213 HA LYS 29 HA LYS 29 -2.660 6.626 0.054
214 1HB LYS 29 2HB LYS 29 -1.674 6.485 -2.375
215 2HB LYS 29 3HB LYS 29 -2.870 7.716 -2.765
216 1HG LYS 29 2HG LYS 29 -1.461 8.562 -0.372
217 2HG LYS 29 3HG LYS 29 -0.307 7.872 -1.494
218 1HD LYS 29 2HD LYS 29 -0.351 10.188 -2.079
219 2HD LYS 29 3HD LYS 29 -1.212 9.331 -3.333
220 1HE LYS 29 2HE LYS 29 -2.239 11.441 -2.592
221 2HE LYS 29 3HE LYS 29 -3.345 10.056 -2.442
222 1HZ LYS 29 1HZ LYS 29 -3.325 11.613 -0.506
223 2HZ LYS 29 2HZ LYS 29 -3.040 10.055 -0.107
224 3HZ LYS 29 3HZ LYS 29 -1.785 11.134 -0.178
225 H ARG 30 H ARG 30 -5.700 6.534 -1.657
226 HA ARG 30 HA ARG 30 -6.385 9.325 -1.083
227 1HB ARG 30 2HB ARG 30 -7.307 7.234 -2.849
228 2HB ARG 30 3HB ARG 30 -8.674 7.794 -1.898
229 1HG ARG 30 2HG ARG 30 -8.165 10.119 -2.605
230 2HG ARG 30 3HG ARG 30 -6.699 9.544 -3.426
231 1HD ARG 30 2HD ARG 30 -8.893 7.955 -4.398
232 2HD ARG 30 3HD ARG 30 -9.446 9.614 -4.440
233 HE ARG 30 HE ARG 30 -7.456 8.316 -6.104
234 1HH1 ARG 30 2HH2 ARG 30 -8.273 11.426 -4.701
235 2HH1 ARG 30 1HH2 ARG 30 -7.561 12.394 -5.957
236 1HH2 ARG 30 2HH1 ARG 30 -6.462 9.541 -7.807
237 2HH2 ARG 30 1HH1 ARG 30 -6.475 11.273 -7.761
238 H MET 31 H MET 31 -6.321 6.486 0.840
239 HA MET 31 HA MET 31 -8.717 6.991 2.334
240 1HB MET 31 2HB MET 31 -7.867 5.362 3.903
241 2HB MET 31 3HB MET 31 -7.431 4.868 2.266
242 1HG MET 31 2HG MET 31 -5.140 5.748 2.638
243 2HG MET 31 3HG MET 31 -5.567 6.235 4.264
244 1HE MET 31 1HE MET 31 -5.900 3.152 1.972
245 2HE MET 31 2HE MET 31 -5.619 1.813 3.098
246 3HE MET 31 3HE MET 31 -7.097 2.771 3.261
247 HA PRO 32 HA PRO 32 -7.272 10.246 5.163
248 1HB PRO 32 2HB PRO 32 -8.380 9.430 7.555
249 2HB PRO 32 3HB PRO 32 -9.317 10.214 6.251
250 1HG PRO 32 2HG PRO 32 -9.042 7.246 6.795
251 2HG PRO 32 3HG PRO 32 -10.549 8.172 6.530
252 1HD PRO 32 2HD PRO 32 -9.410 6.804 4.525
253 2HD PRO 32 3HD PRO 32 -10.064 8.429 4.200
254 H GLY 33 H GLY 33 -5.350 10.390 6.308
255 1HA GLY 33 2HA GLY 33 -3.801 9.716 7.910
256 2HA GLY 33 3HA GLY 33 -4.295 8.029 7.759
257 H VAL 34 H VAL 34 -4.061 8.030 4.730
258 HA VAL 34 HA VAL 34 -1.106 7.786 4.657
259 HB VAL 34 HB VAL 34 -3.157 6.917 2.624
260 1HG1 VAL 34 1HG1 VAL 34 -0.142 6.460 2.868
261 2HG1 VAL 34 2HG1 VAL 34 -1.208 5.649 1.703
262 3HG1 VAL 34 3HG1 VAL 34 -0.948 7.396 1.603
263 1HG2 VAL 34 1HG2 VAL 34 -1.484 5.298 4.622
264 2HG2 VAL 34 2HG2 VAL 34 -3.197 5.641 4.816
265 3HG2 VAL 34 3HG2 VAL 34 -2.621 4.660 3.446
266 H THR 35 H THR 35 0.018 9.538 4.175
267 HA THR 35 HA THR 35 -1.254 11.723 2.658
268 HB THR 35 HB THR 35 0.965 11.458 4.524
269 HG1 THR 35 1HG THR 35 -0.638 12.742 5.105
270 1HG2 THR 35 1HG2 THR 35 1.381 13.265 2.120
271 2HG2 THR 35 2HG2 THR 35 2.215 13.413 3.681
272 3HG2 THR 35 3HG2 THR 35 2.453 11.959 2.710
273 H ASP 36 H ASP 36 1.553 9.399 2.235
274 HA ASP 36 HA ASP 36 0.954 9.595 -0.571
275 1HB ASP 36 2HB ASP 36 3.106 11.140 0.232
276 2HB ASP 36 3HB ASP 36 3.878 9.624 -0.258
277 H ALA 37 H ALA 37 2.071 8.047 -1.856
278 HA ALA 37 HA ALA 37 3.038 5.673 -0.449
279 1HB ALA 37 1HB ALA 37 0.461 5.639 -0.165
280 2HB ALA 37 2HB ALA 37 0.407 5.223 -1.888
281 3HB ALA 37 3HB ALA 37 1.259 4.172 -0.722
282 H ASN 38 H ASN 38 3.914 3.973 -1.771
283 HA ASN 38 HA ASN 38 4.319 4.620 -4.627
284 1HB ASN 38 2HB ASN 38 6.949 4.475 -3.625
285 2HB ASN 38 3HB ASN 38 6.134 5.884 -4.271
286 1HD2 ASN 38 1HD2 ASN 38 5.896 4.173 -1.084
287 2HD2 ASN 38 2HD2 ASN 38 6.283 5.621 -0.154
288 H VAL 39 H VAL 39 4.184 2.573 -5.465
289 HA VAL 39 HA VAL 39 4.965 0.311 -3.825
290 HB VAL 39 HB VAL 39 2.989 0.412 -5.429
291 1HG1 VAL 39 1HG1 VAL 39 4.214 1.299 -7.431
292 2HG1 VAL 39 2HG1 VAL 39 5.096 -0.243 -7.533
293 3HG1 VAL 39 3HG1 VAL 39 3.345 -0.214 -7.734
294 1HG2 VAL 39 1HG2 VAL 39 5.019 -1.823 -5.338
295 2HG2 VAL 39 2HG2 VAL 39 3.559 -1.591 -4.348
296 3HG2 VAL 39 3HG2 VAL 39 3.401 -2.001 -6.055
297 H ASN 40 H ASN 40 6.956 -0.783 -3.979
298 HA ASN 40 HA ASN 40 8.978 0.319 -5.893
299 1HB ASN 40 2HB ASN 40 9.383 0.870 -3.488
300 2HB ASN 40 3HB ASN 40 9.408 -0.861 -3.120
301 1HD2 ASN 40 1HD2 ASN 40 11.640 0.116 -2.331
302 2HD2 ASN 40 2HD2 ASN 40 12.941 -0.016 -3.503
303 H LEU 41 H LEU 41 7.332 -1.322 -6.944
304 HA LEU 41 HA LEU 41 7.682 -4.081 -6.343
305 1HB LEU 41 2HB LEU 41 5.818 -2.580 -7.703
306 2HB LEU 41 3HB LEU 41 6.639 -3.362 -9.042
307 HG LEU 41 HG LEU 41 4.566 -4.483 -8.222
308 1HD1 LEU 41 1HD1 LEU 41 7.096 -6.163 -7.864
309 2HD1 LEU 41 2HD1 LEU 41 5.480 -6.806 -8.096
310 3HD1 LEU 41 3HD1 LEU 41 6.246 -5.857 -9.390
311 1HD2 LEU 41 1HD2 LEU 41 6.015 -5.303 -5.688
312 2HD2 LEU 41 2HD2 LEU 41 4.843 -3.982 -5.797
313 3HD2 LEU 41 3HD2 LEU 41 4.360 -5.633 -6.194
314 H ALA 42 H ALA 42 9.518 -1.876 -8.225
315 HA ALA 42 HA ALA 42 11.123 -3.409 -9.889
316 1HB ALA 42 1HB ALA 42 12.945 -1.900 -9.219
317 2HB ALA 42 2HB ALA 42 11.437 -0.982 -9.453
318 3HB ALA 42 3HB ALA 42 12.014 -1.371 -7.809
319 H THR 43 H THR 43 11.046 -3.391 -6.292
320 HA THR 43 HA THR 43 12.706 -5.860 -6.380
321 HB THR 43 HB THR 43 14.171 -4.133 -5.587
322 HG1 THR 43 1HG THR 43 13.171 -5.834 -3.569
323 1HG2 THR 43 1HG2 THR 43 12.581 -2.463 -4.774
324 2HG2 THR 43 2HG2 THR 43 12.102 -3.522 -3.430
325 3HG2 THR 43 3HG2 THR 43 13.751 -2.878 -3.515
326 H GLU 44 H GLU 44 9.927 -5.726 -6.624
327 HA GLU 44 HA GLU 44 7.973 -6.487 -5.772
328 1HB GLU 44 2HB GLU 44 10.007 -8.398 -4.561
329 2HB GLU 44 3HB GLU 44 8.263 -8.698 -4.636
330 1HG GLU 44 2HG GLU 44 8.279 -8.471 -7.095
331 2HG GLU 44 3HG GLU 44 10.033 -8.213 -7.065
332 H THR 45 H THR 45 8.955 -4.231 -4.133
333 HA THR 45 HA THR 45 7.805 -4.980 -1.484
334 HB THR 45 HB THR 45 9.999 -2.994 -2.225
335 HG1 THR 45 1HG THR 45 10.588 -5.264 -2.311
336 1HG2 THR 45 1HG2 THR 45 8.757 -2.314 -0.199
337 2HG2 THR 45 2HG2 THR 45 8.967 -3.969 0.455
338 3HG2 THR 45 3HG2 THR 45 10.375 -2.913 0.213
339 H VAL 46 H VAL 46 6.549 -3.231 -0.490
340 HA VAL 46 HA VAL 46 5.746 -1.025 -2.326
341 HB VAL 46 HB VAL 46 3.945 -2.593 -2.375
342 1HG1 VAL 46 1HG1 VAL 46 3.933 -2.502 0.669
343 2HG1 VAL 46 2HG1 VAL 46 2.693 -3.266 -0.341
344 3HG1 VAL 46 3HG1 VAL 46 4.330 -3.921 -0.335
345 1HG2 VAL 46 1HG2 VAL 46 3.357 -0.191 -2.218
346 2HG2 VAL 46 2HG2 VAL 46 2.134 -1.289 -1.554
347 3HG2 VAL 46 3HG2 VAL 46 3.170 -0.363 -0.455
348 H ASN 47 H ASN 47 5.511 1.056 -1.308
349 HA ASN 47 HA ASN 47 6.265 1.093 1.546
350 1HB ASN 47 2HB ASN 47 7.531 2.548 -0.803
351 2HB ASN 47 3HB ASN 47 7.442 3.333 0.776
352 1HD2 ASN 47 1HD2 ASN 47 8.127 1.811 2.706
353 2HD2 ASN 47 2HD2 ASN 47 9.745 1.189 2.427
354 H VAL 48 H VAL 48 5.199 2.717 2.752
355 HA VAL 48 HA VAL 48 3.214 4.333 1.293
356 HB VAL 48 HB VAL 48 2.092 2.251 1.571
357 1HG1 VAL 48 1HG1 VAL 48 3.319 1.156 3.318
358 2HG1 VAL 48 2HG1 VAL 48 2.810 2.355 4.516
359 3HG1 VAL 48 3HG1 VAL 48 1.616 1.263 3.785
360 1HG2 VAL 48 1HG2 VAL 48 0.152 2.978 2.854
361 2HG2 VAL 48 2HG2 VAL 48 1.085 4.308 3.567
362 3HG2 VAL 48 3HG2 VAL 48 0.788 4.263 1.822
363 H ILE 49 H ILE 49 3.068 6.261 2.159
364 HA ILE 49 HA ILE 49 4.822 6.824 4.447
365 HB ILE 49 HB ILE 49 3.910 8.724 2.241
366 1HG1 ILE 49 2HG1 ILE 49 5.024 6.985 1.045
367 2HG1 ILE 49 3HG1 ILE 49 6.032 8.421 1.116
368 1HG2 ILE 49 1HG2 ILE 49 5.904 10.011 2.918
369 2HG2 ILE 49 2HG2 ILE 49 4.718 9.845 4.221
370 3HG2 ILE 49 3HG2 ILE 49 6.188 8.861 4.240
371 1HD1 ILE 49 1HD1 ILE 49 7.401 6.437 1.434
372 2HD1 ILE 49 2HD1 ILE 49 7.393 7.388 2.921
373 3HD1 ILE 49 3HD1 ILE 49 6.408 5.910 2.802
374 H TYR 50 H TYR 50 3.327 6.758 6.198
375 HA TYR 50 HA TYR 50 0.826 8.391 5.932
376 1HB TYR 50 2HB TYR 50 -0.537 6.622 6.692
377 2HB TYR 50 3HB TYR 50 0.389 6.077 5.316
378 HD1 TYR 50 HD1 TYR 50 -0.108 5.795 8.963
379 HD2 TYR 50 HD2 TYR 50 2.002 4.194 5.588
380 HE1 TYR 50 HE1 TYR 50 0.321 3.708 10.213
381 HE2 TYR 50 HE2 TYR 50 2.110 1.980 6.725
382 HH TYR 50 HH TYR 50 1.131 1.499 10.032
383 H ASP 51 H ASP 51 -0.339 8.592 7.890
384 HA ASP 51 HA ASP 51 1.518 9.320 10.085
385 1HB ASP 51 2HB ASP 51 -0.109 10.972 9.492
386 2HB ASP 51 3HB ASP 51 -1.432 9.835 9.743
387 HA PRO 52 HA PRO 52 0.393 5.264 11.790
388 1HB PRO 52 2HB PRO 52 2.249 5.007 13.733
389 2HB PRO 52 3HB PRO 52 2.660 4.910 11.996
390 1HG PRO 52 2HG PRO 52 2.845 7.357 13.786
391 2HG PRO 52 3HG PRO 52 4.122 6.653 12.746
392 1HD PRO 52 2HD PRO 52 2.558 8.710 11.911
393 2HD PRO 52 3HD PRO 52 3.065 7.417 10.781
394 H ALA 53 H ALA 53 -0.278 8.352 13.085
395 HA ALA 53 HA ALA 53 -1.438 7.277 15.589
396 1HB ALA 53 1HB ALA 53 -0.336 9.517 15.558
397 2HB ALA 53 2HB ALA 53 -1.521 10.050 14.343
398 3HB ALA 53 3HB ALA 53 -2.066 9.588 15.964
399 H GLU 54 H GLU 54 -2.148 7.910 12.196
400 HA GLU 54 HA GLU 54 -5.031 8.154 12.770
401 1HB GLU 54 2HB GLU 54 -3.756 9.954 11.471
402 2HB GLU 54 3HB GLU 54 -3.634 8.782 10.158
403 1HG GLU 54 2HG GLU 54 -5.608 9.758 9.507
404 2HG GLU 54 3HG GLU 54 -6.338 8.653 10.673
405 H THR 55 H THR 55 -2.687 6.643 10.595
406 HA THR 55 HA THR 55 -4.334 4.205 10.432
407 HB THR 55 HB THR 55 -2.777 3.723 8.281
408 HG1 THR 55 1HG THR 55 -3.006 6.520 8.478
409 1HG2 THR 55 1HG2 THR 55 -4.627 4.591 6.958
410 2HG2 THR 55 2HG2 THR 55 -5.180 3.670 8.383
411 3HG2 THR 55 3HG2 THR 55 -5.273 5.465 8.373
412 H GLY 56 H GLY 56 -2.634 2.416 9.742
413 1HA GLY 56 2HA GLY 56 -0.552 1.604 11.342
414 2HA GLY 56 3HA GLY 56 -1.932 1.823 12.443
415 H THR 57 H THR 57 -0.885 0.360 9.652
416 HA THR 57 HA THR 57 -1.691 -0.375 7.854
417 HB THR 57 HB THR 57 -1.224 -2.819 7.780
418 HG1 THR 57 1HG THR 57 -0.643 -3.778 9.795
419 1HG2 THR 57 1HG2 THR 57 1.093 -2.686 8.492
420 2HG2 THR 57 2HG2 THR 57 0.636 -1.127 7.781
421 3HG2 THR 57 3HG2 THR 57 0.755 -1.306 9.546
422 H ALA 58 H ALA 58 -3.866 -1.311 10.365
423 HA ALA 58 HA ALA 58 -5.988 -2.585 9.488
424 1HB ALA 58 1HB ALA 58 -5.826 0.288 10.426
425 2HB ALA 58 2HB ALA 58 -7.313 -0.705 10.487
426 3HB ALA 58 3HB ALA 58 -5.882 -1.147 11.455
427 H ALA 59 H ALA 59 -5.261 0.670 8.145
428 HA ALA 59 HA ALA 59 -7.845 0.476 6.670
429 1HB ALA 59 1HB ALA 59 -5.742 2.625 6.545
430 2HB ALA 59 2HB ALA 59 -7.386 2.717 5.877
431 3HB ALA 59 3HB ALA 59 -7.159 2.636 7.633
432 H ILE 60 H ILE 60 -4.420 0.552 6.085
433 HA ILE 60 HA ILE 60 -4.177 0.213 3.306
434 HB ILE 60 HB ILE 60 -2.581 -0.314 5.781
435 1HG1 ILE 60 2HG1 ILE 60 -1.621 0.970 3.317
436 2HG1 ILE 60 3HG1 ILE 60 -2.951 1.798 4.101
437 1HG2 ILE 60 1HG2 ILE 60 -0.661 -1.094 4.471
438 2HG2 ILE 60 2HG2 ILE 60 -1.939 -2.305 4.608
439 3HG2 ILE 60 3HG2 ILE 60 -1.734 -1.402 3.084
440 1HD1 ILE 60 1HD1 ILE 60 -1.743 1.886 6.252
441 2HD1 ILE 60 2HD1 ILE 60 -0.333 1.102 5.504
442 3HD1 ILE 60 3HD1 ILE 60 -0.851 2.719 4.974
443 H GLN 61 H GLN 61 -4.346 -2.464 5.752
444 HA GLN 61 HA GLN 61 -4.427 -4.437 3.725
445 1HB GLN 61 2HB GLN 61 -4.686 -4.378 6.590
446 2HB GLN 61 3HB GLN 61 -6.010 -5.326 5.920
447 1HG GLN 61 2HG GLN 61 -4.637 -7.060 5.910
448 2HG GLN 61 3HG GLN 61 -3.855 -6.367 4.501
449 1HE2 GLN 61 1HE2 GLN 61 -2.344 -4.274 5.543
450 2HE2 GLN 61 2HE2 GLN 61 -1.203 -4.931 6.714
451 H GLU 62 H GLU 62 -7.121 -2.741 5.418
452 HA GLU 62 HA GLU 62 -9.246 -4.032 4.181
453 1HB GLU 62 2HB GLU 62 -8.840 -1.584 5.715
454 2HB GLU 62 3HB GLU 62 -9.949 -1.240 4.390
455 1HG GLU 62 2HG GLU 62 -10.280 -3.550 6.347
456 2HG GLU 62 3HG GLU 62 -11.102 -1.986 6.457
457 H LYS 63 H LYS 63 -7.612 -1.048 2.937
458 HA LYS 63 HA LYS 63 -9.203 -1.041 0.570
459 1HB LYS 63 2HB LYS 63 -6.804 0.416 1.636
460 2HB LYS 63 3HB LYS 63 -7.192 0.552 -0.045
461 1HG LYS 63 2HG LYS 63 -9.155 1.201 2.211
462 2HG LYS 63 3HG LYS 63 -8.097 2.367 1.417
463 1HD LYS 63 2HD LYS 63 -10.112 2.789 0.510
464 2HD LYS 63 3HD LYS 63 -9.165 2.006 -0.758
465 1HE LYS 63 2HE LYS 63 -10.514 0.075 -0.736
466 2HE LYS 63 3HE LYS 63 -11.068 0.343 0.938
467 1HZ LYS 63 1HZ LYS 63 -12.407 2.141 0.142
468 2HZ LYS 63 2HZ LYS 63 -11.871 1.935 -1.404
469 3HZ LYS 63 3HZ LYS 63 -12.771 0.767 -0.678
470 H ILE 64 H ILE 64 -6.010 -2.436 1.389
471 HA ILE 64 HA ILE 64 -4.973 -2.961 -1.080
472 HB ILE 64 HB ILE 64 -4.805 -4.072 1.628
473 1HG1 ILE 64 2HG1 ILE 64 -3.432 -2.162 0.661
474 2HG1 ILE 64 3HG1 ILE 64 -2.575 -3.447 1.488
475 1HG2 ILE 64 1HG2 ILE 64 -4.937 -6.151 0.675
476 2HG2 ILE 64 2HG2 ILE 64 -3.848 -5.696 -0.669
477 3HG2 ILE 64 3HG2 ILE 64 -3.246 -5.801 1.010
478 1HD1 ILE 64 1HD1 ILE 64 -1.932 -4.462 -0.645
479 2HD1 ILE 64 2HD1 ILE 64 -2.808 -3.194 -1.528
480 3HD1 ILE 64 3HD1 ILE 64 -1.403 -2.776 -0.524
481 H GLU 65 H GLU 65 -7.100 -4.929 1.079
482 HA GLU 65 HA GLU 65 -7.769 -7.062 -0.621
483 1HB GLU 65 2HB GLU 65 -9.200 -5.769 1.737
484 2HB GLU 65 3HB GLU 65 -9.805 -7.220 0.938
485 1HG GLU 65 2HG GLU 65 -6.963 -7.134 1.961
486 2HG GLU 65 3HG GLU 65 -8.316 -7.479 3.045
487 H LYS 66 H LYS 66 -9.770 -4.118 0.093
488 HA LYS 66 HA LYS 66 -11.822 -4.766 -1.735
489 1HB LYS 66 2HB LYS 66 -10.902 -2.246 -0.401
490 2HB LYS 66 3HB LYS 66 -11.875 -2.046 -1.859
491 1HG LYS 66 2HG LYS 66 -13.421 -2.031 -0.102
492 2HG LYS 66 3HG LYS 66 -13.599 -3.597 -0.898
493 1HD LYS 66 2HD LYS 66 -12.096 -4.570 0.951
494 2HD LYS 66 3HD LYS 66 -12.151 -2.977 1.720
495 1HE LYS 66 2HE LYS 66 -14.774 -3.246 1.524
496 2HE LYS 66 3HE LYS 66 -14.414 -4.962 1.252
497 1HZ LYS 66 1HZ LYS 66 -13.720 -3.306 3.599
498 2HZ LYS 66 2HZ LYS 66 -14.762 -4.593 3.593
499 3HZ LYS 66 3HZ LYS 66 -13.113 -4.742 3.455
500 H LEU 67 H LEU 67 -8.766 -3.085 -2.388
501 HA LEU 67 HA LEU 67 -9.399 -2.462 -5.138
502 1HB LEU 67 2HB LEU 67 -6.823 -2.496 -3.560
503 2HB LEU 67 3HB LEU 67 -6.940 -1.955 -5.231
504 HG LEU 67 HG LEU 67 -8.716 -0.727 -3.088
505 1HD1 LEU 67 1HD1 LEU 67 -6.125 0.478 -4.019
506 2HD1 LEU 67 2HD1 LEU 67 -7.144 0.973 -2.660
507 3HD1 LEU 67 3HD1 LEU 67 -6.195 -0.523 -2.557
508 1HD2 LEU 67 1HD2 LEU 67 -7.738 0.241 -5.816
509 2HD2 LEU 67 2HD2 LEU 67 -9.394 -0.256 -5.417
510 3HD2 LEU 67 3HD2 LEU 67 -8.706 1.196 -4.679
511 H GLY 68 H GLY 68 -8.484 -5.391 -3.555
512 1HA GLY 68 2HA GLY 68 -8.628 -7.454 -4.545
513 2HA GLY 68 3HA GLY 68 -8.433 -6.754 -6.156
514 H TYR 69 H TYR 69 -6.306 -6.185 -3.328
515 HA TYR 69 HA TYR 69 -4.115 -7.784 -4.593
516 1HB TYR 69 2HB TYR 69 -4.247 -4.896 -3.849
517 2HB TYR 69 3HB TYR 69 -2.886 -5.750 -3.155
518 HD1 TYR 69 HD1 TYR 69 -0.918 -5.502 -4.355
519 HD2 TYR 69 HD2 TYR 69 -4.645 -5.752 -6.510
520 HE1 TYR 69 HE1 TYR 69 0.293 -5.310 -6.484
521 HE2 TYR 69 HE2 TYR 69 -3.421 -5.675 -8.642
522 HH TYR 69 HH TYR 69 0.148 -5.545 -8.797
523 H HIS 70 H HIS 70 -2.391 -8.266 -2.919
524 HA HIS 70 HA HIS 70 -3.443 -8.405 -0.146
525 1HB HIS 70 2HB HIS 70 -3.829 -10.572 -1.336
526 2HB HIS 70 3HB HIS 70 -2.086 -10.723 -1.572
527 HD1 HIS 70 1HD HIS 70 -1.671 -9.636 1.719
528 HD2 HIS 70 2HD HIS 70 -3.794 -12.879 0.047
529 HE1 HIS 70 1HE HIS 70 -1.942 -11.341 3.546
530 H VAL 71 H VAL 71 -2.003 -7.369 1.079
531 HA VAL 71 HA VAL 71 0.822 -7.070 0.247
532 HB VAL 71 HB VAL 71 -0.533 -5.100 0.996
533 1HG1 VAL 71 1HG1 VAL 71 -0.349 -6.297 3.793
534 2HG1 VAL 71 2HG1 VAL 71 -1.027 -4.728 3.329
535 3HG1 VAL 71 3HG1 VAL 71 -1.843 -6.220 2.841
536 1HG2 VAL 71 1HG2 VAL 71 1.865 -5.774 2.703
537 2HG2 VAL 71 2HG2 VAL 71 1.890 -5.058 1.073
538 3HG2 VAL 71 3HG2 VAL 71 1.204 -4.147 2.427
539 H VAL 72 H VAL 72 2.509 -7.949 1.605
540 HA VAL 72 HA VAL 72 1.622 -9.916 3.672
541 HB VAL 72 HB VAL 72 3.854 -10.298 1.752
542 1HG1 VAL 72 1HG1 VAL 72 4.363 -11.350 3.898
543 2HG1 VAL 72 2HG1 VAL 72 2.751 -12.099 3.944
544 3HG1 VAL 72 3HG1 VAL 72 3.942 -12.597 2.726
545 1HG2 VAL 72 1HG2 VAL 72 1.686 -10.636 0.608
546 2HG2 VAL 72 2HG2 VAL 72 2.437 -12.210 0.910
547 3HG2 VAL 72 3HG2 VAL 72 1.118 -11.649 1.954
548 H ILE 73 H ILE 73 2.850 -10.013 5.461
549 HA ILE 73 HA ILE 73 4.486 -7.566 5.990
550 HB ILE 73 HB ILE 73 2.796 -9.103 7.958
551 1HG1 ILE 73 2HG1 ILE 73 1.258 -8.182 6.344
552 2HG1 ILE 73 3HG1 ILE 73 1.242 -7.248 7.833
553 1HG2 ILE 73 1HG2 ILE 73 4.227 -6.406 8.054
554 2HG2 ILE 73 2HG2 ILE 73 3.094 -6.999 9.286
555 3HG2 ILE 73 3HG2 ILE 73 4.617 -7.840 9.002
556 1HD1 ILE 73 1HD1 ILE 73 2.590 -5.462 6.775
557 2HD1 ILE 73 2HD1 ILE 73 2.599 -6.384 5.255
558 3HD1 ILE 73 3HD1 ILE 73 1.079 -5.774 5.914
559 H GLU 74 H GLU 74 6.343 -8.973 5.149
560 HA GLU 74 HA GLU 74 7.222 -11.099 6.703
561 1HB GLU 74 2HB GLU 74 8.421 -9.365 4.553
562 2HB GLU 74 3HB GLU 74 9.403 -10.552 5.404
563 1HG GLU 74 2HG GLU 74 6.809 -11.355 4.045
564 2HG GLU 74 3HG GLU 74 8.388 -11.386 3.241
565 H GLY 75 H GLY 75 7.062 -8.076 7.695
566 1HA GLY 75 2HA GLY 75 8.030 -6.836 9.430
567 2HA GLY 75 3HA GLY 75 8.846 -8.326 9.936
568 H ARG 76 H ARG 76 9.052 -5.478 7.811
569 HA ARG 76 HA ARG 76 11.392 -6.230 6.469
570 1HB ARG 76 2HB ARG 76 9.850 -4.367 5.735
571 2HB ARG 76 3HB ARG 76 10.421 -3.409 7.113
572 1HG ARG 76 2HG ARG 76 11.629 -2.630 5.189
573 2HG ARG 76 3HG ARG 76 12.762 -3.526 6.170
574 1HD ARG 76 2HD ARG 76 12.027 -5.581 4.567
575 2HD ARG 76 3HD ARG 76 11.441 -4.283 3.550
576 HE ARG 76 HE ARG 76 13.600 -3.761 2.988
577 1HH1 ARG 76 2HH2 ARG 76 13.888 -5.533 6.101
578 2HH1 ARG 76 1HH2 ARG 76 15.370 -6.279 5.678
579 1HH2 ARG 76 2HH1 ARG 76 15.704 -4.597 2.555
580 2HH2 ARG 76 1HH1 ARG 76 16.508 -5.591 3.729
Start of MODEL 12
1 1H MET 1 H1 MET 1 -3.767 17.537 16.914
2 2H MET 1 H2 MET 1 -4.048 18.414 18.288
3 3H MET 1 H3 MET 1 -3.371 19.134 16.961
4 HA MET 1 HA MET 1 -1.719 18.762 18.610
5 1HB MET 1 2HB MET 1 -2.562 15.867 18.231
6 2HB MET 1 3HB MET 1 -0.990 16.326 18.911
7 1HG MET 1 2HG MET 1 -2.014 17.474 20.766
8 2HG MET 1 3HG MET 1 -3.616 17.346 20.034
9 1HE MET 1 1HE MET 1 -5.147 16.234 21.551
10 2HE MET 1 2HE MET 1 -4.613 15.097 22.806
11 3HE MET 1 3HE MET 1 -3.933 16.744 22.754
12 H LEU 2 H LEU 2 -1.108 15.925 16.555
13 HA LEU 2 HA LEU 2 -0.188 17.517 14.309
14 1HB LEU 2 2HB LEU 2 2.149 16.734 14.538
15 2HB LEU 2 3HB LEU 2 1.706 17.873 15.799
16 HG LEU 2 HG LEU 2 1.201 15.061 16.618
17 1HD1 LEU 2 1HD1 LEU 2 3.551 14.422 16.842
18 2HD1 LEU 2 2HD1 LEU 2 3.073 14.625 15.148
19 3HD1 LEU 2 3HD1 LEU 2 4.050 15.879 15.950
20 1HD2 LEU 2 1HD2 LEU 2 1.236 17.011 18.180
21 2HD2 LEU 2 2HD2 LEU 2 2.407 15.754 18.614
22 3HD2 LEU 2 3HD2 LEU 2 2.958 17.241 17.817
23 H SER 3 H SER 3 0.783 16.020 12.662
24 HA SER 3 HA SER 3 0.051 13.155 13.014
25 1HB SER 3 2HB SER 3 -0.046 14.527 10.287
26 2HB SER 3 3HB SER 3 -0.602 12.945 10.753
27 HG SER 3 HG SER 3 -1.666 15.407 11.722
28 H GLU 4 H GLU 4 2.140 12.419 13.524
29 HA GLU 4 HA GLU 4 4.511 13.196 12.044
30 1HB GLU 4 2HB GLU 4 3.666 10.988 13.857
31 2HB GLU 4 3HB GLU 4 5.163 10.856 12.963
32 1HG GLU 4 2HG GLU 4 6.208 12.473 14.107
33 2HG GLU 4 3HG GLU 4 4.739 13.374 14.447
34 H GLN 5 H GLN 5 5.514 11.405 10.625
35 HA GLN 5 HA GLN 5 3.501 9.775 9.178
36 1HB GLN 5 2HB GLN 5 5.689 11.467 7.906
37 2HB GLN 5 3HB GLN 5 4.767 10.174 7.128
38 1HG GLN 5 2HG GLN 5 2.735 11.790 8.136
39 2HG GLN 5 3HG GLN 5 3.972 12.976 7.701
40 1HE2 GLN 5 1HE2 GLN 5 2.200 10.140 6.530
41 2HE2 GLN 5 2HE2 GLN 5 2.287 10.478 4.843
42 H LYS 6 H LYS 6 4.377 7.814 8.362
43 HA LYS 6 HA LYS 6 7.231 7.306 8.818
44 1HB LYS 6 2HB LYS 6 5.061 5.438 9.791
45 2HB LYS 6 3HB LYS 6 6.774 5.037 9.728
46 1HG LYS 6 2HG LYS 6 5.667 7.307 11.428
47 2HG LYS 6 3HG LYS 6 5.941 5.657 12.001
48 1HD LYS 6 2HD LYS 6 8.335 5.819 11.429
49 2HD LYS 6 3HD LYS 6 8.104 7.474 10.836
50 1HE LYS 6 2HE LYS 6 7.352 8.224 13.059
51 2HE LYS 6 3HE LYS 6 7.513 6.577 13.698
52 1HZ LYS 6 1HZ LYS 6 9.865 6.700 13.254
53 2HZ LYS 6 2HZ LYS 6 9.714 8.219 12.635
54 3HZ LYS 6 3HZ LYS 6 9.401 7.946 14.228
55 H GLU 7 H GLU 7 8.063 5.760 7.578
56 HA GLU 7 HA GLU 7 6.645 5.145 5.062
57 1HB GLU 7 2HB GLU 7 9.610 4.810 5.288
58 2HB GLU 7 3HB GLU 7 8.585 5.396 3.996
59 1HG GLU 7 2HG GLU 7 9.820 7.260 4.637
60 2HG GLU 7 3HG GLU 7 8.341 7.544 5.559
61 H ILE 8 H ILE 8 5.596 3.203 5.659
62 HA ILE 8 HA ILE 8 7.121 1.114 7.004
63 HB ILE 8 HB ILE 8 4.407 0.940 5.847
64 1HG1 ILE 8 2HG1 ILE 8 3.969 2.886 6.988
65 2HG1 ILE 8 3HG1 ILE 8 3.423 1.555 8.018
66 1HG2 ILE 8 1HG2 ILE 8 5.428 -1.087 6.718
67 2HG2 ILE 8 2HG2 ILE 8 5.746 -0.270 8.252
68 3HG2 ILE 8 3HG2 ILE 8 4.065 -0.604 7.743
69 1HD1 ILE 8 1HD1 ILE 8 5.898 3.214 8.316
70 2HD1 ILE 8 2HD1 ILE 8 4.537 3.030 9.448
71 3HD1 ILE 8 3HD1 ILE 8 5.666 1.677 9.165
72 H ALA 9 H ALA 9 7.289 -1.067 5.901
73 HA ALA 9 HA ALA 9 7.336 -0.967 2.940
74 1HB ALA 9 1HB ALA 9 9.653 -0.540 3.807
75 2HB ALA 9 2HB ALA 9 9.571 -2.074 4.686
76 3HB ALA 9 3HB ALA 9 9.502 -2.067 2.911
77 H MET 10 H MET 10 6.325 -2.819 2.124
78 HA MET 10 HA MET 10 6.382 -5.303 3.759
79 1HB MET 10 2HB MET 10 3.830 -4.228 2.472
80 2HB MET 10 3HB MET 10 4.047 -5.762 3.296
81 1HG MET 10 2HG MET 10 3.017 -4.477 4.893
82 2HG MET 10 3HG MET 10 4.708 -4.426 5.375
83 1HE MET 10 1HE MET 10 1.592 -2.540 3.990
84 2HE MET 10 2HE MET 10 2.222 -0.907 3.670
85 3HE MET 10 3HE MET 10 2.694 -2.255 2.617
86 H GLN 11 H GLN 11 5.575 -7.189 2.389
87 HA GLN 11 HA GLN 11 6.837 -7.036 -0.298
88 1HB GLN 11 2HB GLN 11 6.098 -9.257 1.660
89 2HB GLN 11 3HB GLN 11 6.289 -9.633 -0.044
90 1HG GLN 11 2HG GLN 11 8.385 -8.439 1.824
91 2HG GLN 11 3HG GLN 11 8.359 -10.086 1.172
92 1HE2 GLN 11 1HE2 GLN 11 7.728 -9.741 -1.481
93 2HE2 GLN 11 2HE2 GLN 11 8.680 -8.496 -2.258
94 H VAL 12 H VAL 12 5.670 -8.075 -2.104
95 HA VAL 12 HA VAL 12 2.719 -7.584 -1.927
96 HB VAL 12 HB VAL 12 4.636 -7.216 -4.262
97 1HG1 VAL 12 1HG1 VAL 12 2.457 -7.939 -5.102
98 2HG1 VAL 12 2HG1 VAL 12 1.622 -6.791 -4.028
99 3HG1 VAL 12 3HG1 VAL 12 2.621 -6.207 -5.371
100 1HG2 VAL 12 1HG2 VAL 12 4.897 -5.422 -2.633
101 2HG2 VAL 12 2HG2 VAL 12 3.953 -4.796 -3.986
102 3HG2 VAL 12 3HG2 VAL 12 3.130 -5.246 -2.486
103 H SER 13 H SER 13 1.320 -9.099 -2.834
104 HA SER 13 HA SER 13 2.317 -11.314 -4.437
105 1HB SER 13 2HB SER 13 1.026 -11.661 -1.696
106 2HB SER 13 3HB SER 13 0.893 -12.908 -2.942
107 HG SER 13 HG SER 13 2.712 -13.285 -1.639
108 H GLY 14 H GLY 14 0.279 -12.630 -5.091
109 1HA GLY 14 2HA GLY 14 -1.735 -12.688 -6.177
110 2HA GLY 14 3HA GLY 14 -2.343 -11.693 -4.839
111 H MET 15 H MET 15 -0.080 -11.199 -7.585
112 HA MET 15 HA MET 15 -1.434 -8.626 -8.240
113 1HB MET 15 2HB MET 15 0.708 -7.592 -8.422
114 2HB MET 15 3HB MET 15 0.691 -8.462 -6.882
115 1HG MET 15 2HG MET 15 2.779 -9.020 -7.698
116 2HG MET 15 3HG MET 15 1.834 -10.374 -8.322
117 1HE MET 15 1HE MET 15 4.190 -10.594 -9.832
118 2HE MET 15 2HE MET 15 2.664 -11.200 -10.535
119 3HE MET 15 3HE MET 15 3.786 -10.255 -11.535
120 H THR 16 H THR 16 -1.438 -8.045 -10.459
121 HA THR 16 HA THR 16 -0.906 -10.204 -12.407
122 HB THR 16 HB THR 16 -1.843 -8.134 -13.872
123 HG1 THR 16 1HG THR 16 -3.344 -7.806 -11.535
124 1HG2 THR 16 1HG2 THR 16 -3.512 -10.028 -12.143
125 2HG2 THR 16 2HG2 THR 16 -4.123 -9.097 -13.535
126 3HG2 THR 16 3HG2 THR 16 -2.885 -10.340 -13.775
127 H CYS 17 H CYS 17 -0.075 -6.668 -11.997
128 HA CYS 17 HA CYS 17 2.677 -7.312 -12.611
129 1HB CYS 17 2HB CYS 17 2.929 -6.020 -14.616
130 2HB CYS 17 3HB CYS 17 1.636 -7.186 -14.903
131 H ALA 18 H ALA 18 3.998 -5.307 -12.711
132 HA ALA 18 HA ALA 18 3.754 -3.853 -10.339
133 1HB ALA 18 1HB ALA 18 5.879 -4.232 -11.530
134 2HB ALA 18 2HB ALA 18 5.342 -3.169 -12.848
135 3HB ALA 18 3HB ALA 18 5.620 -2.503 -11.225
136 H ALA 19 H ALA 19 2.527 -3.095 -13.584
137 HA ALA 19 HA ALA 19 2.020 -0.313 -13.080
138 1HB ALA 19 1HB ALA 19 0.622 -0.381 -15.048
139 2HB ALA 19 2HB ALA 19 2.100 -1.316 -15.354
140 3HB ALA 19 3HB ALA 19 0.565 -2.151 -15.022
141 H CYS 20 H CYS 20 -0.087 -3.266 -12.812
142 HA CYS 20 HA CYS 20 -2.288 -1.826 -11.682
143 1HB CYS 20 2HB CYS 20 -1.519 -4.768 -11.363
144 2HB CYS 20 3HB CYS 20 -3.086 -4.041 -10.964
145 H ALA 21 H ALA 21 0.556 -3.437 -10.245
146 HA ALA 21 HA ALA 21 -0.098 -2.949 -7.556
147 1HB ALA 21 1HB ALA 21 1.905 -4.246 -8.614
148 2HB ALA 21 2HB ALA 21 2.746 -2.683 -8.507
149 3HB ALA 21 3HB ALA 21 2.092 -3.462 -7.047
150 H ALA 22 H ALA 22 0.788 -0.542 -10.013
151 HA ALA 22 HA ALA 22 1.326 1.571 -8.064
152 1HB ALA 22 1HB ALA 22 0.364 1.889 -10.925
153 2HB ALA 22 2HB ALA 22 1.195 3.072 -9.911
154 3HB ALA 22 3HB ALA 22 2.069 1.633 -10.479
155 H ARG 23 H ARG 23 -1.519 0.341 -9.829
156 HA ARG 23 HA ARG 23 -3.283 2.493 -9.255
157 1HB ARG 23 2HB ARG 23 -3.918 -0.461 -9.639
158 2HB ARG 23 3HB ARG 23 -5.101 0.848 -9.644
159 1HG ARG 23 2HG ARG 23 -4.078 1.887 -11.576
160 2HG ARG 23 3HG ARG 23 -2.744 0.722 -11.570
161 1HD ARG 23 2HD ARG 23 -3.913 -0.679 -12.896
162 2HD ARG 23 3HD ARG 23 -5.087 -0.878 -11.614
163 HE ARG 23 HE ARG 23 -6.585 0.295 -12.840
164 1HH1 ARG 23 2HH2 ARG 23 -3.372 1.298 -13.809
165 2HH1 ARG 23 1HH2 ARG 23 -3.867 2.252 -15.176
166 1HH2 ARG 23 2HH1 ARG 23 -7.331 1.520 -14.671
167 2HH2 ARG 23 1HH1 ARG 23 -6.203 2.382 -15.664
168 H ILE 24 H ILE 24 -2.523 -0.494 -7.401
169 HA ILE 24 HA ILE 24 -4.414 0.092 -5.378
170 HB ILE 24 HB ILE 24 -3.598 -1.566 -4.041
171 1HG1 ILE 24 2HG1 ILE 24 -1.031 -1.266 -5.504
172 2HG1 ILE 24 3HG1 ILE 24 -1.374 -1.098 -3.768
173 1HG2 ILE 24 1HG2 ILE 24 -3.798 -3.368 -5.460
174 2HG2 ILE 24 2HG2 ILE 24 -4.600 -2.095 -6.372
175 3HG2 ILE 24 3HG2 ILE 24 -2.952 -2.584 -6.821
176 1HD1 ILE 24 1HD1 ILE 24 -1.841 -3.562 -3.690
177 2HD1 ILE 24 2HD1 ILE 24 -1.293 -3.634 -5.391
178 3HD1 ILE 24 3HD1 ILE 24 -0.163 -3.156 -4.120
179 H GLU 25 H GLU 25 -0.832 0.684 -5.113
180 HA GLU 25 HA GLU 25 -1.008 2.183 -2.781
181 1HB GLU 25 2HB GLU 25 0.974 1.990 -5.000
182 2HB GLU 25 3HB GLU 25 1.091 3.429 -3.966
183 1HG GLU 25 2HG GLU 25 2.481 1.534 -3.130
184 2HG GLU 25 3HG GLU 25 1.291 2.085 -1.952
185 H LYS 26 H LYS 26 -1.590 3.366 -6.091
186 HA LYS 26 HA LYS 26 -1.695 6.152 -5.226
187 1HB LYS 26 2HB LYS 26 -2.412 4.702 -7.779
188 2HB LYS 26 3HB LYS 26 -2.955 6.355 -7.497
189 1HG LYS 26 2HG LYS 26 -0.904 6.447 -8.729
190 2HG LYS 26 3HG LYS 26 -0.648 7.125 -7.113
191 1HD LYS 26 2HD LYS 26 0.502 5.083 -6.407
192 2HD LYS 26 3HD LYS 26 0.182 4.358 -8.001
193 1HE LYS 26 2HE LYS 26 1.537 5.946 -9.156
194 2HE LYS 26 3HE LYS 26 1.746 6.941 -7.703
195 1HZ LYS 26 1HZ LYS 26 2.752 4.188 -7.987
196 2HZ LYS 26 2HZ LYS 26 3.653 5.549 -8.189
197 3HZ LYS 26 3HZ LYS 26 3.007 5.210 -6.715
198 H GLY 27 H GLY 27 -4.266 3.696 -5.937
199 1HA GLY 27 2HA GLY 27 -6.427 5.442 -5.142
200 2HA GLY 27 3HA GLY 27 -6.493 3.686 -5.311
201 H LEU 28 H LEU 28 -4.171 3.400 -3.387
202 HA LEU 28 HA LEU 28 -5.595 3.328 -0.910
203 1HB LEU 28 2HB LEU 28 -3.883 1.690 -1.561
204 2HB LEU 28 3HB LEU 28 -2.642 2.942 -1.544
205 HG LEU 28 HG LEU 28 -2.737 1.307 0.381
206 1HD1 LEU 28 1HD1 LEU 28 -2.929 4.230 1.236
207 2HD1 LEU 28 2HD1 LEU 28 -2.071 2.914 2.038
208 3HD1 LEU 28 3HD1 LEU 28 -1.509 3.496 0.466
209 1HD2 LEU 28 1HD2 LEU 28 -5.130 1.274 0.579
210 2HD2 LEU 28 2HD2 LEU 28 -4.354 1.624 2.120
211 3HD2 LEU 28 3HD2 LEU 28 -5.163 2.927 1.243
212 H LYS 29 H LYS 29 -2.934 5.411 -2.233
213 HA LYS 29 HA LYS 29 -2.499 7.048 -0.088
214 1HB LYS 29 2HB LYS 29 -1.443 7.197 -2.427
215 2HB LYS 29 3HB LYS 29 -2.836 8.198 -2.883
216 1HG LYS 29 2HG LYS 29 -2.225 9.628 -0.767
217 2HG LYS 29 3HG LYS 29 -0.725 8.723 -0.763
218 1HD LYS 29 2HD LYS 29 -1.821 10.544 -2.965
219 2HD LYS 29 3HD LYS 29 -0.534 10.925 -1.825
220 1HE LYS 29 2HE LYS 29 0.606 8.738 -2.918
221 2HE LYS 29 3HE LYS 29 -0.477 9.144 -4.255
222 1HZ LYS 29 1HZ LYS 29 1.821 10.554 -3.182
223 2HZ LYS 29 2HZ LYS 29 1.414 10.348 -4.727
224 3HZ LYS 29 3HZ LYS 29 0.642 11.505 -3.826
225 H ARG 30 H ARG 30 -5.270 7.200 -2.283
226 HA ARG 30 HA ARG 30 -6.310 9.648 -1.272
227 1HB ARG 30 2HB ARG 30 -6.983 7.746 -3.347
228 2HB ARG 30 3HB ARG 30 -8.429 8.019 -2.391
229 1HG ARG 30 2HG ARG 30 -7.868 10.553 -2.593
230 2HG ARG 30 3HG ARG 30 -6.687 10.061 -3.829
231 1HD ARG 30 2HD ARG 30 -8.557 9.011 -5.122
232 2HD ARG 30 3HD ARG 30 -9.679 9.499 -3.822
233 HE ARG 30 HE ARG 30 -8.147 11.724 -4.874
234 1HH1 ARG 30 2HH2 ARG 30 -10.980 9.731 -5.511
235 2HH1 ARG 30 1HH2 ARG 30 -11.881 10.969 -6.330
236 1HH2 ARG 30 2HH1 ARG 30 -9.296 13.402 -5.972
237 2HH2 ARG 30 1HH1 ARG 30 -10.875 13.106 -6.619
238 H MET 31 H MET 31 -6.170 6.785 0.473
239 HA MET 31 HA MET 31 -8.785 6.819 1.690
240 1HB MET 31 2HB MET 31 -7.900 5.053 3.035
241 2HB MET 31 3HB MET 31 -7.160 4.872 1.456
242 1HG MET 31 2HG MET 31 -5.158 4.892 2.445
243 2HG MET 31 3HG MET 31 -5.390 6.545 2.940
244 1HE MET 31 1HE MET 31 -6.280 2.800 3.828
245 2HE MET 31 2HE MET 31 -4.531 3.157 3.828
246 3HE MET 31 3HE MET 31 -5.332 2.759 5.335
247 HA PRO 32 HA PRO 32 -7.847 9.858 4.898
248 1HB PRO 32 2HB PRO 32 -9.213 9.033 7.084
249 2HB PRO 32 3HB PRO 32 -10.035 9.624 5.610
250 1HG PRO 32 2HG PRO 32 -9.541 6.747 6.416
251 2HG PRO 32 3HG PRO 32 -11.051 7.497 5.836
252 1HD PRO 32 2HD PRO 32 -9.344 6.111 4.212
253 2HD PRO 32 3HD PRO 32 -10.303 7.485 3.597
254 H GLY 33 H GLY 33 -5.856 9.939 5.708
255 1HA GLY 33 2HA GLY 33 -4.538 9.624 7.630
256 2HA GLY 33 3HA GLY 33 -4.929 7.907 7.692
257 H VAL 34 H VAL 34 -4.325 7.989 4.540
258 HA VAL 34 HA VAL 34 -1.356 7.859 4.823
259 HB VAL 34 HB VAL 34 -3.161 7.037 2.543
260 1HG1 VAL 34 1HG1 VAL 34 -1.055 6.030 1.614
261 2HG1 VAL 34 2HG1 VAL 34 -1.017 7.795 1.636
262 3HG1 VAL 34 3HG1 VAL 34 -0.133 6.877 2.871
263 1HG2 VAL 34 1HG2 VAL 34 -3.125 4.942 3.426
264 2HG2 VAL 34 2HG2 VAL 34 -1.415 5.012 3.799
265 3HG2 VAL 34 3HG2 VAL 34 -2.590 5.661 4.946
266 H THR 35 H THR 35 -0.013 9.260 3.684
267 HA THR 35 HA THR 35 -1.358 11.585 2.361
268 HB THR 35 HB THR 35 0.666 11.526 4.492
269 HG1 THR 35 1HG THR 35 -1.196 12.256 5.136
270 1HG2 THR 35 1HG2 THR 35 1.395 13.811 3.904
271 2HG2 THR 35 2HG2 THR 35 1.995 12.602 2.760
272 3HG2 THR 35 3HG2 THR 35 0.614 13.646 2.312
273 H ASP 36 H ASP 36 1.461 9.275 2.218
274 HA ASP 36 HA ASP 36 1.241 9.692 -0.612
275 1HB ASP 36 2HB ASP 36 3.324 11.092 0.484
276 2HB ASP 36 3HB ASP 36 4.115 9.550 0.095
277 H ALA 37 H ALA 37 2.589 8.055 -1.796
278 HA ALA 37 HA ALA 37 3.039 5.555 -0.446
279 1HB ALA 37 1HB ALA 37 1.178 4.232 -1.336
280 2HB ALA 37 2HB ALA 37 0.539 5.562 -0.360
281 3HB ALA 37 3HB ALA 37 0.504 5.671 -2.133
282 H ASN 38 H ASN 38 4.025 3.916 -1.745
283 HA ASN 38 HA ASN 38 4.672 4.636 -4.529
284 1HB ASN 38 2HB ASN 38 7.213 4.355 -3.328
285 2HB ASN 38 3HB ASN 38 6.505 5.783 -4.054
286 1HD2 ASN 38 1HD2 ASN 38 5.920 4.142 -0.869
287 2HD2 ASN 38 2HD2 ASN 38 6.328 5.582 0.063
288 H VAL 39 H VAL 39 4.296 2.659 -5.370
289 HA VAL 39 HA VAL 39 4.948 0.256 -3.912
290 HB VAL 39 HB VAL 39 2.984 0.378 -5.222
291 1HG1 VAL 39 1HG1 VAL 39 4.714 0.862 -7.695
292 2HG1 VAL 39 2HG1 VAL 39 3.086 0.258 -7.723
293 3HG1 VAL 39 3HG1 VAL 39 3.408 1.861 -7.037
294 1HG2 VAL 39 1HG2 VAL 39 4.248 -1.761 -4.895
295 2HG2 VAL 39 2HG2 VAL 39 3.131 -1.717 -6.263
296 3HG2 VAL 39 3HG2 VAL 39 4.873 -1.545 -6.553
297 H ASN 40 H ASN 40 7.104 -0.289 -3.641
298 HA ASN 40 HA ASN 40 9.065 0.369 -5.757
299 1HB ASN 40 2HB ASN 40 9.543 0.835 -3.380
300 2HB ASN 40 3HB ASN 40 9.442 -0.893 -3.024
301 1HD2 ASN 40 1HD2 ASN 40 11.748 -0.180 -2.238
302 2HD2 ASN 40 2HD2 ASN 40 13.026 -0.362 -3.428
303 H LEU 41 H LEU 41 7.424 -1.191 -6.954
304 HA LEU 41 HA LEU 41 7.755 -4.006 -6.512
305 1HB LEU 41 2HB LEU 41 6.131 -2.338 -8.173
306 2HB LEU 41 3HB LEU 41 6.965 -3.422 -9.255
307 HG LEU 41 HG LEU 41 4.711 -4.129 -8.395
308 1HD1 LEU 41 1HD1 LEU 41 5.333 -6.527 -8.185
309 2HD1 LEU 41 2HD1 LEU 41 6.125 -5.713 -9.546
310 3HD1 LEU 41 3HD1 LEU 41 7.036 -6.041 -8.065
311 1HD2 LEU 41 1HD2 LEU 41 5.944 -5.273 -5.917
312 2HD2 LEU 41 2HD2 LEU 41 5.399 -3.598 -5.886
313 3HD2 LEU 41 3HD2 LEU 41 4.269 -4.894 -6.312
314 H ALA 42 H ALA 42 9.711 -1.706 -8.127
315 HA ALA 42 HA ALA 42 11.346 -3.164 -9.834
316 1HB ALA 42 1HB ALA 42 13.154 -1.713 -9.088
317 2HB ALA 42 2HB ALA 42 11.657 -0.753 -9.204
318 3HB ALA 42 3HB ALA 42 12.266 -1.300 -7.616
319 H THR 43 H THR 43 11.067 -3.428 -6.269
320 HA THR 43 HA THR 43 12.707 -5.878 -6.481
321 HB THR 43 HB THR 43 14.086 -4.062 -5.664
322 HG1 THR 43 1HG THR 43 14.482 -6.212 -5.064
323 1HG2 THR 43 1HG2 THR 43 12.290 -2.853 -4.328
324 2HG2 THR 43 2HG2 THR 43 12.496 -4.097 -3.077
325 3HG2 THR 43 3HG2 THR 43 13.855 -3.058 -3.516
326 H GLU 44 H GLU 44 9.992 -5.768 -6.780
327 HA GLU 44 HA GLU 44 7.943 -6.260 -5.957
328 1HB GLU 44 2HB GLU 44 9.635 -8.544 -4.897
329 2HB GLU 44 3HB GLU 44 7.866 -8.537 -4.972
330 1HG GLU 44 2HG GLU 44 8.050 -8.018 -7.466
331 2HG GLU 44 3HG GLU 44 9.760 -8.464 -7.327
332 H THR 45 H THR 45 8.911 -4.237 -4.280
333 HA THR 45 HA THR 45 7.850 -5.026 -1.601
334 HB THR 45 HB THR 45 10.021 -3.052 -2.440
335 HG1 THR 45 1HG THR 45 10.570 -5.330 -2.365
336 1HG2 THR 45 1HG2 THR 45 8.840 -2.159 -0.478
337 2HG2 THR 45 2HG2 THR 45 8.942 -3.761 0.312
338 3HG2 THR 45 3HG2 THR 45 10.414 -2.817 0.001
339 H VAL 46 H VAL 46 6.589 -3.331 -0.541
340 HA VAL 46 HA VAL 46 5.654 -1.099 -2.297
341 HB VAL 46 HB VAL 46 3.816 -2.531 -2.352
342 1HG1 VAL 46 1HG1 VAL 46 2.810 -3.605 -0.320
343 2HG1 VAL 46 2HG1 VAL 46 4.426 -4.226 -0.651
344 3HG1 VAL 46 3HG1 VAL 46 4.189 -3.025 0.634
345 1HG2 VAL 46 1HG2 VAL 46 2.099 -1.429 -1.073
346 2HG2 VAL 46 2HG2 VAL 46 3.266 -0.758 0.066
347 3HG2 VAL 46 3HG2 VAL 46 3.279 -0.214 -1.628
348 H ASN 47 H ASN 47 5.537 0.953 -1.265
349 HA ASN 47 HA ASN 47 6.164 0.966 1.623
350 1HB ASN 47 2HB ASN 47 7.414 2.588 -0.639
351 2HB ASN 47 3HB ASN 47 7.363 3.190 1.021
352 1HD2 ASN 47 1HD2 ASN 47 8.210 1.584 2.743
353 2HD2 ASN 47 2HD2 ASN 47 9.797 0.965 2.314
354 H VAL 48 H VAL 48 4.950 2.525 2.788
355 HA VAL 48 HA VAL 48 3.013 4.135 1.230
356 HB VAL 48 HB VAL 48 2.275 2.366 3.582
357 1HG1 VAL 48 1HG1 VAL 48 0.535 4.033 1.708
358 2HG1 VAL 48 2HG1 VAL 48 0.016 3.141 3.156
359 3HG1 VAL 48 3HG1 VAL 48 1.039 4.579 3.313
360 1HG2 VAL 48 1HG2 VAL 48 0.834 1.154 1.948
361 2HG2 VAL 48 2HG2 VAL 48 1.614 2.043 0.625
362 3HG2 VAL 48 3HG2 VAL 48 2.557 0.925 1.636
363 H ILE 49 H ILE 49 3.080 6.178 2.000
364 HA ILE 49 HA ILE 49 4.713 6.679 4.395
365 HB ILE 49 HB ILE 49 3.941 8.686 2.241
366 1HG1 ILE 49 2HG1 ILE 49 5.153 7.000 1.047
367 2HG1 ILE 49 3HG1 ILE 49 6.185 8.406 1.286
368 1HG2 ILE 49 1HG2 ILE 49 6.034 8.683 4.453
369 2HG2 ILE 49 2HG2 ILE 49 5.955 9.879 3.141
370 3HG2 ILE 49 3HG2 ILE 49 4.623 9.729 4.291
371 1HD1 ILE 49 1HD1 ILE 49 7.499 6.417 1.729
372 2HD1 ILE 49 2HD1 ILE 49 7.223 7.266 3.267
373 3HD1 ILE 49 3HD1 ILE 49 6.286 5.812 2.873
374 H TYR 50 H TYR 50 3.127 6.434 5.981
375 HA TYR 50 HA TYR 50 0.653 8.107 5.702
376 1HB TYR 50 2HB TYR 50 -0.703 6.409 6.526
377 2HB TYR 50 3HB TYR 50 0.168 5.779 5.168
378 HD1 TYR 50 HD1 TYR 50 0.140 5.829 8.941
379 HD2 TYR 50 HD2 TYR 50 1.187 3.623 5.392
380 HE1 TYR 50 HE1 TYR 50 0.564 3.847 10.306
381 HE2 TYR 50 HE2 TYR 50 1.260 1.548 6.731
382 HH TYR 50 HH TYR 50 1.190 1.549 10.227
383 H ASP 51 H ASP 51 -0.490 8.403 7.617
384 HA ASP 51 HA ASP 51 1.401 9.349 9.631
385 1HB ASP 51 2HB ASP 51 -1.538 9.983 9.305
386 2HB ASP 51 3HB ASP 51 -0.334 10.782 10.339
387 HA PRO 52 HA PRO 52 0.021 5.685 11.880
388 1HB PRO 52 2HB PRO 52 1.840 5.548 13.878
389 2HB PRO 52 3HB PRO 52 2.255 5.221 12.171
390 1HG PRO 52 2HG PRO 52 2.553 7.858 13.652
391 2HG PRO 52 3HG PRO 52 3.823 6.968 12.766
392 1HD PRO 52 2HD PRO 52 2.419 8.957 11.600
393 2HD PRO 52 3HD PRO 52 2.810 7.486 10.658
394 H ALA 53 H ALA 53 -0.639 8.825 12.671
395 HA ALA 53 HA ALA 53 -1.700 8.349 15.381
396 1HB ALA 53 1HB ALA 53 -0.683 10.546 14.862
397 2HB ALA 53 2HB ALA 53 -1.804 10.746 13.495
398 3HB ALA 53 3HB ALA 53 -2.428 10.692 15.156
399 H GLU 54 H GLU 54 -2.469 8.163 11.952
400 HA GLU 54 HA GLU 54 -5.354 8.140 12.553
401 1HB GLU 54 2HB GLU 54 -4.365 10.119 11.303
402 2HB GLU 54 3HB GLU 54 -4.122 9.045 9.927
403 1HG GLU 54 2HG GLU 54 -6.543 8.643 9.786
404 2HG GLU 54 3HG GLU 54 -6.807 9.448 11.343
405 H THR 55 H THR 55 -2.882 6.867 10.281
406 HA THR 55 HA THR 55 -4.363 4.324 10.169
407 HB THR 55 HB THR 55 -2.433 3.836 8.316
408 HG1 THR 55 1HG THR 55 -3.006 6.573 8.139
409 1HG2 THR 55 1HG2 THR 55 -4.794 3.545 8.070
410 2HG2 THR 55 2HG2 THR 55 -5.078 5.314 7.926
411 3HG2 THR 55 3HG2 THR 55 -4.105 4.440 6.699
412 H GLY 56 H GLY 56 -2.499 2.559 9.792
413 1HA GLY 56 2HA GLY 56 -0.575 1.902 11.564
414 2HA GLY 56 3HA GLY 56 -1.968 2.206 12.624
415 H THR 57 H THR 57 -0.981 0.592 9.900
416 HA THR 57 HA THR 57 -1.584 -0.409 8.208
417 HB THR 57 HB THR 57 -1.335 -2.884 8.491
418 HG1 THR 57 1HG THR 57 -1.457 -2.180 11.237
419 1HG2 THR 57 1HG2 THR 57 0.730 -1.491 8.489
420 2HG2 THR 57 2HG2 THR 57 0.614 -1.315 10.254
421 3HG2 THR 57 3HG2 THR 57 0.869 -2.913 9.542
422 H ALA 58 H ALA 58 -3.887 -1.058 10.753
423 HA ALA 58 HA ALA 58 -5.940 -2.426 9.964
424 1HB ALA 58 1HB ALA 58 -5.910 -0.882 11.868
425 2HB ALA 58 2HB ALA 58 -5.887 0.505 10.777
426 3HB ALA 58 3HB ALA 58 -7.348 -0.515 10.881
427 H ALA 59 H ALA 59 -5.443 0.809 8.501
428 HA ALA 59 HA ALA 59 -7.950 0.229 6.977
429 1HB ALA 59 1HB ALA 59 -7.935 2.496 6.145
430 2HB ALA 59 2HB ALA 59 -8.021 2.370 7.909
431 3HB ALA 59 3HB ALA 59 -6.515 2.859 7.133
432 H ILE 60 H ILE 60 -4.541 0.127 6.637
433 HA ILE 60 HA ILE 60 -4.454 0.238 3.761
434 HB ILE 60 HB ILE 60 -2.525 -0.404 6.002
435 1HG1 ILE 60 2HG1 ILE 60 -1.157 1.045 4.238
436 2HG1 ILE 60 3HG1 ILE 60 -2.746 1.455 3.649
437 1HG2 ILE 60 1HG2 ILE 60 -0.794 -1.142 4.559
438 2HG2 ILE 60 2HG2 ILE 60 -2.109 -2.307 4.521
439 3HG2 ILE 60 3HG2 ILE 60 -1.897 -1.183 3.153
440 1HD1 ILE 60 1HD1 ILE 60 -3.259 2.189 6.093
441 2HD1 ILE 60 2HD1 ILE 60 -1.584 1.774 6.488
442 3HD1 ILE 60 3HD1 ILE 60 -1.916 3.094 5.358
443 H GLN 61 H GLN 61 -4.540 -2.434 6.168
444 HA GLN 61 HA GLN 61 -4.385 -4.416 4.075
445 1HB GLN 61 2HB GLN 61 -4.762 -4.428 6.972
446 2HB GLN 61 3HB GLN 61 -5.841 -5.554 6.136
447 1HG GLN 61 2HG GLN 61 -4.054 -6.893 6.591
448 2HG GLN 61 3HG GLN 61 -3.825 -6.482 4.893
449 1HE2 GLN 61 1HE2 GLN 61 -2.898 -3.634 6.154
450 2HE2 GLN 61 2HE2 GLN 61 -1.234 -4.002 6.566
451 H GLU 62 H GLU 62 -7.154 -2.914 5.831
452 HA GLU 62 HA GLU 62 -9.318 -4.109 4.555
453 1HB GLU 62 2HB GLU 62 -8.761 -1.321 5.635
454 2HB GLU 62 3HB GLU 62 -10.307 -1.700 4.869
455 1HG GLU 62 2HG GLU 62 -10.627 -3.576 6.481
456 2HG GLU 62 3HG GLU 62 -9.130 -3.092 7.303
457 H LYS 63 H LYS 63 -7.631 -1.098 3.415
458 HA LYS 63 HA LYS 63 -9.184 -1.002 1.064
459 1HB LYS 63 2HB LYS 63 -6.753 0.370 2.143
460 2HB LYS 63 3HB LYS 63 -7.016 0.382 0.421
461 1HG LYS 63 2HG LYS 63 -9.147 1.253 2.382
462 2HG LYS 63 3HG LYS 63 -7.953 2.372 1.702
463 1HD LYS 63 2HD LYS 63 -9.753 0.711 -0.110
464 2HD LYS 63 3HD LYS 63 -10.258 2.269 0.551
465 1HE LYS 63 2HE LYS 63 -8.488 3.462 -0.535
466 2HE LYS 63 3HE LYS 63 -7.617 1.983 -0.940
467 1HZ LYS 63 1HZ LYS 63 -10.207 2.731 -2.090
468 2HZ LYS 63 2HZ LYS 63 -8.733 2.917 -2.800
469 3HZ LYS 63 3HZ LYS 63 -9.306 1.404 -2.476
470 H ILE 64 H ILE 64 -6.055 -2.580 1.775
471 HA ILE 64 HA ILE 64 -5.021 -3.040 -0.757
472 HB ILE 64 HB ILE 64 -4.824 -4.140 1.950
473 1HG1 ILE 64 2HG1 ILE 64 -3.476 -2.259 1.178
474 2HG1 ILE 64 3HG1 ILE 64 -2.562 -3.666 1.719
475 1HG2 ILE 64 1HG2 ILE 64 -3.956 -5.821 -0.366
476 2HG2 ILE 64 2HG2 ILE 64 -3.279 -5.928 1.282
477 3HG2 ILE 64 3HG2 ILE 64 -4.995 -6.241 1.018
478 1HD1 ILE 64 1HD1 ILE 64 -2.411 -4.307 -0.771
479 2HD1 ILE 64 2HD1 ILE 64 -2.933 -2.640 -1.094
480 3HD1 ILE 64 3HD1 ILE 64 -1.449 -2.933 -0.168
481 H GLU 65 H GLU 65 -7.230 -5.070 1.303
482 HA GLU 65 HA GLU 65 -7.905 -7.060 -0.602
483 1HB GLU 65 2HB GLU 65 -9.412 -5.886 1.770
484 2HB GLU 65 3HB GLU 65 -10.034 -7.233 0.814
485 1HG GLU 65 2HG GLU 65 -7.219 -7.558 1.786
486 2HG GLU 65 3HG GLU 65 -8.488 -7.553 3.018
487 H LYS 66 H LYS 66 -9.694 -4.042 0.232
488 HA LYS 66 HA LYS 66 -11.719 -4.342 -1.679
489 1HB LYS 66 2HB LYS 66 -10.650 -2.175 -0.016
490 2HB LYS 66 3HB LYS 66 -11.260 -1.538 -1.538
491 1HG LYS 66 2HG LYS 66 -12.832 -3.394 0.288
492 2HG LYS 66 3HG LYS 66 -12.902 -1.627 0.383
493 1HD LYS 66 2HD LYS 66 -13.662 -1.497 -1.984
494 2HD LYS 66 3HD LYS 66 -13.602 -3.259 -2.100
495 1HE LYS 66 2HE LYS 66 -15.199 -3.061 0.088
496 2HE LYS 66 3HE LYS 66 -15.552 -1.482 -0.627
497 1HZ LYS 66 1HZ LYS 66 -17.075 -3.159 -1.377
498 2HZ LYS 66 2HZ LYS 66 -16.168 -2.673 -2.662
499 3HZ LYS 66 3HZ LYS 66 -15.859 -4.114 -1.926
500 H LEU 67 H LEU 67 -8.496 -3.020 -2.155
501 HA LEU 67 HA LEU 67 -8.885 -2.099 -4.870
502 1HB LEU 67 2HB LEU 67 -6.464 -2.609 -3.129
503 2HB LEU 67 3HB LEU 67 -6.337 -2.019 -4.784
504 HG LEU 67 HG LEU 67 -8.089 -0.569 -2.762
505 1HD1 LEU 67 1HD1 LEU 67 -5.123 -0.163 -3.240
506 2HD1 LEU 67 2HD1 LEU 67 -6.162 0.931 -2.329
507 3HD1 LEU 67 3HD1 LEU 67 -5.875 -0.718 -1.744
508 1HD2 LEU 67 1HD2 LEU 67 -6.699 0.252 -5.351
509 2HD2 LEU 67 2HD2 LEU 67 -8.443 0.112 -5.077
510 3HD2 LEU 67 3HD2 LEU 67 -7.515 1.379 -4.261
511 H GLY 68 H GLY 68 -8.437 -5.226 -3.450
512 1HA GLY 68 2HA GLY 68 -8.731 -7.211 -4.569
513 2HA GLY 68 3HA GLY 68 -8.356 -6.450 -6.120
514 H TYR 69 H TYR 69 -6.367 -6.251 -3.105
515 HA TYR 69 HA TYR 69 -4.256 -7.931 -4.407
516 1HB TYR 69 2HB TYR 69 -4.245 -5.072 -3.679
517 2HB TYR 69 3HB TYR 69 -2.948 -5.963 -2.912
518 HD1 TYR 69 HD1 TYR 69 -4.632 -5.571 -6.235
519 HD2 TYR 69 HD2 TYR 69 -0.985 -6.470 -4.124
520 HE1 TYR 69 HE1 TYR 69 -3.395 -5.308 -8.294
521 HE2 TYR 69 HE2 TYR 69 0.282 -6.114 -6.174
522 HH TYR 69 HH TYR 69 0.178 -5.547 -8.476
523 H HIS 70 H HIS 70 -2.526 -8.478 -2.767
524 HA HIS 70 HA HIS 70 -3.331 -8.316 0.037
525 1HB HIS 70 2HB HIS 70 -4.322 -10.456 -0.956
526 2HB HIS 70 3HB HIS 70 -2.667 -11.051 -1.107
527 HD1 HIS 70 1HD HIS 70 -1.584 -10.059 1.795
528 HD2 HIS 70 2HD HIS 70 -5.291 -11.891 0.961
529 HE1 HIS 70 1HE HIS 70 -2.421 -11.034 3.977
530 H VAL 71 H VAL 71 -1.521 -7.420 0.944
531 HA VAL 71 HA VAL 71 1.112 -7.826 -0.216
532 HB VAL 71 HB VAL 71 1.802 -6.275 1.503
533 1HG1 VAL 71 1HG1 VAL 71 0.554 -4.322 0.834
534 2HG1 VAL 71 2HG1 VAL 71 0.689 -5.410 -0.563
535 3HG1 VAL 71 3HG1 VAL 71 -0.825 -5.329 0.362
536 1HG2 VAL 71 1HG2 VAL 71 0.496 -6.989 3.432
537 2HG2 VAL 71 2HG2 VAL 71 0.261 -5.266 3.122
538 3HG2 VAL 71 3HG2 VAL 71 -1.003 -6.422 2.669
539 H VAL 72 H VAL 72 2.922 -8.433 1.360
540 HA VAL 72 HA VAL 72 2.094 -10.628 3.202
541 HB VAL 72 HB VAL 72 4.494 -10.748 1.450
542 1HG1 VAL 72 1HG1 VAL 72 3.053 -12.861 3.107
543 2HG1 VAL 72 2HG1 VAL 72 4.494 -13.130 2.107
544 3HG1 VAL 72 3HG1 VAL 72 4.601 -12.099 3.536
545 1HG2 VAL 72 1HG2 VAL 72 2.633 -10.879 -0.073
546 2HG2 VAL 72 2HG2 VAL 72 3.221 -12.525 0.211
547 3HG2 VAL 72 3HG2 VAL 72 1.742 -11.969 1.020
548 H ILE 73 H ILE 73 3.264 -10.757 5.064
549 HA ILE 73 HA ILE 73 4.926 -8.365 5.722
550 HB ILE 73 HB ILE 73 3.284 -9.968 7.652
551 1HG1 ILE 73 2HG1 ILE 73 1.681 -9.049 6.077
552 2HG1 ILE 73 3HG1 ILE 73 1.683 -8.201 7.615
553 1HG2 ILE 73 1HG2 ILE 73 5.196 -8.622 8.507
554 2HG2 ILE 73 2HG2 ILE 73 4.556 -7.184 7.742
555 3HG2 ILE 73 3HG2 ILE 73 3.639 -7.968 9.050
556 1HD1 ILE 73 1HD1 ILE 73 2.844 -6.281 6.663
557 2HD1 ILE 73 2HD1 ILE 73 2.975 -7.112 5.095
558 3HD1 ILE 73 3HD1 ILE 73 1.390 -6.661 5.739
559 H GLU 74 H GLU 74 6.701 -9.865 4.718
560 HA GLU 74 HA GLU 74 7.543 -12.031 6.259
561 1HB GLU 74 2HB GLU 74 8.704 -10.478 3.954
562 2HB GLU 74 3HB GLU 74 9.666 -11.654 4.835
563 1HG GLU 74 2HG GLU 74 7.959 -13.411 4.421
564 2HG GLU 74 3HG GLU 74 7.046 -12.264 3.419
565 H GLY 75 H GLY 75 7.665 -8.907 6.942
566 1HA GLY 75 2HA GLY 75 9.865 -9.176 8.973
567 2HA GLY 75 3HA GLY 75 9.601 -7.672 8.071
568 H ARG 76 H ARG 76 7.663 -10.119 9.833
569 HA ARG 76 HA ARG 76 5.778 -8.087 10.751
570 1HB ARG 76 2HB ARG 76 5.173 -10.445 9.907
571 2HB ARG 76 3HB ARG 76 5.812 -11.053 11.428
572 1HG ARG 76 2HG ARG 76 3.926 -8.800 11.798
573 2HG ARG 76 3HG ARG 76 3.198 -10.113 10.873
574 1HD ARG 76 2HD ARG 76 3.578 -11.713 12.596
575 2HD ARG 76 3HD ARG 76 4.672 -10.660 13.484
576 HE ARG 76 HE ARG 76 1.748 -10.635 13.491
577 1HH1 ARG 76 2HH2 ARG 76 4.641 -8.645 14.114
578 2HH1 ARG 76 1HH2 ARG 76 3.891 -7.670 15.323
579 1HH2 ARG 76 2HH1 ARG 76 0.707 -9.267 15.033
580 2HH2 ARG 76 1HH1 ARG 76 1.591 -7.995 15.814
Start of MODEL 13
1 1H MET 1 H1 MET 1 -4.350 17.226 14.515
2 2H MET 1 H2 MET 1 -5.306 18.463 15.063
3 3H MET 1 H3 MET 1 -3.856 18.784 14.330
4 HA MET 1 HA MET 1 -3.639 19.116 16.627
5 1HB MET 1 2HB MET 1 -4.923 16.400 16.704
6 2HB MET 1 3HB MET 1 -3.627 16.671 17.882
7 1HG MET 1 2HG MET 1 -5.896 18.631 17.533
8 2HG MET 1 3HG MET 1 -5.916 17.312 18.711
9 1HE MET 1 1HE MET 1 -5.807 20.823 18.818
10 2HE MET 1 2HE MET 1 -6.483 19.785 20.103
11 3HE MET 1 3HE MET 1 -5.166 20.928 20.472
12 H LEU 2 H LEU 2 -2.496 15.760 16.303
13 HA LEU 2 HA LEU 2 0.010 16.703 15.076
14 1HB LEU 2 2HB LEU 2 0.375 16.680 17.542
15 2HB LEU 2 3HB LEU 2 -0.248 15.026 17.613
16 HG LEU 2 HG LEU 2 1.659 14.258 16.184
17 1HD1 LEU 2 1HD1 LEU 2 2.592 17.153 16.487
18 2HD1 LEU 2 2HD1 LEU 2 3.614 15.812 15.934
19 3HD1 LEU 2 3HD1 LEU 2 2.230 16.312 14.962
20 1HD2 LEU 2 1HD2 LEU 2 1.763 14.155 18.645
21 2HD2 LEU 2 2HD2 LEU 2 3.360 14.457 17.943
22 3HD2 LEU 2 3HD2 LEU 2 2.455 15.792 18.694
23 H SER 3 H SER 3 0.377 15.369 13.390
24 HA SER 3 HA SER 3 -0.413 12.541 13.546
25 1HB SER 3 2HB SER 3 -0.836 14.301 11.093
26 2HB SER 3 3HB SER 3 -1.117 12.563 11.186
27 HG SER 3 HG SER 3 -3.044 12.949 12.061
28 H GLU 4 H GLU 4 1.489 11.452 13.198
29 HA GLU 4 HA GLU 4 3.973 12.910 12.522
30 1HB GLU 4 2HB GLU 4 3.236 10.364 13.885
31 2HB GLU 4 3HB GLU 4 4.854 10.608 13.281
32 1HG GLU 4 2HG GLU 4 5.207 12.452 14.655
33 2HG GLU 4 3HG GLU 4 3.500 12.549 15.094
34 H GLN 5 H GLN 5 5.426 11.273 11.052
35 HA GLN 5 HA GLN 5 3.722 9.728 9.183
36 1HB GLN 5 2HB GLN 5 5.938 11.665 8.529
37 2HB GLN 5 3HB GLN 5 5.269 10.592 7.333
38 1HG GLN 5 2HG GLN 5 3.531 12.641 8.838
39 2HG GLN 5 3HG GLN 5 4.437 13.014 7.406
40 1HE2 GLN 5 1HE2 GLN 5 3.444 9.751 7.125
41 2HE2 GLN 5 2HE2 GLN 5 2.086 10.055 6.078
42 H LYS 6 H LYS 6 4.612 7.826 8.691
43 HA LYS 6 HA LYS 6 7.520 7.460 8.963
44 1HB LYS 6 2HB LYS 6 5.609 5.415 10.088
45 2HB LYS 6 3HB LYS 6 7.352 5.260 9.939
46 1HG LYS 6 2HG LYS 6 6.967 7.669 11.427
47 2HG LYS 6 3HG LYS 6 5.766 6.547 12.038
48 1HD LYS 6 2HD LYS 6 7.697 6.255 13.369
49 2HD LYS 6 3HD LYS 6 7.712 4.863 12.264
50 1HE LYS 6 2HE LYS 6 9.309 6.201 10.756
51 2HE LYS 6 3HE LYS 6 9.290 7.490 11.964
52 1HZ LYS 6 1HZ LYS 6 10.227 5.932 13.540
53 2HZ LYS 6 2HZ LYS 6 10.276 4.755 12.385
54 3HZ LYS 6 3HZ LYS 6 11.188 6.115 12.216
55 H GLU 7 H GLU 7 8.386 5.930 7.654
56 HA GLU 7 HA GLU 7 6.885 5.374 5.181
57 1HB GLU 7 2HB GLU 7 9.872 5.037 5.451
58 2HB GLU 7 3HB GLU 7 8.864 5.533 4.097
59 1HG GLU 7 2HG GLU 7 10.079 7.425 4.664
60 2HG GLU 7 3HG GLU 7 8.542 7.757 5.467
61 H ILE 8 H ILE 8 5.824 3.425 5.666
62 HA ILE 8 HA ILE 8 7.297 1.307 7.023
63 HB ILE 8 HB ILE 8 4.612 1.160 5.802
64 1HG1 ILE 8 2HG1 ILE 8 4.133 3.118 6.880
65 2HG1 ILE 8 3HG1 ILE 8 3.575 1.797 7.916
66 1HG2 ILE 8 1HG2 ILE 8 5.664 -0.846 6.782
67 2HG2 ILE 8 2HG2 ILE 8 5.809 0.012 8.316
68 3HG2 ILE 8 3HG2 ILE 8 4.192 -0.369 7.654
69 1HD1 ILE 8 1HD1 ILE 8 6.010 3.492 8.288
70 2HD1 ILE 8 2HD1 ILE 8 4.592 3.323 9.349
71 3HD1 ILE 8 3HD1 ILE 8 5.744 1.973 9.159
72 H ALA 9 H ALA 9 7.471 -0.869 5.876
73 HA ALA 9 HA ALA 9 7.493 -0.713 2.920
74 1HB ALA 9 1HB ALA 9 9.738 -1.906 4.585
75 2HB ALA 9 2HB ALA 9 9.636 -1.829 2.818
76 3HB ALA 9 3HB ALA 9 9.836 -0.343 3.774
77 H MET 10 H MET 10 6.410 -2.485 2.105
78 HA MET 10 HA MET 10 6.368 -5.018 3.651
79 1HB MET 10 2HB MET 10 3.888 -3.623 2.519
80 2HB MET 10 3HB MET 10 3.966 -5.254 3.187
81 1HG MET 10 2HG MET 10 3.204 -4.156 5.003
82 2HG MET 10 3HG MET 10 4.924 -4.093 5.324
83 1HE MET 10 1HE MET 10 1.611 -2.295 4.846
84 2HE MET 10 2HE MET 10 2.043 -0.639 4.384
85 3HE MET 10 3HE MET 10 2.240 -1.962 3.210
86 H GLN 11 H GLN 11 5.283 -6.742 2.231
87 HA GLN 11 HA GLN 11 6.341 -6.613 -0.556
88 1HB GLN 11 2HB GLN 11 6.434 -8.594 1.577
89 2HB GLN 11 3HB GLN 11 5.506 -9.256 0.240
90 1HG GLN 11 2HG GLN 11 8.219 -7.994 -0.280
91 2HG GLN 11 3HG GLN 11 8.060 -9.640 0.356
92 1HE2 GLN 11 1HE2 GLN 11 7.368 -7.608 -2.461
93 2HE2 GLN 11 2HE2 GLN 11 6.743 -8.905 -3.466
94 H VAL 12 H VAL 12 4.891 -7.742 -2.197
95 HA VAL 12 HA VAL 12 1.998 -7.588 -1.465
96 HB VAL 12 HB VAL 12 1.655 -7.108 -3.918
97 1HG1 VAL 12 1HG1 VAL 12 1.893 -4.675 -3.602
98 2HG1 VAL 12 2HG1 VAL 12 1.211 -5.452 -2.160
99 3HG1 VAL 12 3HG1 VAL 12 2.921 -4.964 -2.183
100 1HG2 VAL 12 1HG2 VAL 12 3.371 -5.993 -5.143
101 2HG2 VAL 12 2HG2 VAL 12 4.495 -6.049 -3.770
102 3HG2 VAL 12 3HG2 VAL 12 4.035 -7.551 -4.615
103 H SER 13 H SER 13 0.601 -9.045 -2.432
104 HA SER 13 HA SER 13 1.707 -11.340 -3.913
105 1HB SER 13 2HB SER 13 0.261 -11.540 -1.244
106 2HB SER 13 3HB SER 13 0.420 -12.896 -2.373
107 HG SER 13 HG SER 13 2.109 -12.823 -0.785
108 H GLY 14 H GLY 14 -0.079 -12.667 -4.762
109 1HA GLY 14 2HA GLY 14 -2.073 -12.979 -5.850
110 2HA GLY 14 3HA GLY 14 -2.825 -11.920 -4.644
111 H MET 15 H MET 15 -0.650 -11.754 -7.524
112 HA MET 15 HA MET 15 -2.119 -9.375 -8.509
113 1HB MET 15 2HB MET 15 -0.010 -8.273 -8.994
114 2HB MET 15 3HB MET 15 -0.181 -8.550 -7.248
115 1HG MET 15 2HG MET 15 1.487 -10.343 -9.054
116 2HG MET 15 3HG MET 15 2.111 -8.907 -8.255
117 1HE MET 15 1HE MET 15 3.153 -12.037 -8.042
118 2HE MET 15 2HE MET 15 4.033 -10.611 -7.430
119 3HE MET 15 3HE MET 15 3.696 -11.984 -6.348
120 H THR 16 H THR 16 -1.846 -8.979 -10.764
121 HA THR 16 HA THR 16 -0.861 -11.150 -12.486
122 HB THR 16 HB THR 16 -1.274 -9.038 -14.117
123 HG1 THR 16 1HG THR 16 -3.350 -8.443 -12.432
124 1HG2 THR 16 1HG2 THR 16 -2.486 -11.138 -14.299
125 2HG2 THR 16 2HG2 THR 16 -3.482 -10.747 -12.881
126 3HG2 THR 16 3HG2 THR 16 -3.630 -9.789 -14.378
127 H CYS 17 H CYS 17 -0.160 -7.590 -12.227
128 HA CYS 17 HA CYS 17 2.733 -8.128 -12.228
129 1HB CYS 17 2HB CYS 17 2.952 -7.071 -14.492
130 2HB CYS 17 3HB CYS 17 2.042 -8.575 -14.522
131 H ALA 18 H ALA 18 3.801 -5.962 -12.937
132 HA ALA 18 HA ALA 18 3.322 -3.942 -10.963
133 1HB ALA 18 1HB ALA 18 5.058 -2.707 -12.225
134 2HB ALA 18 2HB ALA 18 5.538 -4.399 -12.005
135 3HB ALA 18 3HB ALA 18 4.905 -3.852 -13.573
136 H ALA 19 H ALA 19 3.121 -1.558 -11.886
137 HA ALA 19 HA ALA 19 1.823 0.058 -12.751
138 1HB ALA 19 1HB ALA 19 0.679 -1.875 -14.807
139 2HB ALA 19 2HB ALA 19 0.696 -0.109 -14.835
140 3HB ALA 19 3HB ALA 19 2.222 -1.006 -14.987
141 H CYS 20 H CYS 20 -0.066 -3.030 -12.780
142 HA CYS 20 HA CYS 20 -2.419 -1.852 -11.664
143 1HB CYS 20 2HB CYS 20 -1.347 -4.704 -11.208
144 2HB CYS 20 3HB CYS 20 -3.043 -4.194 -11.108
145 H ALA 21 H ALA 21 0.388 -3.440 -10.179
146 HA ALA 21 HA ALA 21 -0.129 -3.045 -7.476
147 1HB ALA 21 1HB ALA 21 2.284 -3.170 -7.183
148 2HB ALA 21 2HB ALA 21 1.797 -4.310 -8.440
149 3HB ALA 21 3HB ALA 21 2.544 -2.779 -8.904
150 H ALA 22 H ALA 22 0.483 -0.521 -9.864
151 HA ALA 22 HA ALA 22 1.235 1.512 -7.888
152 1HB ALA 22 1HB ALA 22 1.124 3.045 -9.704
153 2HB ALA 22 2HB ALA 22 1.848 1.571 -10.387
154 3HB ALA 22 3HB ALA 22 0.137 1.955 -10.686
155 H ARG 23 H ARG 23 -1.682 0.450 -9.672
156 HA ARG 23 HA ARG 23 -3.254 2.711 -8.947
157 1HB ARG 23 2HB ARG 23 -4.124 -0.126 -9.660
158 2HB ARG 23 3HB ARG 23 -5.220 1.254 -9.566
159 1HG ARG 23 2HG ARG 23 -2.808 1.138 -11.425
160 2HG ARG 23 3HG ARG 23 -4.409 0.607 -11.902
161 1HD ARG 23 2HD ARG 23 -4.248 3.381 -10.737
162 2HD ARG 23 3HD ARG 23 -3.441 3.114 -12.294
163 HE ARG 23 HE ARG 23 -6.029 1.984 -12.450
164 1HH1 ARG 23 2HH2 ARG 23 -4.523 5.146 -12.102
165 2HH1 ARG 23 1HH2 ARG 23 -5.710 6.012 -13.027
166 1HH2 ARG 23 2HH1 ARG 23 -7.628 3.091 -13.733
167 2HH2 ARG 23 1HH1 ARG 23 -7.524 4.804 -13.970
168 H ILE 24 H ILE 24 -2.811 -0.459 -7.378
169 HA ILE 24 HA ILE 24 -4.657 0.027 -5.312
170 HB ILE 24 HB ILE 24 -3.726 -1.716 -4.053
171 1HG1 ILE 24 2HG1 ILE 24 -1.316 -1.294 -5.736
172 2HG1 ILE 24 3HG1 ILE 24 -1.445 -1.196 -3.961
173 1HG2 ILE 24 1HG2 ILE 24 -3.260 -2.518 -6.953
174 2HG2 ILE 24 2HG2 ILE 24 -3.960 -3.463 -5.624
175 3HG2 ILE 24 3HG2 ILE 24 -4.878 -2.138 -6.338
176 1HD1 ILE 24 1HD1 ILE 24 -1.879 -3.658 -3.915
177 2HD1 ILE 24 2HD1 ILE 24 -1.537 -3.680 -5.667
178 3HD1 ILE 24 3HD1 ILE 24 -0.267 -3.219 -4.523
179 H GLU 25 H GLU 25 -1.120 0.662 -5.237
180 HA GLU 25 HA GLU 25 -1.029 1.920 -2.750
181 1HB GLU 25 2HB GLU 25 0.668 1.948 -5.224
182 2HB GLU 25 3HB GLU 25 0.960 3.225 -4.035
183 1HG GLU 25 2HG GLU 25 0.828 0.308 -3.211
184 2HG GLU 25 3HG GLU 25 2.318 1.109 -3.730
185 H LYS 26 H LYS 26 -1.852 3.328 -5.906
186 HA LYS 26 HA LYS 26 -1.756 6.055 -4.860
187 1HB LYS 26 2HB LYS 26 -2.427 4.833 -7.520
188 2HB LYS 26 3HB LYS 26 -2.956 6.478 -7.153
189 1HG LYS 26 2HG LYS 26 -0.801 6.516 -8.281
190 2HG LYS 26 3HG LYS 26 -0.703 7.215 -6.661
191 1HD LYS 26 2HD LYS 26 0.334 5.043 -5.838
192 2HD LYS 26 3HD LYS 26 0.180 4.425 -7.483
193 1HE LYS 26 2HE LYS 26 2.422 5.016 -7.291
194 2HE LYS 26 3HE LYS 26 1.694 6.295 -8.268
195 1HZ LYS 26 1HZ LYS 26 2.403 6.445 -5.376
196 2HZ LYS 26 2HZ LYS 26 3.162 7.182 -6.610
197 3HZ LYS 26 3HZ LYS 26 1.640 7.642 -6.212
198 H GLY 27 H GLY 27 -4.425 3.728 -5.561
199 1HA GLY 27 2HA GLY 27 -6.523 5.486 -4.629
200 2HA GLY 27 3HA GLY 27 -6.581 3.721 -4.680
201 H LEU 28 H LEU 28 -4.302 3.185 -3.063
202 HA LEU 28 HA LEU 28 -5.346 3.295 -0.398
203 1HB LEU 28 2HB LEU 28 -4.054 1.558 -1.307
204 2HB LEU 28 3HB LEU 28 -2.654 2.606 -1.516
205 HG LEU 28 HG LEU 28 -3.881 1.923 1.182
206 1HD1 LEU 28 1HD1 LEU 28 -3.221 -0.097 0.055
207 2HD1 LEU 28 2HD1 LEU 28 -1.652 0.596 -0.410
208 3HD1 LEU 28 3HD1 LEU 28 -2.014 0.276 1.296
209 1HD2 LEU 28 1HD2 LEU 28 -2.502 3.813 1.458
210 2HD2 LEU 28 2HD2 LEU 28 -1.337 2.503 1.704
211 3HD2 LEU 28 3HD2 LEU 28 -1.373 3.347 0.161
212 H LYS 29 H LYS 29 -2.969 5.371 -2.148
213 HA LYS 29 HA LYS 29 -2.407 7.063 0.019
214 1HB LYS 29 2HB LYS 29 -1.483 7.015 -2.495
215 2HB LYS 29 3HB LYS 29 -2.690 8.276 -2.714
216 1HG LYS 29 2HG LYS 29 -1.386 9.046 -0.315
217 2HG LYS 29 3HG LYS 29 -0.129 8.261 -1.238
218 1HD LYS 29 2HD LYS 29 0.190 10.318 -2.121
219 2HD LYS 29 3HD LYS 29 -1.121 9.890 -3.206
220 1HE LYS 29 2HE LYS 29 -1.280 11.449 -0.567
221 2HE LYS 29 3HE LYS 29 -1.371 12.142 -2.184
222 1HZ LYS 29 1HZ LYS 29 -3.448 10.819 -2.423
223 2HZ LYS 29 2HZ LYS 29 -3.309 10.364 -0.844
224 3HZ LYS 29 3HZ LYS 29 -3.519 11.941 -1.211
225 H ARG 30 H ARG 30 -5.413 6.804 -1.778
226 HA ARG 30 HA ARG 30 -6.270 9.554 -1.165
227 1HB ARG 30 2HB ARG 30 -7.282 7.266 -2.774
228 2HB ARG 30 3HB ARG 30 -8.527 8.210 -2.012
229 1HG ARG 30 2HG ARG 30 -6.270 9.492 -3.609
230 2HG ARG 30 3HG ARG 30 -7.698 8.796 -4.389
231 1HD ARG 30 2HD ARG 30 -9.184 10.217 -3.042
232 2HD ARG 30 3HD ARG 30 -7.780 11.019 -2.302
233 HE ARG 30 HE ARG 30 -7.401 11.229 -5.058
234 1HH1 ARG 30 2HH2 ARG 30 -9.860 12.265 -2.758
235 2HH1 ARG 30 1HH2 ARG 30 -10.428 13.604 -3.706
236 1HH2 ARG 30 2HH1 ARG 30 -8.103 13.024 -6.347
237 2HH2 ARG 30 1HH1 ARG 30 -9.380 14.051 -5.791
238 H MET 31 H MET 31 -5.874 6.832 0.785
239 HA MET 31 HA MET 31 -8.419 7.072 2.176
240 1HB MET 31 2HB MET 31 -5.912 5.484 2.854
241 2HB MET 31 3HB MET 31 -7.507 5.238 3.557
242 1HG MET 31 2HG MET 31 -6.678 4.777 0.675
243 2HG MET 31 3HG MET 31 -7.119 3.590 1.871
244 1HE MET 31 1HE MET 31 -9.936 5.316 2.918
245 2HE MET 31 2HE MET 31 -11.073 4.364 1.961
246 3HE MET 31 3HE MET 31 -9.733 3.555 2.814
247 HA PRO 32 HA PRO 32 -7.262 10.161 5.070
248 1HB PRO 32 2HB PRO 32 -8.504 9.367 7.404
249 2HB PRO 32 3HB PRO 32 -9.379 10.028 5.992
250 1HG PRO 32 2HG PRO 32 -8.960 7.119 6.709
251 2HG PRO 32 3HG PRO 32 -10.491 7.922 6.252
252 1HD PRO 32 2HD PRO 32 -9.021 6.536 4.484
253 2HD PRO 32 3HD PRO 32 -9.826 8.048 3.961
254 H GLY 33 H GLY 33 -5.442 10.498 6.314
255 1HA GLY 33 2HA GLY 33 -3.824 9.971 7.936
256 2HA GLY 33 3HA GLY 33 -4.234 8.255 7.831
257 H VAL 34 H VAL 34 -4.128 8.530 4.695
258 HA VAL 34 HA VAL 34 -1.245 7.897 4.660
259 HB VAL 34 HB VAL 34 -3.283 7.416 2.476
260 1HG1 VAL 34 1HG1 VAL 34 -1.507 5.801 1.742
261 2HG1 VAL 34 2HG1 VAL 34 -0.899 7.458 1.754
262 3HG1 VAL 34 3HG1 VAL 34 -0.473 6.353 3.064
263 1HG2 VAL 34 1HG2 VAL 34 -3.981 6.159 4.468
264 2HG2 VAL 34 2HG2 VAL 34 -3.234 5.052 3.315
265 3HG2 VAL 34 3HG2 VAL 34 -2.318 5.599 4.735
266 H THR 35 H THR 35 0.251 9.107 3.693
267 HA THR 35 HA THR 35 -0.642 11.694 2.493
268 HB THR 35 HB THR 35 1.561 10.909 4.301
269 HG1 THR 35 1HG THR 35 0.551 12.508 5.531
270 1HG2 THR 35 1HG2 THR 35 1.362 13.501 2.736
271 2HG2 THR 35 2HG2 THR 35 2.378 13.251 4.176
272 3HG2 THR 35 3HG2 THR 35 2.699 12.322 2.705
273 H ASP 36 H ASP 36 1.739 8.964 2.123
274 HA ASP 36 HA ASP 36 1.759 9.609 -0.714
275 1HB ASP 36 2HB ASP 36 4.100 10.195 1.026
276 2HB ASP 36 3HB ASP 36 4.457 9.197 -0.390
277 H ALA 37 H ALA 37 2.668 7.962 -1.976
278 HA ALA 37 HA ALA 37 2.739 5.246 -0.772
279 1HB ALA 37 1HB ALA 37 0.330 5.843 -0.966
280 2HB ALA 37 2HB ALA 37 0.569 6.106 -2.715
281 3HB ALA 37 3HB ALA 37 0.781 4.494 -2.011
282 H ASN 38 H ASN 38 3.933 3.835 -1.969
283 HA ASN 38 HA ASN 38 4.996 4.706 -4.593
284 1HB ASN 38 2HB ASN 38 7.103 4.079 -2.563
285 2HB ASN 38 3HB ASN 38 7.159 5.080 -4.004
286 1HD2 ASN 38 1HD2 ASN 38 5.769 4.877 -0.735
287 2HD2 ASN 38 2HD2 ASN 38 5.940 6.597 -0.355
288 H VAL 39 H VAL 39 4.576 2.892 -5.673
289 HA VAL 39 HA VAL 39 4.795 0.234 -4.491
290 HB VAL 39 HB VAL 39 2.971 0.692 -5.937
291 1HG1 VAL 39 1HG1 VAL 39 3.379 1.113 -8.438
292 2HG1 VAL 39 2HG1 VAL 39 3.484 2.486 -7.332
293 3HG1 VAL 39 3HG1 VAL 39 4.950 1.747 -7.986
294 1HG2 VAL 39 1HG2 VAL 39 3.238 -1.038 -7.630
295 2HG2 VAL 39 2HG2 VAL 39 4.967 -1.104 -7.342
296 3HG2 VAL 39 3HG2 VAL 39 3.830 -1.535 -6.034
297 H ASN 40 H ASN 40 7.048 0.041 -3.943
298 HA ASN 40 HA ASN 40 9.054 0.585 -6.030
299 1HB ASN 40 2HB ASN 40 9.377 1.212 -3.649
300 2HB ASN 40 3HB ASN 40 9.391 -0.502 -3.218
301 1HD2 ASN 40 1HD2 ASN 40 11.605 0.445 -2.385
302 2HD2 ASN 40 2HD2 ASN 40 12.938 0.299 -3.519
303 H LEU 41 H LEU 41 7.524 -1.117 -7.161
304 HA LEU 41 HA LEU 41 8.023 -3.918 -6.667
305 1HB LEU 41 2HB LEU 41 6.513 -2.266 -8.601
306 2HB LEU 41 3HB LEU 41 7.217 -3.679 -9.350
307 HG LEU 41 HG LEU 41 4.872 -3.862 -8.441
308 1HD1 LEU 41 1HD1 LEU 41 6.943 -5.952 -7.670
309 2HD1 LEU 41 2HD1 LEU 41 5.194 -6.232 -7.802
310 3HD1 LEU 41 3HD1 LEU 41 6.133 -5.785 -9.236
311 1HD2 LEU 41 1HD2 LEU 41 6.075 -4.621 -5.772
312 2HD2 LEU 41 2HD2 LEU 41 5.643 -2.934 -6.070
313 3HD2 LEU 41 3HD2 LEU 41 4.410 -4.200 -6.191
314 H ALA 42 H ALA 42 9.835 -1.452 -8.278
315 HA ALA 42 HA ALA 42 11.579 -2.857 -9.940
316 1HB ALA 42 1HB ALA 42 12.099 -0.689 -7.878
317 2HB ALA 42 2HB ALA 42 13.327 -1.278 -9.007
318 3HB ALA 42 3HB ALA 42 11.858 -0.484 -9.637
319 H THR 43 H THR 43 11.289 -3.084 -6.381
320 HA THR 43 HA THR 43 13.182 -5.344 -6.566
321 HB THR 43 HB THR 43 14.548 -3.592 -5.700
322 HG1 THR 43 1HG THR 43 13.633 -5.365 -3.718
323 1HG2 THR 43 1HG2 THR 43 12.302 -3.032 -3.732
324 2HG2 THR 43 2HG2 THR 43 13.961 -2.426 -3.542
325 3HG2 THR 43 3HG2 THR 43 13.001 -1.947 -4.949
326 H GLU 44 H GLU 44 10.328 -5.359 -6.717
327 HA GLU 44 HA GLU 44 8.405 -6.089 -5.699
328 1HB GLU 44 2HB GLU 44 10.611 -8.022 -5.075
329 2HB GLU 44 3HB GLU 44 9.014 -8.322 -4.402
330 1HG GLU 44 2HG GLU 44 9.223 -9.522 -6.480
331 2HG GLU 44 3HG GLU 44 7.965 -8.288 -6.594
332 H THR 45 H THR 45 9.045 -3.879 -4.243
333 HA THR 45 HA THR 45 8.009 -4.689 -1.605
334 HB THR 45 HB THR 45 9.882 -2.323 -1.964
335 HG1 THR 45 1HG THR 45 11.609 -3.775 -1.439
336 1HG2 THR 45 1HG2 THR 45 8.711 -2.726 0.171
337 2HG2 THR 45 2HG2 THR 45 9.351 -4.392 0.181
338 3HG2 THR 45 3HG2 THR 45 10.459 -3.002 0.365
339 H VAL 46 H VAL 46 6.743 -2.975 -0.573
340 HA VAL 46 HA VAL 46 5.920 -0.698 -2.319
341 HB VAL 46 HB VAL 46 4.113 -2.226 -2.549
342 1HG1 VAL 46 1HG1 VAL 46 4.190 -2.610 0.476
343 2HG1 VAL 46 2HG1 VAL 46 2.872 -3.158 -0.569
344 3HG1 VAL 46 3HG1 VAL 46 4.487 -3.845 -0.768
345 1HG2 VAL 46 1HG2 VAL 46 3.619 0.147 -2.011
346 2HG2 VAL 46 2HG2 VAL 46 2.301 -0.978 -1.604
347 3HG2 VAL 46 3HG2 VAL 46 3.324 -0.311 -0.319
348 H ASN 47 H ASN 47 5.825 1.205 -1.286
349 HA ASN 47 HA ASN 47 6.486 1.245 1.605
350 1HB ASN 47 2HB ASN 47 7.746 2.751 -0.729
351 2HB ASN 47 3HB ASN 47 7.730 3.440 0.895
352 1HD2 ASN 47 1HD2 ASN 47 8.451 1.780 2.697
353 2HD2 ASN 47 2HD2 ASN 47 10.042 1.136 2.317
354 H VAL 48 H VAL 48 5.178 2.698 2.761
355 HA VAL 48 HA VAL 48 3.458 4.506 1.210
356 HB VAL 48 HB VAL 48 2.118 2.514 1.363
357 1HG1 VAL 48 1HG1 VAL 48 2.712 2.459 4.344
358 2HG1 VAL 48 2HG1 VAL 48 1.483 1.489 3.509
359 3HG1 VAL 48 3HG1 VAL 48 3.193 1.264 3.126
360 1HG2 VAL 48 1HG2 VAL 48 1.356 4.767 3.240
361 2HG2 VAL 48 2HG2 VAL 48 0.825 4.444 1.584
362 3HG2 VAL 48 3HG2 VAL 48 0.280 3.406 2.919
363 H ILE 49 H ILE 49 3.329 6.380 2.216
364 HA ILE 49 HA ILE 49 4.666 6.639 4.822
365 HB ILE 49 HB ILE 49 4.429 8.508 2.450
366 1HG1 ILE 49 2HG1 ILE 49 6.948 8.842 3.253
367 2HG1 ILE 49 3HG1 ILE 49 6.687 7.323 4.104
368 1HG2 ILE 49 1HG2 ILE 49 3.768 9.938 4.282
369 2HG2 ILE 49 2HG2 ILE 49 5.131 9.343 5.274
370 3HG2 ILE 49 3HG2 ILE 49 5.415 10.313 3.809
371 1HD1 ILE 49 1HD1 ILE 49 6.060 6.285 1.915
372 2HD1 ILE 49 2HD1 ILE 49 6.267 7.893 1.160
373 3HD1 ILE 49 3HD1 ILE 49 7.671 7.035 1.849
374 H TYR 50 H TYR 50 3.183 6.766 6.415
375 HA TYR 50 HA TYR 50 0.737 8.373 6.028
376 1HB TYR 50 2HB TYR 50 -0.720 6.634 6.790
377 2HB TYR 50 3HB TYR 50 0.077 6.142 5.327
378 HD1 TYR 50 HD1 TYR 50 1.196 3.987 5.273
379 HD2 TYR 50 HD2 TYR 50 0.117 5.740 9.022
380 HE1 TYR 50 HE1 TYR 50 1.548 1.813 6.411
381 HE2 TYR 50 HE2 TYR 50 0.907 3.725 10.200
382 HH TYR 50 HH TYR 50 1.406 1.471 9.934
383 H ASP 51 H ASP 51 -0.427 8.587 8.002
384 HA ASP 51 HA ASP 51 1.376 8.962 10.307
385 1HB ASP 51 2HB ASP 51 -0.039 10.822 9.964
386 2HB ASP 51 3HB ASP 51 -1.480 9.797 9.848
387 HA PRO 52 HA PRO 52 -0.125 5.012 11.864
388 1HB PRO 52 2HB PRO 52 1.621 4.614 13.897
389 2HB PRO 52 3HB PRO 52 2.146 4.628 12.191
390 1HG PRO 52 2HG PRO 52 2.234 6.944 14.153
391 2HG PRO 52 3HG PRO 52 3.578 6.306 13.160
392 1HD PRO 52 2HD PRO 52 2.059 8.430 12.371
393 2HD PRO 52 3HD PRO 52 2.663 7.230 11.185
394 H ALA 53 H ALA 53 -1.106 7.921 13.100
395 HA ALA 53 HA ALA 53 -2.360 6.711 15.506
396 1HB ALA 53 1HB ALA 53 -1.220 8.950 15.721
397 2HB ALA 53 2HB ALA 53 -2.410 9.609 14.582
398 3HB ALA 53 3HB ALA 53 -2.950 8.936 16.123
399 H GLU 54 H GLU 54 -2.872 8.080 12.248
400 HA GLU 54 HA GLU 54 -5.792 7.865 12.472
401 1HB GLU 54 2HB GLU 54 -3.842 9.367 10.808
402 2HB GLU 54 3HB GLU 54 -5.043 8.509 9.844
403 1HG GLU 54 2HG GLU 54 -6.061 10.509 10.062
404 2HG GLU 54 3HG GLU 54 -6.837 9.583 11.343
405 H THR 55 H THR 55 -3.127 6.662 10.390
406 HA THR 55 HA THR 55 -4.613 4.123 10.047
407 HB THR 55 HB THR 55 -3.023 3.648 8.053
408 HG1 THR 55 1HG THR 55 -3.117 6.423 8.099
409 1HG2 THR 55 1HG2 THR 55 -5.367 3.846 7.924
410 2HG2 THR 55 2HG2 THR 55 -5.307 5.619 7.999
411 3HG2 THR 55 3HG2 THR 55 -4.611 4.767 6.595
412 H GLY 56 H GLY 56 -2.086 2.734 9.474
413 1HA GLY 56 2HA GLY 56 -0.623 1.686 11.283
414 2HA GLY 56 3HA GLY 56 -1.986 2.038 12.359
415 H THR 57 H THR 57 -1.071 0.454 9.628
416 HA THR 57 HA THR 57 -1.686 -0.413 7.878
417 HB THR 57 HB THR 57 -1.600 -2.897 8.000
418 HG1 THR 57 1HG THR 57 -1.750 -2.387 10.789
419 1HG2 THR 57 1HG2 THR 57 0.542 -1.646 8.132
420 2HG2 THR 57 2HG2 THR 57 0.403 -1.598 9.906
421 3HG2 THR 57 3HG2 THR 57 0.568 -3.151 9.073
422 H ALA 58 H ALA 58 -4.151 -0.981 10.283
423 HA ALA 58 HA ALA 58 -6.239 -2.246 9.379
424 1HB ALA 58 1HB ALA 58 -6.224 -0.683 11.250
425 2HB ALA 58 2HB ALA 58 -6.037 0.687 10.154
426 3HB ALA 58 3HB ALA 58 -7.571 -0.234 10.170
427 H ALA 59 H ALA 59 -5.389 0.928 7.888
428 HA ALA 59 HA ALA 59 -7.940 0.625 6.304
429 1HB ALA 59 1HB ALA 59 -7.294 2.883 7.190
430 2HB ALA 59 2HB ALA 59 -5.935 2.876 6.015
431 3HB ALA 59 3HB ALA 59 -7.609 2.815 5.447
432 H ILE 60 H ILE 60 -4.487 0.741 5.852
433 HA ILE 60 HA ILE 60 -4.300 0.364 3.061
434 HB ILE 60 HB ILE 60 -2.599 -0.145 5.528
435 1HG1 ILE 60 2HG1 ILE 60 -1.181 1.158 3.542
436 2HG1 ILE 60 3HG1 ILE 60 -2.807 1.744 3.279
437 1HG2 ILE 60 1HG2 ILE 60 -0.714 -0.973 4.197
438 2HG2 ILE 60 2HG2 ILE 60 -2.012 -2.142 4.396
439 3HG2 ILE 60 3HG2 ILE 60 -1.823 -1.301 2.844
440 1HD1 ILE 60 1HD1 ILE 60 -1.563 3.203 4.845
441 2HD1 ILE 60 2HD1 ILE 60 -2.941 2.448 5.668
442 3HD1 ILE 60 3HD1 ILE 60 -1.290 1.832 5.935
443 H GLN 61 H GLN 61 -4.484 -2.101 5.654
444 HA GLN 61 HA GLN 61 -4.287 -4.201 3.746
445 1HB GLN 61 2HB GLN 61 -3.844 -4.034 6.300
446 2HB GLN 61 3HB GLN 61 -5.499 -4.650 6.457
447 1HG GLN 61 2HG GLN 61 -4.863 -6.666 5.205
448 2HG GLN 61 3HG GLN 61 -3.299 -5.958 4.767
449 1HE2 GLN 61 1HE2 GLN 61 -2.001 -5.099 6.804
450 2HE2 GLN 61 2HE2 GLN 61 -1.929 -6.244 8.132
451 H GLU 62 H GLU 62 -7.100 -2.725 5.462
452 HA GLU 62 HA GLU 62 -9.243 -4.144 4.364
453 1HB GLU 62 2HB GLU 62 -8.751 -1.280 5.215
454 2HB GLU 62 3HB GLU 62 -10.217 -1.607 4.337
455 1HG GLU 62 2HG GLU 62 -10.769 -3.409 6.023
456 2HG GLU 62 3HG GLU 62 -9.379 -2.843 6.974
457 H LYS 63 H LYS 63 -7.648 -1.232 2.925
458 HA LYS 63 HA LYS 63 -9.242 -1.405 0.596
459 1HB LYS 63 2HB LYS 63 -6.872 0.198 1.540
460 2HB LYS 63 3HB LYS 63 -7.443 0.336 -0.090
461 1HG LYS 63 2HG LYS 63 -9.362 0.577 2.281
462 2HG LYS 63 3HG LYS 63 -8.375 1.909 1.743
463 1HD LYS 63 2HD LYS 63 -10.469 2.261 0.795
464 2HD LYS 63 3HD LYS 63 -9.392 1.818 -0.532
465 1HE LYS 63 2HE LYS 63 -10.488 -0.299 -0.796
466 2HE LYS 63 3HE LYS 63 -11.216 -0.217 0.832
467 1HZ LYS 63 1HZ LYS 63 -12.809 0.219 -0.873
468 2HZ LYS 63 2HZ LYS 63 -12.605 1.558 0.052
469 3HZ LYS 63 3HZ LYS 63 -11.938 1.486 -1.454
470 H ILE 64 H ILE 64 -5.968 -2.541 1.351
471 HA ILE 64 HA ILE 64 -4.952 -3.069 -1.101
472 HB ILE 64 HB ILE 64 -4.607 -4.044 1.610
473 1HG1 ILE 64 2HG1 ILE 64 -3.257 -2.317 0.371
474 2HG1 ILE 64 3HG1 ILE 64 -2.356 -3.564 1.223
475 1HG2 ILE 64 1HG2 ILE 64 -4.848 -6.223 0.927
476 2HG2 ILE 64 2HG2 ILE 64 -3.950 -5.955 -0.594
477 3HG2 ILE 64 3HG2 ILE 64 -3.116 -5.920 0.976
478 1HD1 ILE 64 1HD1 ILE 64 -1.939 -4.783 -0.855
479 2HD1 ILE 64 2HD1 ILE 64 -2.931 -3.633 -1.769
480 3HD1 ILE 64 3HD1 ILE 64 -1.413 -3.099 -1.010
481 H GLU 65 H GLU 65 -6.976 -5.108 1.095
482 HA GLU 65 HA GLU 65 -7.598 -7.294 -0.571
483 1HB GLU 65 2HB GLU 65 -9.077 -5.999 1.762
484 2HB GLU 65 3HB GLU 65 -9.611 -7.493 0.993
485 1HG GLU 65 2HG GLU 65 -6.807 -7.217 2.089
486 2HG GLU 65 3HG GLU 65 -8.174 -7.687 3.108
487 H LYS 66 H LYS 66 -9.650 -4.414 0.141
488 HA LYS 66 HA LYS 66 -11.703 -5.138 -1.664
489 1HB LYS 66 2HB LYS 66 -10.883 -2.662 -0.217
490 2HB LYS 66 3HB LYS 66 -11.982 -2.417 -1.577
491 1HG LYS 66 2HG LYS 66 -12.544 -4.582 0.465
492 2HG LYS 66 3HG LYS 66 -12.945 -2.905 0.834
493 1HD LYS 66 2HD LYS 66 -14.413 -2.654 -0.996
494 2HD LYS 66 3HD LYS 66 -13.860 -4.107 -1.818
495 1HE LYS 66 2HE LYS 66 -15.233 -4.208 0.911
496 2HE LYS 66 3HE LYS 66 -16.154 -4.159 -0.598
497 1HZ LYS 66 1HZ LYS 66 -15.098 -6.163 -1.302
498 2HZ LYS 66 2HZ LYS 66 -14.165 -6.235 0.051
499 3HZ LYS 66 3HZ LYS 66 -15.798 -6.402 0.163
500 H LEU 67 H LEU 67 -8.706 -3.440 -2.384
501 HA LEU 67 HA LEU 67 -9.437 -2.669 -5.080
502 1HB LEU 67 2HB LEU 67 -6.860 -2.852 -3.493
503 2HB LEU 67 3HB LEU 67 -6.837 -2.505 -5.216
504 HG LEU 67 HG LEU 67 -8.670 -0.850 -3.476
505 1HD1 LEU 67 1HD1 LEU 67 -6.761 -0.489 -2.178
506 2HD1 LEU 67 2HD1 LEU 67 -5.661 -0.686 -3.527
507 3HD1 LEU 67 3HD1 LEU 67 -6.626 0.797 -3.378
508 1HD2 LEU 67 1HD2 LEU 67 -8.712 -0.657 -5.971
509 2HD2 LEU 67 2HD2 LEU 67 -8.183 0.842 -5.191
510 3HD2 LEU 67 3HD2 LEU 67 -6.991 -0.228 -5.952
511 H GLY 68 H GLY 68 -8.584 -5.692 -3.614
512 1HA GLY 68 2HA GLY 68 -8.716 -7.748 -4.638
513 2HA GLY 68 3HA GLY 68 -8.611 -7.012 -6.243
514 H TYR 69 H TYR 69 -6.473 -6.664 -3.336
515 HA TYR 69 HA TYR 69 -4.255 -8.084 -4.731
516 1HB TYR 69 2HB TYR 69 -4.501 -5.241 -4.221
517 2HB TYR 69 3HB TYR 69 -3.262 -5.882 -3.171
518 HD1 TYR 69 HD1 TYR 69 -4.399 -5.810 -6.737
519 HD2 TYR 69 HD2 TYR 69 -1.124 -6.518 -4.024
520 HE1 TYR 69 HE1 TYR 69 -2.833 -5.692 -8.612
521 HE2 TYR 69 HE2 TYR 69 0.464 -6.267 -5.882
522 HH TYR 69 HH TYR 69 -0.530 -5.765 -9.287
523 H HIS 70 H HIS 70 -2.452 -8.452 -2.964
524 HA HIS 70 HA HIS 70 -3.504 -8.274 -0.218
525 1HB HIS 70 2HB HIS 70 -3.855 -10.629 -1.182
526 2HB HIS 70 3HB HIS 70 -2.096 -10.793 -1.141
527 HD1 HIS 70 1HD HIS 70 -4.872 -9.649 1.382
528 HD2 HIS 70 2HD HIS 70 -1.524 -12.178 1.039
529 HE1 HIS 70 1HE HIS 70 -4.531 -10.699 3.654
530 H VAL 71 H VAL 71 -1.752 -8.307 1.385
531 HA VAL 71 HA VAL 71 0.862 -7.416 0.317
532 HB VAL 71 HB VAL 71 -0.506 -5.470 0.778
533 1HG1 VAL 71 1HG1 VAL 71 -0.437 -6.286 3.733
534 2HG1 VAL 71 2HG1 VAL 71 -1.253 -4.882 3.028
535 3HG1 VAL 71 3HG1 VAL 71 -1.870 -6.515 2.723
536 1HG2 VAL 71 1HG2 VAL 71 1.817 -5.119 1.025
537 2HG2 VAL 71 2HG2 VAL 71 1.017 -4.284 2.353
538 3HG2 VAL 71 3HG2 VAL 71 1.825 -5.832 2.662
539 H VAL 72 H VAL 72 2.605 -8.121 1.518
540 HA VAL 72 HA VAL 72 2.011 -10.060 3.703
541 HB VAL 72 HB VAL 72 4.399 -10.085 1.952
542 1HG1 VAL 72 1HG1 VAL 72 3.194 -12.179 3.802
543 2HG1 VAL 72 2HG1 VAL 72 4.648 -12.388 2.803
544 3HG1 VAL 72 3HG1 VAL 72 4.650 -11.216 4.121
545 1HG2 VAL 72 1HG2 VAL 72 1.842 -11.719 1.651
546 2HG2 VAL 72 2HG2 VAL 72 2.473 -10.533 0.481
547 3HG2 VAL 72 3HG2 VAL 72 3.369 -12.028 0.791
548 H ILE 73 H ILE 73 3.099 -9.838 5.547
549 HA ILE 73 HA ILE 73 4.447 -7.228 6.000
550 HB ILE 73 HB ILE 73 3.159 -9.053 8.027
551 1HG1 ILE 73 2HG1 ILE 73 1.390 -8.394 6.533
552 2HG1 ILE 73 3HG1 ILE 73 1.304 -7.468 8.024
553 1HG2 ILE 73 1HG2 ILE 73 4.806 -7.519 8.982
554 2HG2 ILE 73 2HG2 ILE 73 4.129 -6.159 8.085
555 3HG2 ILE 73 3HG2 ILE 73 3.184 -6.938 9.377
556 1HD1 ILE 73 1HD1 ILE 73 2.352 -6.416 5.370
557 2HD1 ILE 73 2HD1 ILE 73 0.793 -6.054 6.120
558 3HD1 ILE 73 3HD1 ILE 73 2.282 -5.495 6.894
559 H GLU 74 H GLU 74 6.399 -8.346 4.978
560 HA GLU 74 HA GLU 74 7.707 -10.336 6.399
561 1HB GLU 74 2HB GLU 74 8.269 -8.790 4.039
562 2HB GLU 74 3HB GLU 74 9.718 -9.032 5.027
563 1HG GLU 74 2HG GLU 74 9.537 -10.847 3.433
564 2HG GLU 74 3HG GLU 74 9.285 -11.479 5.064
565 H GLY 75 H GLY 75 7.238 -7.354 7.431
566 1HA GLY 75 2HA GLY 75 7.964 -6.248 9.372
567 2HA GLY 75 3HA GLY 75 9.143 -7.542 9.644
568 H ARG 76 H ARG 76 8.453 -4.891 7.320
569 HA ARG 76 HA ARG 76 9.652 -3.564 6.075
570 1HB ARG 76 2HB ARG 76 10.120 -2.593 8.150
571 2HB ARG 76 3HB ARG 76 11.453 -3.696 8.491
572 1HG ARG 76 2HG ARG 76 12.867 -2.699 6.854
573 2HG ARG 76 3HG ARG 76 11.525 -1.798 6.119
574 1HD ARG 76 2HD ARG 76 11.354 -0.395 8.119
575 2HD ARG 76 3HD ARG 76 12.610 -1.375 8.930
576 HE ARG 76 HE ARG 76 13.658 -0.487 6.467
577 1HH1 ARG 76 2HH2 ARG 76 12.652 0.890 9.531
578 2HH1 ARG 76 1HH2 ARG 76 13.757 2.235 9.501
579 1HH2 ARG 76 2HH1 ARG 76 15.158 1.271 6.364
580 2HH2 ARG 76 1HH1 ARG 76 15.221 2.453 7.629
Start of MODEL 14
1 1H MET 1 H1 MET 1 -3.506 19.523 14.049
2 2H MET 1 H2 MET 1 -4.488 20.334 15.114
3 3H MET 1 H3 MET 1 -2.852 20.191 15.394
4 HA MET 1 HA MET 1 -4.088 18.738 16.809
5 1HB MET 1 2HB MET 1 -4.807 17.449 14.130
6 2HB MET 1 3HB MET 1 -4.918 16.620 15.695
7 1HG MET 1 2HG MET 1 -6.455 18.247 16.568
8 2HG MET 1 3HG MET 1 -6.553 19.042 14.982
9 1HE MET 1 1HE MET 1 -9.903 16.891 15.705
10 2HE MET 1 2HE MET 1 -8.825 17.488 16.985
11 3HE MET 1 3HE MET 1 -9.258 18.550 15.617
12 H LEU 2 H LEU 2 -3.209 15.997 15.290
13 HA LEU 2 HA LEU 2 -0.289 16.269 15.524
14 1HB LEU 2 2HB LEU 2 -0.892 15.786 17.772
15 2HB LEU 2 3HB LEU 2 -2.212 14.725 17.304
16 HG LEU 2 HG LEU 2 0.359 13.692 16.299
17 1HD1 LEU 2 1HD1 LEU 2 1.264 13.048 18.496
18 2HD1 LEU 2 2HD1 LEU 2 1.284 14.807 18.275
19 3HD1 LEU 2 3HD1 LEU 2 0.044 14.053 19.305
20 1HD2 LEU 2 1HD2 LEU 2 -0.454 11.649 17.435
21 2HD2 LEU 2 2HD2 LEU 2 -1.731 12.582 18.240
22 3HD2 LEU 2 3HD2 LEU 2 -1.759 12.363 16.481
23 H SER 3 H SER 3 0.260 15.416 13.554
24 HA SER 3 HA SER 3 -0.658 12.753 12.973
25 1HB SER 3 2HB SER 3 -0.718 14.363 10.466
26 2HB SER 3 3HB SER 3 -1.746 13.035 10.979
27 HG SER 3 HG SER 3 -1.929 15.670 12.024
28 H GLU 4 H GLU 4 1.394 11.840 12.982
29 HA GLU 4 HA GLU 4 3.685 13.394 11.944
30 1HB GLU 4 2HB GLU 4 3.311 11.013 13.661
31 2HB GLU 4 3HB GLU 4 4.701 10.981 12.605
32 1HG GLU 4 2HG GLU 4 5.187 13.318 13.529
33 2HG GLU 4 3HG GLU 4 4.049 12.866 14.802
34 H GLN 5 H GLN 5 5.172 11.684 10.571
35 HA GLN 5 HA GLN 5 3.478 10.120 8.728
36 1HB GLN 5 2HB GLN 5 5.718 12.045 8.062
37 2HB GLN 5 3HB GLN 5 5.058 10.951 6.874
38 1HG GLN 5 2HG GLN 5 3.345 13.055 8.339
39 2HG GLN 5 3HG GLN 5 4.245 13.373 6.886
40 1HE2 GLN 5 1HE2 GLN 5 3.232 10.139 6.713
41 2HE2 GLN 5 2HE2 GLN 5 1.839 10.382 5.707
42 H LYS 6 H LYS 6 4.476 8.212 8.122
43 HA LYS 6 HA LYS 6 7.341 8.010 8.254
44 1HB LYS 6 2HB LYS 6 5.617 6.165 9.964
45 2HB LYS 6 3HB LYS 6 7.175 5.665 9.295
46 1HG LYS 6 2HG LYS 6 8.080 7.910 10.290
47 2HG LYS 6 3HG LYS 6 6.662 7.831 11.344
48 1HD LYS 6 2HD LYS 6 7.409 5.678 12.229
49 2HD LYS 6 3HD LYS 6 8.647 5.539 10.955
50 1HE LYS 6 2HE LYS 6 9.765 7.608 11.816
51 2HE LYS 6 3HE LYS 6 8.620 7.646 13.168
52 1HZ LYS 6 1HZ LYS 6 10.705 6.604 13.730
53 2HZ LYS 6 2HZ LYS 6 9.488 5.501 13.841
54 3HZ LYS 6 3HZ LYS 6 10.520 5.473 12.551
55 H GLU 7 H GLU 7 8.165 6.156 7.277
56 HA GLU 7 HA GLU 7 6.728 5.524 4.783
57 1HB GLU 7 2HB GLU 7 9.687 5.208 4.935
58 2HB GLU 7 3HB GLU 7 8.649 5.871 3.702
59 1HG GLU 7 2HG GLU 7 9.970 7.669 4.397
60 2HG GLU 7 3HG GLU 7 8.507 7.973 5.332
61 H ILE 8 H ILE 8 5.729 3.641 5.536
62 HA ILE 8 HA ILE 8 7.333 1.641 6.980
63 HB ILE 8 HB ILE 8 4.483 1.710 6.141
64 1HG1 ILE 8 2HG1 ILE 8 4.134 1.842 8.729
65 2HG1 ILE 8 3HG1 ILE 8 5.855 2.182 8.869
66 1HG2 ILE 8 1HG2 ILE 8 5.179 -0.509 6.357
67 2HG2 ILE 8 2HG2 ILE 8 6.030 -0.105 7.899
68 3HG2 ILE 8 3HG2 ILE 8 4.239 -0.074 7.795
69 1HD1 ILE 8 1HD1 ILE 8 4.104 3.856 7.092
70 2HD1 ILE 8 2HD1 ILE 8 4.061 4.086 8.860
71 3HD1 ILE 8 3HD1 ILE 8 5.588 4.292 7.983
72 H ALA 9 H ALA 9 7.218 -0.573 6.007
73 HA ALA 9 HA ALA 9 7.310 -0.651 3.059
74 1HB ALA 9 1HB ALA 9 9.436 -1.844 3.072
75 2HB ALA 9 2HB ALA 9 9.669 -0.267 3.858
76 3HB ALA 9 3HB ALA 9 9.535 -1.734 4.843
77 H MET 10 H MET 10 6.552 -2.665 2.308
78 HA MET 10 HA MET 10 6.616 -4.995 4.001
79 1HB MET 10 2HB MET 10 4.118 -5.419 3.826
80 2HB MET 10 3HB MET 10 4.656 -4.276 5.044
81 1HG MET 10 2HG MET 10 3.901 -3.095 2.418
82 2HG MET 10 3HG MET 10 2.606 -3.837 3.353
83 1HE MET 10 1HE MET 10 2.738 -0.823 2.390
84 2HE MET 10 2HE MET 10 1.355 -1.575 3.216
85 3HE MET 10 3HE MET 10 2.015 -0.034 3.817
86 H GLN 11 H GLN 11 5.235 -6.782 2.732
87 HA GLN 11 HA GLN 11 6.428 -6.812 -0.001
88 1HB GLN 11 2HB GLN 11 5.661 -8.888 2.108
89 2HB GLN 11 3HB GLN 11 5.975 -9.355 0.434
90 1HG GLN 11 2HG GLN 11 7.899 -7.987 2.389
91 2HG GLN 11 3HG GLN 11 7.950 -9.672 1.857
92 1HE2 GLN 11 1HE2 GLN 11 7.645 -9.704 -0.792
93 2HE2 GLN 11 2HE2 GLN 11 8.669 -8.529 -1.611
94 H VAL 12 H VAL 12 5.049 -7.705 -1.728
95 HA VAL 12 HA VAL 12 2.142 -7.257 -1.182
96 HB VAL 12 HB VAL 12 3.122 -5.526 -2.542
97 1HG1 VAL 12 1HG1 VAL 12 3.786 -6.136 -4.896
98 2HG1 VAL 12 2HG1 VAL 12 4.965 -6.567 -3.639
99 3HG1 VAL 12 3HG1 VAL 12 3.928 -7.816 -4.367
100 1HG2 VAL 12 1HG2 VAL 12 1.521 -5.520 -4.316
101 2HG2 VAL 12 2HG2 VAL 12 1.318 -7.276 -4.242
102 3HG2 VAL 12 3HG2 VAL 12 0.758 -6.251 -2.898
103 H SER 13 H SER 13 0.618 -8.631 -2.370
104 HA SER 13 HA SER 13 1.743 -11.052 -3.657
105 1HB SER 13 2HB SER 13 -0.265 -10.948 -1.376
106 2HB SER 13 3HB SER 13 -0.269 -12.283 -2.531
107 HG SER 13 HG SER 13 2.094 -12.396 -1.994
108 H GLY 14 H GLY 14 -0.019 -12.186 -4.864
109 1HA GLY 14 2HA GLY 14 -1.532 -12.156 -6.582
110 2HA GLY 14 3HA GLY 14 -2.439 -10.963 -5.633
111 H MET 15 H MET 15 0.727 -10.998 -7.373
112 HA MET 15 HA MET 15 -0.060 -8.570 -8.882
113 1HB MET 15 2HB MET 15 2.059 -7.511 -8.394
114 2HB MET 15 3HB MET 15 1.288 -7.954 -6.872
115 1HG MET 15 2HG MET 15 3.462 -8.572 -6.485
116 2HG MET 15 3HG MET 15 2.779 -10.112 -6.996
117 1HE MET 15 1HE MET 15 5.869 -9.583 -6.726
118 2HE MET 15 2HE MET 15 5.210 -11.113 -7.351
119 3HE MET 15 3HE MET 15 6.492 -10.265 -8.240
120 H THR 16 H THR 16 1.267 -8.215 -10.735
121 HA THR 16 HA THR 16 3.249 -10.139 -11.565
122 HB THR 16 HB THR 16 1.867 -10.233 -13.926
123 HG1 THR 16 1HG THR 16 -0.042 -10.601 -11.870
124 1HG2 THR 16 1HG2 THR 16 1.686 -12.294 -11.667
125 2HG2 THR 16 2HG2 THR 16 1.224 -12.555 -13.352
126 3HG2 THR 16 3HG2 THR 16 2.908 -12.187 -12.944
127 H CYS 17 H CYS 17 1.077 -7.596 -12.875
128 HA CYS 17 HA CYS 17 3.357 -6.328 -14.245
129 1HB CYS 17 2HB CYS 17 1.651 -4.621 -14.911
130 2HB CYS 17 3HB CYS 17 1.323 -6.265 -15.484
131 H ALA 18 H ALA 18 4.533 -4.685 -13.450
132 HA ALA 18 HA ALA 18 4.064 -3.591 -10.777
133 1HB ALA 18 1HB ALA 18 6.093 -2.275 -11.287
134 2HB ALA 18 2HB ALA 18 6.339 -3.997 -11.648
135 3HB ALA 18 3HB ALA 18 6.053 -2.844 -12.967
136 H ALA 19 H ALA 19 1.760 -3.141 -11.920
137 HA ALA 19 HA ALA 19 1.626 -0.258 -12.620
138 1HB ALA 19 1HB ALA 19 0.414 -0.705 -14.708
139 2HB ALA 19 2HB ALA 19 2.050 -1.388 -14.774
140 3HB ALA 19 3HB ALA 19 0.653 -2.453 -14.502
141 H CYS 20 H CYS 20 -0.429 -3.282 -12.593
142 HA CYS 20 HA CYS 20 -2.692 -1.898 -11.489
143 1HB CYS 20 2HB CYS 20 -1.846 -4.832 -11.558
144 2HB CYS 20 3HB CYS 20 -3.341 -4.301 -10.808
145 H ALA 21 H ALA 21 0.022 -3.682 -10.034
146 HA ALA 21 HA ALA 21 -0.530 -3.206 -7.337
147 1HB ALA 21 1HB ALA 21 1.897 -3.464 -7.014
148 2HB ALA 21 2HB ALA 21 1.259 -4.671 -8.135
149 3HB ALA 21 3HB ALA 21 2.140 -3.276 -8.774
150 H ALA 22 H ALA 22 0.185 -0.746 -9.747
151 HA ALA 22 HA ALA 22 1.069 1.234 -7.766
152 1HB ALA 22 1HB ALA 22 0.034 1.758 -10.565
153 2HB ALA 22 2HB ALA 22 1.021 2.801 -9.537
154 3HB ALA 22 3HB ALA 22 1.723 1.316 -10.214
155 H ARG 23 H ARG 23 -1.923 0.330 -9.544
156 HA ARG 23 HA ARG 23 -3.486 2.578 -8.806
157 1HB ARG 23 2HB ARG 23 -4.201 -0.273 -9.580
158 2HB ARG 23 3HB ARG 23 -5.402 0.734 -8.806
159 1HG ARG 23 2HG ARG 23 -5.886 1.060 -10.950
160 2HG ARG 23 3HG ARG 23 -5.005 2.531 -10.555
161 1HD ARG 23 2HD ARG 23 -3.249 2.007 -11.978
162 2HD ARG 23 3HD ARG 23 -3.382 0.265 -11.665
163 HE ARG 23 HE ARG 23 -5.719 1.090 -13.035
164 1HH1 ARG 23 2HH2 ARG 23 -2.292 0.608 -13.638
165 2HH1 ARG 23 1HH2 ARG 23 -2.479 0.153 -15.308
166 1HH2 ARG 23 2HH1 ARG 23 -6.038 0.409 -15.199
167 2HH2 ARG 23 1HH1 ARG 23 -4.688 0.030 -16.212
168 H ILE 24 H ILE 24 -2.967 -0.525 -7.103
169 HA ILE 24 HA ILE 24 -4.847 -0.009 -5.109
170 HB ILE 24 HB ILE 24 -3.945 -1.794 -3.834
171 1HG1 ILE 24 2HG1 ILE 24 -1.508 -1.291 -5.481
172 2HG1 ILE 24 3HG1 ILE 24 -1.679 -1.318 -3.712
173 1HG2 ILE 24 1HG2 ILE 24 -4.225 -3.471 -5.439
174 2HG2 ILE 24 2HG2 ILE 24 -5.079 -2.111 -6.161
175 3HG2 ILE 24 3HG2 ILE 24 -3.464 -2.543 -6.744
176 1HD1 ILE 24 1HD1 ILE 24 -1.781 -3.730 -5.548
177 2HD1 ILE 24 2HD1 ILE 24 -0.419 -3.270 -4.528
178 3HD1 ILE 24 3HD1 ILE 24 -1.957 -3.767 -3.775
179 H GLU 25 H GLU 25 -1.315 0.607 -4.874
180 HA GLU 25 HA GLU 25 -1.364 2.047 -2.467
181 1HB GLU 25 2HB GLU 25 0.493 1.717 -4.773
182 2HB GLU 25 3HB GLU 25 0.694 3.224 -3.865
183 1HG GLU 25 2HG GLU 25 2.095 1.383 -2.973
184 2HG GLU 25 3HG GLU 25 0.964 2.029 -1.778
185 H LYS 26 H LYS 26 -1.972 3.224 -5.771
186 HA LYS 26 HA LYS 26 -1.858 6.027 -4.979
187 1HB LYS 26 2HB LYS 26 -2.690 4.549 -7.476
188 2HB LYS 26 3HB LYS 26 -3.243 6.205 -7.232
189 1HG LYS 26 2HG LYS 26 -1.258 6.312 -8.520
190 2HG LYS 26 3HG LYS 26 -0.923 6.998 -6.921
191 1HD LYS 26 2HD LYS 26 0.285 4.998 -6.260
192 2HD LYS 26 3HD LYS 26 -0.162 4.201 -7.788
193 1HE LYS 26 2HE LYS 26 1.091 5.724 -9.129
194 2HE LYS 26 3HE LYS 26 1.389 6.814 -7.765
195 1HZ LYS 26 1HZ LYS 26 2.445 4.072 -7.949
196 2HZ LYS 26 2HZ LYS 26 3.283 5.438 -8.321
197 3HZ LYS 26 3HZ LYS 26 2.776 5.190 -6.777
198 H GLY 27 H GLY 27 -4.549 3.731 -5.538
199 1HA GLY 27 2HA GLY 27 -6.674 5.517 -4.791
200 2HA GLY 27 3HA GLY 27 -6.712 3.743 -4.769
201 H LEU 28 H LEU 28 -4.521 3.274 -2.996
202 HA LEU 28 HA LEU 28 -5.885 3.539 -0.488
203 1HB LEU 28 2HB LEU 28 -4.506 1.666 -0.987
204 2HB LEU 28 3HB LEU 28 -3.080 2.670 -1.232
205 HG LEU 28 HG LEU 28 -3.377 1.253 0.895
206 1HD1 LEU 28 1HD1 LEU 28 -2.062 2.961 2.199
207 2HD1 LEU 28 2HD1 LEU 28 -1.479 2.651 0.556
208 3HD1 LEU 28 3HD1 LEU 28 -2.399 4.122 0.909
209 1HD2 LEU 28 1HD2 LEU 28 -4.550 2.124 2.737
210 2HD2 LEU 28 2HD2 LEU 28 -4.766 3.697 2.027
211 3HD2 LEU 28 3HD2 LEU 28 -5.668 2.294 1.402
212 H LYS 29 H LYS 29 -3.229 5.396 -1.990
213 HA LYS 29 HA LYS 29 -2.648 7.145 0.059
214 1HB LYS 29 2HB LYS 29 -1.782 6.994 -2.436
215 2HB LYS 29 3HB LYS 29 -3.028 8.208 -2.727
216 1HG LYS 29 2HG LYS 29 -1.682 9.266 -0.493
217 2HG LYS 29 3HG LYS 29 -0.441 8.332 -1.298
218 1HD LYS 29 2HD LYS 29 -0.126 10.279 -2.481
219 2HD LYS 29 3HD LYS 29 -1.387 9.613 -3.495
220 1HE LYS 29 2HE LYS 29 -1.581 11.709 -1.281
221 2HE LYS 29 3HE LYS 29 -1.862 11.941 -3.001
222 1HZ LYS 29 1HZ LYS 29 -3.534 10.410 -1.096
223 2HZ LYS 29 2HZ LYS 29 -3.903 11.851 -1.774
224 3HZ LYS 29 3HZ LYS 29 -3.827 10.494 -2.714
225 H ARG 30 H ARG 30 -5.763 6.865 -1.468
226 HA ARG 30 HA ARG 30 -6.547 9.638 -0.806
227 1HB ARG 30 2HB ARG 30 -7.271 7.682 -2.779
228 2HB ARG 30 3HB ARG 30 -8.708 8.012 -1.825
229 1HG ARG 30 2HG ARG 30 -8.689 10.306 -2.432
230 2HG ARG 30 3HG ARG 30 -6.974 10.273 -2.904
231 1HD ARG 30 2HD ARG 30 -7.417 8.847 -4.794
232 2HD ARG 30 3HD ARG 30 -9.149 8.747 -4.378
233 HE ARG 30 HE ARG 30 -8.673 11.453 -4.594
234 1HH1 ARG 30 2HH2 ARG 30 -8.275 8.689 -6.744
235 2HH1 ARG 30 1HH2 ARG 30 -8.494 9.583 -8.215
236 1HH2 ARG 30 2HH1 ARG 30 -9.000 12.685 -6.531
237 2HH2 ARG 30 1HH1 ARG 30 -8.934 11.913 -8.079
238 H MET 31 H MET 31 -6.218 6.855 1.028
239 HA MET 31 HA MET 31 -8.689 7.210 2.559
240 1HB MET 31 2HB MET 31 -6.182 5.499 2.849
241 2HB MET 31 3HB MET 31 -7.217 5.750 4.229
242 1HG MET 31 2HG MET 31 -9.145 5.093 2.462
243 2HG MET 31 3HG MET 31 -7.786 4.247 1.742
244 1HE MET 31 1HE MET 31 -10.433 4.524 4.572
245 2HE MET 31 2HE MET 31 -10.761 3.351 3.270
246 3HE MET 31 3HE MET 31 -10.516 2.786 4.938
247 HA PRO 32 HA PRO 32 -7.306 10.231 5.504
248 1HB PRO 32 2HB PRO 32 -8.121 9.147 7.917
249 2HB PRO 32 3HB PRO 32 -9.233 9.900 6.737
250 1HG PRO 32 2HG PRO 32 -8.581 6.952 7.022
251 2HG PRO 32 3HG PRO 32 -10.203 7.709 6.965
252 1HD PRO 32 2HD PRO 32 -9.154 6.659 4.758
253 2HD PRO 32 3HD PRO 32 -9.936 8.252 4.640
254 H GLY 33 H GLY 33 -5.470 10.590 6.768
255 1HA GLY 33 2HA GLY 33 -3.624 10.127 8.045
256 2HA GLY 33 3HA GLY 33 -4.028 8.411 8.046
257 H VAL 34 H VAL 34 -4.127 8.410 4.944
258 HA VAL 34 HA VAL 34 -1.226 8.059 4.620
259 HB VAL 34 HB VAL 34 -3.388 7.501 2.579
260 1HG1 VAL 34 1HG1 VAL 34 -1.111 7.718 1.648
261 2HG1 VAL 34 2HG1 VAL 34 -0.451 6.690 2.917
262 3HG1 VAL 34 3HG1 VAL 34 -1.528 6.001 1.705
263 1HG2 VAL 34 1HG2 VAL 34 -3.861 6.124 4.546
264 2HG2 VAL 34 2HG2 VAL 34 -3.118 5.119 3.297
265 3HG2 VAL 34 3HG2 VAL 34 -2.151 5.664 4.683
266 H THR 35 H THR 35 0.091 9.364 3.472
267 HA THR 35 HA THR 35 -1.104 11.858 2.309
268 HB THR 35 HB THR 35 1.005 11.325 4.254
269 HG1 THR 35 1HG THR 35 0.296 13.208 5.042
270 1HG2 THR 35 1HG2 THR 35 2.554 12.033 2.618
271 2HG2 THR 35 2HG2 THR 35 1.512 13.396 2.110
272 3HG2 THR 35 3HG2 THR 35 2.272 13.384 3.718
273 H ASP 36 H ASP 36 1.479 9.317 1.922
274 HA ASP 36 HA ASP 36 1.300 9.810 -0.932
275 1HB ASP 36 2HB ASP 36 3.643 10.712 0.635
276 2HB ASP 36 3HB ASP 36 4.064 9.560 -0.638
277 H ALA 37 H ALA 37 2.428 8.116 -2.133
278 HA ALA 37 HA ALA 37 3.066 5.681 -0.684
279 1HB ALA 37 1HB ALA 37 1.266 4.283 -1.593
280 2HB ALA 37 2HB ALA 37 0.559 5.599 -0.643
281 3HB ALA 37 3HB ALA 37 0.550 5.685 -2.418
282 H ASN 38 H ASN 38 4.144 4.075 -1.888
283 HA ASN 38 HA ASN 38 4.811 4.724 -4.686
284 1HB ASN 38 2HB ASN 38 7.324 4.461 -3.421
285 2HB ASN 38 3HB ASN 38 6.641 5.862 -4.221
286 1HD2 ASN 38 1HD2 ASN 38 5.985 4.370 -0.970
287 2HD2 ASN 38 2HD2 ASN 38 6.377 5.857 -0.105
288 H VAL 39 H VAL 39 4.230 2.728 -5.372
289 HA VAL 39 HA VAL 39 5.003 0.352 -3.861
290 HB VAL 39 HB VAL 39 2.872 0.724 -5.218
291 1HG1 VAL 39 1HG1 VAL 39 3.691 1.604 -7.276
292 2HG1 VAL 39 2HG1 VAL 39 4.728 0.210 -7.577
293 3HG1 VAL 39 3HG1 VAL 39 2.980 0.014 -7.599
294 1HG2 VAL 39 1HG2 VAL 39 2.870 -1.699 -5.923
295 2HG2 VAL 39 2HG2 VAL 39 4.543 -1.774 -5.313
296 3HG2 VAL 39 3HG2 VAL 39 3.208 -1.316 -4.246
297 H ASN 40 H ASN 40 6.749 -1.142 -4.494
298 HA ASN 40 HA ASN 40 8.666 -0.092 -6.519
299 1HB ASN 40 2HB ASN 40 9.214 0.824 -4.278
300 2HB ASN 40 3HB ASN 40 9.324 -0.826 -3.640
301 1HD2 ASN 40 1HD2 ASN 40 11.572 0.281 -3.152
302 2HD2 ASN 40 2HD2 ASN 40 12.799 0.007 -4.375
303 H LEU 41 H LEU 41 7.384 -1.916 -7.517
304 HA LEU 41 HA LEU 41 7.777 -4.598 -6.563
305 1HB LEU 41 2HB LEU 41 6.886 -3.697 -9.335
306 2HB LEU 41 3HB LEU 41 6.782 -5.301 -8.643
307 HG LEU 41 HG LEU 41 4.622 -4.457 -8.477
308 1HD1 LEU 41 1HD1 LEU 41 5.411 -5.410 -6.332
309 2HD1 LEU 41 2HD1 LEU 41 5.772 -3.774 -5.740
310 3HD1 LEU 41 3HD1 LEU 41 4.105 -4.217 -6.135
311 1HD2 LEU 41 1HD2 LEU 41 3.935 -2.283 -7.878
312 2HD2 LEU 41 2HD2 LEU 41 5.533 -1.830 -7.309
313 3HD2 LEU 41 3HD2 LEU 41 5.245 -2.083 -9.041
314 H ALA 42 H ALA 42 9.682 -2.497 -8.504
315 HA ALA 42 HA ALA 42 11.337 -4.145 -9.994
316 1HB ALA 42 1HB ALA 42 11.536 -1.669 -9.863
317 2HB ALA 42 2HB ALA 42 12.209 -1.830 -8.220
318 3HB ALA 42 3HB ALA 42 13.095 -2.486 -9.607
319 H THR 43 H THR 43 11.342 -3.700 -6.441
320 HA THR 43 HA THR 43 13.215 -6.020 -6.247
321 HB THR 43 HB THR 43 14.389 -4.021 -5.588
322 HG1 THR 43 1HG THR 43 13.620 -5.746 -3.491
323 1HG2 THR 43 1HG2 THR 43 13.754 -2.714 -3.619
324 2HG2 THR 43 2HG2 THR 43 12.476 -2.609 -4.841
325 3HG2 THR 43 3HG2 THR 43 12.269 -3.657 -3.422
326 H GLU 44 H GLU 44 10.316 -6.001 -6.511
327 HA GLU 44 HA GLU 44 8.348 -6.583 -5.515
328 1HB GLU 44 2HB GLU 44 10.316 -8.569 -4.330
329 2HB GLU 44 3HB GLU 44 8.553 -8.735 -4.308
330 1HG GLU 44 2HG GLU 44 8.504 -8.607 -6.806
331 2HG GLU 44 3HG GLU 44 10.277 -8.609 -6.812
332 H THR 45 H THR 45 8.850 -4.310 -4.185
333 HA THR 45 HA THR 45 7.940 -4.963 -1.448
334 HB THR 45 HB THR 45 10.262 -3.159 -2.280
335 HG1 THR 45 1HG THR 45 10.079 -5.741 -1.382
336 1HG2 THR 45 1HG2 THR 45 10.584 -2.880 0.181
337 2HG2 THR 45 2HG2 THR 45 9.152 -2.071 -0.482
338 3HG2 THR 45 3HG2 THR 45 8.976 -3.611 0.418
339 H VAL 46 H VAL 46 6.913 -3.020 -0.438
340 HA VAL 46 HA VAL 46 6.139 -0.874 -2.338
341 HB VAL 46 HB VAL 46 4.290 -2.294 -2.579
342 1HG1 VAL 46 1HG1 VAL 46 3.090 -3.394 -0.673
343 2HG1 VAL 46 2HG1 VAL 46 4.699 -4.043 -0.995
344 3HG1 VAL 46 3HG1 VAL 46 4.452 -2.921 0.360
345 1HG2 VAL 46 1HG2 VAL 46 2.445 -1.244 -1.398
346 2HG2 VAL 46 2HG2 VAL 46 3.520 -0.540 -0.195
347 3HG2 VAL 46 3HG2 VAL 46 3.611 0.006 -1.886
348 H ASN 47 H ASN 47 5.800 1.188 -1.325
349 HA ASN 47 HA ASN 47 6.322 1.238 1.590
350 1HB ASN 47 2HB ASN 47 7.603 2.867 -0.652
351 2HB ASN 47 3HB ASN 47 7.488 3.482 1.000
352 1HD2 ASN 47 1HD2 ASN 47 8.300 1.885 2.767
353 2HD2 ASN 47 2HD2 ASN 47 9.902 1.267 2.387
354 H VAL 48 H VAL 48 5.028 2.778 2.680
355 HA VAL 48 HA VAL 48 3.170 4.374 1.025
356 HB VAL 48 HB VAL 48 2.289 2.655 3.361
357 1HG1 VAL 48 1HG1 VAL 48 0.572 4.177 1.350
358 2HG1 VAL 48 2HG1 VAL 48 0.094 3.483 2.913
359 3HG1 VAL 48 3HG1 VAL 48 1.102 4.936 2.849
360 1HG2 VAL 48 1HG2 VAL 48 1.762 2.322 0.377
361 2HG2 VAL 48 2HG2 VAL 48 2.685 1.213 1.400
362 3HG2 VAL 48 3HG2 VAL 48 0.945 1.412 1.665
363 H ILE 49 H ILE 49 3.074 6.397 1.828
364 HA ILE 49 HA ILE 49 4.711 6.955 4.198
365 HB ILE 49 HB ILE 49 3.838 8.937 2.081
366 1HG1 ILE 49 2HG1 ILE 49 5.105 7.333 0.843
367 2HG1 ILE 49 3HG1 ILE 49 6.069 8.784 1.091
368 1HG2 ILE 49 1HG2 ILE 49 5.783 10.225 2.984
369 2HG2 ILE 49 2HG2 ILE 49 4.489 9.965 4.163
370 3HG2 ILE 49 3HG2 ILE 49 5.967 8.999 4.256
371 1HD1 ILE 49 1HD1 ILE 49 7.493 6.864 1.429
372 2HD1 ILE 49 2HD1 ILE 49 7.235 7.638 3.001
373 3HD1 ILE 49 3HD1 ILE 49 6.357 6.149 2.584
374 H TYR 50 H TYR 50 3.290 6.964 5.946
375 HA TYR 50 HA TYR 50 0.753 8.493 5.726
376 1HB TYR 50 2HB TYR 50 -0.590 6.664 6.545
377 2HB TYR 50 3HB TYR 50 0.150 6.236 5.022
378 HD1 TYR 50 HD1 TYR 50 0.172 5.596 8.673
379 HD2 TYR 50 HD2 TYR 50 1.740 4.388 4.871
380 HE1 TYR 50 HE1 TYR 50 1.028 3.487 9.660
381 HE2 TYR 50 HE2 TYR 50 2.155 2.118 5.756
382 HH TYR 50 HH TYR 50 1.894 0.711 7.576
383 H ASP 51 H ASP 51 -0.359 8.558 7.773
384 HA ASP 51 HA ASP 51 1.554 9.146 9.952
385 1HB ASP 51 2HB ASP 51 -0.207 10.756 9.532
386 2HB ASP 51 3HB ASP 51 -1.440 9.508 9.701
387 HA PRO 52 HA PRO 52 0.488 4.930 11.328
388 1HB PRO 52 2HB PRO 52 2.495 4.406 13.030
389 2HB PRO 52 3HB PRO 52 2.760 4.499 11.272
390 1HG PRO 52 2HG PRO 52 3.165 6.735 13.307
391 2HG PRO 52 3HG PRO 52 4.353 6.149 12.106
392 1HD PRO 52 2HD PRO 52 2.752 8.308 11.637
393 2HD PRO 52 3HD PRO 52 3.170 7.158 10.331
394 H ALA 53 H ALA 53 -0.012 7.912 12.892
395 HA ALA 53 HA ALA 53 -0.912 6.700 15.427
396 1HB ALA 53 1HB ALA 53 -1.671 8.941 15.918
397 2HB ALA 53 2HB ALA 53 0.010 9.032 15.343
398 3HB ALA 53 3HB ALA 53 -1.333 9.481 14.267
399 H GLU 54 H GLU 54 -1.970 7.645 12.153
400 HA GLU 54 HA GLU 54 -4.765 7.418 13.015
401 1HB GLU 54 2HB GLU 54 -3.682 9.541 11.878
402 2HB GLU 54 3HB GLU 54 -3.956 8.643 10.388
403 1HG GLU 54 2HG GLU 54 -5.935 9.828 10.557
404 2HG GLU 54 3HG GLU 54 -6.424 8.370 11.437
405 H THR 55 H THR 55 -2.717 6.687 10.178
406 HA THR 55 HA THR 55 -4.102 4.151 9.837
407 HB THR 55 HB THR 55 -2.436 4.092 7.632
408 HG1 THR 55 1HG THR 55 -3.668 6.436 7.412
409 1HG2 THR 55 1HG2 THR 55 -4.562 4.588 6.488
410 2HG2 THR 55 2HG2 THR 55 -4.820 3.434 7.826
411 3HG2 THR 55 3HG2 THR 55 -5.284 5.156 8.019
412 H GLY 56 H GLY 56 -2.119 2.624 8.837
413 1HA GLY 56 2HA GLY 56 -0.147 1.722 10.506
414 2HA GLY 56 3HA GLY 56 -1.719 1.369 11.281
415 H THR 57 H THR 57 -1.897 -0.821 10.670
416 HA THR 57 HA THR 57 -1.411 -1.737 7.924
417 HB THR 57 HB THR 57 -1.904 -3.942 9.063
418 HG1 THR 57 1HG THR 57 -2.922 -3.632 10.922
419 1HG2 THR 57 1HG2 THR 57 0.422 -3.022 8.819
420 2HG2 THR 57 2HG2 THR 57 0.263 -2.193 10.377
421 3HG2 THR 57 3HG2 THR 57 0.236 -3.964 10.311
422 H ALA 58 H ALA 58 -3.923 -1.097 10.295
423 HA ALA 58 HA ALA 58 -5.937 -2.627 9.493
424 1HB ALA 58 1HB ALA 58 -7.487 -0.999 10.550
425 2HB ALA 58 2HB ALA 58 -6.013 -1.246 11.507
426 3HB ALA 58 3HB ALA 58 -6.197 0.221 10.525
427 H ALA 59 H ALA 59 -5.617 0.644 8.330
428 HA ALA 59 HA ALA 59 -8.090 0.349 6.755
429 1HB ALA 59 1HB ALA 59 -7.008 2.517 7.867
430 2HB ALA 59 2HB ALA 59 -6.265 2.666 6.247
431 3HB ALA 59 3HB ALA 59 -8.030 2.593 6.445
432 H ILE 60 H ILE 60 -4.650 0.149 6.234
433 HA ILE 60 HA ILE 60 -4.634 0.039 3.385
434 HB ILE 60 HB ILE 60 -2.710 -0.636 5.626
435 1HG1 ILE 60 2HG1 ILE 60 -1.309 0.894 4.187
436 2HG1 ILE 60 3HG1 ILE 60 -2.680 0.964 3.073
437 1HG2 ILE 60 1HG2 ILE 60 -2.304 -1.499 2.731
438 2HG2 ILE 60 2HG2 ILE 60 -1.044 -1.428 3.979
439 3HG2 ILE 60 3HG2 ILE 60 -2.370 -2.572 4.150
440 1HD1 ILE 60 1HD1 ILE 60 -2.689 1.896 6.003
441 2HD1 ILE 60 2HD1 ILE 60 -2.423 2.967 4.623
442 3HD1 ILE 60 3HD1 ILE 60 -3.991 2.197 4.842
443 H GLN 61 H GLN 61 -4.711 -2.615 5.829
444 HA GLN 61 HA GLN 61 -4.844 -4.613 3.826
445 1HB GLN 61 2HB GLN 61 -4.925 -4.515 6.678
446 2HB GLN 61 3HB GLN 61 -6.318 -5.450 6.153
447 1HG GLN 61 2HG GLN 61 -5.043 -7.239 5.855
448 2HG GLN 61 3HG GLN 61 -4.094 -6.436 4.615
449 1HE2 GLN 61 1HE2 GLN 61 -2.549 -4.591 5.843
450 2HE2 GLN 61 2HE2 GLN 61 -1.538 -5.389 7.042
451 H GLU 62 H GLU 62 -7.459 -2.882 5.588
452 HA GLU 62 HA GLU 62 -9.702 -4.059 4.402
453 1HB GLU 62 2HB GLU 62 -9.030 -1.325 5.506
454 2HB GLU 62 3HB GLU 62 -10.505 -1.480 4.573
455 1HG GLU 62 2HG GLU 62 -11.125 -3.459 6.086
456 2HG GLU 62 3HG GLU 62 -9.768 -2.961 7.116
457 H LYS 63 H LYS 63 -7.884 -1.205 3.107
458 HA LYS 63 HA LYS 63 -9.445 -1.064 0.751
459 1HB LYS 63 2HB LYS 63 -6.804 0.001 1.770
460 2HB LYS 63 3HB LYS 63 -7.195 0.205 0.095
461 1HG LYS 63 2HG LYS 63 -9.058 1.005 2.357
462 2HG LYS 63 3HG LYS 63 -7.848 2.071 1.640
463 1HD LYS 63 2HD LYS 63 -10.156 0.866 0.066
464 2HD LYS 63 3HD LYS 63 -10.170 2.456 0.807
465 1HE LYS 63 2HE LYS 63 -8.992 3.412 -0.854
466 2HE LYS 63 3HE LYS 63 -7.737 2.180 -0.792
467 1HZ LYS 63 1HZ LYS 63 -8.798 2.197 -2.902
468 2HZ LYS 63 2HZ LYS 63 -9.085 0.768 -2.145
469 3HZ LYS 63 3HZ LYS 63 -10.277 1.904 -2.242
470 H ILE 64 H ILE 64 -6.372 -2.741 1.479
471 HA ILE 64 HA ILE 64 -5.438 -3.327 -1.023
472 HB ILE 64 HB ILE 64 -5.242 -4.383 1.720
473 1HG1 ILE 64 2HG1 ILE 64 -3.867 -2.515 0.638
474 2HG1 ILE 64 3HG1 ILE 64 -3.013 -3.786 1.507
475 1HG2 ILE 64 1HG2 ILE 64 -4.418 -6.064 -0.585
476 2HG2 ILE 64 2HG2 ILE 64 -3.722 -6.186 1.056
477 3HG2 ILE 64 3HG2 ILE 64 -5.444 -6.486 0.816
478 1HD1 ILE 64 1HD1 ILE 64 -3.333 -3.689 -1.520
479 2HD1 ILE 64 2HD1 ILE 64 -1.882 -3.243 -0.588
480 3HD1 ILE 64 3HD1 ILE 64 -2.457 -4.918 -0.595
481 H GLU 65 H GLU 65 -7.595 -5.206 1.186
482 HA GLU 65 HA GLU 65 -8.407 -7.292 -0.535
483 1HB GLU 65 2HB GLU 65 -9.667 -5.903 1.857
484 2HB GLU 65 3HB GLU 65 -10.501 -7.216 1.016
485 1HG GLU 65 2HG GLU 65 -7.645 -7.734 1.789
486 2HG GLU 65 3HG GLU 65 -8.844 -7.654 3.088
487 H LYS 66 H LYS 66 -10.132 -4.170 0.132
488 HA LYS 66 HA LYS 66 -12.239 -4.734 -1.695
489 1HB LYS 66 2HB LYS 66 -11.229 -2.235 -0.344
490 2HB LYS 66 3HB LYS 66 -12.308 -2.057 -1.730
491 1HG LYS 66 2HG LYS 66 -13.695 -2.067 0.188
492 2HG LYS 66 3HG LYS 66 -13.959 -3.576 -0.690
493 1HD LYS 66 2HD LYS 66 -12.306 -4.667 0.967
494 2HD LYS 66 3HD LYS 66 -12.356 -3.136 1.867
495 1HE LYS 66 2HE LYS 66 -14.865 -3.416 2.059
496 2HE LYS 66 3HE LYS 66 -14.715 -4.979 1.234
497 1HZ LYS 66 1HZ LYS 66 -13.289 -5.706 3.053
498 2HZ LYS 66 2HZ LYS 66 -13.503 -4.267 3.829
499 3HZ LYS 66 3HZ LYS 66 -14.782 -5.272 3.588
500 H LEU 67 H LEU 67 -9.083 -3.313 -2.317
501 HA LEU 67 HA LEU 67 -9.634 -2.557 -5.063
502 1HB LEU 67 2HB LEU 67 -7.143 -2.856 -3.365
503 2HB LEU 67 3HB LEU 67 -7.044 -2.497 -5.087
504 HG LEU 67 HG LEU 67 -8.884 -0.812 -3.399
505 1HD1 LEU 67 1HD1 LEU 67 -5.868 -0.708 -3.346
506 2HD1 LEU 67 2HD1 LEU 67 -6.812 0.776 -3.141
507 3HD1 LEU 67 3HD1 LEU 67 -6.996 -0.579 -2.019
508 1HD2 LEU 67 1HD2 LEU 67 -7.103 -0.195 -5.800
509 2HD2 LEU 67 2HD2 LEU 67 -8.841 -0.544 -5.871
510 3HD2 LEU 67 3HD2 LEU 67 -8.266 0.916 -5.050
511 H GLY 68 H GLY 68 -9.109 -5.603 -3.525
512 1HA GLY 68 2HA GLY 68 -9.250 -7.667 -4.507
513 2HA GLY 68 3HA GLY 68 -9.105 -6.953 -6.121
514 H TYR 69 H TYR 69 -6.951 -6.578 -3.238
515 HA TYR 69 HA TYR 69 -4.773 -8.056 -4.637
516 1HB TYR 69 2HB TYR 69 -5.010 -5.197 -4.145
517 2HB TYR 69 3HB TYR 69 -3.716 -5.835 -3.157
518 HD1 TYR 69 HD1 TYR 69 -1.643 -6.563 -4.119
519 HD2 TYR 69 HD2 TYR 69 -5.017 -5.685 -6.657
520 HE1 TYR 69 HE1 TYR 69 -0.161 -6.475 -6.054
521 HE2 TYR 69 HE2 TYR 69 -3.539 -5.687 -8.624
522 HH TYR 69 HH TYR 69 -0.035 -6.381 -8.366
523 H HIS 70 H HIS 70 -2.872 -8.250 -2.924
524 HA HIS 70 HA HIS 70 -3.830 -8.253 -0.197
525 1HB HIS 70 2HB HIS 70 -4.338 -10.571 -1.315
526 2HB HIS 70 3HB HIS 70 -2.608 -10.849 -1.128
527 HD1 HIS 70 1HD HIS 70 -4.732 -9.007 1.539
528 HD2 HIS 70 2HD HIS 70 -3.215 -12.828 0.659
529 HE1 HIS 70 1HE HIS 70 -5.092 -10.424 3.617
530 H VAL 71 H VAL 71 -1.990 -8.514 1.357
531 HA VAL 71 HA VAL 71 0.609 -7.797 0.189
532 HB VAL 71 HB VAL 71 -0.714 -5.730 0.479
533 1HG1 VAL 71 1HG1 VAL 71 -2.005 -6.440 2.562
534 2HG1 VAL 71 2HG1 VAL 71 -0.503 -6.264 3.488
535 3HG1 VAL 71 3HG1 VAL 71 -1.230 -4.853 2.711
536 1HG2 VAL 71 1HG2 VAL 71 0.914 -4.392 1.694
537 2HG2 VAL 71 2HG2 VAL 71 1.711 -5.875 2.259
538 3HG2 VAL 71 3HG2 VAL 71 1.632 -5.478 0.513
539 H VAL 72 H VAL 72 2.313 -8.430 1.457
540 HA VAL 72 HA VAL 72 1.634 -10.326 3.631
541 HB VAL 72 HB VAL 72 4.066 -10.263 1.927
542 1HG1 VAL 72 1HG1 VAL 72 4.477 -11.336 4.095
543 2HG1 VAL 72 2HG1 VAL 72 3.028 -12.344 3.887
544 3HG1 VAL 72 3HG1 VAL 72 4.430 -12.554 2.819
545 1HG2 VAL 72 1HG2 VAL 72 1.590 -12.021 1.723
546 2HG2 VAL 72 2HG2 VAL 72 2.146 -10.814 0.539
547 3HG2 VAL 72 3HG2 VAL 72 3.100 -12.276 0.820
548 H ILE 73 H ILE 73 2.620 -10.149 5.506
549 HA ILE 73 HA ILE 73 4.100 -7.620 6.127
550 HB ILE 73 HB ILE 73 2.348 -9.328 7.914
551 1HG1 ILE 73 2HG1 ILE 73 0.943 -8.191 6.293
552 2HG1 ILE 73 3HG1 ILE 73 0.809 -7.455 7.881
553 1HG2 ILE 73 1HG2 ILE 73 2.562 -7.294 9.432
554 2HG2 ILE 73 2HG2 ILE 73 4.015 -8.275 9.278
555 3HG2 ILE 73 3HG2 ILE 73 3.899 -6.751 8.389
556 1HD1 ILE 73 1HD1 ILE 73 2.334 -6.307 5.512
557 2HD1 ILE 73 2HD1 ILE 73 0.819 -5.722 6.208
558 3HD1 ILE 73 3HD1 ILE 73 2.315 -5.593 7.145
559 H GLU 74 H GLU 74 6.070 -8.830 5.309
560 HA GLU 74 HA GLU 74 7.112 -10.808 7.007
561 1HB GLU 74 2HB GLU 74 8.230 -9.126 4.753
562 2HB GLU 74 3HB GLU 74 9.227 -10.176 5.735
563 1HG GLU 74 2HG GLU 74 7.530 -12.069 5.168
564 2HG GLU 74 3HG GLU 74 6.957 -10.989 3.884
565 H GLY 75 H GLY 75 6.466 -7.784 7.666
566 1HA GLY 75 2HA GLY 75 8.972 -6.815 8.847
567 2HA GLY 75 3HA GLY 75 7.414 -5.977 8.704
568 H ARG 76 H ARG 76 6.089 -8.436 10.038
569 HA ARG 76 HA ARG 76 6.753 -7.704 12.793
570 1HB ARG 76 2HB ARG 76 4.758 -6.350 11.407
571 2HB ARG 76 3HB ARG 76 3.841 -7.665 12.131
572 1HG ARG 76 2HG ARG 76 5.541 -5.566 13.558
573 2HG ARG 76 3HG ARG 76 3.783 -5.672 13.495
574 1HD ARG 76 2HD ARG 76 4.123 -6.547 15.560
575 2HD ARG 76 3HD ARG 76 4.148 -8.052 14.607
576 HE ARG 76 HE ARG 76 6.776 -7.299 14.630
577 1HH1 ARG 76 2HH2 ARG 76 4.411 -8.156 17.047
578 2HH1 ARG 76 1HH2 ARG 76 5.546 -8.432 18.336
579 1HH2 ARG 76 2HH1 ARG 76 8.351 -7.651 16.265
580 2HH2 ARG 76 1HH1 ARG 76 7.874 -8.175 17.849
Start of MODEL 15
1 1H MET 1 H1 MET 1 -2.636 15.931 18.876
2 2H MET 1 H2 MET 1 -2.038 16.487 20.334
3 3H MET 1 H3 MET 1 -2.550 17.537 19.140
4 HA MET 1 HA MET 1 -0.230 17.547 19.036
5 1HB MET 1 2HB MET 1 -0.503 14.500 18.929
6 2HB MET 1 3HB MET 1 0.989 15.394 18.597
7 1HG MET 1 2HG MET 1 1.124 14.657 20.859
8 2HG MET 1 3HG MET 1 0.876 16.404 20.870
9 1HE MET 1 1HE MET 1 -0.966 15.664 24.131
10 2HE MET 1 2HE MET 1 0.623 15.119 23.546
11 3HE MET 1 3HE MET 1 0.086 16.791 23.244
12 H LEU 2 H LEU 2 1.052 16.957 16.923
13 HA LEU 2 HA LEU 2 -0.784 17.263 14.624
14 1HB LEU 2 2HB LEU 2 2.224 17.438 15.037
15 2HB LEU 2 3HB LEU 2 1.492 17.529 13.438
16 HG LEU 2 HG LEU 2 0.550 19.417 15.622
17 1HD1 LEU 2 1HD1 LEU 2 2.233 21.055 14.835
18 2HD1 LEU 2 2HD1 LEU 2 2.986 19.646 15.602
19 3HD1 LEU 2 3HD1 LEU 2 2.985 19.795 13.831
20 1HD2 LEU 2 1HD2 LEU 2 -0.729 19.280 13.475
21 2HD2 LEU 2 2HD2 LEU 2 0.052 20.857 13.681
22 3HD2 LEU 2 3HD2 LEU 2 0.759 19.658 12.581
23 H SER 3 H SER 3 -0.643 15.819 12.785
24 HA SER 3 HA SER 3 -0.207 13.068 13.284
25 1HB SER 3 2HB SER 3 -0.295 14.436 10.561
26 2HB SER 3 3HB SER 3 -0.821 12.821 11.007
27 HG SER 3 HG SER 3 -2.646 14.085 10.956
28 H GLU 4 H GLU 4 1.821 12.358 13.714
29 HA GLU 4 HA GLU 4 4.230 13.283 12.308
30 1HB GLU 4 2HB GLU 4 3.573 11.242 14.356
31 2HB GLU 4 3HB GLU 4 4.908 10.882 13.293
32 1HG GLU 4 2HG GLU 4 5.853 13.102 13.896
33 2HG GLU 4 3HG GLU 4 4.609 13.183 15.152
34 H GLN 5 H GLN 5 5.401 11.484 11.022
35 HA GLN 5 HA GLN 5 3.528 9.866 9.371
36 1HB GLN 5 2HB GLN 5 5.736 11.699 8.419
37 2HB GLN 5 3HB GLN 5 5.031 10.433 7.439
38 1HG GLN 5 2HG GLN 5 2.889 12.082 8.569
39 2HG GLN 5 3HG GLN 5 4.088 13.105 7.777
40 1HE2 GLN 5 1HE2 GLN 5 2.915 9.776 7.068
41 2HE2 GLN 5 2HE2 GLN 5 2.326 10.153 5.461
42 H LYS 6 H LYS 6 4.480 7.979 8.458
43 HA LYS 6 HA LYS 6 7.303 7.462 8.896
44 1HB LYS 6 2HB LYS 6 5.185 5.606 10.074
45 2HB LYS 6 3HB LYS 6 6.890 5.181 9.824
46 1HG LYS 6 2HG LYS 6 7.541 7.153 11.258
47 2HG LYS 6 3HG LYS 6 5.831 7.354 11.660
48 1HD LYS 6 2HD LYS 6 5.846 4.905 12.424
49 2HD LYS 6 3HD LYS 6 7.613 4.956 12.218
50 1HE LYS 6 2HE LYS 6 7.632 6.993 13.779
51 2HE LYS 6 3HE LYS 6 5.909 6.713 14.069
52 1HZ LYS 6 1HZ LYS 6 6.499 4.528 14.927
53 2HZ LYS 6 2HZ LYS 6 8.100 4.853 14.701
54 3HZ LYS 6 3HZ LYS 6 7.225 5.739 15.773
55 H GLU 7 H GLU 7 8.016 5.577 7.734
56 HA GLU 7 HA GLU 7 6.616 5.255 5.158
57 1HB GLU 7 2HB GLU 7 9.606 5.054 5.642
58 2HB GLU 7 3HB GLU 7 8.686 5.380 4.178
59 1HG GLU 7 2HG GLU 7 9.740 7.414 4.796
60 2HG GLU 7 3HG GLU 7 8.068 7.639 5.331
61 H ILE 8 H ILE 8 5.596 3.260 5.683
62 HA ILE 8 HA ILE 8 7.198 1.180 7.020
63 HB ILE 8 HB ILE 8 4.373 1.298 6.113
64 1HG1 ILE 8 2HG1 ILE 8 3.921 1.114 8.643
65 2HG1 ILE 8 3HG1 ILE 8 5.651 1.330 8.926
66 1HG2 ILE 8 1HG2 ILE 8 5.028 -0.925 6.027
67 2HG2 ILE 8 2HG2 ILE 8 5.884 -0.749 7.614
68 3HG2 ILE 8 3HG2 ILE 8 4.093 -0.689 7.514
69 1HD1 ILE 8 1HD1 ILE 8 3.975 3.314 7.400
70 2HD1 ILE 8 2HD1 ILE 8 4.054 3.318 9.184
71 3HD1 ILE 8 3HD1 ILE 8 5.533 3.583 8.241
72 H ALA 9 H ALA 9 7.168 -0.931 5.920
73 HA ALA 9 HA ALA 9 7.440 -0.843 2.973
74 1HB ALA 9 1HB ALA 9 9.488 -2.185 3.096
75 2HB ALA 9 2HB ALA 9 9.738 -0.626 3.909
76 3HB ALA 9 3HB ALA 9 9.473 -2.094 4.870
77 H MET 10 H MET 10 6.445 -2.686 2.089
78 HA MET 10 HA MET 10 6.091 -5.062 3.821
79 1HB MET 10 2HB MET 10 3.721 -3.928 2.300
80 2HB MET 10 3HB MET 10 3.765 -5.303 3.400
81 1HG MET 10 2HG MET 10 4.222 -3.778 5.289
82 2HG MET 10 3HG MET 10 4.078 -2.400 4.174
83 1HE MET 10 1HE MET 10 0.808 -2.054 6.209
84 2HE MET 10 2HE MET 10 2.421 -2.543 6.800
85 3HE MET 10 3HE MET 10 2.264 -1.230 5.602
86 H GLN 11 H GLN 11 5.044 -6.828 2.418
87 HA GLN 11 HA GLN 11 6.489 -6.977 -0.182
88 1HB GLN 11 2HB GLN 11 5.470 -8.962 1.906
89 2HB GLN 11 3HB GLN 11 5.746 -9.501 0.258
90 1HG GLN 11 2HG GLN 11 7.777 -8.263 2.178
91 2HG GLN 11 3HG GLN 11 7.696 -9.968 1.685
92 1HE2 GLN 11 1HE2 GLN 11 7.197 -9.712 -1.082
93 2HE2 GLN 11 2HE2 GLN 11 8.411 -8.690 -1.817
94 H VAL 12 H VAL 12 5.293 -7.357 -2.076
95 HA VAL 12 HA VAL 12 2.334 -7.034 -1.817
96 HB VAL 12 HB VAL 12 4.198 -6.827 -4.208
97 1HG1 VAL 12 1HG1 VAL 12 2.153 -5.808 -5.300
98 2HG1 VAL 12 2HG1 VAL 12 2.014 -7.541 -5.002
99 3HG1 VAL 12 3HG1 VAL 12 1.194 -6.382 -3.924
100 1HG2 VAL 12 1HG2 VAL 12 3.544 -4.388 -4.052
101 2HG2 VAL 12 2HG2 VAL 12 2.727 -4.743 -2.524
102 3HG2 VAL 12 3HG2 VAL 12 4.490 -4.941 -2.667
103 H SER 13 H SER 13 0.889 -8.601 -2.843
104 HA SER 13 HA SER 13 2.067 -10.956 -4.118
105 1HB SER 13 2HB SER 13 0.413 -11.064 -1.555
106 2HB SER 13 3HB SER 13 0.694 -12.464 -2.601
107 HG SER 13 HG SER 13 3.001 -11.114 -1.966
108 H GLY 14 H GLY 14 0.290 -12.312 -5.042
109 1HA GLY 14 2HA GLY 14 -1.545 -12.506 -6.409
110 2HA GLY 14 3HA GLY 14 -2.391 -11.417 -5.296
111 H MET 15 H MET 15 0.216 -11.268 -7.805
112 HA MET 15 HA MET 15 -1.021 -8.825 -8.938
113 1HB MET 15 2HB MET 15 1.058 -7.641 -8.907
114 2HB MET 15 3HB MET 15 0.743 -8.236 -7.272
115 1HG MET 15 2HG MET 15 2.992 -8.631 -7.521
116 2HG MET 15 3HG MET 15 2.315 -10.213 -7.916
117 1HE MET 15 1HE MET 15 5.296 -9.421 -8.518
118 2HE MET 15 2HE MET 15 4.574 -10.982 -8.971
119 3HE MET 15 3HE MET 15 5.489 -10.039 -10.171
120 H THR 16 H THR 16 -0.420 -8.408 -11.098
121 HA THR 16 HA THR 16 0.822 -10.653 -12.626
122 HB THR 16 HB THR 16 -0.258 -9.108 -14.543
123 HG1 THR 16 1HG THR 16 -2.177 -8.880 -12.491
124 1HG2 THR 16 1HG2 THR 16 -0.750 -11.470 -14.287
125 2HG2 THR 16 2HG2 THR 16 -1.770 -11.164 -12.867
126 3HG2 THR 16 3HG2 THR 16 -2.269 -10.580 -14.474
127 H CYS 17 H CYS 17 0.594 -7.017 -12.540
128 HA CYS 17 HA CYS 17 3.463 -6.939 -13.299
129 1HB CYS 17 2HB CYS 17 3.006 -5.442 -15.105
130 2HB CYS 17 3HB CYS 17 1.962 -6.852 -15.328
131 H ALA 18 H ALA 18 4.453 -4.903 -13.057
132 HA ALA 18 HA ALA 18 3.822 -3.615 -10.549
133 1HB ALA 18 1HB ALA 18 5.934 -2.973 -12.647
134 2HB ALA 18 2HB ALA 18 5.924 -2.431 -10.956
135 3HB ALA 18 3HB ALA 18 6.122 -4.156 -11.340
136 H ALA 19 H ALA 19 1.678 -3.205 -12.359
137 HA ALA 19 HA ALA 19 1.746 -0.231 -12.697
138 1HB ALA 19 1HB ALA 19 0.496 -0.367 -14.741
139 2HB ALA 19 2HB ALA 19 1.973 -1.335 -14.932
140 3HB ALA 19 3HB ALA 19 0.408 -2.131 -14.658
141 H CYS 20 H CYS 20 -0.467 -3.130 -12.670
142 HA CYS 20 HA CYS 20 -2.597 -1.706 -11.437
143 1HB CYS 20 2HB CYS 20 -1.894 -4.655 -10.990
144 2HB CYS 20 3HB CYS 20 -3.493 -3.895 -10.858
145 H ALA 21 H ALA 21 0.255 -3.354 -10.119
146 HA ALA 21 HA ALA 21 -0.224 -3.035 -7.378
147 1HB ALA 21 1HB ALA 21 1.653 -4.287 -8.537
148 2HB ALA 21 2HB ALA 21 2.468 -2.719 -8.747
149 3HB ALA 21 3HB ALA 21 2.122 -3.354 -7.121
150 H ALA 22 H ALA 22 0.445 -0.501 -9.782
151 HA ALA 22 HA ALA 22 1.209 1.512 -7.787
152 1HB ALA 22 1HB ALA 22 1.072 3.066 -9.602
153 2HB ALA 22 2HB ALA 22 1.900 1.616 -10.215
154 3HB ALA 22 3HB ALA 22 0.194 1.919 -10.624
155 H ARG 23 H ARG 23 -1.668 0.502 -9.649
156 HA ARG 23 HA ARG 23 -3.386 2.622 -8.937
157 1HB ARG 23 2HB ARG 23 -4.030 -0.304 -9.510
158 2HB ARG 23 3HB ARG 23 -5.247 0.935 -9.320
159 1HG ARG 23 2HG ARG 23 -3.005 1.132 -11.391
160 2HG ARG 23 3HG ARG 23 -4.539 0.327 -11.717
161 1HD ARG 23 2HD ARG 23 -4.224 3.247 -10.908
162 2HD ARG 23 3HD ARG 23 -4.546 2.643 -12.544
163 HE ARG 23 HE ARG 23 -6.560 1.517 -11.064
164 1HH1 ARG 23 2HH2 ARG 23 -5.502 4.819 -11.665
165 2HH1 ARG 23 1HH2 ARG 23 -7.051 5.551 -11.382
166 1HH2 ARG 23 2HH1 ARG 23 -8.646 2.435 -10.696
167 2HH2 ARG 23 1HH1 ARG 23 -8.893 4.143 -10.842
168 H ILE 24 H ILE 24 -2.793 -0.484 -7.220
169 HA ILE 24 HA ILE 24 -4.709 0.068 -5.234
170 HB ILE 24 HB ILE 24 -3.844 -1.642 -3.887
171 1HG1 ILE 24 2HG1 ILE 24 -1.371 -1.277 -5.495
172 2HG1 ILE 24 3HG1 ILE 24 -1.584 -1.204 -3.733
173 1HG2 ILE 24 1HG2 ILE 24 -3.349 -2.546 -6.747
174 2HG2 ILE 24 2HG2 ILE 24 -4.095 -3.416 -5.388
175 3HG2 ILE 24 3HG2 ILE 24 -4.968 -2.101 -6.172
176 1HD1 ILE 24 1HD1 ILE 24 -0.382 -3.221 -4.282
177 2HD1 ILE 24 2HD1 ILE 24 -2.017 -3.676 -3.748
178 3HD1 ILE 24 3HD1 ILE 24 -1.597 -3.670 -5.484
179 H GLU 25 H GLU 25 -1.169 0.682 -5.029
180 HA GLU 25 HA GLU 25 -1.184 2.095 -2.622
181 1HB GLU 25 2HB GLU 25 0.594 1.999 -5.033
182 2HB GLU 25 3HB GLU 25 0.783 3.404 -3.969
183 1HG GLU 25 2HG GLU 25 2.275 1.490 -3.373
184 2HG GLU 25 3HG GLU 25 1.237 2.029 -2.052
185 H LYS 26 H LYS 26 -1.968 3.386 -5.858
186 HA LYS 26 HA LYS 26 -2.035 6.131 -4.807
187 1HB LYS 26 2HB LYS 26 -3.175 5.101 -7.420
188 2HB LYS 26 3HB LYS 26 -2.914 6.790 -6.968
189 1HG LYS 26 2HG LYS 26 -0.775 4.683 -7.434
190 2HG LYS 26 3HG LYS 26 -1.194 6.026 -8.492
191 1HD LYS 26 2HD LYS 26 -0.315 7.629 -6.809
192 2HD LYS 26 3HD LYS 26 -0.057 6.310 -5.660
193 1HE LYS 26 2HE LYS 26 2.063 6.874 -6.616
194 2HE LYS 26 3HE LYS 26 1.594 5.236 -7.077
195 1HZ LYS 26 1HZ LYS 26 1.368 7.627 -8.792
196 2HZ LYS 26 2HZ LYS 26 2.509 6.452 -8.916
197 3HZ LYS 26 3HZ LYS 26 0.937 6.096 -9.228
198 H GLY 27 H GLY 27 -4.524 3.675 -5.567
199 1HA GLY 27 2HA GLY 27 -6.800 5.227 -4.783
200 2HA GLY 27 3HA GLY 27 -6.658 3.458 -4.758
201 H LEU 28 H LEU 28 -4.428 3.245 -3.000
202 HA LEU 28 HA LEU 28 -5.795 3.379 -0.467
203 1HB LEU 28 2HB LEU 28 -4.298 1.605 -0.997
204 2HB LEU 28 3HB LEU 28 -2.949 2.696 -1.270
205 HG LEU 28 HG LEU 28 -2.974 1.318 0.844
206 1HD1 LEU 28 1HD1 LEU 28 -1.459 3.232 0.449
207 2HD1 LEU 28 2HD1 LEU 28 -2.672 4.311 1.163
208 3HD1 LEU 28 3HD1 LEU 28 -1.907 3.082 2.156
209 1HD2 LEU 28 1HD2 LEU 28 -4.203 2.226 2.787
210 2HD2 LEU 28 2HD2 LEU 28 -5.021 3.390 1.772
211 3HD2 LEU 28 3HD2 LEU 28 -5.302 1.658 1.520
212 H LYS 29 H LYS 29 -3.195 5.299 -1.975
213 HA LYS 29 HA LYS 29 -2.645 7.079 0.074
214 1HB LYS 29 2HB LYS 29 -1.585 6.716 -2.314
215 2HB LYS 29 3HB LYS 29 -2.720 7.966 -2.811
216 1HG LYS 29 2HG LYS 29 -1.448 8.985 -0.467
217 2HG LYS 29 3HG LYS 29 -0.235 8.020 -1.265
218 1HD LYS 29 2HD LYS 29 0.047 10.202 -2.270
219 2HD LYS 29 3HD LYS 29 -0.792 9.235 -3.461
220 1HE LYS 29 2HE LYS 29 -1.632 11.545 -3.136
221 2HE LYS 29 3HE LYS 29 -2.904 10.327 -2.896
222 1HZ LYS 29 1HZ LYS 29 -1.382 11.442 -0.641
223 2HZ LYS 29 2HZ LYS 29 -2.749 12.170 -1.190
224 3HZ LYS 29 3HZ LYS 29 -2.830 10.630 -0.604
225 H ARG 30 H ARG 30 -5.578 6.841 -1.620
226 HA ARG 30 HA ARG 30 -6.458 9.616 -1.274
227 1HB ARG 30 2HB ARG 30 -7.108 7.368 -2.936
228 2HB ARG 30 3HB ARG 30 -8.552 7.714 -1.999
229 1HG ARG 30 2HG ARG 30 -7.012 9.910 -3.449
230 2HG ARG 30 3HG ARG 30 -8.065 8.808 -4.335
231 1HD ARG 30 2HD ARG 30 -9.992 9.382 -2.987
232 2HD ARG 30 3HD ARG 30 -9.059 10.466 -1.973
233 HE ARG 30 HE ARG 30 -10.032 10.850 -4.736
234 1HH1 ARG 30 2HH2 ARG 30 -7.850 12.078 -2.261
235 2HH1 ARG 30 1HH2 ARG 30 -7.657 13.653 -2.966
236 1HH2 ARG 30 2HH1 ARG 30 -9.747 12.901 -5.760
237 2HH2 ARG 30 1HH1 ARG 30 -8.750 14.115 -5.030
238 H MET 31 H MET 31 -6.228 6.851 0.760
239 HA MET 31 HA MET 31 -8.707 7.191 2.181
240 1HB MET 31 2HB MET 31 -6.061 5.807 2.847
241 2HB MET 31 3HB MET 31 -7.430 5.768 3.938
242 1HG MET 31 2HG MET 31 -7.509 4.768 1.077
243 2HG MET 31 3HG MET 31 -7.271 3.770 2.516
244 1HE MET 31 1HE MET 31 -9.262 4.483 4.676
245 2HE MET 31 2HE MET 31 -10.753 3.658 4.175
246 3HE MET 31 3HE MET 31 -9.188 2.840 3.995
247 HA PRO 32 HA PRO 32 -7.436 10.337 5.200
248 1HB PRO 32 2HB PRO 32 -8.545 9.309 7.501
249 2HB PRO 32 3HB PRO 32 -9.506 10.131 6.239
250 1HG PRO 32 2HG PRO 32 -9.068 7.152 6.588
251 2HG PRO 32 3HG PRO 32 -10.626 8.007 6.376
252 1HD PRO 32 2HD PRO 32 -9.401 6.852 4.291
253 2HD PRO 32 3HD PRO 32 -10.147 8.453 4.072
254 H GLY 33 H GLY 33 -5.637 10.450 6.592
255 1HA GLY 33 2HA GLY 33 -3.986 9.722 7.981
256 2HA GLY 33 3HA GLY 33 -4.565 8.053 7.797
257 H VAL 34 H VAL 34 -4.194 8.708 4.633
258 HA VAL 34 HA VAL 34 -1.312 7.939 4.716
259 HB VAL 34 HB VAL 34 -3.338 7.299 2.561
260 1HG1 VAL 34 1HG1 VAL 34 -1.371 5.851 1.807
261 2HG1 VAL 34 2HG1 VAL 34 -1.029 7.574 1.741
262 3HG1 VAL 34 3HG1 VAL 34 -0.396 6.595 3.069
263 1HG2 VAL 34 1HG2 VAL 34 -2.162 5.569 4.786
264 2HG2 VAL 34 2HG2 VAL 34 -3.870 6.000 4.563
265 3HG2 VAL 34 3HG2 VAL 34 -3.071 4.951 3.393
266 H THR 35 H THR 35 0.081 9.364 3.912
267 HA THR 35 HA THR 35 -1.029 11.734 2.534
268 HB THR 35 HB THR 35 1.530 11.319 3.967
269 HG1 THR 35 1HG THR 35 0.063 11.696 5.575
270 1HG2 THR 35 1HG2 THR 35 0.273 13.793 2.718
271 2HG2 THR 35 2HG2 THR 35 1.665 13.799 3.817
272 3HG2 THR 35 3HG2 THR 35 1.810 13.030 2.220
273 H ASP 36 H ASP 36 1.670 9.267 2.102
274 HA ASP 36 HA ASP 36 1.283 9.560 -0.755
275 1HB ASP 36 2HB ASP 36 3.740 10.520 0.624
276 2HB ASP 36 3HB ASP 36 3.988 9.480 -0.784
277 H ALA 37 H ALA 37 2.280 7.883 -1.977
278 HA ALA 37 HA ALA 37 3.115 5.483 -0.541
279 1HB ALA 37 1HB ALA 37 1.235 4.074 -1.135
280 2HB ALA 37 2HB ALA 37 0.585 5.496 -0.304
281 3HB ALA 37 3HB ALA 37 0.481 5.381 -2.073
282 H ASN 38 H ASN 38 4.019 3.803 -1.847
283 HA ASN 38 HA ASN 38 4.441 4.404 -4.697
284 1HB ASN 38 2HB ASN 38 7.068 4.197 -3.621
285 2HB ASN 38 3HB ASN 38 6.320 5.553 -4.444
286 1HD2 ASN 38 1HD2 ASN 38 5.939 4.193 -1.078
287 2HD2 ASN 38 2HD2 ASN 38 6.383 5.720 -0.316
288 H VAL 39 H VAL 39 4.525 2.461 -5.687
289 HA VAL 39 HA VAL 39 5.015 0.077 -4.054
290 HB VAL 39 HB VAL 39 2.995 0.363 -5.401
291 1HG1 VAL 39 1HG1 VAL 39 4.673 -0.197 -7.889
292 2HG1 VAL 39 2HG1 VAL 39 2.950 0.001 -7.770
293 3HG1 VAL 39 3HG1 VAL 39 3.994 1.395 -7.469
294 1HG2 VAL 39 1HG2 VAL 39 2.756 -1.851 -5.679
295 2HG2 VAL 39 2HG2 VAL 39 4.322 -2.064 -6.494
296 3HG2 VAL 39 3HG2 VAL 39 4.234 -1.891 -4.726
297 H ASN 40 H ASN 40 7.178 -0.459 -3.836
298 HA ASN 40 HA ASN 40 9.034 0.134 -6.069
299 1HB ASN 40 2HB ASN 40 9.575 0.740 -3.701
300 2HB ASN 40 3HB ASN 40 9.650 -0.989 -3.316
301 1HD2 ASN 40 1HD2 ASN 40 11.927 0.252 -2.779
302 2HD2 ASN 40 2HD2 ASN 40 13.123 0.029 -4.044
303 H LEU 41 H LEU 41 7.361 -1.522 -7.063
304 HA LEU 41 HA LEU 41 7.715 -4.288 -6.403
305 1HB LEU 41 2HB LEU 41 5.958 -2.784 -8.013
306 2HB LEU 41 3HB LEU 41 6.812 -3.799 -9.159
307 HG LEU 41 HG LEU 41 4.636 -4.667 -8.273
308 1HD1 LEU 41 1HD1 LEU 41 5.362 -6.995 -8.008
309 2HD1 LEU 41 2HD1 LEU 41 6.239 -6.201 -9.330
310 3HD1 LEU 41 3HD1 LEU 41 7.037 -6.474 -7.766
311 1HD2 LEU 41 1HD2 LEU 41 6.010 -5.547 -5.734
312 2HD2 LEU 41 2HD2 LEU 41 5.216 -3.969 -5.814
313 3HD2 LEU 41 3HD2 LEU 41 4.297 -5.449 -6.150
314 H ALA 42 H ALA 42 9.592 -2.108 -8.291
315 HA ALA 42 HA ALA 42 11.123 -3.747 -9.944
316 1HB ALA 42 1HB ALA 42 12.101 -1.534 -8.098
317 2HB ALA 42 2HB ALA 42 12.938 -2.158 -9.529
318 3HB ALA 42 3HB ALA 42 11.398 -1.286 -9.719
319 H THR 43 H THR 43 11.126 -3.567 -6.358
320 HA THR 43 HA THR 43 13.025 -5.873 -6.383
321 HB THR 43 HB THR 43 14.150 -3.897 -5.562
322 HG1 THR 43 1HG THR 43 13.530 -5.898 -3.671
323 1HG2 THR 43 1HG2 THR 43 12.229 -3.931 -3.190
324 2HG2 THR 43 2HG2 THR 43 13.571 -2.816 -3.482
325 3HG2 THR 43 3HG2 THR 43 12.134 -2.760 -4.517
326 H GLU 44 H GLU 44 10.073 -5.861 -6.583
327 HA GLU 44 HA GLU 44 8.173 -6.617 -5.571
328 1HB GLU 44 2HB GLU 44 10.244 -8.570 -4.522
329 2HB GLU 44 3HB GLU 44 8.501 -8.778 -4.353
330 1HG GLU 44 2HG GLU 44 8.980 -8.203 -7.131
331 2HG GLU 44 3HG GLU 44 10.120 -9.458 -6.625
332 H THR 45 H THR 45 8.718 -4.354 -4.195
333 HA THR 45 HA THR 45 7.806 -5.089 -1.483
334 HB THR 45 HB THR 45 10.146 -3.292 -2.271
335 HG1 THR 45 1HG THR 45 9.965 -5.882 -1.519
336 1HG2 THR 45 1HG2 THR 45 8.974 -2.243 -0.444
337 2HG2 THR 45 2HG2 THR 45 8.923 -3.794 0.451
338 3HG2 THR 45 3HG2 THR 45 10.475 -2.976 0.154
339 H VAL 46 H VAL 46 6.650 -3.284 -0.483
340 HA VAL 46 HA VAL 46 5.922 -1.041 -2.313
341 HB VAL 46 HB VAL 46 4.025 -2.496 -2.348
342 1HG1 VAL 46 1HG1 VAL 46 4.130 -2.512 0.686
343 2HG1 VAL 46 2HG1 VAL 46 2.812 -3.178 -0.297
344 3HG1 VAL 46 3HG1 VAL 46 4.410 -3.915 -0.381
345 1HG2 VAL 46 1HG2 VAL 46 2.310 -1.131 -1.315
346 2HG2 VAL 46 2HG2 VAL 46 3.488 -0.254 -0.347
347 3HG2 VAL 46 3HG2 VAL 46 3.523 -0.108 -2.121
348 H ASN 47 H ASN 47 5.740 0.997 -1.285
349 HA ASN 47 HA ASN 47 6.404 1.053 1.594
350 1HB ASN 47 2HB ASN 47 7.676 2.609 -0.691
351 2HB ASN 47 3HB ASN 47 7.563 3.308 0.928
352 1HD2 ASN 47 1HD2 ASN 47 8.266 1.676 2.782
353 2HD2 ASN 47 2HD2 ASN 47 9.887 1.076 2.471
354 H VAL 48 H VAL 48 5.208 2.598 2.751
355 HA VAL 48 HA VAL 48 3.288 4.219 1.211
356 HB VAL 48 HB VAL 48 2.106 2.173 1.532
357 1HG1 VAL 48 1HG1 VAL 48 2.842 2.324 4.471
358 2HG1 VAL 48 2HG1 VAL 48 1.587 1.273 3.785
359 3HG1 VAL 48 3HG1 VAL 48 3.271 1.076 3.296
360 1HG2 VAL 48 1HG2 VAL 48 0.724 4.036 1.617
361 2HG2 VAL 48 2HG2 VAL 48 0.230 3.064 3.011
362 3HG2 VAL 48 3HG2 VAL 48 1.227 4.515 3.234
363 H ILE 49 H ILE 49 3.264 6.182 1.993
364 HA ILE 49 HA ILE 49 4.894 6.742 4.369
365 HB ILE 49 HB ILE 49 4.072 8.670 2.158
366 1HG1 ILE 49 2HG1 ILE 49 5.247 6.998 0.966
367 2HG1 ILE 49 3HG1 ILE 49 6.284 8.405 1.163
368 1HG2 ILE 49 1HG2 ILE 49 6.264 8.777 4.258
369 2HG2 ILE 49 2HG2 ILE 49 5.997 9.974 2.974
370 3HG2 ILE 49 3HG2 ILE 49 4.774 9.729 4.227
371 1HD1 ILE 49 1HD1 ILE 49 6.486 5.811 2.759
372 2HD1 ILE 49 2HD1 ILE 49 7.580 6.371 1.488
373 3HD1 ILE 49 3HD1 ILE 49 7.489 7.254 3.017
374 H TYR 50 H TYR 50 3.351 6.690 6.046
375 HA TYR 50 HA TYR 50 0.791 8.181 5.623
376 1HB TYR 50 2HB TYR 50 -0.530 6.471 6.535
377 2HB TYR 50 3HB TYR 50 0.286 5.870 5.132
378 HD1 TYR 50 HD1 TYR 50 0.331 5.828 8.888
379 HD2 TYR 50 HD2 TYR 50 1.321 3.757 5.266
380 HE1 TYR 50 HE1 TYR 50 0.730 3.777 10.181
381 HE2 TYR 50 HE2 TYR 50 1.501 1.635 6.529
382 HH TYR 50 HH TYR 50 1.438 1.496 10.019
383 H ASP 51 H ASP 51 -0.353 8.526 7.538
384 HA ASP 51 HA ASP 51 1.459 9.414 9.646
385 1HB ASP 51 2HB ASP 51 -1.461 10.032 9.175
386 2HB ASP 51 3HB ASP 51 -0.346 10.772 10.348
387 HA PRO 52 HA PRO 52 -0.015 5.607 11.596
388 1HB PRO 52 2HB PRO 52 1.856 5.224 13.528
389 2HB PRO 52 3HB PRO 52 2.202 5.006 11.788
390 1HG PRO 52 2HG PRO 52 2.692 7.504 13.441
391 2HG PRO 52 3HG PRO 52 3.869 6.605 12.436
392 1HD PRO 52 2HD PRO 52 2.566 8.749 11.468
393 2HD PRO 52 3HD PRO 52 2.815 7.317 10.426
394 H ALA 53 H ALA 53 -0.668 8.625 12.567
395 HA ALA 53 HA ALA 53 -1.627 8.030 15.291
396 1HB ALA 53 1HB ALA 53 -0.726 10.287 14.786
397 2HB ALA 53 2HB ALA 53 -1.893 10.447 13.451
398 3HB ALA 53 3HB ALA 53 -2.469 10.342 15.129
399 H GLU 54 H GLU 54 -2.462 7.897 11.868
400 HA GLU 54 HA GLU 54 -5.347 7.728 12.522
401 1HB GLU 54 2HB GLU 54 -3.880 9.415 10.621
402 2HB GLU 54 3HB GLU 54 -5.035 8.345 9.811
403 1HG GLU 54 2HG GLU 54 -6.875 9.106 11.170
404 2HG GLU 54 3HG GLU 54 -5.791 10.210 12.042
405 H THR 55 H THR 55 -2.854 6.646 10.107
406 HA THR 55 HA THR 55 -4.307 4.079 9.943
407 HB THR 55 HB THR 55 -2.714 3.543 7.975
408 HG1 THR 55 1HG THR 55 -2.865 6.286 7.803
409 1HG2 THR 55 1HG2 THR 55 -4.359 4.505 6.501
410 2HG2 THR 55 2HG2 THR 55 -5.086 3.707 7.921
411 3HG2 THR 55 3HG2 THR 55 -5.036 5.488 7.828
412 H GLY 56 H GLY 56 -2.227 2.391 9.457
413 1HA GLY 56 2HA GLY 56 -0.368 1.735 11.258
414 2HA GLY 56 3HA GLY 56 -1.761 2.019 12.316
415 H THR 57 H THR 57 -0.758 0.430 9.602
416 HA THR 57 HA THR 57 -1.338 -0.560 7.909
417 HB THR 57 HB THR 57 -1.048 -2.991 8.115
418 HG1 THR 57 1HG THR 57 -1.430 -2.434 10.874
419 1HG2 THR 57 1HG2 THR 57 0.735 -1.652 10.207
420 2HG2 THR 57 2HG2 THR 57 1.085 -3.077 9.225
421 3HG2 THR 57 3HG2 THR 57 0.976 -1.475 8.463
422 H ALA 58 H ALA 58 -3.749 -1.159 10.389
423 HA ALA 58 HA ALA 58 -5.871 -2.415 9.490
424 1HB ALA 58 1HB ALA 58 -5.821 -0.898 11.398
425 2HB ALA 58 2HB ALA 58 -5.667 0.497 10.327
426 3HB ALA 58 3HB ALA 58 -7.181 -0.450 10.339
427 H ALA 59 H ALA 59 -5.187 0.861 8.163
428 HA ALA 59 HA ALA 59 -7.653 0.470 6.558
429 1HB ALA 59 1HB ALA 59 -5.680 2.694 6.099
430 2HB ALA 59 2HB ALA 59 -7.367 2.613 5.605
431 3HB ALA 59 3HB ALA 59 -6.996 2.751 7.331
432 H ILE 60 H ILE 60 -4.222 0.338 6.071
433 HA ILE 60 HA ILE 60 -4.093 0.046 3.255
434 HB ILE 60 HB ILE 60 -2.302 -0.496 5.634
435 1HG1 ILE 60 2HG1 ILE 60 -0.798 0.914 4.126
436 2HG1 ILE 60 3HG1 ILE 60 -2.190 1.051 3.045
437 1HG2 ILE 60 1HG2 ILE 60 -1.865 -2.498 4.353
438 2HG2 ILE 60 2HG2 ILE 60 -1.670 -1.531 2.862
439 3HG2 ILE 60 3HG2 ILE 60 -0.534 -1.351 4.224
440 1HD1 ILE 60 1HD1 ILE 60 -2.047 1.890 6.014
441 2HD1 ILE 60 2HD1 ILE 60 -1.785 3.000 4.663
442 3HD1 ILE 60 3HD1 ILE 60 -3.382 2.285 4.911
443 H GLN 61 H GLN 61 -4.268 -2.496 5.830
444 HA GLN 61 HA GLN 61 -4.385 -4.550 3.847
445 1HB GLN 61 2HB GLN 61 -4.417 -4.391 6.708
446 2HB GLN 61 3HB GLN 61 -5.747 -5.421 6.194
447 1HG GLN 61 2HG GLN 61 -4.401 -7.137 5.768
448 2HG GLN 61 3HG GLN 61 -3.377 -6.201 4.688
449 1HE2 GLN 61 1HE2 GLN 61 -2.128 -4.348 6.216
450 2HE2 GLN 61 2HE2 GLN 61 -1.167 -5.168 7.445
451 H GLU 62 H GLU 62 -7.018 -2.902 5.701
452 HA GLU 62 HA GLU 62 -9.224 -4.173 4.626
453 1HB GLU 62 2HB GLU 62 -8.646 -1.393 5.635
454 2HB GLU 62 3HB GLU 62 -10.123 -1.604 4.709
455 1HG GLU 62 2HG GLU 62 -10.775 -1.899 6.934
456 2HG GLU 62 3HG GLU 62 -10.724 -3.537 6.278
457 H LYS 63 H LYS 63 -7.583 -1.297 3.158
458 HA LYS 63 HA LYS 63 -9.292 -1.366 0.880
459 1HB LYS 63 2HB LYS 63 -6.859 0.110 1.802
460 2HB LYS 63 3HB LYS 63 -7.244 0.181 0.118
461 1HG LYS 63 2HG LYS 63 -9.321 0.841 2.244
462 2HG LYS 63 3HG LYS 63 -8.141 1.991 1.639
463 1HD LYS 63 2HD LYS 63 -10.046 2.467 0.417
464 2HD LYS 63 3HD LYS 63 -8.960 1.652 -0.706
465 1HE LYS 63 2HE LYS 63 -10.315 -0.308 -0.747
466 2HE LYS 63 3HE LYS 63 -11.135 0.116 0.779
467 1HZ LYS 63 1HZ LYS 63 -11.472 1.509 -1.789
468 2HZ LYS 63 2HZ LYS 63 -12.539 0.462 -1.108
469 3HZ LYS 63 3HZ LYS 63 -12.224 1.898 -0.377
470 H ILE 64 H ILE 64 -6.066 -2.759 1.582
471 HA ILE 64 HA ILE 64 -5.125 -3.263 -0.932
472 HB ILE 64 HB ILE 64 -4.821 -4.327 1.769
473 1HG1 ILE 64 2HG1 ILE 64 -3.463 -2.508 0.645
474 2HG1 ILE 64 3HG1 ILE 64 -2.581 -3.802 1.455
475 1HG2 ILE 64 1HG2 ILE 64 -4.066 -6.129 -0.477
476 2HG2 ILE 64 2HG2 ILE 64 -3.360 -6.152 1.163
477 3HG2 ILE 64 3HG2 ILE 64 -5.077 -6.461 0.954
478 1HD1 ILE 64 1HD1 ILE 64 -3.057 -3.610 -1.544
479 2HD1 ILE 64 2HD1 ILE 64 -1.544 -3.273 -0.670
480 3HD1 ILE 64 3HD1 ILE 64 -2.199 -4.920 -0.719
481 H GLU 65 H GLU 65 -7.188 -5.268 1.244
482 HA GLU 65 HA GLU 65 -7.944 -7.344 -0.519
483 1HB GLU 65 2HB GLU 65 -9.179 -6.094 1.957
484 2HB GLU 65 3HB GLU 65 -10.018 -7.379 1.082
485 1HG GLU 65 2HG GLU 65 -7.131 -7.806 1.837
486 2HG GLU 65 3HG GLU 65 -8.393 -7.976 3.065
487 H LYS 66 H LYS 66 -9.837 -4.358 0.301
488 HA LYS 66 HA LYS 66 -11.920 -4.993 -1.527
489 1HB LYS 66 2HB LYS 66 -11.082 -2.475 -0.103
490 2HB LYS 66 3HB LYS 66 -12.203 -2.342 -1.460
491 1HG LYS 66 2HG LYS 66 -13.594 -2.497 0.371
492 2HG LYS 66 3HG LYS 66 -13.653 -4.101 -0.375
493 1HD LYS 66 2HD LYS 66 -11.873 -4.822 1.343
494 2HD LYS 66 3HD LYS 66 -12.105 -3.266 2.136
495 1HE LYS 66 2HE LYS 66 -14.153 -5.505 1.734
496 2HE LYS 66 3HE LYS 66 -13.400 -5.008 3.255
497 1HZ LYS 66 1HZ LYS 66 -15.277 -3.398 1.655
498 2HZ LYS 66 2HZ LYS 66 -15.600 -4.146 3.079
499 3HZ LYS 66 3HZ LYS 66 -14.542 -2.889 3.043
500 H LEU 67 H LEU 67 -8.864 -3.375 -2.178
501 HA LEU 67 HA LEU 67 -9.554 -2.501 -4.860
502 1HB LEU 67 2HB LEU 67 -6.984 -2.780 -3.277
503 2HB LEU 67 3HB LEU 67 -6.965 -2.347 -4.982
504 HG LEU 67 HG LEU 67 -8.751 -0.769 -3.114
505 1HD1 LEU 67 1HD1 LEU 67 -6.825 0.849 -2.832
506 2HD1 LEU 67 2HD1 LEU 67 -6.650 -0.671 -1.941
507 3HD1 LEU 67 3HD1 LEU 67 -5.754 -0.431 -3.426
508 1HD2 LEU 67 1HD2 LEU 67 -7.162 -0.044 -5.625
509 2HD2 LEU 67 2HD2 LEU 67 -8.893 -0.428 -5.591
510 3HD2 LEU 67 3HD2 LEU 67 -8.290 1.015 -4.758
511 H GLY 68 H GLY 68 -8.783 -5.575 -3.462
512 1HA GLY 68 2HA GLY 68 -8.981 -7.594 -4.544
513 2HA GLY 68 3HA GLY 68 -8.808 -6.821 -6.126
514 H TYR 69 H TYR 69 -6.693 -6.577 -3.188
515 HA TYR 69 HA TYR 69 -4.513 -8.031 -4.609
516 1HB TYR 69 2HB TYR 69 -4.714 -5.177 -4.001
517 2HB TYR 69 3HB TYR 69 -3.400 -5.890 -3.096
518 HD1 TYR 69 HD1 TYR 69 -1.377 -6.595 -4.156
519 HD2 TYR 69 HD2 TYR 69 -4.823 -5.586 -6.541
520 HE1 TYR 69 HE1 TYR 69 0.044 -6.408 -6.154
521 HE2 TYR 69 HE2 TYR 69 -3.419 -5.482 -8.544
522 HH TYR 69 HH TYR 69 -1.264 -5.668 -9.392
523 H HIS 70 H HIS 70 -2.670 -8.399 -2.970
524 HA HIS 70 HA HIS 70 -3.608 -8.590 -0.164
525 1HB HIS 70 2HB HIS 70 -3.975 -10.771 -1.346
526 2HB HIS 70 3HB HIS 70 -2.239 -10.867 -1.644
527 HD1 HIS 70 1HD HIS 70 -1.765 -9.789 1.665
528 HD2 HIS 70 2HD HIS 70 -3.804 -13.089 -0.003
529 HE1 HIS 70 1HE HIS 70 -1.933 -11.521 3.472
530 H VAL 71 H VAL 71 -2.065 -7.713 1.122
531 HA VAL 71 HA VAL 71 0.729 -7.500 0.117
532 HB VAL 71 HB VAL 71 -0.593 -5.389 0.697
533 1HG1 VAL 71 1HG1 VAL 71 -0.737 -4.703 3.003
534 2HG1 VAL 71 2HG1 VAL 71 -1.622 -6.230 2.831
535 3HG1 VAL 71 3HG1 VAL 71 -0.002 -6.212 3.562
536 1HG2 VAL 71 1HG2 VAL 71 1.788 -5.365 0.377
537 2HG2 VAL 71 2HG2 VAL 71 1.333 -4.296 1.709
538 3HG2 VAL 71 3HG2 VAL 71 2.045 -5.888 2.061
539 H VAL 72 H VAL 72 2.357 -8.235 1.534
540 HA VAL 72 HA VAL 72 1.573 -10.033 3.767
541 HB VAL 72 HB VAL 72 3.798 -10.320 1.804
542 1HG1 VAL 72 1HG1 VAL 72 4.579 -11.105 3.962
543 2HG1 VAL 72 2HG1 VAL 72 3.079 -12.029 4.215
544 3HG1 VAL 72 3HG1 VAL 72 4.231 -12.506 2.951
545 1HG2 VAL 72 1HG2 VAL 72 1.329 -12.059 2.296
546 2HG2 VAL 72 2HG2 VAL 72 1.584 -11.026 0.875
547 3HG2 VAL 72 3HG2 VAL 72 2.628 -12.427 1.144
548 H ILE 73 H ILE 73 2.930 -9.855 5.548
549 HA ILE 73 HA ILE 73 4.605 -7.387 5.672
550 HB ILE 73 HB ILE 73 2.747 -8.477 7.785
551 1HG1 ILE 73 2HG1 ILE 73 1.972 -5.957 7.430
552 2HG1 ILE 73 3HG1 ILE 73 2.685 -6.163 5.833
553 1HG2 ILE 73 1HG2 ILE 73 3.369 -6.494 9.058
554 2HG2 ILE 73 2HG2 ILE 73 4.800 -7.483 8.786
555 3HG2 ILE 73 3HG2 ILE 73 4.550 -6.022 7.812
556 1HD1 ILE 73 1HD1 ILE 73 1.129 -8.047 5.448
557 2HD1 ILE 73 2HD1 ILE 73 0.537 -7.877 7.124
558 3HD1 ILE 73 3HD1 ILE 73 0.265 -6.579 5.935
559 H GLU 74 H GLU 74 6.363 -8.859 4.964
560 HA GLU 74 HA GLU 74 7.405 -10.741 6.765
561 1HB GLU 74 2HB GLU 74 8.263 -9.482 4.183
562 2HB GLU 74 3HB GLU 74 9.440 -10.352 5.157
563 1HG GLU 74 2HG GLU 74 6.821 -11.695 4.459
564 2HG GLU 74 3HG GLU 74 8.201 -11.706 3.347
565 H GLY 75 H GLY 75 7.148 -7.619 7.204
566 1HA GLY 75 2HA GLY 75 9.523 -7.383 8.989
567 2HA GLY 75 3HA GLY 75 9.186 -6.090 7.818
568 H ARG 76 H ARG 76 7.335 -8.182 10.049
569 HA ARG 76 HA ARG 76 5.395 -6.126 10.695
570 1HB ARG 76 2HB ARG 76 5.167 -8.773 10.781
571 2HB ARG 76 3HB ARG 76 5.921 -8.582 12.371
572 1HG ARG 76 2HG ARG 76 4.021 -6.698 12.647
573 2HG ARG 76 3HG ARG 76 3.244 -7.620 11.347
574 1HD ARG 76 2HD ARG 76 3.504 -9.689 12.791
575 2HD ARG 76 3HD ARG 76 4.169 -8.625 14.063
576 HE ARG 76 HE ARG 76 1.635 -7.649 13.126
577 1HH1 ARG 76 2HH2 ARG 76 3.056 -10.110 15.190
578 2HH1 ARG 76 1HH2 ARG 76 1.667 -10.318 16.212
579 1HH2 ARG 76 2HH1 ARG 76 -0.265 -7.904 14.423
580 2HH2 ARG 76 1HH1 ARG 76 -0.283 -9.020 15.749
Start of MODEL 16
1 1H MET 1 H1 MET 1 -3.721 16.441 17.537
2 2H MET 1 H2 MET 1 -5.291 16.949 17.251
3 3H MET 1 H3 MET 1 -4.424 16.115 16.101
4 HA MET 1 HA MET 1 -4.325 18.316 15.422
5 1HB MET 1 2HB MET 1 -3.703 20.132 16.847
6 2HB MET 1 3HB MET 1 -4.973 19.241 17.676
7 1HG MET 1 2HG MET 1 -2.891 18.039 18.884
8 2HG MET 1 3HG MET 1 -2.023 19.456 18.291
9 1HE MET 1 1HE MET 1 -5.640 18.853 19.887
10 2HE MET 1 2HE MET 1 -4.447 17.918 20.827
11 3HE MET 1 3HE MET 1 -5.254 19.321 21.557
12 H LEU 2 H LEU 2 -2.399 18.701 14.244
13 HA LEU 2 HA LEU 2 -0.382 18.248 13.418
14 1HB LEU 2 2HB LEU 2 0.189 18.539 16.232
15 2HB LEU 2 3HB LEU 2 1.161 17.205 15.637
16 HG LEU 2 HG LEU 2 1.040 19.831 14.102
17 1HD1 LEU 2 1HD1 LEU 2 2.930 20.670 15.448
18 2HD1 LEU 2 2HD1 LEU 2 1.445 20.516 16.399
19 3HD1 LEU 2 3HD1 LEU 2 2.736 19.305 16.571
20 1HD2 LEU 2 1HD2 LEU 2 3.269 17.790 14.572
21 2HD2 LEU 2 2HD2 LEU 2 2.249 17.863 13.120
22 3HD2 LEU 2 3HD2 LEU 2 3.346 19.201 13.499
23 H SER 3 H SER 3 0.801 16.492 12.540
24 HA SER 3 HA SER 3 -0.121 13.740 13.147
25 1HB SER 3 2HB SER 3 -0.437 15.265 10.511
26 2HB SER 3 3HB SER 3 -0.584 13.515 10.661
27 HG SER 3 HG SER 3 -2.317 13.750 11.977
28 H GLU 4 H GLU 4 1.760 12.534 13.174
29 HA GLU 4 HA GLU 4 4.200 13.568 11.912
30 1HB GLU 4 2HB GLU 4 3.521 11.449 13.858
31 2HB GLU 4 3HB GLU 4 4.830 11.071 12.763
32 1HG GLU 4 2HG GLU 4 5.794 13.315 13.397
33 2HG GLU 4 3HG GLU 4 4.603 13.315 14.702
34 H GLN 5 H GLN 5 5.415 11.686 10.650
35 HA GLN 5 HA GLN 5 3.583 10.207 8.880
36 1HB GLN 5 2HB GLN 5 5.861 12.016 8.081
37 2HB GLN 5 3HB GLN 5 5.150 10.885 6.954
38 1HG GLN 5 2HG GLN 5 3.350 12.939 8.330
39 2HG GLN 5 3HG GLN 5 4.425 13.430 7.044
40 1HE2 GLN 5 1HE2 GLN 5 3.102 10.139 6.877
41 2HE2 GLN 5 2HE2 GLN 5 2.024 10.498 5.544
42 H LYS 6 H LYS 6 4.469 8.231 8.354
43 HA LYS 6 HA LYS 6 7.351 7.755 8.652
44 1HB LYS 6 2HB LYS 6 5.233 6.051 10.016
45 2HB LYS 6 3HB LYS 6 6.843 5.472 9.606
46 1HG LYS 6 2HG LYS 6 7.130 7.984 10.997
47 2HG LYS 6 3HG LYS 6 6.100 6.966 11.966
48 1HD LYS 6 2HD LYS 6 8.801 6.132 10.794
49 2HD LYS 6 3HD LYS 6 8.586 6.911 12.365
50 1HE LYS 6 2HE LYS 6 8.762 4.679 12.962
51 2HE LYS 6 3HE LYS 6 7.022 4.982 13.017
52 1HZ LYS 6 1HZ LYS 6 7.590 2.914 11.915
53 2HZ LYS 6 2HZ LYS 6 6.860 3.936 10.853
54 3HZ LYS 6 3HZ LYS 6 8.489 3.711 10.788
55 H GLU 7 H GLU 7 8.046 5.936 7.578
56 HA GLU 7 HA GLU 7 6.571 5.273 5.112
57 1HB GLU 7 2HB GLU 7 9.575 5.127 5.381
58 2HB GLU 7 3HB GLU 7 8.538 5.498 4.011
59 1HG GLU 7 2HG GLU 7 9.651 7.490 4.517
60 2HG GLU 7 3HG GLU 7 8.079 7.756 5.278
61 H ILE 8 H ILE 8 5.675 3.245 5.709
62 HA ILE 8 HA ILE 8 7.336 1.289 7.124
63 HB ILE 8 HB ILE 8 4.619 1.015 5.990
64 1HG1 ILE 8 2HG1 ILE 8 4.282 2.982 7.219
65 2HG1 ILE 8 3HG1 ILE 8 3.617 1.601 8.111
66 1HG2 ILE 8 1HG2 ILE 8 4.316 -0.567 7.822
67 2HG2 ILE 8 2HG2 ILE 8 5.695 -1.005 6.795
68 3HG2 ILE 8 3HG2 ILE 8 5.997 -0.217 8.349
69 1HD1 ILE 8 1HD1 ILE 8 4.819 3.181 9.536
70 2HD1 ILE 8 2HD1 ILE 8 5.479 1.523 9.564
71 3HD1 ILE 8 3HD1 ILE 8 6.312 2.792 8.627
72 H ALA 9 H ALA 9 7.569 -0.904 6.026
73 HA ALA 9 HA ALA 9 7.685 -0.804 3.069
74 1HB ALA 9 1HB ALA 9 9.956 -0.187 4.011
75 2HB ALA 9 2HB ALA 9 9.977 -1.747 4.848
76 3HB ALA 9 3HB ALA 9 9.940 -1.696 3.072
77 H MET 10 H MET 10 6.918 -2.779 2.239
78 HA MET 10 HA MET 10 7.106 -5.225 3.813
79 1HB MET 10 2HB MET 10 4.682 -5.578 4.063
80 2HB MET 10 3HB MET 10 5.219 -4.147 4.930
81 1HG MET 10 2HG MET 10 4.537 -2.861 2.747
82 2HG MET 10 3HG MET 10 3.640 -4.334 2.374
83 1HE MET 10 1HE MET 10 4.422 -1.887 5.290
84 2HE MET 10 2HE MET 10 3.765 -0.952 3.934
85 3HE MET 10 3HE MET 10 2.854 -1.048 5.462
86 H GLN 11 H GLN 11 5.549 -6.958 2.596
87 HA GLN 11 HA GLN 11 6.549 -6.942 -0.201
88 1HB GLN 11 2HB GLN 11 5.783 -9.111 1.813
89 2HB GLN 11 3HB GLN 11 5.898 -9.466 0.096
90 1HG GLN 11 2HG GLN 11 8.124 -8.460 1.920
91 2HG GLN 11 3HG GLN 11 7.955 -10.089 1.237
92 1HE2 GLN 11 1HE2 GLN 11 7.429 -9.859 -1.349
93 2HE2 GLN 11 2HE2 GLN 11 8.367 -8.618 -2.175
94 H VAL 12 H VAL 12 5.123 -8.064 -1.787
95 HA VAL 12 HA VAL 12 2.254 -7.274 -1.435
96 HB VAL 12 HB VAL 12 4.035 -7.061 -3.906
97 1HG1 VAL 12 1HG1 VAL 12 1.760 -7.495 -4.625
98 2HG1 VAL 12 2HG1 VAL 12 1.111 -6.325 -3.449
99 3HG1 VAL 12 3HG1 VAL 12 2.076 -5.775 -4.833
100 1HG2 VAL 12 1HG2 VAL 12 2.883 -4.943 -2.051
101 2HG2 VAL 12 2HG2 VAL 12 4.610 -5.302 -2.311
102 3HG2 VAL 12 3HG2 VAL 12 3.650 -4.593 -3.610
103 H SER 13 H SER 13 0.702 -8.617 -2.654
104 HA SER 13 HA SER 13 1.754 -10.866 -4.184
105 1HB SER 13 2HB SER 13 0.158 -11.215 -1.625
106 2HB SER 13 3HB SER 13 0.109 -12.432 -2.908
107 HG SER 13 HG SER 13 2.613 -11.475 -2.066
108 H GLY 14 H GLY 14 -0.067 -12.025 -5.247
109 1HA GLY 14 2HA GLY 14 -1.814 -11.928 -6.746
110 2HA GLY 14 3HA GLY 14 -2.553 -10.641 -5.776
111 H MET 15 H MET 15 0.585 -10.930 -7.533
112 HA MET 15 HA MET 15 -0.074 -8.519 -9.129
113 1HB MET 15 2HB MET 15 2.126 -7.608 -8.763
114 2HB MET 15 3HB MET 15 1.343 -7.902 -7.214
115 1HG MET 15 2HG MET 15 3.441 -8.662 -6.759
116 2HG MET 15 3HG MET 15 2.688 -10.178 -7.250
117 1HE MET 15 1HE MET 15 6.391 -10.569 -8.446
118 2HE MET 15 2HE MET 15 5.769 -9.858 -6.945
119 3HE MET 15 3HE MET 15 5.036 -11.345 -7.596
120 H THR 16 H THR 16 1.043 -8.394 -11.083
121 HA THR 16 HA THR 16 2.809 -10.184 -12.261
122 HB THR 16 HB THR 16 0.804 -11.070 -13.964
123 HG1 THR 16 1HG THR 16 0.005 -11.563 -11.305
124 1HG2 THR 16 1HG2 THR 16 2.689 -12.442 -13.303
125 2HG2 THR 16 2HG2 THR 16 2.120 -12.583 -11.637
126 3HG2 THR 16 3HG2 THR 16 1.187 -13.308 -12.959
127 H CYS 17 H CYS 17 -0.095 -8.243 -12.962
128 HA CYS 17 HA CYS 17 0.587 -7.263 -15.452
129 1HB CYS 17 2HB CYS 17 -0.702 -5.649 -13.217
130 2HB CYS 17 3HB CYS 17 -0.885 -5.393 -14.959
131 H ALA 18 H ALA 18 2.184 -6.518 -12.451
132 HA ALA 18 HA ALA 18 3.857 -5.125 -11.843
133 1HB ALA 18 1HB ALA 18 4.954 -6.499 -13.601
134 2HB ALA 18 2HB ALA 18 4.587 -5.238 -14.797
135 3HB ALA 18 3HB ALA 18 5.671 -4.885 -13.439
136 H ALA 19 H ALA 19 1.377 -3.873 -12.441
137 HA ALA 19 HA ALA 19 2.195 -1.068 -12.686
138 1HB ALA 19 1HB ALA 19 0.353 -2.348 -14.758
139 2HB ALA 19 2HB ALA 19 0.668 -0.606 -14.579
140 3HB ALA 19 3HB ALA 19 1.981 -1.701 -15.052
141 H CYS 20 H CYS 20 -0.626 -3.327 -12.697
142 HA CYS 20 HA CYS 20 -2.480 -1.835 -11.333
143 1HB CYS 20 2HB CYS 20 -1.747 -4.801 -11.170
144 2HB CYS 20 3HB CYS 20 -3.222 -4.157 -10.453
145 H ALA 21 H ALA 21 0.303 -3.518 -9.889
146 HA ALA 21 HA ALA 21 -0.278 -3.066 -7.190
147 1HB ALA 21 1HB ALA 21 2.486 -3.018 -8.444
148 2HB ALA 21 2HB ALA 21 2.022 -3.535 -6.795
149 3HB ALA 21 3HB ALA 21 1.541 -4.499 -8.187
150 H ALA 22 H ALA 22 0.644 -0.703 -9.635
151 HA ALA 22 HA ALA 22 1.227 1.438 -7.713
152 1HB ALA 22 1HB ALA 22 2.105 1.408 -10.089
153 2HB ALA 22 2HB ALA 22 0.434 1.684 -10.638
154 3HB ALA 22 3HB ALA 22 1.240 2.884 -9.616
155 H ARG 23 H ARG 23 -1.562 0.303 -9.654
156 HA ARG 23 HA ARG 23 -3.327 2.487 -9.052
157 1HB ARG 23 2HB ARG 23 -4.023 -0.447 -9.542
158 2HB ARG 23 3HB ARG 23 -5.152 0.892 -9.533
159 1HG ARG 23 2HG ARG 23 -2.892 0.515 -11.558
160 2HG ARG 23 3HG ARG 23 -4.600 0.146 -11.786
161 1HD ARG 23 2HD ARG 23 -4.369 2.226 -12.811
162 2HD ARG 23 3HD ARG 23 -5.099 2.591 -11.232
163 HE ARG 23 HE ARG 23 -2.193 2.668 -11.203
164 1HH1 ARG 23 2HH2 ARG 23 -5.032 4.561 -12.074
165 2HH1 ARG 23 1HH2 ARG 23 -4.270 6.112 -11.910
166 1HH2 ARG 23 2HH1 ARG 23 -1.105 4.699 -11.062
167 2HH2 ARG 23 1HH1 ARG 23 -1.962 6.182 -11.333
168 H ILE 24 H ILE 24 -2.705 -0.628 -7.368
169 HA ILE 24 HA ILE 24 -4.573 -0.034 -5.350
170 HB ILE 24 HB ILE 24 -3.824 -1.712 -4.016
171 1HG1 ILE 24 2HG1 ILE 24 -1.237 -1.470 -5.439
172 2HG1 ILE 24 3HG1 ILE 24 -1.556 -1.276 -3.697
173 1HG2 ILE 24 1HG2 ILE 24 -4.744 -2.175 -6.426
174 2HG2 ILE 24 2HG2 ILE 24 -3.099 -2.740 -6.776
175 3HG2 ILE 24 3HG2 ILE 24 -4.057 -3.486 -5.480
176 1HD1 ILE 24 1HD1 ILE 24 -2.104 -3.732 -3.622
177 2HD1 ILE 24 2HD1 ILE 24 -1.530 -3.813 -5.314
178 3HD1 ILE 24 3HD1 ILE 24 -0.408 -3.365 -4.023
179 H GLU 25 H GLU 25 -0.998 0.489 -5.076
180 HA GLU 25 HA GLU 25 -1.050 1.836 -2.665
181 1HB GLU 25 2HB GLU 25 0.762 1.929 -5.060
182 2HB GLU 25 3HB GLU 25 1.001 3.134 -3.783
183 1HG GLU 25 2HG GLU 25 0.790 0.172 -3.122
184 2HG GLU 25 3HG GLU 25 2.316 0.975 -3.522
185 H LYS 26 H LYS 26 -1.789 3.236 -5.857
186 HA LYS 26 HA LYS 26 -1.839 5.939 -4.784
187 1HB LYS 26 2HB LYS 26 -2.503 4.800 -7.478
188 2HB LYS 26 3HB LYS 26 -3.005 6.430 -7.018
189 1HG LYS 26 2HG LYS 26 -0.917 6.684 -8.096
190 2HG LYS 26 3HG LYS 26 -0.644 7.003 -6.381
191 1HD LYS 26 2HD LYS 26 0.280 4.630 -6.158
192 2HD LYS 26 3HD LYS 26 -0.091 4.441 -7.864
193 1HE LYS 26 2HE LYS 26 2.195 4.818 -7.884
194 2HE LYS 26 3HE LYS 26 1.529 6.395 -8.309
195 1HZ LYS 26 1HZ LYS 26 1.895 7.071 -6.005
196 2HZ LYS 26 2HZ LYS 26 2.496 5.631 -5.577
197 3HZ LYS 26 3HZ LYS 26 3.288 6.543 -6.677
198 H GLY 27 H GLY 27 -4.361 3.478 -5.565
199 1HA GLY 27 2HA GLY 27 -6.604 5.122 -4.776
200 2HA GLY 27 3HA GLY 27 -6.553 3.356 -4.906
201 H LEU 28 H LEU 28 -4.310 3.076 -3.095
202 HA LEU 28 HA LEU 28 -5.557 2.844 -0.502
203 1HB LEU 28 2HB LEU 28 -3.963 1.330 -1.395
204 2HB LEU 28 3HB LEU 28 -2.714 2.567 -1.442
205 HG LEU 28 HG LEU 28 -4.071 1.789 1.140
206 1HD1 LEU 28 1HD1 LEU 28 -3.374 -0.263 0.178
207 2HD1 LEU 28 2HD1 LEU 28 -1.765 0.385 -0.220
208 3HD1 LEU 28 3HD1 LEU 28 -2.243 0.159 1.478
209 1HD2 LEU 28 1HD2 LEU 28 -1.315 2.910 0.351
210 2HD2 LEU 28 2HD2 LEU 28 -2.620 3.817 1.144
211 3HD2 LEU 28 3HD2 LEU 28 -1.788 2.513 2.011
212 H LYS 29 H LYS 29 -3.061 5.072 -1.867
213 HA LYS 29 HA LYS 29 -2.763 6.804 0.237
214 1HB LYS 29 2HB LYS 29 -1.702 6.913 -2.124
215 2HB LYS 29 3HB LYS 29 -3.135 7.848 -2.578
216 1HG LYS 29 2HG LYS 29 -2.512 9.283 -0.413
217 2HG LYS 29 3HG LYS 29 -0.932 8.556 -0.632
218 1HD LYS 29 2HD LYS 29 -2.519 10.156 -2.715
219 2HD LYS 29 3HD LYS 29 -1.254 10.800 -1.685
220 1HE LYS 29 2HE LYS 29 0.154 8.754 -2.806
221 2HE LYS 29 3HE LYS 29 -1.029 9.019 -4.092
222 1HZ LYS 29 1HZ LYS 29 -0.287 11.438 -3.948
223 2HZ LYS 29 2HZ LYS 29 0.928 10.914 -2.947
224 3HZ LYS 29 3HZ LYS 29 0.894 10.389 -4.444
225 H ARG 30 H ARG 30 -5.559 6.656 -1.935
226 HA ARG 30 HA ARG 30 -6.703 9.159 -1.133
227 1HB ARG 30 2HB ARG 30 -7.356 6.918 -2.915
228 2HB ARG 30 3HB ARG 30 -8.798 7.512 -2.122
229 1HG ARG 30 2HG ARG 30 -6.907 9.552 -3.292
230 2HG ARG 30 3HG ARG 30 -7.775 8.505 -4.412
231 1HD ARG 30 2HD ARG 30 -9.942 9.228 -3.606
232 2HD ARG 30 3HD ARG 30 -9.226 9.938 -2.162
233 HE ARG 30 HE ARG 30 -8.952 11.881 -3.225
234 1HH1 ARG 30 2HH2 ARG 30 -9.080 9.402 -5.719
235 2HH1 ARG 30 1HH2 ARG 30 -8.965 10.501 -7.062
236 1HH2 ARG 30 2HH1 ARG 30 -8.843 13.383 -4.965
237 2HH2 ARG 30 1HH1 ARG 30 -8.844 12.833 -6.607
238 H MET 31 H MET 31 -6.319 6.561 0.915
239 HA MET 31 HA MET 31 -8.880 6.790 2.293
240 1HB MET 31 2HB MET 31 -7.958 5.194 3.772
241 2HB MET 31 3HB MET 31 -7.280 4.800 2.202
242 1HG MET 31 2HG MET 31 -5.133 5.811 2.874
243 2HG MET 31 3HG MET 31 -5.852 6.379 4.370
244 1HE MET 31 1HE MET 31 -5.743 3.199 2.277
245 2HE MET 31 2HE MET 31 -4.071 3.207 2.861
246 3HE MET 31 3HE MET 31 -5.221 1.992 3.460
247 HA PRO 32 HA PRO 32 -7.561 10.143 5.061
248 1HB PRO 32 2HB PRO 32 -8.610 9.478 7.490
249 2HB PRO 32 3HB PRO 32 -9.622 10.021 6.119
250 1HG PRO 32 2HG PRO 32 -9.072 7.177 6.992
251 2HG PRO 32 3HG PRO 32 -10.655 7.917 6.618
252 1HD PRO 32 2HD PRO 32 -9.290 6.432 4.820
253 2HD PRO 32 3HD PRO 32 -10.222 7.851 4.284
254 H GLY 33 H GLY 33 -5.659 10.490 6.207
255 1HA GLY 33 2HA GLY 33 -4.097 10.070 7.842
256 2HA GLY 33 3HA GLY 33 -4.511 8.362 7.885
257 H VAL 34 H VAL 34 -4.199 8.103 4.829
258 HA VAL 34 HA VAL 34 -1.236 8.026 4.777
259 HB VAL 34 HB VAL 34 -3.234 7.199 2.665
260 1HG1 VAL 34 1HG1 VAL 34 -0.215 6.789 2.941
261 2HG1 VAL 34 2HG1 VAL 34 -1.231 5.951 1.760
262 3HG1 VAL 34 3HG1 VAL 34 -1.046 7.708 1.675
263 1HG2 VAL 34 1HG2 VAL 34 -2.769 4.922 3.362
264 2HG2 VAL 34 2HG2 VAL 34 -1.614 5.443 4.578
265 3HG2 VAL 34 3HG2 VAL 34 -3.320 5.817 4.793
266 H THR 35 H THR 35 0.055 9.363 3.562
267 HA THR 35 HA THR 35 -1.324 11.645 2.187
268 HB THR 35 HB THR 35 0.645 11.644 4.321
269 HG1 THR 35 1HG THR 35 -0.128 13.720 4.477
270 1HG2 THR 35 1HG2 THR 35 1.320 13.217 1.799
271 2HG2 THR 35 2HG2 THR 35 1.923 13.605 3.411
272 3HG2 THR 35 3HG2 THR 35 2.342 12.045 2.691
273 H ASP 36 H ASP 36 1.416 9.248 1.991
274 HA ASP 36 HA ASP 36 1.160 9.565 -0.874
275 1HB ASP 36 2HB ASP 36 3.475 10.703 0.567
276 2HB ASP 36 3HB ASP 36 3.959 9.485 -0.618
277 H ALA 37 H ALA 37 2.485 7.921 -2.008
278 HA ALA 37 HA ALA 37 2.886 5.411 -0.604
279 1HB ALA 37 1HB ALA 37 0.335 5.866 -2.215
280 2HB ALA 37 2HB ALA 37 0.876 4.276 -1.675
281 3HB ALA 37 3HB ALA 37 0.435 5.490 -0.478
282 H ASN 38 H ASN 38 3.902 3.801 -1.797
283 HA ASN 38 HA ASN 38 4.659 4.473 -4.546
284 1HB ASN 38 2HB ASN 38 7.161 4.244 -3.191
285 2HB ASN 38 3HB ASN 38 6.543 5.527 -4.220
286 1HD2 ASN 38 1HD2 ASN 38 5.950 4.438 -0.810
287 2HD2 ASN 38 2HD2 ASN 38 6.317 6.019 -0.129
288 H VAL 39 H VAL 39 4.463 2.589 -5.465
289 HA VAL 39 HA VAL 39 4.934 0.105 -4.021
290 HB VAL 39 HB VAL 39 2.995 0.332 -5.421
291 1HG1 VAL 39 1HG1 VAL 39 3.539 1.866 -7.154
292 2HG1 VAL 39 2HG1 VAL 39 4.803 0.823 -7.823
293 3HG1 VAL 39 3HG1 VAL 39 3.146 0.301 -7.884
294 1HG2 VAL 39 1HG2 VAL 39 4.046 -1.837 -5.063
295 2HG2 VAL 39 2HG2 VAL 39 3.189 -1.713 -6.607
296 3HG2 VAL 39 3HG2 VAL 39 4.953 -1.624 -6.584
297 H ASN 40 H ASN 40 7.141 -0.283 -3.651
298 HA ASN 40 HA ASN 40 9.070 0.277 -5.817
299 1HB ASN 40 2HB ASN 40 9.536 0.866 -3.459
300 2HB ASN 40 3HB ASN 40 9.494 -0.851 -3.032
301 1HD2 ASN 40 1HD2 ASN 40 11.777 -0.067 -2.294
302 2HD2 ASN 40 2HD2 ASN 40 13.053 -0.238 -3.490
303 H LEU 41 H LEU 41 7.422 -1.374 -6.899
304 HA LEU 41 HA LEU 41 7.870 -4.172 -6.377
305 1HB LEU 41 2HB LEU 41 6.156 -2.588 -8.090
306 2HB LEU 41 3HB LEU 41 6.929 -3.790 -9.076
307 HG LEU 41 HG LEU 41 4.694 -4.382 -8.080
308 1HD1 LEU 41 1HD1 LEU 41 7.083 -6.229 -7.794
309 2HD1 LEU 41 2HD1 LEU 41 5.403 -6.773 -7.607
310 3HD1 LEU 41 3HD1 LEU 41 5.950 -6.087 -9.150
311 1HD2 LEU 41 1HD2 LEU 41 5.369 -3.654 -5.660
312 2HD2 LEU 41 2HD2 LEU 41 4.402 -5.120 -5.898
313 3HD2 LEU 41 3HD2 LEU 41 6.125 -5.244 -5.554
314 H ALA 42 H ALA 42 9.645 -1.818 -8.111
315 HA ALA 42 HA ALA 42 11.285 -3.236 -9.846
316 1HB ALA 42 1HB ALA 42 13.050 -1.694 -9.205
317 2HB ALA 42 2HB ALA 42 11.509 -0.800 -9.245
318 3HB ALA 42 3HB ALA 42 12.222 -1.308 -7.689
319 H THR 43 H THR 43 11.238 -3.330 -6.258
320 HA THR 43 HA THR 43 12.879 -5.799 -6.425
321 HB THR 43 HB THR 43 14.389 -4.144 -5.591
322 HG1 THR 43 1HG THR 43 13.332 -5.804 -3.571
323 1HG2 THR 43 1HG2 THR 43 12.257 -3.436 -3.529
324 2HG2 THR 43 2HG2 THR 43 13.953 -2.916 -3.467
325 3HG2 THR 43 3HG2 THR 43 12.926 -2.401 -4.812
326 H GLU 44 H GLU 44 10.119 -5.646 -6.651
327 HA GLU 44 HA GLU 44 8.153 -6.408 -5.806
328 1HB GLU 44 2HB GLU 44 10.217 -8.339 -4.703
329 2HB GLU 44 3HB GLU 44 8.479 -8.668 -4.745
330 1HG GLU 44 2HG GLU 44 8.399 -8.421 -7.169
331 2HG GLU 44 3HG GLU 44 10.122 -8.006 -7.222
332 H THR 45 H THR 45 9.115 -4.205 -4.076
333 HA THR 45 HA THR 45 8.009 -5.048 -1.442
334 HB THR 45 HB THR 45 10.082 -2.919 -2.154
335 HG1 THR 45 1HG THR 45 10.758 -5.202 -2.358
336 1HG2 THR 45 1HG2 THR 45 10.565 -2.972 0.272
337 2HG2 THR 45 2HG2 THR 45 8.913 -2.415 -0.042
338 3HG2 THR 45 3HG2 THR 45 9.207 -4.093 0.505
339 H VAL 46 H VAL 46 6.815 -3.202 -0.360
340 HA VAL 46 HA VAL 46 6.000 -0.983 -2.166
341 HB VAL 46 HB VAL 46 4.184 -2.519 -2.336
342 1HG1 VAL 46 1HG1 VAL 46 2.881 -3.280 -0.351
343 2HG1 VAL 46 2HG1 VAL 46 4.522 -3.944 -0.344
344 3HG1 VAL 46 3HG1 VAL 46 4.111 -2.560 0.691
345 1HG2 VAL 46 1HG2 VAL 46 3.355 -0.423 -0.286
346 2HG2 VAL 46 2HG2 VAL 46 3.697 -0.077 -1.993
347 3HG2 VAL 46 3HG2 VAL 46 2.365 -1.170 -1.550
348 H ASN 47 H ASN 47 5.646 1.031 -1.118
349 HA ASN 47 HA ASN 47 6.330 1.134 1.758
350 1HB ASN 47 2HB ASN 47 7.551 2.675 -0.585
351 2HB ASN 47 3HB ASN 47 7.544 3.329 1.053
352 1HD2 ASN 47 1HD2 ASN 47 8.398 1.753 2.814
353 2HD2 ASN 47 2HD2 ASN 47 9.984 1.133 2.381
354 H VAL 48 H VAL 48 4.983 2.627 2.865
355 HA VAL 48 HA VAL 48 3.113 4.227 1.223
356 HB VAL 48 HB VAL 48 1.896 2.232 1.689
357 1HG1 VAL 48 1HG1 VAL 48 3.166 1.184 3.418
358 2HG1 VAL 48 2HG1 VAL 48 2.808 2.475 4.570
359 3HG1 VAL 48 3HG1 VAL 48 1.515 1.397 4.007
360 1HG2 VAL 48 1HG2 VAL 48 1.124 4.544 3.498
361 2HG2 VAL 48 2HG2 VAL 48 0.546 4.151 1.878
362 3HG2 VAL 48 3HG2 VAL 48 0.118 3.114 3.255
363 H ILE 49 H ILE 49 3.026 6.259 2.003
364 HA ILE 49 HA ILE 49 4.665 6.829 4.366
365 HB ILE 49 HB ILE 49 3.870 8.776 2.171
366 1HG1 ILE 49 2HG1 ILE 49 5.048 7.124 0.972
367 2HG1 ILE 49 3HG1 ILE 49 6.111 8.504 1.217
368 1HG2 ILE 49 1HG2 ILE 49 6.014 8.846 4.327
369 2HG2 ILE 49 2HG2 ILE 49 5.850 10.027 3.011
370 3HG2 ILE 49 3HG2 ILE 49 4.565 9.855 4.213
371 1HD1 ILE 49 1HD1 ILE 49 7.451 6.557 1.563
372 2HD1 ILE 49 2HD1 ILE 49 7.162 7.248 3.163
373 3HD1 ILE 49 3HD1 ILE 49 6.257 5.813 2.636
374 H TYR 50 H TYR 50 3.241 6.984 6.127
375 HA TYR 50 HA TYR 50 0.757 8.610 5.829
376 1HB TYR 50 2HB TYR 50 -0.658 6.875 6.652
377 2HB TYR 50 3HB TYR 50 0.224 6.289 5.257
378 HD1 TYR 50 HD1 TYR 50 1.871 4.438 5.512
379 HD2 TYR 50 HD2 TYR 50 -0.273 5.986 8.892
380 HE1 TYR 50 HE1 TYR 50 2.036 2.239 6.648
381 HE2 TYR 50 HE2 TYR 50 0.348 3.951 10.181
382 HH TYR 50 HH TYR 50 1.221 1.858 10.087
383 H ASP 51 H ASP 51 -0.408 8.767 7.867
384 HA ASP 51 HA ASP 51 1.503 9.390 10.067
385 1HB ASP 51 2HB ASP 51 -0.101 11.108 9.507
386 2HB ASP 51 3HB ASP 51 -1.447 9.995 9.773
387 HA PRO 52 HA PRO 52 0.038 5.405 11.699
388 1HB PRO 52 2HB PRO 52 2.051 4.713 13.356
389 2HB PRO 52 3HB PRO 52 2.237 4.660 11.587
390 1HG PRO 52 2HG PRO 52 3.019 6.943 13.448
391 2HG PRO 52 3HG PRO 52 4.044 6.130 12.230
392 1HD PRO 52 2HD PRO 52 2.713 8.465 11.702
393 2HD PRO 52 3HD PRO 52 2.916 7.197 10.454
394 H ALA 53 H ALA 53 -0.199 8.436 13.026
395 HA ALA 53 HA ALA 53 -1.115 7.504 15.672
396 1HB ALA 53 1HB ALA 53 -1.426 10.174 14.255
397 2HB ALA 53 2HB ALA 53 -1.715 9.824 15.967
398 3HB ALA 53 3HB ALA 53 -0.057 9.773 15.320
399 H GLU 54 H GLU 54 -2.135 7.961 12.308
400 HA GLU 54 HA GLU 54 -4.954 7.993 13.159
401 1HB GLU 54 2HB GLU 54 -3.733 9.922 11.693
402 2HB GLU 54 3HB GLU 54 -4.273 8.864 10.383
403 1HG GLU 54 2HG GLU 54 -6.591 8.917 11.404
404 2HG GLU 54 3HG GLU 54 -5.979 10.064 12.610
405 H THR 55 H THR 55 -2.810 6.877 10.518
406 HA THR 55 HA THR 55 -4.371 4.435 10.316
407 HB THR 55 HB THR 55 -2.512 4.077 8.281
408 HG1 THR 55 1HG THR 55 -3.518 6.544 7.868
409 1HG2 THR 55 1HG2 THR 55 -4.469 4.622 6.928
410 2HG2 THR 55 2HG2 THR 55 -4.957 3.632 8.333
411 3HG2 THR 55 3HG2 THR 55 -5.294 5.396 8.308
412 H GLY 56 H GLY 56 -2.855 2.640 9.557
413 1HA GLY 56 2HA GLY 56 -0.664 1.826 11.079
414 2HA GLY 56 3HA GLY 56 -2.188 1.268 11.834
415 H THR 57 H THR 57 -2.033 -0.905 11.034
416 HA THR 57 HA THR 57 -1.554 -1.556 8.230
417 HB THR 57 HB THR 57 -1.986 -3.865 9.276
418 HG1 THR 57 1HG THR 57 -2.037 -3.825 11.570
419 1HG2 THR 57 1HG2 THR 57 0.193 -3.841 10.499
420 2HG2 THR 57 2HG2 THR 57 0.312 -2.877 9.015
421 3HG2 THR 57 3HG2 THR 57 0.155 -2.068 10.581
422 H ALA 58 H ALA 58 -4.098 -1.158 10.600
423 HA ALA 58 HA ALA 58 -6.209 -2.479 9.747
424 1HB ALA 58 1HB ALA 58 -7.646 -0.708 10.698
425 2HB ALA 58 2HB ALA 58 -6.237 -1.052 11.719
426 3HB ALA 58 3HB ALA 58 -6.259 0.401 10.697
427 H ALA 59 H ALA 59 -5.475 0.684 8.385
428 HA ALA 59 HA ALA 59 -8.005 0.492 6.810
429 1HB ALA 59 1HB ALA 59 -7.367 2.659 7.818
430 2HB ALA 59 2HB ALA 59 -5.946 2.663 6.740
431 3HB ALA 59 3HB ALA 59 -7.587 2.718 6.055
432 H ILE 60 H ILE 60 -4.535 0.279 6.468
433 HA ILE 60 HA ILE 60 -4.352 0.080 3.632
434 HB ILE 60 HB ILE 60 -2.616 -0.518 6.031
435 1HG1 ILE 60 2HG1 ILE 60 -1.189 0.773 4.077
436 2HG1 ILE 60 3HG1 ILE 60 -2.780 1.368 3.717
437 1HG2 ILE 60 1HG2 ILE 60 -1.915 -1.518 3.259
438 2HG2 ILE 60 2HG2 ILE 60 -0.824 -1.392 4.664
439 3HG2 ILE 60 3HG2 ILE 60 -2.183 -2.505 4.718
440 1HD1 ILE 60 1HD1 ILE 60 -1.644 2.891 5.260
441 2HD1 ILE 60 2HD1 ILE 60 -2.923 2.078 6.187
442 3HD1 ILE 60 3HD1 ILE 60 -1.219 1.561 6.342
443 H GLN 61 H GLN 61 -4.750 -2.556 6.046
444 HA GLN 61 HA GLN 61 -4.704 -4.536 3.975
445 1HB GLN 61 2HB GLN 61 -5.284 -4.505 6.841
446 2HB GLN 61 3HB GLN 61 -6.438 -5.489 5.931
447 1HG GLN 61 2HG GLN 61 -4.919 -7.072 6.418
448 2HG GLN 61 3HG GLN 61 -4.393 -6.608 4.803
449 1HE2 GLN 61 1HE2 GLN 61 -3.124 -4.040 5.816
450 2HE2 GLN 61 2HE2 GLN 61 -1.663 -4.588 6.626
451 H GLU 62 H GLU 62 -7.415 -2.783 5.566
452 HA GLU 62 HA GLU 62 -9.600 -3.848 4.200
453 1HB GLU 62 2HB GLU 62 -8.916 -1.272 5.569
454 2HB GLU 62 3HB GLU 62 -10.232 -1.150 4.402
455 1HG GLU 62 2HG GLU 62 -10.156 -3.252 6.598
456 2HG GLU 62 3HG GLU 62 -10.957 -1.679 6.750
457 H LYS 63 H LYS 63 -7.668 -0.972 3.166
458 HA LYS 63 HA LYS 63 -9.045 -0.720 0.720
459 1HB LYS 63 2HB LYS 63 -6.539 0.375 2.006
460 2HB LYS 63 3HB LYS 63 -6.752 0.602 0.295
461 1HG LYS 63 2HG LYS 63 -8.920 1.262 2.309
462 2HG LYS 63 3HG LYS 63 -7.732 2.457 1.810
463 1HD LYS 63 2HD LYS 63 -8.607 2.772 -0.289
464 2HD LYS 63 3HD LYS 63 -8.991 1.084 -0.498
465 1HE LYS 63 2HE LYS 63 -11.124 1.852 -0.412
466 2HE LYS 63 3HE LYS 63 -10.903 1.518 1.302
467 1HZ LYS 63 1HZ LYS 63 -11.855 3.662 0.975
468 2HZ LYS 63 2HZ LYS 63 -10.331 3.888 1.556
469 3HZ LYS 63 3HZ LYS 63 -10.652 4.134 -0.042
470 H ILE 64 H ILE 64 -6.038 -2.462 1.596
471 HA ILE 64 HA ILE 64 -5.016 -3.103 -0.857
472 HB ILE 64 HB ILE 64 -4.943 -4.115 1.872
473 1HG1 ILE 64 2HG1 ILE 64 -3.346 -2.537 0.740
474 2HG1 ILE 64 3HG1 ILE 64 -2.658 -3.880 1.646
475 1HG2 ILE 64 1HG2 ILE 64 -3.697 -6.150 1.405
476 2HG2 ILE 64 2HG2 ILE 64 -5.436 -6.243 1.156
477 3HG2 ILE 64 3HG2 ILE 64 -4.351 -6.107 -0.251
478 1HD1 ILE 64 1HD1 ILE 64 -3.027 -3.842 -1.378
479 2HD1 ILE 64 2HD1 ILE 64 -1.505 -3.586 -0.495
480 3HD1 ILE 64 3HD1 ILE 64 -2.326 -5.160 -0.424
481 H GLU 65 H GLU 65 -7.435 -4.886 1.159
482 HA GLU 65 HA GLU 65 -8.152 -6.896 -0.713
483 1HB GLU 65 2HB GLU 65 -9.507 -5.671 1.717
484 2HB GLU 65 3HB GLU 65 -10.305 -6.925 0.764
485 1HG GLU 65 2HG GLU 65 -7.488 -7.381 1.751
486 2HG GLU 65 3HG GLU 65 -8.869 -7.613 2.828
487 H LYS 66 H LYS 66 -9.891 -3.821 0.075
488 HA LYS 66 HA LYS 66 -11.897 -4.199 -1.890
489 1HB LYS 66 2HB LYS 66 -10.845 -1.882 -0.316
490 2HB LYS 66 3HB LYS 66 -11.806 -1.465 -1.715
491 1HG LYS 66 2HG LYS 66 -12.715 -3.511 0.334
492 2HG LYS 66 3HG LYS 66 -13.028 -1.801 0.563
493 1HD LYS 66 2HD LYS 66 -14.010 -3.399 -1.881
494 2HD LYS 66 3HD LYS 66 -14.914 -3.133 -0.402
495 1HE LYS 66 2HE LYS 66 -15.799 -1.440 -1.635
496 2HE LYS 66 3HE LYS 66 -14.490 -0.567 -0.840
497 1HZ LYS 66 1HZ LYS 66 -13.199 -0.927 -2.911
498 2HZ LYS 66 2HZ LYS 66 -14.496 -1.658 -3.590
499 3HZ LYS 66 3HZ LYS 66 -14.582 -0.075 -3.164
500 H LEU 67 H LEU 67 -8.661 -2.945 -2.301
501 HA LEU 67 HA LEU 67 -9.039 -2.004 -5.019
502 1HB LEU 67 2HB LEU 67 -6.609 -2.521 -3.294
503 2HB LEU 67 3HB LEU 67 -6.511 -1.899 -4.943
504 HG LEU 67 HG LEU 67 -8.291 -0.503 -2.908
505 1HD1 LEU 67 1HD1 LEU 67 -6.076 -0.632 -1.846
506 2HD1 LEU 67 2HD1 LEU 67 -5.333 -0.028 -3.307
507 3HD1 LEU 67 3HD1 LEU 67 -6.432 1.016 -2.388
508 1HD2 LEU 67 1HD2 LEU 67 -8.550 0.149 -5.281
509 2HD2 LEU 67 2HD2 LEU 67 -7.841 1.451 -4.323
510 3HD2 LEU 67 3HD2 LEU 67 -6.812 0.475 -5.388
511 H GLY 68 H GLY 68 -8.697 -5.121 -3.600
512 1HA GLY 68 2HA GLY 68 -9.075 -7.098 -4.717
513 2HA GLY 68 3HA GLY 68 -8.665 -6.353 -6.270
514 H TYR 69 H TYR 69 -6.811 -6.435 -3.159
515 HA TYR 69 HA TYR 69 -4.619 -7.949 -4.484
516 1HB TYR 69 2HB TYR 69 -4.796 -5.082 -4.087
517 2HB TYR 69 3HB TYR 69 -3.523 -5.711 -3.070
518 HD1 TYR 69 HD1 TYR 69 -4.796 -5.635 -6.579
519 HD2 TYR 69 HD2 TYR 69 -1.460 -6.530 -4.002
520 HE1 TYR 69 HE1 TYR 69 -3.327 -5.690 -8.520
521 HE2 TYR 69 HE2 TYR 69 0.040 -6.461 -5.934
522 HH TYR 69 HH TYR 69 -1.184 -6.125 -9.276
523 H HIS 70 H HIS 70 -2.718 -8.065 -2.829
524 HA HIS 70 HA HIS 70 -3.669 -8.492 -0.057
525 1HB HIS 70 2HB HIS 70 -3.973 -10.558 -1.474
526 2HB HIS 70 3HB HIS 70 -2.232 -10.581 -1.746
527 HD1 HIS 70 1HD HIS 70 -4.642 -12.277 0.251
528 HD2 HIS 70 2HD HIS 70 -0.869 -10.554 0.931
529 HE1 HIS 70 1HE HIS 70 -3.645 -13.472 2.276
530 H VAL 71 H VAL 71 -2.079 -7.833 1.372
531 HA VAL 71 HA VAL 71 0.629 -7.193 0.300
532 HB VAL 71 HB VAL 71 -0.739 -5.254 1.068
533 1HG1 VAL 71 1HG1 VAL 71 -1.084 -4.808 3.417
534 2HG1 VAL 71 2HG1 VAL 71 -1.912 -6.321 3.015
535 3HG1 VAL 71 3HG1 VAL 71 -0.361 -6.354 3.881
536 1HG2 VAL 71 1HG2 VAL 71 1.781 -5.750 2.644
537 2HG2 VAL 71 2HG2 VAL 71 1.675 -5.166 0.960
538 3HG2 VAL 71 3HG2 VAL 71 1.015 -4.183 2.265
539 H VAL 72 H VAL 72 2.396 -8.043 1.453
540 HA VAL 72 HA VAL 72 1.713 -10.112 3.501
541 HB VAL 72 HB VAL 72 3.977 -10.323 1.595
542 1HG1 VAL 72 1HG1 VAL 72 3.916 -12.699 2.258
543 2HG1 VAL 72 2HG1 VAL 72 4.104 -11.670 3.682
544 3HG1 VAL 72 3HG1 VAL 72 2.520 -12.380 3.306
545 1HG2 VAL 72 1HG2 VAL 72 1.990 -10.382 0.168
546 2HG2 VAL 72 2HG2 VAL 72 2.624 -12.022 0.371
547 3HG2 VAL 72 3HG2 VAL 72 1.198 -11.518 1.291
548 H ILE 73 H ILE 73 2.992 -10.129 5.295
549 HA ILE 73 HA ILE 73 5.095 -8.028 5.528
550 HB ILE 73 HB ILE 73 3.146 -8.980 7.634
551 1HG1 ILE 73 2HG1 ILE 73 2.824 -6.346 7.593
552 2HG1 ILE 73 3HG1 ILE 73 3.442 -6.479 5.950
553 1HG2 ILE 73 1HG2 ILE 73 5.357 -8.521 8.663
554 2HG2 ILE 73 2HG2 ILE 73 5.436 -6.984 7.774
555 3HG2 ILE 73 3HG2 ILE 73 4.197 -7.249 9.031
556 1HD1 ILE 73 1HD1 ILE 73 0.961 -6.487 6.175
557 2HD1 ILE 73 2HD1 ILE 73 1.559 -7.968 5.405
558 3HD1 ILE 73 3HD1 ILE 73 1.088 -7.988 7.127
559 H GLU 74 H GLU 74 6.494 -9.774 4.574
560 HA GLU 74 HA GLU 74 7.283 -11.875 6.269
561 1HB GLU 74 2HB GLU 74 8.309 -10.655 3.706
562 2HB GLU 74 3HB GLU 74 9.237 -11.855 4.591
563 1HG GLU 74 2HG GLU 74 7.413 -13.482 4.446
564 2HG GLU 74 3HG GLU 74 6.396 -12.305 3.594
565 H GLY 75 H GLY 75 7.533 -8.755 6.720
566 1HA GLY 75 2HA GLY 75 10.307 -8.331 7.498
567 2HA GLY 75 3HA GLY 75 8.909 -7.270 7.797
568 H ARG 76 H ARG 76 7.702 -9.964 8.954
569 HA ARG 76 HA ARG 76 8.957 -9.969 11.586
570 1HB ARG 76 2HB ARG 76 7.135 -8.291 11.737
571 2HB ARG 76 3HB ARG 76 5.975 -9.475 11.098
572 1HG ARG 76 2HG ARG 76 6.084 -10.830 13.024
573 2HG ARG 76 3HG ARG 76 7.634 -10.141 13.539
574 1HD ARG 76 2HD ARG 76 6.549 -7.989 14.007
575 2HD ARG 76 3HD ARG 76 4.961 -8.681 13.572
576 HE ARG 76 HE ARG 76 5.951 -10.441 15.433
577 1HH1 ARG 76 2HH2 ARG 76 5.347 -6.977 15.448
578 2HH1 ARG 76 1HH2 ARG 76 5.186 -6.828 17.171
579 1HH2 ARG 76 2HH1 ARG 76 5.721 -10.313 17.729
580 2HH2 ARG 76 1HH1 ARG 76 5.377 -8.799 18.501
Start of MODEL 17
1 1H MET 1 H1 MET 1 3.797 21.032 14.464
2 2H MET 1 H2 MET 1 5.090 21.012 13.409
3 3H MET 1 H3 MET 1 3.557 21.336 12.870
4 HA MET 1 HA MET 1 4.042 19.113 12.289
5 1HB MET 1 2HB MET 1 4.494 18.705 15.285
6 2HB MET 1 3HB MET 1 4.479 17.454 14.038
7 1HG MET 1 2HG MET 1 6.460 18.687 12.962
8 2HG MET 1 3HG MET 1 6.543 19.632 14.465
9 1HE MET 1 1HE MET 1 9.616 17.324 14.927
10 2HE MET 1 2HE MET 1 9.071 18.246 13.507
11 3HE MET 1 3HE MET 1 8.988 18.973 15.134
12 H LEU 2 H LEU 2 2.087 18.032 11.964
13 HA LEU 2 HA LEU 2 0.216 17.625 14.123
14 1HB LEU 2 2HB LEU 2 -0.628 19.799 13.068
15 2HB LEU 2 3HB LEU 2 -0.658 18.961 11.515
16 HG LEU 2 HG LEU 2 -2.172 17.193 12.876
17 1HD1 LEU 2 1HD1 LEU 2 -3.595 18.299 14.528
18 2HD1 LEU 2 2HD1 LEU 2 -1.905 18.386 15.055
19 3HD1 LEU 2 3HD1 LEU 2 -2.689 19.815 14.345
20 1HD2 LEU 2 1HD2 LEU 2 -4.169 18.380 12.104
21 2HD2 LEU 2 2HD2 LEU 2 -3.207 19.852 11.831
22 3HD2 LEU 2 3HD2 LEU 2 -2.894 18.382 10.878
23 H SER 3 H SER 3 -0.153 15.435 13.814
24 HA SER 3 HA SER 3 -0.064 13.371 12.900
25 1HB SER 3 2HB SER 3 -0.292 14.607 10.123
26 2HB SER 3 3HB SER 3 -0.676 12.979 10.612
27 HG SER 3 HG SER 3 -2.414 13.723 11.795
28 H GLU 4 H GLU 4 1.966 12.545 13.342
29 HA GLU 4 HA GLU 4 4.334 13.351 11.830
30 1HB GLU 4 2HB GLU 4 3.684 11.352 13.918
31 2HB GLU 4 3HB GLU 4 4.936 10.916 12.777
32 1HG GLU 4 2HG GLU 4 6.051 13.040 13.267
33 2HG GLU 4 3HG GLU 4 4.853 13.317 14.536
34 H GLN 5 H GLN 5 5.353 11.482 10.501
35 HA GLN 5 HA GLN 5 3.334 9.864 9.071
36 1HB GLN 5 2HB GLN 5 5.464 11.615 7.805
37 2HB GLN 5 3HB GLN 5 4.662 10.284 6.997
38 1HG GLN 5 2HG GLN 5 2.591 11.955 8.121
39 2HG GLN 5 3HG GLN 5 3.747 13.016 7.313
40 1HE2 GLN 5 1HE2 GLN 5 2.491 9.713 6.754
41 2HE2 GLN 5 2HE2 GLN 5 2.025 9.948 5.080
42 H LYS 6 H LYS 6 4.189 7.888 8.298
43 HA LYS 6 HA LYS 6 7.060 7.443 8.581
44 1HB LYS 6 2HB LYS 6 5.056 5.650 10.018
45 2HB LYS 6 3HB LYS 6 6.746 5.259 9.697
46 1HG LYS 6 2HG LYS 6 7.365 7.436 10.932
47 2HG LYS 6 3HG LYS 6 5.685 7.509 11.447
48 1HD LYS 6 2HD LYS 6 6.875 6.511 13.220
49 2HD LYS 6 3HD LYS 6 5.981 5.183 12.450
50 1HE LYS 6 2HE LYS 6 8.041 4.455 11.259
51 2HE LYS 6 3HE LYS 6 8.905 5.891 11.825
52 1HZ LYS 6 1HZ LYS 6 8.701 5.054 14.057
53 2HZ LYS 6 2HZ LYS 6 7.900 3.712 13.525
54 3HZ LYS 6 3HZ LYS 6 9.466 3.970 13.085
55 H GLU 7 H GLU 7 7.802 5.713 7.509
56 HA GLU 7 HA GLU 7 6.320 4.941 5.100
57 1HB GLU 7 2HB GLU 7 9.242 4.340 5.561
58 2HB GLU 7 3HB GLU 7 8.384 4.794 4.097
59 1HG GLU 7 2HG GLU 7 9.625 6.676 4.489
60 2HG GLU 7 3HG GLU 7 8.178 7.164 5.368
61 H ILE 8 H ILE 8 5.271 2.961 5.316
62 HA ILE 8 HA ILE 8 6.619 0.789 6.904
63 HB ILE 8 HB ILE 8 4.760 -0.589 6.478
64 1HG1 ILE 8 2HG1 ILE 8 2.638 0.434 5.570
65 2HG1 ILE 8 3HG1 ILE 8 3.667 1.694 4.857
66 1HG2 ILE 8 1HG2 ILE 8 3.167 0.479 7.796
67 2HG2 ILE 8 2HG2 ILE 8 4.774 0.926 8.405
68 3HG2 ILE 8 3HG2 ILE 8 3.832 2.097 7.438
69 1HD1 ILE 8 1HD1 ILE 8 3.015 -0.483 3.499
70 2HD1 ILE 8 2HD1 ILE 8 4.700 0.090 3.430
71 3HD1 ILE 8 3HD1 ILE 8 4.261 -1.237 4.518
72 H ALA 9 H ALA 9 7.051 -1.275 5.817
73 HA ALA 9 HA ALA 9 7.646 -1.127 2.935
74 1HB ALA 9 1HB ALA 9 9.910 -1.973 3.273
75 2HB ALA 9 2HB ALA 9 9.752 -0.418 4.120
76 3HB ALA 9 3HB ALA 9 9.712 -1.931 5.037
77 H MET 10 H MET 10 6.495 -2.908 2.219
78 HA MET 10 HA MET 10 6.494 -5.392 3.878
79 1HB MET 10 2HB MET 10 4.043 -3.820 2.972
80 2HB MET 10 3HB MET 10 4.000 -5.504 3.522
81 1HG MET 10 2HG MET 10 4.793 -4.955 5.691
82 2HG MET 10 3HG MET 10 5.069 -3.265 5.258
83 1HE MET 10 1HE MET 10 2.162 -3.253 7.837
84 2HE MET 10 2HE MET 10 3.620 -4.262 7.780
85 3HE MET 10 3HE MET 10 3.744 -2.515 7.466
86 H GLN 11 H GLN 11 5.235 -7.148 2.624
87 HA GLN 11 HA GLN 11 6.456 -7.188 -0.095
88 1HB GLN 11 2HB GLN 11 5.683 -9.280 1.991
89 2HB GLN 11 3HB GLN 11 5.984 -9.739 0.309
90 1HG GLN 11 2HG GLN 11 7.924 -8.379 2.249
91 2HG GLN 11 3HG GLN 11 7.996 -10.048 1.662
92 1HE2 GLN 11 1HE2 GLN 11 7.711 -10.068 -0.947
93 2HE2 GLN 11 2HE2 GLN 11 8.574 -8.783 -1.783
94 H VAL 12 H VAL 12 5.237 -8.370 -1.795
95 HA VAL 12 HA VAL 12 2.329 -7.637 -1.659
96 HB VAL 12 HB VAL 12 4.261 -7.521 -4.026
97 1HG1 VAL 12 1HG1 VAL 12 1.377 -6.582 -3.715
98 2HG1 VAL 12 2HG1 VAL 12 2.421 -6.269 -5.119
99 3HG1 VAL 12 3HG1 VAL 12 1.937 -7.923 -4.741
100 1HG2 VAL 12 1HG2 VAL 12 3.113 -5.263 -2.339
101 2HG2 VAL 12 2HG2 VAL 12 4.831 -5.725 -2.442
102 3HG2 VAL 12 3HG2 VAL 12 4.015 -5.055 -3.854
103 H SER 13 H SER 13 0.892 -9.164 -2.601
104 HA SER 13 HA SER 13 2.012 -11.491 -4.043
105 1HB SER 13 2HB SER 13 0.062 -11.608 -1.701
106 2HB SER 13 3HB SER 13 0.385 -12.959 -2.803
107 HG SER 13 HG SER 13 1.681 -13.046 -0.901
108 H GLY 14 H GLY 14 0.296 -12.573 -5.274
109 1HA GLY 14 2HA GLY 14 -1.469 -12.598 -6.738
110 2HA GLY 14 3HA GLY 14 -2.368 -11.772 -5.455
111 H MET 15 H MET 15 0.125 -11.056 -7.951
112 HA MET 15 HA MET 15 -1.206 -8.445 -8.514
113 1HB MET 15 2HB MET 15 1.115 -7.684 -9.138
114 2HB MET 15 3HB MET 15 0.837 -7.917 -7.406
115 1HG MET 15 2HG MET 15 2.077 -9.870 -7.288
116 2HG MET 15 3HG MET 15 2.108 -10.118 -9.041
117 1HE MET 15 1HE MET 15 3.030 -7.329 -10.259
118 2HE MET 15 2HE MET 15 4.779 -7.627 -10.272
119 3HE MET 15 3HE MET 15 3.655 -8.938 -10.699
120 H THR 16 H THR 16 -1.380 -7.799 -10.640
121 HA THR 16 HA THR 16 -0.886 -9.747 -12.790
122 HB THR 16 HB THR 16 -1.730 -7.492 -14.016
123 HG1 THR 16 1HG THR 16 -3.282 -7.153 -11.789
124 1HG2 THR 16 1HG2 THR 16 -2.932 -9.607 -14.095
125 2HG2 THR 16 2HG2 THR 16 -3.510 -9.401 -12.428
126 3HG2 THR 16 3HG2 THR 16 -4.064 -8.300 -13.717
127 H CYS 17 H CYS 17 -0.086 -6.229 -12.294
128 HA CYS 17 HA CYS 17 2.729 -6.796 -12.744
129 1HB CYS 17 2HB CYS 17 3.014 -5.561 -14.776
130 2HB CYS 17 3HB CYS 17 1.747 -6.751 -15.081
131 H ALA 18 H ALA 18 3.982 -4.751 -12.830
132 HA ALA 18 HA ALA 18 3.639 -3.261 -10.508
133 1HB ALA 18 1HB ALA 18 5.190 -2.555 -13.030
134 2HB ALA 18 2HB ALA 18 5.403 -1.790 -11.444
135 3HB ALA 18 3HB ALA 18 5.784 -3.512 -11.654
136 H ALA 19 H ALA 19 2.497 -2.532 -13.813
137 HA ALA 19 HA ALA 19 1.853 0.207 -13.314
138 1HB ALA 19 1HB ALA 19 0.499 0.074 -15.331
139 2HB ALA 19 2HB ALA 19 2.049 -0.750 -15.580
140 3HB ALA 19 3HB ALA 19 0.567 -1.696 -15.313
141 H CYS 20 H CYS 20 -0.099 -2.829 -12.977
142 HA CYS 20 HA CYS 20 -2.423 -1.402 -12.009
143 1HB CYS 20 2HB CYS 20 -1.611 -4.335 -11.659
144 2HB CYS 20 3HB CYS 20 -3.213 -3.642 -11.356
145 H ALA 21 H ALA 21 0.323 -3.106 -10.466
146 HA ALA 21 HA ALA 21 -0.444 -2.653 -7.810
147 1HB ALA 21 1HB ALA 21 1.783 -3.187 -7.207
148 2HB ALA 21 2HB ALA 21 1.441 -4.126 -8.670
149 3HB ALA 21 3HB ALA 21 2.402 -2.643 -8.782
150 H ALA 22 H ALA 22 0.666 -0.246 -10.119
151 HA ALA 22 HA ALA 22 1.361 1.750 -8.135
152 1HB ALA 22 1HB ALA 22 2.064 1.865 -10.530
153 2HB ALA 22 2HB ALA 22 0.364 2.134 -10.981
154 3HB ALA 22 3HB ALA 22 1.204 3.318 -9.968
155 H ARG 23 H ARG 23 -1.600 0.782 -9.936
156 HA ARG 23 HA ARG 23 -3.215 3.007 -9.113
157 1HB ARG 23 2HB ARG 23 -3.767 0.306 -10.341
158 2HB ARG 23 3HB ARG 23 -5.046 1.022 -9.396
159 1HG ARG 23 2HG ARG 23 -5.714 2.084 -11.159
160 2HG ARG 23 3HG ARG 23 -4.366 3.194 -10.977
161 1HD ARG 23 2HD ARG 23 -4.256 0.583 -12.566
162 2HD ARG 23 3HD ARG 23 -4.736 2.145 -13.260
163 HE ARG 23 HE ARG 23 -2.235 2.485 -11.962
164 1HH1 ARG 23 2HH2 ARG 23 -3.485 0.580 -14.620
165 2HH1 ARG 23 1HH2 ARG 23 -2.182 0.899 -15.719
166 1HH2 ARG 23 2HH1 ARG 23 -0.466 2.993 -13.395
167 2HH2 ARG 23 1HH1 ARG 23 -0.424 2.343 -15.003
168 H ILE 24 H ILE 24 -2.690 -0.252 -7.659
169 HA ILE 24 HA ILE 24 -4.592 0.141 -5.624
170 HB ILE 24 HB ILE 24 -3.686 -1.634 -4.374
171 1HG1 ILE 24 2HG1 ILE 24 -1.276 -1.086 -6.007
172 2HG1 ILE 24 3HG1 ILE 24 -1.404 -1.139 -4.237
173 1HG2 ILE 24 1HG2 ILE 24 -3.242 -2.309 -7.306
174 2HG2 ILE 24 2HG2 ILE 24 -3.883 -3.320 -5.995
175 3HG2 ILE 24 3HG2 ILE 24 -4.851 -1.992 -6.622
176 1HD1 ILE 24 1HD1 ILE 24 -0.090 -3.030 -5.182
177 2HD1 ILE 24 2HD1 ILE 24 -1.536 -3.558 -4.283
178 3HD1 ILE 24 3HD1 ILE 24 -1.522 -3.545 -6.069
179 H GLU 25 H GLU 25 -1.023 0.773 -5.215
180 HA GLU 25 HA GLU 25 -1.221 2.103 -2.788
181 1HB GLU 25 2HB GLU 25 0.710 2.064 -5.062
182 2HB GLU 25 3HB GLU 25 0.810 3.485 -4.002
183 1HG GLU 25 2HG GLU 25 2.297 1.619 -3.267
184 2HG GLU 25 3HG GLU 25 1.132 2.102 -2.041
185 H LYS 26 H LYS 26 -1.753 3.542 -6.036
186 HA LYS 26 HA LYS 26 -1.964 6.220 -4.865
187 1HB LYS 26 2HB LYS 26 -2.988 5.252 -7.550
188 2HB LYS 26 3HB LYS 26 -2.781 6.940 -7.058
189 1HG LYS 26 2HG LYS 26 -0.546 4.890 -7.310
190 2HG LYS 26 3HG LYS 26 -0.945 6.090 -8.517
191 1HD LYS 26 2HD LYS 26 -0.193 7.864 -7.175
192 2HD LYS 26 3HD LYS 26 -0.138 6.929 -5.683
193 1HE LYS 26 2HE LYS 26 1.605 6.223 -8.072
194 2HE LYS 26 3HE LYS 26 2.124 7.350 -6.810
195 1HZ LYS 26 1HZ LYS 26 2.023 5.665 -5.195
196 2HZ LYS 26 2HZ LYS 26 1.280 4.592 -6.210
197 3HZ LYS 26 3HZ LYS 26 2.838 5.049 -6.463
198 H GLY 27 H GLY 27 -4.381 3.776 -5.739
199 1HA GLY 27 2HA GLY 27 -6.687 5.272 -4.858
200 2HA GLY 27 3HA GLY 27 -6.563 3.516 -5.013
201 H LEU 28 H LEU 28 -4.183 3.356 -3.210
202 HA LEU 28 HA LEU 28 -5.525 3.180 -0.708
203 1HB LEU 28 2HB LEU 28 -3.265 2.070 -1.702
204 2HB LEU 28 3HB LEU 28 -2.526 3.350 -0.734
205 HG LEU 28 HG LEU 28 -4.410 1.123 0.143
206 1HD1 LEU 28 1HD1 LEU 28 -2.052 0.497 -0.293
207 2HD1 LEU 28 2HD1 LEU 28 -1.521 1.707 0.894
208 3HD1 LEU 28 3HD1 LEU 28 -2.506 0.312 1.403
209 1HD2 LEU 28 1HD2 LEU 28 -3.940 2.064 2.484
210 2HD2 LEU 28 2HD2 LEU 28 -3.312 3.506 1.649
211 3HD2 LEU 28 3HD2 LEU 28 -5.011 3.037 1.483
212 H LYS 29 H LYS 29 -3.138 5.542 -2.019
213 HA LYS 29 HA LYS 29 -3.072 7.356 0.123
214 1HB LYS 29 2HB LYS 29 -1.674 7.504 -1.962
215 2HB LYS 29 3HB LYS 29 -3.102 8.120 -2.811
216 1HG LYS 29 2HG LYS 29 -3.145 9.914 -0.818
217 2HG LYS 29 3HG LYS 29 -1.498 9.412 -0.601
218 1HD LYS 29 2HD LYS 29 -2.557 10.303 -3.346
219 2HD LYS 29 3HD LYS 29 -2.112 11.482 -2.086
220 1HE LYS 29 2HE LYS 29 0.042 10.590 -1.848
221 2HE LYS 29 3HE LYS 29 -0.194 9.291 -3.042
222 1HZ LYS 29 1HZ LYS 29 -0.137 11.152 -4.642
223 2HZ LYS 29 2HZ LYS 29 0.048 12.221 -3.372
224 3HZ LYS 29 3HZ LYS 29 1.178 11.054 -3.615
225 H ARG 30 H ARG 30 -5.617 6.987 -2.366
226 HA ARG 30 HA ARG 30 -7.060 9.351 -1.662
227 1HB ARG 30 2HB ARG 30 -7.770 6.774 -3.040
228 2HB ARG 30 3HB ARG 30 -9.061 7.857 -2.586
229 1HG ARG 30 2HG ARG 30 -6.706 9.083 -4.007
230 2HG ARG 30 3HG ARG 30 -7.750 8.002 -4.944
231 1HD ARG 30 2HD ARG 30 -9.736 9.253 -4.339
232 2HD ARG 30 3HD ARG 30 -8.785 10.362 -3.316
233 HE ARG 30 HE ARG 30 -7.597 10.513 -5.816
234 1HH1 ARG 30 2HH2 ARG 30 -10.830 11.086 -4.534
235 2HH1 ARG 30 1HH2 ARG 30 -11.283 12.266 -5.723
236 1HH2 ARG 30 2HH1 ARG 30 -8.140 12.126 -7.402
237 2HH2 ARG 30 1HH1 ARG 30 -9.698 12.883 -7.377
238 H MET 31 H MET 31 -6.540 6.639 0.404
239 HA MET 31 HA MET 31 -9.118 6.898 1.731
240 1HB MET 31 2HB MET 31 -8.639 4.982 2.715
241 2HB MET 31 3HB MET 31 -7.419 4.823 1.451
242 1HG MET 31 2HG MET 31 -5.692 5.565 2.977
243 2HG MET 31 3HG MET 31 -6.875 5.762 4.276
244 1HE MET 31 1HE MET 31 -8.029 2.137 5.064
245 2HE MET 31 2HE MET 31 -8.192 3.860 5.500
246 3HE MET 31 3HE MET 31 -8.820 3.244 3.955
247 HA PRO 32 HA PRO 32 -7.830 9.911 4.802
248 1HB PRO 32 2HB PRO 32 -9.163 9.079 7.046
249 2HB PRO 32 3HB PRO 32 -9.979 9.846 5.655
250 1HG PRO 32 2HG PRO 32 -9.700 6.887 6.244
251 2HG PRO 32 3HG PRO 32 -11.184 7.795 5.835
252 1HD PRO 32 2HD PRO 32 -9.800 6.422 3.962
253 2HD PRO 32 3HD PRO 32 -10.526 8.003 3.553
254 H GLY 33 H GLY 33 -5.861 9.899 5.653
255 1HA GLY 33 2HA GLY 33 -4.462 9.362 7.444
256 2HA GLY 33 3HA GLY 33 -4.939 7.665 7.395
257 H VAL 34 H VAL 34 -4.502 7.745 4.241
258 HA VAL 34 HA VAL 34 -1.529 7.489 4.441
259 HB VAL 34 HB VAL 34 -3.427 6.499 2.311
260 1HG1 VAL 34 1HG1 VAL 34 -1.423 5.287 1.512
261 2HG1 VAL 34 2HG1 VAL 34 -1.153 7.029 1.427
262 3HG1 VAL 34 3HG1 VAL 34 -0.428 6.099 2.746
263 1HG2 VAL 34 1HG2 VAL 34 -3.804 5.133 4.202
264 2HG2 VAL 34 2HG2 VAL 34 -2.457 4.289 3.417
265 3HG2 VAL 34 3HG2 VAL 34 -2.163 5.326 4.804
266 H THR 35 H THR 35 -0.313 9.159 3.887
267 HA THR 35 HA THR 35 -1.494 11.301 2.251
268 HB THR 35 HB THR 35 0.825 11.188 4.072
269 HG1 THR 35 1HG THR 35 -0.774 11.652 5.361
270 1HG2 THR 35 1HG2 THR 35 0.898 13.688 3.742
271 2HG2 THR 35 2HG2 THR 35 1.504 12.753 2.365
272 3HG2 THR 35 3HG2 THR 35 -0.127 13.471 2.305
273 H ASP 36 H ASP 36 1.307 8.972 2.023
274 HA ASP 36 HA ASP 36 0.929 9.167 -0.781
275 1HB ASP 36 2HB ASP 36 3.224 10.643 0.267
276 2HB ASP 36 3HB ASP 36 3.786 9.262 -0.671
277 H ALA 37 H ALA 37 2.244 7.615 -1.993
278 HA ALA 37 HA ALA 37 2.906 5.241 -0.475
279 1HB ALA 37 1HB ALA 37 0.390 4.997 -2.155
280 2HB ALA 37 2HB ALA 37 1.027 3.885 -0.914
281 3HB ALA 37 3HB ALA 37 0.306 5.412 -0.436
282 H ASN 38 H ASN 38 4.088 3.707 -1.684
283 HA ASN 38 HA ASN 38 4.647 4.377 -4.522
284 1HB ASN 38 2HB ASN 38 7.189 4.280 -3.342
285 2HB ASN 38 3HB ASN 38 6.373 5.686 -3.995
286 1HD2 ASN 38 1HD2 ASN 38 6.000 3.846 -0.912
287 2HD2 ASN 38 2HD2 ASN 38 6.281 5.256 0.107
288 H VAL 39 H VAL 39 4.510 2.381 -5.349
289 HA VAL 39 HA VAL 39 5.268 0.045 -3.777
290 HB VAL 39 HB VAL 39 3.125 0.267 -5.006
291 1HG1 VAL 39 1HG1 VAL 39 3.655 1.459 -6.968
292 2HG1 VAL 39 2HG1 VAL 39 4.809 0.247 -7.526
293 3HG1 VAL 39 3HG1 VAL 39 3.097 -0.139 -7.449
294 1HG2 VAL 39 1HG2 VAL 39 4.989 -2.030 -5.355
295 2HG2 VAL 39 2HG2 VAL 39 3.542 -1.843 -4.366
296 3HG2 VAL 39 3HG2 VAL 39 3.367 -2.055 -6.103
297 H ASN 40 H ASN 40 7.215 -1.096 -4.135
298 HA ASN 40 HA ASN 40 8.996 -0.146 -6.340
299 1HB ASN 40 2HB ASN 40 9.689 0.676 -4.128
300 2HB ASN 40 3HB ASN 40 9.776 -0.986 -3.524
301 1HD2 ASN 40 1HD2 ASN 40 12.036 0.561 -3.362
302 2HD2 ASN 40 2HD2 ASN 40 13.207 0.029 -4.559
303 H LEU 41 H LEU 41 7.751 -1.821 -7.471
304 HA LEU 41 HA LEU 41 7.993 -4.598 -6.748
305 1HB LEU 41 2HB LEU 41 7.410 -3.440 -9.507
306 2HB LEU 41 3HB LEU 41 7.190 -5.092 -8.963
307 HG LEU 41 HG LEU 41 5.044 -4.145 -8.971
308 1HD1 LEU 41 1HD1 LEU 41 5.505 -5.467 -6.960
309 2HD1 LEU 41 2HD1 LEU 41 5.898 -3.986 -6.067
310 3HD1 LEU 41 3HD1 LEU 41 4.261 -4.232 -6.707
311 1HD2 LEU 41 1HD2 LEU 41 5.877 -1.755 -7.335
312 2HD2 LEU 41 2HD2 LEU 41 5.905 -1.754 -9.104
313 3HD2 LEU 41 3HD2 LEU 41 4.396 -2.031 -8.239
314 H ALA 42 H ALA 42 10.068 -2.340 -8.426
315 HA ALA 42 HA ALA 42 11.820 -4.086 -9.758
316 1HB ALA 42 1HB ALA 42 12.539 -1.575 -8.199
317 2HB ALA 42 2HB ALA 42 13.543 -2.385 -9.405
318 3HB ALA 42 3HB ALA 42 12.008 -1.634 -9.898
319 H THR 43 H THR 43 11.520 -3.418 -6.239
320 HA THR 43 HA THR 43 13.489 -5.621 -5.820
321 HB THR 43 HB THR 43 14.177 -3.373 -5.125
322 HG1 THR 43 1HG THR 43 15.054 -4.284 -3.143
323 1HG2 THR 43 1HG2 THR 43 13.453 -2.434 -3.049
324 2HG2 THR 43 2HG2 THR 43 11.943 -2.846 -3.891
325 3HG2 THR 43 3HG2 THR 43 12.557 -3.896 -2.604
326 H GLU 44 H GLU 44 10.516 -5.704 -6.355
327 HA GLU 44 HA GLU 44 8.564 -6.498 -5.542
328 1HB GLU 44 2HB GLU 44 10.755 -8.413 -4.834
329 2HB GLU 44 3HB GLU 44 9.133 -8.816 -4.283
330 1HG GLU 44 2HG GLU 44 9.577 -8.093 -7.185
331 2HG GLU 44 3HG GLU 44 9.827 -9.733 -6.564
332 H THR 45 H THR 45 9.174 -4.356 -3.903
333 HA THR 45 HA THR 45 7.886 -5.242 -1.368
334 HB THR 45 HB THR 45 10.348 -3.493 -1.768
335 HG1 THR 45 1HG THR 45 9.896 -6.055 -0.636
336 1HG2 THR 45 1HG2 THR 45 10.415 -3.258 0.662
337 2HG2 THR 45 2HG2 THR 45 8.984 -2.485 -0.048
338 3HG2 THR 45 3HG2 THR 45 8.833 -4.057 0.789
339 H VAL 46 H VAL 46 6.457 -3.683 -0.519
340 HA VAL 46 HA VAL 46 5.894 -1.317 -2.250
341 HB VAL 46 HB VAL 46 4.083 -2.853 -2.399
342 1HG1 VAL 46 1HG1 VAL 46 3.992 -2.883 0.654
343 2HG1 VAL 46 2HG1 VAL 46 2.741 -3.533 -0.414
344 3HG1 VAL 46 3HG1 VAL 46 4.345 -4.260 -0.418
345 1HG2 VAL 46 1HG2 VAL 46 2.241 -1.544 -1.592
346 2HG2 VAL 46 2HG2 VAL 46 3.270 -0.649 -0.466
347 3HG2 VAL 46 3HG2 VAL 46 3.498 -0.460 -2.221
348 H ASN 47 H ASN 47 5.615 0.746 -1.214
349 HA ASN 47 HA ASN 47 6.178 0.761 1.692
350 1HB ASN 47 2HB ASN 47 7.422 2.451 -0.525
351 2HB ASN 47 3HB ASN 47 7.447 2.916 1.181
352 1HD2 ASN 47 1HD2 ASN 47 8.433 1.261 2.711
353 2HD2 ASN 47 2HD2 ASN 47 9.899 0.492 2.106
354 H VAL 48 H VAL 48 4.915 2.325 2.813
355 HA VAL 48 HA VAL 48 2.993 3.883 1.194
356 HB VAL 48 HB VAL 48 2.165 2.057 3.474
357 1HG1 VAL 48 1HG1 VAL 48 0.499 3.830 1.695
358 2HG1 VAL 48 2HG1 VAL 48 -0.043 2.806 3.048
359 3HG1 VAL 48 3HG1 VAL 48 0.979 4.214 3.367
360 1HG2 VAL 48 1HG2 VAL 48 1.558 1.855 0.504
361 2HG2 VAL 48 2HG2 VAL 48 2.544 0.720 1.446
362 3HG2 VAL 48 3HG2 VAL 48 0.821 0.881 1.790
363 H ILE 49 H ILE 49 3.001 5.922 1.937
364 HA ILE 49 HA ILE 49 4.634 6.503 4.319
365 HB ILE 49 HB ILE 49 3.896 8.396 2.049
366 1HG1 ILE 49 2HG1 ILE 49 5.104 6.683 0.956
367 2HG1 ILE 49 3HG1 ILE 49 6.144 8.087 1.150
368 1HG2 ILE 49 1HG2 ILE 49 5.985 8.528 4.255
369 2HG2 ILE 49 2HG2 ILE 49 5.831 9.681 2.912
370 3HG2 ILE 49 3HG2 ILE 49 4.530 9.521 4.095
371 1HD1 ILE 49 1HD1 ILE 49 6.271 5.511 2.777
372 2HD1 ILE 49 2HD1 ILE 49 7.457 6.110 1.607
373 3HD1 ILE 49 3HD1 ILE 49 7.228 6.968 3.133
374 H TYR 50 H TYR 50 3.042 6.419 5.939
375 HA TYR 50 HA TYR 50 0.479 7.924 5.443
376 1HB TYR 50 2HB TYR 50 -0.771 6.264 6.447
377 2HB TYR 50 3HB TYR 50 0.099 5.582 5.118
378 HD1 TYR 50 HD1 TYR 50 0.892 3.384 5.463
379 HD2 TYR 50 HD2 TYR 50 0.305 5.931 8.883
380 HE1 TYR 50 HE1 TYR 50 1.090 1.453 6.983
381 HE2 TYR 50 HE2 TYR 50 0.901 4.091 10.374
382 HH TYR 50 HH TYR 50 1.648 1.848 10.437
383 H ASP 51 H ASP 51 -0.697 8.294 7.436
384 HA ASP 51 HA ASP 51 1.199 9.474 9.378
385 1HB ASP 51 2HB ASP 51 -1.741 10.003 8.972
386 2HB ASP 51 3HB ASP 51 -0.597 10.840 10.048
387 HA PRO 52 HA PRO 52 -0.071 5.868 11.821
388 1HB PRO 52 2HB PRO 52 1.754 5.920 13.833
389 2HB PRO 52 3HB PRO 52 2.166 5.457 12.159
390 1HG PRO 52 2HG PRO 52 2.437 8.206 13.411
391 2HG PRO 52 3HG PRO 52 3.710 7.261 12.589
392 1HD PRO 52 2HD PRO 52 2.291 9.118 11.286
393 2HD PRO 52 3HD PRO 52 2.658 7.581 10.450
394 H ALA 53 H ALA 53 -0.868 9.005 12.406
395 HA ALA 53 HA ALA 53 -1.880 8.675 15.158
396 1HB ALA 53 1HB ALA 53 -2.149 10.898 13.086
397 2HB ALA 53 2HB ALA 53 -2.767 10.939 14.751
398 3HB ALA 53 3HB ALA 53 -1.016 10.884 14.459
399 H GLU 54 H GLU 54 -2.638 8.103 11.786
400 HA GLU 54 HA GLU 54 -5.511 7.899 12.405
401 1HB GLU 54 2HB GLU 54 -4.678 9.896 11.044
402 2HB GLU 54 3HB GLU 54 -4.373 8.763 9.726
403 1HG GLU 54 2HG GLU 54 -6.783 8.161 9.707
404 2HG GLU 54 3HG GLU 54 -7.053 9.158 11.150
405 H THR 55 H THR 55 -2.968 6.779 10.115
406 HA THR 55 HA THR 55 -4.185 4.094 10.104
407 HB THR 55 HB THR 55 -2.189 3.794 8.259
408 HG1 THR 55 1HG THR 55 -3.119 6.421 7.999
409 1HG2 THR 55 1HG2 THR 55 -5.032 4.870 7.955
410 2HG2 THR 55 2HG2 THR 55 -4.005 4.301 6.608
411 3HG2 THR 55 3HG2 THR 55 -4.417 3.184 7.930
412 H GLY 56 H GLY 56 -1.975 2.572 9.766
413 1HA GLY 56 2HA GLY 56 -0.227 2.052 11.719
414 2HA GLY 56 3HA GLY 56 -1.710 2.300 12.658
415 H THR 57 H THR 57 -0.379 0.659 10.110
416 HA THR 57 HA THR 57 -0.987 -0.293 8.310
417 HB THR 57 HB THR 57 -0.337 -2.671 8.533
418 HG1 THR 57 1HG THR 57 -0.602 -2.160 11.316
419 1HG2 THR 57 1HG2 THR 57 1.234 -0.884 10.480
420 2HG2 THR 57 2HG2 THR 57 1.778 -2.404 9.811
421 3HG2 THR 57 3HG2 THR 57 1.504 -1.018 8.728
422 H ALA 58 H ALA 58 -3.154 -1.250 10.844
423 HA ALA 58 HA ALA 58 -5.117 -2.804 9.981
424 1HB ALA 58 1HB ALA 58 -6.614 -1.157 11.145
425 2HB ALA 58 2HB ALA 58 -5.072 -1.391 12.014
426 3HB ALA 58 3HB ALA 58 -5.304 0.048 11.020
427 H ALA 59 H ALA 59 -4.834 0.568 8.809
428 HA ALA 59 HA ALA 59 -7.368 0.085 7.365
429 1HB ALA 59 1HB ALA 59 -6.427 2.374 8.504
430 2HB ALA 59 2HB ALA 59 -6.131 2.648 6.756
431 3HB ALA 59 3HB ALA 59 -7.742 2.242 7.349
432 H ILE 60 H ILE 60 -3.946 0.197 6.740
433 HA ILE 60 HA ILE 60 -4.017 0.282 3.899
434 HB ILE 60 HB ILE 60 -2.007 -0.384 6.042
435 1HG1 ILE 60 2HG1 ILE 60 -0.655 1.080 4.516
436 2HG1 ILE 60 3HG1 ILE 60 -2.091 1.209 3.479
437 1HG2 ILE 60 1HG2 ILE 60 -0.334 -1.156 4.503
438 2HG2 ILE 60 2HG2 ILE 60 -1.634 -2.330 4.609
439 3HG2 ILE 60 3HG2 ILE 60 -1.527 -1.267 3.183
440 1HD1 ILE 60 1HD1 ILE 60 -3.273 2.407 5.264
441 2HD1 ILE 60 2HD1 ILE 60 -2.041 1.940 6.465
442 3HD1 ILE 60 3HD1 ILE 60 -1.640 3.103 5.202
443 H GLN 61 H GLN 61 -3.914 -2.533 6.180
444 HA GLN 61 HA GLN 61 -3.992 -4.422 4.041
445 1HB GLN 61 2HB GLN 61 -4.259 -4.513 6.931
446 2HB GLN 61 3HB GLN 61 -5.474 -5.530 6.142
447 1HG GLN 61 2HG GLN 61 -3.864 -7.074 6.344
448 2HG GLN 61 3HG GLN 61 -3.446 -6.474 4.743
449 1HE2 GLN 61 1HE2 GLN 61 -2.152 -4.016 5.544
450 2HE2 GLN 61 2HE2 GLN 61 -0.683 -4.464 6.404
451 H GLU 62 H GLU 62 -6.652 -2.877 5.889
452 HA GLU 62 HA GLU 62 -8.813 -4.114 4.622
453 1HB GLU 62 2HB GLU 62 -8.356 -1.759 6.298
454 2HB GLU 62 3HB GLU 62 -9.519 -1.349 5.039
455 1HG GLU 62 2HG GLU 62 -9.805 -3.835 6.773
456 2HG GLU 62 3HG GLU 62 -10.494 -2.262 7.188
457 H LYS 63 H LYS 63 -7.145 -1.075 3.583
458 HA LYS 63 HA LYS 63 -8.762 -0.869 1.254
459 1HB LYS 63 2HB LYS 63 -6.496 0.591 2.452
460 2HB LYS 63 3HB LYS 63 -6.446 0.530 0.710
461 1HG LYS 63 2HG LYS 63 -8.849 1.403 2.340
462 2HG LYS 63 3HG LYS 63 -7.678 2.495 1.580
463 1HD LYS 63 2HD LYS 63 -8.778 2.460 -0.378
464 2HD LYS 63 3HD LYS 63 -8.529 0.730 -0.490
465 1HE LYS 63 2HE LYS 63 -10.875 1.052 -0.679
466 2HE LYS 63 3HE LYS 63 -10.611 0.371 0.929
467 1HZ LYS 63 1HZ LYS 63 -12.145 2.164 1.016
468 2HZ LYS 63 2HZ LYS 63 -10.782 2.609 1.818
469 3HZ LYS 63 3HZ LYS 63 -11.087 3.208 0.314
470 H ILE 64 H ILE 64 -5.620 -2.511 1.821
471 HA ILE 64 HA ILE 64 -4.767 -3.032 -0.756
472 HB ILE 64 HB ILE 64 -4.539 -4.224 1.936
473 1HG1 ILE 64 2HG1 ILE 64 -3.139 -2.329 1.274
474 2HG1 ILE 64 3HG1 ILE 64 -2.236 -3.802 1.616
475 1HG2 ILE 64 1HG2 ILE 64 -3.754 -5.754 -0.502
476 2HG2 ILE 64 2HG2 ILE 64 -3.052 -5.978 1.124
477 3HG2 ILE 64 3HG2 ILE 64 -4.778 -6.236 0.873
478 1HD1 ILE 64 1HD1 ILE 64 -1.222 -2.911 -0.261
479 2HD1 ILE 64 2HD1 ILE 64 -2.260 -4.201 -0.929
480 3HD1 ILE 64 3HD1 ILE 64 -2.745 -2.495 -1.051
481 H GLU 65 H GLU 65 -6.960 -4.927 1.432
482 HA GLU 65 HA GLU 65 -7.832 -6.899 -0.393
483 1HB GLU 65 2HB GLU 65 -9.097 -5.617 2.055
484 2HB GLU 65 3HB GLU 65 -9.944 -6.842 1.115
485 1HG GLU 65 2HG GLU 65 -7.135 -7.540 1.887
486 2HG GLU 65 3HG GLU 65 -8.300 -7.397 3.211
487 H LYS 66 H LYS 66 -9.491 -3.792 0.440
488 HA LYS 66 HA LYS 66 -11.634 -4.154 -1.395
489 1HB LYS 66 2HB LYS 66 -10.449 -1.831 0.071
490 2HB LYS 66 3HB LYS 66 -11.407 -1.454 -1.353
491 1HG LYS 66 2HG LYS 66 -12.870 -1.298 0.421
492 2HG LYS 66 3HG LYS 66 -13.332 -2.755 -0.445
493 1HD LYS 66 2HD LYS 66 -11.561 -2.799 2.055
494 2HD LYS 66 3HD LYS 66 -13.315 -2.704 2.155
495 1HE LYS 66 2HE LYS 66 -13.483 -4.857 0.834
496 2HE LYS 66 3HE LYS 66 -11.722 -4.993 0.937
497 1HZ LYS 66 1HZ LYS 66 -13.582 -4.991 3.203
498 2HZ LYS 66 2HZ LYS 66 -12.592 -6.219 2.708
499 3HZ LYS 66 3HZ LYS 66 -11.975 -4.843 3.364
500 H LEU 67 H LEU 67 -8.427 -2.773 -1.951
501 HA LEU 67 HA LEU 67 -8.891 -1.858 -4.641
502 1HB LEU 67 2HB LEU 67 -6.396 -2.517 -3.062
503 2HB LEU 67 3HB LEU 67 -6.359 -1.841 -4.690
504 HG LEU 67 HG LEU 67 -7.905 -0.451 -2.461
505 1HD1 LEU 67 1HD1 LEU 67 -5.620 -0.726 -1.646
506 2HD1 LEU 67 2HD1 LEU 67 -4.980 -0.162 -3.185
507 3HD1 LEU 67 3HD1 LEU 67 -5.878 0.958 -2.136
508 1HD2 LEU 67 1HD2 LEU 67 -8.455 0.362 -4.672
509 2HD2 LEU 67 2HD2 LEU 67 -7.437 1.552 -3.857
510 3HD2 LEU 67 3HD2 LEU 67 -6.744 0.500 -5.104
511 H GLY 68 H GLY 68 -8.487 -5.018 -3.278
512 1HA GLY 68 2HA GLY 68 -8.885 -6.982 -4.396
513 2HA GLY 68 3HA GLY 68 -8.573 -6.214 -5.957
514 H TYR 69 H TYR 69 -6.376 -6.006 -3.087
515 HA TYR 69 HA TYR 69 -4.433 -7.797 -4.484
516 1HB TYR 69 2HB TYR 69 -4.301 -4.930 -3.907
517 2HB TYR 69 3HB TYR 69 -3.057 -5.782 -3.016
518 HD1 TYR 69 HD1 TYR 69 -4.634 -5.711 -6.431
519 HD2 TYR 69 HD2 TYR 69 -1.043 -6.282 -4.119
520 HE1 TYR 69 HE1 TYR 69 -3.315 -5.624 -8.478
521 HE2 TYR 69 HE2 TYR 69 0.289 -5.997 -6.132
522 HH TYR 69 HH TYR 69 0.267 -5.836 -8.472
523 H HIS 70 H HIS 70 -2.590 -8.311 -2.904
524 HA HIS 70 HA HIS 70 -3.480 -8.440 -0.090
525 1HB HIS 70 2HB HIS 70 -4.063 -10.577 -1.355
526 2HB HIS 70 3HB HIS 70 -2.331 -10.865 -1.514
527 HD1 HIS 70 1HD HIS 70 -1.632 -9.991 1.652
528 HD2 HIS 70 2HD HIS 70 -4.667 -12.552 0.213
529 HE1 HIS 70 1HE HIS 70 -2.293 -11.481 3.570
530 H VAL 71 H VAL 71 -1.854 -7.783 1.176
531 HA VAL 71 HA VAL 71 0.942 -7.739 0.145
532 HB VAL 71 HB VAL 71 -0.713 -5.930 1.853
533 1HG1 VAL 71 1HG1 VAL 71 1.188 -4.797 2.840
534 2HG1 VAL 71 2HG1 VAL 71 1.086 -6.451 3.448
535 3HG1 VAL 71 3HG1 VAL 71 2.287 -6.025 2.211
536 1HG2 VAL 71 1HG2 VAL 71 -0.260 -5.405 -0.496
537 2HG2 VAL 71 2HG2 VAL 71 0.509 -4.212 0.575
538 3HG2 VAL 71 3HG2 VAL 71 1.482 -5.480 -0.194
539 H VAL 72 H VAL 72 2.575 -8.380 1.635
540 HA VAL 72 HA VAL 72 1.696 -10.394 3.648
541 HB VAL 72 HB VAL 72 3.987 -10.541 1.758
542 1HG1 VAL 72 1HG1 VAL 72 3.181 -12.445 3.991
543 2HG1 VAL 72 2HG1 VAL 72 4.379 -12.808 2.734
544 3HG1 VAL 72 3HG1 VAL 72 4.695 -11.515 3.885
545 1HG2 VAL 72 1HG2 VAL 72 1.484 -12.258 2.023
546 2HG2 VAL 72 2HG2 VAL 72 1.837 -11.124 0.700
547 3HG2 VAL 72 3HG2 VAL 72 2.840 -12.569 0.918
548 H ILE 73 H ILE 73 2.901 -10.503 5.457
549 HA ILE 73 HA ILE 73 4.348 -7.994 6.193
550 HB ILE 73 HB ILE 73 2.707 -9.790 7.983
551 1HG1 ILE 73 2HG1 ILE 73 1.180 -8.800 6.372
552 2HG1 ILE 73 3HG1 ILE 73 1.042 -8.037 7.948
553 1HG2 ILE 73 1HG2 ILE 73 4.386 -8.549 9.217
554 2HG2 ILE 73 2HG2 ILE 73 4.021 -7.058 8.349
555 3HG2 ILE 73 3HG2 ILE 73 2.832 -7.754 9.475
556 1HD1 ILE 73 1HD1 ILE 73 2.298 -6.095 7.206
557 2HD1 ILE 73 2HD1 ILE 73 2.525 -6.812 5.592
558 3HD1 ILE 73 3HD1 ILE 73 0.912 -6.376 6.153
559 H GLU 74 H GLU 74 6.321 -9.193 5.298
560 HA GLU 74 HA GLU 74 7.356 -11.251 6.890
561 1HB GLU 74 2HB GLU 74 8.408 -9.590 4.608
562 2HB GLU 74 3HB GLU 74 9.492 -10.542 5.606
563 1HG GLU 74 2HG GLU 74 7.986 -12.567 5.171
564 2HG GLU 74 3HG GLU 74 7.249 -11.605 3.874
565 H GLY 75 H GLY 75 6.921 -8.183 7.646
566 1HA GLY 75 2HA GLY 75 9.429 -7.658 9.141
567 2HA GLY 75 3HA GLY 75 8.010 -6.607 9.059
568 H ARG 76 H ARG 76 6.049 -7.353 10.160
569 HA ARG 76 HA ARG 76 5.078 -7.500 12.156
570 1HB ARG 76 2HB ARG 76 4.802 -9.728 11.260
571 2HB ARG 76 3HB ARG 76 6.318 -10.253 11.992
572 1HG ARG 76 2HG ARG 76 5.384 -10.431 14.095
573 2HG ARG 76 3HG ARG 76 4.355 -9.013 13.878
574 1HD ARG 76 2HD ARG 76 2.793 -10.262 12.489
575 2HD ARG 76 3HD ARG 76 3.762 -11.725 12.599
576 HE ARG 76 HE ARG 76 1.969 -10.536 14.595
577 1HH1 ARG 76 2HH2 ARG 76 4.735 -12.663 14.199
578 2HH1 ARG 76 1HH2 ARG 76 4.467 -13.589 15.644
579 1HH2 ARG 76 2HH1 ARG 76 1.619 -11.651 16.592
580 2HH2 ARG 76 1HH1 ARG 76 2.658 -12.955 17.064
Start of MODEL 18
1 1H MET 1 H1 MET 1 -1.979 17.608 18.709
2 2H MET 1 H2 MET 1 -1.149 18.049 20.051
3 3H MET 1 H3 MET 1 -0.799 18.782 18.615
4 HA MET 1 HA MET 1 0.812 17.122 19.371
5 1HB MET 1 2HB MET 1 0.237 14.755 19.005
6 2HB MET 1 3HB MET 1 -0.653 15.490 20.341
7 1HG MET 1 2HG MET 1 -1.799 15.097 17.546
8 2HG MET 1 3HG MET 1 -2.007 13.962 18.875
9 1HE MET 1 1HE MET 1 -5.541 15.689 18.338
10 2HE MET 1 2HE MET 1 -4.320 15.492 17.058
11 3HE MET 1 3HE MET 1 -4.632 14.168 18.208
12 H LEU 2 H LEU 2 -1.342 17.661 16.604
13 HA LEU 2 HA LEU 2 -0.964 17.704 14.429
14 1HB LEU 2 2HB LEU 2 1.782 18.216 15.446
15 2HB LEU 2 3HB LEU 2 1.793 17.413 13.901
16 HG LEU 2 HG LEU 2 1.922 19.832 13.750
17 1HD1 LEU 2 1HD1 LEU 2 0.976 18.561 11.867
18 2HD1 LEU 2 2HD1 LEU 2 -0.664 18.796 12.508
19 3HD1 LEU 2 3HD1 LEU 2 0.293 20.191 11.988
20 1HD2 LEU 2 1HD2 LEU 2 -0.930 19.956 14.817
21 2HD2 LEU 2 2HD2 LEU 2 0.532 20.390 15.731
22 3HD2 LEU 2 3HD2 LEU 2 0.085 21.305 14.279
23 H SER 3 H SER 3 0.460 16.332 12.650
24 HA SER 3 HA SER 3 -0.246 13.491 13.219
25 1HB SER 3 2HB SER 3 -0.148 14.934 10.537
26 2HB SER 3 3HB SER 3 -0.938 13.410 10.930
27 HG SER 3 HG SER 3 -2.192 14.782 12.477
28 H GLU 4 H GLU 4 1.612 12.237 13.340
29 HA GLU 4 HA GLU 4 4.157 13.165 12.242
30 1HB GLU 4 2HB GLU 4 3.244 10.898 13.888
31 2HB GLU 4 3HB GLU 4 4.441 10.460 12.696
32 1HG GLU 4 2HG GLU 4 5.708 12.528 13.629
33 2HG GLU 4 3HG GLU 4 4.642 12.306 15.012
34 H GLN 5 H GLN 5 5.300 11.411 10.794
35 HA GLN 5 HA GLN 5 3.461 10.018 8.973
36 1HB GLN 5 2HB GLN 5 5.928 11.626 8.268
37 2HB GLN 5 3HB GLN 5 5.197 10.508 7.133
38 1HG GLN 5 2HG GLN 5 3.547 12.778 8.367
39 2HG GLN 5 3HG GLN 5 4.662 13.070 7.056
40 1HE2 GLN 5 1HE2 GLN 5 3.193 9.882 6.927
41 2HE2 GLN 5 2HE2 GLN 5 2.048 10.292 5.670
42 H LYS 6 H LYS 6 4.304 7.952 8.499
43 HA LYS 6 HA LYS 6 7.104 7.414 9.023
44 1HB LYS 6 2HB LYS 6 4.909 5.760 10.260
45 2HB LYS 6 3HB LYS 6 6.521 5.113 9.989
46 1HG LYS 6 2HG LYS 6 6.031 7.622 11.634
47 2HG LYS 6 3HG LYS 6 6.107 6.006 12.322
48 1HD LYS 6 2HD LYS 6 8.362 5.817 12.134
49 2HD LYS 6 3HD LYS 6 8.422 6.570 10.555
50 1HE LYS 6 2HE LYS 6 9.672 7.866 12.197
51 2HE LYS 6 3HE LYS 6 8.379 8.803 11.457
52 1HZ LYS 6 1HZ LYS 6 8.531 9.127 13.861
53 2HZ LYS 6 2HZ LYS 6 7.082 8.595 13.455
54 3HZ LYS 6 3HZ LYS 6 8.154 7.551 14.129
55 H GLU 7 H GLU 7 7.830 5.531 7.945
56 HA GLU 7 HA GLU 7 6.404 4.996 5.387
57 1HB GLU 7 2HB GLU 7 9.420 4.897 5.715
58 2HB GLU 7 3HB GLU 7 8.432 5.048 4.267
59 1HG GLU 7 2HG GLU 7 9.286 7.175 4.487
60 2HG GLU 7 3HG GLU 7 7.765 7.395 5.373
61 H ILE 8 H ILE 8 5.508 2.904 5.796
62 HA ILE 8 HA ILE 8 7.091 0.907 7.215
63 HB ILE 8 HB ILE 8 4.550 0.514 5.752
64 1HG1 ILE 8 2HG1 ILE 8 3.912 2.491 6.869
65 2HG1 ILE 8 3HG1 ILE 8 3.155 1.076 7.603
66 1HG2 ILE 8 1HG2 ILE 8 5.753 -0.600 8.257
67 2HG2 ILE 8 2HG2 ILE 8 4.115 -1.019 7.671
68 3HG2 ILE 8 3HG2 ILE 8 5.543 -1.437 6.701
69 1HD1 ILE 8 1HD1 ILE 8 4.728 1.048 9.388
70 2HD1 ILE 8 2HD1 ILE 8 5.664 2.363 8.639
71 3HD1 ILE 8 3HD1 ILE 8 4.016 2.682 9.262
72 H ALA 9 H ALA 9 7.576 -1.250 6.037
73 HA ALA 9 HA ALA 9 7.718 -0.978 3.074
74 1HB ALA 9 1HB ALA 9 9.967 -2.008 4.828
75 2HB ALA 9 2HB ALA 9 9.971 -1.839 3.064
76 3HB ALA 9 3HB ALA 9 9.935 -0.398 4.111
77 H MET 10 H MET 10 6.623 -2.687 2.199
78 HA MET 10 HA MET 10 6.629 -5.332 3.613
79 1HB MET 10 2HB MET 10 4.221 -3.708 2.726
80 2HB MET 10 3HB MET 10 4.154 -5.428 3.110
81 1HG MET 10 2HG MET 10 4.781 -5.093 5.370
82 2HG MET 10 3HG MET 10 5.168 -3.394 5.120
83 1HE MET 10 1HE MET 10 2.703 -2.190 3.482
84 2HE MET 10 2HE MET 10 1.770 -1.624 4.882
85 3HE MET 10 3HE MET 10 3.542 -1.473 4.877
86 H GLN 11 H GLN 11 5.351 -6.932 2.102
87 HA GLN 11 HA GLN 11 6.424 -6.697 -0.682
88 1HB GLN 11 2HB GLN 11 6.534 -8.809 1.320
89 2HB GLN 11 3HB GLN 11 5.584 -9.374 -0.048
90 1HG GLN 11 2HG GLN 11 8.295 -8.104 -0.521
91 2HG GLN 11 3HG GLN 11 8.133 -9.787 -0.007
92 1HE2 GLN 11 1HE2 GLN 11 7.424 -7.582 -2.658
93 2HE2 GLN 11 2HE2 GLN 11 6.745 -8.794 -3.747
94 H VAL 12 H VAL 12 4.948 -7.883 -2.322
95 HA VAL 12 HA VAL 12 2.065 -7.769 -1.556
96 HB VAL 12 HB VAL 12 1.717 -7.061 -3.978
97 1HG1 VAL 12 1HG1 VAL 12 1.968 -4.644 -3.449
98 2HG1 VAL 12 2HG1 VAL 12 1.196 -5.557 -2.138
99 3HG1 VAL 12 3HG1 VAL 12 2.904 -5.089 -2.010
100 1HG2 VAL 12 1HG2 VAL 12 4.144 -7.411 -4.654
101 2HG2 VAL 12 2HG2 VAL 12 3.396 -5.874 -5.124
102 3HG2 VAL 12 3HG2 VAL 12 4.516 -5.927 -3.739
103 H SER 13 H SER 13 0.691 -9.151 -2.644
104 HA SER 13 HA SER 13 1.946 -11.393 -4.193
105 1HB SER 13 2HB SER 13 -0.389 -11.397 -2.235
106 2HB SER 13 3HB SER 13 0.128 -12.795 -3.201
107 HG SER 13 HG SER 13 1.034 -12.726 -1.047
108 H GLY 14 H GLY 14 0.134 -12.529 -5.541
109 1HA GLY 14 2HA GLY 14 -1.726 -12.540 -6.882
110 2HA GLY 14 3HA GLY 14 -2.209 -10.965 -6.247
111 H MET 15 H MET 15 -0.045 -9.406 -6.910
112 HA MET 15 HA MET 15 -0.546 -8.355 -9.304
113 1HB MET 15 2HB MET 15 1.582 -7.212 -9.164
114 2HB MET 15 3HB MET 15 0.919 -7.480 -7.554
115 1HG MET 15 2HG MET 15 3.035 -8.026 -7.101
116 2HG MET 15 3HG MET 15 2.448 -9.628 -7.544
117 1HE MET 15 1HE MET 15 4.927 -10.459 -7.781
118 2HE MET 15 2HE MET 15 6.176 -9.593 -8.707
119 3HE MET 15 3HE MET 15 5.467 -8.846 -7.257
120 H THR 16 H THR 16 0.000 -8.470 -11.412
121 HA THR 16 HA THR 16 2.011 -10.335 -12.402
122 HB THR 16 HB THR 16 0.006 -11.074 -14.119
123 HG1 THR 16 1HG THR 16 -1.086 -11.104 -11.494
124 1HG2 THR 16 1HG2 THR 16 0.002 -13.230 -12.937
125 2HG2 THR 16 2HG2 THR 16 1.644 -12.591 -13.095
126 3HG2 THR 16 3HG2 THR 16 0.807 -12.505 -11.533
127 H CYS 17 H CYS 17 -0.455 -7.822 -13.409
128 HA CYS 17 HA CYS 17 1.007 -7.552 -15.926
129 1HB CYS 17 2HB CYS 17 -0.470 -5.787 -16.487
130 2HB CYS 17 3HB CYS 17 -1.412 -7.149 -15.857
131 H ALA 18 H ALA 18 1.786 -6.612 -12.828
132 HA ALA 18 HA ALA 18 3.371 -5.287 -11.946
133 1HB ALA 18 1HB ALA 18 5.371 -4.897 -13.263
134 2HB ALA 18 2HB ALA 18 4.724 -6.505 -13.641
135 3HB ALA 18 3HB ALA 18 4.489 -5.161 -14.777
136 H ALA 19 H ALA 19 0.929 -4.025 -12.832
137 HA ALA 19 HA ALA 19 1.868 -1.197 -12.830
138 1HB ALA 19 1HB ALA 19 -0.208 -2.321 -14.755
139 2HB ALA 19 2HB ALA 19 0.239 -0.609 -14.565
140 3HB ALA 19 3HB ALA 19 1.429 -1.775 -15.176
141 H CYS 20 H CYS 20 -0.965 -3.416 -12.493
142 HA CYS 20 HA CYS 20 -2.662 -1.707 -11.097
143 1HB CYS 20 2HB CYS 20 -3.562 -3.871 -10.097
144 2HB CYS 20 3HB CYS 20 -3.423 -3.863 -11.861
145 H ALA 21 H ALA 21 0.161 -3.419 -9.915
146 HA ALA 21 HA ALA 21 -0.011 -3.058 -7.154
147 1HB ALA 21 1HB ALA 21 1.781 -4.271 -8.455
148 2HB ALA 21 2HB ALA 21 2.490 -2.692 -8.854
149 3HB ALA 21 3HB ALA 21 2.392 -3.241 -7.164
150 H ALA 22 H ALA 22 0.628 -0.566 -9.648
151 HA ALA 22 HA ALA 22 1.291 1.509 -7.676
152 1HB ALA 22 1HB ALA 22 2.038 1.637 -10.046
153 2HB ALA 22 2HB ALA 22 0.337 1.737 -10.560
154 3HB ALA 22 3HB ALA 22 1.040 3.026 -9.561
155 H ARG 23 H ARG 23 -1.594 0.408 -9.476
156 HA ARG 23 HA ARG 23 -3.250 2.608 -8.798
157 1HB ARG 23 2HB ARG 23 -3.989 -0.276 -9.451
158 2HB ARG 23 3HB ARG 23 -5.154 1.037 -9.335
159 1HG ARG 23 2HG ARG 23 -2.762 1.248 -11.206
160 2HG ARG 23 3HG ARG 23 -4.209 0.377 -11.693
161 1HD ARG 23 2HD ARG 23 -4.360 3.221 -10.634
162 2HD ARG 23 3HD ARG 23 -4.016 2.871 -12.337
163 HE ARG 23 HE ARG 23 -6.218 1.354 -11.924
164 1HH1 ARG 23 2HH2 ARG 23 -5.597 4.762 -11.254
165 2HH1 ARG 23 1HH2 ARG 23 -7.196 5.300 -11.660
166 1HH2 ARG 23 2HH1 ARG 23 -8.323 2.045 -12.558
167 2HH2 ARG 23 1HH1 ARG 23 -8.780 3.710 -12.426
168 H ILE 24 H ILE 24 -2.722 -0.519 -7.089
169 HA ILE 24 HA ILE 24 -4.637 0.088 -5.095
170 HB ILE 24 HB ILE 24 -3.809 -1.611 -3.725
171 1HG1 ILE 24 2HG1 ILE 24 -1.326 -1.313 -5.339
172 2HG1 ILE 24 3HG1 ILE 24 -1.545 -1.227 -3.575
173 1HG2 ILE 24 1HG2 ILE 24 -3.377 -2.561 -6.583
174 2HG2 ILE 24 2HG2 ILE 24 -4.075 -3.424 -5.199
175 3HG2 ILE 24 3HG2 ILE 24 -4.975 -2.111 -5.952
176 1HD1 ILE 24 1HD1 ILE 24 -1.990 -3.683 -3.569
177 2HD1 ILE 24 2HD1 ILE 24 -1.607 -3.693 -5.316
178 3HD1 ILE 24 3HD1 ILE 24 -0.360 -3.256 -4.141
179 H GLU 25 H GLU 25 -1.070 0.629 -4.868
180 HA GLU 25 HA GLU 25 -1.092 2.062 -2.474
181 1HB GLU 25 2HB GLU 25 0.714 1.860 -4.848
182 2HB GLU 25 3HB GLU 25 0.921 3.312 -3.858
183 1HG GLU 25 2HG GLU 25 2.375 1.406 -3.156
184 2HG GLU 25 3HG GLU 25 1.339 2.019 -1.868
185 H LYS 26 H LYS 26 -1.800 3.299 -5.728
186 HA LYS 26 HA LYS 26 -1.747 6.084 -4.789
187 1HB LYS 26 2HB LYS 26 -2.753 4.999 -7.432
188 2HB LYS 26 3HB LYS 26 -2.497 6.697 -7.013
189 1HG LYS 26 2HG LYS 26 -0.379 4.553 -7.357
190 2HG LYS 26 3HG LYS 26 -0.677 5.956 -8.370
191 1HD LYS 26 2HD LYS 26 0.100 7.423 -6.464
192 2HD LYS 26 3HD LYS 26 0.323 5.973 -5.474
193 1HE LYS 26 2HE LYS 26 2.476 6.562 -6.252
194 2HE LYS 26 3HE LYS 26 1.985 5.065 -7.049
195 1HZ LYS 26 1HZ LYS 26 1.926 7.765 -8.241
196 2HZ LYS 26 2HZ LYS 26 3.008 6.576 -8.577
197 3HZ LYS 26 3HZ LYS 26 1.434 6.388 -9.003
198 H GLY 27 H GLY 27 -4.316 3.672 -5.461
199 1HA GLY 27 2HA GLY 27 -6.490 5.449 -4.766
200 2HA GLY 27 3HA GLY 27 -6.520 3.686 -4.681
201 H LEU 28 H LEU 28 -4.336 3.233 -2.916
202 HA LEU 28 HA LEU 28 -5.630 3.586 -0.420
203 1HB LEU 28 2HB LEU 28 -4.209 1.746 -0.918
204 2HB LEU 28 3HB LEU 28 -2.800 2.777 -1.117
205 HG LEU 28 HG LEU 28 -3.090 1.379 1.019
206 1HD1 LEU 28 1HD1 LEU 28 -1.991 3.231 2.358
207 2HD1 LEU 28 2HD1 LEU 28 -1.297 2.890 0.757
208 3HD1 LEU 28 3HD1 LEU 28 -2.340 4.295 0.993
209 1HD2 LEU 28 1HD2 LEU 28 -5.400 2.013 1.583
210 2HD2 LEU 28 2HD2 LEU 28 -4.279 2.446 2.883
211 3HD2 LEU 28 3HD2 LEU 28 -4.895 3.695 1.842
212 H LYS 29 H LYS 29 -3.067 5.446 -2.064
213 HA LYS 29 HA LYS 29 -2.512 7.325 -0.081
214 1HB LYS 29 2HB LYS 29 -1.556 6.917 -2.532
215 2HB LYS 29 3HB LYS 29 -2.729 8.173 -2.959
216 1HG LYS 29 2HG LYS 29 -1.558 9.418 -0.878
217 2HG LYS 29 3HG LYS 29 -0.310 8.215 -1.201
218 1HD LYS 29 2HD LYS 29 0.414 9.963 -2.682
219 2HD LYS 29 3HD LYS 29 -0.607 9.011 -3.736
220 1HE LYS 29 2HE LYS 29 -1.277 11.270 -4.031
221 2HE LYS 29 3HE LYS 29 -2.541 10.556 -3.005
222 1HZ LYS 29 1HZ LYS 29 -1.171 11.500 -1.097
223 2HZ LYS 29 2HZ LYS 29 -0.315 12.317 -2.182
224 3HZ LYS 29 3HZ LYS 29 -1.937 12.618 -2.039
225 H ARG 30 H ARG 30 -5.514 6.976 -1.821
226 HA ARG 30 HA ARG 30 -6.387 9.762 -1.364
227 1HB ARG 30 2HB ARG 30 -7.260 7.452 -2.991
228 2HB ARG 30 3HB ARG 30 -8.594 8.235 -2.189
229 1HG ARG 30 2HG ARG 30 -7.835 10.410 -3.181
230 2HG ARG 30 3HG ARG 30 -6.477 9.546 -3.943
231 1HD ARG 30 2HD ARG 30 -8.160 8.017 -5.054
232 2HD ARG 30 3HD ARG 30 -9.461 9.040 -4.467
233 HE ARG 30 HE ARG 30 -7.625 9.471 -6.683
234 1HH1 ARG 30 2HH2 ARG 30 -9.610 11.186 -4.340
235 2HH1 ARG 30 1HH2 ARG 30 -9.830 12.614 -5.305
236 1HH2 ARG 30 2HH1 ARG 30 -7.855 11.349 -8.000
237 2HH2 ARG 30 1HH1 ARG 30 -8.780 12.704 -7.444
238 H MET 31 H MET 31 -6.055 7.055 0.640
239 HA MET 31 HA MET 31 -8.672 7.291 1.939
240 1HB MET 31 2HB MET 31 -6.225 5.638 2.674
241 2HB MET 31 3HB MET 31 -7.862 5.380 3.272
242 1HG MET 31 2HG MET 31 -7.019 5.142 0.357
243 2HG MET 31 3HG MET 31 -7.229 3.817 1.467
244 1HE MET 31 1HE MET 31 -8.569 4.416 -1.572
245 2HE MET 31 2HE MET 31 -8.370 2.921 -0.631
246 3HE MET 31 3HE MET 31 -9.986 3.424 -1.228
247 HA PRO 32 HA PRO 32 -7.388 10.169 5.053
248 1HB PRO 32 2HB PRO 32 -8.437 9.116 7.404
249 2HB PRO 32 3HB PRO 32 -9.384 9.986 6.165
250 1HG PRO 32 2HG PRO 32 -9.036 6.999 6.472
251 2HG PRO 32 3HG PRO 32 -10.563 7.904 6.238
252 1HD PRO 32 2HD PRO 32 -9.357 6.717 4.157
253 2HD PRO 32 3HD PRO 32 -10.019 8.358 3.943
254 H GLY 33 H GLY 33 -5.722 10.461 6.567
255 1HA GLY 33 2HA GLY 33 -3.993 9.929 7.955
256 2HA GLY 33 3HA GLY 33 -4.395 8.204 7.813
257 H VAL 34 H VAL 34 -4.215 8.249 4.813
258 HA VAL 34 HA VAL 34 -1.290 7.976 4.683
259 HB VAL 34 HB VAL 34 -3.298 7.492 2.470
260 1HG1 VAL 34 1HG1 VAL 34 -0.920 7.738 1.761
261 2HG1 VAL 34 2HG1 VAL 34 -0.412 6.577 3.001
262 3HG1 VAL 34 3HG1 VAL 34 -1.395 6.057 1.634
263 1HG2 VAL 34 1HG2 VAL 34 -3.926 6.070 4.371
264 2HG2 VAL 34 2HG2 VAL 34 -3.144 5.098 3.135
265 3HG2 VAL 34 3HG2 VAL 34 -2.237 5.568 4.589
266 H THR 35 H THR 35 0.083 9.309 3.578
267 HA THR 35 HA THR 35 -1.134 11.709 2.257
268 HB THR 35 HB THR 35 0.971 11.442 4.258
269 HG1 THR 35 1HG THR 35 -0.522 13.639 3.290
270 1HG2 THR 35 1HG2 THR 35 2.528 11.943 2.519
271 2HG2 THR 35 2HG2 THR 35 1.472 13.211 1.834
272 3HG2 THR 35 3HG2 THR 35 2.223 13.425 3.430
273 H ASP 36 H ASP 36 1.614 9.288 2.041
274 HA ASP 36 HA ASP 36 1.344 9.538 -0.841
275 1HB ASP 36 2HB ASP 36 3.714 10.564 0.628
276 2HB ASP 36 3HB ASP 36 4.048 9.504 -0.745
277 H ALA 37 H ALA 37 2.468 7.851 -1.972
278 HA ALA 37 HA ALA 37 3.229 5.495 -0.441
279 1HB ALA 37 1HB ALA 37 0.687 5.330 -2.117
280 2HB ALA 37 2HB ALA 37 1.420 4.051 -1.119
281 3HB ALA 37 3HB ALA 37 0.696 5.462 -0.345
282 H ASN 38 H ASN 38 4.211 3.825 -1.721
283 HA ASN 38 HA ASN 38 4.868 4.517 -4.511
284 1HB ASN 38 2HB ASN 38 7.390 4.237 -3.218
285 2HB ASN 38 3HB ASN 38 6.736 5.621 -4.071
286 1HD2 ASN 38 1HD2 ASN 38 6.032 4.185 -0.792
287 2HD2 ASN 38 2HD2 ASN 38 6.415 5.686 0.046
288 H VAL 39 H VAL 39 4.878 2.616 -5.526
289 HA VAL 39 HA VAL 39 5.227 0.152 -3.985
290 HB VAL 39 HB VAL 39 3.230 0.606 -5.289
291 1HG1 VAL 39 1HG1 VAL 39 4.874 0.222 -7.834
292 2HG1 VAL 39 2HG1 VAL 39 3.144 0.339 -7.691
293 3HG1 VAL 39 3HG1 VAL 39 4.141 1.750 -7.297
294 1HG2 VAL 39 1HG2 VAL 39 4.269 -1.732 -4.783
295 2HG2 VAL 39 2HG2 VAL 39 2.870 -1.554 -5.829
296 3HG2 VAL 39 3HG2 VAL 39 4.468 -1.782 -6.561
297 H ASN 40 H ASN 40 7.410 -0.283 -3.701
298 HA ASN 40 HA ASN 40 9.314 0.295 -5.864
299 1HB ASN 40 2HB ASN 40 9.760 0.803 -3.458
300 2HB ASN 40 3HB ASN 40 9.783 -0.937 -3.124
301 1HD2 ASN 40 1HD2 ASN 40 12.028 0.056 -2.366
302 2HD2 ASN 40 2HD2 ASN 40 13.311 -0.067 -3.558
303 H LEU 41 H LEU 41 7.710 -1.374 -6.980
304 HA LEU 41 HA LEU 41 8.190 -4.176 -6.468
305 1HB LEU 41 2HB LEU 41 6.592 -2.529 -8.340
306 2HB LEU 41 3HB LEU 41 7.148 -4.028 -9.057
307 HG LEU 41 HG LEU 41 4.893 -3.994 -7.898
308 1HD1 LEU 41 1HD1 LEU 41 6.903 -6.183 -7.248
309 2HD1 LEU 41 2HD1 LEU 41 5.136 -6.341 -7.166
310 3HD1 LEU 41 3HD1 LEU 41 5.926 -6.036 -8.722
311 1HD2 LEU 41 1HD2 LEU 41 6.056 -3.033 -5.676
312 2HD2 LEU 41 2HD2 LEU 41 4.673 -4.124 -5.601
313 3HD2 LEU 41 3HD2 LEU 41 6.309 -4.747 -5.339
314 H ALA 42 H ALA 42 9.923 -1.807 -8.253
315 HA ALA 42 HA ALA 42 11.562 -3.253 -9.976
316 1HB ALA 42 1HB ALA 42 11.738 -0.801 -9.548
317 2HB ALA 42 2HB ALA 42 12.400 -1.166 -7.927
318 3HB ALA 42 3HB ALA 42 13.306 -1.635 -9.375
319 H THR 43 H THR 43 11.529 -3.261 -6.390
320 HA THR 43 HA THR 43 13.260 -5.639 -6.531
321 HB THR 43 HB THR 43 14.780 -3.864 -5.984
322 HG1 THR 43 1HG THR 43 14.896 -5.898 -4.852
323 1HG2 THR 43 1HG2 THR 43 13.791 -2.039 -5.067
324 2HG2 THR 43 2HG2 THR 43 12.653 -2.971 -4.091
325 3HG2 THR 43 3HG2 THR 43 14.331 -2.798 -3.556
326 H GLU 44 H GLU 44 10.609 -5.724 -6.616
327 HA GLU 44 HA GLU 44 8.634 -6.257 -5.522
328 1HB GLU 44 2HB GLU 44 10.736 -8.253 -4.655
329 2HB GLU 44 3HB GLU 44 9.005 -8.514 -4.472
330 1HG GLU 44 2HG GLU 44 8.905 -9.326 -6.540
331 2HG GLU 44 3HG GLU 44 9.257 -7.719 -7.176
332 H THR 45 H THR 45 9.294 -4.079 -4.073
333 HA THR 45 HA THR 45 8.298 -4.905 -1.413
334 HB THR 45 HB THR 45 9.729 -2.500 -1.128
335 HG1 THR 45 1HG THR 45 11.304 -4.349 -2.563
336 1HG2 THR 45 1HG2 THR 45 9.525 -4.242 0.614
337 2HG2 THR 45 2HG2 THR 45 10.554 -5.333 -0.342
338 3HG2 THR 45 3HG2 THR 45 11.230 -3.840 0.344
339 H VAL 46 H VAL 46 7.117 -3.087 -0.374
340 HA VAL 46 HA VAL 46 6.224 -0.932 -2.197
341 HB VAL 46 HB VAL 46 4.505 -2.555 -2.483
342 1HG1 VAL 46 1HG1 VAL 46 3.190 -3.434 -0.492
343 2HG1 VAL 46 2HG1 VAL 46 4.800 -4.129 -0.711
344 3HG1 VAL 46 3HG1 VAL 46 4.514 -2.894 0.543
345 1HG2 VAL 46 1HG2 VAL 46 2.573 -1.462 -1.576
346 2HG2 VAL 46 2HG2 VAL 46 3.527 -0.579 -0.379
347 3HG2 VAL 46 3HG2 VAL 46 3.746 -0.240 -2.114
348 H ASN 47 H ASN 47 5.894 1.018 -1.129
349 HA ASN 47 HA ASN 47 6.410 1.032 1.793
350 1HB ASN 47 2HB ASN 47 7.659 2.723 -0.421
351 2HB ASN 47 3HB ASN 47 7.618 3.250 1.268
352 1HD2 ASN 47 1HD2 ASN 47 8.442 1.475 2.902
353 2HD2 ASN 47 2HD2 ASN 47 10.012 0.857 2.422
354 H VAL 48 H VAL 48 5.122 2.550 2.912
355 HA VAL 48 HA VAL 48 3.171 4.095 1.315
356 HB VAL 48 HB VAL 48 2.140 1.949 1.660
357 1HG1 VAL 48 1HG1 VAL 48 1.617 1.061 3.897
358 2HG1 VAL 48 2HG1 VAL 48 3.349 1.047 3.552
359 3HG1 VAL 48 3HG1 VAL 48 2.673 2.277 4.633
360 1HG2 VAL 48 1HG2 VAL 48 1.020 4.203 3.354
361 2HG2 VAL 48 2HG2 VAL 48 0.679 3.803 1.675
362 3HG2 VAL 48 3HG2 VAL 48 0.151 2.707 2.972
363 H ILE 49 H ILE 49 3.029 6.090 2.116
364 HA ILE 49 HA ILE 49 4.622 6.667 4.513
365 HB ILE 49 HB ILE 49 3.904 8.601 2.284
366 1HG1 ILE 49 2HG1 ILE 49 5.011 6.935 1.048
367 2HG1 ILE 49 3HG1 ILE 49 6.155 8.233 1.353
368 1HG2 ILE 49 1HG2 ILE 49 5.922 9.776 3.106
369 2HG2 ILE 49 2HG2 ILE 49 4.634 9.656 4.310
370 3HG2 ILE 49 3HG2 ILE 49 6.048 8.600 4.427
371 1HD1 ILE 49 1HD1 ILE 49 6.138 5.441 2.522
372 2HD1 ILE 49 2HD1 ILE 49 7.445 6.320 1.721
373 3HD1 ILE 49 3HD1 ILE 49 6.961 6.768 3.357
374 H TYR 50 H TYR 50 3.126 6.747 6.207
375 HA TYR 50 HA TYR 50 0.693 8.449 5.858
376 1HB TYR 50 2HB TYR 50 -0.735 6.775 6.735
377 2HB TYR 50 3HB TYR 50 0.044 6.173 5.305
378 HD1 TYR 50 HD1 TYR 50 1.439 4.145 5.428
379 HD2 TYR 50 HD2 TYR 50 -0.092 5.923 9.012
380 HE1 TYR 50 HE1 TYR 50 1.306 1.916 6.489
381 HE2 TYR 50 HE2 TYR 50 0.309 3.798 10.217
382 HH TYR 50 HH TYR 50 0.962 0.775 8.487
383 H ASP 51 H ASP 51 -0.453 8.815 7.784
384 HA ASP 51 HA ASP 51 1.324 9.427 10.051
385 1HB ASP 51 2HB ASP 51 -0.197 11.148 9.483
386 2HB ASP 51 3HB ASP 51 -1.575 10.042 9.513
387 HA PRO 52 HA PRO 52 0.008 5.426 11.746
388 1HB PRO 52 2HB PRO 52 1.813 5.130 13.737
389 2HB PRO 52 3HB PRO 52 2.269 5.014 12.012
390 1HG PRO 52 2HG PRO 52 2.469 7.461 13.801
391 2HG PRO 52 3HG PRO 52 3.767 6.736 12.807
392 1HD PRO 52 2HD PRO 52 2.266 8.817 11.926
393 2HD PRO 52 3HD PRO 52 2.775 7.516 10.804
394 H ALA 53 H ALA 53 -0.670 8.521 12.969
395 HA ALA 53 HA ALA 53 -1.866 7.524 15.484
396 1HB ALA 53 1HB ALA 53 -2.594 9.824 15.716
397 2HB ALA 53 2HB ALA 53 -0.858 9.818 15.321
398 3HB ALA 53 3HB ALA 53 -2.062 10.206 14.070
399 H GLU 54 H GLU 54 -2.519 8.082 12.054
400 HA GLU 54 HA GLU 54 -5.413 8.104 12.570
401 1HB GLU 54 2HB GLU 54 -3.973 9.960 11.310
402 2HB GLU 54 3HB GLU 54 -4.259 8.905 9.935
403 1HG GLU 54 2HG GLU 54 -6.389 10.121 11.767
404 2HG GLU 54 3HG GLU 54 -5.919 10.761 10.190
405 H THR 55 H THR 55 -2.998 6.845 10.246
406 HA THR 55 HA THR 55 -4.534 4.334 10.079
407 HB THR 55 HB THR 55 -2.826 3.767 8.130
408 HG1 THR 55 1HG THR 55 -3.236 6.474 7.844
409 1HG2 THR 55 1HG2 THR 55 -5.225 3.792 8.042
410 2HG2 THR 55 2HG2 THR 55 -5.273 5.576 7.952
411 3HG2 THR 55 3HG2 THR 55 -4.545 4.639 6.619
412 H GLY 56 H GLY 56 -2.552 2.576 9.649
413 1HA GLY 56 2HA GLY 56 -0.780 1.838 11.511
414 2HA GLY 56 3HA GLY 56 -2.204 2.215 12.511
415 H THR 57 H THR 57 -1.138 0.562 9.870
416 HA THR 57 HA THR 57 -1.813 -0.327 8.099
417 HB THR 57 HB THR 57 -1.564 -2.808 8.270
418 HG1 THR 57 1HG THR 57 -1.207 -3.616 10.413
419 1HG2 THR 57 1HG2 THR 57 0.688 -2.840 9.224
420 2HG2 THR 57 2HG2 THR 57 0.467 -1.381 8.247
421 3HG2 THR 57 3HG2 THR 57 0.418 -1.286 10.027
422 H ALA 58 H ALA 58 -4.168 -1.007 10.574
423 HA ALA 58 HA ALA 58 -6.286 -2.264 9.653
424 1HB ALA 58 1HB ALA 58 -6.083 0.635 10.530
425 2HB ALA 58 2HB ALA 58 -7.606 -0.305 10.541
426 3HB ALA 58 3HB ALA 58 -6.239 -0.773 11.586
427 H ALA 59 H ALA 59 -5.510 0.994 8.320
428 HA ALA 59 HA ALA 59 -7.966 0.699 6.671
429 1HB ALA 59 1HB ALA 59 -7.658 2.833 5.788
430 2HB ALA 59 2HB ALA 59 -7.226 2.950 7.503
431 3HB ALA 59 3HB ALA 59 -5.954 2.877 6.226
432 H ILE 60 H ILE 60 -4.501 0.660 6.209
433 HA ILE 60 HA ILE 60 -4.319 0.323 3.419
434 HB ILE 60 HB ILE 60 -2.602 -0.300 5.845
435 1HG1 ILE 60 2HG1 ILE 60 -0.971 1.004 4.384
436 2HG1 ILE 60 3HG1 ILE 60 -2.314 1.209 3.248
437 1HG2 ILE 60 1HG2 ILE 60 -1.900 -1.378 3.103
438 2HG2 ILE 60 2HG2 ILE 60 -0.817 -1.252 4.510
439 3HG2 ILE 60 3HG2 ILE 60 -2.194 -2.336 4.580
440 1HD1 ILE 60 1HD1 ILE 60 -3.494 2.544 5.036
441 2HD1 ILE 60 2HD1 ILE 60 -2.244 2.067 6.215
442 3HD1 ILE 60 3HD1 ILE 60 -1.833 3.145 4.876
443 H GLN 61 H GLN 61 -4.535 -2.227 5.956
444 HA GLN 61 HA GLN 61 -4.564 -4.274 3.986
445 1HB GLN 61 2HB GLN 61 -4.442 -4.112 6.789
446 2HB GLN 61 3HB GLN 61 -5.808 -5.173 6.429
447 1HG GLN 61 2HG GLN 61 -4.461 -6.785 5.420
448 2HG GLN 61 3HG GLN 61 -3.213 -5.633 4.933
449 1HE2 GLN 61 1HE2 GLN 61 -1.967 -4.530 6.694
450 2HE2 GLN 61 2HE2 GLN 61 -1.514 -5.544 8.061
451 H GLU 62 H GLU 62 -7.259 -2.695 5.778
452 HA GLU 62 HA GLU 62 -9.477 -4.030 4.732
453 1HB GLU 62 2HB GLU 62 -8.848 -1.266 5.686
454 2HB GLU 62 3HB GLU 62 -10.202 -1.333 4.582
455 1HG GLU 62 2HG GLU 62 -10.025 -3.147 7.005
456 2HG GLU 62 3HG GLU 62 -10.771 -1.542 7.036
457 H LYS 63 H LYS 63 -7.851 -1.163 3.255
458 HA LYS 63 HA LYS 63 -9.459 -1.297 0.917
459 1HB LYS 63 2HB LYS 63 -6.938 0.149 1.775
460 2HB LYS 63 3HB LYS 63 -7.709 0.406 0.242
461 1HG LYS 63 2HG LYS 63 -9.040 0.807 2.984
462 2HG LYS 63 3HG LYS 63 -8.297 2.052 2.004
463 1HD LYS 63 2HD LYS 63 -10.515 2.380 1.641
464 2HD LYS 63 3HD LYS 63 -10.010 1.522 0.174
465 1HE LYS 63 2HE LYS 63 -11.300 -0.348 0.682
466 2HE LYS 63 3HE LYS 63 -11.227 -0.077 2.437
467 1HZ LYS 63 1HZ LYS 63 -12.769 1.504 0.486
468 2HZ LYS 63 2HZ LYS 63 -13.374 0.353 1.500
469 3HZ LYS 63 3HZ LYS 63 -12.752 1.738 2.119
470 H ILE 64 H ILE 64 -6.204 -2.480 1.668
471 HA ILE 64 HA ILE 64 -5.240 -3.059 -0.786
472 HB ILE 64 HB ILE 64 -4.894 -4.028 1.933
473 1HG1 ILE 64 2HG1 ILE 64 -3.565 -2.241 0.671
474 2HG1 ILE 64 3HG1 ILE 64 -2.656 -3.448 1.579
475 1HG2 ILE 64 1HG2 ILE 64 -5.096 -6.183 1.245
476 2HG2 ILE 64 2HG2 ILE 64 -4.139 -5.906 -0.239
477 3HG2 ILE 64 3HG2 ILE 64 -3.374 -5.851 1.370
478 1HD1 ILE 64 1HD1 ILE 64 -3.181 -3.640 -1.413
479 2HD1 ILE 64 2HD1 ILE 64 -1.689 -3.020 -0.663
480 3HD1 ILE 64 3HD1 ILE 64 -2.161 -4.712 -0.435
481 H GLU 65 H GLU 65 -7.241 -5.106 1.433
482 HA GLU 65 HA GLU 65 -7.871 -7.248 -0.324
483 1HB GLU 65 2HB GLU 65 -9.192 -6.081 2.153
484 2HB GLU 65 3HB GLU 65 -9.886 -7.462 1.299
485 1HG GLU 65 2HG GLU 65 -6.970 -7.637 2.010
486 2HG GLU 65 3HG GLU 65 -8.161 -7.771 3.310
487 H LYS 66 H LYS 66 -9.835 -4.346 0.519
488 HA LYS 66 HA LYS 66 -11.977 -4.973 -1.156
489 1HB LYS 66 2HB LYS 66 -11.374 -2.935 0.599
490 2HB LYS 66 3HB LYS 66 -11.427 -2.058 -0.927
491 1HG LYS 66 2HG LYS 66 -13.592 -3.917 0.179
492 2HG LYS 66 3HG LYS 66 -13.554 -2.163 0.402
493 1HD LYS 66 2HD LYS 66 -13.468 -1.975 -2.180
494 2HD LYS 66 3HD LYS 66 -13.928 -3.674 -2.230
495 1HE LYS 66 2HE LYS 66 -15.489 -1.400 -0.884
496 2HE LYS 66 3HE LYS 66 -15.873 -2.121 -2.451
497 1HZ LYS 66 1HZ LYS 66 -16.307 -4.195 -1.350
498 2HZ LYS 66 2HZ LYS 66 -15.908 -3.570 0.119
499 3HZ LYS 66 3HZ LYS 66 -17.227 -3.009 -0.682
500 H LEU 67 H LEU 67 -8.974 -3.361 -2.041
501 HA LEU 67 HA LEU 67 -9.732 -2.607 -4.733
502 1HB LEU 67 2HB LEU 67 -7.135 -2.814 -3.182
503 2HB LEU 67 3HB LEU 67 -7.130 -2.471 -4.906
504 HG LEU 67 HG LEU 67 -8.903 -0.787 -3.128
505 1HD1 LEU 67 1HD1 LEU 67 -6.814 -0.622 -1.933
506 2HD1 LEU 67 2HD1 LEU 67 -5.896 -0.503 -3.427
507 3HD1 LEU 67 3HD1 LEU 67 -6.957 0.832 -2.929
508 1HD2 LEU 67 1HD2 LEU 67 -8.990 -0.593 -5.635
509 2HD2 LEU 67 2HD2 LEU 67 -8.430 0.898 -4.859
510 3HD2 LEU 67 3HD2 LEU 67 -7.262 -0.187 -5.638
511 H GLY 68 H GLY 68 -8.878 -5.615 -3.238
512 1HA GLY 68 2HA GLY 68 -9.041 -7.688 -4.239
513 2HA GLY 68 3HA GLY 68 -8.870 -6.979 -5.851
514 H TYR 69 H TYR 69 -6.794 -6.591 -2.884
515 HA TYR 69 HA TYR 69 -4.559 -7.990 -4.269
516 1HB TYR 69 2HB TYR 69 -4.891 -5.157 -3.919
517 2HB TYR 69 3HB TYR 69 -3.644 -5.671 -2.806
518 HD1 TYR 69 HD1 TYR 69 -1.509 -6.564 -3.616
519 HD2 TYR 69 HD2 TYR 69 -4.716 -5.691 -6.367
520 HE1 TYR 69 HE1 TYR 69 0.102 -6.475 -5.479
521 HE2 TYR 69 HE2 TYR 69 -3.098 -5.569 -8.215
522 HH TYR 69 HH TYR 69 -0.851 -5.091 -8.607
523 H HIS 70 H HIS 70 -2.666 -8.150 -2.644
524 HA HIS 70 HA HIS 70 -3.482 -8.245 0.158
525 1HB HIS 70 2HB HIS 70 -4.160 -10.433 -0.848
526 2HB HIS 70 3HB HIS 70 -2.474 -10.734 -1.266
527 HD1 HIS 70 1HD HIS 70 -3.168 -12.955 0.346
528 HD2 HIS 70 2HD HIS 70 -2.826 -9.202 2.216
529 HE1 HIS 70 1HE HIS 70 -2.982 -13.391 2.854
530 H VAL 71 H VAL 71 -1.833 -7.579 1.366
531 HA VAL 71 HA VAL 71 0.862 -7.215 0.202
532 HB VAL 71 HB VAL 71 -0.324 -5.203 0.860
533 1HG1 VAL 71 1HG1 VAL 71 -0.872 -4.658 3.164
534 2HG1 VAL 71 2HG1 VAL 71 -1.674 -6.194 2.817
535 3HG1 VAL 71 3HG1 VAL 71 -0.177 -6.173 3.758
536 1HG2 VAL 71 1HG2 VAL 71 1.375 -4.216 2.375
537 2HG2 VAL 71 2HG2 VAL 71 2.053 -5.840 2.604
538 3HG2 VAL 71 3HG2 VAL 71 2.046 -5.076 0.990
539 H VAL 72 H VAL 72 2.609 -8.197 1.210
540 HA VAL 72 HA VAL 72 1.999 -10.212 3.310
541 HB VAL 72 HB VAL 72 4.432 -10.065 1.649
542 1HG1 VAL 72 1HG1 VAL 72 3.240 -12.324 3.275
543 2HG1 VAL 72 2HG1 VAL 72 4.678 -12.450 2.243
544 3HG1 VAL 72 3HG1 VAL 72 4.706 -11.393 3.657
545 1HG2 VAL 72 1HG2 VAL 72 1.901 -11.679 1.106
546 2HG2 VAL 72 2HG2 VAL 72 2.552 -10.389 0.069
547 3HG2 VAL 72 3HG2 VAL 72 3.439 -11.904 0.248
548 H ILE 73 H ILE 73 2.936 -10.067 5.205
549 HA ILE 73 HA ILE 73 4.233 -7.526 5.942
550 HB ILE 73 HB ILE 73 3.200 -9.714 7.752
551 1HG1 ILE 73 2HG1 ILE 73 1.311 -8.998 6.454
552 2HG1 ILE 73 3HG1 ILE 73 1.236 -8.253 8.044
553 1HG2 ILE 73 1HG2 ILE 73 3.132 -7.815 9.391
554 2HG2 ILE 73 2HG2 ILE 73 4.769 -8.214 8.870
555 3HG2 ILE 73 3HG2 ILE 73 3.962 -6.790 8.200
556 1HD1 ILE 73 1HD1 ILE 73 2.075 -6.111 7.091
557 2HD1 ILE 73 2HD1 ILE 73 2.087 -6.854 5.471
558 3HD1 ILE 73 3HD1 ILE 73 0.566 -6.657 6.346
559 H GLU 74 H GLU 74 6.137 -8.258 4.697
560 HA GLU 74 HA GLU 74 7.701 -10.339 5.632
561 1HB GLU 74 2HB GLU 74 7.627 -8.908 3.412
562 2HB GLU 74 3HB GLU 74 9.060 -8.160 4.127
563 1HG GLU 74 2HG GLU 74 8.727 -11.201 3.808
564 2HG GLU 74 3HG GLU 74 9.280 -10.175 2.484
565 H GLY 75 H GLY 75 7.089 -7.720 7.305
566 1HA GLY 75 2HA GLY 75 7.863 -6.850 9.299
567 2HA GLY 75 3HA GLY 75 8.930 -8.257 9.380
568 H ARG 76 H ARG 76 8.630 -5.023 7.760
569 HA ARG 76 HA ARG 76 11.404 -4.365 8.152
570 1HB ARG 76 2HB ARG 76 10.330 -5.654 5.704
571 2HB ARG 76 3HB ARG 76 10.925 -4.041 5.379
572 1HG ARG 76 2HG ARG 76 13.125 -4.569 6.042
573 2HG ARG 76 3HG ARG 76 12.611 -5.956 7.024
574 1HD ARG 76 2HD ARG 76 12.084 -7.279 5.124
575 2HD ARG 76 3HD ARG 76 12.405 -5.948 3.992
576 HE ARG 76 HE ARG 76 14.753 -6.095 5.318
577 1HH1 ARG 76 2HH2 ARG 76 12.870 -8.756 3.858
578 2HH1 ARG 76 1HH2 ARG 76 14.251 -9.641 3.352
579 1HH2 ARG 76 2HH1 ARG 76 16.592 -7.317 4.711
580 2HH2 ARG 76 1HH1 ARG 76 16.405 -8.828 3.876
Start of MODEL 19
1 1H MET 1 H1 MET 1 -4.217 19.529 16.658
2 2H MET 1 H2 MET 1 -5.624 19.147 15.878
3 3H MET 1 H3 MET 1 -4.477 17.989 16.144
4 HA MET 1 HA MET 1 -4.425 18.701 13.855
5 1HB MET 1 2HB MET 1 -3.889 21.402 15.159
6 2HB MET 1 3HB MET 1 -3.515 21.038 13.470
7 1HG MET 1 2HG MET 1 -5.845 20.576 12.972
8 2HG MET 1 3HG MET 1 -6.307 20.891 14.656
9 1HE MET 1 1HE MET 1 -8.168 22.545 13.713
10 2HE MET 1 2HE MET 1 -7.795 23.930 12.660
11 3HE MET 1 3HE MET 1 -7.610 22.273 12.041
12 H LEU 2 H LEU 2 -2.892 16.929 14.600
13 HA LEU 2 HA LEU 2 -0.314 17.704 13.814
14 1HB LEU 2 2HB LEU 2 0.998 17.014 15.738
15 2HB LEU 2 3HB LEU 2 -0.014 18.385 16.149
16 HG LEU 2 HG LEU 2 -1.653 16.338 16.983
17 1HD1 LEU 2 1HD1 LEU 2 -0.284 14.680 18.168
18 2HD1 LEU 2 2HD1 LEU 2 0.101 14.592 16.446
19 3HD1 LEU 2 3HD1 LEU 2 1.207 15.417 17.555
20 1HD2 LEU 2 1HD2 LEU 2 -0.827 16.832 19.250
21 2HD2 LEU 2 2HD2 LEU 2 0.601 17.632 18.564
22 3HD2 LEU 2 3HD2 LEU 2 -1.019 18.312 18.295
23 H SER 3 H SER 3 0.520 15.932 12.778
24 HA SER 3 HA SER 3 -0.254 13.213 13.550
25 1HB SER 3 2HB SER 3 -0.549 14.146 10.643
26 2HB SER 3 3HB SER 3 -0.938 12.580 11.340
27 HG SER 3 HG SER 3 -2.831 13.719 11.150
28 H GLU 4 H GLU 4 1.817 12.226 13.679
29 HA GLU 4 HA GLU 4 4.046 13.366 12.124
30 1HB GLU 4 2HB GLU 4 3.764 11.311 14.250
31 2HB GLU 4 3HB GLU 4 5.103 11.239 13.149
32 1HG GLU 4 2HG GLU 4 5.629 13.587 13.753
33 2HG GLU 4 3HG GLU 4 4.433 13.430 15.049
34 H GLN 5 H GLN 5 5.112 11.890 10.702
35 HA GLN 5 HA GLN 5 3.300 9.970 9.286
36 1HB GLN 5 2HB GLN 5 5.593 11.641 8.226
37 2HB GLN 5 3HB GLN 5 4.710 10.395 7.347
38 1HG GLN 5 2HG GLN 5 2.847 12.378 8.435
39 2HG GLN 5 3HG GLN 5 4.127 13.179 7.547
40 1HE2 GLN 5 1HE2 GLN 5 2.500 10.036 6.997
41 2HE2 GLN 5 2HE2 GLN 5 2.047 10.350 5.342
42 H LYS 6 H LYS 6 4.290 7.952 8.746
43 HA LYS 6 HA LYS 6 7.199 7.835 9.004
44 1HB LYS 6 2HB LYS 6 5.468 5.679 10.188
45 2HB LYS 6 3HB LYS 6 7.200 5.542 9.950
46 1HG LYS 6 2HG LYS 6 6.177 7.809 11.697
47 2HG LYS 6 3HG LYS 6 6.126 6.163 12.267
48 1HD LYS 6 2HD LYS 6 8.036 7.113 13.136
49 2HD LYS 6 3HD LYS 6 8.539 5.867 12.006
50 1HE LYS 6 2HE LYS 6 8.455 8.814 11.169
51 2HE LYS 6 3HE LYS 6 9.746 8.223 12.207
52 1HZ LYS 6 1HZ LYS 6 10.488 8.101 9.998
53 2HZ LYS 6 2HZ LYS 6 10.259 6.552 10.476
54 3HZ LYS 6 3HZ LYS 6 9.233 7.308 9.447
55 H GLU 7 H GLU 7 8.096 6.416 7.648
56 HA GLU 7 HA GLU 7 6.599 5.424 5.358
57 1HB GLU 7 2HB GLU 7 9.481 4.708 5.731
58 2HB GLU 7 3HB GLU 7 8.595 5.228 4.298
59 1HG GLU 7 2HG GLU 7 10.142 6.923 4.699
60 2HG GLU 7 3HG GLU 7 8.660 7.609 5.378
61 H ILE 8 H ILE 8 6.280 3.223 4.990
62 HA ILE 8 HA ILE 8 7.513 1.261 6.870
63 HB ILE 8 HB ILE 8 5.347 -0.122 6.245
64 1HG1 ILE 8 2HG1 ILE 8 4.487 1.796 4.801
65 2HG1 ILE 8 3HG1 ILE 8 3.398 0.839 5.811
66 1HG2 ILE 8 1HG2 ILE 8 4.362 0.532 8.374
67 2HG2 ILE 8 2HG2 ILE 8 6.110 0.277 8.473
68 3HG2 ILE 8 3HG2 ILE 8 5.473 1.929 8.446
69 1HD1 ILE 8 1HD1 ILE 8 2.967 3.281 6.019
70 2HD1 ILE 8 2HD1 ILE 8 3.360 2.429 7.536
71 3HD1 ILE 8 3HD1 ILE 8 4.561 3.463 6.777
72 H ALA 9 H ALA 9 7.696 -0.918 5.825
73 HA ALA 9 HA ALA 9 7.951 -0.858 2.877
74 1HB ALA 9 1HB ALA 9 10.138 -1.952 3.054
75 2HB ALA 9 2HB ALA 9 10.206 -0.366 3.853
76 3HB ALA 9 3HB ALA 9 10.087 -1.843 4.826
77 H MET 10 H MET 10 6.862 -2.683 2.130
78 HA MET 10 HA MET 10 6.700 -5.098 3.865
79 1HB MET 10 2HB MET 10 4.294 -3.693 2.651
80 2HB MET 10 3HB MET 10 4.253 -5.257 3.438
81 1HG MET 10 2HG MET 10 4.695 -4.329 5.572
82 2HG MET 10 3HG MET 10 5.177 -2.765 4.925
83 1HE MET 10 1HE MET 10 2.952 -1.911 2.828
84 2HE MET 10 2HE MET 10 1.981 -0.950 3.957
85 3HE MET 10 3HE MET 10 3.755 -0.911 4.060
86 H GLN 11 H GLN 11 5.569 -6.893 2.509
87 HA GLN 11 HA GLN 11 6.783 -6.874 -0.216
88 1HB GLN 11 2HB GLN 11 6.042 -9.083 1.756
89 2HB GLN 11 3HB GLN 11 6.447 -9.408 0.073
90 1HG GLN 11 2HG GLN 11 8.226 -8.108 2.198
91 2HG GLN 11 3HG GLN 11 8.381 -9.745 1.548
92 1HE2 GLN 11 1HE2 GLN 11 8.218 -9.617 -1.087
93 2HE2 GLN 11 2HE2 GLN 11 9.090 -8.284 -1.822
94 H VAL 12 H VAL 12 5.524 -8.109 -1.856
95 HA VAL 12 HA VAL 12 2.627 -7.377 -1.698
96 HB VAL 12 HB VAL 12 4.552 -7.148 -4.054
97 1HG1 VAL 12 1HG1 VAL 12 2.286 -7.604 -4.848
98 2HG1 VAL 12 2HG1 VAL 12 1.617 -6.381 -3.739
99 3HG1 VAL 12 3HG1 VAL 12 2.644 -5.896 -5.101
100 1HG2 VAL 12 1HG2 VAL 12 5.040 -5.390 -2.413
101 2HG2 VAL 12 2HG2 VAL 12 4.185 -4.688 -3.787
102 3HG2 VAL 12 3HG2 VAL 12 3.305 -5.008 -2.280
103 H SER 13 H SER 13 1.157 -8.829 -2.761
104 HA SER 13 HA SER 13 2.137 -10.935 -4.464
105 1HB SER 13 2HB SER 13 0.980 -11.551 -1.712
106 2HB SER 13 3HB SER 13 0.884 -12.711 -3.043
107 HG SER 13 HG SER 13 3.378 -11.570 -2.467
108 H GLY 14 H GLY 14 0.089 -12.259 -5.155
109 1HA GLY 14 2HA GLY 14 -1.997 -12.250 -6.123
110 2HA GLY 14 3HA GLY 14 -2.513 -11.092 -4.882
111 H MET 15 H MET 15 -0.469 -11.274 -7.856
112 HA MET 15 HA MET 15 -1.408 -8.599 -8.696
113 1HB MET 15 2HB MET 15 0.857 -7.823 -9.009
114 2HB MET 15 3HB MET 15 0.649 -8.335 -7.334
115 1HG MET 15 2HG MET 15 2.736 -9.191 -7.856
116 2HG MET 15 3HG MET 15 1.693 -10.589 -8.079
117 1HE MET 15 1HE MET 15 2.576 -7.443 -10.401
118 2HE MET 15 2HE MET 15 4.092 -8.006 -9.657
119 3HE MET 15 3HE MET 15 3.832 -8.204 -11.405
120 H THR 16 H THR 16 -1.187 -8.200 -10.925
121 HA THR 16 HA THR 16 -0.751 -10.523 -12.715
122 HB THR 16 HB THR 16 -1.697 -8.647 -14.309
123 HG1 THR 16 1HG THR 16 -2.919 -7.098 -13.082
124 1HG2 THR 16 1HG2 THR 16 -2.985 -10.638 -13.646
125 2HG2 THR 16 2HG2 THR 16 -3.440 -9.861 -12.115
126 3HG2 THR 16 3HG2 THR 16 -4.022 -9.201 -13.661
127 H CYS 17 H CYS 17 -0.117 -6.990 -12.645
128 HA CYS 17 HA CYS 17 2.657 -7.449 -13.617
129 1HB CYS 17 2HB CYS 17 2.360 -5.835 -15.377
130 2HB CYS 17 3HB CYS 17 1.091 -7.056 -15.544
131 H ALA 18 H ALA 18 3.990 -5.535 -13.471
132 HA ALA 18 HA ALA 18 3.738 -4.249 -10.881
133 1HB ALA 18 1HB ALA 18 5.963 -3.369 -11.414
134 2HB ALA 18 2HB ALA 18 5.882 -5.103 -11.790
135 3HB ALA 18 3HB ALA 18 5.800 -3.908 -13.099
136 H ALA 19 H ALA 19 1.549 -3.461 -12.225
137 HA ALA 19 HA ALA 19 1.958 -0.539 -12.532
138 1HB ALA 19 1HB ALA 19 1.996 -1.467 -14.847
139 2HB ALA 19 2HB ALA 19 0.382 -2.160 -14.573
140 3HB ALA 19 3HB ALA 19 0.608 -0.404 -14.537
141 H CYS 20 H CYS 20 -0.524 -3.220 -12.521
142 HA CYS 20 HA CYS 20 -2.452 -1.657 -11.150
143 1HB CYS 20 2HB CYS 20 -1.948 -4.673 -10.839
144 2HB CYS 20 3HB CYS 20 -3.456 -3.801 -10.495
145 H ALA 21 H ALA 21 0.339 -3.501 -10.037
146 HA ALA 21 HA ALA 21 0.165 -3.232 -7.272
147 1HB ALA 21 1HB ALA 21 1.897 -4.466 -8.619
148 2HB ALA 21 2HB ALA 21 2.672 -2.901 -8.962
149 3HB ALA 21 3HB ALA 21 2.552 -3.506 -7.293
150 H ALA 22 H ALA 22 0.778 -0.670 -9.671
151 HA ALA 22 HA ALA 22 1.585 1.316 -7.660
152 1HB ALA 22 1HB ALA 22 0.661 1.737 -10.531
153 2HB ALA 22 2HB ALA 22 1.545 2.863 -9.489
154 3HB ALA 22 3HB ALA 22 2.345 1.389 -10.073
155 H ARG 23 H ARG 23 -1.209 0.503 -9.725
156 HA ARG 23 HA ARG 23 -2.912 2.605 -9.035
157 1HB ARG 23 2HB ARG 23 -3.604 -0.278 -9.706
158 2HB ARG 23 3HB ARG 23 -4.800 0.993 -9.581
159 1HG ARG 23 2HG ARG 23 -2.410 1.249 -11.457
160 2HG ARG 23 3HG ARG 23 -3.870 0.385 -11.926
161 1HD ARG 23 2HD ARG 23 -3.803 3.297 -11.000
162 2HD ARG 23 3HD ARG 23 -3.836 2.805 -12.678
163 HE ARG 23 HE ARG 23 -6.035 2.864 -10.771
164 1HH1 ARG 23 2HH2 ARG 23 -4.906 1.280 -13.706
165 2HH1 ARG 23 1HH2 ARG 23 -6.484 0.881 -14.307
166 1HH2 ARG 23 2HH1 ARG 23 -8.161 2.312 -11.501
167 2HH2 ARG 23 1HH1 ARG 23 -8.378 1.473 -13.002
168 H ILE 24 H ILE 24 -2.574 -0.548 -7.317
169 HA ILE 24 HA ILE 24 -4.556 0.015 -5.402
170 HB ILE 24 HB ILE 24 -3.619 -1.638 -3.957
171 1HG1 ILE 24 2HG1 ILE 24 -1.236 -1.286 -5.738
172 2HG1 ILE 24 3HG1 ILE 24 -1.333 -1.172 -3.970
173 1HG2 ILE 24 1HG2 ILE 24 -4.864 -2.171 -6.152
174 2HG2 ILE 24 2HG2 ILE 24 -3.284 -2.634 -6.805
175 3HG2 ILE 24 3HG2 ILE 24 -3.943 -3.455 -5.375
176 1HD1 ILE 24 1HD1 ILE 24 -1.680 -3.621 -3.843
177 2HD1 ILE 24 2HD1 ILE 24 -1.470 -3.695 -5.616
178 3HD1 ILE 24 3HD1 ILE 24 -0.128 -3.178 -4.594
179 H GLU 25 H GLU 25 -1.032 0.760 -5.070
180 HA GLU 25 HA GLU 25 -1.266 2.082 -2.587
181 1HB GLU 25 2HB GLU 25 0.760 1.931 -4.781
182 2HB GLU 25 3HB GLU 25 0.858 3.350 -3.731
183 1HG GLU 25 2HG GLU 25 2.263 1.518 -2.898
184 2HG GLU 25 3HG GLU 25 1.007 1.945 -1.731
185 H LYS 26 H LYS 26 -1.717 3.302 -5.881
186 HA LYS 26 HA LYS 26 -1.722 6.103 -5.031
187 1HB LYS 26 2HB LYS 26 -2.418 4.756 -7.643
188 2HB LYS 26 3HB LYS 26 -2.919 6.414 -7.312
189 1HG LYS 26 2HG LYS 26 -0.923 6.669 -8.428
190 2HG LYS 26 3HG LYS 26 -0.522 7.013 -6.739
191 1HD LYS 26 2HD LYS 26 0.480 4.832 -6.440
192 2HD LYS 26 3HD LYS 26 -0.108 4.309 -8.016
193 1HE LYS 26 2HE LYS 26 1.922 6.554 -7.589
194 2HE LYS 26 3HE LYS 26 2.349 4.879 -7.956
195 1HZ LYS 26 1HZ LYS 26 0.794 6.658 -9.715
196 2HZ LYS 26 2HZ LYS 26 2.350 6.188 -9.931
197 3HZ LYS 26 3HZ LYS 26 1.142 5.081 -10.031
198 H GLY 27 H GLY 27 -4.246 3.674 -5.775
199 1HA GLY 27 2HA GLY 27 -6.537 5.288 -5.190
200 2HA GLY 27 3HA GLY 27 -6.408 3.521 -5.034
201 H LEU 28 H LEU 28 -4.393 3.221 -3.202
202 HA LEU 28 HA LEU 28 -5.851 3.421 -0.811
203 1HB LEU 28 2HB LEU 28 -4.290 1.673 -1.251
204 2HB LEU 28 3HB LEU 28 -2.933 2.793 -1.309
205 HG LEU 28 HG LEU 28 -3.220 1.307 0.737
206 1HD1 LEU 28 1HD1 LEU 28 -2.989 4.281 1.226
207 2HD1 LEU 28 2HD1 LEU 28 -2.302 3.018 2.230
208 3HD1 LEU 28 3HD1 LEU 28 -1.683 3.260 0.594
209 1HD2 LEU 28 1HD2 LEU 28 -5.409 3.318 1.457
210 2HD2 LEU 28 2HD2 LEU 28 -5.601 1.593 1.109
211 3HD2 LEU 28 3HD2 LEU 28 -4.696 2.144 2.530
212 H LYS 29 H LYS 29 -3.174 5.499 -2.038
213 HA LYS 29 HA LYS 29 -2.812 7.223 0.066
214 1HB LYS 29 2HB LYS 29 -1.730 7.431 -2.192
215 2HB LYS 29 3HB LYS 29 -3.224 8.181 -2.782
216 1HG LYS 29 2HG LYS 29 -2.899 9.876 -0.783
217 2HG LYS 29 3HG LYS 29 -1.288 9.220 -0.666
218 1HD LYS 29 2HD LYS 29 -2.545 10.517 -3.151
219 2HD LYS 29 3HD LYS 29 -1.606 11.364 -1.911
220 1HE LYS 29 2HE LYS 29 0.126 9.336 -2.527
221 2HE LYS 29 3HE LYS 29 -0.642 9.520 -4.084
222 1HZ LYS 29 1HZ LYS 29 1.393 10.834 -3.560
223 2HZ LYS 29 2HZ LYS 29 0.154 11.790 -4.141
224 3HZ LYS 29 3HZ LYS 29 0.630 11.742 -2.539
225 H ARG 30 H ARG 30 -5.807 7.000 -1.858
226 HA ARG 30 HA ARG 30 -6.719 9.605 -1.129
227 1HB ARG 30 2HB ARG 30 -7.333 8.082 -3.107
228 2HB ARG 30 3HB ARG 30 -8.501 7.323 -2.017
229 1HG ARG 30 2HG ARG 30 -9.646 9.465 -1.714
230 2HG ARG 30 3HG ARG 30 -8.374 10.326 -2.591
231 1HD ARG 30 2HD ARG 30 -10.142 8.149 -3.788
232 2HD ARG 30 3HD ARG 30 -10.493 9.860 -3.945
233 HE ARG 30 HE ARG 30 -8.495 8.277 -5.371
234 1HH1 ARG 30 2HH2 ARG 30 -9.240 11.549 -4.324
235 2HH1 ARG 30 1HH2 ARG 30 -8.476 12.345 -5.664
236 1HH2 ARG 30 2HH1 ARG 30 -7.448 9.284 -7.178
237 2HH2 ARG 30 1HH1 ARG 30 -7.410 11.009 -7.314
238 H MET 31 H MET 31 -6.430 6.885 0.919
239 HA MET 31 HA MET 31 -8.823 7.480 2.523
240 1HB MET 31 2HB MET 31 -6.760 5.314 2.311
241 2HB MET 31 3HB MET 31 -7.368 5.621 3.923
242 1HG MET 31 2HG MET 31 -8.626 3.904 2.704
243 2HG MET 31 3HG MET 31 -9.607 5.218 3.312
244 1HE MET 31 1HE MET 31 -7.585 5.369 -0.203
245 2HE MET 31 2HE MET 31 -7.973 3.677 0.115
246 3HE MET 31 3HE MET 31 -8.797 4.558 -1.196
247 HA PRO 32 HA PRO 32 -7.029 10.247 5.305
248 1HB PRO 32 2HB PRO 32 -7.903 9.478 7.815
249 2HB PRO 32 3HB PRO 32 -8.946 10.206 6.563
250 1HG PRO 32 2HG PRO 32 -8.552 7.262 7.162
251 2HG PRO 32 3HG PRO 32 -10.103 8.142 6.990
252 1HD PRO 32 2HD PRO 32 -9.082 6.751 4.939
253 2HD PRO 32 3HD PRO 32 -9.796 8.358 4.623
254 H GLY 33 H GLY 33 -5.413 10.634 6.921
255 1HA GLY 33 2HA GLY 33 -3.433 10.319 7.953
256 2HA GLY 33 3HA GLY 33 -3.788 8.595 8.076
257 H VAL 34 H VAL 34 -4.033 8.153 5.131
258 HA VAL 34 HA VAL 34 -1.200 7.888 4.587
259 HB VAL 34 HB VAL 34 -3.477 7.496 2.651
260 1HG1 VAL 34 1HG1 VAL 34 -1.734 5.935 1.625
261 2HG1 VAL 34 2HG1 VAL 34 -1.145 7.589 1.704
262 3HG1 VAL 34 3HG1 VAL 34 -0.604 6.394 2.890
263 1HG2 VAL 34 1HG2 VAL 34 -3.362 5.075 3.318
264 2HG2 VAL 34 2HG2 VAL 34 -2.326 5.534 4.683
265 3HG2 VAL 34 3HG2 VAL 34 -4.000 6.113 4.582
266 H THR 35 H THR 35 0.099 9.265 3.506
267 HA THR 35 HA THR 35 -1.184 11.609 2.141
268 HB THR 35 HB THR 35 0.779 11.497 4.301
269 HG1 THR 35 1HG THR 35 -0.251 13.286 4.812
270 1HG2 THR 35 1HG2 THR 35 2.404 12.136 2.719
271 2HG2 THR 35 2HG2 THR 35 1.278 13.241 1.863
272 3HG2 THR 35 3HG2 THR 35 1.849 13.635 3.490
273 H ASP 36 H ASP 36 1.621 9.254 2.070
274 HA ASP 36 HA ASP 36 1.193 9.369 -0.732
275 1HB ASP 36 2HB ASP 36 3.438 10.911 0.205
276 2HB ASP 36 3HB ASP 36 4.065 9.472 -0.618
277 H ALA 37 H ALA 37 2.550 7.829 -1.926
278 HA ALA 37 HA ALA 37 3.053 5.364 -0.459
279 1HB ALA 37 1HB ALA 37 0.548 5.502 -0.402
280 2HB ALA 37 2HB ALA 37 0.536 5.581 -2.177
281 3HB ALA 37 3HB ALA 37 1.130 4.124 -1.349
282 H ASN 38 H ASN 38 4.143 3.804 -1.725
283 HA ASN 38 HA ASN 38 4.746 4.542 -4.524
284 1HB ASN 38 2HB ASN 38 7.291 4.331 -3.313
285 2HB ASN 38 3HB ASN 38 6.547 5.738 -4.044
286 1HD2 ASN 38 1HD2 ASN 38 6.010 4.102 -0.850
287 2HD2 ASN 38 2HD2 ASN 38 6.386 5.556 0.076
288 H VAL 39 H VAL 39 4.357 2.530 -5.341
289 HA VAL 39 HA VAL 39 5.185 0.198 -3.817
290 HB VAL 39 HB VAL 39 3.159 0.333 -5.318
291 1HG1 VAL 39 1HG1 VAL 39 5.171 -0.231 -7.550
292 2HG1 VAL 39 2HG1 VAL 39 3.423 -0.242 -7.667
293 3HG1 VAL 39 3HG1 VAL 39 4.261 1.288 -7.356
294 1HG2 VAL 39 1HG2 VAL 39 3.940 -1.702 -4.297
295 2HG2 VAL 39 2HG2 VAL 39 3.414 -2.034 -5.942
296 3HG2 VAL 39 3HG2 VAL 39 5.155 -1.941 -5.569
297 H ASN 40 H ASN 40 7.227 -0.726 -3.924
298 HA ASN 40 HA ASN 40 9.161 0.368 -5.933
299 1HB ASN 40 2HB ASN 40 9.640 0.887 -3.549
300 2HB ASN 40 3HB ASN 40 9.682 -0.843 -3.195
301 1HD2 ASN 40 1HD2 ASN 40 11.922 0.230 -2.479
302 2HD2 ASN 40 2HD2 ASN 40 13.197 0.083 -3.679
303 H LEU 41 H LEU 41 7.489 -1.253 -6.980
304 HA LEU 41 HA LEU 41 7.811 -4.014 -6.461
305 1HB LEU 41 2HB LEU 41 5.946 -2.523 -7.706
306 2HB LEU 41 3HB LEU 41 6.822 -3.042 -9.133
307 HG LEU 41 HG LEU 41 4.846 -4.379 -8.627
308 1HD1 LEU 41 1HD1 LEU 41 5.766 -6.577 -8.907
309 2HD1 LEU 41 2HD1 LEU 41 6.900 -5.458 -9.689
310 3HD1 LEU 41 3HD1 LEU 41 7.266 -6.140 -8.092
311 1HD2 LEU 41 1HD2 LEU 41 4.786 -4.172 -6.178
312 2HD2 LEU 41 2HD2 LEU 41 4.586 -5.832 -6.749
313 3HD2 LEU 41 3HD2 LEU 41 6.121 -5.331 -6.038
314 H ALA 42 H ALA 42 9.663 -1.768 -8.323
315 HA ALA 42 HA ALA 42 11.204 -3.304 -10.053
316 1HB ALA 42 1HB ALA 42 11.484 -0.866 -9.689
317 2HB ALA 42 2HB ALA 42 12.147 -1.198 -8.065
318 3HB ALA 42 3HB ALA 42 13.023 -1.742 -9.507
319 H THR 43 H THR 43 11.277 -3.251 -6.459
320 HA THR 43 HA THR 43 13.042 -5.641 -6.595
321 HB THR 43 HB THR 43 14.304 -3.685 -5.920
322 HG1 THR 43 1HG THR 43 15.222 -4.732 -4.095
323 1HG2 THR 43 1HG2 THR 43 12.460 -2.565 -4.571
324 2HG2 THR 43 2HG2 THR 43 12.795 -3.727 -3.276
325 3HG2 THR 43 3HG2 THR 43 14.056 -2.603 -3.802
326 H GLU 44 H GLU 44 10.298 -5.652 -6.822
327 HA GLU 44 HA GLU 44 8.308 -6.267 -5.914
328 1HB GLU 44 2HB GLU 44 10.255 -8.385 -4.932
329 2HB GLU 44 3HB GLU 44 8.493 -8.560 -4.967
330 1HG GLU 44 2HG GLU 44 8.522 -8.046 -7.440
331 2HG GLU 44 3HG GLU 44 10.291 -8.149 -7.382
332 H THR 45 H THR 45 9.083 -4.169 -4.339
333 HA THR 45 HA THR 45 8.210 -4.977 -1.594
334 HB THR 45 HB THR 45 10.290 -2.960 -2.558
335 HG1 THR 45 1HG THR 45 10.954 -5.163 -2.407
336 1HG2 THR 45 1HG2 THR 45 10.726 -2.571 -0.138
337 2HG2 THR 45 2HG2 THR 45 9.145 -1.963 -0.653
338 3HG2 THR 45 3HG2 THR 45 9.261 -3.498 0.252
339 H VAL 46 H VAL 46 6.874 -3.340 -0.539
340 HA VAL 46 HA VAL 46 5.936 -1.101 -2.271
341 HB VAL 46 HB VAL 46 4.090 -2.606 -2.226
342 1HG1 VAL 46 1HG1 VAL 46 4.660 -4.081 -0.348
343 2HG1 VAL 46 2HG1 VAL 46 4.434 -2.722 0.778
344 3HG1 VAL 46 3HG1 VAL 46 3.050 -3.399 -0.100
345 1HG2 VAL 46 1HG2 VAL 46 3.561 -0.218 -1.847
346 2HG2 VAL 46 2HG2 VAL 46 2.391 -1.313 -1.075
347 3HG2 VAL 46 3HG2 VAL 46 3.597 -0.489 -0.089
348 H ASN 47 H ASN 47 5.827 0.948 -1.239
349 HA ASN 47 HA ASN 47 6.555 0.974 1.625
350 1HB ASN 47 2HB ASN 47 7.671 2.649 -0.676
351 2HB ASN 47 3HB ASN 47 7.737 3.182 1.006
352 1HD2 ASN 47 1HD2 ASN 47 8.743 1.569 2.588
353 2HD2 ASN 47 2HD2 ASN 47 10.253 0.875 2.014
354 H VAL 48 H VAL 48 5.351 2.615 2.822
355 HA VAL 48 HA VAL 48 3.368 4.111 1.256
356 HB VAL 48 HB VAL 48 2.583 2.430 3.665
357 1HG1 VAL 48 1HG1 VAL 48 1.287 4.501 3.334
358 2HG1 VAL 48 2HG1 VAL 48 0.981 4.053 1.643
359 3HG1 VAL 48 3HG1 VAL 48 0.306 3.073 2.956
360 1HG2 VAL 48 1HG2 VAL 48 2.991 0.862 1.839
361 2HG2 VAL 48 2HG2 VAL 48 1.251 1.072 2.048
362 3HG2 VAL 48 3HG2 VAL 48 2.079 1.890 0.707
363 H ILE 49 H ILE 49 3.145 6.114 2.138
364 HA ILE 49 HA ILE 49 4.743 6.711 4.535
365 HB ILE 49 HB ILE 49 3.988 8.657 2.301
366 1HG1 ILE 49 2HG1 ILE 49 5.325 7.007 1.201
367 2HG1 ILE 49 3HG1 ILE 49 6.221 8.506 1.405
368 1HG2 ILE 49 1HG2 ILE 49 5.998 8.804 4.579
369 2HG2 ILE 49 2HG2 ILE 49 5.844 9.995 3.269
370 3HG2 ILE 49 3HG2 ILE 49 4.506 9.737 4.395
371 1HD1 ILE 49 1HD1 ILE 49 7.417 7.529 3.358
372 2HD1 ILE 49 2HD1 ILE 49 6.557 5.997 3.096
373 3HD1 ILE 49 3HD1 ILE 49 7.675 6.604 1.865
374 H TYR 50 H TYR 50 3.113 6.582 6.117
375 HA TYR 50 HA TYR 50 0.688 8.245 5.703
376 1HB TYR 50 2HB TYR 50 -0.791 6.566 6.606
377 2HB TYR 50 3HB TYR 50 -0.034 6.049 5.113
378 HD1 TYR 50 HD1 TYR 50 1.020 5.682 8.774
379 HD2 TYR 50 HD2 TYR 50 -0.218 3.773 5.113
380 HE1 TYR 50 HE1 TYR 50 1.373 3.485 9.796
381 HE2 TYR 50 HE2 TYR 50 0.102 1.568 6.164
382 HH TYR 50 HH TYR 50 0.669 0.447 8.066
383 H ASP 51 H ASP 51 -0.515 8.554 7.668
384 HA ASP 51 HA ASP 51 1.371 9.189 9.831
385 1HB ASP 51 2HB ASP 51 -1.577 9.832 9.696
386 2HB ASP 51 3HB ASP 51 -0.320 10.452 10.805
387 HA PRO 52 HA PRO 52 -0.086 5.243 11.580
388 1HB PRO 52 2HB PRO 52 1.779 4.822 13.506
389 2HB PRO 52 3HB PRO 52 2.087 4.573 11.770
390 1HG PRO 52 2HG PRO 52 2.708 7.061 13.403
391 2HG PRO 52 3HG PRO 52 3.822 6.142 12.345
392 1HD PRO 52 2HD PRO 52 2.555 8.342 11.457
393 2HD PRO 52 3HD PRO 52 2.741 6.920 10.389
394 H ALA 53 H ALA 53 -0.520 8.345 12.704
395 HA ALA 53 HA ALA 53 -1.535 7.659 15.383
396 1HB ALA 53 1HB ALA 53 -1.502 10.235 13.751
397 2HB ALA 53 2HB ALA 53 -2.070 10.063 15.427
398 3HB ALA 53 3HB ALA 53 -0.353 9.812 15.043
399 H GLU 54 H GLU 54 -2.421 7.992 11.980
400 HA GLU 54 HA GLU 54 -5.284 8.031 12.688
401 1HB GLU 54 2HB GLU 54 -3.809 9.847 11.064
402 2HB GLU 54 3HB GLU 54 -4.780 8.865 9.958
403 1HG GLU 54 2HG GLU 54 -6.816 9.399 11.208
404 2HG GLU 54 3HG GLU 54 -5.867 10.392 12.335
405 H THR 55 H THR 55 -3.052 6.997 10.067
406 HA THR 55 HA THR 55 -4.538 4.508 9.847
407 HB THR 55 HB THR 55 -2.901 4.267 7.640
408 HG1 THR 55 1HG THR 55 -4.020 6.642 7.283
409 1HG2 THR 55 1HG2 THR 55 -4.997 4.806 6.507
410 2HG2 THR 55 2HG2 THR 55 -5.305 3.745 7.917
411 3HG2 THR 55 3HG2 THR 55 -5.671 5.502 8.007
412 H GLY 56 H GLY 56 -2.507 2.861 8.890
413 1HA GLY 56 2HA GLY 56 -0.632 2.022 10.687
414 2HA GLY 56 3HA GLY 56 -2.234 1.703 11.408
415 H THR 57 H THR 57 -2.396 -0.523 10.911
416 HA THR 57 HA THR 57 -1.665 -1.626 8.295
417 HB THR 57 HB THR 57 -2.412 -3.730 9.587
418 HG1 THR 57 1HG THR 57 -2.537 -3.347 11.865
419 1HG2 THR 57 1HG2 THR 57 -0.318 -3.754 10.943
420 2HG2 THR 57 2HG2 THR 57 -0.020 -3.048 9.345
421 3HG2 THR 57 3HG2 THR 57 -0.163 -1.994 10.766
422 H ALA 58 H ALA 58 -4.383 -0.855 10.374
423 HA ALA 58 HA ALA 58 -6.323 -2.392 9.362
424 1HB ALA 58 1HB ALA 58 -6.674 0.419 10.456
425 2HB ALA 58 2HB ALA 58 -7.947 -0.819 10.345
426 3HB ALA 58 3HB ALA 58 -6.550 -1.075 11.408
427 H ALA 59 H ALA 59 -5.927 0.949 8.292
428 HA ALA 59 HA ALA 59 -8.310 0.621 6.594
429 1HB ALA 59 1HB ALA 59 -6.275 2.815 6.210
430 2HB ALA 59 2HB ALA 59 -7.987 2.814 5.780
431 3HB ALA 59 3HB ALA 59 -7.527 2.867 7.495
432 H ILE 60 H ILE 60 -4.853 0.484 6.178
433 HA ILE 60 HA ILE 60 -4.698 0.144 3.369
434 HB ILE 60 HB ILE 60 -2.913 -0.491 5.741
435 1HG1 ILE 60 2HG1 ILE 60 -1.428 1.024 4.362
436 2HG1 ILE 60 3HG1 ILE 60 -2.737 1.096 3.175
437 1HG2 ILE 60 1HG2 ILE 60 -2.365 -1.341 2.862
438 2HG2 ILE 60 2HG2 ILE 60 -1.172 -1.307 4.175
439 3HG2 ILE 60 3HG2 ILE 60 -2.526 -2.431 4.259
440 1HD1 ILE 60 1HD1 ILE 60 -2.994 2.038 6.078
441 2HD1 ILE 60 2HD1 ILE 60 -2.511 3.095 4.745
442 3HD1 ILE 60 3HD1 ILE 60 -4.122 2.391 4.749
443 H GLN 61 H GLN 61 -4.944 -2.367 5.961
444 HA GLN 61 HA GLN 61 -4.933 -4.493 4.049
445 1HB GLN 61 2HB GLN 61 -5.338 -4.204 6.926
446 2HB GLN 61 3HB GLN 61 -6.485 -5.329 6.205
447 1HG GLN 61 2HG GLN 61 -4.638 -6.617 6.906
448 2HG GLN 61 3HG GLN 61 -4.678 -6.607 5.143
449 1HE2 GLN 61 1HE2 GLN 61 -3.417 -3.616 6.625
450 2HE2 GLN 61 2HE2 GLN 61 -1.740 -4.044 6.345
451 H GLU 62 H GLU 62 -7.634 -2.737 5.670
452 HA GLU 62 HA GLU 62 -9.817 -4.012 4.517
453 1HB GLU 62 2HB GLU 62 -9.254 -1.268 5.582
454 2HB GLU 62 3HB GLU 62 -10.651 -1.391 4.524
455 1HG GLU 62 2HG GLU 62 -11.376 -1.683 6.796
456 2HG GLU 62 3HG GLU 62 -11.575 -3.218 5.944
457 H LYS 63 H LYS 63 -8.046 -1.181 3.095
458 HA LYS 63 HA LYS 63 -9.627 -1.305 0.744
459 1HB LYS 63 2HB LYS 63 -7.163 0.130 1.699
460 2HB LYS 63 3HB LYS 63 -7.638 0.269 0.031
461 1HG LYS 63 2HG LYS 63 -9.559 0.876 2.316
462 2HG LYS 63 3HG LYS 63 -8.400 2.032 1.666
463 1HD LYS 63 2HD LYS 63 -10.558 2.469 0.732
464 2HD LYS 63 3HD LYS 63 -9.421 1.994 -0.541
465 1HE LYS 63 2HE LYS 63 -10.487 -0.136 -0.825
466 2HE LYS 63 3HE LYS 63 -11.446 0.067 0.671
467 1HZ LYS 63 1HZ LYS 63 -12.720 0.462 -1.306
468 2HZ LYS 63 2HZ LYS 63 -12.619 1.841 -0.418
469 3HZ LYS 63 3HZ LYS 63 -11.714 1.667 -1.785
470 H ILE 64 H ILE 64 -6.432 -2.643 1.567
471 HA ILE 64 HA ILE 64 -5.344 -3.283 -0.891
472 HB ILE 64 HB ILE 64 -5.259 -4.238 1.904
473 1HG1 ILE 64 2HG1 ILE 64 -3.951 -2.278 1.037
474 2HG1 ILE 64 3HG1 ILE 64 -3.034 -3.580 1.797
475 1HG2 ILE 64 1HG2 ILE 64 -3.555 -5.926 1.336
476 2HG2 ILE 64 2HG2 ILE 64 -5.243 -6.349 1.037
477 3HG2 ILE 64 3HG2 ILE 64 -4.199 -5.894 -0.332
478 1HD1 ILE 64 1HD1 ILE 64 -2.554 -4.452 -0.532
479 2HD1 ILE 64 2HD1 ILE 64 -3.226 -2.932 -1.150
480 3HD1 ILE 64 3HD1 ILE 64 -1.813 -2.902 -0.072
481 H GLU 65 H GLU 65 -7.509 -5.150 1.321
482 HA GLU 65 HA GLU 65 -8.200 -7.311 -0.351
483 1HB GLU 65 2HB GLU 65 -9.585 -5.818 1.897
484 2HB GLU 65 3HB GLU 65 -10.465 -6.981 0.888
485 1HG GLU 65 2HG GLU 65 -8.137 -8.355 1.694
486 2HG GLU 65 3HG GLU 65 -8.707 -7.489 3.125
487 H LYS 66 H LYS 66 -10.102 -4.248 0.086
488 HA LYS 66 HA LYS 66 -12.034 -5.054 -1.872
489 1HB LYS 66 2HB LYS 66 -11.437 -2.493 -0.410
490 2HB LYS 66 3HB LYS 66 -12.425 -2.427 -1.863
491 1HG LYS 66 2HG LYS 66 -13.942 -2.553 -0.136
492 2HG LYS 66 3HG LYS 66 -13.997 -4.135 -0.893
493 1HD LYS 66 2HD LYS 66 -12.317 -3.586 1.580
494 2HD LYS 66 3HD LYS 66 -14.048 -3.848 1.724
495 1HE LYS 66 2HE LYS 66 -13.956 -6.085 0.922
496 2HE LYS 66 3HE LYS 66 -12.319 -5.899 0.321
497 1HZ LYS 66 1HZ LYS 66 -13.112 -6.000 3.166
498 2HZ LYS 66 2HZ LYS 66 -12.225 -7.109 2.350
499 3HZ LYS 66 3HZ LYS 66 -11.590 -5.655 2.644
500 H LEU 67 H LEU 67 -8.982 -3.413 -2.274
501 HA LEU 67 HA LEU 67 -9.342 -2.602 -5.035
502 1HB LEU 67 2HB LEU 67 -6.934 -2.957 -3.240
503 2HB LEU 67 3HB LEU 67 -6.818 -2.407 -4.908
504 HG LEU 67 HG LEU 67 -8.621 -0.953 -2.935
505 1HD1 LEU 67 1HD1 LEU 67 -5.675 -0.440 -3.465
506 2HD1 LEU 67 2HD1 LEU 67 -6.753 0.592 -2.503
507 3HD1 LEU 67 3HD1 LEU 67 -6.354 -1.046 -1.951
508 1HD2 LEU 67 1HD2 LEU 67 -8.915 -0.402 -5.337
509 2HD2 LEU 67 2HD2 LEU 67 -8.193 0.951 -4.455
510 3HD2 LEU 67 3HD2 LEU 67 -7.175 -0.079 -5.478
511 H GLY 68 H GLY 68 -8.688 -5.619 -3.405
512 1HA GLY 68 2HA GLY 68 -8.775 -7.702 -4.345
513 2HA GLY 68 3HA GLY 68 -8.572 -7.031 -5.967
514 H TYR 69 H TYR 69 -6.505 -6.529 -3.028
515 HA TYR 69 HA TYR 69 -4.296 -8.083 -4.313
516 1HB TYR 69 2HB TYR 69 -4.475 -5.209 -3.722
517 2HB TYR 69 3HB TYR 69 -3.174 -5.953 -2.822
518 HD1 TYR 69 HD1 TYR 69 -1.132 -6.563 -3.882
519 HD2 TYR 69 HD2 TYR 69 -4.633 -5.752 -6.262
520 HE1 TYR 69 HE1 TYR 69 0.268 -6.388 -5.894
521 HE2 TYR 69 HE2 TYR 69 -3.252 -5.593 -8.265
522 HH TYR 69 HH TYR 69 -1.086 -5.622 -9.119
523 H HIS 70 H HIS 70 -2.508 -8.437 -2.605
524 HA HIS 70 HA HIS 70 -3.365 -8.132 0.135
525 1HB HIS 70 2HB HIS 70 -4.308 -10.375 -0.542
526 2HB HIS 70 3HB HIS 70 -2.654 -10.926 -0.824
527 HD1 HIS 70 1HD HIS 70 -2.663 -12.687 1.157
528 HD2 HIS 70 2HD HIS 70 -3.846 -8.803 2.263
529 HE1 HIS 70 1HE HIS 70 -2.917 -12.684 3.698
530 H VAL 71 H VAL 71 -1.616 -7.434 1.288
531 HA VAL 71 HA VAL 71 1.040 -7.551 0.062
532 HB VAL 71 HB VAL 71 1.640 -6.180 2.019
533 1HG1 VAL 71 1HG1 VAL 71 -0.750 -5.138 0.492
534 2HG1 VAL 71 2HG1 VAL 71 0.462 -4.145 1.319
535 3HG1 VAL 71 3HG1 VAL 71 0.927 -5.125 -0.088
536 1HG2 VAL 71 1HG2 VAL 71 -1.308 -6.141 2.769
537 2HG2 VAL 71 2HG2 VAL 71 -0.031 -6.989 3.668
538 3HG2 VAL 71 3HG2 VAL 71 0.007 -5.227 3.515
539 H VAL 72 H VAL 72 2.867 -8.120 1.611
540 HA VAL 72 HA VAL 72 2.221 -10.436 3.354
541 HB VAL 72 HB VAL 72 4.453 -10.457 1.379
542 1HG1 VAL 72 1HG1 VAL 72 3.234 -12.654 3.106
543 2HG1 VAL 72 2HG1 VAL 72 4.584 -12.850 1.969
544 3HG1 VAL 72 3HG1 VAL 72 4.791 -11.859 3.415
545 1HG2 VAL 72 1HG2 VAL 72 1.719 -11.771 1.188
546 2HG2 VAL 72 2HG2 VAL 72 2.430 -10.597 0.055
547 3HG2 VAL 72 3HG2 VAL 72 3.117 -12.219 0.192
548 H ILE 73 H ILE 73 3.642 -10.637 5.101
549 HA ILE 73 HA ILE 73 5.262 -8.190 5.704
550 HB ILE 73 HB ILE 73 3.538 -9.748 7.616
551 1HG1 ILE 73 2HG1 ILE 73 2.079 -8.603 6.007
552 2HG1 ILE 73 3HG1 ILE 73 2.041 -7.898 7.610
553 1HG2 ILE 73 1HG2 ILE 73 5.417 -8.658 8.727
554 2HG2 ILE 73 2HG2 ILE 73 5.140 -7.159 7.835
555 3HG2 ILE 73 3HG2 ILE 73 3.958 -7.713 9.044
556 1HD1 ILE 73 1HD1 ILE 73 1.974 -6.186 5.855
557 2HD1 ILE 73 2HD1 ILE 73 3.378 -5.990 6.913
558 3HD1 ILE 73 3HD1 ILE 73 3.571 -6.684 5.287
559 H GLU 74 H GLU 74 7.032 -9.638 4.746
560 HA GLU 74 HA GLU 74 7.728 -11.957 6.110
561 1HB GLU 74 2HB GLU 74 9.101 -10.286 3.993
562 2HB GLU 74 3HB GLU 74 9.708 -11.815 4.590
563 1HG GLU 74 2HG GLU 74 7.505 -12.895 3.944
564 2HG GLU 74 3HG GLU 74 7.063 -11.373 3.144
565 H GLY 75 H GLY 75 8.138 -9.017 7.217
566 1HA GLY 75 2HA GLY 75 9.378 -8.204 9.073
567 2HA GLY 75 3HA GLY 75 10.352 -9.682 9.055
568 H ARG 76 H ARG 76 9.907 -6.457 7.621
569 HA ARG 76 HA ARG 76 12.655 -6.244 6.739
570 1HB ARG 76 2HB ARG 76 10.348 -6.523 4.886
571 2HB ARG 76 3HB ARG 76 11.003 -4.898 4.837
572 1HG ARG 76 2HG ARG 76 11.980 -6.198 3.108
573 2HG ARG 76 3HG ARG 76 13.227 -5.731 4.267
574 1HD ARG 76 2HD ARG 76 11.814 -8.436 4.393
575 2HD ARG 76 3HD ARG 76 13.157 -8.210 3.289
576 HE ARG 76 HE ARG 76 13.207 -8.488 6.185
577 1HH1 ARG 76 2HH2 ARG 76 14.963 -7.102 3.480
578 2HH1 ARG 76 1HH2 ARG 76 16.521 -7.079 4.253
579 1HH2 ARG 76 2HH1 ARG 76 15.216 -8.460 7.284
580 2HH2 ARG 76 1HH1 ARG 76 16.661 -7.872 6.513
Start of MODEL 20
1 1H MET 1 H1 MET 1 3.323 16.578 17.995
2 2H MET 1 H2 MET 1 4.598 17.620 18.098
3 3H MET 1 H3 MET 1 3.049 18.095 18.526
4 HA MET 1 HA MET 1 3.413 19.008 16.409
5 1HB MET 1 2HB MET 1 3.946 17.396 14.500
6 2HB MET 1 3HB MET 1 5.276 17.750 15.601
7 1HG MET 1 2HG MET 1 3.539 15.316 16.095
8 2HG MET 1 3HG MET 1 4.807 15.272 14.877
9 1HE MET 1 1HE MET 1 4.305 13.915 18.264
10 2HE MET 1 2HE MET 1 4.998 13.140 16.828
11 3HE MET 1 3HE MET 1 5.999 13.366 18.270
12 H LEU 2 H LEU 2 1.978 18.416 14.375
13 HA LEU 2 HA LEU 2 -0.594 17.187 15.164
14 1HB LEU 2 2HB LEU 2 0.540 18.627 12.740
15 2HB LEU 2 3HB LEU 2 -0.825 17.546 12.518
16 HG LEU 2 HG LEU 2 -2.155 18.756 14.182
17 1HD1 LEU 2 1HD1 LEU 2 -1.435 21.034 14.881
18 2HD1 LEU 2 2HD1 LEU 2 -0.416 19.777 15.589
19 3HD1 LEU 2 3HD1 LEU 2 0.178 20.726 14.205
20 1HD2 LEU 2 1HD2 LEU 2 -2.303 19.252 11.766
21 2HD2 LEU 2 2HD2 LEU 2 -2.596 20.701 12.743
22 3HD2 LEU 2 3HD2 LEU 2 -1.029 20.479 11.934
23 H SER 3 H SER 3 -1.302 15.567 13.211
24 HA SER 3 HA SER 3 -0.453 13.134 13.089
25 1HB SER 3 2HB SER 3 -0.943 14.988 10.712
26 2HB SER 3 3HB SER 3 -1.089 13.229 10.659
27 HG SER 3 HG SER 3 -2.735 13.298 12.081
28 H GLU 4 H GLU 4 1.506 12.263 13.175
29 HA GLU 4 HA GLU 4 3.874 13.436 11.948
30 1HB GLU 4 2HB GLU 4 3.255 11.155 13.719
31 2HB GLU 4 3HB GLU 4 4.594 10.872 12.636
32 1HG GLU 4 2HG GLU 4 5.483 13.106 13.431
33 2HG GLU 4 3HG GLU 4 4.262 12.962 14.706
34 H GLN 5 H GLN 5 5.220 11.568 10.673
35 HA GLN 5 HA GLN 5 3.469 10.102 8.828
36 1HB GLN 5 2HB GLN 5 5.826 11.837 8.099
37 2HB GLN 5 3HB GLN 5 5.147 10.659 6.981
38 1HG GLN 5 2HG GLN 5 3.263 12.742 8.115
39 2HG GLN 5 3HG GLN 5 4.503 13.270 6.994
40 1HE2 GLN 5 1HE2 GLN 5 2.708 10.119 6.979
41 2HE2 GLN 5 2HE2 GLN 5 1.850 10.485 5.490
42 H LYS 6 H LYS 6 4.397 8.086 8.323
43 HA LYS 6 HA LYS 6 7.250 7.783 8.569
44 1HB LYS 6 2HB LYS 6 5.440 5.941 10.186
45 2HB LYS 6 3HB LYS 6 7.071 5.506 9.664
46 1HG LYS 6 2HG LYS 6 7.903 7.662 10.730
47 2HG LYS 6 3HG LYS 6 6.347 7.779 11.550
48 1HD LYS 6 2HD LYS 6 8.226 5.370 11.717
49 2HD LYS 6 3HD LYS 6 8.274 6.749 12.830
50 1HE LYS 6 2HE LYS 6 5.914 6.336 13.485
51 2HE LYS 6 3HE LYS 6 5.872 4.902 12.425
52 1HZ LYS 6 1HZ LYS 6 7.577 3.937 13.797
53 2HZ LYS 6 2HZ LYS 6 7.636 5.281 14.750
54 3HZ LYS 6 3HZ LYS 6 6.278 4.358 14.716
55 H GLU 7 H GLU 7 8.018 5.902 7.519
56 HA GLU 7 HA GLU 7 6.494 5.360 5.054
57 1HB GLU 7 2HB GLU 7 9.511 5.403 5.358
58 2HB GLU 7 3HB GLU 7 8.481 5.610 3.945
59 1HG GLU 7 2HG GLU 7 9.348 7.754 4.414
60 2HG GLU 7 3HG GLU 7 7.731 7.838 5.135
61 H ILE 8 H ILE 8 5.646 3.372 5.756
62 HA ILE 8 HA ILE 8 7.393 1.401 7.039
63 HB ILE 8 HB ILE 8 4.537 1.367 6.214
64 1HG1 ILE 8 2HG1 ILE 8 4.178 1.387 8.795
65 2HG1 ILE 8 3HG1 ILE 8 5.885 1.799 8.959
66 1HG2 ILE 8 1HG2 ILE 8 5.331 -0.830 6.351
67 2HG2 ILE 8 2HG2 ILE 8 6.101 -0.465 7.940
68 3HG2 ILE 8 3HG2 ILE 8 4.311 -0.475 7.750
69 1HD1 ILE 8 1HD1 ILE 8 4.020 3.440 7.260
70 2HD1 ILE 8 2HD1 ILE 8 4.036 3.625 9.034
71 3HD1 ILE 8 3HD1 ILE 8 5.512 3.938 8.106
72 H ALA 9 H ALA 9 7.360 -0.819 6.007
73 HA ALA 9 HA ALA 9 7.515 -0.798 3.050
74 1HB ALA 9 1HB ALA 9 9.797 -0.195 3.908
75 2HB ALA 9 2HB ALA 9 9.813 -1.701 4.839
76 3HB ALA 9 3HB ALA 9 9.752 -1.758 3.065
77 H MET 10 H MET 10 6.740 -2.786 2.272
78 HA MET 10 HA MET 10 7.096 -5.245 3.809
79 1HB MET 10 2HB MET 10 4.613 -5.777 3.760
80 2HB MET 10 3HB MET 10 5.187 -4.701 5.029
81 1HG MET 10 2HG MET 10 4.244 -3.355 2.551
82 2HG MET 10 3HG MET 10 3.029 -4.239 3.449
83 1HE MET 10 1HE MET 10 4.071 -0.092 4.243
84 2HE MET 10 2HE MET 10 5.193 -1.092 3.309
85 3HE MET 10 3HE MET 10 3.501 -0.984 2.796
86 H GLN 11 H GLN 11 5.760 -7.082 2.597
87 HA GLN 11 HA GLN 11 6.617 -6.882 -0.240
88 1HB GLN 11 2HB GLN 11 6.175 -9.177 1.738
89 2HB GLN 11 3HB GLN 11 6.302 -9.461 0.007
90 1HG GLN 11 2HG GLN 11 8.416 -8.125 1.774
91 2HG GLN 11 3HG GLN 11 8.476 -9.788 1.159
92 1HE2 GLN 11 1HE2 GLN 11 7.944 -9.852 -1.380
93 2HE2 GLN 11 2HE2 GLN 11 8.548 -8.501 -2.314
94 H VAL 12 H VAL 12 5.220 -8.017 -1.832
95 HA VAL 12 HA VAL 12 2.356 -7.302 -1.310
96 HB VAL 12 HB VAL 12 3.956 -7.052 -3.892
97 1HG1 VAL 12 1HG1 VAL 12 1.542 -7.247 -4.288
98 2HG1 VAL 12 2HG1 VAL 12 1.208 -6.030 -3.033
99 3HG1 VAL 12 3HG1 VAL 12 2.043 -5.569 -4.528
100 1HG2 VAL 12 1HG2 VAL 12 3.247 -4.985 -1.784
101 2HG2 VAL 12 2HG2 VAL 12 4.888 -5.444 -2.303
102 3HG2 VAL 12 3HG2 VAL 12 3.822 -4.576 -3.408
103 H SER 13 H SER 13 0.736 -8.623 -2.495
104 HA SER 13 HA SER 13 1.681 -10.776 -4.164
105 1HB SER 13 2HB SER 13 1.984 -11.841 -1.961
106 2HB SER 13 3HB SER 13 0.279 -11.523 -1.563
107 HG SER 13 HG SER 13 0.706 -13.654 -2.424
108 H GLY 14 H GLY 14 -0.366 -12.200 -4.638
109 1HA GLY 14 2HA GLY 14 -2.267 -12.222 -5.978
110 2HA GLY 14 3HA GLY 14 -2.940 -11.054 -4.826
111 H MET 15 H MET 15 -0.769 -11.310 -7.704
112 HA MET 15 HA MET 15 -1.659 -8.667 -8.662
113 1HB MET 15 2HB MET 15 0.667 -7.902 -8.909
114 2HB MET 15 3HB MET 15 0.249 -8.216 -7.215
115 1HG MET 15 2HG MET 15 2.409 -9.004 -7.441
116 2HG MET 15 3HG MET 15 1.418 -10.460 -7.443
117 1HE MET 15 1HE MET 15 3.393 -11.913 -8.277
118 2HE MET 15 2HE MET 15 4.428 -11.496 -9.663
119 3HE MET 15 3HE MET 15 4.455 -10.483 -8.200
120 H THR 16 H THR 16 -1.171 -8.300 -10.896
121 HA THR 16 HA THR 16 -0.484 -10.665 -12.532
122 HB THR 16 HB THR 16 -1.181 -8.717 -14.287
123 HG1 THR 16 1HG THR 16 -2.225 -7.136 -13.315
124 1HG2 THR 16 1HG2 THR 16 -2.283 -10.878 -14.119
125 2HG2 THR 16 2HG2 THR 16 -3.099 -10.402 -12.614
126 3HG2 THR 16 3HG2 THR 16 -3.507 -9.599 -14.150
127 H CYS 17 H CYS 17 0.252 -7.114 -12.558
128 HA CYS 17 HA CYS 17 3.064 -7.685 -13.280
129 1HB CYS 17 2HB CYS 17 2.640 -6.129 -15.315
130 2HB CYS 17 3HB CYS 17 2.084 -7.802 -15.426
131 H ALA 18 H ALA 18 4.291 -5.684 -13.544
132 HA ALA 18 HA ALA 18 4.043 -4.142 -11.160
133 1HB ALA 18 1HB ALA 18 5.952 -3.827 -13.511
134 2HB ALA 18 2HB ALA 18 6.182 -3.179 -11.874
135 3HB ALA 18 3HB ALA 18 6.180 -4.931 -12.136
136 H ALA 19 H ALA 19 1.830 -3.632 -12.929
137 HA ALA 19 HA ALA 19 1.999 -0.659 -13.223
138 1HB ALA 19 1HB ALA 19 0.236 -2.634 -14.739
139 2HB ALA 19 2HB ALA 19 0.178 -0.863 -14.867
140 3HB ALA 19 3HB ALA 19 1.623 -1.747 -15.401
141 H CYS 20 H CYS 20 -0.063 -3.515 -12.354
142 HA CYS 20 HA CYS 20 -2.204 -1.924 -11.447
143 1HB CYS 20 2HB CYS 20 -1.507 -4.809 -10.688
144 2HB CYS 20 3HB CYS 20 -3.112 -4.053 -10.636
145 H ALA 21 H ALA 21 0.529 -3.386 -9.736
146 HA ALA 21 HA ALA 21 -0.172 -2.694 -7.109
147 1HB ALA 21 1HB ALA 21 2.651 -2.612 -8.220
148 2HB ALA 21 2HB ALA 21 2.100 -3.026 -6.572
149 3HB ALA 21 3HB ALA 21 1.770 -4.124 -7.906
150 H ALA 22 H ALA 22 0.874 -0.556 -9.770
151 HA ALA 22 HA ALA 22 1.489 1.701 -8.024
152 1HB ALA 22 1HB ALA 22 0.569 1.743 -10.927
153 2HB ALA 22 2HB ALA 22 1.364 3.035 -10.035
154 3HB ALA 22 3HB ALA 22 2.263 1.547 -10.412
155 H ARG 23 H ARG 23 -1.340 0.475 -9.840
156 HA ARG 23 HA ARG 23 -3.093 2.657 -9.298
157 1HB ARG 23 2HB ARG 23 -3.778 -0.283 -9.769
158 2HB ARG 23 3HB ARG 23 -4.916 1.041 -9.783
159 1HG ARG 23 2HG ARG 23 -2.562 0.661 -11.705
160 2HG ARG 23 3HG ARG 23 -4.264 0.363 -12.061
161 1HD ARG 23 2HD ARG 23 -2.936 3.038 -11.495
162 2HD ARG 23 3HD ARG 23 -3.644 2.482 -13.021
163 HE ARG 23 HE ARG 23 -5.738 2.297 -11.242
164 1HH1 ARG 23 2HH2 ARG 23 -3.673 4.888 -12.406
165 2HH1 ARG 23 1HH2 ARG 23 -4.795 6.173 -12.080
166 1HH2 ARG 23 2HH1 ARG 23 -7.263 3.958 -10.751
167 2HH2 ARG 23 1HH1 ARG 23 -6.917 5.611 -11.138
168 H ILE 24 H ILE 24 -2.577 -0.443 -7.506
169 HA ILE 24 HA ILE 24 -4.526 0.230 -5.564
170 HB ILE 24 HB ILE 24 -3.866 -1.399 -4.167
171 1HG1 ILE 24 2HG1 ILE 24 -1.169 -1.264 -5.398
172 2HG1 ILE 24 3HG1 ILE 24 -1.671 -0.990 -3.712
173 1HG2 ILE 24 1HG2 ILE 24 -4.013 -3.270 -5.538
174 2HG2 ILE 24 2HG2 ILE 24 -4.719 -1.995 -6.527
175 3HG2 ILE 24 3HG2 ILE 24 -3.059 -2.543 -6.854
176 1HD1 ILE 24 1HD1 ILE 24 -2.266 -3.428 -3.579
177 2HD1 ILE 24 2HD1 ILE 24 -1.529 -3.590 -5.204
178 3HD1 ILE 24 3HD1 ILE 24 -0.533 -3.101 -3.826
179 H GLU 25 H GLU 25 -0.952 0.719 -5.190
180 HA GLU 25 HA GLU 25 -1.111 2.217 -2.866
181 1HB GLU 25 2HB GLU 25 0.851 2.018 -5.094
182 2HB GLU 25 3HB GLU 25 0.987 3.462 -4.071
183 1HG GLU 25 2HG GLU 25 2.350 1.531 -3.255
184 2HG GLU 25 3HG GLU 25 1.205 2.143 -2.061
185 H LYS 26 H LYS 26 -1.703 3.476 -6.148
186 HA LYS 26 HA LYS 26 -1.736 6.221 -5.189
187 1HB LYS 26 2HB LYS 26 -2.403 4.970 -7.833
188 2HB LYS 26 3HB LYS 26 -2.972 6.592 -7.439
189 1HG LYS 26 2HG LYS 26 -0.947 6.971 -8.520
190 2HG LYS 26 3HG LYS 26 -0.588 7.246 -6.808
191 1HD LYS 26 2HD LYS 26 0.494 5.070 -6.638
192 2HD LYS 26 3HD LYS 26 -0.036 4.698 -8.290
193 1HE LYS 26 2HE LYS 26 1.323 6.523 -9.219
194 2HE LYS 26 3HE LYS 26 1.831 7.009 -7.592
195 1HZ LYS 26 1HZ LYS 26 2.464 4.426 -8.862
196 2HZ LYS 26 2HZ LYS 26 3.487 5.702 -8.725
197 3HZ LYS 26 3HZ LYS 26 2.966 4.925 -7.375
198 H GLY 27 H GLY 27 -4.270 3.765 -5.895
199 1HA GLY 27 2HA GLY 27 -6.513 5.470 -5.213
200 2HA GLY 27 3HA GLY 27 -6.501 3.703 -5.292
201 H LEU 28 H LEU 28 -4.295 3.385 -3.425
202 HA LEU 28 HA LEU 28 -5.737 3.283 -0.964
203 1HB LEU 28 2HB LEU 28 -4.095 1.627 -1.612
204 2HB LEU 28 3HB LEU 28 -2.824 2.840 -1.695
205 HG LEU 28 HG LEU 28 -2.729 1.261 0.218
206 1HD1 LEU 28 1HD1 LEU 28 -1.606 3.515 0.186
207 2HD1 LEU 28 2HD1 LEU 28 -2.976 4.148 1.116
208 3HD1 LEU 28 3HD1 LEU 28 -1.954 2.872 1.799
209 1HD2 LEU 28 1HD2 LEU 28 -4.176 1.706 2.168
210 2HD2 LEU 28 2HD2 LEU 28 -5.224 2.709 1.161
211 3HD2 LEU 28 3HD2 LEU 28 -4.990 0.986 0.774
212 H LYS 29 H LYS 29 -3.049 5.381 -2.198
213 HA LYS 29 HA LYS 29 -2.710 7.023 -0.022
214 1HB LYS 29 2HB LYS 29 -1.551 7.116 -2.326
215 2HB LYS 29 3HB LYS 29 -2.896 8.155 -2.829
216 1HG LYS 29 2HG LYS 29 -2.268 9.525 -0.626
217 2HG LYS 29 3HG LYS 29 -0.767 8.627 -0.724
218 1HD LYS 29 2HD LYS 29 -1.987 10.490 -2.828
219 2HD LYS 29 3HD LYS 29 -0.644 10.864 -1.760
220 1HE LYS 29 2HE LYS 29 0.415 8.661 -2.948
221 2HE LYS 29 3HE LYS 29 -0.705 9.149 -4.227
222 1HZ LYS 29 1HZ LYS 29 0.461 11.439 -3.899
223 2HZ LYS 29 2HZ LYS 29 1.603 10.551 -3.106
224 3HZ LYS 29 3HZ LYS 29 1.322 10.230 -4.641
225 H ARG 30 H ARG 30 -5.473 7.066 -2.240
226 HA ARG 30 HA ARG 30 -6.548 9.593 -1.511
227 1HB ARG 30 2HB ARG 30 -7.325 7.335 -3.151
228 2HB ARG 30 3HB ARG 30 -8.664 7.714 -2.101
229 1HG ARG 30 2HG ARG 30 -9.127 9.004 -3.910
230 2HG ARG 30 3HG ARG 30 -8.276 10.199 -2.922
231 1HD ARG 30 2HD ARG 30 -6.226 9.856 -4.248
232 2HD ARG 30 3HD ARG 30 -6.965 8.457 -5.062
233 HE ARG 30 HE ARG 30 -8.517 10.882 -5.391
234 1HH1 ARG 30 2HH2 ARG 30 -5.699 9.192 -6.641
235 2HH1 ARG 30 1HH2 ARG 30 -5.892 9.726 -8.285
236 1HH2 ARG 30 2HH1 ARG 30 -8.854 11.576 -7.570
237 2HH2 ARG 30 1HH1 ARG 30 -7.740 11.133 -8.817
238 H MET 31 H MET 31 -6.402 6.671 0.376
239 HA MET 31 HA MET 31 -8.874 6.922 1.762
240 1HB MET 31 2HB MET 31 -8.071 5.053 3.025
241 2HB MET 31 3HB MET 31 -7.386 4.887 1.416
242 1HG MET 31 2HG MET 31 -5.420 4.641 2.409
243 2HG MET 31 3HG MET 31 -5.429 6.351 2.744
244 1HE MET 31 1HE MET 31 -5.131 2.926 5.495
245 2HE MET 31 2HE MET 31 -6.172 2.718 4.055
246 3HE MET 31 3HE MET 31 -4.495 3.281 3.897
247 HA PRO 32 HA PRO 32 -7.746 9.876 4.925
248 1HB PRO 32 2HB PRO 32 -9.142 9.121 7.126
249 2HB PRO 32 3HB PRO 32 -9.930 9.751 5.651
250 1HG PRO 32 2HG PRO 32 -9.572 6.852 6.457
251 2HG PRO 32 3HG PRO 32 -11.046 7.677 5.886
252 1HD PRO 32 2HD PRO 32 -9.431 6.213 4.242
253 2HD PRO 32 3HD PRO 32 -10.304 7.654 3.644
254 H GLY 33 H GLY 33 -5.726 9.839 5.620
255 1HA GLY 33 2HA GLY 33 -4.477 9.460 7.709
256 2HA GLY 33 3HA GLY 33 -4.785 7.733 7.552
257 H VAL 34 H VAL 34 -4.263 7.611 4.610
258 HA VAL 34 HA VAL 34 -1.324 7.702 4.739
259 HB VAL 34 HB VAL 34 -3.184 6.833 2.519
260 1HG1 VAL 34 1HG1 VAL 34 -0.993 7.488 1.604
261 2HG1 VAL 34 2HG1 VAL 34 -0.160 6.534 2.844
262 3HG1 VAL 34 3HG1 VAL 34 -1.131 5.727 1.603
263 1HG2 VAL 34 1HG2 VAL 34 -3.150 5.444 4.726
264 2HG2 VAL 34 2HG2 VAL 34 -2.762 4.586 3.239
265 3HG2 VAL 34 3HG2 VAL 34 -1.479 5.060 4.333
266 H THR 35 H THR 35 0.020 9.095 3.599
267 HA THR 35 HA THR 35 -1.338 11.535 2.520
268 HB THR 35 HB THR 35 1.390 11.439 3.661
269 HG1 THR 35 1HG THR 35 -1.078 11.739 5.024
270 1HG2 THR 35 1HG2 THR 35 -0.691 13.643 3.300
271 2HG2 THR 35 2HG2 THR 35 0.849 13.850 4.152
272 3HG2 THR 35 3HG2 THR 35 0.843 13.458 2.426
273 H ASP 36 H ASP 36 1.431 9.257 2.081
274 HA ASP 36 HA ASP 36 1.187 9.760 -0.734
275 1HB ASP 36 2HB ASP 36 3.266 11.124 0.388
276 2HB ASP 36 3HB ASP 36 4.065 9.590 -0.002
277 H ALA 37 H ALA 37 2.568 8.116 -1.943
278 HA ALA 37 HA ALA 37 2.954 5.598 -0.606
279 1HB ALA 37 1HB ALA 37 1.095 4.323 -1.595
280 2HB ALA 37 2HB ALA 37 0.440 5.635 -0.604
281 3HB ALA 37 3HB ALA 37 0.475 5.790 -2.376
282 H ASN 38 H ASN 38 4.023 4.021 -1.837
283 HA ASN 38 HA ASN 38 4.666 4.693 -4.631
284 1HB ASN 38 2HB ASN 38 7.199 4.456 -3.395
285 2HB ASN 38 3HB ASN 38 6.493 5.855 -4.184
286 1HD2 ASN 38 1HD2 ASN 38 5.868 4.342 -0.936
287 2HD2 ASN 38 2HD2 ASN 38 6.238 5.831 -0.071
288 H VAL 39 H VAL 39 4.232 2.685 -5.384
289 HA VAL 39 HA VAL 39 5.030 0.351 -3.844
290 HB VAL 39 HB VAL 39 3.023 0.573 -5.409
291 1HG1 VAL 39 1HG1 VAL 39 5.077 -0.052 -7.578
292 2HG1 VAL 39 2HG1 VAL 39 3.327 0.011 -7.752
293 3HG1 VAL 39 3HG1 VAL 39 4.222 1.497 -7.392
294 1HG2 VAL 39 1HG2 VAL 39 4.625 -1.653 -4.663
295 2HG2 VAL 39 2HG2 VAL 39 2.916 -1.599 -5.080
296 3HG2 VAL 39 3HG2 VAL 39 4.124 -1.900 -6.347
297 H ASN 40 H ASN 40 6.948 -0.894 -4.164
298 HA ASN 40 HA ASN 40 8.886 0.143 -6.188
299 1HB ASN 40 2HB ASN 40 9.377 0.918 -3.840
300 2HB ASN 40 3HB ASN 40 9.554 -0.780 -3.367
301 1HD2 ASN 40 1HD2 ASN 40 11.744 0.635 -2.884
302 2HD2 ASN 40 2HD2 ASN 40 12.966 0.409 -4.124
303 H LEU 41 H LEU 41 7.224 -1.625 -6.966
304 HA LEU 41 HA LEU 41 7.806 -4.358 -6.416
305 1HB LEU 41 2HB LEU 41 6.119 -2.805 -8.245
306 2HB LEU 41 3HB LEU 41 6.802 -4.189 -9.071
307 HG LEU 41 HG LEU 41 4.548 -4.440 -7.966
308 1HD1 LEU 41 1HD1 LEU 41 5.769 -6.349 -8.842
309 2HD1 LEU 41 2HD1 LEU 41 6.717 -6.479 -7.348
310 3HD1 LEU 41 3HD1 LEU 41 4.969 -6.793 -7.324
311 1HD2 LEU 41 1HD2 LEU 41 5.947 -5.183 -5.398
312 2HD2 LEU 41 2HD2 LEU 41 5.526 -3.492 -5.670
313 3HD2 LEU 41 3HD2 LEU 41 4.261 -4.739 -5.699
314 H ALA 42 H ALA 42 9.504 -1.996 -8.285
315 HA ALA 42 HA ALA 42 11.159 -3.578 -9.904
316 1HB ALA 42 1HB ALA 42 11.952 -1.212 -8.166
317 2HB ALA 42 2HB ALA 42 12.858 -1.854 -9.545
318 3HB ALA 42 3HB ALA 42 11.264 -1.109 -9.808
319 H THR 43 H THR 43 11.209 -3.180 -6.320
320 HA THR 43 HA THR 43 13.197 -5.408 -6.261
321 HB THR 43 HB THR 43 14.168 -3.357 -5.412
322 HG1 THR 43 1HG THR 43 13.668 -5.466 -3.603
323 1HG2 THR 43 1HG2 THR 43 13.498 -2.360 -3.330
324 2HG2 THR 43 2HG2 THR 43 12.036 -2.438 -4.331
325 3HG2 THR 43 3HG2 THR 43 12.279 -3.609 -3.028
326 H GLU 44 H GLU 44 10.228 -5.408 -6.513
327 HA GLU 44 HA GLU 44 8.461 -6.510 -5.808
328 1HB GLU 44 2HB GLU 44 10.759 -8.140 -5.396
329 2HB GLU 44 3HB GLU 44 9.684 -8.488 -4.057
330 1HG GLU 44 2HG GLU 44 7.873 -9.024 -5.624
331 2HG GLU 44 3HG GLU 44 8.850 -8.454 -6.996
332 H THR 45 H THR 45 9.311 -4.194 -3.966
333 HA THR 45 HA THR 45 7.871 -5.043 -1.495
334 HB THR 45 HB THR 45 10.084 -2.994 -1.931
335 HG1 THR 45 1HG THR 45 10.149 -5.707 -1.095
336 1HG2 THR 45 1HG2 THR 45 9.051 -4.251 0.628
337 2HG2 THR 45 2HG2 THR 45 10.424 -3.139 0.476
338 3HG2 THR 45 3HG2 THR 45 8.791 -2.554 0.122
339 H VAL 46 H VAL 46 6.699 -3.189 -0.408
340 HA VAL 46 HA VAL 46 5.979 -0.941 -2.245
341 HB VAL 46 HB VAL 46 4.130 -2.489 -2.323
342 1HG1 VAL 46 1HG1 VAL 46 2.841 -3.139 -0.320
343 2HG1 VAL 46 2HG1 VAL 46 4.495 -3.741 -0.178
344 3HG1 VAL 46 3HG1 VAL 46 3.993 -2.278 0.706
345 1HG2 VAL 46 1HG2 VAL 46 2.326 -1.146 -1.448
346 2HG2 VAL 46 2HG2 VAL 46 3.419 -0.180 -0.459
347 3HG2 VAL 46 3HG2 VAL 46 3.538 -0.114 -2.233
348 H ASN 47 H ASN 47 5.650 1.133 -1.217
349 HA ASN 47 HA ASN 47 6.201 1.159 1.687
350 1HB ASN 47 2HB ASN 47 7.445 2.838 -0.548
351 2HB ASN 47 3HB ASN 47 7.354 3.426 1.114
352 1HD2 ASN 47 1HD2 ASN 47 8.270 1.875 2.838
353 2HD2 ASN 47 2HD2 ASN 47 9.882 1.319 2.410
354 H VAL 48 H VAL 48 4.772 2.685 2.785
355 HA VAL 48 HA VAL 48 3.026 4.365 1.133
356 HB VAL 48 HB VAL 48 1.338 3.690 2.957
357 1HG1 VAL 48 1HG1 VAL 48 0.805 3.257 0.667
358 2HG1 VAL 48 2HG1 VAL 48 2.014 1.959 0.554
359 3HG1 VAL 48 3HG1 VAL 48 0.545 1.723 1.514
360 1HG2 VAL 48 1HG2 VAL 48 1.405 1.418 3.750
361 2HG2 VAL 48 2HG2 VAL 48 2.852 1.097 2.796
362 3HG2 VAL 48 3HG2 VAL 48 2.942 2.179 4.212
363 H ILE 49 H ILE 49 2.954 6.351 1.987
364 HA ILE 49 HA ILE 49 4.613 6.847 4.370
365 HB ILE 49 HB ILE 49 3.739 8.812 2.234
366 1HG1 ILE 49 2HG1 ILE 49 4.924 7.209 0.960
367 2HG1 ILE 49 3HG1 ILE 49 5.962 8.611 1.194
368 1HG2 ILE 49 1HG2 ILE 49 6.275 9.228 3.736
369 2HG2 ILE 49 2HG2 ILE 49 5.044 10.367 3.190
370 3HG2 ILE 49 3HG2 ILE 49 4.774 9.403 4.649
371 1HD1 ILE 49 1HD1 ILE 49 6.191 5.965 2.698
372 2HD1 ILE 49 2HD1 ILE 49 7.275 6.571 1.434
373 3HD1 ILE 49 3HD1 ILE 49 7.192 7.401 2.979
374 H TYR 50 H TYR 50 3.146 6.861 6.111
375 HA TYR 50 HA TYR 50 0.606 8.414 5.809
376 1HB TYR 50 2HB TYR 50 -0.703 6.602 6.712
377 2HB TYR 50 3HB TYR 50 0.117 6.133 5.238
378 HD1 TYR 50 HD1 TYR 50 1.383 4.137 5.149
379 HD2 TYR 50 HD2 TYR 50 0.178 5.757 8.938
380 HE1 TYR 50 HE1 TYR 50 1.781 1.939 6.224
381 HE2 TYR 50 HE2 TYR 50 0.842 3.651 10.049
382 HH TYR 50 HH TYR 50 1.671 0.731 8.166
383 H ASP 51 H ASP 51 -0.550 8.547 7.891
384 HA ASP 51 HA ASP 51 1.403 9.321 9.999
385 1HB ASP 51 2HB ASP 51 -0.198 11.008 9.516
386 2HB ASP 51 3HB ASP 51 -1.541 9.877 9.667
387 HA PRO 52 HA PRO 52 0.174 5.257 11.589
388 1HB PRO 52 2HB PRO 52 2.220 4.682 13.229
389 2HB PRO 52 3HB PRO 52 2.416 4.705 11.463
390 1HG PRO 52 2HG PRO 52 3.025 6.987 13.399
391 2HG PRO 52 3HG PRO 52 4.096 6.321 12.128
392 1HD PRO 52 2HD PRO 52 2.581 8.532 11.716
393 2HD PRO 52 3HD PRO 52 2.915 7.337 10.425
394 H ALA 53 H ALA 53 -0.215 8.293 12.990
395 HA ALA 53 HA ALA 53 -1.019 7.262 15.639
396 1HB ALA 53 1HB ALA 53 0.082 9.508 15.400
397 2HB ALA 53 2HB ALA 53 -1.297 10.027 14.402
398 3HB ALA 53 3HB ALA 53 -1.555 9.565 16.092
399 H GLU 54 H GLU 54 -2.171 7.946 12.352
400 HA GLU 54 HA GLU 54 -4.960 7.821 13.307
401 1HB GLU 54 2HB GLU 54 -3.788 9.670 11.557
402 2HB GLU 54 3HB GLU 54 -4.590 8.536 10.467
403 1HG GLU 54 2HG GLU 54 -6.674 8.788 11.939
404 2HG GLU 54 3HG GLU 54 -5.823 10.117 12.750
405 H THR 55 H THR 55 -2.848 6.794 10.669
406 HA THR 55 HA THR 55 -4.264 4.237 10.416
407 HB THR 55 HB THR 55 -2.600 4.173 8.198
408 HG1 THR 55 1HG THR 55 -3.245 6.846 8.708
409 1HG2 THR 55 1HG2 THR 55 -4.985 3.726 8.348
410 2HG2 THR 55 2HG2 THR 55 -5.349 5.469 8.546
411 3HG2 THR 55 3HG2 THR 55 -4.606 4.865 7.038
412 H GLY 56 H GLY 56 -2.431 2.691 9.410
413 1HA GLY 56 2HA GLY 56 -0.267 1.873 10.917
414 2HA GLY 56 3HA GLY 56 -1.776 1.367 11.730
415 H THR 57 H THR 57 -2.026 -0.726 10.994
416 HA THR 57 HA THR 57 -1.507 -1.598 8.244
417 HB THR 57 HB THR 57 -2.070 -3.799 9.381
418 HG1 THR 57 1HG THR 57 -2.473 -3.728 11.557
419 1HG2 THR 57 1HG2 THR 57 0.043 -3.837 10.725
420 2HG2 THR 57 2HG2 THR 57 0.291 -2.942 9.213
421 3HG2 THR 57 3HG2 THR 57 0.105 -2.065 10.739
422 H ALA 58 H ALA 58 -3.977 -0.890 10.613
423 HA ALA 58 HA ALA 58 -6.017 -2.362 9.942
424 1HB ALA 58 1HB ALA 58 -6.237 0.535 10.819
425 2HB ALA 58 2HB ALA 58 -7.517 -0.688 10.964
426 3HB ALA 58 3HB ALA 58 -6.006 -0.876 11.873
427 H ALA 59 H ALA 59 -5.651 0.809 8.516
428 HA ALA 59 HA ALA 59 -8.146 0.310 6.929
429 1HB ALA 59 1HB ALA 59 -6.481 2.807 7.140
430 2HB ALA 59 2HB ALA 59 -7.874 2.607 6.056
431 3HB ALA 59 3HB ALA 59 -8.077 2.488 7.814
432 H ILE 60 H ILE 60 -4.684 0.267 6.599
433 HA ILE 60 HA ILE 60 -4.531 0.232 3.768
434 HB ILE 60 HB ILE 60 -2.698 -0.427 6.056
435 1HG1 ILE 60 2HG1 ILE 60 -2.378 1.007 3.422
436 2HG1 ILE 60 3HG1 ILE 60 -3.139 1.784 4.813
437 1HG2 ILE 60 1HG2 ILE 60 -0.952 -1.272 4.482
438 2HG2 ILE 60 2HG2 ILE 60 -2.279 -2.404 4.622
439 3HG2 ILE 60 3HG2 ILE 60 -2.164 -1.359 3.192
440 1HD1 ILE 60 1HD1 ILE 60 -0.745 2.408 4.565
441 2HD1 ILE 60 2HD1 ILE 60 -1.199 1.748 6.143
442 3HD1 ILE 60 3HD1 ILE 60 -0.307 0.738 4.995
443 H GLN 61 H GLN 61 -4.659 -2.538 6.085
444 HA GLN 61 HA GLN 61 -4.591 -4.471 3.979
445 1HB GLN 61 2HB GLN 61 -5.112 -4.486 6.865
446 2HB GLN 61 3HB GLN 61 -6.186 -5.560 5.958
447 1HG GLN 61 2HG GLN 61 -4.581 -7.046 6.371
448 2HG GLN 61 3HG GLN 61 -4.009 -6.462 4.812
449 1HE2 GLN 61 1HE2 GLN 61 -2.951 -3.884 5.914
450 2HE2 GLN 61 2HE2 GLN 61 -1.518 -4.348 6.819
451 H GLU 62 H GLU 62 -7.285 -2.830 5.657
452 HA GLU 62 HA GLU 62 -9.459 -4.076 4.477
453 1HB GLU 62 2HB GLU 62 -9.093 -1.938 6.211
454 2HB GLU 62 3HB GLU 62 -9.747 -1.118 4.794
455 1HG GLU 62 2HG GLU 62 -10.988 -3.477 6.277
456 2HG GLU 62 3HG GLU 62 -11.515 -1.791 6.360
457 H LYS 63 H LYS 63 -7.797 -1.090 3.270
458 HA LYS 63 HA LYS 63 -9.283 -0.993 0.875
459 1HB LYS 63 2HB LYS 63 -6.769 0.248 1.986
460 2HB LYS 63 3HB LYS 63 -7.175 0.475 0.306
461 1HG LYS 63 2HG LYS 63 -9.007 1.266 2.600
462 2HG LYS 63 3HG LYS 63 -7.810 2.314 1.831
463 1HD LYS 63 2HD LYS 63 -9.816 2.946 0.890
464 2HD LYS 63 3HD LYS 63 -8.958 2.061 -0.372
465 1HE LYS 63 2HE LYS 63 -10.487 0.284 -0.353
466 2HE LYS 63 3HE LYS 63 -10.960 0.555 1.345
467 1HZ LYS 63 1HZ LYS 63 -12.167 2.481 0.621
468 2HZ LYS 63 2HZ LYS 63 -11.730 2.225 -0.950
469 3HZ LYS 63 3HZ LYS 63 -12.680 1.137 -0.165
470 H ILE 64 H ILE 64 -6.114 -2.485 1.644
471 HA ILE 64 HA ILE 64 -5.110 -3.095 -0.869
472 HB ILE 64 HB ILE 64 -4.958 -4.092 1.891
473 1HG1 ILE 64 2HG1 ILE 64 -3.597 -2.218 1.091
474 2HG1 ILE 64 3HG1 ILE 64 -2.697 -3.607 1.694
475 1HG2 ILE 64 1HG2 ILE 64 -4.049 -5.833 -0.360
476 2HG2 ILE 64 2HG2 ILE 64 -3.400 -5.891 1.304
477 3HG2 ILE 64 3HG2 ILE 64 -5.111 -6.208 1.019
478 1HD1 ILE 64 1HD1 ILE 64 -3.007 -2.685 -1.157
479 2HD1 ILE 64 2HD1 ILE 64 -1.538 -2.939 -0.192
480 3HD1 ILE 64 3HD1 ILE 64 -2.485 -4.335 -0.761
481 H GLU 65 H GLU 65 -7.319 -4.989 1.268
482 HA GLU 65 HA GLU 65 -8.025 -7.060 -0.512
483 1HB GLU 65 2HB GLU 65 -9.404 -5.718 1.813
484 2HB GLU 65 3HB GLU 65 -10.183 -7.043 0.939
485 1HG GLU 65 2HG GLU 65 -7.383 -7.314 2.052
486 2HG GLU 65 3HG GLU 65 -8.790 -7.529 3.096
487 H LYS 66 H LYS 66 -9.872 -3.977 0.097
488 HA LYS 66 HA LYS 66 -11.853 -4.556 -1.890
489 1HB LYS 66 2HB LYS 66 -10.976 -2.051 -0.465
490 2HB LYS 66 3HB LYS 66 -11.953 -1.895 -1.918
491 1HG LYS 66 2HG LYS 66 -13.491 -1.828 -0.214
492 2HG LYS 66 3HG LYS 66 -13.698 -3.432 -0.910
493 1HD LYS 66 2HD LYS 66 -11.904 -2.925 1.478
494 2HD LYS 66 3HD LYS 66 -13.630 -3.023 1.723
495 1HE LYS 66 2HE LYS 66 -13.781 -5.288 1.100
496 2HE LYS 66 3HE LYS 66 -12.204 -5.308 0.311
497 1HZ LYS 66 1HZ LYS 66 -12.607 -4.934 3.203
498 2HZ LYS 66 2HZ LYS 66 -12.095 -6.338 2.486
499 3HZ LYS 66 3HZ LYS 66 -11.183 -4.952 2.451
500 H LEU 67 H LEU 67 -8.705 -3.016 -2.231
501 HA LEU 67 HA LEU 67 -9.049 -2.127 -4.953
502 1HB LEU 67 2HB LEU 67 -6.628 -2.569 -3.197
503 2HB LEU 67 3HB LEU 67 -6.527 -1.925 -4.836
504 HG LEU 67 HG LEU 67 -8.330 -0.609 -2.764
505 1HD1 LEU 67 1HD1 LEU 67 -6.013 -0.727 -1.852
506 2HD1 LEU 67 2HD1 LEU 67 -5.430 0.080 -3.317
507 3HD1 LEU 67 3HD1 LEU 67 -6.535 0.928 -2.221
508 1HD2 LEU 67 1HD2 LEU 67 -8.696 0.086 -5.106
509 2HD2 LEU 67 2HD2 LEU 67 -7.952 1.390 -4.173
510 3HD2 LEU 67 3HD2 LEU 67 -6.963 0.427 -5.286
511 H GLY 68 H GLY 68 -8.534 -5.234 -3.498
512 1HA GLY 68 2HA GLY 68 -8.780 -7.230 -4.593
513 2HA GLY 68 3HA GLY 68 -8.468 -6.463 -6.156
514 H TYR 69 H TYR 69 -6.439 -6.264 -3.164
515 HA TYR 69 HA TYR 69 -4.301 -7.856 -4.523
516 1HB TYR 69 2HB TYR 69 -4.397 -5.002 -3.861
517 2HB TYR 69 3HB TYR 69 -3.121 -5.795 -2.966
518 HD1 TYR 69 HD1 TYR 69 -4.567 -5.522 -6.414
519 HD2 TYR 69 HD2 TYR 69 -1.093 -6.407 -4.026
520 HE1 TYR 69 HE1 TYR 69 -3.166 -5.333 -8.403
521 HE2 TYR 69 HE2 TYR 69 0.331 -6.114 -6.001
522 HH TYR 69 HH TYR 69 0.393 -5.843 -8.290
523 H HIS 70 H HIS 70 -2.476 -8.280 -2.860
524 HA HIS 70 HA HIS 70 -3.424 -8.270 -0.093
525 1HB HIS 70 2HB HIS 70 -3.973 -10.521 -1.239
526 2HB HIS 70 3HB HIS 70 -2.230 -10.806 -1.264
527 HD1 HIS 70 1HD HIS 70 -3.470 -9.133 1.926
528 HD2 HIS 70 2HD HIS 70 -3.181 -12.993 0.279
529 HE1 HIS 70 1HE HIS 70 -3.681 -10.766 3.858
530 H VAL 71 H VAL 71 -1.435 -8.961 1.344
531 HA VAL 71 HA VAL 71 1.065 -7.811 0.319
532 HB VAL 71 HB VAL 71 -0.700 -6.710 2.525
533 1HG1 VAL 71 1HG1 VAL 71 0.992 -5.196 3.217
534 2HG1 VAL 71 2HG1 VAL 71 1.692 -6.810 3.350
535 3HG1 VAL 71 3HG1 VAL 71 2.119 -5.760 1.973
536 1HG2 VAL 71 1HG2 VAL 71 -1.166 -5.773 0.317
537 2HG2 VAL 71 2HG2 VAL 71 -0.371 -4.550 1.319
538 3HG2 VAL 71 3HG2 VAL 71 0.551 -5.407 0.069
539 H VAL 72 H VAL 72 2.804 -8.508 1.603
540 HA VAL 72 HA VAL 72 2.199 -10.751 3.464
541 HB VAL 72 HB VAL 72 4.517 -10.701 1.608
542 1HG1 VAL 72 1HG1 VAL 72 4.727 -12.148 3.602
543 2HG1 VAL 72 2HG1 VAL 72 3.180 -12.929 3.201
544 3HG1 VAL 72 3HG1 VAL 72 4.584 -13.126 2.135
545 1HG2 VAL 72 1HG2 VAL 72 3.267 -12.417 0.244
546 2HG2 VAL 72 2HG2 VAL 72 1.805 -12.030 1.177
547 3HG2 VAL 72 3HG2 VAL 72 2.565 -10.800 0.139
548 H ILE 73 H ILE 73 3.369 -10.748 5.274
549 HA ILE 73 HA ILE 73 5.199 -8.433 5.825
550 HB ILE 73 HB ILE 73 3.405 -9.914 7.760
551 1HG1 ILE 73 2HG1 ILE 73 1.990 -8.595 6.296
552 2HG1 ILE 73 3HG1 ILE 73 2.127 -7.844 7.880
553 1HG2 ILE 73 1HG2 ILE 73 4.046 -7.994 9.263
554 2HG2 ILE 73 2HG2 ILE 73 5.385 -9.065 8.856
555 3HG2 ILE 73 3HG2 ILE 73 5.257 -7.502 8.054
556 1HD1 ILE 73 1HD1 ILE 73 3.553 -6.929 5.366
557 2HD1 ILE 73 2HD1 ILE 73 2.185 -6.142 6.155
558 3HD1 ILE 73 3HD1 ILE 73 3.755 -6.188 6.970
559 H GLU 74 H GLU 74 6.761 -9.915 4.748
560 HA GLU 74 HA GLU 74 7.425 -12.318 5.985
561 1HB GLU 74 2HB GLU 74 7.763 -11.343 3.539
562 2HB GLU 74 3HB GLU 74 9.414 -11.108 4.143
563 1HG GLU 74 2HG GLU 74 7.881 -13.761 4.252
564 2HG GLU 74 3HG GLU 74 8.858 -13.261 2.871
565 H GLY 75 H GLY 75 7.904 -9.346 7.021
566 1HA GLY 75 2HA GLY 75 10.155 -10.016 8.867
567 2HA GLY 75 3HA GLY 75 10.100 -8.444 8.044
568 H ARG 76 H ARG 76 7.879 -10.647 9.790
569 HA ARG 76 HA ARG 76 6.324 -8.482 10.961
570 1HB ARG 76 2HB ARG 76 5.524 -10.911 10.419
571 2HB ARG 76 3HB ARG 76 6.431 -11.368 11.868
572 1HG ARG 76 2HG ARG 76 4.956 -9.236 12.824
573 2HG ARG 76 3HG ARG 76 3.868 -9.840 11.569
574 1HD ARG 76 2HD ARG 76 3.945 -12.093 12.625
575 2HD ARG 76 3HD ARG 76 5.128 -11.469 13.813
576 HE ARG 76 HE ARG 76 2.783 -9.843 13.835
577 1HH1 ARG 76 2HH2 ARG 76 3.937 -12.990 14.881
578 2HH1 ARG 76 1HH2 ARG 76 2.907 -13.112 16.275
579 1HH2 ARG 76 2HH1 ARG 76 1.377 -9.940 15.673
580 2HH2 ARG 76 1HH1 ARG 76 1.398 -11.318 16.724
Start of MODEL 21
1 1H MET 1 H1 MET 1 -0.819 20.041 12.571
2 2H MET 1 H2 MET 1 -1.855 21.233 13.088
3 3H MET 1 H3 MET 1 -0.553 20.761 14.019
4 HA MET 1 HA MET 1 -2.635 19.928 14.863
5 1HB MET 1 2HB MET 1 -2.431 18.187 12.356
6 2HB MET 1 3HB MET 1 -3.487 17.869 13.747
7 1HG MET 1 2HG MET 1 -4.651 19.986 13.427
8 2HG MET 1 3HG MET 1 -3.716 20.288 11.948
9 1HE MET 1 1HE MET 1 -6.117 20.653 10.778
10 2HE MET 1 2HE MET 1 -7.378 19.398 10.750
11 3HE MET 1 3HE MET 1 -6.964 20.201 12.281
12 H LEU 2 H LEU 2 -2.017 16.841 14.417
13 HA LEU 2 HA LEU 2 0.611 16.675 15.725
14 1HB LEU 2 2HB LEU 2 -0.471 15.480 17.681
15 2HB LEU 2 3HB LEU 2 -0.653 17.218 17.598
16 HG LEU 2 HG LEU 2 -2.983 16.231 16.277
17 1HD1 LEU 2 1HD1 LEU 2 -2.563 13.995 17.190
18 2HD1 LEU 2 2HD1 LEU 2 -2.474 14.675 18.832
19 3HD1 LEU 2 3HD1 LEU 2 -3.993 14.750 17.912
20 1HD2 LEU 2 1HD2 LEU 2 -2.787 18.251 17.694
21 2HD2 LEU 2 2HD2 LEU 2 -4.130 17.211 18.195
22 3HD2 LEU 2 3HD2 LEU 2 -2.621 17.217 19.131
23 H SER 3 H SER 3 -0.282 15.882 13.199
24 HA SER 3 HA SER 3 -0.456 12.916 13.340
25 1HB SER 3 2HB SER 3 -0.646 14.712 10.885
26 2HB SER 3 3HB SER 3 -1.139 13.035 11.050
27 HG SER 3 HG SER 3 -2.810 13.694 12.401
28 H GLU 4 H GLU 4 1.704 12.332 13.849
29 HA GLU 4 HA GLU 4 3.963 13.425 12.327
30 1HB GLU 4 2HB GLU 4 3.569 11.358 14.412
31 2HB GLU 4 3HB GLU 4 4.839 11.052 13.256
32 1HG GLU 4 2HG GLU 4 5.670 13.367 13.772
33 2HG GLU 4 3HG GLU 4 4.576 13.315 15.162
34 H GLN 5 H GLN 5 5.164 11.710 10.971
35 HA GLN 5 HA GLN 5 3.296 10.001 9.391
36 1HB GLN 5 2HB GLN 5 5.484 11.850 8.425
37 2HB GLN 5 3HB GLN 5 4.737 10.590 7.455
38 1HG GLN 5 2HG GLN 5 2.700 12.350 8.637
39 2HG GLN 5 3HG GLN 5 3.897 13.277 7.737
40 1HE2 GLN 5 1HE2 GLN 5 2.636 9.973 7.161
41 2HE2 GLN 5 2HE2 GLN 5 1.930 10.339 5.604
42 H LYS 6 H LYS 6 4.272 8.041 8.703
43 HA LYS 6 HA LYS 6 7.142 7.880 8.776
44 1HB LYS 6 2HB LYS 6 5.559 5.979 10.539
45 2HB LYS 6 3HB LYS 6 7.177 5.625 9.926
46 1HG LYS 6 2HG LYS 6 7.970 7.823 10.895
47 2HG LYS 6 3HG LYS 6 6.446 7.915 11.790
48 1HD LYS 6 2HD LYS 6 8.435 5.607 11.950
49 2HD LYS 6 3HD LYS 6 8.413 7.006 13.041
50 1HE LYS 6 2HE LYS 6 6.045 6.465 13.676
51 2HE LYS 6 3HE LYS 6 6.132 4.997 12.680
52 1HZ LYS 6 1HZ LYS 6 7.826 5.613 15.010
53 2HZ LYS 6 2HZ LYS 6 6.567 4.557 14.991
54 3HZ LYS 6 3HZ LYS 6 7.917 4.239 14.102
55 H GLU 7 H GLU 7 8.012 6.167 7.746
56 HA GLU 7 HA GLU 7 6.432 5.101 5.508
57 1HB GLU 7 2HB GLU 7 9.382 4.638 5.693
58 2HB GLU 7 3HB GLU 7 8.363 5.074 4.322
59 1HG GLU 7 2HG GLU 7 9.696 6.938 4.576
60 2HG GLU 7 3HG GLU 7 8.288 7.462 5.500
61 H ILE 8 H ILE 8 6.363 2.903 5.127
62 HA ILE 8 HA ILE 8 7.584 0.981 7.034
63 HB ILE 8 HB ILE 8 5.287 -0.274 6.223
64 1HG1 ILE 8 2HG1 ILE 8 4.447 1.885 5.178
65 2HG1 ILE 8 3HG1 ILE 8 3.376 0.894 6.159
66 1HG2 ILE 8 1HG2 ILE 8 6.102 -0.347 8.417
67 2HG2 ILE 8 2HG2 ILE 8 5.665 1.358 8.682
68 3HG2 ILE 8 3HG2 ILE 8 4.386 0.131 8.411
69 1HD1 ILE 8 1HD1 ILE 8 3.324 3.389 6.703
70 2HD1 ILE 8 2HD1 ILE 8 3.505 2.213 8.034
71 3HD1 ILE 8 3HD1 ILE 8 4.889 3.140 7.479
72 H ALA 9 H ALA 9 7.986 -1.129 5.925
73 HA ALA 9 HA ALA 9 8.035 -0.974 2.958
74 1HB ALA 9 1HB ALA 9 10.341 -1.805 2.976
75 2HB ALA 9 2HB ALA 9 10.273 -0.258 3.850
76 3HB ALA 9 3HB ALA 9 10.370 -1.769 4.753
77 H MET 10 H MET 10 7.207 -2.886 2.122
78 HA MET 10 HA MET 10 7.407 -5.371 3.686
79 1HB MET 10 2HB MET 10 5.041 -5.613 4.087
80 2HB MET 10 3HB MET 10 5.523 -4.046 4.720
81 1HG MET 10 2HG MET 10 4.907 -3.355 2.164
82 2HG MET 10 3HG MET 10 3.835 -4.733 2.361
83 1HE MET 10 1HE MET 10 3.735 -0.612 4.363
84 2HE MET 10 2HE MET 10 5.144 -1.704 4.488
85 3HE MET 10 3HE MET 10 4.636 -1.079 2.905
86 H GLN 11 H GLN 11 5.734 -7.015 2.514
87 HA GLN 11 HA GLN 11 6.734 -7.084 -0.286
88 1HB GLN 11 2HB GLN 11 5.994 -9.136 1.839
89 2HB GLN 11 3HB GLN 11 6.110 -9.610 0.145
90 1HG GLN 11 2HG GLN 11 8.291 -8.426 1.937
91 2HG GLN 11 3HG GLN 11 8.192 -10.099 1.358
92 1HE2 GLN 11 1HE2 GLN 11 7.525 -9.793 -1.302
93 2HE2 GLN 11 2HE2 GLN 11 8.576 -8.658 -2.125
94 H VAL 12 H VAL 12 5.274 -8.158 -1.866
95 HA VAL 12 HA VAL 12 2.466 -7.166 -1.531
96 HB VAL 12 HB VAL 12 4.218 -7.311 -4.021
97 1HG1 VAL 12 1HG1 VAL 12 1.407 -6.198 -3.577
98 2HG1 VAL 12 2HG1 VAL 12 2.396 -5.879 -5.014
99 3HG1 VAL 12 3HG1 VAL 12 1.870 -7.522 -4.671
100 1HG2 VAL 12 1HG2 VAL 12 4.132 -4.805 -3.873
101 2HG2 VAL 12 2HG2 VAL 12 3.329 -4.970 -2.305
102 3HG2 VAL 12 3HG2 VAL 12 5.007 -5.526 -2.520
103 H SER 13 H SER 13 0.759 -8.438 -2.670
104 HA SER 13 HA SER 13 1.553 -10.858 -4.057
105 1HB SER 13 2HB SER 13 0.170 -10.967 -1.360
106 2HB SER 13 3HB SER 13 -0.108 -12.231 -2.565
107 HG SER 13 HG SER 13 2.525 -11.462 -1.942
108 H GLY 14 H GLY 14 -0.468 -12.006 -4.867
109 1HA GLY 14 2HA GLY 14 -2.302 -11.870 -6.255
110 2HA GLY 14 3HA GLY 14 -2.938 -10.612 -5.180
111 H MET 15 H MET 15 -0.251 -11.020 -7.582
112 HA MET 15 HA MET 15 -0.983 -8.511 -8.916
113 1HB MET 15 2HB MET 15 1.270 -7.587 -8.664
114 2HB MET 15 3HB MET 15 0.510 -7.849 -7.093
115 1HG MET 15 2HG MET 15 2.699 -8.503 -6.771
116 2HG MET 15 3HG MET 15 1.849 -10.036 -6.949
117 1HE MET 15 1HE MET 15 5.461 -10.688 -8.347
118 2HE MET 15 2HE MET 15 5.006 -9.631 -6.991
119 3HE MET 15 3HE MET 15 4.214 -11.215 -7.191
120 H THR 16 H THR 16 0.425 -8.194 -10.831
121 HA THR 16 HA THR 16 1.848 -10.532 -11.873
122 HB THR 16 HB THR 16 0.579 -9.985 -14.160
123 HG1 THR 16 1HG THR 16 -1.430 -9.563 -12.205
124 1HG2 THR 16 1HG2 THR 16 -0.573 -11.818 -12.014
125 2HG2 THR 16 2HG2 THR 16 -0.944 -11.874 -13.745
126 3HG2 THR 16 3HG2 THR 16 0.699 -12.212 -13.184
127 H CYS 17 H CYS 17 0.569 -7.352 -13.086
128 HA CYS 17 HA CYS 17 3.343 -6.777 -13.989
129 1HB CYS 17 2HB CYS 17 2.488 -5.302 -15.559
130 2HB CYS 17 3HB CYS 17 1.455 -6.732 -15.655
131 H ALA 18 H ALA 18 4.338 -4.799 -13.576
132 HA ALA 18 HA ALA 18 3.781 -3.651 -10.951
133 1HB ALA 18 1HB ALA 18 5.867 -2.934 -13.049
134 2HB ALA 18 2HB ALA 18 5.843 -2.397 -11.356
135 3HB ALA 18 3HB ALA 18 6.078 -4.115 -11.738
136 H ALA 19 H ALA 19 1.553 -3.221 -12.476
137 HA ALA 19 HA ALA 19 1.548 -0.255 -12.757
138 1HB ALA 19 1HB ALA 19 0.186 -2.056 -14.791
139 2HB ALA 19 2HB ALA 19 0.251 -0.289 -14.765
140 3HB ALA 19 3HB ALA 19 1.734 -1.220 -15.055
141 H CYS 20 H CYS 20 -0.645 -3.199 -12.784
142 HA CYS 20 HA CYS 20 -2.719 -1.868 -11.374
143 1HB CYS 20 2HB CYS 20 -1.892 -4.802 -10.995
144 2HB CYS 20 3HB CYS 20 -3.483 -4.077 -10.705
145 H ALA 21 H ALA 21 0.254 -3.447 -10.287
146 HA ALA 21 HA ALA 21 -0.092 -3.211 -7.524
147 1HB ALA 21 1HB ALA 21 1.751 -4.372 -8.937
148 2HB ALA 21 2HB ALA 21 2.583 -2.803 -8.880
149 3HB ALA 21 3HB ALA 21 2.181 -3.684 -7.380
150 H ALA 22 H ALA 22 0.346 -0.569 -9.812
151 HA ALA 22 HA ALA 22 1.227 1.381 -7.806
152 1HB ALA 22 1HB ALA 22 -0.015 1.807 -10.551
153 2HB ALA 22 2HB ALA 22 0.849 2.995 -9.566
154 3HB ALA 22 3HB ALA 22 1.732 1.617 -10.262
155 H ARG 23 H ARG 23 -1.765 0.106 -9.245
156 HA ARG 23 HA ARG 23 -3.444 2.323 -8.646
157 1HB ARG 23 2HB ARG 23 -4.149 -0.618 -9.022
158 2HB ARG 23 3HB ARG 23 -5.316 0.688 -8.959
159 1HG ARG 23 2HG ARG 23 -3.043 0.814 -10.973
160 2HG ARG 23 3HG ARG 23 -4.443 -0.202 -11.293
161 1HD ARG 23 2HD ARG 23 -4.732 2.726 -10.537
162 2HD ARG 23 3HD ARG 23 -4.497 2.184 -12.214
163 HE ARG 23 HE ARG 23 -6.560 0.603 -11.295
164 1HH1 ARG 23 2HH2 ARG 23 -6.051 4.072 -11.592
165 2HH1 ARG 23 1HH2 ARG 23 -7.695 4.455 -12.002
166 1HH2 ARG 23 2HH1 ARG 23 -8.746 1.049 -11.896
167 2HH2 ARG 23 1HH1 ARG 23 -9.270 2.675 -12.172
168 H ILE 24 H ILE 24 -2.540 -0.594 -6.752
169 HA ILE 24 HA ILE 24 -4.395 -0.018 -4.722
170 HB ILE 24 HB ILE 24 -2.712 -1.263 -3.170
171 1HG1 ILE 24 2HG1 ILE 24 -1.945 -2.492 -5.838
172 2HG1 ILE 24 3HG1 ILE 24 -1.008 -1.153 -5.197
173 1HG2 ILE 24 1HG2 ILE 24 -4.300 -2.584 -5.394
174 2HG2 ILE 24 2HG2 ILE 24 -3.650 -3.358 -3.929
175 3HG2 ILE 24 3HG2 ILE 24 -4.868 -2.114 -3.771
176 1HD1 ILE 24 1HD1 ILE 24 -1.465 -3.789 -3.733
177 2HD1 ILE 24 2HD1 ILE 24 0.030 -3.286 -4.550
178 3HD1 ILE 24 3HD1 ILE 24 -0.548 -2.427 -3.108
179 H GLU 25 H GLU 25 -0.806 0.612 -4.304
180 HA GLU 25 HA GLU 25 -0.878 2.365 -2.303
181 1HB GLU 25 2HB GLU 25 0.804 2.157 -4.771
182 2HB GLU 25 3HB GLU 25 1.054 3.561 -3.731
183 1HG GLU 25 2HG GLU 25 2.509 1.524 -3.197
184 2HG GLU 25 3HG GLU 25 1.615 2.136 -1.811
185 H LYS 26 H LYS 26 -1.689 3.293 -5.649
186 HA LYS 26 HA LYS 26 -1.903 6.129 -4.925
187 1HB LYS 26 2HB LYS 26 -2.392 4.516 -7.417
188 2HB LYS 26 3HB LYS 26 -3.003 6.168 -7.290
189 1HG LYS 26 2HG LYS 26 -0.731 5.966 -8.363
190 2HG LYS 26 3HG LYS 26 -0.856 7.107 -7.014
191 1HD LYS 26 2HD LYS 26 0.233 5.463 -5.515
192 2HD LYS 26 3HD LYS 26 0.357 4.323 -6.876
193 1HE LYS 26 2HE LYS 26 1.829 5.901 -8.070
194 2HE LYS 26 3HE LYS 26 1.560 7.140 -6.829
195 1HZ LYS 26 1HZ LYS 26 3.637 6.054 -6.488
196 2HZ LYS 26 2HZ LYS 26 2.643 5.720 -5.230
197 3HZ LYS 26 3HZ LYS 26 2.917 4.577 -6.380
198 H GLY 27 H GLY 27 -4.200 3.401 -5.101
199 1HA GLY 27 2HA GLY 27 -6.523 5.050 -4.499
200 2HA GLY 27 3HA GLY 27 -6.388 3.298 -4.360
201 H LEU 28 H LEU 28 -3.945 3.459 -2.635
202 HA LEU 28 HA LEU 28 -5.234 3.729 -0.032
203 1HB LEU 28 2HB LEU 28 -2.494 3.050 -1.016
204 2HB LEU 28 3HB LEU 28 -2.664 3.598 0.640
205 HG LEU 28 HG LEU 28 -3.992 1.762 1.291
206 1HD1 LEU 28 1HD1 LEU 28 -4.253 0.803 -1.557
207 2HD1 LEU 28 2HD1 LEU 28 -4.855 0.028 -0.090
208 3HD1 LEU 28 3HD1 LEU 28 -5.544 1.571 -0.604
209 1HD2 LEU 28 1HD2 LEU 28 -1.909 0.740 -0.694
210 2HD2 LEU 28 2HD2 LEU 28 -1.538 1.348 0.928
211 3HD2 LEU 28 3HD2 LEU 28 -2.518 -0.121 0.731
212 H LYS 29 H LYS 29 -2.845 5.725 -1.844
213 HA LYS 29 HA LYS 29 -2.515 7.816 -0.029
214 1HB LYS 29 2HB LYS 29 -1.303 7.634 -2.138
215 2HB LYS 29 3HB LYS 29 -2.783 7.965 -3.057
216 1HG LYS 29 2HG LYS 29 -2.928 10.215 -2.076
217 2HG LYS 29 3HG LYS 29 -1.515 9.874 -1.066
218 1HD LYS 29 2HD LYS 29 -0.151 9.552 -3.150
219 2HD LYS 29 3HD LYS 29 -1.560 9.968 -4.127
220 1HE LYS 29 2HE LYS 29 -0.007 11.760 -2.189
221 2HE LYS 29 3HE LYS 29 -0.054 11.885 -3.934
222 1HZ LYS 29 1HZ LYS 29 -2.412 12.438 -3.735
223 2HZ LYS 29 2HZ LYS 29 -2.302 12.341 -2.087
224 3HZ LYS 29 3HZ LYS 29 -1.459 13.492 -2.898
225 H ARG 30 H ARG 30 -5.359 7.087 -1.966
226 HA ARG 30 HA ARG 30 -6.674 9.643 -1.481
227 1HB ARG 30 2HB ARG 30 -7.260 7.069 -2.898
228 2HB ARG 30 3HB ARG 30 -8.653 7.985 -2.355
229 1HG ARG 30 2HG ARG 30 -7.909 9.964 -3.534
230 2HG ARG 30 3HG ARG 30 -6.377 9.183 -3.995
231 1HD ARG 30 2HD ARG 30 -7.465 7.616 -5.413
232 2HD ARG 30 3HD ARG 30 -9.069 7.991 -4.726
233 HE ARG 30 HE ARG 30 -8.016 10.365 -5.855
234 1HH1 ARG 30 2HH2 ARG 30 -9.180 7.217 -6.882
235 2HH1 ARG 30 1HH2 ARG 30 -9.956 7.771 -8.335
236 1HH2 ARG 30 2HH1 ARG 30 -9.043 11.176 -7.780
237 2HH2 ARG 30 1HH1 ARG 30 -9.841 10.090 -8.867
238 H MET 31 H MET 31 -6.063 7.159 0.714
239 HA MET 31 HA MET 31 -8.724 7.289 1.992
240 1HB MET 31 2HB MET 31 -6.219 5.689 2.675
241 2HB MET 31 3HB MET 31 -7.785 5.493 3.444
242 1HG MET 31 2HG MET 31 -7.161 5.022 0.508
243 2HG MET 31 3HG MET 31 -7.385 3.803 1.735
244 1HE MET 31 1HE MET 31 -10.132 4.957 3.282
245 2HE MET 31 2HE MET 31 -11.282 3.993 2.350
246 3HE MET 31 3HE MET 31 -9.739 3.286 2.877
247 HA PRO 32 HA PRO 32 -7.407 10.284 5.007
248 1HB PRO 32 2HB PRO 32 -8.622 9.395 7.316
249 2HB PRO 32 3HB PRO 32 -9.509 10.176 5.976
250 1HG PRO 32 2HG PRO 32 -9.159 7.210 6.469
251 2HG PRO 32 3HG PRO 32 -10.688 8.088 6.164
252 1HD PRO 32 2HD PRO 32 -9.405 6.827 4.180
253 2HD PRO 32 3HD PRO 32 -10.106 8.434 3.859
254 H GLY 33 H GLY 33 -5.692 10.472 6.479
255 1HA GLY 33 2HA GLY 33 -4.040 9.770 7.933
256 2HA GLY 33 3HA GLY 33 -4.532 8.081 7.707
257 H VAL 34 H VAL 34 -4.347 8.299 4.672
258 HA VAL 34 HA VAL 34 -1.430 7.797 4.602
259 HB VAL 34 HB VAL 34 -3.455 7.401 2.398
260 1HG1 VAL 34 1HG1 VAL 34 -0.691 6.192 2.929
261 2HG1 VAL 34 2HG1 VAL 34 -1.735 5.820 1.547
262 3HG1 VAL 34 3HG1 VAL 34 -1.041 7.437 1.722
263 1HG2 VAL 34 1HG2 VAL 34 -3.389 4.969 3.105
264 2HG2 VAL 34 2HG2 VAL 34 -2.553 5.483 4.590
265 3HG2 VAL 34 3HG2 VAL 34 -4.213 6.021 4.261
266 H THR 35 H THR 35 0.014 9.113 3.506
267 HA THR 35 HA THR 35 -1.157 11.558 2.218
268 HB THR 35 HB THR 35 1.011 11.233 4.153
269 HG1 THR 35 1HG THR 35 -0.630 13.387 3.338
270 1HG2 THR 35 1HG2 THR 35 2.151 13.301 3.326
271 2HG2 THR 35 2HG2 THR 35 2.470 11.848 2.372
272 3HG2 THR 35 3HG2 THR 35 1.337 13.090 1.768
273 H ASP 36 H ASP 36 1.371 8.969 1.866
274 HA ASP 36 HA ASP 36 0.908 9.161 -0.981
275 1HB ASP 36 2HB ASP 36 3.422 10.253 0.251
276 2HB ASP 36 3HB ASP 36 3.669 9.089 -1.047
277 H ALA 37 H ALA 37 2.072 7.343 -2.078
278 HA ALA 37 HA ALA 37 3.107 5.266 -0.390
279 1HB ALA 37 1HB ALA 37 1.358 3.684 -0.474
280 2HB ALA 37 2HB ALA 37 0.505 5.172 -0.110
281 3HB ALA 37 3HB ALA 37 0.499 4.567 -1.768
282 H ASN 38 H ASN 38 4.130 3.595 -1.619
283 HA ASN 38 HA ASN 38 4.513 4.202 -4.495
284 1HB ASN 38 2HB ASN 38 7.067 3.904 -3.065
285 2HB ASN 38 3HB ASN 38 6.583 5.022 -4.326
286 1HD2 ASN 38 1HD2 ASN 38 6.219 4.382 -0.799
287 2HD2 ASN 38 2HD2 ASN 38 6.324 6.082 -0.350
288 H VAL 39 H VAL 39 4.308 2.287 -5.476
289 HA VAL 39 HA VAL 39 5.114 -0.174 -4.097
290 HB VAL 39 HB VAL 39 3.017 0.100 -5.450
291 1HG1 VAL 39 1HG1 VAL 39 3.091 -0.159 -7.850
292 2HG1 VAL 39 2HG1 VAL 39 4.050 1.268 -7.446
293 3HG1 VAL 39 3HG1 VAL 39 4.838 -0.272 -7.874
294 1HG2 VAL 39 1HG2 VAL 39 4.921 -2.142 -6.179
295 2HG2 VAL 39 2HG2 VAL 39 3.941 -2.046 -4.700
296 3HG2 VAL 39 3HG2 VAL 39 3.145 -2.161 -6.264
297 H ASN 40 H ASN 40 7.163 -0.911 -4.143
298 HA ASN 40 HA ASN 40 8.987 0.086 -6.292
299 1HB ASN 40 2HB ASN 40 9.560 0.692 -3.930
300 2HB ASN 40 3HB ASN 40 9.684 -1.033 -3.553
301 1HD2 ASN 40 1HD2 ASN 40 11.950 0.122 -3.007
302 2HD2 ASN 40 2HD2 ASN 40 13.131 -0.015 -4.300
303 H LEU 41 H LEU 41 7.302 -1.580 -7.212
304 HA LEU 41 HA LEU 41 7.745 -4.360 -6.698
305 1HB LEU 41 2HB LEU 41 5.863 -2.810 -8.146
306 2HB LEU 41 3HB LEU 41 6.678 -3.756 -9.374
307 HG LEU 41 HG LEU 41 4.621 -4.807 -8.532
308 1HD1 LEU 41 1HD1 LEU 41 7.089 -6.437 -7.851
309 2HD1 LEU 41 2HD1 LEU 41 5.471 -7.057 -8.219
310 3HD1 LEU 41 3HD1 LEU 41 6.396 -6.206 -9.465
311 1HD2 LEU 41 1HD2 LEU 41 5.102 -5.993 -6.122
312 2HD2 LEU 41 2HD2 LEU 41 5.796 -4.391 -5.834
313 3HD2 LEU 41 3HD2 LEU 41 4.128 -4.544 -6.373
314 H ALA 42 H ALA 42 9.442 -2.043 -8.612
315 HA ALA 42 HA ALA 42 10.999 -3.574 -10.340
316 1HB ALA 42 1HB ALA 42 12.772 -1.945 -9.887
317 2HB ALA 42 2HB ALA 42 11.203 -1.111 -10.037
318 3HB ALA 42 3HB ALA 42 11.927 -1.399 -8.430
319 H THR 43 H THR 43 11.106 -3.439 -6.749
320 HA THR 43 HA THR 43 12.877 -5.810 -6.884
321 HB THR 43 HB THR 43 14.268 -3.955 -6.220
322 HG1 THR 43 1HG THR 43 13.625 -5.818 -4.196
323 1HG2 THR 43 1HG2 THR 43 13.996 -2.716 -4.195
324 2HG2 THR 43 2HG2 THR 43 12.451 -2.607 -5.054
325 3HG2 THR 43 3HG2 THR 43 12.620 -3.695 -3.667
326 H GLU 44 H GLU 44 10.075 -5.764 -6.935
327 HA GLU 44 HA GLU 44 8.209 -6.599 -5.930
328 1HB GLU 44 2HB GLU 44 10.431 -8.408 -4.898
329 2HB GLU 44 3HB GLU 44 8.713 -8.813 -4.850
330 1HG GLU 44 2HG GLU 44 8.528 -8.617 -7.292
331 2HG GLU 44 3HG GLU 44 10.246 -8.199 -7.407
332 H THR 45 H THR 45 9.152 -4.314 -4.366
333 HA THR 45 HA THR 45 8.265 -5.120 -1.631
334 HB THR 45 HB THR 45 10.352 -3.084 -2.545
335 HG1 THR 45 1HG THR 45 10.993 -5.332 -2.642
336 1HG2 THR 45 1HG2 THR 45 9.469 -3.970 0.221
337 2HG2 THR 45 2HG2 THR 45 10.899 -2.969 -0.123
338 3HG2 THR 45 3HG2 THR 45 9.282 -2.336 -0.481
339 H VAL 46 H VAL 46 7.030 -3.397 -0.520
340 HA VAL 46 HA VAL 46 6.226 -1.096 -2.211
341 HB VAL 46 HB VAL 46 4.482 -2.773 -2.474
342 1HG1 VAL 46 1HG1 VAL 46 3.023 -3.457 -0.641
343 2HG1 VAL 46 2HG1 VAL 46 4.681 -3.955 -0.251
344 3HG1 VAL 46 3HG1 VAL 46 3.956 -2.498 0.497
345 1HG2 VAL 46 1HG2 VAL 46 3.887 -0.305 -2.365
346 2HG2 VAL 46 2HG2 VAL 46 2.609 -1.465 -1.975
347 3HG2 VAL 46 3HG2 VAL 46 3.415 -0.556 -0.681
348 H ASN 47 H ASN 47 5.806 0.788 -1.128
349 HA ASN 47 HA ASN 47 6.424 0.848 1.774
350 1HB ASN 47 2HB ASN 47 7.441 2.626 -0.503
351 2HB ASN 47 3HB ASN 47 7.524 3.105 1.196
352 1HD2 ASN 47 1HD2 ASN 47 8.616 1.439 2.696
353 2HD2 ASN 47 2HD2 ASN 47 10.145 0.841 2.059
354 H VAL 48 H VAL 48 5.041 2.343 2.973
355 HA VAL 48 HA VAL 48 3.051 3.799 1.307
356 HB VAL 48 HB VAL 48 2.388 2.135 3.738
357 1HG1 VAL 48 1HG1 VAL 48 0.172 2.706 3.328
358 2HG1 VAL 48 2HG1 VAL 48 1.006 4.230 2.997
359 3HG1 VAL 48 3HG1 VAL 48 0.466 3.202 1.656
360 1HG2 VAL 48 1HG2 VAL 48 1.920 1.408 0.822
361 2HG2 VAL 48 2HG2 VAL 48 2.930 0.524 1.984
362 3HG2 VAL 48 3HG2 VAL 48 1.183 0.597 2.216
363 H ILE 49 H ILE 49 2.982 5.907 2.009
364 HA ILE 49 HA ILE 49 4.543 6.537 4.430
365 HB ILE 49 HB ILE 49 3.821 8.370 2.101
366 1HG1 ILE 49 2HG1 ILE 49 5.146 6.652 1.139
367 2HG1 ILE 49 3HG1 ILE 49 6.127 8.104 1.317
368 1HG2 ILE 49 1HG2 ILE 49 5.670 9.751 3.000
369 2HG2 ILE 49 2HG2 ILE 49 4.310 9.591 4.118
370 3HG2 ILE 49 3HG2 ILE 49 5.789 8.659 4.398
371 1HD1 ILE 49 1HD1 ILE 49 7.468 6.180 1.925
372 2HD1 ILE 49 2HD1 ILE 49 7.141 7.113 3.397
373 3HD1 ILE 49 3HD1 ILE 49 6.249 5.613 3.074
374 H TYR 50 H TYR 50 3.131 6.797 6.156
375 HA TYR 50 HA TYR 50 0.643 8.349 5.716
376 1HB TYR 50 2HB TYR 50 -0.757 6.663 6.650
377 2HB TYR 50 3HB TYR 50 -0.015 6.098 5.183
378 HD1 TYR 50 HD1 TYR 50 0.542 5.907 8.938
379 HD2 TYR 50 HD2 TYR 50 0.665 3.882 5.156
380 HE1 TYR 50 HE1 TYR 50 1.032 3.803 10.084
381 HE2 TYR 50 HE2 TYR 50 0.760 1.705 6.332
382 HH TYR 50 HH TYR 50 1.258 1.464 9.798
383 H ASP 51 H ASP 51 -0.527 8.703 7.664
384 HA ASP 51 HA ASP 51 1.290 9.429 9.811
385 1HB ASP 51 2HB ASP 51 -1.690 9.875 9.817
386 2HB ASP 51 3HB ASP 51 -0.401 10.666 10.767
387 HA PRO 52 HA PRO 52 0.074 5.492 11.770
388 1HB PRO 52 2HB PRO 52 1.922 5.339 13.753
389 2HB PRO 52 3HB PRO 52 2.311 5.055 12.033
390 1HG PRO 52 2HG PRO 52 2.635 7.647 13.577
391 2HG PRO 52 3HG PRO 52 3.873 6.802 12.597
392 1HD PRO 52 2HD PRO 52 2.425 8.817 11.582
393 2HD PRO 52 3HD PRO 52 2.794 7.386 10.573
394 H ALA 53 H ALA 53 -0.707 8.563 12.669
395 HA ALA 53 HA ALA 53 -1.743 7.944 15.365
396 1HB ALA 53 1HB ALA 53 -1.855 10.421 13.589
397 2HB ALA 53 2HB ALA 53 -2.505 10.292 15.238
398 3HB ALA 53 3HB ALA 53 -0.753 10.177 14.965
399 H GLU 54 H GLU 54 -2.513 7.925 11.935
400 HA GLU 54 HA GLU 54 -5.415 7.853 12.516
401 1HB GLU 54 2HB GLU 54 -3.883 9.599 10.813
402 2HB GLU 54 3HB GLU 54 -4.870 8.553 9.790
403 1HG GLU 54 2HG GLU 54 -6.041 10.098 12.123
404 2HG GLU 54 3HG GLU 54 -5.922 10.737 10.476
405 H THR 55 H THR 55 -2.952 6.770 10.126
406 HA THR 55 HA THR 55 -4.349 4.155 10.027
407 HB THR 55 HB THR 55 -2.871 3.674 7.945
408 HG1 THR 55 1HG THR 55 -3.169 6.425 7.843
409 1HG2 THR 55 1HG2 THR 55 -5.247 3.746 8.030
410 2HG2 THR 55 2HG2 THR 55 -5.274 5.529 7.974
411 3HG2 THR 55 3HG2 THR 55 -4.648 4.607 6.583
412 H GLY 56 H GLY 56 -1.984 2.644 9.333
413 1HA GLY 56 2HA GLY 56 -0.431 1.741 11.228
414 2HA GLY 56 3HA GLY 56 -1.836 2.151 12.227
415 H THR 57 H THR 57 -0.872 0.542 9.499
416 HA THR 57 HA THR 57 -1.644 -0.307 7.740
417 HB THR 57 HB THR 57 -1.337 -2.781 7.882
418 HG1 THR 57 1HG THR 57 -0.898 -3.611 9.990
419 1HG2 THR 57 1HG2 THR 57 0.952 -2.781 8.709
420 2HG2 THR 57 2HG2 THR 57 0.664 -1.272 7.823
421 3HG2 THR 57 3HG2 THR 57 0.690 -1.277 9.604
422 H ALA 58 H ALA 58 -3.839 -1.040 10.332
423 HA ALA 58 HA ALA 58 -5.965 -2.379 9.549
424 1HB ALA 58 1HB ALA 58 -7.283 -0.473 10.543
425 2HB ALA 58 2HB ALA 58 -5.814 -0.871 11.475
426 3HB ALA 58 3HB ALA 58 -5.812 0.532 10.404
427 H ALA 59 H ALA 59 -5.335 0.883 8.152
428 HA ALA 59 HA ALA 59 -7.919 0.554 6.683
429 1HB ALA 59 1HB ALA 59 -5.975 2.798 6.206
430 2HB ALA 59 2HB ALA 59 -7.695 2.725 5.821
431 3HB ALA 59 3HB ALA 59 -7.206 2.811 7.522
432 H ILE 60 H ILE 60 -4.487 0.578 6.029
433 HA ILE 60 HA ILE 60 -4.493 0.340 3.214
434 HB ILE 60 HB ILE 60 -2.593 -0.284 5.495
435 1HG1 ILE 60 2HG1 ILE 60 -1.158 1.113 3.854
436 2HG1 ILE 60 3HG1 ILE 60 -2.671 1.453 3.026
437 1HG2 ILE 60 1HG2 ILE 60 -2.013 -1.226 2.681
438 2HG2 ILE 60 2HG2 ILE 60 -0.860 -1.099 4.032
439 3HG2 ILE 60 3HG2 ILE 60 -2.187 -2.245 4.132
440 1HD1 ILE 60 1HD1 ILE 60 -3.542 2.497 5.134
441 2HD1 ILE 60 2HD1 ILE 60 -2.069 1.986 5.993
442 3HD1 ILE 60 3HD1 ILE 60 -1.975 3.203 4.712
443 H GLN 61 H GLN 61 -4.506 -2.187 5.754
444 HA GLN 61 HA GLN 61 -4.476 -4.276 3.836
445 1HB GLN 61 2HB GLN 61 -4.049 -4.044 6.508
446 2HB GLN 61 3HB GLN 61 -5.557 -4.963 6.504
447 1HG GLN 61 2HG GLN 61 -4.516 -6.787 5.375
448 2HG GLN 61 3HG GLN 61 -3.201 -5.785 4.743
449 1HE2 GLN 61 1HE2 GLN 61 -1.730 -4.725 6.389
450 2HE2 GLN 61 2HE2 GLN 61 -1.297 -5.721 7.775
451 H GLU 62 H GLU 62 -7.168 -2.799 5.719
452 HA GLU 62 HA GLU 62 -9.380 -4.188 4.707
453 1HB GLU 62 2HB GLU 62 -8.795 -1.399 5.665
454 2HB GLU 62 3HB GLU 62 -10.254 -1.568 4.718
455 1HG GLU 62 2HG GLU 62 -9.634 -3.316 7.132
456 2HG GLU 62 3HG GLU 62 -10.563 -1.810 7.203
457 H LYS 63 H LYS 63 -7.813 -1.282 3.235
458 HA LYS 63 HA LYS 63 -9.464 -1.354 0.949
459 1HB LYS 63 2HB LYS 63 -6.955 0.056 1.846
460 2HB LYS 63 3HB LYS 63 -7.436 0.154 0.182
461 1HG LYS 63 2HG LYS 63 -9.377 0.711 2.461
462 2HG LYS 63 3HG LYS 63 -8.315 1.935 1.779
463 1HD LYS 63 2HD LYS 63 -10.475 0.423 0.212
464 2HD LYS 63 3HD LYS 63 -10.581 2.062 0.818
465 1HE LYS 63 2HE LYS 63 -8.210 2.218 -0.604
466 2HE LYS 63 3HE LYS 63 -9.073 0.962 -1.519
467 1HZ LYS 63 1HZ LYS 63 -10.871 2.544 -1.786
468 2HZ LYS 63 2HZ LYS 63 -10.033 3.652 -0.876
469 3HZ LYS 63 3HZ LYS 63 -9.450 3.180 -2.340
470 H ILE 64 H ILE 64 -6.260 -2.763 1.610
471 HA ILE 64 HA ILE 64 -5.323 -3.160 -0.930
472 HB ILE 64 HB ILE 64 -4.876 -4.195 1.747
473 1HG1 ILE 64 2HG1 ILE 64 -3.640 -2.348 0.595
474 2HG1 ILE 64 3HG1 ILE 64 -2.669 -3.609 1.350
475 1HG2 ILE 64 1HG2 ILE 64 -3.343 -6.001 1.030
476 2HG2 ILE 64 2HG2 ILE 64 -5.066 -6.365 0.930
477 3HG2 ILE 64 3HG2 ILE 64 -4.157 -5.973 -0.554
478 1HD1 ILE 64 1HD1 ILE 64 -2.293 -4.674 -0.849
479 2HD1 ILE 64 2HD1 ILE 64 -3.261 -3.408 -1.625
480 3HD1 ILE 64 3HD1 ILE 64 -1.740 -2.990 -0.804
481 H GLU 65 H GLU 65 -7.317 -5.284 1.211
482 HA GLU 65 HA GLU 65 -7.994 -7.366 -0.588
483 1HB GLU 65 2HB GLU 65 -9.359 -6.166 1.855
484 2HB GLU 65 3HB GLU 65 -10.052 -7.529 0.975
485 1HG GLU 65 2HG GLU 65 -7.193 -7.657 1.942
486 2HG GLU 65 3HG GLU 65 -8.546 -8.018 3.022
487 H LYS 66 H LYS 66 -9.952 -4.462 0.292
488 HA LYS 66 HA LYS 66 -12.044 -4.914 -1.518
489 1HB LYS 66 2HB LYS 66 -10.955 -2.588 -0.024
490 2HB LYS 66 3HB LYS 66 -11.930 -2.142 -1.415
491 1HG LYS 66 2HG LYS 66 -12.918 -4.181 0.609
492 2HG LYS 66 3HG LYS 66 -13.081 -2.444 0.894
493 1HD LYS 66 2HD LYS 66 -14.298 -2.129 -1.205
494 2HD LYS 66 3HD LYS 66 -14.114 -3.845 -1.620
495 1HE LYS 66 2HE LYS 66 -15.460 -4.501 0.337
496 2HE LYS 66 3HE LYS 66 -15.574 -2.814 0.866
497 1HZ LYS 66 1HZ LYS 66 -16.686 -3.877 -1.649
498 2HZ LYS 66 2HZ LYS 66 -17.543 -3.534 -0.289
499 3HZ LYS 66 3HZ LYS 66 -16.811 -2.321 -1.121
500 H LEU 67 H LEU 67 -8.937 -3.402 -2.196
501 HA LEU 67 HA LEU 67 -9.578 -2.464 -4.851
502 1HB LEU 67 2HB LEU 67 -7.008 -2.903 -3.332
503 2HB LEU 67 3HB LEU 67 -7.040 -2.246 -4.975
504 HG LEU 67 HG LEU 67 -8.732 -0.982 -2.806
505 1HD1 LEU 67 1HD1 LEU 67 -6.998 0.554 -2.203
506 2HD1 LEU 67 2HD1 LEU 67 -6.405 -1.096 -1.926
507 3HD1 LEU 67 3HD1 LEU 67 -5.888 -0.172 -3.338
508 1HD2 LEU 67 1HD2 LEU 67 -9.086 -0.273 -5.183
509 2HD2 LEU 67 2HD2 LEU 67 -8.452 1.042 -4.182
510 3HD2 LEU 67 3HD2 LEU 67 -7.370 0.168 -5.282
511 H GLY 68 H GLY 68 -8.869 -5.589 -3.535
512 1HA GLY 68 2HA GLY 68 -9.039 -7.592 -4.644
513 2HA GLY 68 3HA GLY 68 -8.875 -6.793 -6.215
514 H TYR 69 H TYR 69 -6.748 -6.553 -3.282
515 HA TYR 69 HA TYR 69 -4.519 -7.878 -4.755
516 1HB TYR 69 2HB TYR 69 -4.946 -5.076 -4.140
517 2HB TYR 69 3HB TYR 69 -3.605 -5.656 -3.168
518 HD1 TYR 69 HD1 TYR 69 -1.477 -6.180 -4.166
519 HD2 TYR 69 HD2 TYR 69 -4.906 -5.375 -6.651
520 HE1 TYR 69 HE1 TYR 69 -0.004 -5.868 -6.095
521 HE2 TYR 69 HE2 TYR 69 -3.452 -5.341 -8.639
522 HH TYR 69 HH TYR 69 0.095 -5.806 -8.412
523 H HIS 70 H HIS 70 -2.604 -8.113 -3.069
524 HA HIS 70 HA HIS 70 -3.586 -8.256 -0.314
525 1HB HIS 70 2HB HIS 70 -3.944 -10.501 -1.464
526 2HB HIS 70 3HB HIS 70 -2.193 -10.634 -1.588
527 HD1 HIS 70 1HD HIS 70 -2.680 -12.896 -0.059
528 HD2 HIS 70 2HD HIS 70 -3.614 -9.204 1.729
529 HE1 HIS 70 1HE HIS 70 -3.036 -13.344 2.425
530 H VAL 71 H VAL 71 -1.717 -8.381 1.232
531 HA VAL 71 HA VAL 71 0.844 -7.475 0.089
532 HB VAL 71 HB VAL 71 -0.635 -5.493 0.622
533 1HG1 VAL 71 1HG1 VAL 71 -1.035 -4.847 2.916
534 2HG1 VAL 71 2HG1 VAL 71 -1.749 -6.452 2.675
535 3HG1 VAL 71 3HG1 VAL 71 -0.207 -6.284 3.536
536 1HG2 VAL 71 1HG2 VAL 71 1.785 -5.290 0.537
537 2HG2 VAL 71 2HG2 VAL 71 1.114 -4.249 1.800
538 3HG2 VAL 71 3HG2 VAL 71 1.896 -5.783 2.248
539 H VAL 72 H VAL 72 2.596 -8.110 1.412
540 HA VAL 72 HA VAL 72 1.867 -10.098 3.510
541 HB VAL 72 HB VAL 72 4.272 -10.324 1.804
542 1HG1 VAL 72 1HG1 VAL 72 2.687 -12.340 3.451
543 2HG1 VAL 72 2HG1 VAL 72 4.191 -12.664 2.567
544 3HG1 VAL 72 3HG1 VAL 72 4.204 -11.567 3.954
545 1HG2 VAL 72 1HG2 VAL 72 1.550 -11.586 1.280
546 2HG2 VAL 72 2HG2 VAL 72 2.406 -10.443 0.217
547 3HG2 VAL 72 3HG2 VAL 72 3.070 -12.058 0.488
548 H ILE 73 H ILE 73 2.857 -9.893 5.370
549 HA ILE 73 HA ILE 73 4.435 -7.394 5.806
550 HB ILE 73 HB ILE 73 2.724 -8.929 7.766
551 1HG1 ILE 73 2HG1 ILE 73 1.274 -7.968 6.069
552 2HG1 ILE 73 3HG1 ILE 73 1.166 -7.051 7.563
553 1HG2 ILE 73 1HG2 ILE 73 2.965 -6.763 9.068
554 2HG2 ILE 73 2HG2 ILE 73 4.448 -7.709 8.944
555 3HG2 ILE 73 3HG2 ILE 73 4.237 -6.287 7.917
556 1HD1 ILE 73 1HD1 ILE 73 2.656 -5.288 6.584
557 2HD1 ILE 73 2HD1 ILE 73 2.660 -6.191 5.050
558 3HD1 ILE 73 3HD1 ILE 73 1.152 -5.531 5.688
559 H GLU 74 H GLU 74 6.229 -8.714 4.944
560 HA GLU 74 HA GLU 74 7.294 -10.794 6.438
561 1HB GLU 74 2HB GLU 74 7.912 -9.455 4.021
562 2HB GLU 74 3HB GLU 74 9.393 -9.647 4.969
563 1HG GLU 74 2HG GLU 74 9.156 -11.580 3.547
564 2HG GLU 74 3HG GLU 74 8.847 -12.098 5.210
565 H GLY 75 H GLY 75 7.073 -7.832 7.526
566 1HA GLY 75 2HA GLY 75 8.001 -6.670 9.319
567 2HA GLY 75 3HA GLY 75 8.958 -8.118 9.676
568 H ARG 76 H ARG 76 8.825 -5.156 7.627
569 HA ARG 76 HA ARG 76 11.706 -4.935 7.678
570 1HB ARG 76 2HB ARG 76 10.250 -5.672 5.220
571 2HB ARG 76 3HB ARG 76 10.828 -4.018 5.117
572 1HG ARG 76 2HG ARG 76 12.608 -5.223 4.241
573 2HG ARG 76 3HG ARG 76 13.109 -4.873 5.894
574 1HD ARG 76 2HD ARG 76 11.876 -7.327 6.248
575 2HD ARG 76 3HD ARG 76 12.330 -7.462 4.572
576 HE ARG 76 HE ARG 76 14.593 -7.418 5.085
577 1HH1 ARG 76 2HH2 ARG 76 12.666 -7.147 8.088
578 2HH1 ARG 76 1HH2 ARG 76 14.037 -7.263 9.126
579 1HH2 ARG 76 2HH1 ARG 76 16.398 -7.626 6.493
580 2HH2 ARG 76 1HH1 ARG 76 16.180 -7.595 8.212
Start of MODEL 22
1 1H MET 1 H1 MET 1 1.930 21.659 15.838
2 2H MET 1 H2 MET 1 2.494 22.554 14.546
3 3H MET 1 H3 MET 1 0.907 22.070 14.631
4 HA MET 1 HA MET 1 1.902 20.574 13.149
5 1HB MET 1 2HB MET 1 4.005 20.370 15.350
6 2HB MET 1 3HB MET 1 3.839 19.162 14.071
7 1HG MET 1 2HG MET 1 4.312 20.778 12.346
8 2HG MET 1 3HG MET 1 4.333 22.113 13.511
9 1HE MET 1 1HE MET 1 6.600 22.927 12.462
10 2HE MET 1 2HE MET 1 8.047 21.902 12.339
11 3HE MET 1 3HE MET 1 6.621 21.542 11.340
12 H LEU 2 H LEU 2 1.193 18.355 13.212
13 HA LEU 2 HA LEU 2 0.711 16.891 15.561
14 1HB LEU 2 2HB LEU 2 -1.370 18.676 15.228
15 2HB LEU 2 3HB LEU 2 -1.862 17.432 14.086
16 HG LEU 2 HG LEU 2 -1.343 15.808 16.175
17 1HD1 LEU 2 1HD1 LEU 2 -2.062 18.450 17.524
18 2HD1 LEU 2 2HD1 LEU 2 -1.867 16.874 18.314
19 3HD1 LEU 2 3HD1 LEU 2 -0.462 17.681 17.592
20 1HD2 LEU 2 1HD2 LEU 2 -3.841 17.530 15.940
21 2HD2 LEU 2 2HD2 LEU 2 -3.521 16.000 15.091
22 3HD2 LEU 2 3HD2 LEU 2 -3.706 16.011 16.854
23 H SER 3 H SER 3 -0.485 14.755 14.646
24 HA SER 3 HA SER 3 -0.400 13.032 13.215
25 1HB SER 3 2HB SER 3 -0.793 15.196 11.100
26 2HB SER 3 3HB SER 3 -1.036 13.466 10.866
27 HG SER 3 HG SER 3 -2.678 13.465 12.293
28 H GLU 4 H GLU 4 1.731 12.343 13.635
29 HA GLU 4 HA GLU 4 4.027 13.351 12.229
30 1HB GLU 4 2HB GLU 4 3.386 11.065 14.012
31 2HB GLU 4 3HB GLU 4 4.796 10.912 13.001
32 1HG GLU 4 2HG GLU 4 5.466 13.191 13.909
33 2HG GLU 4 3HG GLU 4 4.250 12.875 15.156
34 H GLN 5 H GLN 5 5.330 11.583 10.907
35 HA GLN 5 HA GLN 5 3.540 10.053 9.115
36 1HB GLN 5 2HB GLN 5 5.843 11.867 8.382
37 2HB GLN 5 3HB GLN 5 5.121 10.774 7.224
38 1HG GLN 5 2HG GLN 5 3.449 12.914 8.673
39 2HG GLN 5 3HG GLN 5 4.392 13.257 7.242
40 1HE2 GLN 5 1HE2 GLN 5 3.209 10.008 7.142
41 2HE2 GLN 5 2HE2 GLN 5 1.904 10.324 6.041
42 H LYS 6 H LYS 6 4.357 8.109 8.585
43 HA LYS 6 HA LYS 6 7.222 7.559 8.841
44 1HB LYS 6 2HB LYS 6 5.074 5.859 10.092
45 2HB LYS 6 3HB LYS 6 6.594 5.171 9.609
46 1HG LYS 6 2HG LYS 6 7.099 7.587 11.191
47 2HG LYS 6 3HG LYS 6 6.014 6.518 12.041
48 1HD LYS 6 2HD LYS 6 8.225 6.058 12.723
49 2HD LYS 6 3HD LYS 6 7.658 4.642 11.841
50 1HE LYS 6 2HE LYS 6 9.231 6.835 10.416
51 2HE LYS 6 3HE LYS 6 10.103 5.720 11.463
52 1HZ LYS 6 1HZ LYS 6 9.824 5.279 8.992
53 2HZ LYS 6 2HZ LYS 6 9.742 3.981 10.025
54 3HZ LYS 6 3HZ LYS 6 8.405 4.640 9.322
55 H GLU 7 H GLU 7 7.886 5.855 7.612
56 HA GLU 7 HA GLU 7 6.387 5.279 5.150
57 1HB GLU 7 2HB GLU 7 9.302 4.681 5.295
58 2HB GLU 7 3HB GLU 7 8.376 5.430 4.020
59 1HG GLU 7 2HG GLU 7 9.867 7.082 4.622
60 2HG GLU 7 3HG GLU 7 8.473 7.585 5.578
61 H ILE 8 H ILE 8 5.628 3.127 5.338
62 HA ILE 8 HA ILE 8 7.184 1.261 7.020
63 HB ILE 8 HB ILE 8 4.453 1.071 5.874
64 1HG1 ILE 8 2HG1 ILE 8 4.226 2.872 7.398
65 2HG1 ILE 8 3HG1 ILE 8 3.498 1.409 8.084
66 1HG2 ILE 8 1HG2 ILE 8 6.075 -0.511 7.782
67 2HG2 ILE 8 2HG2 ILE 8 4.294 -0.714 7.684
68 3HG2 ILE 8 3HG2 ILE 8 5.297 -1.042 6.256
69 1HD1 ILE 8 1HD1 ILE 8 5.510 0.978 9.369
70 2HD1 ILE 8 2HD1 ILE 8 6.240 2.458 8.710
71 3HD1 ILE 8 3HD1 ILE 8 4.807 2.572 9.763
72 H ALA 9 H ALA 9 7.362 -0.919 5.916
73 HA ALA 9 HA ALA 9 7.563 -0.816 2.982
74 1HB ALA 9 1HB ALA 9 9.810 -1.738 3.004
75 2HB ALA 9 2HB ALA 9 9.845 -0.221 3.932
76 3HB ALA 9 3HB ALA 9 9.836 -1.772 4.779
77 H MET 10 H MET 10 6.746 -2.801 2.188
78 HA MET 10 HA MET 10 7.201 -5.213 3.679
79 1HB MET 10 2HB MET 10 4.963 -5.891 4.158
80 2HB MET 10 3HB MET 10 5.294 -4.409 5.019
81 1HG MET 10 2HG MET 10 3.908 -4.311 2.335
82 2HG MET 10 3HG MET 10 3.039 -4.778 3.797
83 1HE MET 10 1HE MET 10 3.172 -3.275 6.065
84 2HE MET 10 2HE MET 10 2.288 -1.760 5.745
85 3HE MET 10 3HE MET 10 1.675 -3.298 5.101
86 H GLN 11 H GLN 11 5.602 -7.034 2.515
87 HA GLN 11 HA GLN 11 6.530 -6.929 -0.310
88 1HB GLN 11 2HB GLN 11 5.862 -9.115 1.713
89 2HB GLN 11 3HB GLN 11 5.856 -9.477 -0.008
90 1HG GLN 11 2HG GLN 11 8.209 -8.427 1.626
91 2HG GLN 11 3HG GLN 11 7.999 -10.083 1.029
92 1HE2 GLN 11 1HE2 GLN 11 7.175 -9.834 -1.577
93 2HE2 GLN 11 2HE2 GLN 11 8.149 -8.704 -2.474
94 H VAL 12 H VAL 12 5.022 -8.023 -1.919
95 HA VAL 12 HA VAL 12 2.156 -7.781 -1.220
96 HB VAL 12 HB VAL 12 1.924 -6.952 -3.672
97 1HG1 VAL 12 1HG1 VAL 12 2.898 -5.103 -1.483
98 2HG1 VAL 12 2HG1 VAL 12 2.000 -4.600 -2.929
99 3HG1 VAL 12 3HG1 VAL 12 1.226 -5.651 -1.730
100 1HG2 VAL 12 1HG2 VAL 12 4.714 -5.851 -3.109
101 2HG2 VAL 12 2HG2 VAL 12 4.347 -7.149 -4.272
102 3HG2 VAL 12 3HG2 VAL 12 3.676 -5.521 -4.500
103 H SER 13 H SER 13 0.733 -8.980 -2.565
104 HA SER 13 HA SER 13 1.847 -11.042 -4.315
105 1HB SER 13 2HB SER 13 0.397 -11.695 -1.704
106 2HB SER 13 3HB SER 13 0.631 -12.852 -3.028
107 HG SER 13 HG SER 13 2.277 -13.028 -1.449
108 H GLY 14 H GLY 14 0.000 -12.283 -5.306
109 1HA GLY 14 2HA GLY 14 -2.066 -12.372 -6.346
110 2HA GLY 14 3HA GLY 14 -2.698 -11.204 -5.171
111 H MET 15 H MET 15 -0.402 -11.419 -7.960
112 HA MET 15 HA MET 15 -1.385 -8.884 -9.052
113 1HB MET 15 2HB MET 15 0.765 -7.850 -9.054
114 2HB MET 15 3HB MET 15 0.446 -8.369 -7.388
115 1HG MET 15 2HG MET 15 2.625 -9.043 -7.592
116 2HG MET 15 3HG MET 15 1.836 -10.511 -8.162
117 1HE MET 15 1HE MET 15 4.137 -11.029 -11.036
118 2HE MET 15 2HE MET 15 4.137 -11.268 -9.269
119 3HE MET 15 3HE MET 15 2.680 -11.650 -10.229
120 H THR 16 H THR 16 -0.331 -8.504 -11.193
121 HA THR 16 HA THR 16 0.823 -10.929 -12.484
122 HB THR 16 HB THR 16 -0.382 -9.975 -14.618
123 HG1 THR 16 1HG THR 16 -2.188 -9.205 -12.568
124 1HG2 THR 16 1HG2 THR 16 -0.776 -12.217 -13.800
125 2HG2 THR 16 2HG2 THR 16 -1.810 -11.622 -12.486
126 3HG2 THR 16 3HG2 THR 16 -2.335 -11.465 -14.179
127 H CYS 17 H CYS 17 0.132 -7.439 -13.114
128 HA CYS 17 HA CYS 17 2.908 -7.194 -14.161
129 1HB CYS 17 2HB CYS 17 2.075 -5.383 -15.520
130 2HB CYS 17 3HB CYS 17 1.094 -6.836 -15.774
131 H ALA 18 H ALA 18 4.153 -5.389 -13.662
132 HA ALA 18 HA ALA 18 3.809 -4.265 -10.991
133 1HB ALA 18 1HB ALA 18 5.953 -3.129 -11.541
134 2HB ALA 18 2HB ALA 18 6.026 -4.877 -11.836
135 3HB ALA 18 3HB ALA 18 5.850 -3.756 -13.199
136 H ALA 19 H ALA 19 1.549 -3.560 -12.207
137 HA ALA 19 HA ALA 19 1.815 -0.631 -12.648
138 1HB ALA 19 1HB ALA 19 1.965 -1.660 -14.901
139 2HB ALA 19 2HB ALA 19 0.376 -2.410 -14.648
140 3HB ALA 19 3HB ALA 19 0.525 -0.645 -14.689
141 H CYS 20 H CYS 20 -0.599 -3.371 -12.494
142 HA CYS 20 HA CYS 20 -2.625 -1.707 -11.302
143 1HB CYS 20 2HB CYS 20 -3.472 -3.902 -10.343
144 2HB CYS 20 3HB CYS 20 -3.342 -3.850 -12.109
145 H ALA 21 H ALA 21 0.108 -3.496 -10.037
146 HA ALA 21 HA ALA 21 -0.009 -3.090 -7.328
147 1HB ALA 21 1HB ALA 21 2.290 -3.496 -7.327
148 2HB ALA 21 2HB ALA 21 1.796 -4.216 -8.851
149 3HB ALA 21 3HB ALA 21 2.564 -2.621 -8.854
150 H ALA 22 H ALA 22 0.515 -0.564 -9.782
151 HA ALA 22 HA ALA 22 1.363 1.462 -7.837
152 1HB ALA 22 1HB ALA 22 0.326 1.791 -10.682
153 2HB ALA 22 2HB ALA 22 1.146 3.006 -9.686
154 3HB ALA 22 3HB ALA 22 2.035 1.568 -10.237
155 H ARG 23 H ARG 23 -1.586 0.645 -9.724
156 HA ARG 23 HA ARG 23 -3.134 2.826 -8.740
157 1HB ARG 23 2HB ARG 23 -3.934 0.164 -9.974
158 2HB ARG 23 3HB ARG 23 -5.114 1.350 -9.411
159 1HG ARG 23 2HG ARG 23 -4.937 2.514 -11.308
160 2HG ARG 23 3HG ARG 23 -3.262 2.877 -10.923
161 1HD ARG 23 2HD ARG 23 -3.167 1.966 -13.038
162 2HD ARG 23 3HD ARG 23 -2.626 0.646 -11.981
163 HE ARG 23 HE ARG 23 -5.412 0.359 -12.295
164 1HH1 ARG 23 2HH2 ARG 23 -2.513 0.169 -14.262
165 2HH1 ARG 23 1HH2 ARG 23 -3.250 -0.648 -15.606
166 1HH2 ARG 23 2HH1 ARG 23 -6.480 -0.698 -14.085
167 2HH2 ARG 23 1HH1 ARG 23 -5.570 -1.173 -15.479
168 H ILE 24 H ILE 24 -2.736 -0.493 -7.409
169 HA ILE 24 HA ILE 24 -4.652 -0.108 -5.386
170 HB ILE 24 HB ILE 24 -3.699 -1.832 -4.094
171 1HG1 ILE 24 2HG1 ILE 24 -1.302 -1.356 -5.787
172 2HG1 ILE 24 3HG1 ILE 24 -1.412 -1.278 -4.011
173 1HG2 ILE 24 1HG2 ILE 24 -3.968 -3.558 -5.637
174 2HG2 ILE 24 2HG2 ILE 24 -4.837 -2.231 -6.408
175 3HG2 ILE 24 3HG2 ILE 24 -3.214 -2.666 -6.969
176 1HD1 ILE 24 1HD1 ILE 24 -1.514 -3.772 -5.695
177 2HD1 ILE 24 2HD1 ILE 24 -0.169 -3.256 -4.674
178 3HD1 ILE 24 3HD1 ILE 24 -1.716 -3.719 -3.921
179 H GLU 25 H GLU 25 -1.140 0.630 -5.190
180 HA GLU 25 HA GLU 25 -1.165 1.802 -2.642
181 1HB GLU 25 2HB GLU 25 0.629 2.005 -5.056
182 2HB GLU 25 3HB GLU 25 0.877 3.113 -3.699
183 1HG GLU 25 2HG GLU 25 0.663 0.113 -3.253
184 2HG GLU 25 3HG GLU 25 2.187 0.942 -3.600
185 H LYS 26 H LYS 26 -1.955 3.200 -5.794
186 HA LYS 26 HA LYS 26 -1.897 5.943 -4.820
187 1HB LYS 26 2HB LYS 26 -3.090 4.780 -7.344
188 2HB LYS 26 3HB LYS 26 -2.873 6.507 -7.031
189 1HG LYS 26 2HG LYS 26 -0.503 4.602 -6.879
190 2HG LYS 26 3HG LYS 26 -1.085 5.191 -8.435
191 1HD LYS 26 2HD LYS 26 -0.600 7.470 -7.815
192 2HD LYS 26 3HD LYS 26 -0.247 7.012 -6.130
193 1HE LYS 26 2HE LYS 26 1.684 5.695 -6.777
194 2HE LYS 26 3HE LYS 26 1.301 5.856 -8.498
195 1HZ LYS 26 1HZ LYS 26 1.780 8.202 -8.320
196 2HZ LYS 26 2HZ LYS 26 2.152 8.045 -6.717
197 3HZ LYS 26 3HZ LYS 26 3.068 7.298 -7.853
198 H GLY 27 H GLY 27 -4.550 3.591 -5.486
199 1HA GLY 27 2HA GLY 27 -6.678 5.305 -4.537
200 2HA GLY 27 3HA GLY 27 -6.718 3.540 -4.621
201 H LEU 28 H LEU 28 -4.450 2.985 -2.990
202 HA LEU 28 HA LEU 28 -5.501 3.072 -0.322
203 1HB LEU 28 2HB LEU 28 -4.172 1.363 -1.197
204 2HB LEU 28 3HB LEU 28 -2.792 2.434 -1.421
205 HG LEU 28 HG LEU 28 -4.029 2.024 1.315
206 1HD1 LEU 28 1HD1 LEU 28 -2.328 0.183 1.547
207 2HD1 LEU 28 2HD1 LEU 28 -3.687 -0.148 0.461
208 3HD1 LEU 28 3HD1 LEU 28 -2.084 0.261 -0.206
209 1HD2 LEU 28 1HD2 LEU 28 -1.956 3.676 0.290
210 2HD2 LEU 28 2HD2 LEU 28 -2.166 3.238 1.978
211 3HD2 LEU 28 3HD2 LEU 28 -1.093 2.278 0.919
212 H LYS 29 H LYS 29 -3.161 5.185 -2.064
213 HA LYS 29 HA LYS 29 -2.531 6.831 0.098
214 1HB LYS 29 2HB LYS 29 -1.632 6.826 -2.377
215 2HB LYS 29 3HB LYS 29 -2.912 8.006 -2.654
216 1HG LYS 29 2HG LYS 29 -1.566 8.831 -0.240
217 2HG LYS 29 3HG LYS 29 -0.335 8.234 -1.326
218 1HD LYS 29 2HD LYS 29 -0.291 10.269 -2.228
219 2HD LYS 29 3HD LYS 29 -1.794 9.889 -3.047
220 1HE LYS 29 2HE LYS 29 -1.506 11.165 -0.274
221 2HE LYS 29 3HE LYS 29 -1.745 12.073 -1.769
222 1HZ LYS 29 1HZ LYS 29 -3.767 11.824 -0.576
223 2HZ LYS 29 2HZ LYS 29 -3.901 10.847 -1.903
224 3HZ LYS 29 3HZ LYS 29 -3.588 10.212 -0.412
225 H ARG 30 H ARG 30 -5.541 6.661 -1.721
226 HA ARG 30 HA ARG 30 -6.405 9.368 -1.052
227 1HB ARG 30 2HB ARG 30 -7.410 7.079 -2.621
228 2HB ARG 30 3HB ARG 30 -8.681 7.918 -1.785
229 1HG ARG 30 2HG ARG 30 -6.573 9.346 -3.477
230 2HG ARG 30 3HG ARG 30 -7.997 8.584 -4.176
231 1HD ARG 30 2HD ARG 30 -9.394 10.020 -2.475
232 2HD ARG 30 3HD ARG 30 -7.910 10.914 -2.214
233 HE ARG 30 HE ARG 30 -8.206 11.992 -4.209
234 1HH1 ARG 30 2HH2 ARG 30 -10.140 9.058 -4.247
235 2HH1 ARG 30 1HH2 ARG 30 -10.981 9.411 -5.726
236 1HH2 ARG 30 2HH1 ARG 30 -9.289 12.518 -6.199
237 2HH2 ARG 30 1HH1 ARG 30 -10.464 11.432 -6.862
238 H MET 31 H MET 31 -6.012 6.646 0.942
239 HA MET 31 HA MET 31 -8.480 6.999 2.432
240 1HB MET 31 2HB MET 31 -5.925 5.481 3.120
241 2HB MET 31 3HB MET 31 -7.473 5.305 3.942
242 1HG MET 31 2HG MET 31 -6.787 4.541 1.095
243 2HG MET 31 3HG MET 31 -7.245 3.504 2.421
244 1HE MET 31 1HE MET 31 -9.968 5.053 3.498
245 2HE MET 31 2HE MET 31 -11.144 4.171 2.514
246 3HE MET 31 3HE MET 31 -9.777 3.305 3.255
247 HA PRO 32 HA PRO 32 -7.254 10.286 5.105
248 1HB PRO 32 2HB PRO 32 -8.365 9.569 7.527
249 2HB PRO 32 3HB PRO 32 -9.323 10.162 6.139
250 1HG PRO 32 2HG PRO 32 -8.811 7.284 6.922
251 2HG PRO 32 3HG PRO 32 -10.384 8.048 6.546
252 1HD PRO 32 2HD PRO 32 -9.041 6.644 4.707
253 2HD PRO 32 3HD PRO 32 -9.851 8.158 4.211
254 H GLY 33 H GLY 33 -5.521 10.722 6.543
255 1HA GLY 33 2HA GLY 33 -3.734 10.282 7.880
256 2HA GLY 33 3HA GLY 33 -4.166 8.575 7.950
257 H VAL 34 H VAL 34 -4.135 8.696 4.715
258 HA VAL 34 HA VAL 34 -1.247 8.071 4.631
259 HB VAL 34 HB VAL 34 -3.333 7.471 2.536
260 1HG1 VAL 34 1HG1 VAL 34 -0.974 7.462 1.745
261 2HG1 VAL 34 2HG1 VAL 34 -0.499 6.450 3.110
262 3HG1 VAL 34 3HG1 VAL 34 -1.567 5.795 1.869
263 1HG2 VAL 34 1HG2 VAL 34 -2.301 5.747 4.837
264 2HG2 VAL 34 2HG2 VAL 34 -3.972 6.299 4.599
265 3HG2 VAL 34 3HG2 VAL 34 -3.254 5.151 3.463
266 H THR 35 H THR 35 0.204 9.347 3.707
267 HA THR 35 HA THR 35 -0.751 11.868 2.427
268 HB THR 35 HB THR 35 1.280 11.152 4.395
269 HG1 THR 35 1HG THR 35 0.711 13.131 5.122
270 1HG2 THR 35 1HG2 THR 35 2.042 13.173 2.267
271 2HG2 THR 35 2HG2 THR 35 2.790 13.033 3.872
272 3HG2 THR 35 3HG2 THR 35 2.921 11.692 2.734
273 H ASP 36 H ASP 36 1.529 9.104 1.987
274 HA ASP 36 HA ASP 36 1.407 9.644 -0.850
275 1HB ASP 36 2HB ASP 36 3.831 10.405 0.684
276 2HB ASP 36 3HB ASP 36 4.159 9.252 -0.613
277 H ALA 37 H ALA 37 2.410 7.887 -2.062
278 HA ALA 37 HA ALA 37 2.842 5.366 -0.642
279 1HB ALA 37 1HB ALA 37 0.313 5.644 -0.652
280 2HB ALA 37 2HB ALA 37 0.392 5.697 -2.430
281 3HB ALA 37 3HB ALA 37 0.853 4.232 -1.552
282 H ASN 38 H ASN 38 3.839 3.740 -1.891
283 HA ASN 38 HA ASN 38 4.530 4.426 -4.648
284 1HB ASN 38 2HB ASN 38 7.085 4.317 -3.406
285 2HB ASN 38 3HB ASN 38 6.347 5.607 -4.340
286 1HD2 ASN 38 1HD2 ASN 38 5.860 4.409 -0.950
287 2HD2 ASN 38 2HD2 ASN 38 6.234 5.975 -0.233
288 H VAL 39 H VAL 39 4.320 2.450 -5.494
289 HA VAL 39 HA VAL 39 5.034 0.115 -3.942
290 HB VAL 39 HB VAL 39 3.035 0.399 -5.508
291 1HG1 VAL 39 1HG1 VAL 39 3.203 -0.220 -7.779
292 2HG1 VAL 39 2HG1 VAL 39 4.288 1.152 -7.538
293 3HG1 VAL 39 3HG1 VAL 39 4.927 -0.504 -7.690
294 1HG2 VAL 39 1HG2 VAL 39 3.103 -2.018 -5.990
295 2HG2 VAL 39 2HG2 VAL 39 4.825 -2.039 -5.523
296 3HG2 VAL 39 3HG2 VAL 39 3.566 -1.622 -4.341
297 H ASN 40 H ASN 40 7.187 -0.370 -3.701
298 HA ASN 40 HA ASN 40 9.093 0.314 -5.866
299 1HB ASN 40 2HB ASN 40 9.579 0.802 -3.468
300 2HB ASN 40 3HB ASN 40 9.622 -0.937 -3.153
301 1HD2 ASN 40 1HD2 ASN 40 11.866 0.512 -2.573
302 2HD2 ASN 40 2HD2 ASN 40 13.112 0.237 -3.780
303 H LEU 41 H LEU 41 7.392 -1.271 -6.963
304 HA LEU 41 HA LEU 41 7.699 -4.066 -6.489
305 1HB LEU 41 2HB LEU 41 5.877 -2.533 -7.776
306 2HB LEU 41 3HB LEU 41 6.795 -3.067 -9.175
307 HG LEU 41 HG LEU 41 4.792 -4.371 -8.744
308 1HD1 LEU 41 1HD1 LEU 41 7.213 -6.116 -8.116
309 2HD1 LEU 41 2HD1 LEU 41 5.681 -6.647 -8.807
310 3HD1 LEU 41 3HD1 LEU 41 6.743 -5.578 -9.742
311 1HD2 LEU 41 1HD2 LEU 41 5.921 -5.273 -6.076
312 2HD2 LEU 41 2HD2 LEU 41 4.584 -4.128 -6.331
313 3HD2 LEU 41 3HD2 LEU 41 4.433 -5.806 -6.862
314 H ALA 42 H ALA 42 9.607 -1.739 -8.202
315 HA ALA 42 HA ALA 42 11.178 -3.277 -9.930
316 1HB ALA 42 1HB ALA 42 12.980 -1.708 -9.388
317 2HB ALA 42 2HB ALA 42 11.442 -0.835 -9.596
318 3HB ALA 42 3HB ALA 42 12.092 -1.145 -7.963
319 H THR 43 H THR 43 11.232 -3.150 -6.324
320 HA THR 43 HA THR 43 12.957 -5.583 -6.439
321 HB THR 43 HB THR 43 14.305 -3.826 -5.505
322 HG1 THR 43 1HG THR 43 13.333 -5.701 -3.639
323 1HG2 THR 43 1HG2 THR 43 13.237 -2.164 -4.428
324 2HG2 THR 43 2HG2 THR 43 11.871 -3.175 -3.915
325 3HG2 THR 43 3HG2 THR 43 13.387 -3.198 -3.001
326 H GLU 44 H GLU 44 10.122 -5.497 -6.748
327 HA GLU 44 HA GLU 44 8.259 -6.466 -5.999
328 1HB GLU 44 2HB GLU 44 10.523 -8.190 -5.721
329 2HB GLU 44 3HB GLU 44 9.492 -8.545 -4.346
330 1HG GLU 44 2HG GLU 44 8.557 -8.471 -7.253
331 2HG GLU 44 3HG GLU 44 9.030 -9.928 -6.368
332 H THR 45 H THR 45 9.077 -4.217 -4.212
333 HA THR 45 HA THR 45 7.927 -5.112 -1.608
334 HB THR 45 HB THR 45 10.069 -3.034 -2.258
335 HG1 THR 45 1HG THR 45 10.692 -5.319 -2.438
336 1HG2 THR 45 1HG2 THR 45 9.081 -4.137 0.388
337 2HG2 THR 45 2HG2 THR 45 10.492 -3.079 0.176
338 3HG2 THR 45 3HG2 THR 45 8.877 -2.456 -0.194
339 H VAL 46 H VAL 46 6.740 -3.296 -0.490
340 HA VAL 46 HA VAL 46 5.917 -1.058 -2.276
341 HB VAL 46 HB VAL 46 4.078 -2.614 -2.255
342 1HG1 VAL 46 1HG1 VAL 46 4.440 -3.904 -0.225
343 2HG1 VAL 46 2HG1 VAL 46 4.223 -2.459 0.791
344 3HG1 VAL 46 3HG1 VAL 46 2.859 -3.119 -0.120
345 1HG2 VAL 46 1HG2 VAL 46 3.386 -0.340 -0.358
346 2HG2 VAL 46 2HG2 VAL 46 3.649 -0.144 -2.103
347 3HG2 VAL 46 3HG2 VAL 46 2.330 -1.175 -1.512
348 H ASN 47 H ASN 47 5.647 0.998 -1.241
349 HA ASN 47 HA ASN 47 6.386 1.104 1.621
350 1HB ASN 47 2HB ASN 47 7.582 2.653 -0.730
351 2HB ASN 47 3HB ASN 47 7.595 3.293 0.915
352 1HD2 ASN 47 1HD2 ASN 47 8.390 1.597 2.649
353 2HD2 ASN 47 2HD2 ASN 47 9.948 0.914 2.192
354 H VAL 48 H VAL 48 5.063 2.590 2.749
355 HA VAL 48 HA VAL 48 3.229 4.238 1.143
356 HB VAL 48 HB VAL 48 2.003 2.201 1.412
357 1HG1 VAL 48 1HG1 VAL 48 3.131 1.088 3.230
358 2HG1 VAL 48 2HG1 VAL 48 2.638 2.346 4.379
359 3HG1 VAL 48 3HG1 VAL 48 1.426 1.281 3.646
360 1HG2 VAL 48 1HG2 VAL 48 0.718 4.217 1.587
361 2HG2 VAL 48 2HG2 VAL 48 0.087 3.041 2.757
362 3HG2 VAL 48 3HG2 VAL 48 1.075 4.391 3.316
363 H ILE 49 H ILE 49 2.942 6.175 2.068
364 HA ILE 49 HA ILE 49 4.577 6.693 4.452
365 HB ILE 49 HB ILE 49 3.756 8.666 2.288
366 1HG1 ILE 49 2HG1 ILE 49 5.029 7.029 1.113
367 2HG1 ILE 49 3HG1 ILE 49 5.982 8.494 1.326
368 1HG2 ILE 49 1HG2 ILE 49 5.847 8.792 4.487
369 2HG2 ILE 49 2HG2 ILE 49 5.669 9.981 3.179
370 3HG2 ILE 49 3HG2 ILE 49 4.364 9.748 4.349
371 1HD1 ILE 49 1HD1 ILE 49 7.400 6.569 1.719
372 2HD1 ILE 49 2HD1 ILE 49 7.158 7.416 3.260
373 3HD1 ILE 49 3HD1 ILE 49 6.266 5.916 2.912
374 H TYR 50 H TYR 50 3.186 6.926 6.236
375 HA TYR 50 HA TYR 50 0.712 8.524 5.928
376 1HB TYR 50 2HB TYR 50 -0.734 6.803 6.713
377 2HB TYR 50 3HB TYR 50 0.089 6.228 5.294
378 HD1 TYR 50 HD1 TYR 50 1.744 4.340 5.481
379 HD2 TYR 50 HD2 TYR 50 -0.311 5.868 8.928
380 HE1 TYR 50 HE1 TYR 50 1.897 2.128 6.561
381 HE2 TYR 50 HE2 TYR 50 0.078 3.734 10.098
382 HH TYR 50 HH TYR 50 1.229 0.836 8.390
383 H ASP 51 H ASP 51 -0.443 8.698 7.931
384 HA ASP 51 HA ASP 51 1.389 9.286 10.158
385 1HB ASP 51 2HB ASP 51 -0.192 11.003 9.601
386 2HB ASP 51 3HB ASP 51 -1.544 9.874 9.715
387 HA PRO 52 HA PRO 52 0.111 5.221 11.752
388 1HB PRO 52 2HB PRO 52 1.964 4.851 13.678
389 2HB PRO 52 3HB PRO 52 2.361 4.762 11.936
390 1HG PRO 52 2HG PRO 52 2.651 7.174 13.760
391 2HG PRO 52 3HG PRO 52 3.909 6.435 12.730
392 1HD PRO 52 2HD PRO 52 2.453 8.558 11.895
393 2HD PRO 52 3HD PRO 52 2.866 7.244 10.749
394 H ALA 53 H ALA 53 -0.404 8.319 13.115
395 HA ALA 53 HA ALA 53 -1.563 7.283 15.623
396 1HB ALA 53 1HB ALA 53 -1.709 10.024 14.314
397 2HB ALA 53 2HB ALA 53 -2.179 9.596 15.967
398 3HB ALA 53 3HB ALA 53 -0.465 9.544 15.494
399 H GLU 54 H GLU 54 -2.300 7.988 12.234
400 HA GLU 54 HA GLU 54 -5.164 8.127 12.847
401 1HB GLU 54 2HB GLU 54 -4.083 10.093 11.853
402 2HB GLU 54 3HB GLU 54 -3.760 9.203 10.369
403 1HG GLU 54 2HG GLU 54 -6.089 9.017 9.869
404 2HG GLU 54 3HG GLU 54 -6.580 9.330 11.539
405 H THR 55 H THR 55 -2.940 6.844 10.423
406 HA THR 55 HA THR 55 -4.673 4.455 10.192
407 HB THR 55 HB THR 55 -3.108 3.806 8.183
408 HG1 THR 55 1HG THR 55 -3.134 6.609 8.166
409 1HG2 THR 55 1HG2 THR 55 -4.773 4.869 6.699
410 2HG2 THR 55 2HG2 THR 55 -5.486 4.001 8.084
411 3HG2 THR 55 3HG2 THR 55 -5.416 5.785 8.091
412 H GLY 56 H GLY 56 -3.033 2.567 9.728
413 1HA GLY 56 2HA GLY 56 -0.806 2.006 11.297
414 2HA GLY 56 3HA GLY 56 -2.177 2.116 12.421
415 H THR 57 H THR 57 -1.056 0.664 9.658
416 HA THR 57 HA THR 57 -1.631 -0.213 7.902
417 HB THR 57 HB THR 57 -1.469 -2.702 7.942
418 HG1 THR 57 1HG THR 57 -1.635 -2.246 10.737
419 1HG2 THR 57 1HG2 THR 57 0.538 -1.374 9.827
420 2HG2 THR 57 2HG2 THR 57 0.721 -2.928 9.004
421 3HG2 THR 57 3HG2 THR 57 0.647 -1.436 8.048
422 H ALA 58 H ALA 58 -4.053 -0.982 10.330
423 HA ALA 58 HA ALA 58 -6.136 -2.180 9.443
424 1HB ALA 58 1HB ALA 58 -5.991 0.742 10.239
425 2HB ALA 58 2HB ALA 58 -7.496 -0.218 10.255
426 3HB ALA 58 3HB ALA 58 -6.136 -0.646 11.321
427 H ALA 59 H ALA 59 -5.378 1.001 7.927
428 HA ALA 59 HA ALA 59 -7.962 0.670 6.409
429 1HB ALA 59 1HB ALA 59 -5.923 2.902 6.163
430 2HB ALA 59 2HB ALA 59 -7.564 2.869 5.498
431 3HB ALA 59 3HB ALA 59 -7.344 2.919 7.259
432 H ILE 60 H ILE 60 -4.539 0.837 5.889
433 HA ILE 60 HA ILE 60 -4.320 0.388 3.123
434 HB ILE 60 HB ILE 60 -2.688 0.037 5.638
435 1HG1 ILE 60 2HG1 ILE 60 -1.449 1.202 3.323
436 2HG1 ILE 60 3HG1 ILE 60 -3.024 1.926 3.567
437 1HG2 ILE 60 1HG2 ILE 60 -1.781 -1.305 3.088
438 2HG2 ILE 60 2HG2 ILE 60 -0.736 -0.823 4.445
439 3HG2 ILE 60 3HG2 ILE 60 -2.009 -2.016 4.699
440 1HD1 ILE 60 1HD1 ILE 60 -1.348 3.205 4.820
441 2HD1 ILE 60 2HD1 ILE 60 -2.532 2.457 5.903
442 3HD1 ILE 60 3HD1 ILE 60 -0.905 1.748 5.742
443 H GLN 61 H GLN 61 -4.467 -2.078 5.741
444 HA GLN 61 HA GLN 61 -4.333 -4.172 3.823
445 1HB GLN 61 2HB GLN 61 -4.049 -3.957 6.501
446 2HB GLN 61 3HB GLN 61 -5.570 -4.858 6.416
447 1HG GLN 61 2HG GLN 61 -4.508 -6.694 5.332
448 2HG GLN 61 3HG GLN 61 -3.143 -5.713 4.783
449 1HE2 GLN 61 1HE2 GLN 61 -1.816 -4.628 6.573
450 2HE2 GLN 61 2HE2 GLN 61 -1.458 -5.642 7.963
451 H GLU 62 H GLU 62 -7.122 -2.690 5.561
452 HA GLU 62 HA GLU 62 -9.282 -4.121 4.514
453 1HB GLU 62 2HB GLU 62 -8.765 -1.262 5.335
454 2HB GLU 62 3HB GLU 62 -10.217 -1.559 4.421
455 1HG GLU 62 2HG GLU 62 -10.935 -3.250 6.094
456 2HG GLU 62 3HG GLU 62 -9.457 -2.927 7.027
457 H LYS 63 H LYS 63 -7.724 -1.221 3.017
458 HA LYS 63 HA LYS 63 -9.322 -1.451 0.697
459 1HB LYS 63 2HB LYS 63 -6.932 0.168 1.598
460 2HB LYS 63 3HB LYS 63 -7.543 0.304 -0.022
461 1HG LYS 63 2HG LYS 63 -9.488 0.483 2.320
462 2HG LYS 63 3HG LYS 63 -8.438 1.824 1.938
463 1HD LYS 63 2HD LYS 63 -10.573 2.196 0.940
464 2HD LYS 63 3HD LYS 63 -9.338 2.030 -0.321
465 1HE LYS 63 2HE LYS 63 -10.178 -0.193 -0.893
466 2HE LYS 63 3HE LYS 63 -11.238 -0.204 0.545
467 1HZ LYS 63 1HZ LYS 63 -12.437 0.309 -1.442
468 2HZ LYS 63 2HZ LYS 63 -12.461 1.600 -0.424
469 3HZ LYS 63 3HZ LYS 63 -11.485 1.614 -1.753
470 H ILE 64 H ILE 64 -6.043 -2.528 1.469
471 HA ILE 64 HA ILE 64 -5.005 -3.098 -0.964
472 HB ILE 64 HB ILE 64 -4.656 -3.969 1.744
473 1HG1 ILE 64 2HG1 ILE 64 -3.255 -2.384 0.454
474 2HG1 ILE 64 3HG1 ILE 64 -2.395 -3.642 1.327
475 1HG2 ILE 64 1HG2 ILE 64 -4.993 -6.195 1.250
476 2HG2 ILE 64 2HG2 ILE 64 -4.070 -6.107 -0.273
477 3HG2 ILE 64 3HG2 ILE 64 -3.255 -5.951 1.298
478 1HD1 ILE 64 1HD1 ILE 64 -2.175 -4.952 -0.786
479 2HD1 ILE 64 2HD1 ILE 64 -2.973 -3.637 -1.665
480 3HD1 ILE 64 3HD1 ILE 64 -1.411 -3.354 -0.865
481 H GLU 65 H GLU 65 -7.078 -5.150 1.180
482 HA GLU 65 HA GLU 65 -7.674 -7.286 -0.591
483 1HB GLU 65 2HB GLU 65 -9.118 -6.105 1.809
484 2HB GLU 65 3HB GLU 65 -9.734 -7.514 0.941
485 1HG GLU 65 2HG GLU 65 -6.862 -7.607 1.830
486 2HG GLU 65 3HG GLU 65 -8.125 -7.741 3.057
487 H LYS 66 H LYS 66 -9.693 -4.368 0.172
488 HA LYS 66 HA LYS 66 -11.664 -5.094 -1.708
489 1HB LYS 66 2HB LYS 66 -11.083 -2.709 -0.072
490 2HB LYS 66 3HB LYS 66 -11.916 -2.304 -1.575
491 1HG LYS 66 2HG LYS 66 -12.823 -4.493 0.321
492 2HG LYS 66 3HG LYS 66 -13.420 -2.840 0.429
493 1HD LYS 66 2HD LYS 66 -13.575 -4.155 -2.287
494 2HD LYS 66 3HD LYS 66 -14.644 -4.788 -1.030
495 1HE LYS 66 2HE LYS 66 -15.667 -2.611 -0.692
496 2HE LYS 66 3HE LYS 66 -14.479 -1.825 -1.748
497 1HZ LYS 66 1HZ LYS 66 -15.362 -3.095 -3.586
498 2HZ LYS 66 2HZ LYS 66 -16.478 -3.810 -2.613
499 3HZ LYS 66 3HZ LYS 66 -16.542 -2.192 -2.885
500 H LEU 67 H LEU 67 -8.668 -3.462 -2.330
501 HA LEU 67 HA LEU 67 -9.272 -2.554 -5.024
502 1HB LEU 67 2HB LEU 67 -6.791 -2.869 -3.315
503 2HB LEU 67 3HB LEU 67 -6.644 -2.508 -5.022
504 HG LEU 67 HG LEU 67 -8.517 -0.843 -3.321
505 1HD1 LEU 67 1HD1 LEU 67 -6.628 0.776 -2.949
506 2HD1 LEU 67 2HD1 LEU 67 -6.515 -0.717 -2.015
507 3HD1 LEU 67 3HD1 LEU 67 -5.511 -0.516 -3.434
508 1HD2 LEU 67 1HD2 LEU 67 -8.736 0.307 -5.240
509 2HD2 LEU 67 2HD2 LEU 67 -6.999 0.645 -5.274
510 3HD2 LEU 67 3HD2 LEU 67 -7.635 -0.800 -6.069
511 H GLY 68 H GLY 68 -8.597 -5.635 -3.588
512 1HA GLY 68 2HA GLY 68 -8.806 -7.669 -4.641
513 2HA GLY 68 3HA GLY 68 -8.605 -6.922 -6.233
514 H TYR 69 H TYR 69 -6.566 -6.734 -3.234
515 HA TYR 69 HA TYR 69 -4.329 -8.107 -4.636
516 1HB TYR 69 2HB TYR 69 -4.611 -5.280 -4.213
517 2HB TYR 69 3HB TYR 69 -3.421 -5.839 -3.060
518 HD1 TYR 69 HD1 TYR 69 -1.235 -6.580 -3.789
519 HD2 TYR 69 HD2 TYR 69 -4.369 -5.896 -6.669
520 HE1 TYR 69 HE1 TYR 69 0.445 -6.377 -5.571
521 HE2 TYR 69 HE2 TYR 69 -2.707 -5.756 -8.458
522 HH TYR 69 HH TYR 69 -0.443 -5.648 -8.962
523 H HIS 70 H HIS 70 -2.473 -8.437 -2.990
524 HA HIS 70 HA HIS 70 -3.463 -8.525 -0.189
525 1HB HIS 70 2HB HIS 70 -3.580 -10.792 -1.374
526 2HB HIS 70 3HB HIS 70 -1.816 -10.741 -1.441
527 HD1 HIS 70 1HD HIS 70 -4.727 -11.182 0.993
528 HD2 HIS 70 2HD HIS 70 -0.532 -10.877 0.992
529 HE1 HIS 70 1HE HIS 70 -3.934 -11.963 3.296
530 H VAL 71 H VAL 71 -1.925 -7.925 1.303
531 HA VAL 71 HA VAL 71 0.767 -7.181 0.281
532 HB VAL 71 HB VAL 71 -0.719 -5.259 0.859
533 1HG1 VAL 71 1HG1 VAL 71 -1.742 -6.303 2.960
534 2HG1 VAL 71 2HG1 VAL 71 -0.183 -6.012 3.750
535 3HG1 VAL 71 3HG1 VAL 71 -1.124 -4.648 3.139
536 1HG2 VAL 71 1HG2 VAL 71 1.627 -4.984 0.667
537 2HG2 VAL 71 2HG2 VAL 71 1.108 -4.099 2.113
538 3HG2 VAL 71 3HG2 VAL 71 1.889 -5.701 2.265
539 H VAL 72 H VAL 72 2.434 -8.223 1.291
540 HA VAL 72 HA VAL 72 1.714 -10.136 3.474
541 HB VAL 72 HB VAL 72 4.011 -10.295 1.610
542 1HG1 VAL 72 1HG1 VAL 72 2.853 -12.318 3.563
543 2HG1 VAL 72 2HG1 VAL 72 4.183 -12.634 2.432
544 3HG1 VAL 72 3HG1 VAL 72 4.403 -11.464 3.732
545 1HG2 VAL 72 1HG2 VAL 72 1.920 -10.665 0.308
546 2HG2 VAL 72 2HG2 VAL 72 2.842 -12.163 0.499
547 3HG2 VAL 72 3HG2 VAL 72 1.417 -11.884 1.512
548 H ILE 73 H ILE 73 2.886 -10.040 5.300
549 HA ILE 73 HA ILE 73 4.852 -7.823 5.609
550 HB ILE 73 HB ILE 73 2.935 -8.891 7.681
551 1HG1 ILE 73 2HG1 ILE 73 2.483 -6.231 7.507
552 2HG1 ILE 73 3HG1 ILE 73 3.105 -6.470 5.878
553 1HG2 ILE 73 1HG2 ILE 73 5.132 -8.224 8.673
554 2HG2 ILE 73 2HG2 ILE 73 5.015 -6.669 7.825
555 3HG2 ILE 73 3HG2 ILE 73 3.829 -7.107 9.084
556 1HD1 ILE 73 1HD1 ILE 73 0.844 -6.756 5.603
557 2HD1 ILE 73 2HD1 ILE 73 1.320 -8.446 5.872
558 3HD1 ILE 73 3HD1 ILE 73 0.631 -7.500 7.210
559 H GLU 74 H GLU 74 6.355 -9.422 4.644
560 HA GLU 74 HA GLU 74 7.290 -11.546 6.201
561 1HB GLU 74 2HB GLU 74 8.255 -10.041 3.779
562 2HB GLU 74 3HB GLU 74 9.296 -11.203 4.582
563 1HG GLU 74 2HG GLU 74 6.626 -12.354 4.117
564 2HG GLU 74 3HG GLU 74 7.409 -11.826 2.620
565 H GLY 75 H GLY 75 7.394 -8.435 6.897
566 1HA GLY 75 2HA GLY 75 10.131 -8.265 8.058
567 2HA GLY 75 3HA GLY 75 8.916 -6.979 8.030
568 H ARG 76 H ARG 76 6.967 -7.305 9.351
569 HA ARG 76 HA ARG 76 6.037 -7.378 11.377
570 1HB ARG 76 2HB ARG 76 5.581 -9.613 10.450
571 2HB ARG 76 3HB ARG 76 7.053 -10.210 11.194
572 1HG ARG 76 2HG ARG 76 5.479 -8.972 13.280
573 2HG ARG 76 3HG ARG 76 4.366 -9.944 12.302
574 1HD ARG 76 2HD ARG 76 5.863 -11.893 12.513
575 2HD ARG 76 3HD ARG 76 7.009 -10.907 13.466
576 HE ARG 76 HE ARG 76 4.580 -10.703 14.801
577 1HH1 ARG 76 2HH2 ARG 76 6.914 -13.179 13.969
578 2HH1 ARG 76 1HH2 ARG 76 6.538 -14.260 15.275
579 1HH2 ARG 76 2HH1 ARG 76 4.027 -12.085 16.599
580 2HH2 ARG 76 1HH1 ARG 76 4.854 -13.591 16.835
Start of MODEL 23
1 1H MET 1 H1 MET 1 0.101 14.184 18.297
2 2H MET 1 H2 MET 1 -1.545 13.958 18.376
3 3H MET 1 H3 MET 1 -0.795 14.494 16.977
4 HA MET 1 HA MET 1 -1.931 16.281 18.234
5 1HB MET 1 2HB MET 1 -1.267 15.469 20.482
6 2HB MET 1 3HB MET 1 0.433 15.780 20.114
7 1HG MET 1 2HG MET 1 -1.753 17.905 20.194
8 2HG MET 1 3HG MET 1 -0.666 17.507 21.527
9 1HE MET 1 1HE MET 1 -1.102 20.471 20.542
10 2HE MET 1 2HE MET 1 0.012 20.025 21.862
11 3HE MET 1 3HE MET 1 0.576 21.062 20.532
12 H LEU 2 H LEU 2 -1.487 17.407 16.428
13 HA LEU 2 HA LEU 2 -0.453 17.916 14.497
14 1HB LEU 2 2HB LEU 2 1.552 18.666 15.918
15 2HB LEU 2 3HB LEU 2 2.281 17.096 15.579
16 HG LEU 2 HG LEU 2 1.310 18.652 13.206
17 1HD1 LEU 2 1HD1 LEU 2 3.356 20.056 13.218
18 2HD1 LEU 2 2HD1 LEU 2 2.295 20.443 14.584
19 3HD1 LEU 2 3HD1 LEU 2 3.753 19.461 14.844
20 1HD2 LEU 2 1HD2 LEU 2 3.957 17.238 13.809
21 2HD2 LEU 2 2HD2 LEU 2 2.564 16.433 13.093
22 3HD2 LEU 2 3HD2 LEU 2 3.355 17.755 12.220
23 H SER 3 H SER 3 0.257 16.466 12.672
24 HA SER 3 HA SER 3 -0.311 13.609 13.244
25 1HB SER 3 2HB SER 3 -0.592 14.999 10.564
26 2HB SER 3 3HB SER 3 -1.287 13.472 11.116
27 HG SER 3 HG SER 3 -2.939 14.872 11.372
28 H GLU 4 H GLU 4 1.404 12.288 12.832
29 HA GLU 4 HA GLU 4 3.955 13.449 11.876
30 1HB GLU 4 2HB GLU 4 3.155 11.178 13.607
31 2HB GLU 4 3HB GLU 4 4.572 10.939 12.618
32 1HG GLU 4 2HG GLU 4 5.379 13.148 13.532
33 2HG GLU 4 3HG GLU 4 4.082 12.988 14.718
34 H GLN 5 H GLN 5 5.209 11.583 10.555
35 HA GLN 5 HA GLN 5 3.372 10.094 8.799
36 1HB GLN 5 2HB GLN 5 5.767 11.753 7.983
37 2HB GLN 5 3HB GLN 5 4.969 10.650 6.879
38 1HG GLN 5 2HG GLN 5 3.462 12.974 8.221
39 2HG GLN 5 3HG GLN 5 4.440 13.174 6.798
40 1HE2 GLN 5 1HE2 GLN 5 2.938 10.036 6.848
41 2HE2 GLN 5 2HE2 GLN 5 1.706 10.431 5.673
42 H LYS 6 H LYS 6 4.171 8.071 8.346
43 HA LYS 6 HA LYS 6 7.004 7.491 8.713
44 1HB LYS 6 2HB LYS 6 4.809 6.097 10.281
45 2HB LYS 6 3HB LYS 6 6.257 5.234 9.799
46 1HG LYS 6 2HG LYS 6 7.104 7.756 10.960
47 2HG LYS 6 3HG LYS 6 5.892 7.083 12.004
48 1HD LYS 6 2HD LYS 6 7.373 5.655 12.867
49 2HD LYS 6 3HD LYS 6 7.698 4.912 11.312
50 1HE LYS 6 2HE LYS 6 9.100 7.344 12.509
51 2HE LYS 6 3HE LYS 6 9.754 5.715 12.288
52 1HZ LYS 6 1HZ LYS 6 9.445 6.111 9.811
53 2HZ LYS 6 2HZ LYS 6 9.142 7.654 10.126
54 3HZ LYS 6 3HZ LYS 6 10.583 7.031 10.520
55 H GLU 7 H GLU 7 7.553 5.437 7.882
56 HA GLU 7 HA GLU 7 6.344 5.073 5.223
57 1HB GLU 7 2HB GLU 7 9.278 4.775 5.597
58 2HB GLU 7 3HB GLU 7 8.320 5.565 4.362
59 1HG GLU 7 2HG GLU 7 9.668 7.210 5.398
60 2HG GLU 7 3HG GLU 7 8.038 7.511 5.996
61 H ILE 8 H ILE 8 5.326 3.090 5.689
62 HA ILE 8 HA ILE 8 6.755 1.004 7.144
63 HB ILE 8 HB ILE 8 4.148 0.901 5.743
64 1HG1 ILE 8 2HG1 ILE 8 3.762 2.836 6.977
65 2HG1 ILE 8 3HG1 ILE 8 2.997 1.464 7.782
66 1HG2 ILE 8 1HG2 ILE 8 5.285 -0.538 8.119
67 2HG2 ILE 8 2HG2 ILE 8 3.593 -0.701 7.562
68 3HG2 ILE 8 3HG2 ILE 8 4.928 -1.219 6.522
69 1HD1 ILE 8 1HD1 ILE 8 4.816 1.273 9.337
70 2HD1 ILE 8 2HD1 ILE 8 5.655 2.627 8.545
71 3HD1 ILE 8 3HD1 ILE 8 4.105 2.911 9.384
72 H ALA 9 H ALA 9 6.945 -1.206 6.050
73 HA ALA 9 HA ALA 9 7.271 -1.124 3.116
74 1HB ALA 9 1HB ALA 9 9.497 -2.128 3.281
75 2HB ALA 9 2HB ALA 9 9.495 -0.548 4.093
76 3HB ALA 9 3HB ALA 9 9.438 -2.037 5.055
77 H MET 10 H MET 10 6.528 -3.071 2.237
78 HA MET 10 HA MET 10 6.720 -5.561 3.744
79 1HB MET 10 2HB MET 10 4.200 -5.989 3.426
80 2HB MET 10 3HB MET 10 4.705 -5.008 4.803
81 1HG MET 10 2HG MET 10 3.936 -3.685 2.221
82 2HG MET 10 3HG MET 10 2.679 -4.276 3.304
83 1HE MET 10 1HE MET 10 1.782 -1.712 3.066
84 2HE MET 10 2HE MET 10 2.697 -0.325 3.710
85 3HE MET 10 3HE MET 10 3.273 -1.166 2.254
86 H GLN 11 H GLN 11 5.550 -7.374 2.387
87 HA GLN 11 HA GLN 11 6.493 -7.103 -0.404
88 1HB GLN 11 2HB GLN 11 6.331 -9.253 1.576
89 2HB GLN 11 3HB GLN 11 5.419 -9.694 0.127
90 1HG GLN 11 2HG GLN 11 8.286 -8.735 -0.049
91 2HG GLN 11 3HG GLN 11 7.834 -10.424 0.244
92 1HE2 GLN 11 1HE2 GLN 11 7.640 -7.797 -2.088
93 2HE2 GLN 11 2HE2 GLN 11 7.062 -8.728 -3.440
94 H VAL 12 H VAL 12 5.000 -8.233 -2.072
95 HA VAL 12 HA VAL 12 2.119 -7.580 -1.580
96 HB VAL 12 HB VAL 12 2.109 -6.989 -4.031
97 1HG1 VAL 12 1HG1 VAL 12 2.892 -4.690 -3.673
98 2HG1 VAL 12 2HG1 VAL 12 1.968 -5.266 -2.274
99 3HG1 VAL 12 3HG1 VAL 12 3.747 -5.205 -2.205
100 1HG2 VAL 12 1HG2 VAL 12 4.135 -6.377 -5.119
101 2HG2 VAL 12 2HG2 VAL 12 5.099 -6.608 -3.640
102 3HG2 VAL 12 3HG2 VAL 12 4.413 -8.005 -4.500
103 H SER 13 H SER 13 0.587 -8.883 -2.537
104 HA SER 13 HA SER 13 1.421 -10.889 -4.532
105 1HB SER 13 2HB SER 13 -0.591 -11.416 -2.329
106 2HB SER 13 3HB SER 13 -0.055 -12.561 -3.565
107 HG SER 13 HG SER 13 0.995 -12.820 -1.473
108 H GLY 14 H GLY 14 -0.205 -11.210 -6.049
109 1HA GLY 14 2HA GLY 14 -2.576 -10.865 -6.735
110 2HA GLY 14 3HA GLY 14 -2.456 -9.209 -6.126
111 H MET 15 H MET 15 0.365 -8.926 -7.132
112 HA MET 15 HA MET 15 -0.197 -7.653 -9.527
113 1HB MET 15 2HB MET 15 2.242 -7.623 -9.920
114 2HB MET 15 3HB MET 15 1.788 -7.078 -8.310
115 1HG MET 15 2HG MET 15 2.881 -8.794 -7.275
116 2HG MET 15 3HG MET 15 2.390 -9.988 -8.472
117 1HE MET 15 1HE MET 15 4.518 -11.292 -8.379
118 2HE MET 15 2HE MET 15 6.139 -10.593 -8.572
119 3HE MET 15 3HE MET 15 5.172 -10.199 -7.131
120 H THR 16 H THR 16 -0.221 -8.090 -11.605
121 HA THR 16 HA THR 16 0.725 -10.671 -12.734
122 HB THR 16 HB THR 16 -1.562 -10.478 -14.086
123 HG1 THR 16 1HG THR 16 -2.349 -9.448 -11.564
124 1HG2 THR 16 1HG2 THR 16 -2.665 -12.012 -12.520
125 2HG2 THR 16 2HG2 THR 16 -0.954 -12.428 -12.722
126 3HG2 THR 16 3HG2 THR 16 -1.496 -11.598 -11.250
127 H CYS 17 H CYS 17 -1.095 -7.726 -13.544
128 HA CYS 17 HA CYS 17 0.329 -7.268 -16.047
129 1HB CYS 17 2HB CYS 17 -1.093 -5.216 -16.092
130 2HB CYS 17 3HB CYS 17 -2.048 -6.683 -15.770
131 H ALA 18 H ALA 18 1.264 -6.702 -12.879
132 HA ALA 18 HA ALA 18 2.781 -5.465 -11.822
133 1HB ALA 18 1HB ALA 18 3.660 -4.241 -14.467
134 2HB ALA 18 2HB ALA 18 4.522 -4.248 -12.923
135 3HB ALA 18 3HB ALA 18 4.260 -5.774 -13.792
136 H ALA 19 H ALA 19 1.285 -3.436 -14.376
137 HA ALA 19 HA ALA 19 1.486 -0.957 -13.246
138 1HB ALA 19 1HB ALA 19 -0.491 -0.318 -14.566
139 2HB ALA 19 2HB ALA 19 0.583 -1.391 -15.485
140 3HB ALA 19 3HB ALA 19 -0.918 -2.031 -14.777
141 H CYS 20 H CYS 20 -1.165 -3.271 -12.471
142 HA CYS 20 HA CYS 20 -2.625 -1.527 -10.903
143 1HB CYS 20 2HB CYS 20 -2.439 -4.553 -10.904
144 2HB CYS 20 3HB CYS 20 -3.440 -3.700 -9.723
145 H ALA 21 H ALA 21 0.412 -3.055 -10.087
146 HA ALA 21 HA ALA 21 0.296 -2.866 -7.249
147 1HB ALA 21 1HB ALA 21 2.036 -4.037 -8.698
148 2HB ALA 21 2HB ALA 21 2.748 -2.435 -8.991
149 3HB ALA 21 3HB ALA 21 2.658 -3.105 -7.350
150 H ALA 22 H ALA 22 0.750 -0.397 -9.807
151 HA ALA 22 HA ALA 22 1.460 1.729 -7.908
152 1HB ALA 22 1HB ALA 22 2.150 1.827 -10.294
153 2HB ALA 22 2HB ALA 22 0.440 1.887 -10.776
154 3HB ALA 22 3HB ALA 22 1.136 3.204 -9.816
155 H ARG 23 H ARG 23 -1.407 0.518 -9.664
156 HA ARG 23 HA ARG 23 -3.198 2.536 -8.924
157 1HB ARG 23 2HB ARG 23 -3.649 -0.400 -9.504
158 2HB ARG 23 3HB ARG 23 -4.976 0.590 -9.070
159 1HG ARG 23 2HG ARG 23 -3.106 1.335 -11.357
160 2HG ARG 23 3HG ARG 23 -4.544 0.336 -11.575
161 1HD ARG 23 2HD ARG 23 -4.580 3.221 -10.509
162 2HD ARG 23 3HD ARG 23 -4.947 2.698 -12.135
163 HE ARG 23 HE ARG 23 -6.939 1.758 -11.534
164 1HH1 ARG 23 2HH2 ARG 23 -5.326 2.821 -8.543
165 2HH1 ARG 23 1HH2 ARG 23 -6.744 2.730 -7.579
166 1HH2 ARG 23 2HH1 ARG 23 -8.814 1.607 -10.247
167 2HH2 ARG 23 1HH1 ARG 23 -8.780 2.026 -8.569
168 H ILE 24 H ILE 24 -2.393 -0.465 -7.064
169 HA ILE 24 HA ILE 24 -4.341 0.136 -5.113
170 HB ILE 24 HB ILE 24 -3.489 -1.443 -3.649
171 1HG1 ILE 24 2HG1 ILE 24 -0.990 -1.142 -5.257
172 2HG1 ILE 24 3HG1 ILE 24 -1.248 -1.057 -3.494
173 1HG2 ILE 24 1HG2 ILE 24 -4.641 -2.085 -5.841
174 2HG2 ILE 24 2HG2 ILE 24 -3.040 -2.570 -6.427
175 3HG2 ILE 24 3HG2 ILE 24 -3.740 -3.339 -4.988
176 1HD1 ILE 24 1HD1 ILE 24 -1.635 -3.533 -3.499
177 2HD1 ILE 24 2HD1 ILE 24 -1.200 -3.529 -5.234
178 3HD1 ILE 24 3HD1 ILE 24 -0.002 -3.058 -4.024
179 H GLU 25 H GLU 25 -0.759 0.797 -4.680
180 HA GLU 25 HA GLU 25 -0.820 2.529 -2.563
181 1HB GLU 25 2HB GLU 25 0.776 2.366 -5.090
182 2HB GLU 25 3HB GLU 25 0.986 3.798 -4.087
183 1HG GLU 25 2HG GLU 25 2.577 1.877 -3.568
184 2HG GLU 25 3HG GLU 25 1.683 2.438 -2.164
185 H LYS 26 H LYS 26 -1.771 3.396 -5.840
186 HA LYS 26 HA LYS 26 -2.220 6.208 -5.052
187 1HB LYS 26 2HB LYS 26 -2.630 4.823 -7.710
188 2HB LYS 26 3HB LYS 26 -2.803 6.554 -7.405
189 1HG LYS 26 2HG LYS 26 -0.246 4.896 -7.062
190 2HG LYS 26 3HG LYS 26 -0.582 6.002 -8.386
191 1HD LYS 26 2HD LYS 26 -0.546 7.912 -6.824
192 2HD LYS 26 3HD LYS 26 -0.284 6.826 -5.444
193 1HE LYS 26 2HE LYS 26 1.827 6.017 -6.382
194 2HE LYS 26 3HE LYS 26 1.681 7.174 -7.717
195 1HZ LYS 26 1HZ LYS 26 1.891 7.914 -4.816
196 2HZ LYS 26 2HZ LYS 26 3.085 7.958 -5.904
197 3HZ LYS 26 3HZ LYS 26 1.791 8.953 -6.055
198 H GLY 27 H GLY 27 -4.121 3.398 -5.082
199 1HA GLY 27 2HA GLY 27 -6.652 4.849 -4.608
200 2HA GLY 27 3HA GLY 27 -6.319 3.138 -4.318
201 H LEU 28 H LEU 28 -3.997 3.306 -2.734
202 HA LEU 28 HA LEU 28 -5.241 3.581 -0.168
203 1HB LEU 28 2HB LEU 28 -2.333 3.288 -0.967
204 2HB LEU 28 3HB LEU 28 -2.886 3.245 0.702
205 HG LEU 28 HG LEU 28 -4.100 1.303 -1.320
206 1HD1 LEU 28 1HD1 LEU 28 -1.780 0.896 -1.590
207 2HD1 LEU 28 2HD1 LEU 28 -1.433 1.121 0.132
208 3HD1 LEU 28 3HD1 LEU 28 -2.328 -0.306 -0.439
209 1HD2 LEU 28 1HD2 LEU 28 -4.646 0.016 0.545
210 2HD2 LEU 28 2HD2 LEU 28 -3.516 0.891 1.582
211 3HD2 LEU 28 3HD2 LEU 28 -5.030 1.670 1.067
212 H LYS 29 H LYS 29 -2.999 5.656 -1.970
213 HA LYS 29 HA LYS 29 -2.577 7.743 -0.213
214 1HB LYS 29 2HB LYS 29 -1.658 7.360 -2.501
215 2HB LYS 29 3HB LYS 29 -3.144 8.000 -3.207
216 1HG LYS 29 2HG LYS 29 -1.542 9.591 -1.180
217 2HG LYS 29 3HG LYS 29 -0.971 9.451 -2.854
218 1HD LYS 29 2HD LYS 29 -3.405 10.357 -3.419
219 2HD LYS 29 3HD LYS 29 -3.343 10.909 -1.726
220 1HE LYS 29 2HE LYS 29 -1.026 11.914 -2.288
221 2HE LYS 29 3HE LYS 29 -1.395 11.599 -3.977
222 1HZ LYS 29 1HZ LYS 29 -2.937 13.298 -2.127
223 2HZ LYS 29 2HZ LYS 29 -1.944 13.820 -3.328
224 3HZ LYS 29 3HZ LYS 29 -3.339 13.029 -3.706
225 H ARG 30 H ARG 30 -5.648 6.900 -1.728
226 HA ARG 30 HA ARG 30 -6.799 9.574 -1.324
227 1HB ARG 30 2HB ARG 30 -7.341 7.237 -2.921
228 2HB ARG 30 3HB ARG 30 -8.769 7.553 -1.968
229 1HG ARG 30 2HG ARG 30 -8.977 9.772 -2.865
230 2HG ARG 30 3HG ARG 30 -7.332 9.753 -3.529
231 1HD ARG 30 2HD ARG 30 -9.570 7.916 -4.459
232 2HD ARG 30 3HD ARG 30 -9.069 9.427 -5.259
233 HE ARG 30 HE ARG 30 -6.785 7.729 -4.869
234 1HH1 ARG 30 2HH2 ARG 30 -9.661 7.976 -6.882
235 2HH1 ARG 30 1HH2 ARG 30 -8.956 7.208 -8.271
236 1HH2 ARG 30 2HH1 ARG 30 -5.833 6.693 -6.582
237 2HH2 ARG 30 1HH1 ARG 30 -6.655 6.473 -8.114
238 H MET 31 H MET 31 -6.048 7.161 0.864
239 HA MET 31 HA MET 31 -8.648 7.236 2.253
240 1HB MET 31 2HB MET 31 -6.144 5.610 2.807
241 2HB MET 31 3HB MET 31 -7.741 5.329 3.490
242 1HG MET 31 2HG MET 31 -6.941 5.063 0.555
243 2HG MET 31 3HG MET 31 -7.260 3.789 1.692
244 1HE MET 31 1HE MET 31 -9.837 3.663 2.836
245 2HE MET 31 2HE MET 31 -10.123 5.412 2.946
246 3HE MET 31 3HE MET 31 -11.255 4.401 2.047
247 HA PRO 32 HA PRO 32 -7.328 10.198 5.222
248 1HB PRO 32 2HB PRO 32 -8.508 9.337 7.567
249 2HB PRO 32 3HB PRO 32 -9.408 10.090 6.218
250 1HG PRO 32 2HG PRO 32 -9.055 7.139 6.782
251 2HG PRO 32 3HG PRO 32 -10.578 8.009 6.423
252 1HD PRO 32 2HD PRO 32 -9.227 6.668 4.524
253 2HD PRO 32 3HD PRO 32 -9.980 8.240 4.116
254 H GLY 33 H GLY 33 -5.502 10.462 6.449
255 1HA GLY 33 2HA GLY 33 -3.801 9.834 7.941
256 2HA GLY 33 3HA GLY 33 -4.184 8.123 7.733
257 H VAL 34 H VAL 34 -4.281 8.371 4.672
258 HA VAL 34 HA VAL 34 -1.378 7.937 4.427
259 HB VAL 34 HB VAL 34 -3.500 7.515 2.314
260 1HG1 VAL 34 1HG1 VAL 34 -1.811 5.891 1.458
261 2HG1 VAL 34 2HG1 VAL 34 -1.112 7.517 1.554
262 3HG1 VAL 34 3HG1 VAL 34 -0.726 6.316 2.793
263 1HG2 VAL 34 1HG2 VAL 34 -2.549 5.674 4.541
264 2HG2 VAL 34 2HG2 VAL 34 -4.213 6.184 4.222
265 3HG2 VAL 34 3HG2 VAL 34 -3.402 5.093 3.095
266 H THR 35 H THR 35 0.043 9.304 3.360
267 HA THR 35 HA THR 35 -1.192 11.755 2.165
268 HB THR 35 HB THR 35 0.518 11.738 4.171
269 HG1 THR 35 1HG THR 35 0.451 13.596 2.033
270 1HG2 THR 35 1HG2 THR 35 2.438 10.760 2.951
271 2HG2 THR 35 2HG2 THR 35 2.373 12.095 1.772
272 3HG2 THR 35 3HG2 THR 35 2.752 12.425 3.464
273 H ASP 36 H ASP 36 1.349 9.286 1.617
274 HA ASP 36 HA ASP 36 0.496 9.066 -1.048
275 1HB ASP 36 2HB ASP 36 2.420 10.992 -1.033
276 2HB ASP 36 3HB ASP 36 3.410 9.547 -1.265
277 H ALA 37 H ALA 37 2.066 7.514 -2.257
278 HA ALA 37 HA ALA 37 3.076 5.419 -0.559
279 1HB ALA 37 1HB ALA 37 0.451 5.365 -0.450
280 2HB ALA 37 2HB ALA 37 0.541 4.761 -2.100
281 3HB ALA 37 3HB ALA 37 1.303 3.868 -0.753
282 H ASN 38 H ASN 38 4.052 3.663 -1.792
283 HA ASN 38 HA ASN 38 4.770 4.384 -4.569
284 1HB ASN 38 2HB ASN 38 7.256 4.272 -3.216
285 2HB ASN 38 3HB ASN 38 6.507 5.646 -4.005
286 1HD2 ASN 38 1HD2 ASN 38 5.852 3.992 -0.837
287 2HD2 ASN 38 2HD2 ASN 38 6.118 5.458 0.104
288 H VAL 39 H VAL 39 4.914 2.474 -5.546
289 HA VAL 39 HA VAL 39 5.353 0.061 -3.978
290 HB VAL 39 HB VAL 39 3.366 0.476 -5.340
291 1HG1 VAL 39 1HG1 VAL 39 4.447 1.566 -7.342
292 2HG1 VAL 39 2HG1 VAL 39 5.032 -0.037 -7.837
293 3HG1 VAL 39 3HG1 VAL 39 3.313 0.266 -7.713
294 1HG2 VAL 39 1HG2 VAL 39 4.612 -1.951 -6.514
295 2HG2 VAL 39 2HG2 VAL 39 4.450 -1.842 -4.741
296 3HG2 VAL 39 3HG2 VAL 39 3.021 -1.694 -5.753
297 H ASN 40 H ASN 40 7.511 -0.336 -3.640
298 HA ASN 40 HA ASN 40 9.459 0.245 -5.776
299 1HB ASN 40 2HB ASN 40 9.820 0.870 -3.377
300 2HB ASN 40 3HB ASN 40 9.893 -0.852 -2.973
301 1HD2 ASN 40 1HD2 ASN 40 12.081 0.336 -2.219
302 2HD2 ASN 40 2HD2 ASN 40 13.396 0.172 -3.372
303 H LEU 41 H LEU 41 7.907 -1.481 -6.847
304 HA LEU 41 HA LEU 41 8.358 -4.258 -6.224
305 1HB LEU 41 2HB LEU 41 6.815 -2.669 -8.168
306 2HB LEU 41 3HB LEU 41 7.470 -4.117 -8.908
307 HG LEU 41 HG LEU 41 5.166 -4.229 -7.874
308 1HD1 LEU 41 1HD1 LEU 41 7.247 -6.320 -7.121
309 2HD1 LEU 41 2HD1 LEU 41 5.493 -6.581 -7.156
310 3HD1 LEU 41 3HD1 LEU 41 6.360 -6.204 -8.652
311 1HD2 LEU 41 1HD2 LEU 41 4.801 -4.326 -5.608
312 2HD2 LEU 41 2HD2 LEU 41 6.417 -4.955 -5.238
313 3HD2 LEU 41 3HD2 LEU 41 6.191 -3.236 -5.575
314 H ALA 42 H ALA 42 10.186 -1.962 -8.030
315 HA ALA 42 HA ALA 42 11.926 -3.516 -9.554
316 1HB ALA 42 1HB ALA 42 13.632 -1.851 -8.962
317 2HB ALA 42 2HB ALA 42 12.080 -1.048 -9.305
318 3HB ALA 42 3HB ALA 42 12.630 -1.271 -7.622
319 H THR 43 H THR 43 11.650 -3.314 -5.975
320 HA THR 43 HA THR 43 13.531 -5.605 -5.855
321 HB THR 43 HB THR 43 14.638 -3.536 -5.212
322 HG1 THR 43 1HG THR 43 15.518 -4.484 -3.294
323 1HG2 THR 43 1HG2 THR 43 12.620 -2.558 -3.947
324 2HG2 THR 43 2HG2 THR 43 13.069 -3.617 -2.602
325 3HG2 THR 43 3HG2 THR 43 14.207 -2.388 -3.171
326 H GLU 44 H GLU 44 10.726 -5.740 -6.186
327 HA GLU 44 HA GLU 44 8.797 -6.522 -5.222
328 1HB GLU 44 2HB GLU 44 11.109 -8.280 -4.481
329 2HB GLU 44 3HB GLU 44 9.539 -8.700 -3.810
330 1HG GLU 44 2HG GLU 44 9.811 -8.187 -6.783
331 2HG GLU 44 3HG GLU 44 10.136 -9.767 -6.053
332 H THR 45 H THR 45 9.167 -4.267 -3.836
333 HA THR 45 HA THR 45 8.106 -5.047 -1.215
334 HB THR 45 HB THR 45 10.298 -2.948 -1.682
335 HG1 THR 45 1HG THR 45 11.099 -5.156 -1.823
336 1HG2 THR 45 1HG2 THR 45 8.803 -2.494 0.188
337 2HG2 THR 45 2HG2 THR 45 8.967 -4.192 0.731
338 3HG2 THR 45 3HG2 THR 45 10.362 -3.077 0.826
339 H VAL 46 H VAL 46 6.627 -3.434 -0.409
340 HA VAL 46 HA VAL 46 6.102 -1.111 -2.208
341 HB VAL 46 HB VAL 46 4.352 -2.735 -2.562
342 1HG1 VAL 46 1HG1 VAL 46 2.793 -3.403 -0.756
343 2HG1 VAL 46 2HG1 VAL 46 4.420 -3.972 -0.368
344 3HG1 VAL 46 3HG1 VAL 46 3.767 -2.515 0.417
345 1HG2 VAL 46 1HG2 VAL 46 3.305 -0.464 -0.828
346 2HG2 VAL 46 2HG2 VAL 46 3.719 -0.350 -2.553
347 3HG2 VAL 46 3HG2 VAL 46 2.434 -1.449 -2.019
348 H ASN 47 H ASN 47 5.723 0.856 -1.170
349 HA ASN 47 HA ASN 47 6.117 0.885 1.765
350 1HB ASN 47 2HB ASN 47 7.439 2.545 -0.433
351 2HB ASN 47 3HB ASN 47 7.292 3.152 1.217
352 1HD2 ASN 47 1HD2 ASN 47 8.165 1.632 2.987
353 2HD2 ASN 47 2HD2 ASN 47 9.791 1.085 2.624
354 H VAL 48 H VAL 48 4.858 2.556 2.839
355 HA VAL 48 HA VAL 48 3.027 4.109 1.130
356 HB VAL 48 HB VAL 48 2.069 2.375 3.413
357 1HG1 VAL 48 1HG1 VAL 48 0.437 3.929 1.364
358 2HG1 VAL 48 2HG1 VAL 48 -0.135 3.158 2.841
359 3HG1 VAL 48 3HG1 VAL 48 0.879 4.610 2.930
360 1HG2 VAL 48 1HG2 VAL 48 1.621 1.969 0.430
361 2HG2 VAL 48 2HG2 VAL 48 2.556 0.917 1.495
362 3HG2 VAL 48 3HG2 VAL 48 0.813 1.083 1.734
363 H ILE 49 H ILE 49 2.982 6.154 1.885
364 HA ILE 49 HA ILE 49 4.472 6.739 4.331
365 HB ILE 49 HB ILE 49 3.653 8.605 2.056
366 1HG1 ILE 49 2HG1 ILE 49 5.009 6.958 1.000
367 2HG1 ILE 49 3HG1 ILE 49 5.935 8.438 1.198
368 1HG2 ILE 49 1HG2 ILE 49 4.187 9.760 4.119
369 2HG2 ILE 49 2HG2 ILE 49 5.728 8.901 4.248
370 3HG2 ILE 49 3HG2 ILE 49 5.438 10.029 2.897
371 1HD1 ILE 49 1HD1 ILE 49 6.192 5.933 2.918
372 2HD1 ILE 49 2HD1 ILE 49 7.346 6.526 1.711
373 3HD1 ILE 49 3HD1 ILE 49 7.075 7.451 3.197
374 H TYR 50 H TYR 50 2.989 6.799 6.043
375 HA TYR 50 HA TYR 50 0.512 8.417 5.693
376 1HB TYR 50 2HB TYR 50 -0.867 6.682 6.695
377 2HB TYR 50 3HB TYR 50 -0.178 6.178 5.173
378 HD1 TYR 50 HD1 TYR 50 0.702 3.997 5.043
379 HD2 TYR 50 HD2 TYR 50 0.501 5.911 8.887
380 HE1 TYR 50 HE1 TYR 50 0.827 1.801 6.145
381 HE2 TYR 50 HE2 TYR 50 0.813 3.738 9.988
382 HH TYR 50 HH TYR 50 0.912 0.699 8.156
383 H ASP 51 H ASP 51 -0.626 8.766 7.691
384 HA ASP 51 HA ASP 51 1.224 9.422 9.868
385 1HB ASP 51 2HB ASP 51 -0.290 11.162 9.386
386 2HB ASP 51 3HB ASP 51 -1.678 10.066 9.443
387 HA PRO 52 HA PRO 52 0.006 5.472 11.671
388 1HB PRO 52 2HB PRO 52 1.908 5.239 13.562
389 2HB PRO 52 3HB PRO 52 2.344 5.316 11.831
390 1HG PRO 52 2HG PRO 52 2.294 7.628 13.808
391 2HG PRO 52 3HG PRO 52 3.658 7.120 12.769
392 1HD PRO 52 2HD PRO 52 1.907 9.082 12.018
393 2HD PRO 52 3HD PRO 52 2.608 7.934 10.835
394 H ALA 53 H ALA 53 -1.036 8.381 12.855
395 HA ALA 53 HA ALA 53 -2.019 7.248 15.430
396 1HB ALA 53 1HB ALA 53 -2.755 9.502 15.904
397 2HB ALA 53 2HB ALA 53 -1.025 9.530 15.504
398 3HB ALA 53 3HB ALA 53 -2.226 10.080 14.320
399 H GLU 54 H GLU 54 -2.920 8.722 12.296
400 HA GLU 54 HA GLU 54 -5.747 8.165 12.666
401 1HB GLU 54 2HB GLU 54 -4.127 9.805 10.891
402 2HB GLU 54 3HB GLU 54 -5.129 8.723 9.914
403 1HG GLU 54 2HG GLU 54 -6.390 10.702 10.239
404 2HG GLU 54 3HG GLU 54 -7.139 9.471 11.265
405 H THR 55 H THR 55 -3.052 6.817 10.759
406 HA THR 55 HA THR 55 -4.585 4.268 10.690
407 HB THR 55 HB THR 55 -3.357 3.567 8.618
408 HG1 THR 55 1HG THR 55 -2.390 6.104 8.949
409 1HG2 THR 55 1HG2 THR 55 -5.579 3.925 8.639
410 2HG2 THR 55 2HG2 THR 55 -5.432 5.710 8.515
411 3HG2 THR 55 3HG2 THR 55 -4.886 4.674 7.168
412 H GLY 56 H GLY 56 -1.678 3.454 9.616
413 1HA GLY 56 2HA GLY 56 -0.558 1.810 11.171
414 2HA GLY 56 3HA GLY 56 -2.062 1.905 12.100
415 H THR 57 H THR 57 -0.689 0.197 9.985
416 HA THR 57 HA THR 57 -1.486 -0.543 7.714
417 HB THR 57 HB THR 57 -1.198 -2.974 8.463
418 HG1 THR 57 1HG THR 57 -1.947 -2.889 10.546
419 1HG2 THR 57 1HG2 THR 57 0.910 -1.068 9.562
420 2HG2 THR 57 2HG2 THR 57 1.127 -2.728 9.002
421 3HG2 THR 57 3HG2 THR 57 0.727 -1.463 7.830
422 H ALA 58 H ALA 58 -3.568 -0.895 10.474
423 HA ALA 58 HA ALA 58 -5.721 -2.384 9.848
424 1HB ALA 58 1HB ALA 58 -7.039 -0.623 10.968
425 2HB ALA 58 2HB ALA 58 -5.491 -0.887 11.800
426 3HB ALA 58 3HB ALA 58 -5.693 0.523 10.746
427 H ALA 59 H ALA 59 -5.139 0.825 8.489
428 HA ALA 59 HA ALA 59 -7.777 0.515 7.033
429 1HB ALA 59 1HB ALA 59 -5.820 2.773 6.716
430 2HB ALA 59 2HB ALA 59 -7.470 2.704 6.084
431 3HB ALA 59 3HB ALA 59 -7.230 2.753 7.839
432 H ILE 60 H ILE 60 -4.384 0.748 6.355
433 HA ILE 60 HA ILE 60 -4.370 0.632 3.596
434 HB ILE 60 HB ILE 60 -2.476 0.108 5.852
435 1HG1 ILE 60 2HG1 ILE 60 -1.040 1.531 4.198
436 2HG1 ILE 60 3HG1 ILE 60 -2.540 1.733 3.300
437 1HG2 ILE 60 1HG2 ILE 60 -1.896 -1.857 4.507
438 2HG2 ILE 60 2HG2 ILE 60 -1.589 -0.778 3.117
439 3HG2 ILE 60 3HG2 ILE 60 -0.642 -0.627 4.630
440 1HD1 ILE 60 1HD1 ILE 60 -3.544 2.795 5.358
441 2HD1 ILE 60 2HD1 ILE 60 -2.085 2.372 6.291
442 3HD1 ILE 60 3HD1 ILE 60 -1.983 3.565 4.996
443 H GLN 61 H GLN 61 -4.398 -2.091 5.902
444 HA GLN 61 HA GLN 61 -4.149 -4.129 3.887
445 1HB GLN 61 2HB GLN 61 -4.552 -4.075 6.784
446 2HB GLN 61 3HB GLN 61 -5.591 -5.237 5.962
447 1HG GLN 61 2HG GLN 61 -3.749 -6.494 6.494
448 2HG GLN 61 3HG GLN 61 -3.611 -6.190 4.766
449 1HE2 GLN 61 1HE2 GLN 61 -2.747 -3.246 6.167
450 2HE2 GLN 61 2HE2 GLN 61 -1.023 -3.563 6.282
451 H GLU 62 H GLU 62 -6.923 -2.753 5.730
452 HA GLU 62 HA GLU 62 -9.035 -4.131 4.663
453 1HB GLU 62 2HB GLU 62 -8.653 -1.670 6.124
454 2HB GLU 62 3HB GLU 62 -9.719 -1.279 4.783
455 1HG GLU 62 2HG GLU 62 -10.161 -3.540 6.770
456 2HG GLU 62 3HG GLU 62 -10.974 -1.968 6.782
457 H LYS 63 H LYS 63 -7.612 -1.128 3.241
458 HA LYS 63 HA LYS 63 -9.225 -1.346 0.898
459 1HB LYS 63 2HB LYS 63 -6.927 0.331 1.876
460 2HB LYS 63 3HB LYS 63 -7.413 0.416 0.205
461 1HG LYS 63 2HG LYS 63 -9.348 0.802 2.540
462 2HG LYS 63 3HG LYS 63 -8.405 2.076 1.789
463 1HD LYS 63 2HD LYS 63 -10.534 2.289 0.896
464 2HD LYS 63 3HD LYS 63 -9.505 1.689 -0.402
465 1HE LYS 63 2HE LYS 63 -10.616 -0.391 -0.440
466 2HE LYS 63 3HE LYS 63 -11.181 -0.244 1.250
467 1HZ LYS 63 1HZ LYS 63 -12.718 1.420 0.523
468 2HZ LYS 63 2HZ LYS 63 -12.194 1.302 -1.036
469 3HZ LYS 63 3HZ LYS 63 -12.942 0.029 -0.317
470 H ILE 64 H ILE 64 -5.894 -2.395 1.661
471 HA ILE 64 HA ILE 64 -4.898 -2.884 -0.826
472 HB ILE 64 HB ILE 64 -4.504 -3.816 1.862
473 1HG1 ILE 64 2HG1 ILE 64 -3.244 -1.990 0.828
474 2HG1 ILE 64 3HG1 ILE 64 -2.271 -3.283 1.512
475 1HG2 ILE 64 1HG2 ILE 64 -4.636 -6.009 1.186
476 2HG2 ILE 64 2HG2 ILE 64 -3.694 -5.717 -0.298
477 3HG2 ILE 64 3HG2 ILE 64 -2.925 -5.620 1.306
478 1HD1 ILE 64 1HD1 ILE 64 -2.089 -4.250 -0.827
479 2HD1 ILE 64 2HD1 ILE 64 -2.790 -2.728 -1.411
480 3HD1 ILE 64 3HD1 ILE 64 -1.255 -2.713 -0.514
481 H GLU 65 H GLU 65 -6.867 -4.970 1.365
482 HA GLU 65 HA GLU 65 -7.396 -7.196 -0.279
483 1HB GLU 65 2HB GLU 65 -9.055 -5.952 1.957
484 2HB GLU 65 3HB GLU 65 -9.353 -7.535 1.240
485 1HG GLU 65 2HG GLU 65 -6.760 -6.794 2.616
486 2HG GLU 65 3HG GLU 65 -8.117 -7.598 3.406
487 H LYS 66 H LYS 66 -9.606 -4.396 0.368
488 HA LYS 66 HA LYS 66 -11.544 -5.232 -1.521
489 1HB LYS 66 2HB LYS 66 -10.921 -2.635 -0.144
490 2HB LYS 66 3HB LYS 66 -11.921 -2.560 -1.595
491 1HG LYS 66 2HG LYS 66 -13.524 -2.741 0.006
492 2HG LYS 66 3HG LYS 66 -13.374 -4.414 -0.526
493 1HD LYS 66 2HD LYS 66 -11.862 -4.833 1.482
494 2HD LYS 66 3HD LYS 66 -12.120 -3.150 1.962
495 1HE LYS 66 2HE LYS 66 -14.682 -3.721 1.834
496 2HE LYS 66 3HE LYS 66 -14.159 -5.415 1.832
497 1HZ LYS 66 1HZ LYS 66 -13.525 -3.386 3.898
498 2HZ LYS 66 2HZ LYS 66 -14.615 -4.620 4.081
499 3HZ LYS 66 3HZ LYS 66 -12.978 -4.851 3.974
500 H LEU 67 H LEU 67 -8.603 -3.363 -2.091
501 HA LEU 67 HA LEU 67 -9.247 -2.612 -4.807
502 1HB LEU 67 2HB LEU 67 -6.670 -2.685 -3.231
503 2HB LEU 67 3HB LEU 67 -6.775 -2.102 -4.892
504 HG LEU 67 HG LEU 67 -8.580 -0.927 -2.745
505 1HD1 LEU 67 1HD1 LEU 67 -6.942 0.837 -2.377
506 2HD1 LEU 67 2HD1 LEU 67 -6.218 -0.731 -1.972
507 3HD1 LEU 67 3HD1 LEU 67 -5.811 0.059 -3.499
508 1HD2 LEU 67 1HD2 LEU 67 -9.149 -0.390 -5.097
509 2HD2 LEU 67 2HD2 LEU 67 -8.539 1.036 -4.248
510 3HD2 LEU 67 3HD2 LEU 67 -7.484 0.163 -5.377
511 H GLY 68 H GLY 68 -8.235 -5.588 -3.338
512 1HA GLY 68 2HA GLY 68 -8.360 -7.608 -4.439
513 2HA GLY 68 3HA GLY 68 -8.090 -6.842 -6.007
514 H TYR 69 H TYR 69 -6.129 -6.386 -3.025
515 HA TYR 69 HA TYR 69 -3.904 -8.016 -4.188
516 1HB TYR 69 2HB TYR 69 -3.950 -5.153 -3.389
517 2HB TYR 69 3HB TYR 69 -2.669 -6.089 -2.647
518 HD1 TYR 69 HD1 TYR 69 -0.661 -6.455 -3.793
519 HD2 TYR 69 HD2 TYR 69 -4.257 -5.608 -6.018
520 HE1 TYR 69 HE1 TYR 69 0.664 -6.207 -5.854
521 HE2 TYR 69 HE2 TYR 69 -2.955 -5.406 -8.064
522 HH TYR 69 HH TYR 69 -0.786 -5.047 -8.896
523 H HIS 70 H HIS 70 -2.370 -8.636 -2.415
524 HA HIS 70 HA HIS 70 -3.376 -8.262 0.341
525 1HB HIS 70 2HB HIS 70 -4.109 -10.548 -0.311
526 2HB HIS 70 3HB HIS 70 -2.446 -10.954 -0.758
527 HD1 HIS 70 1HD HIS 70 -4.439 -9.862 2.385
528 HD2 HIS 70 2HD HIS 70 -0.989 -11.973 1.199
529 HE1 HIS 70 1HE HIS 70 -3.446 -10.902 4.499
530 H VAL 71 H VAL 71 -1.548 -7.569 1.622
531 HA VAL 71 HA VAL 71 1.055 -7.653 0.271
532 HB VAL 71 HB VAL 71 1.746 -6.191 2.028
533 1HG1 VAL 71 1HG1 VAL 71 0.607 -4.158 1.231
534 2HG1 VAL 71 2HG1 VAL 71 0.998 -5.271 -0.095
535 3HG1 VAL 71 3HG1 VAL 71 -0.661 -5.182 0.525
536 1HG2 VAL 71 1HG2 VAL 71 -1.179 -5.982 2.894
537 2HG2 VAL 71 2HG2 VAL 71 0.099 -6.788 3.821
538 3HG2 VAL 71 3HG2 VAL 71 0.179 -5.044 3.532
539 H VAL 72 H VAL 72 2.818 -8.637 1.281
540 HA VAL 72 HA VAL 72 2.066 -10.769 3.238
541 HB VAL 72 HB VAL 72 4.544 -10.867 1.636
542 1HG1 VAL 72 1HG1 VAL 72 2.772 -13.020 2.838
543 2HG1 VAL 72 2HG1 VAL 72 4.336 -13.266 2.035
544 3HG1 VAL 72 3HG1 VAL 72 4.263 -12.386 3.567
545 1HG2 VAL 72 1HG2 VAL 72 2.818 -10.670 -0.105
546 2HG2 VAL 72 2HG2 VAL 72 3.333 -12.355 0.003
547 3HG2 VAL 72 3HG2 VAL 72 1.798 -11.854 0.745
548 H ILE 73 H ILE 73 3.009 -10.721 5.158
549 HA ILE 73 HA ILE 73 4.810 -8.421 5.810
550 HB ILE 73 HB ILE 73 2.916 -9.828 7.679
551 1HG1 ILE 73 2HG1 ILE 73 1.507 -8.786 6.024
552 2HG1 ILE 73 3HG1 ILE 73 1.526 -7.855 7.515
553 1HG2 ILE 73 1HG2 ILE 73 3.352 -7.848 9.086
554 2HG2 ILE 73 2HG2 ILE 73 4.866 -8.675 8.694
555 3HG2 ILE 73 3HG2 ILE 73 4.459 -7.191 7.859
556 1HD1 ILE 73 1HD1 ILE 73 2.990 -7.119 4.968
557 2HD1 ILE 73 2HD1 ILE 73 1.537 -6.355 5.621
558 3HD1 ILE 73 3HD1 ILE 73 3.064 -6.188 6.483
559 H GLU 74 H GLU 74 6.555 -10.018 5.009
560 HA GLU 74 HA GLU 74 7.064 -12.270 6.524
561 1HB GLU 74 2HB GLU 74 8.750 -10.676 4.579
562 2HB GLU 74 3HB GLU 74 9.199 -12.254 5.217
563 1HG GLU 74 2HG GLU 74 7.112 -13.245 4.301
564 2HG GLU 74 3HG GLU 74 6.675 -11.682 3.587
565 H GLY 75 H GLY 75 7.532 -9.179 7.278
566 1HA GLY 75 2HA GLY 75 9.479 -9.705 9.519
567 2HA GLY 75 3HA GLY 75 9.144 -8.104 8.835
568 H ARG 76 H ARG 76 7.319 -10.930 10.085
569 HA ARG 76 HA ARG 76 5.067 -9.300 10.776
570 1HB ARG 76 2HB ARG 76 4.821 -11.651 10.031
571 2HB ARG 76 3HB ARG 76 5.717 -12.196 11.454
572 1HG ARG 76 2HG ARG 76 3.309 -12.544 11.715
573 2HG ARG 76 3HG ARG 76 3.936 -11.437 12.933
574 1HD ARG 76 2HD ARG 76 3.085 -9.500 11.415
575 2HD ARG 76 3HD ARG 76 2.362 -10.744 10.405
576 HE ARG 76 HE ARG 76 0.690 -10.997 11.967
577 1HH1 ARG 76 2HH2 ARG 76 3.417 -9.276 13.537
578 2HH1 ARG 76 1HH2 ARG 76 2.463 -8.685 14.842
579 1HH2 ARG 76 2HH1 ARG 76 -0.561 -10.236 13.749
580 2HH2 ARG 76 1HH1 ARG 76 0.173 -9.279 14.996
Start of MODEL 24
1 1H MET 1 H1 MET 1 -4.473 17.718 15.258
2 2H MET 1 H2 MET 1 -5.290 18.763 16.249
3 3H MET 1 H3 MET 1 -4.146 19.328 15.195
4 HA MET 1 HA MET 1 -3.272 19.340 17.382
5 1HB MET 1 2HB MET 1 -4.085 16.420 17.278
6 2HB MET 1 3HB MET 1 -2.702 16.935 18.259
7 1HG MET 1 2HG MET 1 -4.039 18.516 19.493
8 2HG MET 1 3HG MET 1 -5.490 18.082 18.570
9 1HE MET 1 1HE MET 1 -6.011 16.680 22.239
10 2HE MET 1 2HE MET 1 -5.030 18.105 21.827
11 3HE MET 1 3HE MET 1 -6.600 17.838 21.022
12 H LEU 2 H LEU 2 -2.107 16.191 16.157
13 HA LEU 2 HA LEU 2 0.002 17.483 14.598
14 1HB LEU 2 2HB LEU 2 0.478 17.367 17.190
15 2HB LEU 2 3HB LEU 2 0.725 15.646 16.928
16 HG LEU 2 HG LEU 2 2.188 17.721 15.237
17 1HD1 LEU 2 1HD1 LEU 2 3.997 17.751 16.915
18 2HD1 LEU 2 2HD1 LEU 2 2.496 18.426 17.569
19 3HD1 LEU 2 3HD1 LEU 2 2.996 16.780 18.019
20 1HD2 LEU 2 1HD2 LEU 2 2.432 15.305 14.617
21 2HD2 LEU 2 2HD2 LEU 2 3.953 15.992 15.193
22 3HD2 LEU 2 3HD2 LEU 2 2.991 14.955 16.264
23 H SER 3 H SER 3 0.667 16.062 13.015
24 HA SER 3 HA SER 3 -0.324 13.248 13.041
25 1HB SER 3 2HB SER 3 -0.543 15.351 10.838
26 2HB SER 3 3HB SER 3 -0.636 13.610 10.535
27 HG SER 3 HG SER 3 -2.359 13.407 11.796
28 H GLU 4 H GLU 4 1.646 12.331 13.497
29 HA GLU 4 HA GLU 4 4.151 13.127 12.323
30 1HB GLU 4 2HB GLU 4 3.095 10.809 13.871
31 2HB GLU 4 3HB GLU 4 4.738 10.814 13.268
32 1HG GLU 4 2HG GLU 4 5.374 12.587 14.558
33 2HG GLU 4 3HG GLU 4 3.715 13.103 14.863
34 H GLN 5 H GLN 5 5.333 11.203 11.063
35 HA GLN 5 HA GLN 5 3.512 9.839 9.179
36 1HB GLN 5 2HB GLN 5 5.973 11.487 8.567
37 2HB GLN 5 3HB GLN 5 5.302 10.365 7.394
38 1HG GLN 5 2HG GLN 5 3.571 12.580 8.620
39 2HG GLN 5 3HG GLN 5 4.708 12.907 7.342
40 1HE2 GLN 5 1HE2 GLN 5 3.292 9.695 7.099
41 2HE2 GLN 5 2HE2 GLN 5 2.185 10.135 5.815
42 H LYS 6 H LYS 6 4.341 7.835 8.475
43 HA LYS 6 HA LYS 6 7.110 7.144 9.078
44 1HB LYS 6 2HB LYS 6 4.686 5.538 9.973
45 2HB LYS 6 3HB LYS 6 6.213 4.742 9.651
46 1HG LYS 6 2HG LYS 6 5.899 6.964 11.706
47 2HG LYS 6 3HG LYS 6 5.843 5.226 12.031
48 1HD LYS 6 2HD LYS 6 8.192 5.147 10.820
49 2HD LYS 6 3HD LYS 6 8.176 6.902 10.985
50 1HE LYS 6 2HE LYS 6 9.450 5.977 12.793
51 2HE LYS 6 3HE LYS 6 7.973 6.705 13.445
52 1HZ LYS 6 1HZ LYS 6 8.484 4.541 14.401
53 2HZ LYS 6 2HZ LYS 6 7.040 4.507 13.623
54 3HZ LYS 6 3HZ LYS 6 8.365 3.822 12.925
55 H GLU 7 H GLU 7 7.763 5.321 7.871
56 HA GLU 7 HA GLU 7 6.409 5.012 5.250
57 1HB GLU 7 2HB GLU 7 9.415 4.890 5.641
58 2HB GLU 7 3HB GLU 7 8.455 5.101 4.178
59 1HG GLU 7 2HG GLU 7 9.548 7.175 4.688
60 2HG GLU 7 3HG GLU 7 7.832 7.406 5.058
61 H ILE 8 H ILE 8 5.461 2.960 5.680
62 HA ILE 8 HA ILE 8 7.061 0.913 7.042
63 HB ILE 8 HB ILE 8 4.365 0.862 5.818
64 1HG1 ILE 8 2HG1 ILE 8 4.128 2.570 7.416
65 2HG1 ILE 8 3HG1 ILE 8 3.388 1.098 8.061
66 1HG2 ILE 8 1HG2 ILE 8 5.083 -1.316 6.086
67 2HG2 ILE 8 2HG2 ILE 8 5.804 -0.961 7.682
68 3HG2 ILE 8 3HG2 ILE 8 4.027 -1.015 7.475
69 1HD1 ILE 8 1HD1 ILE 8 4.726 2.163 9.779
70 2HD1 ILE 8 2HD1 ILE 8 5.465 0.612 9.284
71 3HD1 ILE 8 3HD1 ILE 8 6.139 2.151 8.694
72 H ALA 9 H ALA 9 7.228 -1.212 5.873
73 HA ALA 9 HA ALA 9 7.530 -1.013 2.938
74 1HB ALA 9 1HB ALA 9 9.763 -0.493 3.952
75 2HB ALA 9 2HB ALA 9 9.707 -2.039 4.815
76 3HB ALA 9 3HB ALA 9 9.751 -2.016 3.038
77 H MET 10 H MET 10 6.453 -2.818 2.118
78 HA MET 10 HA MET 10 6.468 -5.349 3.732
79 1HB MET 10 2HB MET 10 4.058 -4.063 2.405
80 2HB MET 10 3HB MET 10 4.089 -5.699 3.039
81 1HG MET 10 2HG MET 10 3.790 -5.045 5.144
82 2HG MET 10 3HG MET 10 4.866 -3.664 5.054
83 1HE MET 10 1HE MET 10 1.354 -4.588 5.760
84 2HE MET 10 2HE MET 10 2.345 -3.542 6.812
85 3HE MET 10 3HE MET 10 0.862 -2.910 6.051
86 H GLN 11 H GLN 11 5.758 -7.210 2.364
87 HA GLN 11 HA GLN 11 6.914 -7.104 -0.368
88 1HB GLN 11 2HB GLN 11 6.636 -9.111 1.735
89 2HB GLN 11 3HB GLN 11 5.815 -9.663 0.279
90 1HG GLN 11 2HG GLN 11 8.620 -8.597 -0.034
91 2HG GLN 11 3HG GLN 11 8.377 -10.152 0.768
92 1HE2 GLN 11 1HE2 GLN 11 7.874 -8.431 -2.323
93 2HE2 GLN 11 2HE2 GLN 11 7.456 -9.876 -3.220
94 H VAL 12 H VAL 12 5.558 -8.340 -2.034
95 HA VAL 12 HA VAL 12 2.689 -7.499 -1.857
96 HB VAL 12 HB VAL 12 4.571 -7.341 -4.250
97 1HG1 VAL 12 1HG1 VAL 12 1.723 -6.349 -3.790
98 2HG1 VAL 12 2HG1 VAL 12 2.714 -5.982 -5.215
99 3HG1 VAL 12 3HG1 VAL 12 2.217 -7.648 -4.903
100 1HG2 VAL 12 1HG2 VAL 12 3.546 -5.163 -2.387
101 2HG2 VAL 12 2HG2 VAL 12 5.249 -5.634 -2.616
102 3HG2 VAL 12 3HG2 VAL 12 4.366 -4.856 -3.927
103 H SER 13 H SER 13 1.153 -8.985 -2.775
104 HA SER 13 HA SER 13 2.093 -11.131 -4.509
105 1HB SER 13 2HB SER 13 1.054 -11.602 -1.690
106 2HB SER 13 3HB SER 13 0.859 -12.828 -2.950
107 HG SER 13 HG SER 13 3.397 -11.686 -2.566
108 H GLY 14 H GLY 14 0.166 -12.497 -5.166
109 1HA GLY 14 2HA GLY 14 -1.915 -12.688 -6.102
110 2HA GLY 14 3HA GLY 14 -2.513 -11.591 -4.845
111 H MET 15 H MET 15 -0.663 -11.591 -7.970
112 HA MET 15 HA MET 15 -1.978 -9.093 -8.777
113 1HB MET 15 2HB MET 15 0.065 -7.877 -8.945
114 2HB MET 15 3HB MET 15 -0.043 -8.493 -7.283
115 1HG MET 15 2HG MET 15 2.124 -9.085 -7.667
116 2HG MET 15 3HG MET 15 1.413 -10.485 -8.463
117 1HE MET 15 1HE MET 15 3.813 -10.748 -9.674
118 2HE MET 15 2HE MET 15 2.399 -11.195 -10.669
119 3HE MET 15 3HE MET 15 3.726 -10.258 -11.386
120 H THR 16 H THR 16 -1.614 -8.551 -10.987
121 HA THR 16 HA THR 16 -0.710 -10.713 -12.785
122 HB THR 16 HB THR 16 -1.483 -8.707 -14.398
123 HG1 THR 16 1HG THR 16 -3.358 -8.176 -12.465
124 1HG2 THR 16 1HG2 THR 16 -3.430 -10.469 -12.840
125 2HG2 THR 16 2HG2 THR 16 -3.785 -9.609 -14.362
126 3HG2 THR 16 3HG2 THR 16 -2.569 -10.896 -14.335
127 H CYS 17 H CYS 17 -0.234 -7.146 -12.385
128 HA CYS 17 HA CYS 17 2.585 -7.472 -13.270
129 1HB CYS 17 2HB CYS 17 2.221 -5.854 -15.031
130 2HB CYS 17 3HB CYS 17 1.052 -7.166 -15.227
131 H ALA 18 H ALA 18 3.864 -5.599 -13.131
132 HA ALA 18 HA ALA 18 3.590 -4.101 -10.671
133 1HB ALA 18 1HB ALA 18 5.754 -4.964 -11.545
134 2HB ALA 18 2HB ALA 18 5.610 -3.883 -12.943
135 3HB ALA 18 3HB ALA 18 5.782 -3.205 -11.313
136 H ALA 19 H ALA 19 1.374 -3.507 -12.205
137 HA ALA 19 HA ALA 19 1.737 -0.596 -12.706
138 1HB ALA 19 1HB ALA 19 0.429 -0.628 -14.726
139 2HB ALA 19 2HB ALA 19 1.800 -1.736 -14.936
140 3HB ALA 19 3HB ALA 19 0.173 -2.374 -14.619
141 H CYS 20 H CYS 20 -0.681 -3.304 -12.500
142 HA CYS 20 HA CYS 20 -2.675 -1.780 -11.186
143 1HB CYS 20 2HB CYS 20 -1.823 -4.710 -10.802
144 2HB CYS 20 3HB CYS 20 -3.339 -4.019 -10.205
145 H ALA 21 H ALA 21 0.229 -3.349 -9.986
146 HA ALA 21 HA ALA 21 0.182 -2.918 -7.272
147 1HB ALA 21 1HB ALA 21 1.966 -4.011 -8.638
148 2HB ALA 21 2HB ALA 21 2.499 -2.403 -9.184
149 3HB ALA 21 3HB ALA 21 2.615 -2.859 -7.475
150 H ALA 22 H ALA 22 0.476 -0.408 -9.811
151 HA ALA 22 HA ALA 22 1.237 1.717 -7.956
152 1HB ALA 22 1HB ALA 22 1.837 1.728 -10.397
153 2HB ALA 22 2HB ALA 22 0.109 1.900 -10.779
154 3HB ALA 22 3HB ALA 22 0.939 3.167 -9.862
155 H ARG 23 H ARG 23 -1.659 0.673 -9.770
156 HA ARG 23 HA ARG 23 -3.424 2.721 -9.025
157 1HB ARG 23 2HB ARG 23 -4.085 -0.225 -9.458
158 2HB ARG 23 3HB ARG 23 -5.247 1.110 -9.397
159 1HG ARG 23 2HG ARG 23 -4.111 2.167 -11.348
160 2HG ARG 23 3HG ARG 23 -3.054 0.753 -11.487
161 1HD ARG 23 2HD ARG 23 -6.115 0.760 -11.723
162 2HD ARG 23 3HD ARG 23 -4.969 0.668 -13.042
163 HE ARG 23 HE ARG 23 -4.387 -1.520 -12.559
164 1HH1 ARG 23 2HH2 ARG 23 -6.699 -0.400 -10.125
165 2HH1 ARG 23 1HH2 ARG 23 -7.148 -2.001 -9.616
166 1HH2 ARG 23 2HH1 ARG 23 -4.888 -3.610 -11.837
167 2HH2 ARG 23 1HH1 ARG 23 -6.170 -3.869 -10.686
168 H ILE 24 H ILE 24 -2.841 -0.433 -7.382
169 HA ILE 24 HA ILE 24 -4.730 0.014 -5.357
170 HB ILE 24 HB ILE 24 -3.767 -1.694 -4.048
171 1HG1 ILE 24 2HG1 ILE 24 -1.354 -1.213 -5.732
172 2HG1 ILE 24 3HG1 ILE 24 -1.507 -1.122 -3.958
173 1HG2 ILE 24 1HG2 ILE 24 -3.250 -2.603 -6.889
174 2HG2 ILE 24 2HG2 ILE 24 -4.038 -3.442 -5.540
175 3HG2 ILE 24 3HG2 ILE 24 -4.878 -2.136 -6.378
176 1HD1 ILE 24 1HD1 ILE 24 -0.212 -3.071 -4.557
177 2HD1 ILE 24 2HD1 ILE 24 -1.781 -3.584 -3.888
178 3HD1 ILE 24 3HD1 ILE 24 -1.487 -3.610 -5.653
179 H GLU 25 H GLU 25 -1.233 0.732 -5.262
180 HA GLU 25 HA GLU 25 -1.184 1.986 -2.795
181 1HB GLU 25 2HB GLU 25 0.616 1.577 -5.000
182 2HB GLU 25 3HB GLU 25 0.684 3.293 -4.581
183 1HG GLU 25 2HG GLU 25 2.334 1.892 -3.312
184 2HG GLU 25 3HG GLU 25 1.187 2.729 -2.263
185 H LYS 26 H LYS 26 -2.174 3.371 -5.918
186 HA LYS 26 HA LYS 26 -2.133 6.087 -4.787
187 1HB LYS 26 2HB LYS 26 -3.378 5.264 -7.412
188 2HB LYS 26 3HB LYS 26 -2.967 6.883 -6.825
189 1HG LYS 26 2HG LYS 26 -1.141 4.737 -7.829
190 2HG LYS 26 3HG LYS 26 -1.237 6.423 -8.297
191 1HD LYS 26 2HD LYS 26 -0.248 7.090 -6.103
192 2HD LYS 26 3HD LYS 26 -0.151 5.386 -5.636
193 1HE LYS 26 2HE LYS 26 1.211 5.098 -7.874
194 2HE LYS 26 3HE LYS 26 1.499 6.835 -7.685
195 1HZ LYS 26 1HZ LYS 26 2.173 4.665 -5.804
196 2HZ LYS 26 2HZ LYS 26 3.222 5.618 -6.626
197 3HZ LYS 26 3HZ LYS 26 2.348 6.218 -5.371
198 H GLY 27 H GLY 27 -4.726 3.707 -5.502
199 1HA GLY 27 2HA GLY 27 -6.870 5.357 -4.496
200 2HA GLY 27 3HA GLY 27 -6.853 3.588 -4.530
201 H LEU 28 H LEU 28 -4.560 3.111 -3.008
202 HA LEU 28 HA LEU 28 -5.456 3.166 -0.284
203 1HB LEU 28 2HB LEU 28 -4.137 1.505 -1.278
204 2HB LEU 28 3HB LEU 28 -2.797 2.622 -1.536
205 HG LEU 28 HG LEU 28 -3.885 1.990 1.230
206 1HD1 LEU 28 1HD1 LEU 28 -1.870 0.541 -0.522
207 2HD1 LEU 28 2HD1 LEU 28 -1.988 0.299 1.226
208 3HD1 LEU 28 3HD1 LEU 28 -3.382 -0.065 0.187
209 1HD2 LEU 28 1HD2 LEU 28 -2.234 3.434 1.865
210 2HD2 LEU 28 2HD2 LEU 28 -1.028 2.476 0.959
211 3HD2 LEU 28 3HD2 LEU 28 -1.879 3.799 0.174
212 H LYS 29 H LYS 29 -3.164 5.272 -2.117
213 HA LYS 29 HA LYS 29 -2.509 6.916 0.054
214 1HB LYS 29 2HB LYS 29 -1.491 6.870 -2.322
215 2HB LYS 29 3HB LYS 29 -2.786 7.990 -2.758
216 1HG LYS 29 2HG LYS 29 -1.570 8.942 -0.286
217 2HG LYS 29 3HG LYS 29 -0.296 8.388 -1.339
218 1HD LYS 29 2HD LYS 29 -0.311 10.365 -2.319
219 2HD LYS 29 3HD LYS 29 -1.834 9.964 -3.091
220 1HE LYS 29 2HE LYS 29 -1.474 11.304 -0.361
221 2HE LYS 29 3HE LYS 29 -1.779 12.169 -1.868
222 1HZ LYS 29 1HZ LYS 29 -3.758 11.923 -0.597
223 2HZ LYS 29 2HZ LYS 29 -3.921 10.933 -1.909
224 3HZ LYS 29 3HZ LYS 29 -3.564 10.315 -0.423
225 H ARG 30 H ARG 30 -5.474 6.833 -1.876
226 HA ARG 30 HA ARG 30 -6.285 9.520 -1.092
227 1HB ARG 30 2HB ARG 30 -7.350 7.376 -2.832
228 2HB ARG 30 3HB ARG 30 -8.594 8.172 -1.886
229 1HG ARG 30 2HG ARG 30 -7.598 10.405 -2.662
230 2HG ARG 30 3HG ARG 30 -6.592 9.454 -3.784
231 1HD ARG 30 2HD ARG 30 -8.673 8.522 -4.794
232 2HD ARG 30 3HD ARG 30 -9.634 9.443 -3.605
233 HE ARG 30 HE ARG 30 -7.847 11.144 -5.114
234 1HH1 ARG 30 2HH2 ARG 30 -10.940 9.475 -5.321
235 2HH1 ARG 30 1HH2 ARG 30 -11.677 10.611 -6.407
236 1HH2 ARG 30 2HH1 ARG 30 -8.778 12.682 -6.572
237 2HH2 ARG 30 1HH1 ARG 30 -10.395 12.471 -7.152
238 H MET 31 H MET 31 -6.060 6.694 0.782
239 HA MET 31 HA MET 31 -8.552 7.084 2.213
240 1HB MET 31 2HB MET 31 -6.032 5.571 3.027
241 2HB MET 31 3HB MET 31 -7.627 5.384 3.750
242 1HG MET 31 2HG MET 31 -6.728 4.590 0.981
243 2HG MET 31 3HG MET 31 -7.316 3.585 2.274
244 1HE MET 31 1HE MET 31 -10.080 5.386 3.003
245 2HE MET 31 2HE MET 31 -11.210 4.463 2.009
246 3HE MET 31 3HE MET 31 -9.960 3.615 2.956
247 HA PRO 32 HA PRO 32 -7.262 10.291 5.023
248 1HB PRO 32 2HB PRO 32 -8.411 9.525 7.404
249 2HB PRO 32 3HB PRO 32 -9.337 10.216 6.041
250 1HG PRO 32 2HG PRO 32 -8.969 7.290 6.712
251 2HG PRO 32 3HG PRO 32 -10.499 8.142 6.349
252 1HD PRO 32 2HD PRO 32 -9.185 6.736 4.482
253 2HD PRO 32 3HD PRO 32 -9.949 8.284 4.024
254 H GLY 33 H GLY 33 -5.672 10.541 6.734
255 1HA GLY 33 2HA GLY 33 -3.859 10.035 7.903
256 2HA GLY 33 3HA GLY 33 -4.297 8.321 7.844
257 H VAL 34 H VAL 34 -4.194 8.668 4.664
258 HA VAL 34 HA VAL 34 -1.283 8.077 4.589
259 HB VAL 34 HB VAL 34 -3.400 7.526 2.525
260 1HG1 VAL 34 1HG1 VAL 34 -0.540 6.486 3.042
261 2HG1 VAL 34 2HG1 VAL 34 -1.604 5.845 1.791
262 3HG1 VAL 34 3HG1 VAL 34 -1.019 7.520 1.696
263 1HG2 VAL 34 1HG2 VAL 34 -2.352 5.746 4.767
264 2HG2 VAL 34 2HG2 VAL 34 -4.027 6.278 4.512
265 3HG2 VAL 34 3HG2 VAL 34 -3.279 5.161 3.370
266 H THR 35 H THR 35 0.155 9.411 3.616
267 HA THR 35 HA THR 35 -0.945 11.802 2.181
268 HB THR 35 HB THR 35 0.904 11.528 4.430
269 HG1 THR 35 1HG THR 35 -1.107 12.561 4.505
270 1HG2 THR 35 1HG2 THR 35 2.100 13.632 3.850
271 2HG2 THR 35 2HG2 THR 35 2.594 12.247 2.866
272 3HG2 THR 35 3HG2 THR 35 1.511 13.497 2.186
273 H ASP 36 H ASP 36 1.562 9.219 2.034
274 HA ASP 36 HA ASP 36 1.445 9.711 -0.814
275 1HB ASP 36 2HB ASP 36 3.867 10.505 0.684
276 2HB ASP 36 3HB ASP 36 4.203 9.282 -0.545
277 H ALA 37 H ALA 37 2.384 7.927 -2.006
278 HA ALA 37 HA ALA 37 3.031 5.531 -0.521
279 1HB ALA 37 1HB ALA 37 0.398 5.790 -0.473
280 2HB ALA 37 2HB ALA 37 0.505 5.208 -2.145
281 3HB ALA 37 3HB ALA 37 1.129 4.228 -0.789
282 H ASN 38 H ASN 38 4.068 3.900 -1.762
283 HA ASN 38 HA ASN 38 4.626 4.535 -4.597
284 1HB ASN 38 2HB ASN 38 7.183 4.452 -3.407
285 2HB ASN 38 3HB ASN 38 6.385 5.818 -4.163
286 1HD2 ASN 38 1HD2 ASN 38 5.953 4.200 -0.935
287 2HD2 ASN 38 2HD2 ASN 38 6.233 5.698 -0.050
288 H VAL 39 H VAL 39 4.630 2.557 -5.478
289 HA VAL 39 HA VAL 39 5.198 0.235 -3.802
290 HB VAL 39 HB VAL 39 3.133 0.264 -4.897
291 1HG1 VAL 39 1HG1 VAL 39 4.608 0.797 -7.514
292 2HG1 VAL 39 2HG1 VAL 39 3.017 0.089 -7.438
293 3HG1 VAL 39 3HG1 VAL 39 3.285 1.701 -6.762
294 1HG2 VAL 39 1HG2 VAL 39 3.136 -1.873 -5.645
295 2HG2 VAL 39 2HG2 VAL 39 4.679 -1.698 -6.529
296 3HG2 VAL 39 3HG2 VAL 39 4.655 -1.836 -4.751
297 H ASN 40 H ASN 40 7.368 -0.213 -3.644
298 HA ASN 40 HA ASN 40 9.161 0.388 -5.895
299 1HB ASN 40 2HB ASN 40 9.725 0.927 -3.531
300 2HB ASN 40 3HB ASN 40 9.773 -0.806 -3.175
301 1HD2 ASN 40 1HD2 ASN 40 12.055 0.255 -2.554
302 2HD2 ASN 40 2HD2 ASN 40 13.271 0.093 -3.812
303 H LEU 41 H LEU 41 7.555 -1.244 -6.963
304 HA LEU 41 HA LEU 41 7.948 -4.039 -6.514
305 1HB LEU 41 2HB LEU 41 6.243 -2.403 -8.091
306 2HB LEU 41 3HB LEU 41 7.107 -3.384 -9.254
307 HG LEU 41 HG LEU 41 4.896 -4.256 -8.449
308 1HD1 LEU 41 1HD1 LEU 41 7.268 -6.112 -7.938
309 2HD1 LEU 41 2HD1 LEU 41 5.601 -6.604 -8.292
310 3HD1 LEU 41 3HD1 LEU 41 6.559 -5.759 -9.520
311 1HD2 LEU 41 1HD2 LEU 41 5.530 -3.680 -5.934
312 2HD2 LEU 41 2HD2 LEU 41 4.463 -5.030 -6.358
313 3HD2 LEU 41 3HD2 LEU 41 6.156 -5.330 -5.941
314 H ALA 42 H ALA 42 9.849 -1.697 -8.180
315 HA ALA 42 HA ALA 42 11.398 -3.181 -9.964
316 1HB ALA 42 1HB ALA 42 11.672 -0.736 -9.482
317 2HB ALA 42 2HB ALA 42 12.393 -1.179 -7.906
318 3HB ALA 42 3HB ALA 42 13.206 -1.643 -9.406
319 H THR 43 H THR 43 11.330 -3.362 -6.403
320 HA THR 43 HA THR 43 13.112 -5.709 -6.635
321 HB THR 43 HB THR 43 14.592 -4.044 -5.817
322 HG1 THR 43 1HG THR 43 13.598 -5.720 -3.797
323 1HG2 THR 43 1HG2 THR 43 14.088 -2.786 -3.671
324 2HG2 THR 43 2HG2 THR 43 13.193 -2.268 -5.110
325 3HG2 THR 43 3HG2 THR 43 12.388 -3.266 -3.882
326 H GLU 44 H GLU 44 10.284 -5.561 -6.730
327 HA GLU 44 HA GLU 44 8.369 -6.335 -5.784
328 1HB GLU 44 2HB GLU 44 10.489 -8.288 -4.836
329 2HB GLU 44 3HB GLU 44 8.757 -8.575 -4.676
330 1HG GLU 44 2HG GLU 44 9.442 -9.713 -6.627
331 2HG GLU 44 3HG GLU 44 8.451 -8.341 -7.125
332 H THR 45 H THR 45 9.299 -4.131 -4.159
333 HA THR 45 HA THR 45 8.095 -4.973 -1.575
334 HB THR 45 HB THR 45 9.800 -2.519 -1.688
335 HG1 THR 45 1HG THR 45 11.710 -3.759 -1.579
336 1HG2 THR 45 1HG2 THR 45 8.852 -3.387 0.404
337 2HG2 THR 45 2HG2 THR 45 9.629 -4.966 0.096
338 3HG2 THR 45 3HG2 THR 45 10.623 -3.525 0.443
339 H VAL 46 H VAL 46 6.848 -3.243 -0.491
340 HA VAL 46 HA VAL 46 5.989 -1.032 -2.277
341 HB VAL 46 HB VAL 46 4.253 -2.661 -2.496
342 1HG1 VAL 46 1HG1 VAL 46 4.634 -4.090 -0.520
343 2HG1 VAL 46 2HG1 VAL 46 4.125 -2.762 0.550
344 3HG1 VAL 46 3HG1 VAL 46 2.968 -3.522 -0.553
345 1HG2 VAL 46 1HG2 VAL 46 3.344 -0.545 -0.504
346 2HG2 VAL 46 2HG2 VAL 46 3.503 -0.349 -2.268
347 3HG2 VAL 46 3HG2 VAL 46 2.337 -1.510 -1.591
348 H ASN 47 H ASN 47 5.645 0.985 -1.224
349 HA ASN 47 HA ASN 47 6.236 1.003 1.674
350 1HB ASN 47 2HB ASN 47 7.502 2.634 -0.580
351 2HB ASN 47 3HB ASN 47 7.481 3.194 1.094
352 1HD2 ASN 47 1HD2 ASN 47 8.324 1.528 2.766
353 2HD2 ASN 47 2HD2 ASN 47 9.883 0.868 2.299
354 H VAL 48 H VAL 48 5.030 2.614 2.807
355 HA VAL 48 HA VAL 48 3.178 4.250 1.218
356 HB VAL 48 HB VAL 48 1.919 2.245 1.509
357 1HG1 VAL 48 1HG1 VAL 48 2.620 2.351 4.464
358 2HG1 VAL 48 2HG1 VAL 48 1.358 1.330 3.751
359 3HG1 VAL 48 3HG1 VAL 48 3.048 1.098 3.291
360 1HG2 VAL 48 1HG2 VAL 48 0.038 3.134 2.884
361 2HG2 VAL 48 2HG2 VAL 48 1.064 4.479 3.394
362 3HG2 VAL 48 3HG2 VAL 48 0.675 4.276 1.686
363 H ILE 49 H ILE 49 3.035 6.204 2.067
364 HA ILE 49 HA ILE 49 4.622 6.731 4.472
365 HB ILE 49 HB ILE 49 3.878 8.699 2.282
366 1HG1 ILE 49 2HG1 ILE 49 4.996 6.934 1.107
367 2HG1 ILE 49 3HG1 ILE 49 6.022 8.350 1.203
368 1HG2 ILE 49 1HG2 ILE 49 5.816 9.950 3.075
369 2HG2 ILE 49 2HG2 ILE 49 4.661 9.673 4.390
370 3HG2 ILE 49 3HG2 ILE 49 6.145 8.708 4.302
371 1HD1 ILE 49 1HD1 ILE 49 6.886 5.812 1.771
372 2HD1 ILE 49 2HD1 ILE 49 7.636 7.285 2.410
373 3HD1 ILE 49 3HD1 ILE 49 6.478 6.369 3.385
374 H TYR 50 H TYR 50 3.150 6.761 6.160
375 HA TYR 50 HA TYR 50 0.674 8.394 5.852
376 1HB TYR 50 2HB TYR 50 -0.749 6.687 6.644
377 2HB TYR 50 3HB TYR 50 0.086 6.095 5.245
378 HD1 TYR 50 HD1 TYR 50 1.593 4.120 5.460
379 HD2 TYR 50 HD2 TYR 50 -0.302 5.838 8.904
380 HE1 TYR 50 HE1 TYR 50 1.636 1.912 6.603
381 HE2 TYR 50 HE2 TYR 50 0.123 3.769 10.170
382 HH TYR 50 HH TYR 50 1.029 1.590 10.050
383 H ASP 51 H ASP 51 -0.458 8.671 7.790
384 HA ASP 51 HA ASP 51 1.325 9.341 10.021
385 1HB ASP 51 2HB ASP 51 -0.219 11.043 9.349
386 2HB ASP 51 3HB ASP 51 -1.589 9.938 9.479
387 HA PRO 52 HA PRO 52 0.038 5.345 11.735
388 1HB PRO 52 2HB PRO 52 1.841 5.071 13.727
389 2HB PRO 52 3HB PRO 52 2.294 4.942 12.003
390 1HG PRO 52 2HG PRO 52 2.484 7.407 13.769
391 2HG PRO 52 3HG PRO 52 3.787 6.677 12.786
392 1HD PRO 52 2HD PRO 52 2.289 8.741 11.876
393 2HD PRO 52 3HD PRO 52 2.783 7.422 10.767
394 H ALA 53 H ALA 53 -0.602 8.461 12.976
395 HA ALA 53 HA ALA 53 -1.849 7.432 15.455
396 1HB ALA 53 1HB ALA 53 -0.649 9.632 15.450
397 2HB ALA 53 2HB ALA 53 -1.808 10.221 14.238
398 3HB ALA 53 3HB ALA 53 -2.377 9.755 15.849
399 H GLU 54 H GLU 54 -2.458 8.229 12.055
400 HA GLU 54 HA GLU 54 -5.349 8.438 12.597
401 1HB GLU 54 2HB GLU 54 -4.129 10.343 11.495
402 2HB GLU 54 3HB GLU 54 -3.920 9.324 10.074
403 1HG GLU 54 2HG GLU 54 -6.399 9.128 9.866
404 2HG GLU 54 3HG GLU 54 -6.601 10.016 11.385
405 H THR 55 H THR 55 -3.022 6.983 10.376
406 HA THR 55 HA THR 55 -4.738 4.588 10.183
407 HB THR 55 HB THR 55 -3.191 3.971 8.118
408 HG1 THR 55 1HG THR 55 -3.093 6.769 8.296
409 1HG2 THR 55 1HG2 THR 55 -4.890 5.003 6.680
410 2HG2 THR 55 2HG2 THR 55 -5.561 4.123 8.076
411 3HG2 THR 55 3HG2 THR 55 -5.528 5.910 8.081
412 H GLY 56 H GLY 56 -2.951 2.735 9.630
413 1HA GLY 56 2HA GLY 56 -0.890 2.059 11.296
414 2HA GLY 56 3HA GLY 56 -2.257 2.331 12.396
415 H THR 57 H THR 57 -1.211 0.684 9.742
416 HA THR 57 HA THR 57 -1.785 -0.241 7.997
417 HB THR 57 HB THR 57 -1.786 -2.767 8.269
418 HG1 THR 57 1HG THR 57 -1.714 -2.057 11.006
419 1HG2 THR 57 1HG2 THR 57 0.363 -1.530 8.139
420 2HG2 THR 57 2HG2 THR 57 0.344 -1.317 9.903
421 3HG2 THR 57 3HG2 THR 57 0.453 -2.944 9.208
422 H ALA 58 H ALA 58 -4.241 -0.824 10.405
423 HA ALA 58 HA ALA 58 -6.299 -2.042 9.488
424 1HB ALA 58 1HB ALA 58 -6.157 0.874 10.352
425 2HB ALA 58 2HB ALA 58 -7.677 -0.068 10.357
426 3HB ALA 58 3HB ALA 58 -6.318 -0.531 11.414
427 H ALA 59 H ALA 59 -5.504 1.131 7.981
428 HA ALA 59 HA ALA 59 -8.079 0.867 6.471
429 1HB ALA 59 1HB ALA 59 -7.380 3.112 7.170
430 2HB ALA 59 2HB ALA 59 -5.922 2.962 6.128
431 3HB ALA 59 3HB ALA 59 -7.543 2.961 5.407
432 H ILE 60 H ILE 60 -4.651 0.852 5.950
433 HA ILE 60 HA ILE 60 -4.495 0.434 3.177
434 HB ILE 60 HB ILE 60 -2.754 0.114 5.620
435 1HG1 ILE 60 2HG1 ILE 60 -1.878 1.428 3.146
436 2HG1 ILE 60 3HG1 ILE 60 -3.355 2.119 3.774
437 1HG2 ILE 60 1HG2 ILE 60 -1.950 -1.039 2.937
438 2HG2 ILE 60 2HG2 ILE 60 -0.816 -0.533 4.217
439 3HG2 ILE 60 3HG2 ILE 60 -1.975 -1.829 4.517
440 1HD1 ILE 60 1HD1 ILE 60 -1.459 3.331 4.716
441 2HD1 ILE 60 2HD1 ILE 60 -2.348 2.478 5.987
442 3HD1 ILE 60 3HD1 ILE 60 -0.801 1.820 5.396
443 H GLN 61 H GLN 61 -4.621 -2.063 5.811
444 HA GLN 61 HA GLN 61 -4.365 -4.174 3.856
445 1HB GLN 61 2HB GLN 61 -4.787 -4.046 6.741
446 2HB GLN 61 3HB GLN 61 -5.825 -5.238 5.946
447 1HG GLN 61 2HG GLN 61 -4.026 -6.522 6.472
448 2HG GLN 61 3HG GLN 61 -3.752 -6.162 4.769
449 1HE2 GLN 61 1HE2 GLN 61 -2.942 -3.288 5.678
450 2HE2 GLN 61 2HE2 GLN 61 -1.341 -3.492 6.348
451 H GLU 62 H GLU 62 -7.181 -2.597 5.450
452 HA GLU 62 HA GLU 62 -9.310 -4.104 4.415
453 1HB GLU 62 2HB GLU 62 -8.862 -1.418 5.560
454 2HB GLU 62 3HB GLU 62 -10.061 -1.335 4.293
455 1HG GLU 62 2HG GLU 62 -10.236 -3.419 6.499
456 2HG GLU 62 3HG GLU 62 -10.873 -1.780 6.673
457 H LYS 63 H LYS 63 -7.798 -1.165 3.002
458 HA LYS 63 HA LYS 63 -9.294 -1.374 0.618
459 1HB LYS 63 2HB LYS 63 -6.980 0.255 1.660
460 2HB LYS 63 3HB LYS 63 -7.518 0.414 0.021
461 1HG LYS 63 2HG LYS 63 -9.487 0.540 2.377
462 2HG LYS 63 3HG LYS 63 -8.532 1.919 1.915
463 1HD LYS 63 2HD LYS 63 -10.638 2.240 0.975
464 2HD LYS 63 3HD LYS 63 -9.534 1.911 -0.366
465 1HE LYS 63 2HE LYS 63 -10.523 -0.235 -0.741
466 2HE LYS 63 3HE LYS 63 -11.280 -0.266 0.878
467 1HZ LYS 63 1HZ LYS 63 -12.049 1.507 -1.337
468 2HZ LYS 63 2HZ LYS 63 -12.861 0.168 -0.831
469 3HZ LYS 63 3HZ LYS 63 -12.741 1.469 0.161
470 H ILE 64 H ILE 64 -6.089 -2.514 1.486
471 HA ILE 64 HA ILE 64 -4.961 -3.037 -0.989
472 HB ILE 64 HB ILE 64 -4.701 -3.959 1.760
473 1HG1 ILE 64 2HG1 ILE 64 -3.337 -2.190 0.652
474 2HG1 ILE 64 3HG1 ILE 64 -2.440 -3.464 1.461
475 1HG2 ILE 64 1HG2 ILE 64 -3.151 -5.802 1.264
476 2HG2 ILE 64 2HG2 ILE 64 -4.873 -6.144 1.109
477 3HG2 ILE 64 3HG2 ILE 64 -3.891 -5.888 -0.357
478 1HD1 ILE 64 1HD1 ILE 64 -1.368 -2.998 -0.609
479 2HD1 ILE 64 2HD1 ILE 64 -2.127 -4.601 -0.735
480 3HD1 ILE 64 3HD1 ILE 64 -2.874 -3.205 -1.531
481 H GLU 65 H GLU 65 -7.027 -5.068 1.154
482 HA GLU 65 HA GLU 65 -7.590 -7.189 -0.652
483 1HB GLU 65 2HB GLU 65 -8.848 -6.082 1.875
484 2HB GLU 65 3HB GLU 65 -9.698 -7.326 0.966
485 1HG GLU 65 2HG GLU 65 -6.785 -7.667 1.696
486 2HG GLU 65 3HG GLU 65 -8.071 -8.063 2.825
487 H LYS 66 H LYS 66 -9.643 -4.343 0.191
488 HA LYS 66 HA LYS 66 -11.652 -5.005 -1.641
489 1HB LYS 66 2HB LYS 66 -10.949 -2.674 -0.015
490 2HB LYS 66 3HB LYS 66 -11.737 -2.190 -1.514
491 1HG LYS 66 2HG LYS 66 -12.820 -4.294 0.419
492 2HG LYS 66 3HG LYS 66 -13.261 -2.595 0.460
493 1HD LYS 66 2HD LYS 66 -14.854 -2.946 -1.088
494 2HD LYS 66 3HD LYS 66 -13.590 -3.325 -2.265
495 1HE LYS 66 2HE LYS 66 -13.681 -5.758 -1.315
496 2HE LYS 66 3HE LYS 66 -15.153 -5.248 -0.488
497 1HZ LYS 66 1HZ LYS 66 -15.592 -6.284 -2.601
498 2HZ LYS 66 2HZ LYS 66 -16.070 -4.712 -2.665
499 3HZ LYS 66 3HZ LYS 66 -14.670 -5.183 -3.399
500 H LEU 67 H LEU 67 -8.674 -3.301 -2.335
501 HA LEU 67 HA LEU 67 -9.338 -2.551 -5.059
502 1HB LEU 67 2HB LEU 67 -6.800 -2.674 -3.408
503 2HB LEU 67 3HB LEU 67 -6.762 -2.299 -5.123
504 HG LEU 67 HG LEU 67 -8.652 -0.716 -3.374
505 1HD1 LEU 67 1HD1 LEU 67 -6.724 -0.370 -2.076
506 2HD1 LEU 67 2HD1 LEU 67 -5.645 -0.441 -3.454
507 3HD1 LEU 67 3HD1 LEU 67 -6.684 0.980 -3.211
508 1HD2 LEU 67 1HD2 LEU 67 -7.002 -0.046 -5.859
509 2HD2 LEU 67 2HD2 LEU 67 -8.723 -0.468 -5.851
510 3HD2 LEU 67 3HD2 LEU 67 -8.176 1.020 -5.065
511 H GLY 68 H GLY 68 -8.402 -5.514 -3.509
512 1HA GLY 68 2HA GLY 68 -8.573 -7.585 -4.500
513 2HA GLY 68 3HA GLY 68 -8.357 -6.892 -6.110
514 H TYR 69 H TYR 69 -6.338 -6.578 -3.098
515 HA TYR 69 HA TYR 69 -4.090 -8.013 -4.438
516 1HB TYR 69 2HB TYR 69 -4.369 -5.152 -3.950
517 2HB TYR 69 3HB TYR 69 -3.064 -5.792 -2.977
518 HD1 TYR 69 HD1 TYR 69 -4.411 -5.727 -6.469
519 HD2 TYR 69 HD2 TYR 69 -0.990 -6.474 -3.958
520 HE1 TYR 69 HE1 TYR 69 -2.959 -5.584 -8.425
521 HE2 TYR 69 HE2 TYR 69 0.483 -6.191 -5.912
522 HH TYR 69 HH TYR 69 -0.698 -5.523 -9.192
523 H HIS 70 H HIS 70 -2.257 -8.329 -2.748
524 HA HIS 70 HA HIS 70 -3.092 -8.098 0.035
525 1HB HIS 70 2HB HIS 70 -3.805 -10.432 -1.124
526 2HB HIS 70 3HB HIS 70 -2.152 -10.846 -0.688
527 HD1 HIS 70 1HD HIS 70 -5.510 -11.156 0.710
528 HD2 HIS 70 2HD HIS 70 -1.890 -9.675 2.210
529 HE1 HIS 70 1HE HIS 70 -5.585 -11.468 3.197
530 H VAL 71 H VAL 71 -1.316 -7.417 1.204
531 HA VAL 71 HA VAL 71 1.348 -7.534 -0.005
532 HB VAL 71 HB VAL 71 1.938 -6.217 2.009
533 1HG1 VAL 71 1HG1 VAL 71 0.936 -4.136 1.245
534 2HG1 VAL 71 2HG1 VAL 71 1.320 -5.162 -0.154
535 3HG1 VAL 71 3HG1 VAL 71 -0.348 -5.042 0.429
536 1HG2 VAL 71 1HG2 VAL 71 -1.038 -6.063 2.623
537 2HG2 VAL 71 2HG2 VAL 71 0.162 -6.964 3.575
538 3HG2 VAL 71 3HG2 VAL 71 0.273 -5.203 3.433
539 H VAL 72 H VAL 72 3.181 -8.266 1.490
540 HA VAL 72 HA VAL 72 2.299 -10.503 3.272
541 HB VAL 72 HB VAL 72 4.800 -10.838 1.748
542 1HG1 VAL 72 1HG1 VAL 72 2.750 -12.783 2.846
543 2HG1 VAL 72 2HG1 VAL 72 4.307 -13.200 2.104
544 3HG1 VAL 72 3HG1 VAL 72 4.275 -12.316 3.635
545 1HG2 VAL 72 1HG2 VAL 72 3.575 -12.184 0.039
546 2HG2 VAL 72 2HG2 VAL 72 2.038 -11.564 0.677
547 3HG2 VAL 72 3HG2 VAL 72 3.204 -10.463 -0.094
548 H ILE 73 H ILE 73 3.300 -10.622 5.184
549 HA ILE 73 HA ILE 73 4.943 -8.268 5.890
550 HB ILE 73 HB ILE 73 3.482 -10.051 7.809
551 1HG1 ILE 73 2HG1 ILE 73 1.754 -9.325 6.295
552 2HG1 ILE 73 3HG1 ILE 73 1.708 -8.431 7.806
553 1HG2 ILE 73 1HG2 ILE 73 5.221 -8.552 8.713
554 2HG2 ILE 73 2HG2 ILE 73 4.526 -7.174 7.851
555 3HG2 ILE 73 3HG2 ILE 73 3.616 -7.956 9.166
556 1HD1 ILE 73 1HD1 ILE 73 2.822 -7.307 5.213
557 2HD1 ILE 73 2HD1 ILE 73 1.225 -6.990 5.905
558 3HD1 ILE 73 3HD1 ILE 73 2.670 -6.452 6.770
559 H GLU 74 H GLU 74 6.797 -9.577 4.823
560 HA GLU 74 HA GLU 74 7.696 -11.915 6.028
561 1HB GLU 74 2HB GLU 74 8.741 -9.986 3.988
562 2HB GLU 74 3HB GLU 74 9.809 -11.219 4.647
563 1HG GLU 74 2HG GLU 74 7.104 -12.004 3.517
564 2HG GLU 74 3HG GLU 74 8.552 -11.857 2.505
565 H GLY 75 H GLY 75 7.713 -9.124 7.506
566 1HA GLY 75 2HA GLY 75 8.813 -8.311 9.411
567 2HA GLY 75 3HA GLY 75 9.821 -9.769 9.409
568 H ARG 76 H ARG 76 9.438 -6.467 8.073
569 HA ARG 76 HA ARG 76 12.237 -6.357 7.269
570 1HB ARG 76 2HB ARG 76 10.231 -6.923 5.397
571 2HB ARG 76 3HB ARG 76 10.285 -5.164 5.343
572 1HG ARG 76 2HG ARG 76 12.705 -7.011 5.051
573 2HG ARG 76 3HG ARG 76 11.735 -6.419 3.692
574 1HD ARG 76 2HD ARG 76 12.239 -4.096 4.310
575 2HD ARG 76 3HD ARG 76 13.286 -4.651 5.632
576 HE ARG 76 HE ARG 76 14.355 -6.014 3.584
577 1HH1 ARG 76 2HH2 ARG 76 13.630 -2.592 3.960
578 2HH1 ARG 76 1HH2 ARG 76 14.749 -2.041 2.748
579 1HH2 ARG 76 2HH1 ARG 76 15.897 -5.343 2.015
580 2HH2 ARG 76 1HH1 ARG 76 16.117 -3.663 1.651
Start of MODEL 25
1 1H MET 1 H1 MET 1 2.587 17.606 12.615
2 2H MET 1 H2 MET 1 4.171 17.374 13.030
3 3H MET 1 H3 MET 1 3.064 16.147 13.155
4 HA MET 1 HA MET 1 3.698 17.177 15.290
5 1HB MET 1 2HB MET 1 2.209 19.499 13.993
6 2HB MET 1 3HB MET 1 2.256 19.273 15.748
7 1HG MET 1 2HG MET 1 4.711 19.296 15.724
8 2HG MET 1 3HG MET 1 4.698 19.630 13.982
9 1HE MET 1 1HE MET 1 5.870 22.971 15.771
10 2HE MET 1 2HE MET 1 6.158 21.321 16.366
11 3HE MET 1 3HE MET 1 6.341 21.687 14.630
12 H LEU 2 H LEU 2 0.418 18.304 14.413
13 HA LEU 2 HA LEU 2 -0.892 16.679 16.242
14 1HB LEU 2 2HB LEU 2 -2.936 17.218 15.035
15 2HB LEU 2 3HB LEU 2 -1.878 18.608 15.227
16 HG LEU 2 HG LEU 2 -1.083 17.750 12.727
17 1HD1 LEU 2 1HD1 LEU 2 -3.077 17.190 11.430
18 2HD1 LEU 2 2HD1 LEU 2 -2.870 15.971 12.695
19 3HD1 LEU 2 3HD1 LEU 2 -4.088 17.244 12.886
20 1HD2 LEU 2 1HD2 LEU 2 -1.663 20.047 13.346
21 2HD2 LEU 2 2HD2 LEU 2 -2.484 19.569 11.850
22 3HD2 LEU 2 3HD2 LEU 2 -3.389 19.620 13.378
23 H SER 3 H SER 3 0.077 15.916 12.947
24 HA SER 3 HA SER 3 -0.354 13.029 13.460
25 1HB SER 3 2HB SER 3 -0.408 14.656 10.861
26 2HB SER 3 3HB SER 3 -0.137 12.909 10.900
27 HG SER 3 HG SER 3 -2.070 12.584 11.819
28 H GLU 4 H GLU 4 1.506 11.823 13.112
29 HA GLU 4 HA GLU 4 4.050 13.160 12.388
30 1HB GLU 4 2HB GLU 4 3.314 10.725 13.914
31 2HB GLU 4 3HB GLU 4 4.725 10.608 12.896
32 1HG GLU 4 2HG GLU 4 5.393 12.835 14.055
33 2HG GLU 4 3HG GLU 4 4.237 12.302 15.273
34 H GLN 5 H GLN 5 5.289 11.372 10.902
35 HA GLN 5 HA GLN 5 3.451 9.964 9.076
36 1HB GLN 5 2HB GLN 5 5.882 11.649 8.412
37 2HB GLN 5 3HB GLN 5 5.172 10.556 7.245
38 1HG GLN 5 2HG GLN 5 3.578 12.826 8.576
39 2HG GLN 5 3HG GLN 5 4.578 13.055 7.169
40 1HE2 GLN 5 1HE2 GLN 5 3.330 9.908 6.821
41 2HE2 GLN 5 2HE2 GLN 5 1.966 10.349 5.821
42 H LYS 6 H LYS 6 4.365 7.924 8.537
43 HA LYS 6 HA LYS 6 7.194 7.563 8.797
44 1HB LYS 6 2HB LYS 6 5.373 5.676 10.337
45 2HB LYS 6 3HB LYS 6 7.047 5.329 9.881
46 1HG LYS 6 2HG LYS 6 7.668 7.569 10.984
47 2HG LYS 6 3HG LYS 6 6.084 7.492 11.778
48 1HD LYS 6 2HD LYS 6 6.757 5.309 12.790
49 2HD LYS 6 3HD LYS 6 8.299 5.397 11.898
50 1HE LYS 6 2HE LYS 6 8.735 7.648 13.035
51 2HE LYS 6 3HE LYS 6 7.313 7.356 14.045
52 1HZ LYS 6 1HZ LYS 6 8.428 5.374 14.868
53 2HZ LYS 6 2HZ LYS 6 9.741 5.687 13.917
54 3HZ LYS 6 3HZ LYS 6 9.333 6.726 15.125
55 H GLU 7 H GLU 7 8.022 5.839 7.735
56 HA GLU 7 HA GLU 7 6.617 5.357 5.201
57 1HB GLU 7 2HB GLU 7 9.605 5.124 5.655
58 2HB GLU 7 3HB GLU 7 8.669 5.509 4.215
59 1HG GLU 7 2HG GLU 7 9.658 7.529 4.772
60 2HG GLU 7 3HG GLU 7 8.097 7.737 5.580
61 H ILE 8 H ILE 8 5.591 3.353 5.637
62 HA ILE 8 HA ILE 8 7.081 1.275 7.041
63 HB ILE 8 HB ILE 8 4.434 1.127 5.726
64 1HG1 ILE 8 2HG1 ILE 8 4.050 3.067 6.961
65 2HG1 ILE 8 3HG1 ILE 8 3.346 1.693 7.826
66 1HG2 ILE 8 1HG2 ILE 8 5.723 -0.246 8.050
67 2HG2 ILE 8 2HG2 ILE 8 4.000 -0.454 7.617
68 3HG2 ILE 8 3HG2 ILE 8 5.266 -0.964 6.485
69 1HD1 ILE 8 1HD1 ILE 8 5.988 2.950 8.455
70 2HD1 ILE 8 2HD1 ILE 8 4.462 3.158 9.361
71 3HD1 ILE 8 3HD1 ILE 8 5.249 1.555 9.278
72 H ALA 9 H ALA 9 7.300 -0.910 5.941
73 HA ALA 9 HA ALA 9 7.736 -0.754 2.995
74 1HB ALA 9 1HB ALA 9 9.987 -1.744 3.381
75 2HB ALA 9 2HB ALA 9 9.851 -0.126 4.105
76 3HB ALA 9 3HB ALA 9 9.750 -1.551 5.136
77 H MET 10 H MET 10 6.610 -2.494 2.165
78 HA MET 10 HA MET 10 6.615 -5.083 3.674
79 1HB MET 10 2HB MET 10 4.190 -3.519 2.717
80 2HB MET 10 3HB MET 10 4.136 -5.226 3.162
81 1HG MET 10 2HG MET 10 4.795 -4.775 5.418
82 2HG MET 10 3HG MET 10 5.075 -3.067 5.088
83 1HE MET 10 1HE MET 10 1.561 -1.533 4.798
84 2HE MET 10 2HE MET 10 3.312 -1.234 4.844
85 3HE MET 10 3HE MET 10 2.582 -2.053 3.441
86 H GLN 11 H GLN 11 5.436 -6.775 2.252
87 HA GLN 11 HA GLN 11 6.452 -6.641 -0.562
88 1HB GLN 11 2HB GLN 11 6.540 -8.686 1.534
89 2HB GLN 11 3HB GLN 11 5.602 -9.279 0.173
90 1HG GLN 11 2HG GLN 11 8.267 -8.043 -0.472
91 2HG GLN 11 3HG GLN 11 8.227 -9.600 0.355
92 1HE2 GLN 11 1HE2 GLN 11 7.460 -7.997 -2.668
93 2HE2 GLN 11 2HE2 GLN 11 7.022 -9.449 -3.569
94 H VAL 12 H VAL 12 4.900 -7.905 -2.120
95 HA VAL 12 HA VAL 12 2.084 -7.806 -1.230
96 HB VAL 12 HB VAL 12 1.503 -6.999 -3.477
97 1HG1 VAL 12 1HG1 VAL 12 1.593 -5.418 -1.556
98 2HG1 VAL 12 2HG1 VAL 12 3.275 -5.034 -1.982
99 3HG1 VAL 12 3HG1 VAL 12 1.963 -4.631 -3.103
100 1HG2 VAL 12 1HG2 VAL 12 4.420 -6.250 -3.809
101 2HG2 VAL 12 2HG2 VAL 12 3.622 -7.605 -4.648
102 3HG2 VAL 12 3HG2 VAL 12 3.073 -5.943 -4.929
103 H SER 13 H SER 13 0.708 -9.019 -2.907
104 HA SER 13 HA SER 13 2.118 -11.096 -4.419
105 1HB SER 13 2HB SER 13 0.285 -11.700 -2.051
106 2HB SER 13 3HB SER 13 0.720 -12.899 -3.284
107 HG SER 13 HG SER 13 2.901 -11.579 -2.270
108 H GLY 14 H GLY 14 0.281 -12.477 -5.545
109 1HA GLY 14 2HA GLY 14 -1.770 -12.598 -6.615
110 2HA GLY 14 3HA GLY 14 -2.264 -11.049 -5.927
111 H MET 15 H MET 15 0.089 -9.573 -6.814
112 HA MET 15 HA MET 15 -0.696 -8.543 -9.205
113 1HB MET 15 2HB MET 15 1.439 -7.433 -9.318
114 2HB MET 15 3HB MET 15 0.991 -7.620 -7.619
115 1HG MET 15 2HG MET 15 3.168 -8.172 -7.489
116 2HG MET 15 3HG MET 15 2.491 -9.784 -7.723
117 1HE MET 15 1HE MET 15 5.567 -8.974 -8.004
118 2HE MET 15 2HE MET 15 4.941 -10.622 -8.240
119 3HE MET 15 3HE MET 15 6.005 -9.891 -9.462
120 H THR 16 H THR 16 -0.356 -8.802 -11.371
121 HA THR 16 HA THR 16 1.091 -11.227 -12.335
122 HB THR 16 HB THR 16 -0.220 -10.400 -14.495
123 HG1 THR 16 1HG THR 16 -2.062 -9.632 -12.511
124 1HG2 THR 16 1HG2 THR 16 -2.110 -11.870 -13.859
125 2HG2 THR 16 2HG2 THR 16 -0.544 -12.585 -13.440
126 3HG2 THR 16 3HG2 THR 16 -1.549 -11.861 -12.168
127 H CYS 17 H CYS 17 0.691 -7.664 -12.885
128 HA CYS 17 HA CYS 17 3.378 -7.658 -14.156
129 1HB CYS 17 2HB CYS 17 2.559 -6.245 -15.910
130 2HB CYS 17 3HB CYS 17 1.510 -7.668 -15.848
131 H ALA 18 H ALA 18 4.349 -5.544 -14.232
132 HA ALA 18 HA ALA 18 4.146 -4.156 -11.678
133 1HB ALA 18 1HB ALA 18 6.320 -4.650 -12.727
134 2HB ALA 18 2HB ALA 18 5.885 -3.641 -14.126
135 3HB ALA 18 3HB ALA 18 6.087 -2.902 -12.522
136 H ALA 19 H ALA 19 1.731 -3.818 -12.615
137 HA ALA 19 HA ALA 19 1.624 -0.905 -13.205
138 1HB ALA 19 1HB ALA 19 -0.039 -2.920 -14.774
139 2HB ALA 19 2HB ALA 19 -0.107 -1.155 -14.889
140 3HB ALA 19 3HB ALA 19 1.352 -2.018 -15.411
141 H CYS 20 H CYS 20 -0.519 -3.775 -12.691
142 HA CYS 20 HA CYS 20 -2.588 -2.389 -11.531
143 1HB CYS 20 2HB CYS 20 -1.677 -5.217 -10.760
144 2HB CYS 20 3HB CYS 20 -3.305 -4.546 -10.574
145 H ALA 21 H ALA 21 0.214 -3.739 -9.851
146 HA ALA 21 HA ALA 21 -0.456 -3.187 -7.204
147 1HB ALA 21 1HB ALA 21 2.305 -3.020 -8.463
148 2HB ALA 21 2HB ALA 21 1.928 -3.319 -6.749
149 3HB ALA 21 3HB ALA 21 1.496 -4.524 -7.971
150 H ALA 22 H ALA 22 0.310 -0.838 -9.707
151 HA ALA 22 HA ALA 22 1.016 1.334 -7.893
152 1HB ALA 22 1HB ALA 22 -0.072 1.419 -10.738
153 2HB ALA 22 2HB ALA 22 0.754 2.723 -9.867
154 3HB ALA 22 3HB ALA 22 1.653 1.260 -10.331
155 H ARG 23 H ARG 23 -1.938 0.063 -9.489
156 HA ARG 23 HA ARG 23 -3.515 2.414 -9.020
157 1HB ARG 23 2HB ARG 23 -4.452 -0.469 -9.412
158 2HB ARG 23 3HB ARG 23 -5.432 0.999 -9.506
159 1HG ARG 23 2HG ARG 23 -3.738 1.770 -11.342
160 2HG ARG 23 3HG ARG 23 -3.194 0.088 -11.359
161 1HD ARG 23 2HD ARG 23 -4.880 0.315 -13.105
162 2HD ARG 23 3HD ARG 23 -5.534 -0.657 -11.800
163 HE ARG 23 HE ARG 23 -7.142 0.904 -11.387
164 1HH1 ARG 23 2HH2 ARG 23 -4.621 2.423 -13.309
165 2HH1 ARG 23 1HH2 ARG 23 -5.444 3.938 -13.524
166 1HH2 ARG 23 2HH1 ARG 23 -8.268 2.920 -11.591
167 2HH2 ARG 23 1HH1 ARG 23 -7.575 4.220 -12.503
168 H ILE 24 H ILE 24 -3.196 -0.699 -7.296
169 HA ILE 24 HA ILE 24 -5.032 -0.095 -5.268
170 HB ILE 24 HB ILE 24 -4.157 -1.841 -3.964
171 1HG1 ILE 24 2HG1 ILE 24 -1.721 -1.550 -5.654
172 2HG1 ILE 24 3HG1 ILE 24 -1.858 -1.372 -3.883
173 1HG2 ILE 24 1HG2 ILE 24 -4.467 -3.605 -5.477
174 2HG2 ILE 24 2HG2 ILE 24 -5.281 -2.267 -6.288
175 3HG2 ILE 24 3HG2 ILE 24 -3.668 -2.761 -6.821
176 1HD1 ILE 24 1HD1 ILE 24 -2.006 -3.920 -5.476
177 2HD1 ILE 24 2HD1 ILE 24 -0.728 -3.440 -4.354
178 3HD1 ILE 24 3HD1 ILE 24 -2.352 -3.809 -3.726
179 H GLU 25 H GLU 25 -1.519 0.431 -5.307
180 HA GLU 25 HA GLU 25 -1.290 1.637 -2.834
181 1HB GLU 25 2HB GLU 25 0.504 0.996 -4.754
182 2HB GLU 25 3HB GLU 25 0.423 2.736 -5.015
183 1HG GLU 25 2HG GLU 25 0.634 2.754 -2.316
184 2HG GLU 25 3HG GLU 25 1.238 1.120 -2.555
185 H LYS 26 H LYS 26 -2.130 3.173 -5.939
186 HA LYS 26 HA LYS 26 -1.962 5.863 -4.781
187 1HB LYS 26 2HB LYS 26 -2.711 4.764 -7.475
188 2HB LYS 26 3HB LYS 26 -3.161 6.416 -7.033
189 1HG LYS 26 2HG LYS 26 -0.983 6.359 -8.200
190 2HG LYS 26 3HG LYS 26 -0.880 7.046 -6.576
191 1HD LYS 26 2HD LYS 26 0.019 4.864 -5.740
192 2HD LYS 26 3HD LYS 26 -0.007 4.261 -7.414
193 1HE LYS 26 2HE LYS 26 1.646 5.996 -8.029
194 2HE LYS 26 3HE LYS 26 1.593 6.638 -6.374
195 1HZ LYS 26 1HZ LYS 26 3.461 5.215 -6.589
196 2HZ LYS 26 2HZ LYS 26 2.411 4.433 -5.605
197 3HZ LYS 26 3HZ LYS 26 2.551 3.974 -7.161
198 H GLY 27 H GLY 27 -4.625 3.573 -5.484
199 1HA GLY 27 2HA GLY 27 -6.763 5.178 -4.455
200 2HA GLY 27 3HA GLY 27 -6.673 3.408 -4.444
201 H LEU 28 H LEU 28 -4.330 3.086 -2.906
202 HA LEU 28 HA LEU 28 -5.350 3.224 -0.233
203 1HB LEU 28 2HB LEU 28 -3.934 1.495 -1.179
204 2HB LEU 28 3HB LEU 28 -2.574 2.611 -1.273
205 HG LEU 28 HG LEU 28 -3.909 1.693 1.300
206 1HD1 LEU 28 1HD1 LEU 28 -1.875 0.262 1.482
207 2HD1 LEU 28 2HD1 LEU 28 -2.886 -0.171 0.098
208 3HD1 LEU 28 3HD1 LEU 28 -1.393 0.759 -0.148
209 1HD2 LEU 28 1HD2 LEU 28 -2.729 3.775 1.720
210 2HD2 LEU 28 2HD2 LEU 28 -1.593 2.507 2.161
211 3HD2 LEU 28 3HD2 LEU 28 -1.408 3.333 0.611
212 H LYS 29 H LYS 29 -2.853 5.168 -1.976
213 HA LYS 29 HA LYS 29 -2.161 6.889 0.105
214 1HB LYS 29 2HB LYS 29 -1.111 6.787 -2.204
215 2HB LYS 29 3HB LYS 29 -2.473 7.776 -2.772
216 1HG LYS 29 2HG LYS 29 -1.790 9.367 -0.739
217 2HG LYS 29 3HG LYS 29 -0.295 8.461 -0.779
218 1HD LYS 29 2HD LYS 29 -1.569 10.013 -3.102
219 2HD LYS 29 3HD LYS 29 -0.296 10.624 -2.039
220 1HE LYS 29 2HE LYS 29 1.108 8.598 -2.778
221 2HE LYS 29 3HE LYS 29 -0.081 8.323 -4.048
222 1HZ LYS 29 1HZ LYS 29 0.482 10.646 -4.793
223 2HZ LYS 29 2HZ LYS 29 1.624 10.667 -3.548
224 3HZ LYS 29 3HZ LYS 29 1.814 9.649 -4.750
225 H ARG 30 H ARG 30 -4.967 7.003 -2.060
226 HA ARG 30 HA ARG 30 -5.908 9.561 -1.214
227 1HB ARG 30 2HB ARG 30 -6.932 7.251 -2.806
228 2HB ARG 30 3HB ARG 30 -8.185 8.188 -2.045
229 1HG ARG 30 2HG ARG 30 -6.190 9.960 -3.295
230 2HG ARG 30 3HG ARG 30 -6.730 8.749 -4.438
231 1HD ARG 30 2HD ARG 30 -8.938 9.442 -4.424
232 2HD ARG 30 3HD ARG 30 -8.882 10.134 -2.814
233 HE ARG 30 HE ARG 30 -8.234 11.441 -5.323
234 1HH1 ARG 30 2HH2 ARG 30 -7.585 11.442 -1.857
235 2HH1 ARG 30 1HH2 ARG 30 -7.275 13.144 -1.733
236 1HH2 ARG 30 2HH1 ARG 30 -7.809 13.724 -5.218
237 2HH2 ARG 30 1HH1 ARG 30 -7.385 14.467 -3.712
238 H MET 31 H MET 31 -5.747 6.839 0.815
239 HA MET 31 HA MET 31 -8.306 7.341 2.131
240 1HB MET 31 2HB MET 31 -5.942 5.600 2.937
241 2HB MET 31 3HB MET 31 -7.556 5.517 3.632
242 1HG MET 31 2HG MET 31 -6.747 4.835 0.787
243 2HG MET 31 3HG MET 31 -7.282 3.759 2.054
244 1HE MET 31 1HE MET 31 -9.883 3.684 2.815
245 2HE MET 31 2HE MET 31 -9.972 5.440 3.073
246 3HE MET 31 3HE MET 31 -11.166 4.646 2.037
247 HA PRO 32 HA PRO 32 -6.984 10.397 5.001
248 1HB PRO 32 2HB PRO 32 -8.240 9.703 7.365
249 2HB PRO 32 3HB PRO 32 -9.073 10.421 5.957
250 1HG PRO 32 2HG PRO 32 -8.856 7.489 6.668
251 2HG PRO 32 3HG PRO 32 -10.333 8.399 6.228
252 1HD PRO 32 2HD PRO 32 -9.019 6.924 4.420
253 2HD PRO 32 3HD PRO 32 -9.654 8.520 3.931
254 H GLY 33 H GLY 33 -5.522 10.759 6.793
255 1HA GLY 33 2HA GLY 33 -3.738 10.314 8.093
256 2HA GLY 33 3HA GLY 33 -4.188 8.610 8.125
257 H VAL 34 H VAL 34 -4.045 8.628 4.977
258 HA VAL 34 HA VAL 34 -1.133 8.204 4.842
259 HB VAL 34 HB VAL 34 -3.209 7.695 2.701
260 1HG1 VAL 34 1HG1 VAL 34 -0.309 6.824 3.147
261 2HG1 VAL 34 2HG1 VAL 34 -1.374 6.050 1.979
262 3HG1 VAL 34 3HG1 VAL 34 -0.954 7.771 1.812
263 1HG2 VAL 34 1HG2 VAL 34 -3.859 6.354 4.632
264 2HG2 VAL 34 2HG2 VAL 34 -3.122 5.317 3.418
265 3HG2 VAL 34 3HG2 VAL 34 -2.192 5.788 4.852
266 H THR 35 H THR 35 0.257 9.439 3.570
267 HA THR 35 HA THR 35 -0.999 11.830 2.274
268 HB THR 35 HB THR 35 0.632 11.878 4.521
269 HG1 THR 35 1HG THR 35 -0.013 13.884 2.632
270 1HG2 THR 35 1HG2 THR 35 2.565 13.232 3.854
271 2HG2 THR 35 2HG2 THR 35 2.700 11.589 3.211
272 3HG2 THR 35 3HG2 THR 35 2.228 12.941 2.145
273 H ASP 36 H ASP 36 1.726 9.429 2.085
274 HA ASP 36 HA ASP 36 1.490 9.795 -0.764
275 1HB ASP 36 2HB ASP 36 3.569 11.237 0.471
276 2HB ASP 36 3HB ASP 36 4.359 9.783 -0.144
277 H ALA 37 H ALA 37 3.070 8.268 -1.880
278 HA ALA 37 HA ALA 37 3.612 5.808 -0.506
279 1HB ALA 37 1HB ALA 37 1.229 5.645 -2.401
280 2HB ALA 37 2HB ALA 37 1.883 4.387 -1.321
281 3HB ALA 37 3HB ALA 37 1.050 5.778 -0.637
282 H ASN 38 H ASN 38 4.378 4.043 -1.965
283 HA ASN 38 HA ASN 38 5.430 4.873 -4.506
284 1HB ASN 38 2HB ASN 38 7.851 4.433 -3.046
285 2HB ASN 38 3HB ASN 38 7.342 5.813 -3.995
286 1HD2 ASN 38 1HD2 ASN 38 6.231 4.621 -0.737
287 2HD2 ASN 38 2HD2 ASN 38 6.708 6.110 0.074
288 H VAL 39 H VAL 39 4.380 2.893 -4.963
289 HA VAL 39 HA VAL 39 5.151 0.471 -3.863
290 HB VAL 39 HB VAL 39 3.092 0.672 -4.960
291 1HG1 VAL 39 1HG1 VAL 39 3.042 2.102 -6.705
292 2HG1 VAL 39 2HG1 VAL 39 4.613 1.635 -7.364
293 3HG1 VAL 39 3HG1 VAL 39 3.200 0.609 -7.633
294 1HG2 VAL 39 1HG2 VAL 39 2.988 -1.313 -6.226
295 2HG2 VAL 39 2HG2 VAL 39 4.714 -1.250 -6.611
296 3HG2 VAL 39 3HG2 VAL 39 4.171 -1.528 -4.929
297 H ASN 40 H ASN 40 7.346 0.136 -3.699
298 HA ASN 40 HA ASN 40 9.142 0.472 -5.976
299 1HB ASN 40 2HB ASN 40 9.782 1.069 -3.673
300 2HB ASN 40 3HB ASN 40 9.584 -0.614 -3.171
301 1HD2 ASN 40 1HD2 ASN 40 11.883 -0.405 -2.477
302 2HD2 ASN 40 2HD2 ASN 40 13.143 -0.600 -3.681
303 H LEU 41 H LEU 41 7.451 -1.138 -6.988
304 HA LEU 41 HA LEU 41 7.813 -3.953 -6.498
305 1HB LEU 41 2HB LEU 41 6.185 -2.232 -8.210
306 2HB LEU 41 3HB LEU 41 6.809 -3.569 -9.148
307 HG LEU 41 HG LEU 41 4.562 -3.851 -8.041
308 1HD1 LEU 41 1HD1 LEU 41 6.712 -5.950 -7.603
309 2HD1 LEU 41 2HD1 LEU 41 4.962 -6.256 -7.542
310 3HD1 LEU 41 3HD1 LEU 41 5.718 -5.723 -9.054
311 1HD2 LEU 41 1HD2 LEU 41 4.277 -4.200 -5.792
312 2HD2 LEU 41 2HD2 LEU 41 5.916 -4.822 -5.540
313 3HD2 LEU 41 3HD2 LEU 41 5.648 -3.086 -5.695
314 H ALA 42 H ALA 42 9.639 -1.642 -8.274
315 HA ALA 42 HA ALA 42 11.117 -3.071 -10.115
316 1HB ALA 42 1HB ALA 42 11.500 -0.679 -9.506
317 2HB ALA 42 2HB ALA 42 12.220 -1.222 -7.964
318 3HB ALA 42 3HB ALA 42 13.002 -1.638 -9.497
319 H THR 43 H THR 43 11.353 -3.239 -6.539
320 HA THR 43 HA THR 43 12.773 -5.809 -6.894
321 HB THR 43 HB THR 43 14.515 -4.274 -6.305
322 HG1 THR 43 1HG THR 43 13.655 -5.932 -4.190
323 1HG2 THR 43 1HG2 THR 43 14.576 -3.042 -4.203
324 2HG2 THR 43 2HG2 THR 43 13.202 -2.493 -5.178
325 3HG2 THR 43 3HG2 THR 43 12.940 -3.577 -3.794
326 H GLU 44 H GLU 44 10.046 -5.460 -6.748
327 HA GLU 44 HA GLU 44 8.180 -6.104 -5.617
328 1HB GLU 44 2HB GLU 44 10.336 -8.158 -5.198
329 2HB GLU 44 3HB GLU 44 8.844 -8.364 -4.342
330 1HG GLU 44 2HG GLU 44 7.765 -7.871 -6.784
331 2HG GLU 44 3HG GLU 44 9.315 -8.563 -7.275
332 H THR 45 H THR 45 8.900 -3.956 -4.264
333 HA THR 45 HA THR 45 8.092 -4.669 -1.501
334 HB THR 45 HB THR 45 9.428 -2.236 -1.403
335 HG1 THR 45 1HG THR 45 10.320 -2.850 -3.531
336 1HG2 THR 45 1HG2 THR 45 10.558 -5.011 -0.825
337 2HG2 THR 45 2HG2 THR 45 11.194 -3.488 -0.165
338 3HG2 THR 45 3HG2 THR 45 9.572 -4.043 0.297
339 H VAL 46 H VAL 46 6.822 -2.974 -0.475
340 HA VAL 46 HA VAL 46 5.888 -0.796 -2.249
341 HB VAL 46 HB VAL 46 4.111 -2.431 -2.324
342 1HG1 VAL 46 1HG1 VAL 46 2.865 -3.139 -0.308
343 2HG1 VAL 46 2HG1 VAL 46 4.520 -3.751 -0.305
344 3HG1 VAL 46 3HG1 VAL 46 4.079 -2.366 0.721
345 1HG2 VAL 46 1HG2 VAL 46 3.508 -0.039 -2.191
346 2HG2 VAL 46 2HG2 VAL 46 2.260 -1.086 -1.498
347 3HG2 VAL 46 3HG2 VAL 46 3.343 -0.177 -0.429
348 H ASN 47 H ASN 47 5.926 1.203 -1.256
349 HA ASN 47 HA ASN 47 6.454 1.232 1.665
350 1HB ASN 47 2HB ASN 47 7.778 2.790 -0.595
351 2HB ASN 47 3HB ASN 47 7.699 3.441 1.040
352 1HD2 ASN 47 1HD2 ASN 47 8.441 1.850 2.844
353 2HD2 ASN 47 2HD2 ASN 47 10.039 1.220 2.491
354 H VAL 48 H VAL 48 5.055 2.660 2.806
355 HA VAL 48 HA VAL 48 3.310 4.406 1.173
356 HB VAL 48 HB VAL 48 2.322 2.547 3.352
357 1HG1 VAL 48 1HG1 VAL 48 1.232 4.898 3.034
358 2HG1 VAL 48 2HG1 VAL 48 0.693 4.288 1.468
359 3HG1 VAL 48 3HG1 VAL 48 0.187 3.486 2.977
360 1HG2 VAL 48 1HG2 VAL 48 0.968 1.505 1.539
361 2HG2 VAL 48 2HG2 VAL 48 1.909 2.421 0.343
362 3HG2 VAL 48 3HG2 VAL 48 2.704 1.212 1.373
363 H ILE 49 H ILE 49 3.215 6.366 2.082
364 HA ILE 49 HA ILE 49 4.710 6.765 4.565
365 HB ILE 49 HB ILE 49 4.030 8.865 2.463
366 1HG1 ILE 49 2HG1 ILE 49 5.243 7.224 1.215
367 2HG1 ILE 49 3HG1 ILE 49 6.250 8.632 1.518
368 1HG2 ILE 49 1HG2 ILE 49 4.663 9.782 4.600
369 2HG2 ILE 49 2HG2 ILE 49 6.096 8.749 4.691
370 3HG2 ILE 49 3HG2 ILE 49 5.992 10.025 3.458
371 1HD1 ILE 49 1HD1 ILE 49 7.380 7.405 3.375
372 2HD1 ILE 49 2HD1 ILE 49 6.442 5.953 2.952
373 3HD1 ILE 49 3HD1 ILE 49 7.598 6.641 1.802
374 H TYR 50 H TYR 50 3.163 6.768 6.226
375 HA TYR 50 HA TYR 50 0.786 8.536 5.959
376 1HB TYR 50 2HB TYR 50 -0.737 6.821 6.699
377 2HB TYR 50 3HB TYR 50 0.049 6.315 5.223
378 HD1 TYR 50 HD1 TYR 50 -0.222 5.724 8.853
379 HD2 TYR 50 HD2 TYR 50 1.504 4.346 5.165
380 HE1 TYR 50 HE1 TYR 50 0.435 3.577 9.910
381 HE2 TYR 50 HE2 TYR 50 1.685 2.078 6.097
382 HH TYR 50 HH TYR 50 1.162 0.704 7.914
383 H ASP 51 H ASP 51 -0.436 8.573 8.039
384 HA ASP 51 HA ASP 51 1.481 9.110 10.231
385 1HB ASP 51 2HB ASP 51 -0.146 10.823 9.748
386 2HB ASP 51 3HB ASP 51 -1.476 9.678 9.911
387 HA PRO 52 HA PRO 52 0.091 4.975 11.586
388 1HB PRO 52 2HB PRO 52 2.001 4.337 13.372
389 2HB PRO 52 3HB PRO 52 2.307 4.361 11.617
390 1HG PRO 52 2HG PRO 52 2.854 6.605 13.603
391 2HG PRO 52 3HG PRO 52 4.007 5.896 12.434
392 1HD PRO 52 2HD PRO 52 2.605 8.166 11.889
393 2HD PRO 52 3HD PRO 52 2.928 6.949 10.615
394 H ALA 53 H ALA 53 -0.278 7.987 13.104
395 HA ALA 53 HA ALA 53 -1.390 6.841 15.591
396 1HB ALA 53 1HB ALA 53 -1.452 9.666 14.472
397 2HB ALA 53 2HB ALA 53 -1.911 9.142 16.100
398 3HB ALA 53 3HB ALA 53 -0.209 9.056 15.591
399 H GLU 54 H GLU 54 -2.213 7.876 12.277
400 HA GLU 54 HA GLU 54 -5.053 7.948 13.042
401 1HB GLU 54 2HB GLU 54 -3.840 9.998 11.986
402 2HB GLU 54 3HB GLU 54 -4.055 9.134 10.459
403 1HG GLU 54 2HG GLU 54 -6.533 8.946 11.036
404 2HG GLU 54 3HG GLU 54 -6.209 9.935 12.471
405 H THR 55 H THR 55 -2.938 6.926 10.353
406 HA THR 55 HA THR 55 -4.607 4.558 10.016
407 HB THR 55 HB THR 55 -2.862 4.173 7.939
408 HG1 THR 55 1HG THR 55 -3.737 6.701 7.588
409 1HG2 THR 55 1HG2 THR 55 -5.558 5.643 8.038
410 2HG2 THR 55 2HG2 THR 55 -4.821 4.860 6.607
411 3HG2 THR 55 3HG2 THR 55 -5.304 3.873 8.007
412 H GLY 56 H GLY 56 -3.017 2.736 9.257
413 1HA GLY 56 2HA GLY 56 -0.835 1.985 10.854
414 2HA GLY 56 3HA GLY 56 -2.371 1.483 11.611
415 H THR 57 H THR 57 -2.454 -0.678 10.964
416 HA THR 57 HA THR 57 -1.881 -1.608 8.248
417 HB THR 57 HB THR 57 -2.691 -3.759 9.401
418 HG1 THR 57 1HG THR 57 -2.919 -3.582 11.651
419 1HG2 THR 57 1HG2 THR 57 -0.608 -3.968 10.763
420 2HG2 THR 57 2HG2 THR 57 -0.268 -3.150 9.227
421 3HG2 THR 57 3HG2 THR 57 -0.384 -2.207 10.722
422 H ALA 58 H ALA 58 -4.479 -0.991 10.527
423 HA ALA 58 HA ALA 58 -6.640 -2.112 9.644
424 1HB ALA 58 1HB ALA 58 -6.608 -0.593 11.553
425 2HB ALA 58 2HB ALA 58 -6.557 0.811 10.467
426 3HB ALA 58 3HB ALA 58 -7.991 -0.237 10.502
427 H ALA 59 H ALA 59 -5.736 0.996 8.166
428 HA ALA 59 HA ALA 59 -8.254 0.865 6.575
429 1HB ALA 59 1HB ALA 59 -7.654 2.957 5.591
430 2HB ALA 59 2HB ALA 59 -7.365 3.069 7.338
431 3HB ALA 59 3HB ALA 59 -5.997 2.839 6.196
432 H ILE 60 H ILE 60 -4.804 0.573 6.154
433 HA ILE 60 HA ILE 60 -4.678 0.172 3.372
434 HB ILE 60 HB ILE 60 -2.916 -0.417 5.785
435 1HG1 ILE 60 2HG1 ILE 60 -1.506 0.882 3.822
436 2HG1 ILE 60 3HG1 ILE 60 -3.113 1.479 3.495
437 1HG2 ILE 60 1HG2 ILE 60 -2.498 -2.403 4.484
438 2HG2 ILE 60 2HG2 ILE 60 -2.319 -1.440 2.998
439 3HG2 ILE 60 3HG2 ILE 60 -1.143 -1.289 4.328
440 1HD1 ILE 60 1HD1 ILE 60 -1.505 1.688 6.082
441 2HD1 ILE 60 2HD1 ILE 60 -1.973 3.008 5.007
442 3HD1 ILE 60 3HD1 ILE 60 -3.217 2.179 5.964
443 H GLN 61 H GLN 61 -4.941 -2.343 5.956
444 HA GLN 61 HA GLN 61 -4.997 -4.424 4.039
445 1HB GLN 61 2HB GLN 61 -5.267 -4.215 6.895
446 2HB GLN 61 3HB GLN 61 -6.594 -5.191 6.281
447 1HG GLN 61 2HG GLN 61 -5.270 -6.956 6.203
448 2HG GLN 61 3HG GLN 61 -4.312 -6.223 4.929
449 1HE2 GLN 61 1HE2 GLN 61 -2.867 -4.231 6.125
450 2HE2 GLN 61 2HE2 GLN 61 -1.855 -4.941 7.377
451 H GLU 62 H GLU 62 -7.669 -2.590 5.593
452 HA GLU 62 HA GLU 62 -9.883 -3.843 4.464
453 1HB GLU 62 2HB GLU 62 -9.265 -1.274 5.708
454 2HB GLU 62 3HB GLU 62 -10.323 -0.988 4.341
455 1HG GLU 62 2HG GLU 62 -10.892 -3.026 6.526
456 2HG GLU 62 3HG GLU 62 -11.508 -1.367 6.507
457 H LYS 63 H LYS 63 -8.069 -1.068 3.029
458 HA LYS 63 HA LYS 63 -9.552 -1.183 0.590
459 1HB LYS 63 2HB LYS 63 -7.134 0.259 1.685
460 2HB LYS 63 3HB LYS 63 -7.547 0.378 0.003
461 1HG LYS 63 2HG LYS 63 -9.464 1.028 2.306
462 2HG LYS 63 3HG LYS 63 -8.480 2.167 1.407
463 1HD LYS 63 2HD LYS 63 -10.378 2.503 0.258
464 2HD LYS 63 3HD LYS 63 -9.660 1.252 -0.734
465 1HE LYS 63 2HE LYS 63 -11.447 -0.090 -0.415
466 2HE LYS 63 3HE LYS 63 -11.306 -0.002 1.351
467 1HZ LYS 63 1HZ LYS 63 -13.400 0.785 0.605
468 2HZ LYS 63 2HZ LYS 63 -12.569 2.021 1.289
469 3HZ LYS 63 3HZ LYS 63 -12.714 1.933 -0.353
470 H ILE 64 H ILE 64 -6.417 -2.564 1.567
471 HA ILE 64 HA ILE 64 -5.331 -3.273 -0.836
472 HB ILE 64 HB ILE 64 -5.233 -4.153 1.940
473 1HG1 ILE 64 2HG1 ILE 64 -3.766 -2.436 0.765
474 2HG1 ILE 64 3HG1 ILE 64 -2.992 -3.645 1.785
475 1HG2 ILE 64 1HG2 ILE 64 -3.765 -6.057 1.528
476 2HG2 ILE 64 2HG2 ILE 64 -5.475 -6.326 1.220
477 3HG2 ILE 64 3HG2 ILE 64 -4.362 -6.080 -0.155
478 1HD1 ILE 64 1HD1 ILE 64 -2.332 -4.969 -0.140
479 2HD1 ILE 64 2HD1 ILE 64 -3.179 -3.861 -1.242
480 3HD1 ILE 64 3HD1 ILE 64 -1.764 -3.301 -0.318
481 H GLU 65 H GLU 65 -7.605 -5.027 1.368
482 HA GLU 65 HA GLU 65 -8.267 -7.240 -0.259
483 1HB GLU 65 2HB GLU 65 -9.649 -5.823 2.051
484 2HB GLU 65 3HB GLU 65 -10.379 -7.223 1.258
485 1HG GLU 65 2HG GLU 65 -7.523 -7.489 2.165
486 2HG GLU 65 3HG GLU 65 -8.804 -7.482 3.385
487 H LYS 66 H LYS 66 -10.195 -4.207 0.266
488 HA LYS 66 HA LYS 66 -12.226 -4.951 -1.575
489 1HB LYS 66 2HB LYS 66 -11.320 -2.339 -0.395
490 2HB LYS 66 3HB LYS 66 -12.390 -2.289 -1.800
491 1HG LYS 66 2HG LYS 66 -13.849 -2.200 0.007
492 2HG LYS 66 3HG LYS 66 -13.968 -3.851 -0.603
493 1HD LYS 66 2HD LYS 66 -12.308 -4.511 1.283
494 2HD LYS 66 3HD LYS 66 -12.399 -2.837 1.815
495 1HE LYS 66 2HE LYS 66 -13.905 -3.987 3.201
496 2HE LYS 66 3HE LYS 66 -14.918 -3.106 2.069
497 1HZ LYS 66 1HZ LYS 66 -15.130 -5.227 0.860
498 2HZ LYS 66 2HZ LYS 66 -14.160 -5.959 1.980
499 3HZ LYS 66 3HZ LYS 66 -15.623 -5.365 2.429
500 H LEU 67 H LEU 67 -9.144 -3.340 -2.228
501 HA LEU 67 HA LEU 67 -9.683 -2.821 -5.025
502 1HB LEU 67 2HB LEU 67 -7.196 -2.845 -3.293
503 2HB LEU 67 3HB LEU 67 -7.119 -2.568 -5.027
504 HG LEU 67 HG LEU 67 -9.060 -0.898 -3.421
505 1HD1 LEU 67 1HD1 LEU 67 -7.163 -0.497 -2.089
506 2HD1 LEU 67 2HD1 LEU 67 -6.055 -0.578 -3.443
507 3HD1 LEU 67 3HD1 LEU 67 -7.136 0.821 -3.262
508 1HD2 LEU 67 1HD2 LEU 67 -7.336 -0.343 -5.880
509 2HD2 LEU 67 2HD2 LEU 67 -9.052 -0.786 -5.910
510 3HD2 LEU 67 3HD2 LEU 67 -8.550 0.747 -5.184
511 H GLY 68 H GLY 68 -8.909 -5.701 -3.260
512 1HA GLY 68 2HA GLY 68 -9.051 -7.822 -4.104
513 2HA GLY 68 3HA GLY 68 -8.893 -7.221 -5.760
514 H TYR 69 H TYR 69 -6.781 -6.767 -2.850
515 HA TYR 69 HA TYR 69 -4.576 -8.254 -4.208
516 1HB TYR 69 2HB TYR 69 -4.821 -5.376 -3.742
517 2HB TYR 69 3HB TYR 69 -3.469 -6.023 -2.843
518 HD1 TYR 69 HD1 TYR 69 -1.463 -6.745 -3.943
519 HD2 TYR 69 HD2 TYR 69 -5.018 -5.931 -6.243
520 HE1 TYR 69 HE1 TYR 69 -0.109 -6.571 -5.960
521 HE2 TYR 69 HE2 TYR 69 -3.677 -5.849 -8.294
522 HH TYR 69 HH TYR 69 -0.099 -6.086 -8.252
523 H HIS 70 H HIS 70 -2.676 -8.422 -2.591
524 HA HIS 70 HA HIS 70 -3.504 -8.341 0.213
525 1HB HIS 70 2HB HIS 70 -3.844 -10.721 -0.870
526 2HB HIS 70 3HB HIS 70 -2.095 -10.855 -0.677
527 HD1 HIS 70 1HD HIS 70 -1.797 -9.570 2.270
528 HD2 HIS 70 2HD HIS 70 -4.868 -12.161 0.978
529 HE1 HIS 70 1HE HIS 70 -2.894 -10.507 4.355
530 H VAL 71 H VAL 71 -1.951 -7.428 1.348
531 HA VAL 71 HA VAL 71 0.796 -7.113 0.314
532 HB VAL 71 HB VAL 71 -0.326 -5.139 1.064
533 1HG1 VAL 71 1HG1 VAL 71 -0.907 -4.751 3.442
534 2HG1 VAL 71 2HG1 VAL 71 -1.852 -6.110 2.835
535 3HG1 VAL 71 3HG1 VAL 71 -0.434 -6.407 3.856
536 1HG2 VAL 71 1HG2 VAL 71 1.940 -5.921 2.910
537 2HG2 VAL 71 2HG2 VAL 71 2.033 -5.094 1.330
538 3HG2 VAL 71 3HG2 VAL 71 1.302 -4.281 2.707
539 H VAL 72 H VAL 72 2.593 -7.890 1.598
540 HA VAL 72 HA VAL 72 1.956 -10.053 3.554
541 HB VAL 72 HB VAL 72 4.208 -10.016 1.635
542 1HG1 VAL 72 1HG1 VAL 72 4.773 -11.256 3.644
543 2HG1 VAL 72 2HG1 VAL 72 3.261 -12.187 3.524
544 3HG1 VAL 72 3HG1 VAL 72 4.537 -12.377 2.306
545 1HG2 VAL 72 1HG2 VAL 72 1.649 -11.666 1.506
546 2HG2 VAL 72 2HG2 VAL 72 2.143 -10.416 0.340
547 3HG2 VAL 72 3HG2 VAL 72 3.071 -11.913 0.471
548 H ILE 73 H ILE 73 3.195 -10.073 5.337
549 HA ILE 73 HA ILE 73 4.541 -7.509 5.974
550 HB ILE 73 HB ILE 73 3.354 -9.535 7.866
551 1HG1 ILE 73 2HG1 ILE 73 1.535 -8.791 6.466
552 2HG1 ILE 73 3HG1 ILE 73 1.457 -8.013 8.037
553 1HG2 ILE 73 1HG2 ILE 73 4.969 -8.051 8.934
554 2HG2 ILE 73 2HG2 ILE 73 4.253 -6.632 8.162
555 3HG2 ILE 73 3HG2 ILE 73 3.341 -7.539 9.389
556 1HD1 ILE 73 1HD1 ILE 73 2.442 -6.674 5.486
557 2HD1 ILE 73 2HD1 ILE 73 0.878 -6.442 6.272
558 3HD1 ILE 73 3HD1 ILE 73 2.352 -5.918 7.096
559 H GLU 74 H GLU 74 6.474 -8.437 4.826
560 HA GLU 74 HA GLU 74 7.871 -10.585 5.908
561 1HB GLU 74 2HB GLU 74 8.172 -8.750 3.722
562 2HB GLU 74 3HB GLU 74 9.723 -9.117 4.477
563 1HG GLU 74 2HG GLU 74 7.788 -11.302 3.627
564 2HG GLU 74 3HG GLU 74 9.085 -10.678 2.596
565 H GLY 75 H GLY 75 7.451 -7.897 7.493
566 1HA GLY 75 2HA GLY 75 8.465 -6.918 9.365
567 2HA GLY 75 3HA GLY 75 9.537 -8.327 9.413
568 H ARG 76 H ARG 76 8.997 -5.216 7.659
569 HA ARG 76 HA ARG 76 11.831 -4.619 7.640
570 1HB ARG 76 2HB ARG 76 10.065 -5.034 5.213
571 2HB ARG 76 3HB ARG 76 10.872 -3.486 5.341
572 1HG ARG 76 2HG ARG 76 12.385 -4.740 4.103
573 2HG ARG 76 3HG ARG 76 13.055 -4.720 5.731
574 1HD ARG 76 2HD ARG 76 11.695 -7.059 5.926
575 2HD ARG 76 3HD ARG 76 11.729 -6.967 4.185
576 HE ARG 76 HE ARG 76 13.997 -7.336 4.138
577 1HH1 ARG 76 2HH2 ARG 76 12.940 -7.042 7.540
578 2HH1 ARG 76 1HH2 ARG 76 14.522 -7.275 8.188
579 1HH2 ARG 76 2HH1 ARG 76 16.097 -7.668 5.021
580 2HH2 ARG 76 1HH1 ARG 76 16.338 -7.698 6.738
Start of MODEL 26
1 1H MET 1 H1 MET 1 -2.276 21.085 16.352
2 2H MET 1 H2 MET 1 -2.348 20.858 18.005
3 3H MET 1 H3 MET 1 -0.892 20.971 17.208
4 HA MET 1 HA MET 1 -1.172 18.682 17.532
5 1HB MET 1 2HB MET 1 -3.981 19.276 16.503
6 2HB MET 1 3HB MET 1 -3.308 17.640 16.522
7 1HG MET 1 2HG MET 1 -3.082 17.625 18.897
8 2HG MET 1 3HG MET 1 -3.436 19.354 19.033
9 1HE MET 1 1HE MET 1 -4.777 17.071 20.821
10 2HE MET 1 2HE MET 1 -5.054 18.822 21.007
11 3HE MET 1 3HE MET 1 -6.436 17.709 20.876
12 H LEU 2 H LEU 2 -0.523 17.214 15.738
13 HA LEU 2 HA LEU 2 -0.705 18.130 13.016
14 1HB LEU 2 2HB LEU 2 1.325 19.295 14.569
15 2HB LEU 2 3HB LEU 2 2.156 17.929 13.841
16 HG LEU 2 HG LEU 2 0.533 19.975 12.251
17 1HD1 LEU 2 1HD1 LEU 2 2.325 21.129 13.470
18 2HD1 LEU 2 2HD1 LEU 2 3.518 19.963 12.856
19 3HD1 LEU 2 3HD1 LEU 2 2.685 21.066 11.739
20 1HD2 LEU 2 1HD2 LEU 2 2.684 17.961 11.428
21 2HD2 LEU 2 2HD2 LEU 2 0.963 17.908 10.986
22 3HD2 LEU 2 3HD2 LEU 2 1.988 19.200 10.365
23 H SER 3 H SER 3 -0.140 16.376 11.655
24 HA SER 3 HA SER 3 -0.017 13.727 12.824
25 1HB SER 3 2HB SER 3 -0.153 14.867 9.989
26 2HB SER 3 3HB SER 3 -0.096 13.148 10.362
27 HG SER 3 HG SER 3 -2.021 13.217 11.273
28 H GLU 4 H GLU 4 1.839 12.745 13.122
29 HA GLU 4 HA GLU 4 4.374 13.462 11.826
30 1HB GLU 4 2HB GLU 4 3.511 11.467 13.815
31 2HB GLU 4 3HB GLU 4 4.621 10.817 12.631
32 1HG GLU 4 2HG GLU 4 5.954 13.024 13.207
33 2HG GLU 4 3HG GLU 4 5.031 12.884 14.701
34 H GLN 5 H GLN 5 5.341 11.488 10.557
35 HA GLN 5 HA GLN 5 3.371 10.083 8.914
36 1HB GLN 5 2HB GLN 5 5.680 11.743 7.892
37 2HB GLN 5 3HB GLN 5 5.003 10.445 6.935
38 1HG GLN 5 2HG GLN 5 2.902 12.307 7.901
39 2HG GLN 5 3HG GLN 5 4.164 13.135 6.985
40 1HE2 GLN 5 1HE2 GLN 5 2.650 9.869 6.748
41 2HE2 GLN 5 2HE2 GLN 5 2.268 9.989 5.035
42 H LYS 6 H LYS 6 4.241 8.014 8.331
43 HA LYS 6 HA LYS 6 7.104 7.555 8.768
44 1HB LYS 6 2HB LYS 6 4.940 5.836 9.999
45 2HB LYS 6 3HB LYS 6 6.543 5.207 9.692
46 1HG LYS 6 2HG LYS 6 6.075 7.639 11.459
47 2HG LYS 6 3HG LYS 6 6.168 5.976 12.040
48 1HD LYS 6 2HD LYS 6 8.374 6.078 12.140
49 2HD LYS 6 3HD LYS 6 8.465 6.281 10.384
50 1HE LYS 6 2HE LYS 6 8.364 8.701 10.585
51 2HE LYS 6 3HE LYS 6 8.060 8.610 12.334
52 1HZ LYS 6 1HZ LYS 6 10.288 9.146 11.821
53 2HZ LYS 6 2HZ LYS 6 10.279 7.648 12.503
54 3HZ LYS 6 3HZ LYS 6 10.479 7.814 10.863
55 H GLU 7 H GLU 7 7.881 5.883 7.669
56 HA GLU 7 HA GLU 7 6.467 5.053 5.201
57 1HB GLU 7 2HB GLU 7 9.434 4.751 5.392
58 2HB GLU 7 3HB GLU 7 8.414 5.369 4.113
59 1HG GLU 7 2HG GLU 7 9.723 7.166 4.740
60 2HG GLU 7 3HG GLU 7 8.240 7.530 5.619
61 H ILE 8 H ILE 8 5.595 3.018 5.602
62 HA ILE 8 HA ILE 8 7.316 0.979 6.980
63 HB ILE 8 HB ILE 8 5.479 -0.507 6.882
64 1HG1 ILE 8 2HG1 ILE 8 3.191 0.348 6.284
65 2HG1 ILE 8 3HG1 ILE 8 3.974 1.680 5.403
66 1HG2 ILE 8 1HG2 ILE 8 5.701 0.981 8.767
67 2HG2 ILE 8 2HG2 ILE 8 4.616 2.151 7.970
68 3HG2 ILE 8 3HG2 ILE 8 4.026 0.517 8.393
69 1HD1 ILE 8 1HD1 ILE 8 4.907 -1.119 4.955
70 2HD1 ILE 8 2HD1 ILE 8 3.318 -0.705 4.298
71 3HD1 ILE 8 3HD1 ILE 8 4.772 0.196 3.776
72 H ALA 9 H ALA 9 7.662 -1.108 5.822
73 HA ALA 9 HA ALA 9 7.703 -0.887 2.869
74 1HB ALA 9 1HB ALA 9 9.994 -0.322 3.757
75 2HB ALA 9 2HB ALA 9 10.023 -1.879 4.593
76 3HB ALA 9 3HB ALA 9 9.956 -1.830 2.817
77 H MET 10 H MET 10 6.520 -2.720 2.181
78 HA MET 10 HA MET 10 6.748 -5.234 3.787
79 1HB MET 10 2HB MET 10 4.141 -3.801 3.136
80 2HB MET 10 3HB MET 10 4.228 -5.495 3.634
81 1HG MET 10 2HG MET 10 5.273 -3.184 5.282
82 2HG MET 10 3HG MET 10 3.720 -3.967 5.525
83 1HE MET 10 1HE MET 10 4.679 -3.883 8.083
84 2HE MET 10 2HE MET 10 6.142 -4.766 8.592
85 3HE MET 10 3HE MET 10 6.291 -3.348 7.535
86 H GLN 11 H GLN 11 5.401 -7.016 2.594
87 HA GLN 11 HA GLN 11 6.537 -7.024 -0.150
88 1HB GLN 11 2HB GLN 11 5.812 -9.127 1.931
89 2HB GLN 11 3HB GLN 11 5.793 -9.581 0.227
90 1HG GLN 11 2HG GLN 11 8.158 -8.558 1.848
91 2HG GLN 11 3HG GLN 11 7.925 -10.178 1.167
92 1HE2 GLN 11 1HE2 GLN 11 7.122 -9.794 -1.411
93 2HE2 GLN 11 2HE2 GLN 11 8.080 -8.577 -2.245
94 H VAL 12 H VAL 12 5.274 -8.027 -1.858
95 HA VAL 12 HA VAL 12 2.377 -7.300 -1.641
96 HB VAL 12 HB VAL 12 4.216 -7.117 -4.065
97 1HG1 VAL 12 1HG1 VAL 12 1.852 -7.376 -4.684
98 2HG1 VAL 12 2HG1 VAL 12 1.384 -6.109 -3.523
99 3HG1 VAL 12 3HG1 VAL 12 2.349 -5.704 -4.952
100 1HG2 VAL 12 1HG2 VAL 12 3.262 -4.973 -2.129
101 2HG2 VAL 12 2HG2 VAL 12 4.954 -5.443 -2.431
102 3HG2 VAL 12 3HG2 VAL 12 4.025 -4.629 -3.689
103 H SER 13 H SER 13 0.869 -8.672 -2.825
104 HA SER 13 HA SER 13 1.920 -10.970 -4.301
105 1HB SER 13 2HB SER 13 0.304 -11.238 -1.731
106 2HB SER 13 3HB SER 13 0.396 -12.529 -2.944
107 HG SER 13 HG SER 13 2.830 -11.431 -2.191
108 H GLY 14 H GLY 14 -0.149 -12.229 -5.161
109 1HA GLY 14 2HA GLY 14 -2.219 -12.166 -6.188
110 2HA GLY 14 3HA GLY 14 -2.522 -10.546 -5.550
111 H MET 15 H MET 15 -0.146 -9.307 -6.538
112 HA MET 15 HA MET 15 -0.734 -8.247 -8.913
113 1HB MET 15 2HB MET 15 1.564 -7.516 -9.056
114 2HB MET 15 3HB MET 15 1.146 -7.664 -7.343
115 1HG MET 15 2HG MET 15 3.176 -8.705 -7.292
116 2HG MET 15 3HG MET 15 2.168 -10.106 -7.642
117 1HE MET 15 1HE MET 15 5.180 -11.180 -9.721
118 2HE MET 15 2HE MET 15 5.046 -10.615 -8.039
119 3HE MET 15 3HE MET 15 3.807 -11.703 -8.720
120 H THR 16 H THR 16 -0.453 -8.517 -11.080
121 HA THR 16 HA THR 16 0.707 -11.066 -12.109
122 HB THR 16 HB THR 16 -0.708 -10.110 -14.217
123 HG1 THR 16 1HG THR 16 -2.308 -9.527 -11.956
124 1HG2 THR 16 1HG2 THR 16 -2.519 -11.684 -13.514
125 2HG2 THR 16 2HG2 THR 16 -0.897 -12.376 -13.358
126 3HG2 THR 16 3HG2 THR 16 -1.758 -11.819 -11.908
127 H CYS 17 H CYS 17 0.487 -7.492 -12.776
128 HA CYS 17 HA CYS 17 3.112 -7.746 -14.154
129 1HB CYS 17 2HB CYS 17 2.349 -6.337 -15.928
130 2HB CYS 17 3HB CYS 17 1.189 -7.665 -15.777
131 H ALA 18 H ALA 18 4.229 -5.702 -14.355
132 HA ALA 18 HA ALA 18 4.274 -4.273 -11.818
133 1HB ALA 18 1HB ALA 18 6.338 -4.954 -12.987
134 2HB ALA 18 2HB ALA 18 5.911 -3.914 -14.364
135 3HB ALA 18 3HB ALA 18 6.261 -3.194 -12.779
136 H ALA 19 H ALA 19 1.844 -3.762 -12.642
137 HA ALA 19 HA ALA 19 1.906 -0.864 -13.298
138 1HB ALA 19 1HB ALA 19 0.151 -1.024 -14.947
139 2HB ALA 19 2HB ALA 19 1.499 -2.054 -15.462
140 3HB ALA 19 3HB ALA 19 0.041 -2.779 -14.756
141 H CYS 20 H CYS 20 -0.367 -3.601 -12.617
142 HA CYS 20 HA CYS 20 -2.333 -2.042 -11.476
143 1HB CYS 20 2HB CYS 20 -1.636 -4.906 -10.662
144 2HB CYS 20 3HB CYS 20 -3.201 -4.086 -10.474
145 H ALA 21 H ALA 21 0.440 -3.474 -9.799
146 HA ALA 21 HA ALA 21 -0.211 -2.776 -7.179
147 1HB ALA 21 1HB ALA 21 2.595 -2.715 -8.335
148 2HB ALA 21 2HB ALA 21 2.083 -3.096 -6.671
149 3HB ALA 21 3HB ALA 21 1.714 -4.215 -7.980
150 H ALA 22 H ALA 22 0.682 -0.580 -9.796
151 HA ALA 22 HA ALA 22 1.496 1.627 -8.068
152 1HB ALA 22 1HB ALA 22 2.107 1.458 -10.494
153 2HB ALA 22 2HB ALA 22 0.388 1.650 -10.911
154 3HB ALA 22 3HB ALA 22 1.248 2.960 -10.090
155 H ARG 23 H ARG 23 -1.461 0.531 -9.752
156 HA ARG 23 HA ARG 23 -3.099 2.784 -9.156
157 1HB ARG 23 2HB ARG 23 -3.737 -0.119 -9.779
158 2HB ARG 23 3HB ARG 23 -4.987 1.096 -9.536
159 1HG ARG 23 2HG ARG 23 -4.588 2.187 -11.478
160 2HG ARG 23 3HG ARG 23 -2.847 1.898 -11.463
161 1HD ARG 23 2HD ARG 23 -2.956 -0.125 -12.487
162 2HD ARG 23 3HD ARG 23 -4.545 -0.553 -11.882
163 HE ARG 23 HE ARG 23 -3.860 0.873 -14.324
164 1HH1 ARG 23 2HH2 ARG 23 -6.392 0.385 -11.936
165 2HH1 ARG 23 1HH2 ARG 23 -7.723 0.681 -13.013
166 1HH2 ARG 23 2HH1 ARG 23 -5.590 1.343 -15.800
167 2HH2 ARG 23 1HH1 ARG 23 -7.237 1.283 -15.266
168 H ILE 24 H ILE 24 -2.646 -0.351 -7.411
169 HA ILE 24 HA ILE 24 -4.571 0.286 -5.441
170 HB ILE 24 HB ILE 24 -3.838 -1.399 -4.082
171 1HG1 ILE 24 2HG1 ILE 24 -1.243 -1.187 -5.519
172 2HG1 ILE 24 3HG1 ILE 24 -1.592 -1.015 -3.783
173 1HG2 ILE 24 1HG2 ILE 24 -3.214 -2.406 -6.883
174 2HG2 ILE 24 2HG2 ILE 24 -4.063 -3.214 -5.546
175 3HG2 ILE 24 3HG2 ILE 24 -4.847 -1.894 -6.405
176 1HD1 ILE 24 1HD1 ILE 24 -0.443 -3.102 -4.139
177 2HD1 ILE 24 2HD1 ILE 24 -2.136 -3.452 -3.711
178 3HD1 ILE 24 3HD1 ILE 24 -1.590 -3.541 -5.413
179 H GLU 25 H GLU 25 -0.996 0.780 -5.150
180 HA GLU 25 HA GLU 25 -1.096 2.245 -2.775
181 1HB GLU 25 2HB GLU 25 0.804 2.051 -5.072
182 2HB GLU 25 3HB GLU 25 0.982 3.470 -4.025
183 1HG GLU 25 2HG GLU 25 2.370 1.505 -3.312
184 2HG GLU 25 3HG GLU 25 1.295 2.115 -2.058
185 H LYS 26 H LYS 26 -1.732 3.496 -6.064
186 HA LYS 26 HA LYS 26 -1.672 6.237 -5.100
187 1HB LYS 26 2HB LYS 26 -2.525 5.109 -7.739
188 2HB LYS 26 3HB LYS 26 -2.917 6.758 -7.260
189 1HG LYS 26 2HG LYS 26 -0.928 7.031 -8.398
190 2HG LYS 26 3HG LYS 26 -0.438 7.142 -6.700
191 1HD LYS 26 2HD LYS 26 0.333 4.762 -6.782
192 2HD LYS 26 3HD LYS 26 -0.363 4.680 -8.396
193 1HE LYS 26 2HE LYS 26 1.908 4.906 -8.872
194 2HE LYS 26 3HE LYS 26 1.301 6.549 -9.078
195 1HZ LYS 26 1HZ LYS 26 2.701 5.466 -6.704
196 2HZ LYS 26 2HZ LYS 26 3.328 6.496 -7.817
197 3HZ LYS 26 3HZ LYS 26 2.130 6.998 -6.810
198 H GLY 27 H GLY 27 -4.305 3.910 -5.840
199 1HA GLY 27 2HA GLY 27 -6.489 5.625 -5.078
200 2HA GLY 27 3HA GLY 27 -6.507 3.856 -5.143
201 H LEU 28 H LEU 28 -4.331 3.396 -3.328
202 HA LEU 28 HA LEU 28 -5.756 3.375 -0.871
203 1HB LEU 28 2HB LEU 28 -4.108 1.686 -1.409
204 2HB LEU 28 3HB LEU 28 -2.824 2.885 -1.516
205 HG LEU 28 HG LEU 28 -2.757 1.427 0.463
206 1HD1 LEU 28 1HD1 LEU 28 -3.078 4.301 1.351
207 2HD1 LEU 28 2HD1 LEU 28 -2.048 3.032 1.999
208 3HD1 LEU 28 3HD1 LEU 28 -1.696 3.701 0.400
209 1HD2 LEU 28 1HD2 LEU 28 -4.924 1.021 1.120
210 2HD2 LEU 28 2HD2 LEU 28 -4.311 2.079 2.398
211 3HD2 LEU 28 3HD2 LEU 28 -5.392 2.736 1.180
212 H LYS 29 H LYS 29 -3.076 5.471 -2.107
213 HA LYS 29 HA LYS 29 -2.884 7.121 0.137
214 1HB LYS 29 2HB LYS 29 -1.432 7.163 -1.928
215 2HB LYS 29 3HB LYS 29 -2.717 8.081 -2.724
216 1HG LYS 29 2HG LYS 29 -2.356 9.521 -0.342
217 2HG LYS 29 3HG LYS 29 -0.770 8.882 -0.597
218 1HD LYS 29 2HD LYS 29 -2.313 10.266 -2.843
219 2HD LYS 29 3HD LYS 29 -1.528 11.216 -1.585
220 1HE LYS 29 2HE LYS 29 0.561 10.864 -2.302
221 2HE LYS 29 3HE LYS 29 0.282 9.158 -2.736
222 1HZ LYS 29 1HZ LYS 29 0.832 10.532 -4.549
223 2HZ LYS 29 2HZ LYS 29 -0.686 9.900 -4.752
224 3HZ LYS 29 3HZ LYS 29 -0.489 11.492 -4.329
225 H ARG 30 H ARG 30 -5.647 6.946 -2.089
226 HA ARG 30 HA ARG 30 -6.623 9.601 -1.342
227 1HB ARG 30 2HB ARG 30 -7.417 7.516 -3.251
228 2HB ARG 30 3HB ARG 30 -8.789 8.066 -2.307
229 1HG ARG 30 2HG ARG 30 -8.696 9.474 -4.188
230 2HG ARG 30 3HG ARG 30 -8.075 10.448 -2.852
231 1HD ARG 30 2HD ARG 30 -5.715 9.529 -3.642
232 2HD ARG 30 3HD ARG 30 -6.524 9.150 -5.150
233 HE ARG 30 HE ARG 30 -5.647 11.708 -4.142
234 1HH1 ARG 30 2HH2 ARG 30 -8.222 10.303 -6.076
235 2HH1 ARG 30 1HH2 ARG 30 -8.593 11.753 -6.959
236 1HH2 ARG 30 2HH1 ARG 30 -6.076 13.660 -5.294
237 2HH2 ARG 30 1HH1 ARG 30 -7.316 13.711 -6.500
238 H MET 31 H MET 31 -6.390 6.726 0.433
239 HA MET 31 HA MET 31 -8.929 6.848 1.768
240 1HB MET 31 2HB MET 31 -8.147 5.012 2.981
241 2HB MET 31 3HB MET 31 -7.380 4.851 1.411
242 1HG MET 31 2HG MET 31 -5.446 4.625 2.513
243 2HG MET 31 3HG MET 31 -5.516 6.321 2.928
244 1HE MET 31 1HE MET 31 -6.296 2.535 5.110
245 2HE MET 31 2HE MET 31 -7.878 3.221 4.666
246 3HE MET 31 3HE MET 31 -6.634 2.893 3.432
247 HA PRO 32 HA PRO 32 -7.885 9.850 4.906
248 1HB PRO 32 2HB PRO 32 -9.213 9.029 7.135
249 2HB PRO 32 3HB PRO 32 -10.042 9.664 5.682
250 1HG PRO 32 2HG PRO 32 -9.596 6.765 6.443
251 2HG PRO 32 3HG PRO 32 -11.100 7.560 5.904
252 1HD PRO 32 2HD PRO 32 -9.489 6.154 4.216
253 2HD PRO 32 3HD PRO 32 -10.385 7.593 3.650
254 H GLY 33 H GLY 33 -5.842 9.860 5.511
255 1HA GLY 33 2HA GLY 33 -4.540 9.621 7.573
256 2HA GLY 33 3HA GLY 33 -4.857 7.889 7.564
257 H VAL 34 H VAL 34 -4.375 7.751 4.518
258 HA VAL 34 HA VAL 34 -1.413 7.748 4.686
259 HB VAL 34 HB VAL 34 -3.233 6.815 2.464
260 1HG1 VAL 34 1HG1 VAL 34 -0.209 6.630 2.859
261 2HG1 VAL 34 2HG1 VAL 34 -1.118 5.774 1.600
262 3HG1 VAL 34 3HG1 VAL 34 -1.043 7.531 1.580
263 1HG2 VAL 34 1HG2 VAL 34 -2.398 5.598 4.987
264 2HG2 VAL 34 2HG2 VAL 34 -3.422 4.931 3.715
265 3HG2 VAL 34 3HG2 VAL 34 -1.672 4.722 3.639
266 H THR 35 H THR 35 -0.074 9.105 3.559
267 HA THR 35 HA THR 35 -1.391 11.461 2.260
268 HB THR 35 HB THR 35 0.807 11.291 4.224
269 HG1 THR 35 1HG THR 35 -0.533 12.887 5.176
270 1HG2 THR 35 1HG2 THR 35 1.141 13.751 3.843
271 2HG2 THR 35 2HG2 THR 35 1.756 12.730 2.537
272 3HG2 THR 35 3HG2 THR 35 0.211 13.596 2.332
273 H ASP 36 H ASP 36 1.452 9.172 2.123
274 HA ASP 36 HA ASP 36 1.253 9.619 -0.694
275 1HB ASP 36 2HB ASP 36 3.376 10.954 0.482
276 2HB ASP 36 3HB ASP 36 4.109 9.430 -0.042
277 H ALA 37 H ALA 37 2.547 8.044 -1.927
278 HA ALA 37 HA ALA 37 2.988 5.501 -0.609
279 1HB ALA 37 1HB ALA 37 0.462 5.584 -0.583
280 2HB ALA 37 2HB ALA 37 0.502 5.621 -2.361
281 3HB ALA 37 3HB ALA 37 1.127 4.214 -1.473
282 H ASN 38 H ASN 38 4.059 3.920 -1.840
283 HA ASN 38 HA ASN 38 4.706 4.582 -4.638
284 1HB ASN 38 2HB ASN 38 7.233 4.352 -3.392
285 2HB ASN 38 3HB ASN 38 6.526 5.756 -4.167
286 1HD2 ASN 38 1HD2 ASN 38 5.913 4.208 -0.937
287 2HD2 ASN 38 2HD2 ASN 38 6.295 5.684 -0.052
288 H VAL 39 H VAL 39 4.282 2.558 -5.395
289 HA VAL 39 HA VAL 39 5.079 0.234 -3.852
290 HB VAL 39 HB VAL 39 3.038 0.448 -5.334
291 1HG1 VAL 39 1HG1 VAL 39 4.137 1.403 -7.356
292 2HG1 VAL 39 2HG1 VAL 39 4.981 -0.143 -7.607
293 3HG1 VAL 39 3HG1 VAL 39 3.228 -0.080 -7.690
294 1HG2 VAL 39 1HG2 VAL 39 4.637 -1.785 -4.662
295 2HG2 VAL 39 2HG2 VAL 39 2.925 -1.735 -5.085
296 3HG2 VAL 39 3HG2 VAL 39 4.138 -2.005 -6.351
297 H ASN 40 H ASN 40 7.082 -0.826 -4.065
298 HA ASN 40 HA ASN 40 8.971 0.191 -6.150
299 1HB ASN 40 2HB ASN 40 9.492 0.863 -3.792
300 2HB ASN 40 3HB ASN 40 9.640 -0.852 -3.374
301 1HD2 ASN 40 1HD2 ASN 40 11.857 0.476 -2.847
302 2HD2 ASN 40 2HD2 ASN 40 13.070 0.293 -4.105
303 H LEU 41 H LEU 41 7.349 -1.499 -7.057
304 HA LEU 41 HA LEU 41 7.738 -4.247 -6.492
305 1HB LEU 41 2HB LEU 41 6.080 -2.633 -8.189
306 2HB LEU 41 3HB LEU 41 6.829 -3.822 -9.234
307 HG LEU 41 HG LEU 41 4.583 -4.362 -8.234
308 1HD1 LEU 41 1HD1 LEU 41 5.919 -6.098 -9.287
309 2HD1 LEU 41 2HD1 LEU 41 6.829 -6.364 -7.787
310 3HD1 LEU 41 3HD1 LEU 41 5.098 -6.753 -7.859
311 1HD2 LEU 41 1HD2 LEU 41 5.497 -3.656 -5.805
312 2HD2 LEU 41 2HD2 LEU 41 4.222 -4.867 -6.043
313 3HD2 LEU 41 3HD2 LEU 41 5.886 -5.373 -5.726
314 H ALA 42 H ALA 42 9.645 -2.055 -8.334
315 HA ALA 42 HA ALA 42 11.224 -3.706 -9.944
316 1HB ALA 42 1HB ALA 42 12.088 -1.476 -8.065
317 2HB ALA 42 2HB ALA 42 13.071 -2.158 -9.369
318 3HB ALA 42 3HB ALA 42 11.572 -1.281 -9.762
319 H THR 43 H THR 43 11.124 -3.513 -6.358
320 HA THR 43 HA THR 43 12.926 -5.885 -6.320
321 HB THR 43 HB THR 43 14.144 -3.934 -5.594
322 HG1 THR 43 1HG THR 43 14.847 -4.808 -3.628
323 1HG2 THR 43 1HG2 THR 43 12.006 -3.682 -3.443
324 2HG2 THR 43 2HG2 THR 43 13.585 -2.873 -3.378
325 3HG2 THR 43 3HG2 THR 43 12.452 -2.500 -4.684
326 H GLU 44 H GLU 44 10.034 -5.686 -6.586
327 HA GLU 44 HA GLU 44 8.080 -6.423 -5.778
328 1HB GLU 44 2HB GLU 44 9.986 -8.453 -4.543
329 2HB GLU 44 3HB GLU 44 8.232 -8.647 -4.671
330 1HG GLU 44 2HG GLU 44 8.411 -8.269 -7.167
331 2HG GLU 44 3HG GLU 44 10.168 -8.405 -6.984
332 H THR 45 H THR 45 9.257 -4.273 -3.978
333 HA THR 45 HA THR 45 7.912 -5.029 -1.434
334 HB THR 45 HB THR 45 9.995 -2.874 -1.968
335 HG1 THR 45 1HG THR 45 11.498 -4.398 -1.280
336 1HG2 THR 45 1HG2 THR 45 8.713 -2.662 0.159
337 2HG2 THR 45 2HG2 THR 45 9.144 -4.348 0.553
338 3HG2 THR 45 3HG2 THR 45 10.408 -3.103 0.455
339 H VAL 46 H VAL 46 6.540 -3.374 -0.471
340 HA VAL 46 HA VAL 46 5.783 -1.086 -2.248
341 HB VAL 46 HB VAL 46 3.919 -2.548 -2.232
342 1HG1 VAL 46 1HG1 VAL 46 4.117 -2.641 0.822
343 2HG1 VAL 46 2HG1 VAL 46 2.777 -3.277 -0.145
344 3HG1 VAL 46 3HG1 VAL 46 4.377 -4.001 -0.292
345 1HG2 VAL 46 1HG2 VAL 46 3.423 -0.160 -1.933
346 2HG2 VAL 46 2HG2 VAL 46 2.204 -1.219 -1.190
347 3HG2 VAL 46 3HG2 VAL 46 3.369 -0.380 -0.166
348 H ASN 47 H ASN 47 5.651 0.999 -1.255
349 HA ASN 47 HA ASN 47 6.282 1.078 1.644
350 1HB ASN 47 2HB ASN 47 7.449 2.718 -0.656
351 2HB ASN 47 3HB ASN 47 7.451 3.279 1.019
352 1HD2 ASN 47 1HD2 ASN 47 8.423 1.649 2.660
353 2HD2 ASN 47 2HD2 ASN 47 9.979 1.035 2.132
354 H VAL 48 H VAL 48 4.782 2.429 2.723
355 HA VAL 48 HA VAL 48 3.071 4.185 1.123
356 HB VAL 48 HB VAL 48 1.579 2.571 1.170
357 1HG1 VAL 48 1HG1 VAL 48 1.229 0.763 2.740
358 2HG1 VAL 48 2HG1 VAL 48 2.883 0.732 2.130
359 3HG1 VAL 48 3HG1 VAL 48 2.530 1.392 3.753
360 1HG2 VAL 48 1HG2 VAL 48 -0.027 2.806 2.981
361 2HG2 VAL 48 2HG2 VAL 48 1.232 3.330 4.090
362 3HG2 VAL 48 3HG2 VAL 48 0.731 4.398 2.745
363 H ILE 49 H ILE 49 2.915 6.097 2.029
364 HA ILE 49 HA ILE 49 4.488 6.524 4.458
365 HB ILE 49 HB ILE 49 3.861 8.561 2.290
366 1HG1 ILE 49 2HG1 ILE 49 4.966 6.795 1.101
367 2HG1 ILE 49 3HG1 ILE 49 6.023 8.188 1.293
368 1HG2 ILE 49 1HG2 ILE 49 5.911 9.652 3.194
369 2HG2 ILE 49 2HG2 ILE 49 4.593 9.536 4.363
370 3HG2 ILE 49 3HG2 ILE 49 5.964 8.428 4.484
371 1HD1 ILE 49 1HD1 ILE 49 6.190 5.602 2.892
372 2HD1 ILE 49 2HD1 ILE 49 7.319 6.170 1.652
373 3HD1 ILE 49 3HD1 ILE 49 7.188 7.050 3.175
374 H TYR 50 H TYR 50 2.966 6.674 6.151
375 HA TYR 50 HA TYR 50 0.493 8.329 5.710
376 1HB TYR 50 2HB TYR 50 -0.862 6.632 6.736
377 2HB TYR 50 3HB TYR 50 -0.038 5.946 5.356
378 HD1 TYR 50 HD1 TYR 50 2.008 4.450 5.774
379 HD2 TYR 50 HD2 TYR 50 -0.486 5.825 8.986
380 HE1 TYR 50 HE1 TYR 50 2.531 2.409 7.054
381 HE2 TYR 50 HE2 TYR 50 0.284 3.929 10.379
382 HH TYR 50 HH TYR 50 2.234 1.268 9.037
383 H ASP 51 H ASP 51 -0.689 8.607 7.762
384 HA ASP 51 HA ASP 51 1.215 9.514 9.859
385 1HB ASP 51 2HB ASP 51 -0.405 11.113 9.208
386 2HB ASP 51 3HB ASP 51 -1.731 9.971 9.439
387 HA PRO 52 HA PRO 52 0.030 5.594 11.807
388 1HB PRO 52 2HB PRO 52 2.051 5.207 13.535
389 2HB PRO 52 3HB PRO 52 2.277 5.054 11.776
390 1HG PRO 52 2HG PRO 52 2.795 7.529 13.493
391 2HG PRO 52 3HG PRO 52 3.937 6.749 12.365
392 1HD PRO 52 2HD PRO 52 2.405 8.885 11.636
393 2HD PRO 52 3HD PRO 52 2.758 7.557 10.484
394 H ALA 53 H ALA 53 -0.434 8.730 12.935
395 HA ALA 53 HA ALA 53 -1.276 7.955 15.649
396 1HB ALA 53 1HB ALA 53 -2.055 10.244 15.733
397 2HB ALA 53 2HB ALA 53 -0.404 10.262 15.064
398 3HB ALA 53 3HB ALA 53 -1.815 10.441 13.988
399 H GLU 54 H GLU 54 -2.328 7.994 12.285
400 HA GLU 54 HA GLU 54 -5.154 7.930 13.102
401 1HB GLU 54 2HB GLU 54 -3.803 9.615 11.288
402 2HB GLU 54 3HB GLU 54 -4.675 8.486 10.248
403 1HG GLU 54 2HG GLU 54 -5.998 10.006 12.538
404 2HG GLU 54 3HG GLU 54 -5.869 10.628 10.892
405 H THR 55 H THR 55 -2.997 6.800 10.512
406 HA THR 55 HA THR 55 -4.338 4.212 10.489
407 HB THR 55 HB THR 55 -2.461 3.928 8.441
408 HG1 THR 55 1HG THR 55 -3.624 6.465 8.339
409 1HG2 THR 55 1HG2 THR 55 -4.794 3.233 8.499
410 2HG2 THR 55 2HG2 THR 55 -5.368 4.936 8.439
411 3HG2 THR 55 3HG2 THR 55 -4.482 4.226 7.055
412 H GLY 56 H GLY 56 -2.752 2.523 9.784
413 1HA GLY 56 2HA GLY 56 -0.420 2.021 11.315
414 2HA GLY 56 3HA GLY 56 -1.857 1.197 11.979
415 H THR 57 H THR 57 -1.496 -0.853 11.128
416 HA THR 57 HA THR 57 -0.917 -1.406 8.311
417 HB THR 57 HB THR 57 -1.124 -3.755 9.285
418 HG1 THR 57 1HG THR 57 -1.376 -3.856 11.527
419 1HG2 THR 57 1HG2 THR 57 1.075 -2.550 9.173
420 2HG2 THR 57 2HG2 THR 57 0.773 -1.803 10.749
421 3HG2 THR 57 3HG2 THR 57 0.981 -3.559 10.627
422 H ALA 58 H ALA 58 -3.446 -1.436 10.736
423 HA ALA 58 HA ALA 58 -5.273 -3.030 9.725
424 1HB ALA 58 1HB ALA 58 -5.883 -0.414 11.158
425 2HB ALA 58 2HB ALA 58 -6.989 -1.798 11.037
426 3HB ALA 58 3HB ALA 58 -5.465 -1.958 11.929
427 H ALA 59 H ALA 59 -5.332 0.406 8.900
428 HA ALA 59 HA ALA 59 -7.856 -0.082 7.434
429 1HB ALA 59 1HB ALA 59 -8.000 2.214 7.010
430 2HB ALA 59 2HB ALA 59 -7.330 2.092 8.647
431 3HB ALA 59 3HB ALA 59 -6.274 2.464 7.265
432 H ILE 60 H ILE 60 -4.439 0.255 6.764
433 HA ILE 60 HA ILE 60 -4.506 0.361 3.934
434 HB ILE 60 HB ILE 60 -2.487 -0.323 6.078
435 1HG1 ILE 60 2HG1 ILE 60 -1.186 1.295 4.652
436 2HG1 ILE 60 3HG1 ILE 60 -2.602 1.357 3.581
437 1HG2 ILE 60 1HG2 ILE 60 -2.036 -1.101 3.176
438 2HG2 ILE 60 2HG2 ILE 60 -0.789 -0.958 4.437
439 3HG2 ILE 60 3HG2 ILE 60 -2.030 -2.195 4.587
440 1HD1 ILE 60 1HD1 ILE 60 -2.748 2.006 6.570
441 2HD1 ILE 60 2HD1 ILE 60 -2.290 3.228 5.385
442 3HD1 ILE 60 3HD1 ILE 60 -3.894 2.482 5.294
443 H GLN 61 H GLN 61 -4.314 -2.455 6.162
444 HA GLN 61 HA GLN 61 -4.242 -4.317 4.055
445 1HB GLN 61 2HB GLN 61 -3.797 -4.476 6.597
446 2HB GLN 61 3HB GLN 61 -5.474 -5.006 6.725
447 1HG GLN 61 2HG GLN 61 -5.000 -7.053 5.728
448 2HG GLN 61 3HG GLN 61 -3.792 -6.384 4.630
449 1HE2 GLN 61 1HE2 GLN 61 -1.781 -5.380 5.875
450 2HE2 GLN 61 2HE2 GLN 61 -1.112 -6.465 7.084
451 H GLU 62 H GLU 62 -6.977 -2.978 5.887
452 HA GLU 62 HA GLU 62 -9.161 -4.227 4.685
453 1HB GLU 62 2HB GLU 62 -8.798 -2.195 6.493
454 2HB GLU 62 3HB GLU 62 -9.384 -1.260 5.120
455 1HG GLU 62 2HG GLU 62 -10.778 -3.684 6.335
456 2HG GLU 62 3HG GLU 62 -11.134 -2.004 6.735
457 H LYS 63 H LYS 63 -7.584 -1.166 3.553
458 HA LYS 63 HA LYS 63 -9.137 -1.103 1.177
459 1HB LYS 63 2HB LYS 63 -6.863 0.427 2.381
460 2HB LYS 63 3HB LYS 63 -7.038 0.491 0.644
461 1HG LYS 63 2HG LYS 63 -9.157 1.258 2.667
462 2HG LYS 63 3HG LYS 63 -8.167 2.354 1.678
463 1HD LYS 63 2HD LYS 63 -9.767 2.355 0.105
464 2HD LYS 63 3HD LYS 63 -9.296 0.709 -0.259
465 1HE LYS 63 2HE LYS 63 -11.667 0.676 0.048
466 2HE LYS 63 3HE LYS 63 -11.007 -0.093 1.497
467 1HZ LYS 63 1HZ LYS 63 -11.962 2.674 1.310
468 2HZ LYS 63 2HZ LYS 63 -12.689 1.409 2.080
469 3HZ LYS 63 3HZ LYS 63 -11.270 1.993 2.646
470 H ILE 64 H ILE 64 -5.972 -2.572 1.845
471 HA ILE 64 HA ILE 64 -4.999 -2.950 -0.740
472 HB ILE 64 HB ILE 64 -4.666 -4.083 1.933
473 1HG1 ILE 64 2HG1 ILE 64 -3.302 -2.276 0.897
474 2HG1 ILE 64 3HG1 ILE 64 -2.420 -3.643 1.568
475 1HG2 ILE 64 1HG2 ILE 64 -4.028 -5.827 -0.420
476 2HG2 ILE 64 2HG2 ILE 64 -3.246 -5.949 1.177
477 3HG2 ILE 64 3HG2 ILE 64 -4.982 -6.204 1.039
478 1HD1 ILE 64 1HD1 ILE 64 -2.949 -3.181 -1.398
479 2HD1 ILE 64 2HD1 ILE 64 -1.413 -2.996 -0.529
480 3HD1 ILE 64 3HD1 ILE 64 -2.138 -4.600 -0.718
481 H GLU 65 H GLU 65 -7.134 -5.027 1.342
482 HA GLU 65 HA GLU 65 -7.852 -6.976 -0.592
483 1HB GLU 65 2HB GLU 65 -9.275 -5.901 1.882
484 2HB GLU 65 3HB GLU 65 -9.933 -7.209 0.898
485 1HG GLU 65 2HG GLU 65 -7.136 -7.383 2.023
486 2HG GLU 65 3HG GLU 65 -8.562 -7.871 2.950
487 H LYS 66 H LYS 66 -9.653 -4.016 0.412
488 HA LYS 66 HA LYS 66 -11.728 -4.397 -1.422
489 1HB LYS 66 2HB LYS 66 -10.926 -2.355 0.438
490 2HB LYS 66 3HB LYS 66 -11.370 -1.545 -1.064
491 1HG LYS 66 2HG LYS 66 -13.075 -3.630 0.368
492 2HG LYS 66 3HG LYS 66 -13.232 -1.890 0.613
493 1HD LYS 66 2HD LYS 66 -13.745 -1.555 -1.790
494 2HD LYS 66 3HD LYS 66 -13.580 -3.292 -2.090
495 1HE LYS 66 2HE LYS 66 -15.432 -3.753 -0.482
496 2HE LYS 66 3HE LYS 66 -15.625 -2.014 -0.209
497 1HZ LYS 66 1HZ LYS 66 -16.005 -3.399 -2.785
498 2HZ LYS 66 2HZ LYS 66 -17.200 -2.852 -1.798
499 3HZ LYS 66 3HZ LYS 66 -16.194 -1.782 -2.536
500 H LEU 67 H LEU 67 -8.624 -2.855 -2.008
501 HA LEU 67 HA LEU 67 -9.229 -1.828 -4.644
502 1HB LEU 67 2HB LEU 67 -6.667 -2.356 -3.122
503 2HB LEU 67 3HB LEU 67 -6.679 -1.686 -4.752
504 HG LEU 67 HG LEU 67 -8.331 -0.370 -2.568
505 1HD1 LEU 67 1HD1 LEU 67 -6.020 -0.541 -1.695
506 2HD1 LEU 67 2HD1 LEU 67 -5.413 0.184 -3.188
507 3HD1 LEU 67 3HD1 LEU 67 -6.454 1.129 -2.102
508 1HD2 LEU 67 1HD2 LEU 67 -6.980 0.710 -5.086
509 2HD2 LEU 67 2HD2 LEU 67 -8.711 0.350 -4.929
510 3HD2 LEU 67 3HD2 LEU 67 -7.984 1.636 -3.955
511 H GLY 68 H GLY 68 -8.620 -4.999 -3.408
512 1HA GLY 68 2HA GLY 68 -9.012 -6.923 -4.614
513 2HA GLY 68 3HA GLY 68 -8.685 -6.096 -6.143
514 H TYR 69 H TYR 69 -6.629 -6.116 -3.149
515 HA TYR 69 HA TYR 69 -4.568 -7.709 -4.603
516 1HB TYR 69 2HB TYR 69 -4.586 -4.867 -4.001
517 2HB TYR 69 3HB TYR 69 -3.360 -5.633 -3.018
518 HD1 TYR 69 HD1 TYR 69 -1.292 -6.325 -3.980
519 HD2 TYR 69 HD2 TYR 69 -4.657 -5.427 -6.520
520 HE1 TYR 69 HE1 TYR 69 0.198 -6.070 -5.881
521 HE2 TYR 69 HE2 TYR 69 -3.181 -5.332 -8.456
522 HH TYR 69 HH TYR 69 0.366 -5.872 -8.202
523 H HIS 70 H HIS 70 -2.679 -8.124 -2.999
524 HA HIS 70 HA HIS 70 -3.587 -8.219 -0.223
525 1HB HIS 70 2HB HIS 70 -3.956 -10.506 -1.544
526 2HB HIS 70 3HB HIS 70 -2.232 -10.712 -1.214
527 HD1 HIS 70 1HD HIS 70 -5.535 -9.887 0.718
528 HD2 HIS 70 2HD HIS 70 -1.727 -11.647 1.241
529 HE1 HIS 70 1HE HIS 70 -5.465 -10.785 3.082
530 H VAL 71 H VAL 71 -1.981 -7.874 1.207
531 HA VAL 71 HA VAL 71 0.750 -7.328 0.164
532 HB VAL 71 HB VAL 71 -0.644 -5.336 0.899
533 1HG1 VAL 71 1HG1 VAL 71 -1.742 -6.426 2.899
534 2HG1 VAL 71 2HG1 VAL 71 -0.169 -6.381 3.722
535 3HG1 VAL 71 3HG1 VAL 71 -0.962 -4.873 3.244
536 1HG2 VAL 71 1HG2 VAL 71 1.766 -5.212 0.748
537 2HG2 VAL 71 2HG2 VAL 71 1.179 -4.261 2.118
538 3HG2 VAL 71 3HG2 VAL 71 1.941 -5.839 2.406
539 H VAL 72 H VAL 72 2.437 -8.166 1.485
540 HA VAL 72 HA VAL 72 1.578 -10.168 3.526
541 HB VAL 72 HB VAL 72 4.006 -10.328 1.851
542 1HG1 VAL 72 1HG1 VAL 72 4.191 -11.513 3.985
543 2HG1 VAL 72 2HG1 VAL 72 2.649 -12.345 3.675
544 3HG1 VAL 72 3HG1 VAL 72 4.067 -12.675 2.659
545 1HG2 VAL 72 1HG2 VAL 72 2.816 -12.203 0.648
546 2HG2 VAL 72 2HG2 VAL 72 1.325 -11.745 1.494
547 3HG2 VAL 72 3HG2 VAL 72 2.084 -10.625 0.340
548 H ILE 73 H ILE 73 2.468 -10.013 5.401
549 HA ILE 73 HA ILE 73 4.088 -7.599 6.039
550 HB ILE 73 HB ILE 73 2.351 -9.292 7.846
551 1HG1 ILE 73 2HG1 ILE 73 0.959 -8.071 6.256
552 2HG1 ILE 73 3HG1 ILE 73 0.843 -7.395 7.875
553 1HG2 ILE 73 1HG2 ILE 73 4.114 -8.279 9.168
554 2HG2 ILE 73 2HG2 ILE 73 3.928 -6.730 8.344
555 3HG2 ILE 73 3HG2 ILE 73 2.648 -7.334 9.418
556 1HD1 ILE 73 1HD1 ILE 73 2.427 -6.186 5.571
557 2HD1 ILE 73 2HD1 ILE 73 0.893 -5.610 6.225
558 3HD1 ILE 73 3HD1 ILE 73 2.346 -5.524 7.225
559 H GLU 74 H GLU 74 5.956 -8.802 5.134
560 HA GLU 74 HA GLU 74 6.819 -11.079 6.455
561 1HB GLU 74 2HB GLU 74 7.514 -9.936 4.112
562 2HB GLU 74 3HB GLU 74 8.963 -9.626 5.098
563 1HG GLU 74 2HG GLU 74 8.913 -12.115 5.685
564 2HG GLU 74 3HG GLU 74 7.628 -12.294 4.473
565 H GLY 75 H GLY 75 6.830 -8.048 7.510
566 1HA GLY 75 2HA GLY 75 7.625 -7.029 9.481
567 2HA GLY 75 3HA GLY 75 8.565 -8.488 9.840
568 H ARG 76 H ARG 76 8.530 -5.373 8.039
569 HA ARG 76 HA ARG 76 11.391 -5.281 8.038
570 1HB ARG 76 2HB ARG 76 10.496 -6.396 5.764
571 2HB ARG 76 3HB ARG 76 9.941 -4.758 5.434
572 1HG ARG 76 2HG ARG 76 12.005 -4.484 4.544
573 2HG ARG 76 3HG ARG 76 12.507 -4.223 6.218
574 1HD ARG 76 2HD ARG 76 12.763 -6.832 6.315
575 2HD ARG 76 3HD ARG 76 12.763 -6.781 4.555
576 HE ARG 76 HE ARG 76 14.891 -6.193 6.357
577 1HH1 ARG 76 2HH2 ARG 76 13.561 -4.991 3.342
578 2HH1 ARG 76 1HH2 ARG 76 15.019 -4.225 2.786
579 1HH2 ARG 76 2HH1 ARG 76 16.873 -5.245 5.665
580 2HH2 ARG 76 1HH1 ARG 76 16.968 -4.405 4.150
Start of MODEL 27
1 1H MET 1 H1 MET 1 -1.016 19.129 18.349
2 2H MET 1 H2 MET 1 -0.644 18.773 19.917
3 3H MET 1 H3 MET 1 0.552 19.156 18.845
4 HA MET 1 HA MET 1 0.549 16.835 19.273
5 1HB MET 1 2HB MET 1 -2.312 17.010 18.237
6 2HB MET 1 3HB MET 1 -1.365 15.515 18.264
7 1HG MET 1 2HG MET 1 -1.017 15.759 20.704
8 2HG MET 1 3HG MET 1 -2.067 17.189 20.706
9 1HE MET 1 1HE MET 1 -3.439 16.053 22.678
10 2HE MET 1 2HE MET 1 -4.140 14.422 22.557
11 3HE MET 1 3HE MET 1 -2.374 14.625 22.594
12 H LEU 2 H LEU 2 -1.298 17.876 16.352
13 HA LEU 2 HA LEU 2 -0.815 17.854 14.179
14 1HB LEU 2 2HB LEU 2 1.995 18.149 15.186
15 2HB LEU 2 3HB LEU 2 1.849 17.302 13.668
16 HG LEU 2 HG LEU 2 0.400 19.233 12.833
17 1HD1 LEU 2 1HD1 LEU 2 1.591 20.573 15.312
18 2HD1 LEU 2 2HD1 LEU 2 0.700 21.386 14.011
19 3HD1 LEU 2 3HD1 LEU 2 -0.135 20.228 15.061
20 1HD2 LEU 2 1HD2 LEU 2 3.304 19.737 13.599
21 2HD2 LEU 2 2HD2 LEU 2 2.724 18.893 12.148
22 3HD2 LEU 2 3HD2 LEU 2 2.388 20.619 12.357
23 H SER 3 H SER 3 0.433 16.239 12.517
24 HA SER 3 HA SER 3 -0.149 13.463 13.377
25 1HB SER 3 2HB SER 3 -0.376 14.707 10.598
26 2HB SER 3 3HB SER 3 -0.846 13.071 11.073
27 HG SER 3 HG SER 3 -2.488 13.962 12.345
28 H GLU 4 H GLU 4 1.502 12.036 12.698
29 HA GLU 4 HA GLU 4 4.130 13.249 12.018
30 1HB GLU 4 2HB GLU 4 3.221 10.889 13.577
31 2HB GLU 4 3HB GLU 4 4.696 10.716 12.664
32 1HG GLU 4 2HG GLU 4 5.413 12.879 13.767
33 2HG GLU 4 3HG GLU 4 4.059 12.620 14.857
34 H GLN 5 H GLN 5 5.382 11.321 10.696
35 HA GLN 5 HA GLN 5 3.550 9.930 8.866
36 1HB GLN 5 2HB GLN 5 6.115 11.397 8.178
37 2HB GLN 5 3HB GLN 5 5.281 10.350 7.042
38 1HG GLN 5 2HG GLN 5 4.014 12.853 8.309
39 2HG GLN 5 3HG GLN 5 4.959 12.861 6.851
40 1HE2 GLN 5 1HE2 GLN 5 3.339 9.880 6.774
41 2HE2 GLN 5 2HE2 GLN 5 1.971 10.401 5.825
42 H LYS 6 H LYS 6 4.338 7.820 8.417
43 HA LYS 6 HA LYS 6 7.191 7.379 8.784
44 1HB LYS 6 2HB LYS 6 5.146 5.536 10.104
45 2HB LYS 6 3HB LYS 6 6.836 5.112 9.776
46 1HG LYS 6 2HG LYS 6 7.524 7.191 11.073
47 2HG LYS 6 3HG LYS 6 5.844 7.320 11.618
48 1HD LYS 6 2HD LYS 6 6.035 4.964 12.520
49 2HD LYS 6 3HD LYS 6 7.746 4.970 12.021
50 1HE LYS 6 2HE LYS 6 8.074 7.059 13.449
51 2HE LYS 6 3HE LYS 6 6.418 6.865 14.037
52 1HZ LYS 6 1HZ LYS 6 7.079 4.701 14.903
53 2HZ LYS 6 2HZ LYS 6 8.626 4.944 14.382
54 3HZ LYS 6 3HZ LYS 6 7.983 5.919 15.542
55 H GLU 7 H GLU 7 7.932 5.568 7.653
56 HA GLU 7 HA GLU 7 6.500 5.152 5.117
57 1HB GLU 7 2HB GLU 7 9.482 4.807 5.544
58 2HB GLU 7 3HB GLU 7 8.560 5.228 4.106
59 1HG GLU 7 2HG GLU 7 9.713 7.160 4.675
60 2HG GLU 7 3HG GLU 7 8.109 7.494 5.347
61 H ILE 8 H ILE 8 5.465 3.111 5.456
62 HA ILE 8 HA ILE 8 6.883 1.077 6.996
63 HB ILE 8 HB ILE 8 4.412 0.794 5.380
64 1HG1 ILE 8 2HG1 ILE 8 3.919 2.774 6.713
65 2HG1 ILE 8 3HG1 ILE 8 2.974 1.345 7.124
66 1HG2 ILE 8 1HG2 ILE 8 3.900 -0.829 7.235
67 2HG2 ILE 8 2HG2 ILE 8 5.277 -1.233 6.191
68 3HG2 ILE 8 3HG2 ILE 8 5.575 -0.516 7.791
69 1HD1 ILE 8 1HD1 ILE 8 4.311 0.874 9.029
70 2HD1 ILE 8 2HD1 ILE 8 5.508 2.106 8.554
71 3HD1 ILE 8 3HD1 ILE 8 3.884 2.602 9.112
72 H ALA 9 H ALA 9 7.347 -1.056 5.907
73 HA ALA 9 HA ALA 9 7.779 -0.931 2.976
74 1HB ALA 9 1HB ALA 9 9.813 -1.941 5.019
75 2HB ALA 9 2HB ALA 9 9.957 -2.026 3.251
76 3HB ALA 9 3HB ALA 9 9.973 -0.450 4.071
77 H MET 10 H MET 10 6.693 -2.681 2.139
78 HA MET 10 HA MET 10 6.504 -5.190 3.727
79 1HB MET 10 2HB MET 10 4.160 -3.560 2.670
80 2HB MET 10 3HB MET 10 4.046 -5.276 3.070
81 1HG MET 10 2HG MET 10 4.696 -4.865 5.367
82 2HG MET 10 3HG MET 10 4.874 -3.140 5.052
83 1HE MET 10 1HE MET 10 1.263 -1.868 4.653
84 2HE MET 10 2HE MET 10 2.985 -1.445 4.724
85 3HE MET 10 3HE MET 10 2.339 -2.329 3.319
86 H GLN 11 H GLN 11 5.445 -6.898 2.345
87 HA GLN 11 HA GLN 11 6.684 -6.859 -0.355
88 1HB GLN 11 2HB GLN 11 5.928 -8.990 1.693
89 2HB GLN 11 3HB GLN 11 6.020 -9.432 -0.006
90 1HG GLN 11 2HG GLN 11 8.258 -8.247 1.701
91 2HG GLN 11 3HG GLN 11 8.140 -9.918 1.130
92 1HE2 GLN 11 1HE2 GLN 11 7.406 -9.724 -1.498
93 2HE2 GLN 11 2HE2 GLN 11 8.335 -8.524 -2.381
94 H VAL 12 H VAL 12 5.469 -7.512 -2.169
95 HA VAL 12 HA VAL 12 2.530 -7.044 -1.886
96 HB VAL 12 HB VAL 12 4.364 -6.932 -4.316
97 1HG1 VAL 12 1HG1 VAL 12 1.388 -6.328 -3.999
98 2HG1 VAL 12 2HG1 VAL 12 2.359 -5.885 -5.414
99 3HG1 VAL 12 3HG1 VAL 12 2.118 -7.587 -5.021
100 1HG2 VAL 12 1HG2 VAL 12 3.021 -4.763 -2.646
101 2HG2 VAL 12 2HG2 VAL 12 4.771 -5.043 -2.812
102 3HG2 VAL 12 3HG2 VAL 12 3.831 -4.474 -4.193
103 H SER 13 H SER 13 1.025 -8.598 -2.629
104 HA SER 13 HA SER 13 1.989 -10.868 -4.187
105 1HB SER 13 2HB SER 13 2.144 -11.658 -1.842
106 2HB SER 13 3HB SER 13 0.433 -11.236 -1.591
107 HG SER 13 HG SER 13 0.801 -13.471 -2.169
108 H GLY 14 H GLY 14 -0.146 -12.213 -4.570
109 1HA GLY 14 2HA GLY 14 -1.967 -12.240 -6.029
110 2HA GLY 14 3HA GLY 14 -2.666 -11.093 -4.871
111 H MET 15 H MET 15 -0.196 -11.104 -7.504
112 HA MET 15 HA MET 15 -1.249 -8.499 -8.479
113 1HB MET 15 2HB MET 15 0.963 -7.619 -8.616
114 2HB MET 15 3HB MET 15 0.814 -8.342 -7.007
115 1HG MET 15 2HG MET 15 2.888 -9.104 -7.629
116 2HG MET 15 3HG MET 15 1.894 -10.452 -8.181
117 1HE MET 15 1HE MET 15 4.543 -10.536 -10.961
118 2HE MET 15 2HE MET 15 4.727 -10.415 -9.193
119 3HE MET 15 3HE MET 15 3.482 -11.484 -9.894
120 H THR 16 H THR 16 -1.030 -8.111 -10.702
121 HA THR 16 HA THR 16 -0.380 -10.438 -12.447
122 HB THR 16 HB THR 16 -1.294 -8.598 -14.141
123 HG1 THR 16 1HG THR 16 -2.915 -7.891 -11.990
124 1HG2 THR 16 1HG2 THR 16 -2.369 -10.761 -13.775
125 2HG2 THR 16 2HG2 THR 16 -3.101 -10.185 -12.262
126 3HG2 THR 16 3HG2 THR 16 -3.586 -9.475 -13.823
127 H CYS 17 H CYS 17 0.189 -6.862 -12.184
128 HA CYS 17 HA CYS 17 2.983 -7.278 -13.034
129 1HB CYS 17 2HB CYS 17 2.748 -5.784 -14.938
130 2HB CYS 17 3HB CYS 17 1.587 -7.104 -15.114
131 H ALA 18 H ALA 18 4.187 -5.272 -13.077
132 HA ALA 18 HA ALA 18 3.833 -3.687 -10.681
133 1HB ALA 18 1HB ALA 18 5.965 -2.681 -11.381
134 2HB ALA 18 2HB ALA 18 6.046 -4.450 -11.500
135 3HB ALA 18 3HB ALA 18 5.840 -3.472 -12.965
136 H ALA 19 H ALA 19 1.585 -3.277 -12.126
137 HA ALA 19 HA ALA 19 1.722 -0.373 -12.652
138 1HB ALA 19 1HB ALA 19 0.452 -0.476 -14.704
139 2HB ALA 19 2HB ALA 19 1.921 -1.447 -14.908
140 3HB ALA 19 3HB ALA 19 0.358 -2.244 -14.636
141 H CYS 20 H CYS 20 -0.454 -3.299 -12.563
142 HA CYS 20 HA CYS 20 -2.573 -1.845 -11.256
143 1HB CYS 20 2HB CYS 20 -1.917 -4.822 -10.977
144 2HB CYS 20 3HB CYS 20 -3.478 -4.031 -10.711
145 H ALA 21 H ALA 21 0.331 -3.526 -10.114
146 HA ALA 21 HA ALA 21 -0.098 -3.183 -7.359
147 1HB ALA 21 1HB ALA 21 2.587 -3.006 -8.753
148 2HB ALA 21 2HB ALA 21 2.225 -3.605 -7.112
149 3HB ALA 21 3HB ALA 21 1.707 -4.531 -8.522
150 H ALA 22 H ALA 22 0.493 -0.658 -9.733
151 HA ALA 22 HA ALA 22 1.408 1.330 -7.770
152 1HB ALA 22 1HB ALA 22 1.173 2.903 -9.576
153 2HB ALA 22 2HB ALA 22 2.014 1.470 -10.207
154 3HB ALA 22 3HB ALA 22 0.293 1.736 -10.573
155 H ARG 23 H ARG 23 -1.535 0.441 -9.589
156 HA ARG 23 HA ARG 23 -3.199 2.538 -8.744
157 1HB ARG 23 2HB ARG 23 -3.713 -0.267 -9.733
158 2HB ARG 23 3HB ARG 23 -5.055 0.677 -9.080
159 1HG ARG 23 2HG ARG 23 -4.828 2.408 -10.640
160 2HG ARG 23 3HG ARG 23 -3.225 1.891 -11.173
161 1HD ARG 23 2HD ARG 23 -5.519 -0.032 -11.479
162 2HD ARG 23 3HD ARG 23 -5.471 1.360 -12.573
163 HE ARG 23 HE ARG 23 -2.965 0.568 -12.877
164 1HH1 ARG 23 2HH2 ARG 23 -5.871 -1.493 -12.879
165 2HH1 ARG 23 1HH2 ARG 23 -5.049 -2.803 -13.682
166 1HH2 ARG 23 2HH1 ARG 23 -2.068 -1.037 -14.272
167 2HH2 ARG 23 1HH1 ARG 23 -2.814 -2.609 -14.181
168 H ILE 24 H ILE 24 -2.585 -0.596 -7.061
169 HA ILE 24 HA ILE 24 -4.451 -0.070 -5.018
170 HB ILE 24 HB ILE 24 -3.446 -1.653 -3.629
171 1HG1 ILE 24 2HG1 ILE 24 -1.079 -1.267 -5.400
172 2HG1 ILE 24 3HG1 ILE 24 -1.172 -1.157 -3.629
173 1HG2 ILE 24 1HG2 ILE 24 -3.128 -2.634 -6.494
174 2HG2 ILE 24 2HG2 ILE 24 -3.664 -3.499 -5.038
175 3HG2 ILE 24 3HG2 ILE 24 -4.709 -2.281 -5.755
176 1HD1 ILE 24 1HD1 ILE 24 -1.212 -3.664 -5.317
177 2HD1 ILE 24 2HD1 ILE 24 0.046 -3.155 -4.188
178 3HD1 ILE 24 3HD1 ILE 24 -1.544 -3.651 -3.564
179 H GLU 25 H GLU 25 -0.959 0.746 -4.997
180 HA GLU 25 HA GLU 25 -0.943 2.060 -2.498
181 1HB GLU 25 2HB GLU 25 0.754 2.248 -5.016
182 2HB GLU 25 3HB GLU 25 1.055 3.332 -3.653
183 1HG GLU 25 2HG GLU 25 0.926 0.319 -3.274
184 2HG GLU 25 3HG GLU 25 2.411 1.187 -3.688
185 H LYS 26 H LYS 26 -1.686 3.300 -5.745
186 HA LYS 26 HA LYS 26 -1.724 6.075 -4.774
187 1HB LYS 26 2HB LYS 26 -2.629 5.009 -7.452
188 2HB LYS 26 3HB LYS 26 -2.370 6.704 -7.013
189 1HG LYS 26 2HG LYS 26 -0.247 4.521 -7.166
190 2HG LYS 26 3HG LYS 26 -0.481 5.853 -8.292
191 1HD LYS 26 2HD LYS 26 0.130 7.465 -6.493
192 2HD LYS 26 3HD LYS 26 0.377 6.109 -5.365
193 1HE LYS 26 2HE LYS 26 2.118 5.154 -6.819
194 2HE LYS 26 3HE LYS 26 1.920 6.492 -7.966
195 1HZ LYS 26 1HZ LYS 26 3.778 6.837 -6.498
196 2HZ LYS 26 2HZ LYS 26 2.648 7.991 -6.203
197 3HZ LYS 26 3HZ LYS 26 2.844 6.728 -5.164
198 H GLY 27 H GLY 27 -4.207 3.629 -5.554
199 1HA GLY 27 2HA GLY 27 -6.491 5.244 -4.920
200 2HA GLY 27 3HA GLY 27 -6.365 3.477 -4.793
201 H LEU 28 H LEU 28 -4.266 3.193 -2.977
202 HA LEU 28 HA LEU 28 -5.666 3.534 -0.518
203 1HB LEU 28 2HB LEU 28 -4.210 1.698 -0.954
204 2HB LEU 28 3HB LEU 28 -2.802 2.741 -1.133
205 HG LEU 28 HG LEU 28 -3.134 1.366 1.000
206 1HD1 LEU 28 1HD1 LEU 28 -1.338 2.875 0.813
207 2HD1 LEU 28 2HD1 LEU 28 -2.390 4.285 0.957
208 3HD1 LEU 28 3HD1 LEU 28 -2.111 3.262 2.365
209 1HD2 LEU 28 1HD2 LEU 28 -4.404 2.399 2.821
210 2HD2 LEU 28 2HD2 LEU 28 -4.969 3.671 1.782
211 3HD2 LEU 28 3HD2 LEU 28 -5.476 1.998 1.472
212 H LYS 29 H LYS 29 -3.059 5.390 -2.074
213 HA LYS 29 HA LYS 29 -2.480 7.260 -0.121
214 1HB LYS 29 2HB LYS 29 -1.686 6.905 -2.656
215 2HB LYS 29 3HB LYS 29 -2.865 8.196 -2.952
216 1HG LYS 29 2HG LYS 29 -1.553 9.371 -0.947
217 2HG LYS 29 3HG LYS 29 -0.363 8.118 -1.325
218 1HD LYS 29 2HD LYS 29 0.399 9.712 -2.889
219 2HD LYS 29 3HD LYS 29 -0.863 8.988 -3.861
220 1HE LYS 29 2HE LYS 29 -1.272 11.312 -4.015
221 2HE LYS 29 3HE LYS 29 -2.464 10.760 -2.822
222 1HZ LYS 29 1HZ LYS 29 -0.914 11.518 -1.094
223 2HZ LYS 29 2HZ LYS 29 0.182 11.953 -2.180
224 3HZ LYS 29 3HZ LYS 29 -1.267 12.769 -2.098
225 H ARG 30 H ARG 30 -5.481 6.941 -1.899
226 HA ARG 30 HA ARG 30 -6.373 9.697 -1.397
227 1HB ARG 30 2HB ARG 30 -7.041 7.476 -3.154
228 2HB ARG 30 3HB ARG 30 -8.491 7.973 -2.318
229 1HG ARG 30 2HG ARG 30 -6.719 10.098 -3.564
230 2HG ARG 30 3HG ARG 30 -7.570 8.987 -4.638
231 1HD ARG 30 2HD ARG 30 -9.706 9.497 -3.580
232 2HD ARG 30 3HD ARG 30 -8.925 10.693 -2.515
233 HE ARG 30 HE ARG 30 -8.134 11.520 -4.986
234 1HH1 ARG 30 2HH2 ARG 30 -11.317 10.826 -3.639
235 2HH1 ARG 30 1HH2 ARG 30 -12.198 11.795 -4.778
236 1HH2 ARG 30 2HH1 ARG 30 -9.259 12.854 -6.499
237 2HH2 ARG 30 1HH1 ARG 30 -10.981 13.012 -6.421
238 H MET 31 H MET 31 -6.036 7.080 0.650
239 HA MET 31 HA MET 31 -8.679 7.296 1.915
240 1HB MET 31 2HB MET 31 -6.280 5.562 2.592
241 2HB MET 31 3HB MET 31 -7.917 5.340 3.200
242 1HG MET 31 2HG MET 31 -7.167 5.161 0.245
243 2HG MET 31 3HG MET 31 -7.278 3.804 1.342
244 1HE MET 31 1HE MET 31 -8.716 4.276 -1.563
245 2HE MET 31 2HE MET 31 -8.603 2.783 -0.608
246 3HE MET 31 3HE MET 31 -10.190 3.364 -1.184
247 HA PRO 32 HA PRO 32 -7.429 10.194 4.930
248 1HB PRO 32 2HB PRO 32 -8.650 9.322 7.275
249 2HB PRO 32 3HB PRO 32 -9.487 10.129 5.919
250 1HG PRO 32 2HG PRO 32 -9.245 7.157 6.433
251 2HG PRO 32 3HG PRO 32 -10.724 8.083 6.040
252 1HD PRO 32 2HD PRO 32 -9.411 6.740 4.126
253 2HD PRO 32 3HD PRO 32 -10.011 8.383 3.769
254 H GLY 33 H GLY 33 -5.758 10.601 6.349
255 1HA GLY 33 2HA GLY 33 -4.100 10.183 7.904
256 2HA GLY 33 3HA GLY 33 -4.516 8.471 7.925
257 H VAL 34 H VAL 34 -4.331 8.414 4.812
258 HA VAL 34 HA VAL 34 -1.439 7.926 4.785
259 HB VAL 34 HB VAL 34 -3.407 7.593 2.500
260 1HG1 VAL 34 1HG1 VAL 34 -0.554 6.614 3.042
261 2HG1 VAL 34 2HG1 VAL 34 -1.552 6.073 1.697
262 3HG1 VAL 34 3HG1 VAL 34 -1.059 7.751 1.783
263 1HG2 VAL 34 1HG2 VAL 34 -4.114 6.158 4.369
264 2HG2 VAL 34 2HG2 VAL 34 -3.347 5.180 3.118
265 3HG2 VAL 34 3HG2 VAL 34 -2.445 5.592 4.596
266 H THR 35 H THR 35 0.066 9.137 3.661
267 HA THR 35 HA THR 35 -0.904 11.772 2.631
268 HB THR 35 HB THR 35 1.676 10.966 3.855
269 HG1 THR 35 1HG THR 35 0.821 12.555 5.382
270 1HG2 THR 35 1HG2 THR 35 0.798 13.623 2.664
271 2HG2 THR 35 2HG2 THR 35 2.214 13.397 3.714
272 3HG2 THR 35 3HG2 THR 35 2.163 12.612 2.130
273 H ASP 36 H ASP 36 1.722 9.266 2.005
274 HA ASP 36 HA ASP 36 1.134 9.526 -0.820
275 1HB ASP 36 2HB ASP 36 3.681 10.495 0.438
276 2HB ASP 36 3HB ASP 36 3.707 9.735 -1.147
277 H ALA 37 H ALA 37 2.461 7.877 -2.032
278 HA ALA 37 HA ALA 37 2.944 5.410 -0.527
279 1HB ALA 37 1HB ALA 37 0.972 4.246 -1.443
280 2HB ALA 37 2HB ALA 37 0.425 5.669 -0.564
281 3HB ALA 37 3HB ALA 37 0.501 5.702 -2.339
282 H ASN 38 H ASN 38 3.843 3.701 -1.859
283 HA ASN 38 HA ASN 38 4.663 4.484 -4.564
284 1HB ASN 38 2HB ASN 38 7.049 4.010 -2.862
285 2HB ASN 38 3HB ASN 38 6.818 5.071 -4.242
286 1HD2 ASN 38 1HD2 ASN 38 6.004 4.674 -0.787
287 2HD2 ASN 38 2HD2 ASN 38 6.254 6.373 -0.365
288 H VAL 39 H VAL 39 4.489 2.585 -5.604
289 HA VAL 39 HA VAL 39 4.988 0.067 -4.175
290 HB VAL 39 HB VAL 39 3.117 0.380 -5.813
291 1HG1 VAL 39 1HG1 VAL 39 4.388 1.633 -7.602
292 2HG1 VAL 39 2HG1 VAL 39 5.257 0.124 -7.969
293 3HG1 VAL 39 3HG1 VAL 39 3.510 0.208 -8.179
294 1HG2 VAL 39 1HG2 VAL 39 3.822 -1.802 -5.088
295 2HG2 VAL 39 2HG2 VAL 39 3.547 -1.858 -6.841
296 3HG2 VAL 39 3HG2 VAL 39 5.202 -1.766 -6.211
297 H ASN 40 H ASN 40 7.003 -0.894 -4.153
298 HA ASN 40 HA ASN 40 9.140 0.221 -5.936
299 1HB ASN 40 2HB ASN 40 9.445 0.753 -3.540
300 2HB ASN 40 3HB ASN 40 9.344 -0.964 -3.144
301 1HD2 ASN 40 1HD2 ASN 40 11.551 -0.286 -2.184
302 2HD2 ASN 40 2HD2 ASN 40 12.932 -0.456 -3.258
303 H LEU 41 H LEU 41 7.532 -1.388 -7.103
304 HA LEU 41 HA LEU 41 7.868 -4.174 -6.608
305 1HB LEU 41 2HB LEU 41 6.160 -2.550 -8.156
306 2HB LEU 41 3HB LEU 41 7.023 -3.496 -9.346
307 HG LEU 41 HG LEU 41 4.821 -4.386 -8.546
308 1HD1 LEU 41 1HD1 LEU 41 6.406 -5.871 -9.685
309 2HD1 LEU 41 2HD1 LEU 41 7.193 -6.251 -8.144
310 3HD1 LEU 41 3HD1 LEU 41 5.513 -6.743 -8.428
311 1HD2 LEU 41 1HD2 LEU 41 4.386 -5.226 -6.478
312 2HD2 LEU 41 2HD2 LEU 41 6.073 -5.542 -6.076
313 3HD2 LEU 41 3HD2 LEU 41 5.451 -3.895 -6.005
314 H ALA 42 H ALA 42 9.797 -1.878 -8.279
315 HA ALA 42 HA ALA 42 11.445 -3.316 -9.981
316 1HB ALA 42 1HB ALA 42 12.279 -1.406 -7.760
317 2HB ALA 42 2HB ALA 42 13.250 -1.854 -9.172
318 3HB ALA 42 3HB ALA 42 11.750 -0.919 -9.393
319 H THR 43 H THR 43 11.267 -3.502 -6.394
320 HA THR 43 HA THR 43 12.903 -5.977 -6.578
321 HB THR 43 HB THR 43 14.383 -4.304 -5.698
322 HG1 THR 43 1HG THR 43 13.354 -6.106 -3.790
323 1HG2 THR 43 1HG2 THR 43 12.274 -3.767 -3.565
324 2HG2 THR 43 2HG2 THR 43 13.941 -3.158 -3.550
325 3HG2 THR 43 3HG2 THR 43 12.827 -2.643 -4.826
326 H GLU 44 H GLU 44 10.086 -5.658 -6.775
327 HA GLU 44 HA GLU 44 8.143 -6.485 -6.028
328 1HB GLU 44 2HB GLU 44 10.094 -8.441 -4.751
329 2HB GLU 44 3HB GLU 44 8.354 -8.713 -4.909
330 1HG GLU 44 2HG GLU 44 8.476 -8.455 -7.357
331 2HG GLU 44 3HG GLU 44 10.228 -8.208 -7.252
332 H THR 45 H THR 45 9.213 -4.294 -4.272
333 HA THR 45 HA THR 45 7.989 -5.029 -1.659
334 HB THR 45 HB THR 45 10.125 -2.998 -2.437
335 HG1 THR 45 1HG THR 45 11.457 -4.541 -1.326
336 1HG2 THR 45 1HG2 THR 45 9.161 -3.920 0.297
337 2HG2 THR 45 2HG2 THR 45 10.597 -2.923 0.001
338 3HG2 THR 45 3HG2 THR 45 8.999 -2.272 -0.374
339 H VAL 46 H VAL 46 6.871 -3.189 -0.550
340 HA VAL 46 HA VAL 46 6.008 -0.926 -2.272
341 HB VAL 46 HB VAL 46 4.214 -2.529 -2.479
342 1HG1 VAL 46 1HG1 VAL 46 4.540 -3.995 -0.548
343 2HG1 VAL 46 2HG1 VAL 46 4.156 -2.660 0.563
344 3HG1 VAL 46 3HG1 VAL 46 2.909 -3.323 -0.507
345 1HG2 VAL 46 1HG2 VAL 46 3.688 -0.128 -2.166
346 2HG2 VAL 46 2HG2 VAL 46 2.372 -1.218 -1.684
347 3HG2 VAL 46 3HG2 VAL 46 3.371 -0.436 -0.443
348 H ASN 47 H ASN 47 5.665 0.998 -1.177
349 HA ASN 47 HA ASN 47 6.437 1.029 1.671
350 1HB ASN 47 2HB ASN 47 7.713 2.494 -0.683
351 2HB ASN 47 3HB ASN 47 7.752 3.182 0.941
352 1HD2 ASN 47 1HD2 ASN 47 8.527 1.604 2.730
353 2HD2 ASN 47 2HD2 ASN 47 10.079 0.896 2.317
354 H VAL 48 H VAL 48 5.045 2.475 2.823
355 HA VAL 48 HA VAL 48 3.277 4.159 1.175
356 HB VAL 48 HB VAL 48 2.031 2.138 1.533
357 1HG1 VAL 48 1HG1 VAL 48 3.150 1.198 3.500
358 2HG1 VAL 48 2HG1 VAL 48 2.487 2.495 4.526
359 3HG1 VAL 48 3HG1 VAL 48 1.407 1.323 3.754
360 1HG2 VAL 48 1HG2 VAL 48 0.118 3.117 2.774
361 2HG2 VAL 48 2HG2 VAL 48 1.143 4.463 3.295
362 3HG2 VAL 48 3HG2 VAL 48 0.811 4.222 1.569
363 H ILE 49 H ILE 49 3.097 6.133 2.023
364 HA ILE 49 HA ILE 49 4.626 6.640 4.462
365 HB ILE 49 HB ILE 49 3.859 8.696 2.339
366 1HG1 ILE 49 2HG1 ILE 49 5.064 7.063 1.102
367 2HG1 ILE 49 3HG1 ILE 49 6.056 8.496 1.350
368 1HG2 ILE 49 1HG2 ILE 49 5.968 8.669 4.526
369 2HG2 ILE 49 2HG2 ILE 49 5.797 9.921 3.276
370 3HG2 ILE 49 3HG2 ILE 49 4.502 9.655 4.449
371 1HD1 ILE 49 1HD1 ILE 49 6.315 5.868 2.868
372 2HD1 ILE 49 2HD1 ILE 49 7.427 6.510 1.646
373 3HD1 ILE 49 3HD1 ILE 49 7.253 7.340 3.202
374 H TYR 50 H TYR 50 3.069 6.634 6.130
375 HA TYR 50 HA TYR 50 0.616 8.296 5.752
376 1HB TYR 50 2HB TYR 50 -0.770 6.635 6.835
377 2HB TYR 50 3HB TYR 50 -0.154 6.102 5.291
378 HD1 TYR 50 HD1 TYR 50 0.927 5.833 8.932
379 HD2 TYR 50 HD2 TYR 50 0.091 3.803 5.226
380 HE1 TYR 50 HE1 TYR 50 1.255 3.683 10.044
381 HE2 TYR 50 HE2 TYR 50 0.380 1.633 6.370
382 HH TYR 50 HH TYR 50 1.427 1.412 9.776
383 H ASP 51 H ASP 51 -0.493 8.747 7.751
384 HA ASP 51 HA ASP 51 1.447 9.321 9.922
385 1HB ASP 51 2HB ASP 51 -0.011 11.117 9.585
386 2HB ASP 51 3HB ASP 51 -1.430 10.063 9.511
387 HA PRO 52 HA PRO 52 0.109 5.326 11.517
388 1HB PRO 52 2HB PRO 52 1.986 4.866 13.372
389 2HB PRO 52 3HB PRO 52 2.418 5.027 11.651
390 1HG PRO 52 2HG PRO 52 2.504 7.222 13.762
391 2HG PRO 52 3HG PRO 52 3.833 6.707 12.683
392 1HD PRO 52 2HD PRO 52 2.175 8.807 12.072
393 2HD PRO 52 3HD PRO 52 2.816 7.709 10.810
394 H ALA 53 H ALA 53 -0.901 8.161 12.799
395 HA ALA 53 HA ALA 53 -1.832 6.999 15.372
396 1HB ALA 53 1HB ALA 53 -2.506 9.233 15.936
397 2HB ALA 53 2HB ALA 53 -0.800 9.278 15.442
398 3HB ALA 53 3HB ALA 53 -2.068 9.855 14.342
399 H GLU 54 H GLU 54 -2.764 8.305 12.158
400 HA GLU 54 HA GLU 54 -5.617 7.792 12.738
401 1HB GLU 54 2HB GLU 54 -4.147 9.640 11.012
402 2HB GLU 54 3HB GLU 54 -5.220 8.626 10.040
403 1HG GLU 54 2HG GLU 54 -6.529 10.457 10.542
404 2HG GLU 54 3HG GLU 54 -7.102 9.223 11.666
405 H THR 55 H THR 55 -3.233 7.086 10.158
406 HA THR 55 HA THR 55 -4.334 4.420 9.892
407 HB THR 55 HB THR 55 -2.393 4.448 7.881
408 HG1 THR 55 1HG THR 55 -3.897 6.568 7.364
409 1HG2 THR 55 1HG2 THR 55 -5.390 5.160 7.899
410 2HG2 THR 55 2HG2 THR 55 -4.435 4.597 6.499
411 3HG2 THR 55 3HG2 THR 55 -4.719 3.499 7.877
412 H GLY 56 H GLY 56 -2.313 3.015 9.164
413 1HA GLY 56 2HA GLY 56 -0.598 1.983 11.041
414 2HA GLY 56 3HA GLY 56 -2.280 1.739 11.604
415 H THR 57 H THR 57 -1.944 -0.613 10.939
416 HA THR 57 HA THR 57 -1.329 -1.277 8.156
417 HB THR 57 HB THR 57 -1.733 -3.602 9.187
418 HG1 THR 57 1HG THR 57 -1.810 -3.556 11.488
419 1HG2 THR 57 1HG2 THR 57 0.543 -2.588 8.966
420 2HG2 THR 57 2HG2 THR 57 0.342 -1.768 10.524
421 3HG2 THR 57 3HG2 THR 57 0.410 -3.541 10.454
422 H ALA 58 H ALA 58 -3.968 -1.055 10.439
423 HA ALA 58 HA ALA 58 -5.877 -2.578 9.434
424 1HB ALA 58 1HB ALA 58 -7.537 -1.062 10.500
425 2HB ALA 58 2HB ALA 58 -6.100 -1.293 11.516
426 3HB ALA 58 3HB ALA 58 -6.296 0.209 10.587
427 H ALA 59 H ALA 59 -5.528 0.772 8.356
428 HA ALA 59 HA ALA 59 -8.006 0.468 6.772
429 1HB ALA 59 1HB ALA 59 -7.772 2.688 6.042
430 2HB ALA 59 2HB ALA 59 -7.186 2.701 7.720
431 3HB ALA 59 3HB ALA 59 -6.036 2.712 6.345
432 H ILE 60 H ILE 60 -4.562 0.560 6.191
433 HA ILE 60 HA ILE 60 -4.450 0.284 3.397
434 HB ILE 60 HB ILE 60 -2.644 -0.334 5.763
435 1HG1 ILE 60 2HG1 ILE 60 -1.119 1.067 4.281
436 2HG1 ILE 60 3HG1 ILE 60 -2.487 1.187 3.171
437 1HG2 ILE 60 1HG2 ILE 60 -0.885 -1.190 4.287
438 2HG2 ILE 60 2HG2 ILE 60 -2.211 -2.334 4.438
439 3HG2 ILE 60 3HG2 ILE 60 -2.054 -1.348 2.958
440 1HD1 ILE 60 1HD1 ILE 60 -2.170 3.185 4.711
441 2HD1 ILE 60 2HD1 ILE 60 -3.744 2.434 4.989
442 3HD1 ILE 60 3HD1 ILE 60 -2.399 2.122 6.102
443 H GLN 61 H GLN 61 -4.578 -2.317 5.893
444 HA GLN 61 HA GLN 61 -4.502 -4.307 3.891
445 1HB GLN 61 2HB GLN 61 -4.016 -4.352 6.412
446 2HB GLN 61 3HB GLN 61 -5.707 -4.835 6.603
447 1HG GLN 61 2HG GLN 61 -5.323 -6.864 5.354
448 2HG GLN 61 3HG GLN 61 -3.810 -6.260 4.666
449 1HE2 GLN 61 1HE2 GLN 61 -2.098 -5.561 6.399
450 2HE2 GLN 61 2HE2 GLN 61 -1.887 -6.726 7.697
451 H GLU 62 H GLU 62 -7.240 -2.826 5.627
452 HA GLU 62 HA GLU 62 -9.446 -4.161 4.574
453 1HB GLU 62 2HB GLU 62 -8.958 -1.818 6.036
454 2HB GLU 62 3HB GLU 62 -9.728 -1.187 4.603
455 1HG GLU 62 2HG GLU 62 -10.885 -3.447 6.305
456 2HG GLU 62 3HG GLU 62 -11.158 -1.737 6.639
457 H LYS 63 H LYS 63 -7.789 -1.295 3.141
458 HA LYS 63 HA LYS 63 -9.308 -1.375 0.705
459 1HB LYS 63 2HB LYS 63 -6.895 0.113 1.774
460 2HB LYS 63 3HB LYS 63 -7.555 0.356 0.184
461 1HG LYS 63 2HG LYS 63 -9.010 0.775 2.856
462 2HG LYS 63 3HG LYS 63 -8.424 2.012 1.762
463 1HD LYS 63 2HD LYS 63 -10.627 2.056 1.108
464 2HD LYS 63 3HD LYS 63 -10.029 0.822 0.005
465 1HE LYS 63 2HE LYS 63 -11.880 -0.316 0.807
466 2HE LYS 63 3HE LYS 63 -10.767 -0.792 2.088
467 1HZ LYS 63 1HZ LYS 63 -12.519 -0.144 3.167
468 2HZ LYS 63 2HZ LYS 63 -11.574 1.154 3.335
469 3HZ LYS 63 3HZ LYS 63 -12.855 1.217 2.272
470 H ILE 64 H ILE 64 -6.068 -2.578 1.516
471 HA ILE 64 HA ILE 64 -5.088 -3.160 -0.986
472 HB ILE 64 HB ILE 64 -4.750 -4.107 1.760
473 1HG1 ILE 64 2HG1 ILE 64 -3.437 -2.312 0.525
474 2HG1 ILE 64 3HG1 ILE 64 -2.521 -3.532 1.405
475 1HG2 ILE 64 1HG2 ILE 64 -3.977 -5.976 -0.434
476 2HG2 ILE 64 2HG2 ILE 64 -3.243 -5.930 1.191
477 3HG2 ILE 64 3HG2 ILE 64 -4.963 -6.266 1.028
478 1HD1 ILE 64 1HD1 ILE 64 -3.009 -3.633 -1.601
479 2HD1 ILE 64 2HD1 ILE 64 -1.536 -3.042 -0.809
480 3HD1 ILE 64 3HD1 ILE 64 -2.001 -4.741 -0.652
481 H GLU 65 H GLU 65 -7.150 -5.156 1.236
482 HA GLU 65 HA GLU 65 -7.766 -7.285 -0.530
483 1HB GLU 65 2HB GLU 65 -9.189 -6.092 1.881
484 2HB GLU 65 3HB GLU 65 -9.807 -7.509 1.029
485 1HG GLU 65 2HG GLU 65 -6.925 -7.565 1.903
486 2HG GLU 65 3HG GLU 65 -8.191 -7.740 3.125
487 H LYS 66 H LYS 66 -9.822 -4.425 0.299
488 HA LYS 66 HA LYS 66 -11.832 -5.084 -1.558
489 1HB LYS 66 2HB LYS 66 -11.101 -2.714 0.066
490 2HB LYS 66 3HB LYS 66 -12.042 -2.317 -1.367
491 1HG LYS 66 2HG LYS 66 -12.864 -4.597 0.460
492 2HG LYS 66 3HG LYS 66 -13.291 -2.948 0.880
493 1HD LYS 66 2HD LYS 66 -13.894 -3.993 -1.912
494 2HD LYS 66 3HD LYS 66 -14.957 -4.415 -0.561
495 1HE LYS 66 2HE LYS 66 -15.438 -2.097 -0.070
496 2HE LYS 66 3HE LYS 66 -14.216 -1.521 -1.216
497 1HZ LYS 66 1HZ LYS 66 -16.646 -3.005 -1.970
498 2HZ LYS 66 2HZ LYS 66 -16.442 -1.377 -2.091
499 3HZ LYS 66 3HZ LYS 66 -15.517 -2.389 -3.003
500 H LEU 67 H LEU 67 -8.848 -3.354 -2.203
501 HA LEU 67 HA LEU 67 -9.564 -2.512 -4.886
502 1HB LEU 67 2HB LEU 67 -6.951 -2.681 -3.375
503 2HB LEU 67 3HB LEU 67 -7.062 -2.102 -5.038
504 HG LEU 67 HG LEU 67 -8.835 -0.864 -2.905
505 1HD1 LEU 67 1HD1 LEU 67 -6.046 0.112 -3.577
506 2HD1 LEU 67 2HD1 LEU 67 -7.191 0.828 -2.435
507 3HD1 LEU 67 3HD1 LEU 67 -6.458 -0.749 -2.090
508 1HD2 LEU 67 1HD2 LEU 67 -8.702 1.097 -4.403
509 2HD2 LEU 67 2HD2 LEU 67 -7.609 0.216 -5.487
510 3HD2 LEU 67 3HD2 LEU 67 -9.292 -0.312 -5.296
511 H GLY 68 H GLY 68 -8.610 -5.526 -3.465
512 1HA GLY 68 2HA GLY 68 -8.837 -7.549 -4.543
513 2HA GLY 68 3HA GLY 68 -8.631 -6.791 -6.124
514 H TYR 69 H TYR 69 -6.560 -6.619 -3.149
515 HA TYR 69 HA TYR 69 -4.353 -8.052 -4.559
516 1HB TYR 69 2HB TYR 69 -4.570 -5.196 -3.891
517 2HB TYR 69 3HB TYR 69 -3.185 -5.933 -3.123
518 HD1 TYR 69 HD1 TYR 69 -1.234 -6.520 -4.339
519 HD2 TYR 69 HD2 TYR 69 -4.865 -5.523 -6.438
520 HE1 TYR 69 HE1 TYR 69 0.035 -6.265 -6.414
521 HE2 TYR 69 HE2 TYR 69 -3.628 -5.434 -8.547
522 HH TYR 69 HH TYR 69 -0.063 -5.835 -8.701
523 H HIS 70 H HIS 70 -2.485 -8.357 -2.884
524 HA HIS 70 HA HIS 70 -3.467 -8.486 -0.095
525 1HB HIS 70 2HB HIS 70 -3.857 -10.690 -1.341
526 2HB HIS 70 3HB HIS 70 -2.104 -10.878 -1.369
527 HD1 HIS 70 1HD HIS 70 -1.400 -10.101 1.666
528 HD2 HIS 70 2HD HIS 70 -4.745 -12.342 0.398
529 HE1 HIS 70 1HE HIS 70 -2.161 -11.459 3.653
530 H VAL 71 H VAL 71 -1.955 -7.638 1.210
531 HA VAL 71 HA VAL 71 0.823 -7.263 0.230
532 HB VAL 71 HB VAL 71 -0.494 -5.324 1.074
533 1HG1 VAL 71 1HG1 VAL 71 -0.208 -6.600 3.830
534 2HG1 VAL 71 2HG1 VAL 71 -0.886 -5.010 3.447
535 3HG1 VAL 71 3HG1 VAL 71 -1.735 -6.476 2.936
536 1HG2 VAL 71 1HG2 VAL 71 1.955 -5.976 2.733
537 2HG2 VAL 71 2HG2 VAL 71 1.967 -5.312 1.079
538 3HG2 VAL 71 3HG2 VAL 71 1.285 -4.367 2.409
539 H VAL 72 H VAL 72 2.608 -7.970 1.605
540 HA VAL 72 HA VAL 72 1.956 -10.074 3.611
541 HB VAL 72 HB VAL 72 4.112 -10.251 1.574
542 1HG1 VAL 72 1HG1 VAL 72 4.330 -12.591 2.400
543 2HG1 VAL 72 2HG1 VAL 72 4.686 -11.412 3.660
544 3HG1 VAL 72 3HG1 VAL 72 3.117 -12.247 3.648
545 1HG2 VAL 72 1HG2 VAL 72 2.776 -12.156 0.626
546 2HG2 VAL 72 2HG2 VAL 72 1.443 -11.724 1.717
547 3HG2 VAL 72 3HG2 VAL 72 1.959 -10.601 0.438
548 H ILE 73 H ILE 73 3.338 -10.130 5.336
549 HA ILE 73 HA ILE 73 5.065 -7.728 5.688
550 HB ILE 73 HB ILE 73 3.279 -9.041 7.739
551 1HG1 ILE 73 2HG1 ILE 73 2.446 -6.515 7.707
552 2HG1 ILE 73 3HG1 ILE 73 3.097 -6.530 6.065
553 1HG2 ILE 73 1HG2 ILE 73 3.946 -7.214 9.190
554 2HG2 ILE 73 2HG2 ILE 73 5.392 -8.121 8.749
555 3HG2 ILE 73 3HG2 ILE 73 5.048 -6.577 7.943
556 1HD1 ILE 73 1HD1 ILE 73 0.661 -7.032 6.264
557 2HD1 ILE 73 2HD1 ILE 73 1.575 -8.335 5.484
558 3HD1 ILE 73 3HD1 ILE 73 1.083 -8.494 7.193
559 H GLU 74 H GLU 74 6.848 -9.238 4.835
560 HA GLU 74 HA GLU 74 7.703 -11.261 6.559
561 1HB GLU 74 2HB GLU 74 8.928 -9.880 4.161
562 2HB GLU 74 3HB GLU 74 9.728 -11.156 5.059
563 1HG GLU 74 2HG GLU 74 7.700 -12.636 4.681
564 2HG GLU 74 3HG GLU 74 7.082 -11.396 3.572
565 H GLY 75 H GLY 75 7.773 -8.103 7.002
566 1HA GLY 75 2HA GLY 75 8.660 -6.844 8.762
567 2HA GLY 75 3HA GLY 75 9.578 -8.264 9.274
568 H ARG 76 H ARG 76 9.486 -5.799 6.692
569 HA ARG 76 HA ARG 76 10.989 -4.639 5.554
570 1HB ARG 76 2HB ARG 76 11.149 -3.845 7.940
571 2HB ARG 76 3HB ARG 76 12.537 -4.893 8.113
572 1HG ARG 76 2HG ARG 76 13.047 -3.267 5.801
573 2HG ARG 76 3HG ARG 76 12.249 -2.185 6.947
574 1HD ARG 76 2HD ARG 76 14.635 -2.028 7.282
575 2HD ARG 76 3HD ARG 76 13.954 -2.890 8.690
576 HE ARG 76 HE ARG 76 14.536 -4.837 6.789
577 1HH1 ARG 76 2HH2 ARG 76 16.431 -2.596 8.709
578 2HH1 ARG 76 1HH2 ARG 76 17.934 -3.459 8.535
579 1HH2 ARG 76 2HH1 ARG 76 16.383 -5.969 6.488
580 2HH2 ARG 76 1HH1 ARG 76 17.913 -5.496 7.190
Start of MODEL 28
1 1H MET 1 H1 MET 1 3.396 19.249 14.869
2 2H MET 1 H2 MET 1 4.304 18.434 15.979
3 3H MET 1 H3 MET 1 3.299 17.611 14.965
4 HA MET 1 HA MET 1 2.319 17.750 17.147
5 1HB MET 1 2HB MET 1 2.824 20.709 16.677
6 2HB MET 1 3HB MET 1 1.552 20.159 17.775
7 1HG MET 1 2HG MET 1 3.092 18.955 19.153
8 2HG MET 1 3HG MET 1 4.466 19.409 18.126
9 1HE MET 1 1HE MET 1 5.432 20.102 20.642
10 2HE MET 1 2HE MET 1 4.706 21.419 21.598
11 3HE MET 1 3HE MET 1 3.836 19.880 21.411
12 H LEU 2 H LEU 2 1.146 16.649 15.260
13 HA LEU 2 HA LEU 2 -1.473 17.424 15.375
14 1HB LEU 2 2HB LEU 2 -0.363 19.092 13.435
15 2HB LEU 2 3HB LEU 2 -0.881 17.751 12.442
16 HG LEU 2 HG LEU 2 -2.650 19.233 14.430
17 1HD1 LEU 2 1HD1 LEU 2 -1.947 20.661 12.551
18 2HD1 LEU 2 2HD1 LEU 2 -2.484 19.423 11.393
19 3HD1 LEU 2 3HD1 LEU 2 -3.667 20.250 12.430
20 1HD2 LEU 2 1HD2 LEU 2 -3.451 16.923 14.048
21 2HD2 LEU 2 2HD2 LEU 2 -4.505 18.076 13.223
22 3HD2 LEU 2 3HD2 LEU 2 -3.313 17.148 12.291
23 H SER 3 H SER 3 0.621 16.212 12.762
24 HA SER 3 HA SER 3 -0.116 13.382 13.219
25 1HB SER 3 2HB SER 3 -0.333 15.036 10.645
26 2HB SER 3 3HB SER 3 -0.177 13.276 10.640
27 HG SER 3 HG SER 3 -2.045 13.051 11.676
28 H GLU 4 H GLU 4 1.795 12.170 13.062
29 HA GLU 4 HA GLU 4 4.265 13.452 12.056
30 1HB GLU 4 2HB GLU 4 3.610 11.145 13.806
31 2HB GLU 4 3HB GLU 4 5.009 10.982 12.776
32 1HG GLU 4 2HG GLU 4 5.739 13.215 13.674
33 2HG GLU 4 3HG GLU 4 4.478 13.005 14.890
34 H GLN 5 H GLN 5 5.493 11.508 10.763
35 HA GLN 5 HA GLN 5 3.622 10.096 8.991
36 1HB GLN 5 2HB GLN 5 6.031 11.751 8.217
37 2HB GLN 5 3HB GLN 5 5.330 10.584 7.109
38 1HG GLN 5 2HG GLN 5 3.519 12.739 8.266
39 2HG GLN 5 3HG GLN 5 4.723 13.174 7.069
40 1HE2 GLN 5 1HE2 GLN 5 3.095 9.967 7.072
41 2HE2 GLN 5 2HE2 GLN 5 2.235 10.267 5.579
42 H LYS 6 H LYS 6 4.451 8.056 8.436
43 HA LYS 6 HA LYS 6 7.292 7.603 8.715
44 1HB LYS 6 2HB LYS 6 5.340 5.787 10.175
45 2HB LYS 6 3HB LYS 6 6.999 5.345 9.752
46 1HG LYS 6 2HG LYS 6 7.813 7.403 10.911
47 2HG LYS 6 3HG LYS 6 6.192 7.646 11.574
48 1HD LYS 6 2HD LYS 6 6.252 5.596 12.802
49 2HD LYS 6 3HD LYS 6 7.718 5.036 11.993
50 1HE LYS 6 2HE LYS 6 7.570 7.554 13.737
51 2HE LYS 6 3HE LYS 6 8.071 5.965 14.339
52 1HZ LYS 6 1HZ LYS 6 9.429 7.468 12.195
53 2HZ LYS 6 2HZ LYS 6 9.943 7.325 13.745
54 3HZ LYS 6 3HZ LYS 6 9.887 5.998 12.771
55 H GLU 7 H GLU 7 8.056 5.889 7.617
56 HA GLU 7 HA GLU 7 6.630 5.420 5.084
57 1HB GLU 7 2HB GLU 7 9.624 5.217 5.500
58 2HB GLU 7 3HB GLU 7 8.657 5.579 4.074
59 1HG GLU 7 2HG GLU 7 9.679 7.607 4.626
60 2HG GLU 7 3HG GLU 7 8.094 7.819 5.382
61 H ILE 8 H ILE 8 5.609 3.447 5.674
62 HA ILE 8 HA ILE 8 7.209 1.386 7.013
63 HB ILE 8 HB ILE 8 4.431 1.370 5.997
64 1HG1 ILE 8 2HG1 ILE 8 4.346 3.193 7.478
65 2HG1 ILE 8 3HG1 ILE 8 3.661 1.793 8.320
66 1HG2 ILE 8 1HG2 ILE 8 5.954 -0.340 7.897
67 2HG2 ILE 8 2HG2 ILE 8 4.167 -0.374 7.805
68 3HG2 ILE 8 3HG2 ILE 8 5.133 -0.804 6.381
69 1HD1 ILE 8 1HD1 ILE 8 5.157 2.963 9.805
70 2HD1 ILE 8 2HD1 ILE 8 5.841 1.372 9.364
71 3HD1 ILE 8 3HD1 ILE 8 6.463 2.853 8.598
72 H ALA 9 H ALA 9 7.263 -0.764 5.984
73 HA ALA 9 HA ALA 9 7.448 -0.753 3.031
74 1HB ALA 9 1HB ALA 9 9.752 -0.364 3.959
75 2HB ALA 9 2HB ALA 9 9.581 -1.841 4.926
76 3HB ALA 9 3HB ALA 9 9.586 -1.938 3.154
77 H MET 10 H MET 10 6.598 -2.725 2.221
78 HA MET 10 HA MET 10 6.739 -5.096 3.856
79 1HB MET 10 2HB MET 10 4.352 -5.598 3.961
80 2HB MET 10 3HB MET 10 4.777 -4.217 4.950
81 1HG MET 10 2HG MET 10 3.499 -4.007 2.197
82 2HG MET 10 3HG MET 10 2.641 -4.057 3.736
83 1HE MET 10 1HE MET 10 1.244 -2.085 3.313
84 2HE MET 10 2HE MET 10 1.841 -0.462 2.927
85 3HE MET 10 3HE MET 10 1.970 -1.765 1.720
86 H GLN 11 H GLN 11 5.304 -6.909 2.660
87 HA GLN 11 HA GLN 11 6.388 -6.899 -0.107
88 1HB GLN 11 2HB GLN 11 5.578 -9.074 1.882
89 2HB GLN 11 3HB GLN 11 5.900 -9.422 0.187
90 1HG GLN 11 2HG GLN 11 7.842 -8.270 2.252
91 2HG GLN 11 3HG GLN 11 7.854 -9.899 1.553
92 1HE2 GLN 11 1HE2 GLN 11 7.612 -9.716 -1.056
93 2HE2 GLN 11 2HE2 GLN 11 8.543 -8.429 -1.801
94 H VAL 12 H VAL 12 5.082 -7.946 -1.752
95 HA VAL 12 HA VAL 12 2.189 -7.211 -1.516
96 HB VAL 12 HB VAL 12 4.078 -7.145 -3.914
97 1HG1 VAL 12 1HG1 VAL 12 1.163 -6.298 -3.613
98 2HG1 VAL 12 2HG1 VAL 12 2.202 -5.892 -4.996
99 3HG1 VAL 12 3HG1 VAL 12 1.799 -7.579 -4.676
100 1HG2 VAL 12 1HG2 VAL 12 2.892 -4.920 -2.207
101 2HG2 VAL 12 2HG2 VAL 12 4.619 -5.326 -2.367
102 3HG2 VAL 12 3HG2 VAL 12 3.738 -4.659 -3.741
103 H SER 13 H SER 13 0.673 -8.642 -2.672
104 HA SER 13 HA SER 13 1.762 -10.936 -4.098
105 1HB SER 13 2HB SER 13 0.120 -11.238 -1.557
106 2HB SER 13 3HB SER 13 0.190 -12.507 -2.789
107 HG SER 13 HG SER 13 2.623 -11.429 -1.941
108 H GLY 14 H GLY 14 -0.046 -12.139 -5.155
109 1HA GLY 14 2HA GLY 14 -1.756 -12.054 -6.693
110 2HA GLY 14 3HA GLY 14 -2.575 -10.865 -5.663
111 H MET 15 H MET 15 0.568 -10.874 -7.407
112 HA MET 15 HA MET 15 -0.270 -8.507 -8.987
113 1HB MET 15 2HB MET 15 1.918 -7.525 -8.774
114 2HB MET 15 3HB MET 15 1.261 -7.832 -7.166
115 1HG MET 15 2HG MET 15 3.452 -8.432 -6.929
116 2HG MET 15 3HG MET 15 2.687 -10.000 -7.181
117 1HE MET 15 1HE MET 15 6.321 -10.266 -8.721
118 2HE MET 15 2HE MET 15 5.836 -9.309 -7.310
119 3HE MET 15 3HE MET 15 5.185 -10.948 -7.540
120 H THR 16 H THR 16 0.980 -8.334 -10.948
121 HA THR 16 HA THR 16 2.739 -10.078 -12.113
122 HB THR 16 HB THR 16 0.884 -11.101 -13.857
123 HG1 THR 16 1HG THR 16 -0.125 -11.544 -11.265
124 1HG2 THR 16 1HG2 THR 16 1.253 -13.295 -12.761
125 2HG2 THR 16 2HG2 THR 16 2.744 -12.391 -13.051
126 3HG2 THR 16 3HG2 THR 16 2.096 -12.506 -11.418
127 H CYS 17 H CYS 17 -0.214 -8.226 -12.786
128 HA CYS 17 HA CYS 17 0.323 -7.129 -15.267
129 1HB CYS 17 2HB CYS 17 -1.718 -6.740 -13.910
130 2HB CYS 17 3HB CYS 17 -0.781 -5.754 -12.771
131 H ALA 18 H ALA 18 1.732 -6.257 -12.129
132 HA ALA 18 HA ALA 18 3.491 -5.009 -11.487
133 1HB ALA 18 1HB ALA 18 5.448 -4.861 -12.885
134 2HB ALA 18 2HB ALA 18 4.713 -6.461 -13.103
135 3HB ALA 18 3HB ALA 18 4.515 -5.208 -14.348
136 H ALA 19 H ALA 19 1.045 -3.806 -12.896
137 HA ALA 19 HA ALA 19 2.027 -0.991 -12.803
138 1HB ALA 19 1HB ALA 19 1.680 -1.661 -15.156
139 2HB ALA 19 2HB ALA 19 0.014 -2.134 -14.780
140 3HB ALA 19 3HB ALA 19 0.506 -0.433 -14.632
141 H CYS 20 H CYS 20 -0.875 -3.167 -12.659
142 HA CYS 20 HA CYS 20 -2.563 -1.615 -11.148
143 1HB CYS 20 2HB CYS 20 -1.907 -4.602 -11.117
144 2HB CYS 20 3HB CYS 20 -3.105 -3.966 -10.017
145 H ALA 21 H ALA 21 0.297 -3.319 -9.945
146 HA ALA 21 HA ALA 21 0.049 -2.934 -7.212
147 1HB ALA 21 1HB ALA 21 2.619 -2.571 -8.797
148 2HB ALA 21 2HB ALA 21 2.430 -3.174 -7.133
149 3HB ALA 21 3HB ALA 21 1.861 -4.148 -8.481
150 H ALA 22 H ALA 22 0.741 -0.457 -9.680
151 HA ALA 22 HA ALA 22 1.361 1.664 -7.756
152 1HB ALA 22 1HB ALA 22 0.480 1.830 -10.668
153 2HB ALA 22 2HB ALA 22 1.215 3.117 -9.694
154 3HB ALA 22 3HB ALA 22 2.170 1.681 -10.129
155 H ARG 23 H ARG 23 -1.409 0.638 -9.749
156 HA ARG 23 HA ARG 23 -3.175 2.767 -9.177
157 1HB ARG 23 2HB ARG 23 -3.784 -0.167 -9.742
158 2HB ARG 23 3HB ARG 23 -4.987 1.103 -9.744
159 1HG ARG 23 2HG ARG 23 -2.524 1.280 -11.535
160 2HG ARG 23 3HG ARG 23 -3.922 0.317 -11.995
161 1HD ARG 23 2HD ARG 23 -4.048 3.283 -11.272
162 2HD ARG 23 3HD ARG 23 -3.925 2.696 -12.918
163 HE ARG 23 HE ARG 23 -6.271 2.758 -11.206
164 1HH1 ARG 23 2HH2 ARG 23 -4.814 1.000 -13.885
165 2HH1 ARG 23 1HH2 ARG 23 -6.309 0.430 -14.557
166 1HH2 ARG 23 2HH1 ARG 23 -8.296 1.995 -12.040
167 2HH2 ARG 23 1HH1 ARG 23 -8.335 1.014 -13.465
168 H ILE 24 H ILE 24 -2.801 -0.412 -7.527
169 HA ILE 24 HA ILE 24 -4.808 0.103 -5.630
170 HB ILE 24 HB ILE 24 -4.040 -1.677 -4.303
171 1HG1 ILE 24 2HG1 ILE 24 -1.491 -1.329 -5.831
172 2HG1 ILE 24 3HG1 ILE 24 -1.783 -1.273 -4.071
173 1HG2 ILE 24 1HG2 ILE 24 -3.489 -2.530 -7.164
174 2HG2 ILE 24 2HG2 ILE 24 -4.278 -3.420 -5.852
175 3HG2 ILE 24 3HG2 ILE 24 -5.107 -2.063 -6.616
176 1HD1 ILE 24 1HD1 ILE 24 -0.580 -3.291 -4.627
177 2HD1 ILE 24 2HD1 ILE 24 -2.223 -3.691 -4.074
178 3HD1 ILE 24 3HD1 ILE 24 -1.817 -3.720 -5.821
179 H GLU 25 H GLU 25 -1.233 0.587 -5.180
180 HA GLU 25 HA GLU 25 -1.413 1.833 -2.720
181 1HB GLU 25 2HB GLU 25 0.591 1.572 -4.837
182 2HB GLU 25 3HB GLU 25 0.705 3.152 -4.044
183 1HG GLU 25 2HG GLU 25 2.093 1.386 -2.958
184 2HG GLU 25 3HG GLU 25 0.917 2.115 -1.858
185 H LYS 26 H LYS 26 -2.007 3.308 -5.881
186 HA LYS 26 HA LYS 26 -2.009 6.010 -4.774
187 1HB LYS 26 2HB LYS 26 -2.970 4.957 -7.444
188 2HB LYS 26 3HB LYS 26 -2.878 6.673 -7.015
189 1HG LYS 26 2HG LYS 26 -0.478 4.797 -6.924
190 2HG LYS 26 3HG LYS 26 -0.921 5.731 -8.348
191 1HD LYS 26 2HD LYS 26 -0.582 7.821 -7.187
192 2HD LYS 26 3HD LYS 26 -0.292 7.029 -5.638
193 1HE LYS 26 2HE LYS 26 1.440 6.569 -8.106
194 2HE LYS 26 3HE LYS 26 1.792 7.793 -6.878
195 1HZ LYS 26 1HZ LYS 26 2.972 5.703 -6.554
196 2HZ LYS 26 2HZ LYS 26 2.104 6.126 -5.251
197 3HZ LYS 26 3HZ LYS 26 1.557 4.927 -6.242
198 H GLY 27 H GLY 27 -4.640 3.683 -5.616
199 1HA GLY 27 2HA GLY 27 -6.697 5.530 -4.656
200 2HA GLY 27 3HA GLY 27 -6.931 3.815 -4.903
201 H LEU 28 H LEU 28 -4.606 3.069 -3.194
202 HA LEU 28 HA LEU 28 -5.819 2.875 -0.604
203 1HB LEU 28 2HB LEU 28 -4.190 1.361 -1.490
204 2HB LEU 28 3HB LEU 28 -2.943 2.608 -1.444
205 HG LEU 28 HG LEU 28 -4.396 1.938 1.102
206 1HD1 LEU 28 1HD1 LEU 28 -3.984 -0.197 0.179
207 2HD1 LEU 28 2HD1 LEU 28 -2.301 0.214 -0.225
208 3HD1 LEU 28 3HD1 LEU 28 -2.805 0.073 1.470
209 1HD2 LEU 28 1HD2 LEU 28 -2.659 3.804 0.874
210 2HD2 LEU 28 2HD2 LEU 28 -2.240 2.583 2.059
211 3HD2 LEU 28 3HD2 LEU 28 -1.467 2.558 0.460
212 H LYS 29 H LYS 29 -3.263 5.048 -1.921
213 HA LYS 29 HA LYS 29 -2.953 6.708 0.260
214 1HB LYS 29 2HB LYS 29 -1.698 6.648 -1.997
215 2HB LYS 29 3HB LYS 29 -2.947 7.750 -2.569
216 1HG LYS 29 2HG LYS 29 -2.023 8.835 -0.078
217 2HG LYS 29 3HG LYS 29 -0.606 8.177 -0.850
218 1HD LYS 29 2HD LYS 29 -0.431 9.988 -2.138
219 2HD LYS 29 3HD LYS 29 -1.954 9.640 -2.928
220 1HE LYS 29 2HE LYS 29 -1.578 11.193 -0.325
221 2HE LYS 29 3HE LYS 29 -1.845 11.915 -1.912
222 1HZ LYS 29 1HZ LYS 29 -4.025 10.818 -1.892
223 2HZ LYS 29 2HZ LYS 29 -3.733 10.195 -0.403
224 3HZ LYS 29 3HZ LYS 29 -3.847 11.816 -0.591
225 H ARG 30 H ARG 30 -5.872 6.497 -1.673
226 HA ARG 30 HA ARG 30 -6.726 9.251 -1.066
227 1HB ARG 30 2HB ARG 30 -7.914 6.941 -2.602
228 2HB ARG 30 3HB ARG 30 -8.939 8.223 -2.061
229 1HG ARG 30 2HG ARG 30 -7.538 9.895 -3.190
230 2HG ARG 30 3HG ARG 30 -6.402 8.622 -3.701
231 1HD ARG 30 2HD ARG 30 -8.130 7.545 -5.028
232 2HD ARG 30 3HD ARG 30 -9.363 8.686 -4.430
233 HE ARG 30 HE ARG 30 -7.343 10.249 -5.573
234 1HH1 ARG 30 2HH2 ARG 30 -9.647 7.815 -6.639
235 2HH1 ARG 30 1HH2 ARG 30 -9.828 8.435 -8.251
236 1HH2 ARG 30 2HH1 ARG 30 -7.569 11.142 -7.702
237 2HH2 ARG 30 1HH1 ARG 30 -8.609 10.386 -8.862
238 H MET 31 H MET 31 -6.471 6.449 0.853
239 HA MET 31 HA MET 31 -8.897 6.843 2.347
240 1HB MET 31 2HB MET 31 -7.977 5.277 3.915
241 2HB MET 31 3HB MET 31 -7.494 4.791 2.291
242 1HG MET 31 2HG MET 31 -5.241 5.787 2.707
243 2HG MET 31 3HG MET 31 -5.726 6.266 4.305
244 1HE MET 31 1HE MET 31 -5.624 1.831 3.216
245 2HE MET 31 2HE MET 31 -7.131 2.753 3.341
246 3HE MET 31 3HE MET 31 -5.925 3.154 2.077
247 HA PRO 32 HA PRO 32 -7.482 10.163 5.155
248 1HB PRO 32 2HB PRO 32 -8.594 9.319 7.536
249 2HB PRO 32 3HB PRO 32 -9.532 10.092 6.231
250 1HG PRO 32 2HG PRO 32 -9.192 7.135 6.786
251 2HG PRO 32 3HG PRO 32 -10.723 8.025 6.526
252 1HD PRO 32 2HD PRO 32 -9.558 6.677 4.521
253 2HD PRO 32 3HD PRO 32 -10.261 8.282 4.194
254 H GLY 33 H GLY 33 -5.533 10.299 6.226
255 1HA GLY 33 2HA GLY 33 -4.016 9.653 7.839
256 2HA GLY 33 3HA GLY 33 -4.434 7.955 7.647
257 H VAL 34 H VAL 34 -4.115 8.019 4.645
258 HA VAL 34 HA VAL 34 -1.160 7.838 4.632
259 HB VAL 34 HB VAL 34 -3.178 6.999 2.552
260 1HG1 VAL 34 1HG1 VAL 34 -0.976 7.496 1.524
261 2HG1 VAL 34 2HG1 VAL 34 -0.156 6.578 2.789
262 3HG1 VAL 34 3HG1 VAL 34 -1.196 5.745 1.615
263 1HG2 VAL 34 1HG2 VAL 34 -2.720 4.738 3.285
264 2HG2 VAL 34 2HG2 VAL 34 -1.503 5.270 4.439
265 3HG2 VAL 34 3HG2 VAL 34 -3.195 5.672 4.723
266 H THR 35 H THR 35 0.168 9.272 3.717
267 HA THR 35 HA THR 35 -1.066 11.603 2.309
268 HB THR 35 HB THR 35 1.218 11.359 4.171
269 HG1 THR 35 1HG THR 35 -1.148 12.921 4.203
270 1HG2 THR 35 1HG2 THR 35 0.439 13.697 2.392
271 2HG2 THR 35 2HG2 THR 35 1.353 13.892 3.906
272 3HG2 THR 35 3HG2 THR 35 2.035 12.927 2.587
273 H ASP 36 H ASP 36 1.515 9.098 2.079
274 HA ASP 36 HA ASP 36 1.308 9.616 -0.720
275 1HB ASP 36 2HB ASP 36 3.508 10.879 0.402
276 2HB ASP 36 3HB ASP 36 4.195 9.329 -0.114
277 H ALA 37 H ALA 37 2.475 7.980 -1.989
278 HA ALA 37 HA ALA 37 2.899 5.401 -0.627
279 1HB ALA 37 1HB ALA 37 0.389 5.613 -0.633
280 2HB ALA 37 2HB ALA 37 0.442 5.683 -2.410
281 3HB ALA 37 3HB ALA 37 0.982 4.228 -1.551
282 H ASN 38 H ASN 38 4.105 3.912 -1.778
283 HA ASN 38 HA ASN 38 4.760 4.558 -4.595
284 1HB ASN 38 2HB ASN 38 7.259 4.370 -3.282
285 2HB ASN 38 3HB ASN 38 6.544 5.756 -4.087
286 1HD2 ASN 38 1HD2 ASN 38 5.916 4.190 -0.864
287 2HD2 ASN 38 2HD2 ASN 38 6.228 5.680 0.023
288 H VAL 39 H VAL 39 4.794 2.622 -5.565
289 HA VAL 39 HA VAL 39 5.233 0.218 -3.959
290 HB VAL 39 HB VAL 39 3.215 0.545 -5.269
291 1HG1 VAL 39 1HG1 VAL 39 3.148 0.242 -7.661
292 2HG1 VAL 39 2HG1 VAL 39 4.125 1.672 -7.306
293 3HG1 VAL 39 3HG1 VAL 39 4.880 0.140 -7.799
294 1HG2 VAL 39 1HG2 VAL 39 4.556 -1.831 -6.470
295 2HG2 VAL 39 2HG2 VAL 39 4.408 -1.730 -4.699
296 3HG2 VAL 39 3HG2 VAL 39 2.961 -1.648 -5.700
297 H ASN 40 H ASN 40 7.373 -0.220 -3.670
298 HA ASN 40 HA ASN 40 9.293 0.316 -5.843
299 1HB ASN 40 2HB ASN 40 9.733 0.880 -3.447
300 2HB ASN 40 3HB ASN 40 9.750 -0.850 -3.074
301 1HD2 ASN 40 1HD2 ASN 40 12.002 0.321 -2.379
302 2HD2 ASN 40 2HD2 ASN 40 13.279 0.103 -3.565
303 H LEU 41 H LEU 41 7.654 -1.291 -6.925
304 HA LEU 41 HA LEU 41 7.950 -4.082 -6.346
305 1HB LEU 41 2HB LEU 41 6.257 -2.451 -7.936
306 2HB LEU 41 3HB LEU 41 7.028 -3.524 -9.081
307 HG LEU 41 HG LEU 41 4.806 -4.216 -8.128
308 1HD1 LEU 41 1HD1 LEU 41 7.112 -6.177 -7.823
309 2HD1 LEU 41 2HD1 LEU 41 5.395 -6.610 -7.950
310 3HD1 LEU 41 3HD1 LEU 41 6.212 -5.817 -9.309
311 1HD2 LEU 41 1HD2 LEU 41 5.535 -3.660 -5.660
312 2HD2 LEU 41 2HD2 LEU 41 4.482 -5.047 -6.002
313 3HD2 LEU 41 3HD2 LEU 41 6.198 -5.297 -5.676
314 H ALA 42 H ALA 42 9.848 -1.852 -8.138
315 HA ALA 42 HA ALA 42 11.457 -3.434 -9.779
316 1HB ALA 42 1HB ALA 42 13.256 -1.868 -9.199
317 2HB ALA 42 2HB ALA 42 11.733 -0.985 -9.456
318 3HB ALA 42 3HB ALA 42 12.331 -1.289 -7.804
319 H THR 43 H THR 43 11.330 -3.319 -6.188
320 HA THR 43 HA THR 43 13.117 -5.697 -6.189
321 HB THR 43 HB THR 43 14.281 -3.703 -5.436
322 HG1 THR 43 1HG THR 43 15.107 -4.750 -3.556
323 1HG2 THR 43 1HG2 THR 43 12.304 -2.679 -4.166
324 2HG2 THR 43 2HG2 THR 43 12.655 -3.832 -2.868
325 3HG2 THR 43 3HG2 THR 43 13.872 -2.640 -3.341
326 H GLU 44 H GLU 44 10.347 -5.686 -6.577
327 HA GLU 44 HA GLU 44 8.319 -6.320 -5.782
328 1HB GLU 44 2HB GLU 44 10.214 -8.426 -4.682
329 2HB GLU 44 3HB GLU 44 8.456 -8.610 -4.807
330 1HG GLU 44 2HG GLU 44 8.601 -8.117 -7.274
331 2HG GLU 44 3HG GLU 44 10.366 -8.195 -7.132
332 H THR 45 H THR 45 9.166 -4.217 -4.088
333 HA THR 45 HA THR 45 8.045 -5.034 -1.441
334 HB THR 45 HB THR 45 10.232 -3.035 -2.191
335 HG1 THR 45 1HG THR 45 10.834 -5.286 -2.132
336 1HG2 THR 45 1HG2 THR 45 9.020 -3.743 0.504
337 2HG2 THR 45 2HG2 THR 45 10.538 -2.845 0.286
338 3HG2 THR 45 3HG2 THR 45 9.021 -2.141 -0.291
339 H VAL 46 H VAL 46 6.775 -3.250 -0.427
340 HA VAL 46 HA VAL 46 6.119 -0.992 -2.251
341 HB VAL 46 HB VAL 46 4.303 -2.532 -2.495
342 1HG1 VAL 46 1HG1 VAL 46 4.067 -2.473 0.542
343 2HG1 VAL 46 2HG1 VAL 46 2.838 -3.138 -0.546
344 3HG1 VAL 46 3HG1 VAL 46 4.433 -3.895 -0.456
345 1HG2 VAL 46 1HG2 VAL 46 3.827 -0.060 -2.284
346 2HG2 VAL 46 2HG2 VAL 46 2.513 -1.198 -1.944
347 3HG2 VAL 46 3HG2 VAL 46 3.326 -0.368 -0.606
348 H ASN 47 H ASN 47 5.695 1.017 -1.205
349 HA ASN 47 HA ASN 47 6.307 1.054 1.678
350 1HB ASN 47 2HB ASN 47 7.556 2.654 -0.600
351 2HB ASN 47 3HB ASN 47 7.452 3.327 1.029
352 1HD2 ASN 47 1HD2 ASN 47 8.269 1.805 2.845
353 2HD2 ASN 47 2HD2 ASN 47 9.887 1.214 2.500
354 H VAL 48 H VAL 48 5.085 2.646 2.829
355 HA VAL 48 HA VAL 48 3.244 4.296 1.233
356 HB VAL 48 HB VAL 48 2.258 2.460 3.450
357 1HG1 VAL 48 1HG1 VAL 48 0.827 4.370 1.538
358 2HG1 VAL 48 2HG1 VAL 48 0.040 3.329 2.734
359 3HG1 VAL 48 3HG1 VAL 48 1.075 4.659 3.269
360 1HG2 VAL 48 1HG2 VAL 48 2.662 1.132 1.399
361 2HG2 VAL 48 2HG2 VAL 48 0.926 1.387 1.614
362 3HG2 VAL 48 3HG2 VAL 48 1.817 2.351 0.425
363 H ILE 49 H ILE 49 3.132 6.257 2.066
364 HA ILE 49 HA ILE 49 4.753 6.787 4.453
365 HB ILE 49 HB ILE 49 3.941 8.759 2.284
366 1HG1 ILE 49 2HG1 ILE 49 5.098 7.079 1.056
367 2HG1 ILE 49 3HG1 ILE 49 6.115 8.500 1.237
368 1HG2 ILE 49 1HG2 ILE 49 5.940 9.990 3.105
369 2HG2 ILE 49 2HG2 ILE 49 4.675 9.799 4.327
370 3HG2 ILE 49 3HG2 ILE 49 6.124 8.784 4.397
371 1HD1 ILE 49 1HD1 ILE 49 7.377 7.371 3.062
372 2HD1 ILE 49 2HD1 ILE 49 6.409 5.899 2.791
373 3HD1 ILE 49 3HD1 ILE 49 7.472 6.518 1.519
374 H TYR 50 H TYR 50 3.275 6.860 6.190
375 HA TYR 50 HA TYR 50 0.772 8.466 5.835
376 1HB TYR 50 2HB TYR 50 -0.596 6.705 6.702
377 2HB TYR 50 3HB TYR 50 0.256 6.182 5.270
378 HD1 TYR 50 HD1 TYR 50 0.013 5.825 8.952
379 HD2 TYR 50 HD2 TYR 50 1.810 4.276 5.364
380 HE1 TYR 50 HE1 TYR 50 0.436 3.665 10.077
381 HE2 TYR 50 HE2 TYR 50 1.946 2.045 6.393
382 HH TYR 50 HH TYR 50 1.399 0.764 8.254
383 H ASP 51 H ASP 51 -0.408 8.723 7.813
384 HA ASP 51 HA ASP 51 1.460 9.444 10.007
385 1HB ASP 51 2HB ASP 51 -0.065 11.143 9.465
386 2HB ASP 51 3HB ASP 51 -1.446 10.047 9.545
387 HA PRO 52 HA PRO 52 0.234 5.420 11.675
388 1HB PRO 52 2HB PRO 52 2.146 5.027 13.525
389 2HB PRO 52 3HB PRO 52 2.495 4.990 11.776
390 1HG PRO 52 2HG PRO 52 2.813 7.361 13.662
391 2HG PRO 52 3HG PRO 52 4.049 6.685 12.559
392 1HD PRO 52 2HD PRO 52 2.486 8.805 11.867
393 2HD PRO 52 3HD PRO 52 2.960 7.566 10.665
394 H ALA 53 H ALA 53 -0.345 8.496 13.008
395 HA ALA 53 HA ALA 53 -1.401 7.454 15.571
396 1HB ALA 53 1HB ALA 53 -1.633 10.180 14.238
397 2HB ALA 53 2HB ALA 53 -2.104 9.754 15.893
398 3HB ALA 53 3HB ALA 53 -0.387 9.738 15.429
399 H GLU 54 H GLU 54 -2.226 8.022 12.198
400 HA GLU 54 HA GLU 54 -5.095 8.126 12.836
401 1HB GLU 54 2HB GLU 54 -3.613 9.877 11.462
402 2HB GLU 54 3HB GLU 54 -4.017 8.830 10.105
403 1HG GLU 54 2HG GLU 54 -6.181 9.897 11.981
404 2HG GLU 54 3HG GLU 54 -5.460 10.927 10.747
405 H THR 55 H THR 55 -2.796 6.785 10.501
406 HA THR 55 HA THR 55 -4.322 4.260 10.393
407 HB THR 55 HB THR 55 -2.710 3.834 8.263
408 HG1 THR 55 1HG THR 55 -3.061 6.613 8.443
409 1HG2 THR 55 1HG2 THR 55 -4.586 4.616 6.936
410 2HG2 THR 55 2HG2 THR 55 -5.112 3.681 8.362
411 3HG2 THR 55 3HG2 THR 55 -5.275 5.471 8.343
412 H GLY 56 H GLY 56 -2.474 2.550 9.710
413 1HA GLY 56 2HA GLY 56 -0.438 1.754 11.297
414 2HA GLY 56 3HA GLY 56 -1.789 1.965 12.440
415 H THR 57 H THR 57 -0.814 0.539 9.610
416 HA THR 57 HA THR 57 -1.654 -0.232 7.890
417 HB THR 57 HB THR 57 0.047 -1.551 7.929
418 HG1 THR 57 1HG THR 57 -1.928 -2.918 7.244
419 1HG2 THR 57 1HG2 THR 57 -1.005 -2.621 10.537
420 2HG2 THR 57 2HG2 THR 57 0.475 -3.236 9.747
421 3HG2 THR 57 3HG2 THR 57 0.383 -1.533 10.249
422 H ALA 58 H ALA 58 -3.754 -1.185 10.416
423 HA ALA 58 HA ALA 58 -5.859 -2.556 9.604
424 1HB ALA 58 1HB ALA 58 -5.730 0.332 10.486
425 2HB ALA 58 2HB ALA 58 -7.194 -0.690 10.594
426 3HB ALA 58 3HB ALA 58 -5.735 -1.086 11.538
427 H ALA 59 H ALA 59 -5.237 0.690 8.202
428 HA ALA 59 HA ALA 59 -7.832 0.416 6.765
429 1HB ALA 59 1HB ALA 59 -7.178 2.598 7.739
430 2HB ALA 59 2HB ALA 59 -5.801 2.632 6.604
431 3HB ALA 59 3HB ALA 59 -7.466 2.677 5.989
432 H ILE 60 H ILE 60 -4.414 0.578 6.159
433 HA ILE 60 HA ILE 60 -4.170 0.229 3.398
434 HB ILE 60 HB ILE 60 -2.573 -0.299 5.860
435 1HG1 ILE 60 2HG1 ILE 60 -1.735 0.855 3.265
436 2HG1 ILE 60 3HG1 ILE 60 -2.867 1.779 4.251
437 1HG2 ILE 60 1HG2 ILE 60 -1.770 -1.525 3.200
438 2HG2 ILE 60 2HG2 ILE 60 -0.699 -1.252 4.594
439 3HG2 ILE 60 3HG2 ILE 60 -2.042 -2.383 4.738
440 1HD1 ILE 60 1HD1 ILE 60 -1.332 1.724 6.190
441 2HD1 ILE 60 2HD1 ILE 60 -0.098 0.924 5.186
442 3HD1 ILE 60 3HD1 ILE 60 -0.648 2.570 4.800
443 H GLN 61 H GLN 61 -4.454 -2.433 5.846
444 HA GLN 61 HA GLN 61 -4.586 -4.400 3.822
445 1HB GLN 61 2HB GLN 61 -4.769 -4.355 6.649
446 2HB GLN 61 3HB GLN 61 -6.183 -5.220 6.051
447 1HG GLN 61 2HG GLN 61 -4.914 -7.042 5.941
448 2HG GLN 61 3HG GLN 61 -4.085 -6.362 4.551
449 1HE2 GLN 61 1HE2 GLN 61 -2.310 -4.602 5.324
450 2HE2 GLN 61 2HE2 GLN 61 -1.353 -5.084 6.719
451 H GLU 62 H GLU 62 -7.229 -2.615 5.470
452 HA GLU 62 HA GLU 62 -9.456 -3.811 4.341
453 1HB GLU 62 2HB GLU 62 -9.096 -1.768 6.025
454 2HB GLU 62 3HB GLU 62 -9.413 -0.783 4.606
455 1HG GLU 62 2HG GLU 62 -11.248 -2.978 5.675
456 2HG GLU 62 3HG GLU 62 -11.385 -1.274 6.099
457 H LYS 63 H LYS 63 -7.669 -0.991 2.961
458 HA LYS 63 HA LYS 63 -9.111 -1.013 0.446
459 1HB LYS 63 2HB LYS 63 -6.669 0.356 1.624
460 2HB LYS 63 3HB LYS 63 -7.132 0.534 -0.038
461 1HG LYS 63 2HG LYS 63 -8.775 1.375 2.396
462 2HG LYS 63 3HG LYS 63 -7.945 2.419 1.229
463 1HD LYS 63 2HD LYS 63 -10.075 2.660 0.451
464 2HD LYS 63 3HD LYS 63 -9.464 1.355 -0.557
465 1HE LYS 63 2HE LYS 63 -11.383 0.283 0.066
466 2HE LYS 63 3HE LYS 63 -10.504 -0.099 1.559
467 1HZ LYS 63 1HZ LYS 63 -12.612 1.800 1.304
468 2HZ LYS 63 2HZ LYS 63 -12.239 0.613 2.427
469 3HZ LYS 63 3HZ LYS 63 -11.423 2.014 2.444
470 H ILE 64 H ILE 64 -6.020 -2.450 1.469
471 HA ILE 64 HA ILE 64 -5.014 -3.114 -0.990
472 HB ILE 64 HB ILE 64 -4.827 -4.035 1.762
473 1HG1 ILE 64 2HG1 ILE 64 -3.350 -2.384 0.566
474 2HG1 ILE 64 3HG1 ILE 64 -2.554 -3.656 1.484
475 1HG2 ILE 64 1HG2 ILE 64 -5.174 -6.207 1.086
476 2HG2 ILE 64 2HG2 ILE 64 -4.146 -6.013 -0.359
477 3HG2 ILE 64 3HG2 ILE 64 -3.434 -6.000 1.278
478 1HD1 ILE 64 1HD1 ILE 64 -2.133 -4.944 -0.529
479 2HD1 ILE 64 2HD1 ILE 64 -2.985 -3.751 -1.529
480 3HD1 ILE 64 3HD1 ILE 64 -1.478 -3.300 -0.697
481 H GLU 65 H GLU 65 -7.250 -4.953 1.170
482 HA GLU 65 HA GLU 65 -7.966 -7.060 -0.579
483 1HB GLU 65 2HB GLU 65 -9.268 -5.762 1.839
484 2HB GLU 65 3HB GLU 65 -10.075 -7.069 0.971
485 1HG GLU 65 2HG GLU 65 -7.220 -7.415 1.896
486 2HG GLU 65 3HG GLU 65 -8.574 -7.662 3.003
487 H LYS 66 H LYS 66 -9.861 -4.060 0.161
488 HA LYS 66 HA LYS 66 -11.919 -4.621 -1.647
489 1HB LYS 66 2HB LYS 66 -11.022 -2.315 -0.134
490 2HB LYS 66 3HB LYS 66 -11.679 -1.798 -1.673
491 1HG LYS 66 2HG LYS 66 -13.817 -2.375 -1.167
492 2HG LYS 66 3HG LYS 66 -13.364 -3.863 -0.305
493 1HD LYS 66 2HD LYS 66 -12.483 -2.581 1.548
494 2HD LYS 66 3HD LYS 66 -12.965 -1.072 0.767
495 1HE LYS 66 2HE LYS 66 -14.703 -1.313 2.228
496 2HE LYS 66 3HE LYS 66 -15.401 -2.069 0.783
497 1HZ LYS 66 1HZ LYS 66 -15.710 -3.375 2.806
498 2HZ LYS 66 2HZ LYS 66 -14.684 -4.214 1.813
499 3HZ LYS 66 3HZ LYS 66 -14.092 -3.342 3.088
500 H LEU 67 H LEU 67 -8.850 -3.006 -2.341
501 HA LEU 67 HA LEU 67 -9.477 -2.277 -5.058
502 1HB LEU 67 2HB LEU 67 -6.911 -2.528 -3.467
503 2HB LEU 67 3HB LEU 67 -6.918 -2.051 -5.160
504 HG LEU 67 HG LEU 67 -8.705 -0.563 -3.208
505 1HD1 LEU 67 1HD1 LEU 67 -6.523 -0.451 -2.138
506 2HD1 LEU 67 2HD1 LEU 67 -5.750 -0.085 -3.667
507 3HD1 LEU 67 3HD1 LEU 67 -6.851 1.097 -2.928
508 1HD2 LEU 67 1HD2 LEU 67 -8.352 1.273 -4.820
509 2HD2 LEU 67 2HD2 LEU 67 -7.242 0.262 -5.763
510 3HD2 LEU 67 3HD2 LEU 67 -8.962 -0.156 -5.664
511 H GLY 68 H GLY 68 -8.724 -5.298 -3.561
512 1HA GLY 68 2HA GLY 68 -9.073 -7.324 -4.591
513 2HA GLY 68 3HA GLY 68 -8.799 -6.620 -6.190
514 H TYR 69 H TYR 69 -6.737 -6.417 -3.212
515 HA TYR 69 HA TYR 69 -4.602 -7.986 -4.577
516 1HB TYR 69 2HB TYR 69 -4.742 -5.115 -4.189
517 2HB TYR 69 3HB TYR 69 -3.485 -5.755 -3.155
518 HD1 TYR 69 HD1 TYR 69 -4.773 -5.828 -6.676
519 HD2 TYR 69 HD2 TYR 69 -1.399 -6.465 -4.072
520 HE1 TYR 69 HE1 TYR 69 -3.284 -5.887 -8.626
521 HE2 TYR 69 HE2 TYR 69 0.104 -6.297 -5.990
522 HH TYR 69 HH TYR 69 0.290 -6.046 -8.248
523 H HIS 70 H HIS 70 -2.691 -8.198 -2.906
524 HA HIS 70 HA HIS 70 -3.650 -8.315 -0.138
525 1HB HIS 70 2HB HIS 70 -4.126 -10.525 -1.310
526 2HB HIS 70 3HB HIS 70 -2.385 -10.730 -1.486
527 HD1 HIS 70 1HD HIS 70 -2.996 -13.010 -0.011
528 HD2 HIS 70 2HD HIS 70 -3.574 -9.314 1.912
529 HE1 HIS 70 1HE HIS 70 -3.288 -13.504 2.474
530 H VAL 71 H VAL 71 -1.893 -8.265 1.360
531 HA VAL 71 HA VAL 71 0.790 -7.608 0.268
532 HB VAL 71 HB VAL 71 -1.051 -6.040 1.977
533 1HG1 VAL 71 1HG1 VAL 71 1.829 -6.254 2.916
534 2HG1 VAL 71 2HG1 VAL 71 0.604 -5.084 3.452
535 3HG1 VAL 71 3HG1 VAL 71 0.390 -6.794 3.819
536 1HG2 VAL 71 1HG2 VAL 71 1.565 -5.208 0.673
537 2HG2 VAL 71 2HG2 VAL 71 0.046 -5.340 -0.215
538 3HG2 VAL 71 3HG2 VAL 71 0.194 -4.187 1.128
539 H VAL 72 H VAL 72 2.501 -8.237 1.696
540 HA VAL 72 HA VAL 72 1.809 -10.394 3.627
541 HB VAL 72 HB VAL 72 3.988 -10.495 1.600
542 1HG1 VAL 72 1HG1 VAL 72 4.686 -11.621 3.660
543 2HG1 VAL 72 2HG1 VAL 72 3.142 -12.502 3.725
544 3HG1 VAL 72 3HG1 VAL 72 4.310 -12.826 2.430
545 1HG2 VAL 72 1HG2 VAL 72 2.711 -12.454 0.698
546 2HG2 VAL 72 2HG2 VAL 72 1.392 -12.076 1.824
547 3HG2 VAL 72 3HG2 VAL 72 1.820 -10.936 0.532
548 H ILE 73 H ILE 73 3.180 -10.524 5.357
549 HA ILE 73 HA ILE 73 4.805 -8.067 5.921
550 HB ILE 73 HB ILE 73 3.146 -9.654 7.877
551 1HG1 ILE 73 2HG1 ILE 73 1.621 -8.504 6.381
552 2HG1 ILE 73 3HG1 ILE 73 1.690 -7.756 7.967
553 1HG2 ILE 73 1HG2 ILE 73 5.042 -8.608 8.985
554 2HG2 ILE 73 2HG2 ILE 73 4.793 -7.091 8.118
555 3HG2 ILE 73 3HG2 ILE 73 3.613 -7.638 9.328
556 1HD1 ILE 73 1HD1 ILE 73 1.549 -6.046 6.260
557 2HD1 ILE 73 2HD1 ILE 73 3.111 -5.922 7.081
558 3HD1 ILE 73 3HD1 ILE 73 3.003 -6.658 5.466
559 H GLU 74 H GLU 74 6.644 -9.428 4.969
560 HA GLU 74 HA GLU 74 7.564 -11.560 6.497
561 1HB GLU 74 2HB GLU 74 8.822 -9.760 4.413
562 2HB GLU 74 3HB GLU 74 9.702 -11.056 5.198
563 1HG GLU 74 2HG GLU 74 7.920 -12.682 4.461
564 2HG GLU 74 3HG GLU 74 7.226 -11.388 3.466
565 H GLY 75 H GLY 75 7.374 -8.485 7.377
566 1HA GLY 75 2HA GLY 75 8.280 -7.164 9.081
567 2HA GLY 75 3HA GLY 75 8.920 -8.668 9.764
568 H ARG 76 H ARG 76 9.579 -6.043 7.383
569 HA ARG 76 HA ARG 76 12.431 -6.737 7.289
570 1HB ARG 76 2HB ARG 76 10.876 -7.889 5.534
571 2HB ARG 76 3HB ARG 76 10.669 -6.286 4.838
572 1HG ARG 76 2HG ARG 76 13.298 -7.820 5.162
573 2HG ARG 76 3HG ARG 76 12.304 -7.749 3.704
574 1HD ARG 76 2HD ARG 76 13.811 -6.090 3.141
575 2HD ARG 76 3HD ARG 76 12.571 -5.138 3.937
576 HE ARG 76 HE ARG 76 13.898 -4.746 5.759
577 1HH1 ARG 76 2HH2 ARG 76 15.330 -7.349 3.920
578 2HH1 ARG 76 1HH2 ARG 76 16.918 -7.247 4.622
579 1HH2 ARG 76 2HH1 ARG 76 15.965 -4.488 6.699
580 2HH2 ARG 76 1HH1 ARG 76 17.293 -5.540 6.287
Start of MODEL 29
1 1H MET 1 H1 MET 1 4.277 16.143 15.448
2 2H MET 1 H2 MET 1 5.076 16.112 16.886
3 3H MET 1 H3 MET 1 3.833 15.148 16.612
4 HA MET 1 HA MET 1 3.052 17.020 17.981
5 1HB MET 1 2HB MET 1 4.694 18.557 15.971
6 2HB MET 1 3HB MET 1 3.252 19.344 16.621
7 1HG MET 1 2HG MET 1 4.010 19.075 18.893
8 2HG MET 1 3HG MET 1 5.519 18.323 18.337
9 1HE MET 1 1HE MET 1 6.662 20.273 19.935
10 2HE MET 1 2HE MET 1 6.427 22.010 19.625
11 3HE MET 1 3HE MET 1 5.075 21.031 20.236
12 H LEU 2 H LEU 2 2.756 18.393 14.729
13 HA LEU 2 HA LEU 2 -0.040 17.599 14.367
14 1HB LEU 2 2HB LEU 2 2.027 19.200 12.940
15 2HB LEU 2 3HB LEU 2 1.169 18.117 11.859
16 HG LEU 2 HG LEU 2 -1.007 19.013 12.659
17 1HD1 LEU 2 1HD1 LEU 2 -1.013 21.159 13.912
18 2HD1 LEU 2 2HD1 LEU 2 -0.327 19.858 14.896
19 3HD1 LEU 2 3HD1 LEU 2 0.747 21.044 14.127
20 1HD2 LEU 2 1HD2 LEU 2 -0.810 21.141 11.435
21 2HD2 LEU 2 2HD2 LEU 2 0.960 21.082 11.585
22 3HD2 LEU 2 3HD2 LEU 2 0.105 19.861 10.618
23 H SER 3 H SER 3 -0.450 16.210 12.249
24 HA SER 3 HA SER 3 0.128 13.644 12.421
25 1HB SER 3 2HB SER 3 0.090 15.212 9.797
26 2HB SER 3 3HB SER 3 -0.396 13.534 10.031
27 HG SER 3 HG SER 3 -2.102 14.223 11.286
28 H GLU 4 H GLU 4 2.068 12.698 12.796
29 HA GLU 4 HA GLU 4 4.520 13.588 11.435
30 1HB GLU 4 2HB GLU 4 3.832 11.556 13.500
31 2HB GLU 4 3HB GLU 4 5.403 11.646 12.768
32 1HG GLU 4 2HG GLU 4 5.817 13.782 13.565
33 2HG GLU 4 3HG GLU 4 4.128 14.045 13.981
34 H GLN 5 H GLN 5 5.614 11.864 10.114
35 HA GLN 5 HA GLN 5 3.682 10.066 8.729
36 1HB GLN 5 2HB GLN 5 5.673 12.009 7.554
37 2HB GLN 5 3HB GLN 5 4.966 10.696 6.621
38 1HG GLN 5 2HG GLN 5 3.146 12.662 8.101
39 2HG GLN 5 3HG GLN 5 3.858 13.065 6.552
40 1HE2 GLN 5 1HE2 GLN 5 3.598 11.348 4.832
41 2HE2 GLN 5 2HE2 GLN 5 2.147 10.356 4.764
42 H LYS 6 H LYS 6 4.586 8.146 7.960
43 HA LYS 6 HA LYS 6 7.455 7.717 8.242
44 1HB LYS 6 2HB LYS 6 6.566 7.096 10.401
45 2HB LYS 6 3HB LYS 6 5.348 6.024 9.658
46 1HG LYS 6 2HG LYS 6 7.113 4.606 8.800
47 2HG LYS 6 3HG LYS 6 8.360 5.758 9.353
48 1HD LYS 6 2HD LYS 6 7.579 5.354 11.716
49 2HD LYS 6 3HD LYS 6 6.444 4.144 11.093
50 1HE LYS 6 2HE LYS 6 8.617 3.073 9.981
51 2HE LYS 6 3HE LYS 6 9.495 4.125 11.092
52 1HZ LYS 6 1HZ LYS 6 9.269 2.138 12.205
53 2HZ LYS 6 2HZ LYS 6 8.043 3.025 12.852
54 3HZ LYS 6 3HZ LYS 6 7.722 1.879 11.712
55 H GLU 7 H GLU 7 8.128 5.906 7.201
56 HA GLU 7 HA GLU 7 6.647 5.200 4.745
57 1HB GLU 7 2HB GLU 7 9.609 4.929 4.815
58 2HB GLU 7 3HB GLU 7 8.522 5.525 3.585
59 1HG GLU 7 2HG GLU 7 9.825 7.364 4.150
60 2HG GLU 7 3HG GLU 7 8.382 7.687 5.110
61 H ILE 8 H ILE 8 5.721 3.258 5.502
62 HA ILE 8 HA ILE 8 7.434 1.322 6.910
63 HB ILE 8 HB ILE 8 4.601 1.186 6.039
64 1HG1 ILE 8 2HG1 ILE 8 4.753 3.054 7.617
65 2HG1 ILE 8 3HG1 ILE 8 3.834 1.673 8.232
66 1HG2 ILE 8 1HG2 ILE 8 6.338 -0.446 7.802
67 2HG2 ILE 8 2HG2 ILE 8 4.546 -0.560 7.864
68 3HG2 ILE 8 3HG2 ILE 8 5.410 -0.947 6.360
69 1HD1 ILE 8 1HD1 ILE 8 5.674 0.867 9.493
70 2HD1 ILE 8 2HD1 ILE 8 6.723 2.152 8.838
71 3HD1 ILE 8 3HD1 ILE 8 5.347 2.563 9.913
72 H ALA 9 H ALA 9 7.450 -0.898 5.909
73 HA ALA 9 HA ALA 9 7.475 -0.924 2.955
74 1HB ALA 9 1HB ALA 9 9.626 -2.097 2.968
75 2HB ALA 9 2HB ALA 9 9.824 -0.504 3.730
76 3HB ALA 9 3HB ALA 9 9.726 -1.959 4.736
77 H MET 10 H MET 10 6.584 -2.894 2.224
78 HA MET 10 HA MET 10 6.707 -5.270 3.889
79 1HB MET 10 2HB MET 10 4.265 -5.622 4.005
80 2HB MET 10 3HB MET 10 4.821 -4.300 5.013
81 1HG MET 10 2HG MET 10 3.691 -3.880 2.248
82 2HG MET 10 3HG MET 10 2.662 -3.996 3.668
83 1HE MET 10 1HE MET 10 1.979 -2.191 5.190
84 2HE MET 10 2HE MET 10 3.562 -2.458 5.959
85 3HE MET 10 3HE MET 10 3.005 -0.802 5.600
86 H GLN 11 H GLN 11 5.287 -7.075 2.674
87 HA GLN 11 HA GLN 11 6.455 -7.081 -0.071
88 1HB GLN 11 2HB GLN 11 6.031 -9.050 2.124
89 2HB GLN 11 3HB GLN 11 5.529 -9.641 0.548
90 1HG GLN 11 2HG GLN 11 8.222 -8.338 0.564
91 2HG GLN 11 3HG GLN 11 8.057 -9.808 1.517
92 1HE2 GLN 11 1HE2 GLN 11 8.176 -8.573 -1.791
93 2HE2 GLN 11 2HE2 GLN 11 7.997 -10.148 -2.540
94 H VAL 12 H VAL 12 5.120 -8.343 -1.727
95 HA VAL 12 HA VAL 12 2.239 -7.557 -1.503
96 HB VAL 12 HB VAL 12 4.063 -7.221 -3.917
97 1HG1 VAL 12 1HG1 VAL 12 1.724 -7.571 -4.568
98 2HG1 VAL 12 2HG1 VAL 12 1.180 -6.370 -3.373
99 3HG1 VAL 12 3HG1 VAL 12 2.139 -5.869 -4.780
100 1HG2 VAL 12 1HG2 VAL 12 2.996 -5.166 -1.937
101 2HG2 VAL 12 2HG2 VAL 12 4.707 -5.561 -2.229
102 3HG2 VAL 12 3HG2 VAL 12 3.761 -4.768 -3.487
103 H SER 13 H SER 13 0.754 -8.941 -2.519
104 HA SER 13 HA SER 13 1.811 -11.314 -3.988
105 1HB SER 13 2HB SER 13 -0.333 -11.219 -1.825
106 2HB SER 13 3HB SER 13 -0.094 -12.599 -2.915
107 HG SER 13 HG SER 13 2.194 -11.650 -1.680
108 H GLY 14 H GLY 14 -0.095 -12.284 -5.306
109 1HA GLY 14 2HA GLY 14 -1.874 -12.025 -6.750
110 2HA GLY 14 3HA GLY 14 -2.216 -10.426 -6.083
111 H MET 15 H MET 15 0.397 -9.289 -6.514
112 HA MET 15 HA MET 15 0.227 -8.098 -8.886
113 1HB MET 15 2HB MET 15 2.615 -7.532 -8.754
114 2HB MET 15 3HB MET 15 1.764 -7.378 -7.233
115 1HG MET 15 2HG MET 15 3.753 -8.363 -6.573
116 2HG MET 15 3HG MET 15 2.692 -9.764 -6.672
117 1HE MET 15 1HE MET 15 6.200 -11.209 -7.622
118 2HE MET 15 2HE MET 15 5.836 -9.961 -6.412
119 3HE MET 15 3HE MET 15 4.775 -11.382 -6.574
120 H THR 16 H THR 16 0.868 -8.168 -10.900
121 HA THR 16 HA THR 16 2.420 -10.351 -12.109
122 HB THR 16 HB THR 16 0.416 -10.434 -13.863
123 HG1 THR 16 1HG THR 16 -1.011 -10.017 -11.451
124 1HG2 THR 16 1HG2 THR 16 0.170 -11.984 -11.249
125 2HG2 THR 16 2HG2 THR 16 -0.525 -12.408 -12.821
126 3HG2 THR 16 3HG2 THR 16 1.234 -12.408 -12.607
127 H CYS 17 H CYS 17 0.070 -7.824 -12.986
128 HA CYS 17 HA CYS 17 1.418 -6.820 -15.209
129 1HB CYS 17 2HB CYS 17 -0.352 -5.187 -13.351
130 2HB CYS 17 3HB CYS 17 -0.082 -4.918 -15.079
131 H ALA 18 H ALA 18 2.071 -6.145 -11.858
132 HA ALA 18 HA ALA 18 3.439 -4.797 -10.717
133 1HB ALA 18 1HB ALA 18 5.382 -3.760 -11.676
134 2HB ALA 18 2HB ALA 18 5.208 -5.396 -12.334
135 3HB ALA 18 3HB ALA 18 4.786 -3.984 -13.325
136 H ALA 19 H ALA 19 2.621 -3.041 -13.742
137 HA ALA 19 HA ALA 19 2.373 -0.456 -12.742
138 1HB ALA 19 1HB ALA 19 0.655 -1.805 -14.870
139 2HB ALA 19 2HB ALA 19 0.860 -0.054 -14.649
140 3HB ALA 19 3HB ALA 19 2.243 -1.055 -15.126
141 H CYS 20 H CYS 20 -0.201 -2.972 -12.806
142 HA CYS 20 HA CYS 20 -2.219 -1.448 -11.625
143 1HB CYS 20 2HB CYS 20 -1.664 -4.437 -11.561
144 2HB CYS 20 3HB CYS 20 -3.166 -3.715 -10.961
145 H ALA 21 H ALA 21 0.570 -2.918 -10.045
146 HA ALA 21 HA ALA 21 -0.512 -2.723 -7.383
147 1HB ALA 21 1HB ALA 21 1.452 -4.175 -8.206
148 2HB ALA 21 2HB ALA 21 2.430 -2.698 -8.073
149 3HB ALA 21 3HB ALA 21 1.589 -3.366 -6.649
150 H ALA 22 H ALA 22 0.628 -0.320 -9.698
151 HA ALA 22 HA ALA 22 1.261 1.671 -7.645
152 1HB ALA 22 1HB ALA 22 1.244 3.261 -9.431
153 2HB ALA 22 2HB ALA 22 2.118 1.822 -9.997
154 3HB ALA 22 3HB ALA 22 0.452 2.133 -10.541
155 H ARG 23 H ARG 23 -1.539 0.659 -9.638
156 HA ARG 23 HA ARG 23 -3.269 2.809 -8.927
157 1HB ARG 23 2HB ARG 23 -3.900 -0.017 -9.847
158 2HB ARG 23 3HB ARG 23 -5.111 1.250 -9.643
159 1HG ARG 23 2HG ARG 23 -4.174 2.623 -11.361
160 2HG ARG 23 3HG ARG 23 -2.652 1.733 -11.350
161 1HD ARG 23 2HD ARG 23 -3.689 1.052 -13.313
162 2HD ARG 23 3HD ARG 23 -3.874 -0.302 -12.181
163 HE ARG 23 HE ARG 23 -6.190 1.347 -12.052
164 1HH1 ARG 23 2HH2 ARG 23 -4.565 -1.113 -14.014
165 2HH1 ARG 23 1HH2 ARG 23 -5.918 -1.437 -15.039
166 1HH2 ARG 23 2HH1 ARG 23 -8.068 0.867 -13.362
167 2HH2 ARG 23 1HH1 ARG 23 -7.977 -0.332 -14.610
168 H ILE 24 H ILE 24 -2.691 -0.401 -7.368
169 HA ILE 24 HA ILE 24 -4.657 0.051 -5.397
170 HB ILE 24 HB ILE 24 -3.898 -1.617 -4.072
171 1HG1 ILE 24 2HG1 ILE 24 -1.266 -1.258 -5.359
172 2HG1 ILE 24 3HG1 ILE 24 -1.689 -1.162 -3.640
173 1HG2 ILE 24 1HG2 ILE 24 -3.958 -3.403 -5.556
174 2HG2 ILE 24 2HG2 ILE 24 -4.760 -2.118 -6.452
175 3HG2 ILE 24 3HG2 ILE 24 -3.079 -2.544 -6.843
176 1HD1 ILE 24 1HD1 ILE 24 -1.454 -3.641 -5.371
177 2HD1 ILE 24 2HD1 ILE 24 -0.397 -3.169 -4.041
178 3HD1 ILE 24 3HD1 ILE 24 -2.073 -3.650 -3.694
179 H GLU 25 H GLU 25 -1.122 0.701 -5.001
180 HA GLU 25 HA GLU 25 -1.213 2.159 -2.668
181 1HB GLU 25 2HB GLU 25 0.523 2.195 -5.115
182 2HB GLU 25 3HB GLU 25 0.699 3.550 -3.995
183 1HG GLU 25 2HG GLU 25 2.246 1.590 -3.573
184 2HG GLU 25 3HG GLU 25 1.310 2.122 -2.182
185 H LYS 26 H LYS 26 -2.109 3.470 -5.879
186 HA LYS 26 HA LYS 26 -2.409 6.167 -4.750
187 1HB LYS 26 2HB LYS 26 -3.576 5.136 -7.345
188 2HB LYS 26 3HB LYS 26 -3.365 6.818 -6.854
189 1HG LYS 26 2HG LYS 26 -1.204 4.811 -7.523
190 2HG LYS 26 3HG LYS 26 -1.686 6.203 -8.474
191 1HD LYS 26 2HD LYS 26 -0.649 7.725 -6.904
192 2HD LYS 26 3HD LYS 26 -0.499 6.472 -5.667
193 1HE LYS 26 2HE LYS 26 1.670 6.909 -6.659
194 2HE LYS 26 3HE LYS 26 1.145 5.237 -6.868
195 1HZ LYS 26 1HZ LYS 26 2.118 6.129 -8.859
196 2HZ LYS 26 2HZ LYS 26 0.542 5.754 -9.126
197 3HZ LYS 26 3HZ LYS 26 0.998 7.328 -8.943
198 H GLY 27 H GLY 27 -4.769 3.574 -5.580
199 1HA GLY 27 2HA GLY 27 -7.077 5.038 -4.662
200 2HA GLY 27 3HA GLY 27 -6.933 3.285 -4.841
201 H LEU 28 H LEU 28 -4.584 3.147 -3.082
202 HA LEU 28 HA LEU 28 -5.816 2.783 -0.493
203 1HB LEU 28 2HB LEU 28 -4.096 1.397 -1.425
204 2HB LEU 28 3HB LEU 28 -2.931 2.720 -1.389
205 HG LEU 28 HG LEU 28 -4.316 1.791 1.131
206 1HD1 LEU 28 1HD1 LEU 28 -3.464 -0.192 0.039
207 2HD1 LEU 28 2HD1 LEU 28 -1.873 0.567 -0.186
208 3HD1 LEU 28 3HD1 LEU 28 -2.461 0.180 1.443
209 1HD2 LEU 28 1HD2 LEU 28 -2.192 2.632 2.144
210 2HD2 LEU 28 2HD2 LEU 28 -1.588 3.046 0.530
211 3HD2 LEU 28 3HD2 LEU 28 -2.990 3.890 1.220
212 H LYS 29 H LYS 29 -3.327 5.086 -1.745
213 HA LYS 29 HA LYS 29 -3.103 6.718 0.456
214 1HB LYS 29 2HB LYS 29 -1.726 6.904 -1.572
215 2HB LYS 29 3HB LYS 29 -3.104 7.570 -2.451
216 1HG LYS 29 2HG LYS 29 -2.849 9.238 -0.137
217 2HG LYS 29 3HG LYS 29 -1.228 8.857 -0.575
218 1HD LYS 29 2HD LYS 29 -3.207 9.789 -2.708
219 2HD LYS 29 3HD LYS 29 -2.477 10.949 -1.580
220 1HE LYS 29 2HE LYS 29 -0.306 10.484 -2.205
221 2HE LYS 29 3HE LYS 29 -0.695 9.014 -3.132
222 1HZ LYS 29 1HZ LYS 29 -0.045 10.924 -4.340
223 2HZ LYS 29 2HZ LYS 29 -1.613 10.542 -4.759
224 3HZ LYS 29 3HZ LYS 29 -1.288 11.831 -3.765
225 H ARG 30 H ARG 30 -5.796 6.691 -1.848
226 HA ARG 30 HA ARG 30 -6.958 9.123 -1.087
227 1HB ARG 30 2HB ARG 30 -7.729 6.787 -2.623
228 2HB ARG 30 3HB ARG 30 -9.103 7.295 -1.658
229 1HG ARG 30 2HG ARG 30 -7.447 9.122 -3.460
230 2HG ARG 30 3HG ARG 30 -8.937 8.299 -3.950
231 1HD ARG 30 2HD ARG 30 -10.191 9.453 -2.151
232 2HD ARG 30 3HD ARG 30 -8.722 10.338 -1.687
233 HE ARG 30 HE ARG 30 -9.181 10.709 -4.469
234 1HH1 ARG 30 2HH2 ARG 30 -10.528 11.631 -1.353
235 2HH1 ARG 30 1HH2 ARG 30 -11.237 13.120 -1.898
236 1HH2 ARG 30 2HH1 ARG 30 -10.107 12.684 -5.258
237 2HH2 ARG 30 1HH1 ARG 30 -10.981 13.729 -4.189
238 H MET 31 H MET 31 -6.626 6.390 1.001
239 HA MET 31 HA MET 31 -8.962 6.824 2.605
240 1HB MET 31 2HB MET 31 -7.937 5.284 4.147
241 2HB MET 31 3HB MET 31 -7.502 4.791 2.512
242 1HG MET 31 2HG MET 31 -5.271 5.798 2.795
243 2HG MET 31 3HG MET 31 -5.686 6.319 4.412
244 1HE MET 31 1HE MET 31 -5.457 1.879 3.338
245 2HE MET 31 2HE MET 31 -7.012 2.721 3.424
246 3HE MET 31 3HE MET 31 -5.787 3.180 2.193
247 HA PRO 32 HA PRO 32 -7.491 10.228 5.249
248 1HB PRO 32 2HB PRO 32 -8.404 9.473 7.727
249 2HB PRO 32 3HB PRO 32 -9.476 10.124 6.451
250 1HG PRO 32 2HG PRO 32 -8.956 7.209 7.106
251 2HG PRO 32 3HG PRO 32 -10.542 8.016 6.923
252 1HD PRO 32 2HD PRO 32 -9.460 6.642 4.889
253 2HD PRO 32 3HD PRO 32 -10.252 8.201 4.554
254 H GLY 33 H GLY 33 -5.527 10.502 6.317
255 1HA GLY 33 2HA GLY 33 -3.896 10.009 7.838
256 2HA GLY 33 3HA GLY 33 -4.379 8.320 7.893
257 H VAL 34 H VAL 34 -4.150 8.150 4.776
258 HA VAL 34 HA VAL 34 -1.174 7.984 4.675
259 HB VAL 34 HB VAL 34 -3.259 7.103 2.684
260 1HG1 VAL 34 1HG1 VAL 34 -1.113 7.591 1.569
261 2HG1 VAL 34 2HG1 VAL 34 -0.225 6.701 2.815
262 3HG1 VAL 34 3HG1 VAL 34 -1.296 5.838 1.701
263 1HG2 VAL 34 1HG2 VAL 34 -2.767 4.846 3.399
264 2HG2 VAL 34 2HG2 VAL 34 -1.543 5.377 4.535
265 3HG2 VAL 34 3HG2 VAL 34 -3.227 5.780 4.844
266 H THR 35 H THR 35 0.093 9.376 3.489
267 HA THR 35 HA THR 35 -1.377 11.584 2.107
268 HB THR 35 HB THR 35 0.455 11.781 4.201
269 HG1 THR 35 1HG THR 35 -0.530 13.681 2.361
270 1HG2 THR 35 1HG2 THR 35 1.690 12.917 1.647
271 2HG2 THR 35 2HG2 THR 35 2.228 13.191 3.313
272 3HG2 THR 35 3HG2 THR 35 2.365 11.573 2.603
273 H ASP 36 H ASP 36 1.400 9.278 1.776
274 HA ASP 36 HA ASP 36 0.829 9.268 -1.043
275 1HB ASP 36 2HB ASP 36 3.232 10.681 -0.105
276 2HB ASP 36 3HB ASP 36 3.611 9.342 -1.183
277 H ALA 37 H ALA 37 2.103 7.627 -2.180
278 HA ALA 37 HA ALA 37 3.017 5.431 -0.595
279 1HB ALA 37 1HB ALA 37 0.447 5.315 -0.331
280 2HB ALA 37 2HB ALA 37 0.392 4.927 -2.055
281 3HB ALA 37 3HB ALA 37 1.243 3.854 -0.912
282 H ASN 38 H ASN 38 3.942 3.690 -1.881
283 HA ASN 38 HA ASN 38 4.372 4.304 -4.737
284 1HB ASN 38 2HB ASN 38 6.997 4.253 -3.692
285 2HB ASN 38 3HB ASN 38 6.147 5.608 -4.411
286 1HD2 ASN 38 1HD2 ASN 38 5.892 4.013 -1.167
287 2HD2 ASN 38 2HD2 ASN 38 6.224 5.503 -0.284
288 H VAL 39 H VAL 39 4.449 2.331 -5.639
289 HA VAL 39 HA VAL 39 5.064 0.023 -3.974
290 HB VAL 39 HB VAL 39 3.052 0.211 -5.339
291 1HG1 VAL 39 1HG1 VAL 39 4.020 1.255 -7.410
292 2HG1 VAL 39 2HG1 VAL 39 4.755 -0.314 -7.811
293 3HG1 VAL 39 3HG1 VAL 39 3.022 -0.173 -7.698
294 1HG2 VAL 39 1HG2 VAL 39 4.470 -2.188 -6.380
295 2HG2 VAL 39 2HG2 VAL 39 4.345 -1.984 -4.617
296 3HG2 VAL 39 3HG2 VAL 39 2.886 -2.006 -5.598
297 H ASN 40 H ASN 40 7.236 -0.379 -3.690
298 HA ASN 40 HA ASN 40 9.123 0.193 -5.894
299 1HB ASN 40 2HB ASN 40 9.573 0.837 -3.513
300 2HB ASN 40 3HB ASN 40 9.663 -0.885 -3.103
301 1HD2 ASN 40 1HD2 ASN 40 11.881 0.353 -2.469
302 2HD2 ASN 40 2HD2 ASN 40 13.145 0.151 -3.674
303 H LEU 41 H LEU 41 7.505 -1.520 -6.892
304 HA LEU 41 HA LEU 41 7.919 -4.269 -6.186
305 1HB LEU 41 2HB LEU 41 6.137 -2.801 -7.820
306 2HB LEU 41 3HB LEU 41 6.955 -3.866 -8.939
307 HG LEU 41 HG LEU 41 4.783 -4.655 -7.939
308 1HD1 LEU 41 1HD1 LEU 41 5.516 -6.998 -7.700
309 2HD1 LEU 41 2HD1 LEU 41 6.317 -6.207 -9.068
310 3HD1 LEU 41 3HD1 LEU 41 7.202 -6.474 -7.551
311 1HD2 LEU 41 1HD2 LEU 41 6.259 -5.560 -5.463
312 2HD2 LEU 41 2HD2 LEU 41 5.489 -3.970 -5.502
313 3HD2 LEU 41 3HD2 LEU 41 4.528 -5.433 -5.783
314 H ALA 42 H ALA 42 9.719 -2.065 -8.104
315 HA ALA 42 HA ALA 42 11.359 -3.677 -9.679
316 1HB ALA 42 1HB ALA 42 12.170 -1.362 -7.875
317 2HB ALA 42 2HB ALA 42 13.103 -2.002 -9.239
318 3HB ALA 42 3HB ALA 42 11.536 -1.216 -9.535
319 H THR 43 H THR 43 11.334 -3.372 -6.084
320 HA THR 43 HA THR 43 13.330 -5.604 -6.027
321 HB THR 43 HB THR 43 14.277 -3.553 -5.154
322 HG1 THR 43 1HG THR 43 13.756 -5.661 -3.352
323 1HG2 THR 43 1HG2 THR 43 12.307 -3.804 -2.834
324 2HG2 THR 43 2HG2 THR 43 13.562 -2.576 -3.063
325 3HG2 THR 43 3HG2 THR 43 12.146 -2.614 -4.132
326 H GLU 44 H GLU 44 10.329 -5.625 -6.293
327 HA GLU 44 HA GLU 44 8.519 -6.590 -5.446
328 1HB GLU 44 2HB GLU 44 10.557 -8.410 -5.510
329 2HB GLU 44 3HB GLU 44 10.014 -8.586 -3.847
330 1HG GLU 44 2HG GLU 44 7.618 -8.754 -4.869
331 2HG GLU 44 3HG GLU 44 8.429 -8.915 -6.443
332 H THR 45 H THR 45 9.000 -4.331 -3.940
333 HA THR 45 HA THR 45 7.761 -5.156 -1.390
334 HB THR 45 HB THR 45 9.971 -3.059 -1.676
335 HG1 THR 45 1HG THR 45 10.150 -5.842 -1.415
336 1HG2 THR 45 1HG2 THR 45 8.531 -2.986 0.321
337 2HG2 THR 45 2HG2 THR 45 8.887 -4.719 0.607
338 3HG2 THR 45 3HG2 THR 45 10.187 -3.502 0.739
339 H VAL 46 H VAL 46 6.448 -3.440 -0.439
340 HA VAL 46 HA VAL 46 5.859 -1.156 -2.279
341 HB VAL 46 HB VAL 46 3.981 -2.669 -2.341
342 1HG1 VAL 46 1HG1 VAL 46 3.842 -2.372 0.674
343 2HG1 VAL 46 2HG1 VAL 46 2.643 -3.192 -0.341
344 3HG1 VAL 46 3HG1 VAL 46 4.262 -3.876 -0.191
345 1HG2 VAL 46 1HG2 VAL 46 3.461 -0.275 -2.359
346 2HG2 VAL 46 2HG2 VAL 46 2.220 -1.228 -1.516
347 3HG2 VAL 46 3HG2 VAL 46 3.353 -0.254 -0.583
348 H ASN 47 H ASN 47 5.647 0.888 -1.302
349 HA ASN 47 HA ASN 47 6.290 1.019 1.582
350 1HB ASN 47 2HB ASN 47 7.480 2.583 -0.753
351 2HB ASN 47 3HB ASN 47 7.470 3.225 0.893
352 1HD2 ASN 47 1HD2 ASN 47 8.340 1.603 2.630
353 2HD2 ASN 47 2HD2 ASN 47 9.913 0.966 2.174
354 H VAL 48 H VAL 48 5.164 2.724 2.689
355 HA VAL 48 HA VAL 48 3.175 4.209 1.122
356 HB VAL 48 HB VAL 48 2.024 2.174 1.534
357 1HG1 VAL 48 1HG1 VAL 48 2.841 2.441 4.440
358 2HG1 VAL 48 2HG1 VAL 48 1.584 1.338 3.847
359 3HG1 VAL 48 3HG1 VAL 48 3.259 1.146 3.313
360 1HG2 VAL 48 1HG2 VAL 48 0.771 4.267 1.741
361 2HG2 VAL 48 2HG2 VAL 48 0.107 2.986 2.758
362 3HG2 VAL 48 3HG2 VAL 48 1.055 4.296 3.485
363 H ILE 49 H ILE 49 2.926 6.197 1.915
364 HA ILE 49 HA ILE 49 4.737 6.919 4.113
365 HB ILE 49 HB ILE 49 3.778 8.704 1.848
366 1HG1 ILE 49 2HG1 ILE 49 4.913 6.902 0.734
367 2HG1 ILE 49 3HG1 ILE 49 5.884 8.365 0.711
368 1HG2 ILE 49 1HG2 ILE 49 4.619 9.909 3.758
369 2HG2 ILE 49 2HG2 ILE 49 6.078 8.918 3.830
370 3HG2 ILE 49 3HG2 ILE 49 5.802 10.008 2.452
371 1HD1 ILE 49 1HD1 ILE 49 7.273 7.461 2.598
372 2HD1 ILE 49 2HD1 ILE 49 6.337 5.950 2.507
373 3HD1 ILE 49 3HD1 ILE 49 7.332 6.472 1.139
374 H TYR 50 H TYR 50 3.271 6.847 5.871
375 HA TYR 50 HA TYR 50 0.801 8.528 5.702
376 1HB TYR 50 2HB TYR 50 -0.591 6.752 6.439
377 2HB TYR 50 3HB TYR 50 0.345 6.164 5.075
378 HD1 TYR 50 HD1 TYR 50 2.095 4.407 5.454
379 HD2 TYR 50 HD2 TYR 50 -0.340 5.878 8.672
380 HE1 TYR 50 HE1 TYR 50 2.298 2.227 6.614
381 HE2 TYR 50 HE2 TYR 50 0.149 3.835 9.966
382 HH TYR 50 HH TYR 50 1.675 0.984 8.463
383 H ASP 51 H ASP 51 -0.357 8.514 7.777
384 HA ASP 51 HA ASP 51 1.580 9.284 9.858
385 1HB ASP 51 2HB ASP 51 -0.139 10.890 9.220
386 2HB ASP 51 3HB ASP 51 -1.416 9.749 9.672
387 HA PRO 52 HA PRO 52 0.425 5.287 11.646
388 1HB PRO 52 2HB PRO 52 2.483 4.811 13.286
389 2HB PRO 52 3HB PRO 52 2.643 4.722 11.515
390 1HG PRO 52 2HG PRO 52 3.299 7.109 13.305
391 2HG PRO 52 3HG PRO 52 4.370 6.359 12.085
392 1HD PRO 52 2HD PRO 52 2.836 8.559 11.543
393 2HD PRO 52 3HD PRO 52 3.137 7.292 10.315
394 H ALA 53 H ALA 53 0.156 8.451 12.960
395 HA ALA 53 HA ALA 53 -0.701 7.506 15.613
396 1HB ALA 53 1HB ALA 53 -1.073 10.179 14.213
397 2HB ALA 53 2HB ALA 53 -1.304 9.815 15.929
398 3HB ALA 53 3HB ALA 53 0.332 9.780 15.233
399 H GLU 54 H GLU 54 -1.850 7.956 12.277
400 HA GLU 54 HA GLU 54 -4.611 8.139 13.283
401 1HB GLU 54 2HB GLU 54 -3.509 10.059 11.884
402 2HB GLU 54 3HB GLU 54 -3.879 9.022 10.497
403 1HG GLU 54 2HG GLU 54 -6.278 8.903 11.366
404 2HG GLU 54 3HG GLU 54 -5.815 10.072 12.614
405 H THR 55 H THR 55 -2.677 6.836 10.608
406 HA THR 55 HA THR 55 -4.409 4.460 10.520
407 HB THR 55 HB THR 55 -2.812 3.976 8.339
408 HG1 THR 55 1HG THR 55 -3.294 6.738 8.518
409 1HG2 THR 55 1HG2 THR 55 -4.764 4.715 7.061
410 2HG2 THR 55 2HG2 THR 55 -5.223 3.726 8.464
411 3HG2 THR 55 3HG2 THR 55 -5.452 5.514 8.503
412 H GLY 56 H GLY 56 -3.075 2.612 9.749
413 1HA GLY 56 2HA GLY 56 -0.589 2.027 11.040
414 2HA GLY 56 3HA GLY 56 -1.990 1.283 11.845
415 H THR 57 H THR 57 -2.160 -0.741 11.044
416 HA THR 57 HA THR 57 -1.396 -1.581 8.353
417 HB THR 57 HB THR 57 -1.966 -3.801 9.511
418 HG1 THR 57 1HG THR 57 -2.261 -3.591 11.784
419 1HG2 THR 57 1HG2 THR 57 0.371 -2.867 9.455
420 2HG2 THR 57 2HG2 THR 57 0.058 -1.941 10.930
421 3HG2 THR 57 3HG2 THR 57 0.057 -3.713 10.981
422 H ALA 58 H ALA 58 -4.113 -1.043 10.485
423 HA ALA 58 HA ALA 58 -6.062 -2.534 9.532
424 1HB ALA 58 1HB ALA 58 -6.401 0.304 10.541
425 2HB ALA 58 2HB ALA 58 -7.674 -0.935 10.487
426 3HB ALA 58 3HB ALA 58 -6.258 -1.162 11.532
427 H ALA 59 H ALA 59 -5.605 0.723 8.317
428 HA ALA 59 HA ALA 59 -8.060 0.437 6.662
429 1HB ALA 59 1HB ALA 59 -7.603 2.715 5.915
430 2HB ALA 59 2HB ALA 59 -7.481 2.615 7.683
431 3HB ALA 59 3HB ALA 59 -6.005 2.656 6.691
432 H ILE 60 H ILE 60 -4.607 0.373 6.341
433 HA ILE 60 HA ILE 60 -4.267 0.123 3.536
434 HB ILE 60 HB ILE 60 -2.709 -0.327 6.061
435 1HG1 ILE 60 2HG1 ILE 60 -1.992 0.907 3.448
436 2HG1 ILE 60 3HG1 ILE 60 -3.115 1.768 4.482
437 1HG2 ILE 60 1HG2 ILE 60 -1.826 -1.445 3.371
438 2HG2 ILE 60 2HG2 ILE 60 -0.772 -1.142 4.774
439 3HG2 ILE 60 3HG2 ILE 60 -2.054 -2.347 4.890
440 1HD1 ILE 60 1HD1 ILE 60 -0.805 2.593 4.835
441 2HD1 ILE 60 2HD1 ILE 60 -1.555 1.955 6.293
442 3HD1 ILE 60 3HD1 ILE 60 -0.327 0.992 5.441
443 H GLN 61 H GLN 61 -4.612 -2.545 5.979
444 HA GLN 61 HA GLN 61 -4.551 -4.510 3.889
445 1HB GLN 61 2HB GLN 61 -5.055 -4.520 6.768
446 2HB GLN 61 3HB GLN 61 -6.198 -5.534 5.880
447 1HG GLN 61 2HG GLN 61 -4.645 -7.095 6.254
448 2HG GLN 61 3HG GLN 61 -4.091 -6.539 4.681
449 1HE2 GLN 61 1HE2 GLN 61 -2.924 -3.990 5.842
450 2HE2 GLN 61 2HE2 GLN 61 -1.478 -4.533 6.683
451 H GLU 62 H GLU 62 -7.297 -2.811 5.515
452 HA GLU 62 HA GLU 62 -9.452 -3.984 4.195
453 1HB GLU 62 2HB GLU 62 -8.886 -1.267 5.371
454 2HB GLU 62 3HB GLU 62 -10.304 -1.426 4.351
455 1HG GLU 62 2HG GLU 62 -11.114 -3.301 5.773
456 2HG GLU 62 3HG GLU 62 -9.708 -3.073 6.834
457 H LYS 63 H LYS 63 -7.708 -1.020 3.039
458 HA LYS 63 HA LYS 63 -9.140 -0.934 0.589
459 1HB LYS 63 2HB LYS 63 -6.659 0.329 1.754
460 2HB LYS 63 3HB LYS 63 -7.030 0.520 0.073
461 1HG LYS 63 2HG LYS 63 -8.877 1.331 2.360
462 2HG LYS 63 3HG LYS 63 -7.821 2.386 1.414
463 1HD LYS 63 2HD LYS 63 -9.589 2.900 0.283
464 2HD LYS 63 3HD LYS 63 -9.171 1.477 -0.670
465 1HE LYS 63 2HE LYS 63 -10.948 0.179 0.397
466 2HE LYS 63 3HE LYS 63 -11.102 1.347 1.714
467 1HZ LYS 63 1HZ LYS 63 -12.863 1.511 0.117
468 2HZ LYS 63 2HZ LYS 63 -12.002 2.907 0.173
469 3HZ LYS 63 3HZ LYS 63 -11.804 1.871 -1.092
470 H ILE 64 H ILE 64 -6.042 -2.513 1.526
471 HA ILE 64 HA ILE 64 -5.007 -3.090 -0.944
472 HB ILE 64 HB ILE 64 -4.885 -4.149 1.784
473 1HG1 ILE 64 2HG1 ILE 64 -3.398 -2.400 0.758
474 2HG1 ILE 64 3HG1 ILE 64 -2.613 -3.744 1.579
475 1HG2 ILE 64 1HG2 ILE 64 -3.459 -6.047 1.212
476 2HG2 ILE 64 2HG2 ILE 64 -5.191 -6.265 0.976
477 3HG2 ILE 64 3HG2 ILE 64 -4.141 -5.977 -0.438
478 1HD1 ILE 64 1HD1 ILE 64 -2.936 -3.477 -1.434
479 2HD1 ILE 64 2HD1 ILE 64 -1.448 -3.264 -0.482
480 3HD1 ILE 64 3HD1 ILE 64 -2.216 -4.860 -0.598
481 H GLU 65 H GLU 65 -7.269 -5.012 1.118
482 HA GLU 65 HA GLU 65 -7.959 -7.038 -0.741
483 1HB GLU 65 2HB GLU 65 -9.333 -5.838 1.693
484 2HB GLU 65 3HB GLU 65 -10.087 -7.132 0.760
485 1HG GLU 65 2HG GLU 65 -7.257 -7.429 1.780
486 2HG GLU 65 3HG GLU 65 -8.647 -7.773 2.809
487 H LYS 66 H LYS 66 -9.769 -4.025 0.077
488 HA LYS 66 HA LYS 66 -11.829 -4.526 -1.745
489 1HB LYS 66 2HB LYS 66 -11.005 -2.308 -0.061
490 2HB LYS 66 3HB LYS 66 -11.545 -1.666 -1.608
491 1HG LYS 66 2HG LYS 66 -13.124 -3.663 0.067
492 2HG LYS 66 3HG LYS 66 -13.330 -1.910 0.161
493 1HD LYS 66 2HD LYS 66 -13.916 -1.820 -2.254
494 2HD LYS 66 3HD LYS 66 -13.739 -3.577 -2.374
495 1HE LYS 66 2HE LYS 66 -15.526 -3.865 -0.640
496 2HE LYS 66 3HE LYS 66 -15.745 -2.108 -0.593
497 1HZ LYS 66 1HZ LYS 66 -17.349 -3.167 -2.008
498 2HZ LYS 66 2HZ LYS 66 -16.380 -2.204 -2.920
499 3HZ LYS 66 3HZ LYS 66 -16.177 -3.838 -2.944
500 H LEU 67 H LEU 67 -8.730 -2.988 -2.391
501 HA LEU 67 HA LEU 67 -9.343 -2.194 -5.113
502 1HB LEU 67 2HB LEU 67 -6.812 -2.433 -3.459
503 2HB LEU 67 3HB LEU 67 -6.763 -1.990 -5.165
504 HG LEU 67 HG LEU 67 -8.653 -0.472 -3.355
505 1HD1 LEU 67 1HD1 LEU 67 -5.655 -0.049 -3.489
506 2HD1 LEU 67 2HD1 LEU 67 -6.808 1.195 -2.969
507 3HD1 LEU 67 3HD1 LEU 67 -6.638 -0.309 -2.064
508 1HD2 LEU 67 1HD2 LEU 67 -8.659 -0.143 -5.850
509 2HD2 LEU 67 2HD2 LEU 67 -8.230 1.318 -4.955
510 3HD2 LEU 67 3HD2 LEU 67 -6.966 0.367 -5.758
511 H GLY 68 H GLY 68 -8.627 -5.233 -3.641
512 1HA GLY 68 2HA GLY 68 -8.926 -7.246 -4.726
513 2HA GLY 68 3HA GLY 68 -8.595 -6.510 -6.298
514 H TYR 69 H TYR 69 -6.624 -6.306 -3.264
515 HA TYR 69 HA TYR 69 -4.470 -7.924 -4.544
516 1HB TYR 69 2HB TYR 69 -4.532 -5.051 -3.958
517 2HB TYR 69 3HB TYR 69 -3.257 -5.849 -3.067
518 HD1 TYR 69 HD1 TYR 69 -4.721 -5.576 -6.508
519 HD2 TYR 69 HD2 TYR 69 -1.254 -6.542 -4.139
520 HE1 TYR 69 HE1 TYR 69 -3.341 -5.470 -8.512
521 HE2 TYR 69 HE2 TYR 69 0.151 -6.352 -6.131
522 HH TYR 69 HH TYR 69 -1.182 -5.433 -9.337
523 H HIS 70 H HIS 70 -2.684 -8.228 -2.799
524 HA HIS 70 HA HIS 70 -3.702 -8.313 -0.059
525 1HB HIS 70 2HB HIS 70 -4.341 -10.492 -1.025
526 2HB HIS 70 3HB HIS 70 -2.663 -10.788 -1.484
527 HD1 HIS 70 1HD HIS 70 -2.731 -12.991 0.082
528 HD2 HIS 70 2HD HIS 70 -3.484 -9.343 2.040
529 HE1 HIS 70 1HE HIS 70 -2.665 -13.469 2.587
530 H VAL 71 H VAL 71 -2.062 -7.820 1.336
531 HA VAL 71 HA VAL 71 0.674 -7.441 0.239
532 HB VAL 71 HB VAL 71 -0.706 -5.406 0.867
533 1HG1 VAL 71 1HG1 VAL 71 -1.758 -6.299 2.959
534 2HG1 VAL 71 2HG1 VAL 71 -0.162 -6.249 3.738
535 3HG1 VAL 71 3HG1 VAL 71 -0.923 -4.753 3.179
536 1HG2 VAL 71 1HG2 VAL 71 1.129 -4.236 1.917
537 2HG2 VAL 71 2HG2 VAL 71 1.922 -5.790 2.293
538 3HG2 VAL 71 3HG2 VAL 71 1.676 -5.277 0.602
539 H VAL 72 H VAL 72 2.375 -8.291 1.506
540 HA VAL 72 HA VAL 72 1.539 -10.192 3.659
541 HB VAL 72 HB VAL 72 3.845 -10.359 1.816
542 1HG1 VAL 72 1HG1 VAL 72 4.515 -11.288 3.945
543 2HG1 VAL 72 2HG1 VAL 72 3.009 -12.226 4.055
544 3HG1 VAL 72 3HG1 VAL 72 4.225 -12.611 2.819
545 1HG2 VAL 72 1HG2 VAL 72 1.347 -12.104 2.064
546 2HG2 VAL 72 2HG2 VAL 72 1.667 -10.970 0.736
547 3HG2 VAL 72 3HG2 VAL 72 2.692 -12.398 0.944
548 H ILE 73 H ILE 73 2.605 -10.160 5.482
549 HA ILE 73 HA ILE 73 4.056 -7.636 6.141
550 HB ILE 73 HB ILE 73 2.358 -9.400 7.916
551 1HG1 ILE 73 2HG1 ILE 73 0.916 -8.338 6.272
552 2HG1 ILE 73 3HG1 ILE 73 0.736 -7.584 7.848
553 1HG2 ILE 73 1HG2 ILE 73 3.780 -6.745 8.368
554 2HG2 ILE 73 2HG2 ILE 73 2.469 -7.350 9.412
555 3HG2 ILE 73 3HG2 ILE 73 3.971 -8.253 9.269
556 1HD1 ILE 73 1HD1 ILE 73 2.250 -6.410 5.483
557 2HD1 ILE 73 2HD1 ILE 73 0.699 -5.881 6.146
558 3HD1 ILE 73 3HD1 ILE 73 2.171 -5.675 7.104
559 H GLU 74 H GLU 74 6.032 -8.801 5.310
560 HA GLU 74 HA GLU 74 7.183 -10.798 6.900
561 1HB GLU 74 2HB GLU 74 8.094 -8.969 4.696
562 2HB GLU 74 3HB GLU 74 9.264 -9.917 5.605
563 1HG GLU 74 2HG GLU 74 6.847 -11.283 4.382
564 2HG GLU 74 3HG GLU 74 8.318 -10.976 3.445
565 H GLY 75 H GLY 75 6.471 -7.880 7.866
566 1HA GLY 75 2HA GLY 75 9.031 -7.131 9.224
567 2HA GLY 75 3HA GLY 75 7.683 -6.066 8.783
568 H ARG 76 H ARG 76 6.018 -8.499 10.006
569 HA ARG 76 HA ARG 76 6.272 -8.156 12.841
570 1HB ARG 76 2HB ARG 76 5.351 -5.872 11.878
571 2HB ARG 76 3HB ARG 76 3.953 -6.821 11.434
572 1HG ARG 76 2HG ARG 76 3.197 -6.053 13.414
573 2HG ARG 76 3HG ARG 76 3.997 -7.473 14.068
574 1HD ARG 76 2HD ARG 76 5.575 -4.861 13.861
575 2HD ARG 76 3HD ARG 76 4.298 -5.010 15.050
576 HE ARG 76 HE ARG 76 5.414 -6.513 16.290
577 1HH1 ARG 76 2HH2 ARG 76 7.316 -6.233 13.234
578 2HH1 ARG 76 1HH2 ARG 76 8.762 -6.731 13.987
579 1HH2 ARG 76 2HH1 ARG 76 7.359 -7.271 17.196
580 2HH2 ARG 76 1HH1 ARG 76 8.785 -7.422 16.223
Start of MODEL 30
1 1H MET 1 H1 MET 1 4.277 16.143 15.448
2 2H MET 1 H2 MET 1 5.076 16.112 16.886
3 3H MET 1 H3 MET 1 3.833 15.148 16.612
4 HA MET 1 HA MET 1 3.052 17.020 17.981
5 1HB MET 1 2HB MET 1 4.694 18.557 15.971
6 2HB MET 1 3HB MET 1 3.252 19.344 16.621
7 1HG MET 1 2HG MET 1 4.010 19.075 18.893
8 2HG MET 1 3HG MET 1 5.519 18.323 18.337
9 1HE MET 1 1HE MET 1 6.662 20.273 19.935
10 2HE MET 1 2HE MET 1 6.427 22.010 19.625
11 3HE MET 1 3HE MET 1 5.075 21.031 20.236
12 H LEU 2 H LEU 2 2.756 18.393 14.729
13 HA LEU 2 HA LEU 2 -0.040 17.599 14.367
14 1HB LEU 2 2HB LEU 2 2.027 19.200 12.940
15 2HB LEU 2 3HB LEU 2 1.169 18.117 11.859
16 HG LEU 2 HG LEU 2 -1.007 19.013 12.659
17 1HD1 LEU 2 1HD1 LEU 2 -1.013 21.159 13.912
18 2HD1 LEU 2 2HD1 LEU 2 -0.327 19.858 14.896
19 3HD1 LEU 2 3HD1 LEU 2 0.747 21.044 14.127
20 1HD2 LEU 2 1HD2 LEU 2 -0.810 21.141 11.435
21 2HD2 LEU 2 2HD2 LEU 2 0.960 21.082 11.585
22 3HD2 LEU 2 3HD2 LEU 2 0.105 19.861 10.618
23 H SER 3 H SER 3 -0.450 16.210 12.249
24 HA SER 3 HA SER 3 0.128 13.644 12.421
25 1HB SER 3 2HB SER 3 0.090 15.212 9.797
26 2HB SER 3 3HB SER 3 -0.396 13.534 10.031
27 HG SER 3 HG SER 3 -2.102 14.223 11.286
28 H GLU 4 H GLU 4 2.068 12.698 12.796
29 HA GLU 4 HA GLU 4 4.520 13.588 11.435
30 1HB GLU 4 2HB GLU 4 3.832 11.556 13.500
31 2HB GLU 4 3HB GLU 4 5.403 11.646 12.768
32 1HG GLU 4 2HG GLU 4 5.817 13.782 13.565
33 2HG GLU 4 3HG GLU 4 4.128 14.045 13.981
34 H GLN 5 H GLN 5 5.614 11.864 10.114
35 HA GLN 5 HA GLN 5 3.682 10.066 8.729
36 1HB GLN 5 2HB GLN 5 5.673 12.009 7.554
37 2HB GLN 5 3HB GLN 5 4.966 10.696 6.621
38 1HG GLN 5 2HG GLN 5 3.146 12.662 8.101
39 2HG GLN 5 3HG GLN 5 3.858 13.065 6.552
40 1HE2 GLN 5 1HE2 GLN 5 3.598 11.348 4.832
41 2HE2 GLN 5 2HE2 GLN 5 2.147 10.356 4.764
42 H LYS 6 H LYS 6 4.586 8.146 7.960
43 HA LYS 6 HA LYS 6 7.455 7.717 8.242
44 1HB LYS 6 2HB LYS 6 6.566 7.096 10.401
45 2HB LYS 6 3HB LYS 6 5.348 6.024 9.658
46 1HG LYS 6 2HG LYS 6 7.113 4.606 8.800
47 2HG LYS 6 3HG LYS 6 8.360 5.758 9.353
48 1HD LYS 6 2HD LYS 6 7.579 5.354 11.716
49 2HD LYS 6 3HD LYS 6 6.444 4.144 11.093
50 1HE LYS 6 2HE LYS 6 8.617 3.073 9.981
51 2HE LYS 6 3HE LYS 6 9.495 4.125 11.092
52 1HZ LYS 6 1HZ LYS 6 9.269 2.138 12.205
53 2HZ LYS 6 2HZ LYS 6 8.043 3.025 12.852
54 3HZ LYS 6 3HZ LYS 6 7.722 1.879 11.712
55 H GLU 7 H GLU 7 8.128 5.906 7.201
56 HA GLU 7 HA GLU 7 6.647 5.200 4.745
57 1HB GLU 7 2HB GLU 7 9.609 4.929 4.815
58 2HB GLU 7 3HB GLU 7 8.522 5.525 3.585
59 1HG GLU 7 2HG GLU 7 9.825 7.364 4.150
60 2HG GLU 7 3HG GLU 7 8.382 7.687 5.110
61 H ILE 8 H ILE 8 5.721 3.258 5.502
62 HA ILE 8 HA ILE 8 7.434 1.322 6.910
63 HB ILE 8 HB ILE 8 4.601 1.186 6.039
64 1HG1 ILE 8 2HG1 ILE 8 4.753 3.054 7.617
65 2HG1 ILE 8 3HG1 ILE 8 3.834 1.673 8.232
66 1HG2 ILE 8 1HG2 ILE 8 6.338 -0.446 7.802
67 2HG2 ILE 8 2HG2 ILE 8 4.546 -0.560 7.864
68 3HG2 ILE 8 3HG2 ILE 8 5.410 -0.947 6.360
69 1HD1 ILE 8 1HD1 ILE 8 5.674 0.867 9.493
70 2HD1 ILE 8 2HD1 ILE 8 6.723 2.152 8.838
71 3HD1 ILE 8 3HD1 ILE 8 5.347 2.563 9.913
72 H ALA 9 H ALA 9 7.450 -0.898 5.909
73 HA ALA 9 HA ALA 9 7.475 -0.924 2.955
74 1HB ALA 9 1HB ALA 9 9.626 -2.097 2.968
75 2HB ALA 9 2HB ALA 9 9.824 -0.504 3.730
76 3HB ALA 9 3HB ALA 9 9.726 -1.959 4.736
77 H MET 10 H MET 10 6.584 -2.894 2.224
78 HA MET 10 HA MET 10 6.707 -5.270 3.889
79 1HB MET 10 2HB MET 10 4.265 -5.622 4.005
80 2HB MET 10 3HB MET 10 4.821 -4.300 5.013
81 1HG MET 10 2HG MET 10 3.691 -3.880 2.248
82 2HG MET 10 3HG MET 10 2.662 -3.996 3.668
83 1HE MET 10 1HE MET 10 1.979 -2.191 5.190
84 2HE MET 10 2HE MET 10 3.562 -2.458 5.959
85 3HE MET 10 3HE MET 10 3.005 -0.802 5.600
86 H GLN 11 H GLN 11 5.287 -7.075 2.674
87 HA GLN 11 HA GLN 11 6.455 -7.081 -0.071
88 1HB GLN 11 2HB GLN 11 6.031 -9.050 2.124
89 2HB GLN 11 3HB GLN 11 5.529 -9.641 0.548
90 1HG GLN 11 2HG GLN 11 8.222 -8.338 0.564
91 2HG GLN 11 3HG GLN 11 8.057 -9.808 1.517
92 1HE2 GLN 11 1HE2 GLN 11 8.176 -8.573 -1.791
93 2HE2 GLN 11 2HE2 GLN 11 7.997 -10.148 -2.540
94 H VAL 12 H VAL 12 5.120 -8.343 -1.727
95 HA VAL 12 HA VAL 12 2.239 -7.557 -1.503
96 HB VAL 12 HB VAL 12 4.063 -7.221 -3.917
97 1HG1 VAL 12 1HG1 VAL 12 1.724 -7.571 -4.568
98 2HG1 VAL 12 2HG1 VAL 12 1.180 -6.370 -3.373
99 3HG1 VAL 12 3HG1 VAL 12 2.139 -5.869 -4.780
100 1HG2 VAL 12 1HG2 VAL 12 2.996 -5.166 -1.937
101 2HG2 VAL 12 2HG2 VAL 12 4.707 -5.561 -2.229
102 3HG2 VAL 12 3HG2 VAL 12 3.761 -4.768 -3.487
103 H SER 13 H SER 13 0.754 -8.941 -2.519
104 HA SER 13 HA SER 13 1.811 -11.314 -3.988
105 1HB SER 13 2HB SER 13 -0.333 -11.219 -1.825
106 2HB SER 13 3HB SER 13 -0.094 -12.599 -2.915
107 HG SER 13 HG SER 13 2.194 -11.650 -1.680
108 H GLY 14 H GLY 14 -0.095 -12.284 -5.306
109 1HA GLY 14 2HA GLY 14 -1.874 -12.025 -6.750
110 2HA GLY 14 3HA GLY 14 -2.216 -10.426 -6.083
111 H MET 15 H MET 15 0.397 -9.289 -6.514
112 HA MET 15 HA MET 15 0.227 -8.098 -8.886
113 1HB MET 15 2HB MET 15 2.615 -7.532 -8.754
114 2HB MET 15 3HB MET 15 1.764 -7.378 -7.233
115 1HG MET 15 2HG MET 15 3.753 -8.363 -6.573
116 2HG MET 15 3HG MET 15 2.692 -9.764 -6.672
117 1HE MET 15 1HE MET 15 6.200 -11.209 -7.622
118 2HE MET 15 2HE MET 15 5.836 -9.961 -6.412
119 3HE MET 15 3HE MET 15 4.775 -11.382 -6.574
120 H THR 16 H THR 16 0.868 -8.168 -10.900
121 HA THR 16 HA THR 16 2.420 -10.351 -12.109
122 HB THR 16 HB THR 16 0.416 -10.434 -13.863
123 HG1 THR 16 1HG THR 16 -1.011 -10.017 -11.451
124 1HG2 THR 16 1HG2 THR 16 0.170 -11.984 -11.249
125 2HG2 THR 16 2HG2 THR 16 -0.525 -12.408 -12.821
126 3HG2 THR 16 3HG2 THR 16 1.234 -12.408 -12.607
127 H CYS 17 H CYS 17 0.070 -7.824 -12.986
128 HA CYS 17 HA CYS 17 1.418 -6.820 -15.209
129 1HB CYS 17 2HB CYS 17 -0.352 -5.187 -13.351
130 2HB CYS 17 3HB CYS 17 -0.082 -4.918 -15.079
131 H ALA 18 H ALA 18 2.071 -6.145 -11.858
132 HA ALA 18 HA ALA 18 3.439 -4.797 -10.717
133 1HB ALA 18 1HB ALA 18 5.382 -3.760 -11.676
134 2HB ALA 18 2HB ALA 18 5.208 -5.396 -12.334
135 3HB ALA 18 3HB ALA 18 4.786 -3.984 -13.325
136 H ALA 19 H ALA 19 2.621 -3.041 -13.742
137 HA ALA 19 HA ALA 19 2.373 -0.456 -12.742
138 1HB ALA 19 1HB ALA 19 0.655 -1.805 -14.870
139 2HB ALA 19 2HB ALA 19 0.860 -0.054 -14.649
140 3HB ALA 19 3HB ALA 19 2.243 -1.055 -15.126
141 H CYS 20 H CYS 20 -0.201 -2.972 -12.806
142 HA CYS 20 HA CYS 20 -2.219 -1.448 -11.625
143 1HB CYS 20 2HB CYS 20 -1.664 -4.437 -11.561
144 2HB CYS 20 3HB CYS 20 -3.166 -3.715 -10.961
145 H ALA 21 H ALA 21 0.570 -2.918 -10.045
146 HA ALA 21 HA ALA 21 -0.512 -2.723 -7.383
147 1HB ALA 21 1HB ALA 21 1.452 -4.175 -8.206
148 2HB ALA 21 2HB ALA 21 2.430 -2.698 -8.073
149 3HB ALA 21 3HB ALA 21 1.589 -3.366 -6.649
150 H ALA 22 H ALA 22 0.628 -0.320 -9.698
151 HA ALA 22 HA ALA 22 1.261 1.671 -7.645
152 1HB ALA 22 1HB ALA 22 1.244 3.261 -9.431
153 2HB ALA 22 2HB ALA 22 2.118 1.822 -9.997
154 3HB ALA 22 3HB ALA 22 0.452 2.133 -10.541
155 H ARG 23 H ARG 23 -1.539 0.659 -9.638
156 HA ARG 23 HA ARG 23 -3.269 2.809 -8.927
157 1HB ARG 23 2HB ARG 23 -3.900 -0.017 -9.847
158 2HB ARG 23 3HB ARG 23 -5.111 1.250 -9.643
159 1HG ARG 23 2HG ARG 23 -4.174 2.623 -11.361
160 2HG ARG 23 3HG ARG 23 -2.652 1.733 -11.350
161 1HD ARG 23 2HD ARG 23 -3.689 1.052 -13.313
162 2HD ARG 23 3HD ARG 23 -3.874 -0.302 -12.181
163 HE ARG 23 HE ARG 23 -6.190 1.347 -12.052
164 1HH1 ARG 23 2HH2 ARG 23 -4.565 -1.113 -14.014
165 2HH1 ARG 23 1HH2 ARG 23 -5.918 -1.437 -15.039
166 1HH2 ARG 23 2HH1 ARG 23 -8.068 0.867 -13.362
167 2HH2 ARG 23 1HH1 ARG 23 -7.977 -0.332 -14.610
168 H ILE 24 H ILE 24 -2.691 -0.401 -7.368
169 HA ILE 24 HA ILE 24 -4.657 0.051 -5.397
170 HB ILE 24 HB ILE 24 -3.898 -1.617 -4.072
171 1HG1 ILE 24 2HG1 ILE 24 -1.266 -1.258 -5.359
172 2HG1 ILE 24 3HG1 ILE 24 -1.689 -1.162 -3.640
173 1HG2 ILE 24 1HG2 ILE 24 -3.958 -3.403 -5.556
174 2HG2 ILE 24 2HG2 ILE 24 -4.760 -2.118 -6.452
175 3HG2 ILE 24 3HG2 ILE 24 -3.079 -2.544 -6.843
176 1HD1 ILE 24 1HD1 ILE 24 -1.454 -3.641 -5.371
177 2HD1 ILE 24 2HD1 ILE 24 -0.397 -3.169 -4.041
178 3HD1 ILE 24 3HD1 ILE 24 -2.073 -3.650 -3.694
179 H GLU 25 H GLU 25 -1.122 0.701 -5.001
180 HA GLU 25 HA GLU 25 -1.213 2.159 -2.668
181 1HB GLU 25 2HB GLU 25 0.523 2.195 -5.115
182 2HB GLU 25 3HB GLU 25 0.699 3.550 -3.995
183 1HG GLU 25 2HG GLU 25 2.246 1.590 -3.573
184 2HG GLU 25 3HG GLU 25 1.310 2.122 -2.182
185 H LYS 26 H LYS 26 -2.109 3.470 -5.879
186 HA LYS 26 HA LYS 26 -2.409 6.167 -4.750
187 1HB LYS 26 2HB LYS 26 -3.576 5.136 -7.345
188 2HB LYS 26 3HB LYS 26 -3.365 6.818 -6.854
189 1HG LYS 26 2HG LYS 26 -1.204 4.811 -7.523
190 2HG LYS 26 3HG LYS 26 -1.686 6.203 -8.474
191 1HD LYS 26 2HD LYS 26 -0.649 7.725 -6.904
192 2HD LYS 26 3HD LYS 26 -0.499 6.472 -5.667
193 1HE LYS 26 2HE LYS 26 1.670 6.909 -6.659
194 2HE LYS 26 3HE LYS 26 1.145 5.237 -6.868
195 1HZ LYS 26 1HZ LYS 26 2.118 6.129 -8.859
196 2HZ LYS 26 2HZ LYS 26 0.542 5.754 -9.126
197 3HZ LYS 26 3HZ LYS 26 0.998 7.328 -8.943
198 H GLY 27 H GLY 27 -4.769 3.574 -5.580
199 1HA GLY 27 2HA GLY 27 -7.077 5.038 -4.662
200 2HA GLY 27 3HA GLY 27 -6.933 3.285 -4.841
201 H LEU 28 H LEU 28 -4.584 3.147 -3.082
202 HA LEU 28 HA LEU 28 -5.816 2.783 -0.493
203 1HB LEU 28 2HB LEU 28 -4.096 1.397 -1.425
204 2HB LEU 28 3HB LEU 28 -2.931 2.720 -1.389
205 HG LEU 28 HG LEU 28 -4.316 1.791 1.131
206 1HD1 LEU 28 1HD1 LEU 28 -3.464 -0.192 0.039
207 2HD1 LEU 28 2HD1 LEU 28 -1.873 0.567 -0.186
208 3HD1 LEU 28 3HD1 LEU 28 -2.461 0.180 1.443
209 1HD2 LEU 28 1HD2 LEU 28 -2.192 2.632 2.144
210 2HD2 LEU 28 2HD2 LEU 28 -1.588 3.046 0.530
211 3HD2 LEU 28 3HD2 LEU 28 -2.990 3.890 1.220
212 H LYS 29 H LYS 29 -3.327 5.086 -1.745
213 HA LYS 29 HA LYS 29 -3.103 6.718 0.456
214 1HB LYS 29 2HB LYS 29 -1.726 6.904 -1.572
215 2HB LYS 29 3HB LYS 29 -3.104 7.570 -2.451
216 1HG LYS 29 2HG LYS 29 -2.849 9.238 -0.137
217 2HG LYS 29 3HG LYS 29 -1.228 8.857 -0.575
218 1HD LYS 29 2HD LYS 29 -3.207 9.789 -2.708
219 2HD LYS 29 3HD LYS 29 -2.477 10.949 -1.580
220 1HE LYS 29 2HE LYS 29 -0.306 10.484 -2.205
221 2HE LYS 29 3HE LYS 29 -0.695 9.014 -3.132
222 1HZ LYS 29 1HZ LYS 29 -0.045 10.924 -4.340
223 2HZ LYS 29 2HZ LYS 29 -1.613 10.542 -4.759
224 3HZ LYS 29 3HZ LYS 29 -1.288 11.831 -3.765
225 H ARG 30 H ARG 30 -5.796 6.691 -1.848
226 HA ARG 30 HA ARG 30 -6.958 9.123 -1.087
227 1HB ARG 30 2HB ARG 30 -7.729 6.787 -2.623
228 2HB ARG 30 3HB ARG 30 -9.103 7.295 -1.658
229 1HG ARG 30 2HG ARG 30 -7.447 9.122 -3.460
230 2HG ARG 30 3HG ARG 30 -8.937 8.299 -3.950
231 1HD ARG 30 2HD ARG 30 -10.191 9.453 -2.151
232 2HD ARG 30 3HD ARG 30 -8.722 10.338 -1.687
233 HE ARG 30 HE ARG 30 -9.181 10.709 -4.469
234 1HH1 ARG 30 2HH2 ARG 30 -10.528 11.631 -1.353
235 2HH1 ARG 30 1HH2 ARG 30 -11.237 13.120 -1.898
236 1HH2 ARG 30 2HH1 ARG 30 -10.107 12.684 -5.258
237 2HH2 ARG 30 1HH1 ARG 30 -10.981 13.729 -4.189
238 H MET 31 H MET 31 -6.626 6.390 1.001
239 HA MET 31 HA MET 31 -8.962 6.824 2.605
240 1HB MET 31 2HB MET 31 -7.937 5.284 4.147
241 2HB MET 31 3HB MET 31 -7.502 4.791 2.512
242 1HG MET 31 2HG MET 31 -5.271 5.798 2.795
243 2HG MET 31 3HG MET 31 -5.686 6.319 4.412
244 1HE MET 31 1HE MET 31 -5.457 1.879 3.338
245 2HE MET 31 2HE MET 31 -7.012 2.721 3.424
246 3HE MET 31 3HE MET 31 -5.787 3.180 2.193
247 HA PRO 32 HA PRO 32 -7.491 10.228 5.249
248 1HB PRO 32 2HB PRO 32 -8.404 9.473 7.727
249 2HB PRO 32 3HB PRO 32 -9.476 10.124 6.451
250 1HG PRO 32 2HG PRO 32 -8.956 7.209 7.106
251 2HG PRO 32 3HG PRO 32 -10.542 8.016 6.923
252 1HD PRO 32 2HD PRO 32 -9.460 6.642 4.889
253 2HD PRO 32 3HD PRO 32 -10.252 8.201 4.554
254 H GLY 33 H GLY 33 -5.527 10.502 6.317
255 1HA GLY 33 2HA GLY 33 -3.896 10.009 7.838
256 2HA GLY 33 3HA GLY 33 -4.379 8.320 7.893
257 H VAL 34 H VAL 34 -4.150 8.150 4.776
258 HA VAL 34 HA VAL 34 -1.174 7.984 4.675
259 HB VAL 34 HB VAL 34 -3.259 7.103 2.684
260 1HG1 VAL 34 1HG1 VAL 34 -1.113 7.591 1.569
261 2HG1 VAL 34 2HG1 VAL 34 -0.225 6.701 2.815
262 3HG1 VAL 34 3HG1 VAL 34 -1.296 5.838 1.701
263 1HG2 VAL 34 1HG2 VAL 34 -2.767 4.846 3.399
264 2HG2 VAL 34 2HG2 VAL 34 -1.543 5.377 4.535
265 3HG2 VAL 34 3HG2 VAL 34 -3.227 5.780 4.844
266 H THR 35 H THR 35 0.093 9.376 3.489
267 HA THR 35 HA THR 35 -1.377 11.584 2.107
268 HB THR 35 HB THR 35 0.455 11.781 4.201
269 HG1 THR 35 1HG THR 35 -0.530 13.681 2.361
270 1HG2 THR 35 1HG2 THR 35 1.690 12.917 1.647
271 2HG2 THR 35 2HG2 THR 35 2.228 13.191 3.313
272 3HG2 THR 35 3HG2 THR 35 2.365 11.573 2.603
273 H ASP 36 H ASP 36 1.400 9.278 1.776
274 HA ASP 36 HA ASP 36 0.829 9.268 -1.043
275 1HB ASP 36 2HB ASP 36 3.232 10.681 -0.105
276 2HB ASP 36 3HB ASP 36 3.611 9.342 -1.183
277 H ALA 37 H ALA 37 2.103 7.627 -2.180
278 HA ALA 37 HA ALA 37 3.017 5.431 -0.595
279 1HB ALA 37 1HB ALA 37 0.447 5.315 -0.331
280 2HB ALA 37 2HB ALA 37 0.392 4.927 -2.055
281 3HB ALA 37 3HB ALA 37 1.243 3.854 -0.912
282 H ASN 38 H ASN 38 3.942 3.690 -1.881
283 HA ASN 38 HA ASN 38 4.372 4.304 -4.737
284 1HB ASN 38 2HB ASN 38 6.997 4.253 -3.692
285 2HB ASN 38 3HB ASN 38 6.147 5.608 -4.411
286 1HD2 ASN 38 1HD2 ASN 38 5.892 4.013 -1.167
287 2HD2 ASN 38 2HD2 ASN 38 6.224 5.503 -0.284
288 H VAL 39 H VAL 39 4.449 2.331 -5.639
289 HA VAL 39 HA VAL 39 5.064 0.023 -3.974
290 HB VAL 39 HB VAL 39 3.052 0.211 -5.339
291 1HG1 VAL 39 1HG1 VAL 39 4.020 1.255 -7.410
292 2HG1 VAL 39 2HG1 VAL 39 4.755 -0.314 -7.811
293 3HG1 VAL 39 3HG1 VAL 39 3.022 -0.173 -7.698
294 1HG2 VAL 39 1HG2 VAL 39 4.470 -2.188 -6.380
295 2HG2 VAL 39 2HG2 VAL 39 4.345 -1.984 -4.617
296 3HG2 VAL 39 3HG2 VAL 39 2.886 -2.006 -5.598
297 H ASN 40 H ASN 40 7.236 -0.379 -3.690
298 HA ASN 40 HA ASN 40 9.123 0.193 -5.894
299 1HB ASN 40 2HB ASN 40 9.573 0.837 -3.513
300 2HB ASN 40 3HB ASN 40 9.663 -0.885 -3.103
301 1HD2 ASN 40 1HD2 ASN 40 11.881 0.353 -2.469
302 2HD2 ASN 40 2HD2 ASN 40 13.145 0.151 -3.674
303 H LEU 41 H LEU 41 7.505 -1.520 -6.892
304 HA LEU 41 HA LEU 41 7.919 -4.269 -6.186
305 1HB LEU 41 2HB LEU 41 6.137 -2.801 -7.820
306 2HB LEU 41 3HB LEU 41 6.955 -3.866 -8.939
307 HG LEU 41 HG LEU 41 4.783 -4.655 -7.939
308 1HD1 LEU 41 1HD1 LEU 41 5.516 -6.998 -7.700
309 2HD1 LEU 41 2HD1 LEU 41 6.317 -6.207 -9.068
310 3HD1 LEU 41 3HD1 LEU 41 7.202 -6.474 -7.551
311 1HD2 LEU 41 1HD2 LEU 41 6.259 -5.560 -5.463
312 2HD2 LEU 41 2HD2 LEU 41 5.489 -3.970 -5.502
313 3HD2 LEU 41 3HD2 LEU 41 4.528 -5.433 -5.783
314 H ALA 42 H ALA 42 9.719 -2.065 -8.104
315 HA ALA 42 HA ALA 42 11.359 -3.677 -9.679
316 1HB ALA 42 1HB ALA 42 12.170 -1.362 -7.875
317 2HB ALA 42 2HB ALA 42 13.103 -2.002 -9.239
318 3HB ALA 42 3HB ALA 42 11.536 -1.216 -9.535
319 H THR 43 H THR 43 11.334 -3.372 -6.084
320 HA THR 43 HA THR 43 13.330 -5.604 -6.027
321 HB THR 43 HB THR 43 14.277 -3.553 -5.154
322 HG1 THR 43 1HG THR 43 13.756 -5.661 -3.352
323 1HG2 THR 43 1HG2 THR 43 12.307 -3.804 -2.834
324 2HG2 THR 43 2HG2 THR 43 13.562 -2.576 -3.063
325 3HG2 THR 43 3HG2 THR 43 12.146 -2.614 -4.132
326 H GLU 44 H GLU 44 10.329 -5.625 -6.293
327 HA GLU 44 HA GLU 44 8.519 -6.590 -5.446
328 1HB GLU 44 2HB GLU 44 10.557 -8.410 -5.510
329 2HB GLU 44 3HB GLU 44 10.014 -8.586 -3.847
330 1HG GLU 44 2HG GLU 44 7.618 -8.754 -4.869
331 2HG GLU 44 3HG GLU 44 8.429 -8.915 -6.443
332 H THR 45 H THR 45 9.000 -4.331 -3.940
333 HA THR 45 HA THR 45 7.761 -5.156 -1.390
334 HB THR 45 HB THR 45 9.971 -3.059 -1.676
335 HG1 THR 45 1HG THR 45 10.150 -5.842 -1.415
336 1HG2 THR 45 1HG2 THR 45 8.531 -2.986 0.321
337 2HG2 THR 45 2HG2 THR 45 8.887 -4.719 0.607
338 3HG2 THR 45 3HG2 THR 45 10.187 -3.502 0.739
339 H VAL 46 H VAL 46 6.448 -3.440 -0.439
340 HA VAL 46 HA VAL 46 5.859 -1.156 -2.279
341 HB VAL 46 HB VAL 46 3.981 -2.669 -2.341
342 1HG1 VAL 46 1HG1 VAL 46 3.842 -2.372 0.674
343 2HG1 VAL 46 2HG1 VAL 46 2.643 -3.192 -0.341
344 3HG1 VAL 46 3HG1 VAL 46 4.262 -3.876 -0.191
345 1HG2 VAL 46 1HG2 VAL 46 3.461 -0.275 -2.359
346 2HG2 VAL 46 2HG2 VAL 46 2.220 -1.228 -1.516
347 3HG2 VAL 46 3HG2 VAL 46 3.353 -0.254 -0.583
348 H ASN 47 H ASN 47 5.647 0.888 -1.302
349 HA ASN 47 HA ASN 47 6.290 1.019 1.582
350 1HB ASN 47 2HB ASN 47 7.480 2.583 -0.753
351 2HB ASN 47 3HB ASN 47 7.470 3.225 0.893
352 1HD2 ASN 47 1HD2 ASN 47 8.340 1.603 2.630
353 2HD2 ASN 47 2HD2 ASN 47 9.913 0.966 2.174
354 H VAL 48 H VAL 48 5.164 2.724 2.689
355 HA VAL 48 HA VAL 48 3.175 4.209 1.122
356 HB VAL 48 HB VAL 48 2.024 2.174 1.534
357 1HG1 VAL 48 1HG1 VAL 48 2.841 2.441 4.440
358 2HG1 VAL 48 2HG1 VAL 48 1.584 1.338 3.847
359 3HG1 VAL 48 3HG1 VAL 48 3.259 1.146 3.313
360 1HG2 VAL 48 1HG2 VAL 48 0.771 4.267 1.741
361 2HG2 VAL 48 2HG2 VAL 48 0.107 2.986 2.758
362 3HG2 VAL 48 3HG2 VAL 48 1.055 4.296 3.485
363 H ILE 49 H ILE 49 2.926 6.197 1.915
364 HA ILE 49 HA ILE 49 4.737 6.919 4.113
365 HB ILE 49 HB ILE 49 3.778 8.704 1.848
366 1HG1 ILE 49 2HG1 ILE 49 4.913 6.902 0.734
367 2HG1 ILE 49 3HG1 ILE 49 5.884 8.365 0.711
368 1HG2 ILE 49 1HG2 ILE 49 4.619 9.909 3.758
369 2HG2 ILE 49 2HG2 ILE 49 6.078 8.918 3.830
370 3HG2 ILE 49 3HG2 ILE 49 5.802 10.008 2.452
371 1HD1 ILE 49 1HD1 ILE 49 7.273 7.461 2.598
372 2HD1 ILE 49 2HD1 ILE 49 6.337 5.950 2.507
373 3HD1 ILE 49 3HD1 ILE 49 7.332 6.472 1.139
374 H TYR 50 H TYR 50 3.271 6.847 5.871
375 HA TYR 50 HA TYR 50 0.801 8.528 5.702
376 1HB TYR 50 2HB TYR 50 -0.591 6.752 6.439
377 2HB TYR 50 3HB TYR 50 0.345 6.164 5.075
378 HD1 TYR 50 HD1 TYR 50 2.095 4.407 5.454
379 HD2 TYR 50 HD2 TYR 50 -0.340 5.878 8.672
380 HE1 TYR 50 HE1 TYR 50 2.298 2.227 6.614
381 HE2 TYR 50 HE2 TYR 50 0.149 3.835 9.966
382 HH TYR 50 HH TYR 50 1.675 0.984 8.463
383 H ASP 51 H ASP 51 -0.357 8.514 7.777
384 HA ASP 51 HA ASP 51 1.580 9.284 9.858
385 1HB ASP 51 2HB ASP 51 -0.139 10.890 9.220
386 2HB ASP 51 3HB ASP 51 -1.416 9.749 9.672
387 HA PRO 52 HA PRO 52 0.425 5.287 11.646
388 1HB PRO 52 2HB PRO 52 2.483 4.811 13.286
389 2HB PRO 52 3HB PRO 52 2.643 4.722 11.515
390 1HG PRO 52 2HG PRO 52 3.299 7.109 13.305
391 2HG PRO 52 3HG PRO 52 4.370 6.359 12.085
392 1HD PRO 52 2HD PRO 52 2.836 8.559 11.543
393 2HD PRO 52 3HD PRO 52 3.137 7.292 10.315
394 H ALA 53 H ALA 53 0.156 8.451 12.960
395 HA ALA 53 HA ALA 53 -0.701 7.506 15.613
396 1HB ALA 53 1HB ALA 53 -1.073 10.179 14.213
397 2HB ALA 53 2HB ALA 53 -1.304 9.815 15.929
398 3HB ALA 53 3HB ALA 53 0.332 9.780 15.233
399 H GLU 54 H GLU 54 -1.850 7.956 12.277
400 HA GLU 54 HA GLU 54 -4.611 8.139 13.283
401 1HB GLU 54 2HB GLU 54 -3.509 10.059 11.884
402 2HB GLU 54 3HB GLU 54 -3.879 9.022 10.497
403 1HG GLU 54 2HG GLU 54 -6.278 8.903 11.366
404 2HG GLU 54 3HG GLU 54 -5.815 10.072 12.614
405 H THR 55 H THR 55 -2.677 6.836 10.608
406 HA THR 55 HA THR 55 -4.409 4.460 10.520
407 HB THR 55 HB THR 55 -2.812 3.976 8.339
408 HG1 THR 55 1HG THR 55 -3.294 6.738 8.518
409 1HG2 THR 55 1HG2 THR 55 -4.764 4.715 7.061
410 2HG2 THR 55 2HG2 THR 55 -5.223 3.726 8.464
411 3HG2 THR 55 3HG2 THR 55 -5.452 5.514 8.503
412 H GLY 56 H GLY 56 -3.075 2.612 9.749
413 1HA GLY 56 2HA GLY 56 -0.589 2.027 11.040
414 2HA GLY 56 3HA GLY 56 -1.990 1.283 11.845
415 H THR 57 H THR 57 -2.160 -0.741 11.044
416 HA THR 57 HA THR 57 -1.396 -1.581 8.353
417 HB THR 57 HB THR 57 -1.966 -3.801 9.511
418 HG1 THR 57 1HG THR 57 -2.261 -3.591 11.784
419 1HG2 THR 57 1HG2 THR 57 0.371 -2.867 9.455
420 2HG2 THR 57 2HG2 THR 57 0.058 -1.941 10.930
421 3HG2 THR 57 3HG2 THR 57 0.057 -3.713 10.981
422 H ALA 58 H ALA 58 -4.113 -1.043 10.485
423 HA ALA 58 HA ALA 58 -6.062 -2.534 9.532
424 1HB ALA 58 1HB ALA 58 -6.401 0.304 10.541
425 2HB ALA 58 2HB ALA 58 -7.674 -0.935 10.487
426 3HB ALA 58 3HB ALA 58 -6.258 -1.162 11.532
427 H ALA 59 H ALA 59 -5.605 0.723 8.317
428 HA ALA 59 HA ALA 59 -8.060 0.437 6.662
429 1HB ALA 59 1HB ALA 59 -7.603 2.715 5.915
430 2HB ALA 59 2HB ALA 59 -7.481 2.615 7.683
431 3HB ALA 59 3HB ALA 59 -6.005 2.656 6.691
432 H ILE 60 H ILE 60 -4.607 0.373 6.341
433 HA ILE 60 HA ILE 60 -4.267 0.123 3.536
434 HB ILE 60 HB ILE 60 -2.709 -0.327 6.061
435 1HG1 ILE 60 2HG1 ILE 60 -1.992 0.907 3.448
436 2HG1 ILE 60 3HG1 ILE 60 -3.115 1.768 4.482
437 1HG2 ILE 60 1HG2 ILE 60 -1.826 -1.445 3.371
438 2HG2 ILE 60 2HG2 ILE 60 -0.772 -1.142 4.774
439 3HG2 ILE 60 3HG2 ILE 60 -2.054 -2.347 4.890
440 1HD1 ILE 60 1HD1 ILE 60 -0.805 2.593 4.835
441 2HD1 ILE 60 2HD1 ILE 60 -1.555 1.955 6.293
442 3HD1 ILE 60 3HD1 ILE 60 -0.327 0.992 5.441
443 H GLN 61 H GLN 61 -4.612 -2.545 5.979
444 HA GLN 61 HA GLN 61 -4.551 -4.510 3.889
445 1HB GLN 61 2HB GLN 61 -5.055 -4.520 6.768
446 2HB GLN 61 3HB GLN 61 -6.198 -5.534 5.880
447 1HG GLN 61 2HG GLN 61 -4.645 -7.095 6.254
448 2HG GLN 61 3HG GLN 61 -4.091 -6.539 4.681
449 1HE2 GLN 61 1HE2 GLN 61 -2.924 -3.990 5.842
450 2HE2 GLN 61 2HE2 GLN 61 -1.478 -4.533 6.683
451 H GLU 62 H GLU 62 -7.297 -2.811 5.515
452 HA GLU 62 HA GLU 62 -9.452 -3.984 4.195
453 1HB GLU 62 2HB GLU 62 -8.886 -1.267 5.371
454 2HB GLU 62 3HB GLU 62 -10.304 -1.426 4.351
455 1HG GLU 62 2HG GLU 62 -11.114 -3.301 5.773
456 2HG GLU 62 3HG GLU 62 -9.708 -3.073 6.834
457 H LYS 63 H LYS 63 -7.708 -1.020 3.039
458 HA LYS 63 HA LYS 63 -9.140 -0.934 0.589
459 1HB LYS 63 2HB LYS 63 -6.659 0.329 1.754
460 2HB LYS 63 3HB LYS 63 -7.030 0.520 0.073
461 1HG LYS 63 2HG LYS 63 -8.877 1.331 2.360
462 2HG LYS 63 3HG LYS 63 -7.821 2.386 1.414
463 1HD LYS 63 2HD LYS 63 -9.589 2.900 0.283
464 2HD LYS 63 3HD LYS 63 -9.171 1.477 -0.670
465 1HE LYS 63 2HE LYS 63 -10.948 0.179 0.397
466 2HE LYS 63 3HE LYS 63 -11.102 1.347 1.714
467 1HZ LYS 63 1HZ LYS 63 -12.863 1.511 0.117
468 2HZ LYS 63 2HZ LYS 63 -12.002 2.907 0.173
469 3HZ LYS 63 3HZ LYS 63 -11.804 1.871 -1.092
470 H ILE 64 H ILE 64 -6.042 -2.513 1.526
471 HA ILE 64 HA ILE 64 -5.007 -3.090 -0.944
472 HB ILE 64 HB ILE 64 -4.885 -4.149 1.784
473 1HG1 ILE 64 2HG1 ILE 64 -3.398 -2.400 0.758
474 2HG1 ILE 64 3HG1 ILE 64 -2.613 -3.744 1.579
475 1HG2 ILE 64 1HG2 ILE 64 -3.459 -6.047 1.212
476 2HG2 ILE 64 2HG2 ILE 64 -5.191 -6.265 0.976
477 3HG2 ILE 64 3HG2 ILE 64 -4.141 -5.977 -0.438
478 1HD1 ILE 64 1HD1 ILE 64 -2.936 -3.477 -1.434
479 2HD1 ILE 64 2HD1 ILE 64 -1.448 -3.264 -0.482
480 3HD1 ILE 64 3HD1 ILE 64 -2.216 -4.860 -0.598
481 H GLU 65 H GLU 65 -7.269 -5.012 1.118
482 HA GLU 65 HA GLU 65 -7.959 -7.038 -0.741
483 1HB GLU 65 2HB GLU 65 -9.333 -5.838 1.693
484 2HB GLU 65 3HB GLU 65 -10.087 -7.132 0.760
485 1HG GLU 65 2HG GLU 65 -7.257 -7.429 1.780
486 2HG GLU 65 3HG GLU 65 -8.647 -7.773 2.809
487 H LYS 66 H LYS 66 -9.769 -4.025 0.077
488 HA LYS 66 HA LYS 66 -11.829 -4.526 -1.745
489 1HB LYS 66 2HB LYS 66 -11.005 -2.308 -0.061
490 2HB LYS 66 3HB LYS 66 -11.545 -1.666 -1.608
491 1HG LYS 66 2HG LYS 66 -13.124 -3.663 0.067
492 2HG LYS 66 3HG LYS 66 -13.330 -1.910 0.161
493 1HD LYS 66 2HD LYS 66 -13.916 -1.820 -2.254
494 2HD LYS 66 3HD LYS 66 -13.739 -3.577 -2.374
495 1HE LYS 66 2HE LYS 66 -15.526 -3.865 -0.640
496 2HE LYS 66 3HE LYS 66 -15.745 -2.108 -0.593
497 1HZ LYS 66 1HZ LYS 66 -17.349 -3.167 -2.008
498 2HZ LYS 66 2HZ LYS 66 -16.380 -2.204 -2.920
499 3HZ LYS 66 3HZ LYS 66 -16.177 -3.838 -2.944
500 H LEU 67 H LEU 67 -8.730 -2.988 -2.391
501 HA LEU 67 HA LEU 67 -9.343 -2.194 -5.113
502 1HB LEU 67 2HB LEU 67 -6.812 -2.433 -3.459
503 2HB LEU 67 3HB LEU 67 -6.763 -1.990 -5.165
504 HG LEU 67 HG LEU 67 -8.653 -0.472 -3.355
505 1HD1 LEU 67 1HD1 LEU 67 -5.655 -0.049 -3.489
506 2HD1 LEU 67 2HD1 LEU 67 -6.808 1.195 -2.969
507 3HD1 LEU 67 3HD1 LEU 67 -6.638 -0.309 -2.064
508 1HD2 LEU 67 1HD2 LEU 67 -8.659 -0.143 -5.850
509 2HD2 LEU 67 2HD2 LEU 67 -8.230 1.318 -4.955
510 3HD2 LEU 67 3HD2 LEU 67 -6.966 0.367 -5.758
511 H GLY 68 H GLY 68 -8.627 -5.233 -3.641
512 1HA GLY 68 2HA GLY 68 -8.926 -7.246 -4.726
513 2HA GLY 68 3HA GLY 68 -8.595 -6.510 -6.298
514 H TYR 69 H TYR 69 -6.624 -6.306 -3.264
515 HA TYR 69 HA TYR 69 -4.470 -7.924 -4.544
516 1HB TYR 69 2HB TYR 69 -4.532 -5.051 -3.958
517 2HB TYR 69 3HB TYR 69 -3.257 -5.849 -3.067
518 HD1 TYR 69 HD1 TYR 69 -4.721 -5.576 -6.508
519 HD2 TYR 69 HD2 TYR 69 -1.254 -6.542 -4.139
520 HE1 TYR 69 HE1 TYR 69 -3.341 -5.470 -8.512
521 HE2 TYR 69 HE2 TYR 69 0.151 -6.352 -6.131
522 HH TYR 69 HH TYR 69 -1.182 -5.433 -9.337
523 H HIS 70 H HIS 70 -2.684 -8.228 -2.799
524 HA HIS 70 HA HIS 70 -3.702 -8.313 -0.059
525 1HB HIS 70 2HB HIS 70 -4.341 -10.492 -1.025
526 2HB HIS 70 3HB HIS 70 -2.663 -10.788 -1.484
527 HD1 HIS 70 1HD HIS 70 -2.731 -12.991 0.082
528 HD2 HIS 70 2HD HIS 70 -3.484 -9.343 2.040
529 HE1 HIS 70 1HE HIS 70 -2.665 -13.469 2.587
530 H VAL 71 H VAL 71 -2.062 -7.820 1.336
531 HA VAL 71 HA VAL 71 0.674 -7.441 0.239
532 HB VAL 71 HB VAL 71 -0.706 -5.406 0.867
533 1HG1 VAL 71 1HG1 VAL 71 -1.758 -6.299 2.959
534 2HG1 VAL 71 2HG1 VAL 71 -0.162 -6.249 3.738
535 3HG1 VAL 71 3HG1 VAL 71 -0.923 -4.753 3.179
536 1HG2 VAL 71 1HG2 VAL 71 1.129 -4.236 1.917
537 2HG2 VAL 71 2HG2 VAL 71 1.922 -5.790 2.293
538 3HG2 VAL 71 3HG2 VAL 71 1.676 -5.277 0.602
539 H VAL 72 H VAL 72 2.375 -8.291 1.506
540 HA VAL 72 HA VAL 72 1.539 -10.192 3.659
541 HB VAL 72 HB VAL 72 3.845 -10.359 1.816
542 1HG1 VAL 72 1HG1 VAL 72 4.515 -11.288 3.945
543 2HG1 VAL 72 2HG1 VAL 72 3.009 -12.226 4.055
544 3HG1 VAL 72 3HG1 VAL 72 4.225 -12.611 2.819
545 1HG2 VAL 72 1HG2 VAL 72 1.347 -12.104 2.064
546 2HG2 VAL 72 2HG2 VAL 72 1.667 -10.970 0.736
547 3HG2 VAL 72 3HG2 VAL 72 2.692 -12.398 0.944
548 H ILE 73 H ILE 73 2.605 -10.160 5.482
549 HA ILE 73 HA ILE 73 4.056 -7.636 6.141
550 HB ILE 73 HB ILE 73 2.358 -9.400 7.916
551 1HG1 ILE 73 2HG1 ILE 73 0.916 -8.338 6.272
552 2HG1 ILE 73 3HG1 ILE 73 0.736 -7.584 7.848
553 1HG2 ILE 73 1HG2 ILE 73 3.780 -6.745 8.368
554 2HG2 ILE 73 2HG2 ILE 73 2.469 -7.350 9.412
555 3HG2 ILE 73 3HG2 ILE 73 3.971 -8.253 9.269
556 1HD1 ILE 73 1HD1 ILE 73 2.250 -6.410 5.483
557 2HD1 ILE 73 2HD1 ILE 73 0.699 -5.881 6.146
558 3HD1 ILE 73 3HD1 ILE 73 2.171 -5.675 7.104
559 H GLU 74 H GLU 74 6.032 -8.801 5.310
560 HA GLU 74 HA GLU 74 7.183 -10.798 6.900
561 1HB GLU 74 2HB GLU 74 8.094 -8.969 4.696
562 2HB GLU 74 3HB GLU 74 9.264 -9.917 5.605
563 1HG GLU 74 2HG GLU 74 6.847 -11.283 4.382
564 2HG GLU 74 3HG GLU 74 8.318 -10.976 3.445
565 H GLY 75 H GLY 75 6.471 -7.880 7.866
566 1HA GLY 75 2HA GLY 75 9.031 -7.131 9.224
567 2HA GLY 75 3HA GLY 75 7.683 -6.066 8.783
568 H ARG 76 H ARG 76 6.018 -8.499 10.006
569 HA ARG 76 HA ARG 76 6.272 -8.156 12.841
570 1HB ARG 76 2HB ARG 76 5.351 -5.872 11.878
571 2HB ARG 76 3HB ARG 76 3.953 -6.821 11.434
572 1HG ARG 76 2HG ARG 76 3.197 -6.053 13.414
573 2HG ARG 76 3HG ARG 76 3.997 -7.473 14.068
574 1HD ARG 76 2HD ARG 76 5.575 -4.861 13.861
575 2HD ARG 76 3HD ARG 76 4.298 -5.010 15.050
576 HE ARG 76 HE ARG 76 5.414 -6.513 16.290
577 1HH1 ARG 76 2HH2 ARG 76 7.316 -6.233 13.234
578 2HH1 ARG 76 1HH2 ARG 76 8.762 -6.731 13.987
579 1HH2 ARG 76 2HH1 ARG 76 7.359 -7.271 17.196
580 2HH2 ARG 76 1HH1 ARG 76 8.785 -7.422 16.223